USER MOD reduce.3.24.130724 H: found=0, std=0, add=1005, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1005 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 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 1 ARG N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 GLN :FLIP amide:sc= -0.0106 F(o=-0.8,f=-0.011) USER MOD Single : A 8 SER OG : rot -131:sc= 1.24 USER MOD Single : A 12 LYS NZ :NH3+ -136:sc= 0.69 (180deg=-1.01) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=-0.0045) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -0.0138 X(o=-0.014,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 163:sc= 0.754 (180deg=0.443) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ -144:sc= 0 (180deg=-0.807) USER MOD Single : A 25 LYS NZ :NH3+ -169:sc= -0.0112 (180deg=-0.071) USER MOD Single : A 26 TYR OH : rot -63:sc= 2.86 USER MOD Single : A 28 THR OG1 : rot 88:sc= 0.0306 USER MOD Single : A 30 SER OG : rot 180:sc= -0.0867 USER MOD Single : A 31 SER OG : rot -41:sc= 0.104 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0.032) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= -3.35! C(o=-3.4!,f=-3.6!) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= -0.421 K(o=-0.42,f=-3.2!) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS :FLIP no HD1:sc= -1.51 F(o=-7!,f=-1.5) USER MOD Single : A 47 SER OG : rot -25:sc= 0.285! USER MOD Single : A 48 THR OG1 : rot 120:sc= -3.02 USER MOD Single : A 49 HIS :FLIP no HD1:sc= -0.47 F(o=-1.8,f=-0.47) USER MOD Single : A 53 MET CE :methyl 171:sc= -12.1! (180deg=-12.8!) USER MOD Single : A 58 THR OG1 : rot -67:sc= -3.52! USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 65:sc= 1.23 USER MOD Single : A 77 SER OG : rot 20:sc= 0.29! USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 ASN :FLIP amide:sc= 0.733 F(o=-1.3,f=0.73) USER MOD Single : A 96 SER OG : rot 54:sc= 0.0403 USER MOD Single : A 97 SER OG : rot 180:sc= 0.00301 USER MOD Single : A 98 THR OG1 : rot -52:sc= 1.18 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 HIS : no HD1:sc= -6.64! C(o=-6.6!,f=-8.6!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -0.0254 K(o=-0.025,f=-0.59) USER MOD Single : A 121 SER OG : rot 66:sc= 1.11 USER MOD Single : A 122 GLN : amide:sc= -5.76! C(o=-5.8!,f=-13!) USER MOD Single : A 126 SER OG : rot -171:sc= 0.371 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 1 -15.110 -17.234 15.045 1.00 0.00 N ATOM 2 CA ARG A 1 -15.418 -15.781 14.978 1.00 0.00 C ATOM 3 C ARG A 1 -14.284 -15.008 14.313 1.00 0.00 C ATOM 4 O ARG A 1 -13.192 -14.886 14.869 1.00 0.00 O ATOM 5 CB ARG A 1 -15.646 -15.266 16.400 1.00 0.00 C ATOM 6 CG ARG A 1 -16.443 -13.972 16.457 1.00 0.00 C ATOM 7 CD ARG A 1 -15.531 -12.761 16.576 1.00 0.00 C ATOM 8 NE ARG A 1 -16.276 -11.506 16.501 1.00 0.00 N ATOM 9 CZ ARG A 1 -16.959 -10.988 17.518 1.00 0.00 C ATOM 10 NH1 ARG A 1 -16.997 -11.614 18.688 1.00 0.00 N ATOM 11 NH2 ARG A 1 -17.609 -9.842 17.365 1.00 0.00 N ATOM 0 H1 ARG A 1 -15.898 -17.735 15.502 1.00 0.00 H new ATOM 0 H2 ARG A 1 -14.975 -17.605 14.083 1.00 0.00 H new ATOM 0 H3 ARG A 1 -14.241 -17.380 15.597 1.00 0.00 H new ATOM 0 HA ARG A 1 -16.314 -15.632 14.376 1.00 0.00 H new ATOM 0 HB2 ARG A 1 -16.168 -16.031 16.975 1.00 0.00 H new ATOM 0 HB3 ARG A 1 -14.680 -15.110 16.880 1.00 0.00 H new ATOM 0 HG2 ARG A 1 -17.056 -13.881 15.560 1.00 0.00 H new ATOM 0 HG3 ARG A 1 -17.125 -14.000 17.307 1.00 0.00 H new ATOM 0 HD2 ARG A 1 -14.990 -12.806 17.521 1.00 0.00 H new ATOM 0 HD3 ARG A 1 -14.786 -12.789 15.781 1.00 0.00 H new ATOM 0 HE ARG A 1 -16.272 -10.997 15.617 1.00 0.00 H new ATOM 0 HH11 ARG A 1 -16.501 -12.497 18.810 1.00 0.00 H new ATOM 0 HH12 ARG A 1 -17.522 -11.212 19.465 1.00 0.00 H new ATOM 0 HH21 ARG A 1 -17.585 -9.358 16.467 1.00 0.00 H new ATOM 0 HH22 ARG A 1 -18.133 -9.445 18.145 1.00 0.00 H new ATOM 27 N ALA A 2 -14.551 -14.485 13.120 1.00 0.00 N ATOM 28 CA ALA A 2 -13.555 -13.721 12.381 1.00 0.00 C ATOM 29 C ALA A 2 -13.374 -12.332 12.982 1.00 0.00 C ATOM 30 O ALA A 2 -14.166 -11.899 13.820 1.00 0.00 O ATOM 31 CB ALA A 2 -13.953 -13.616 10.917 1.00 0.00 C ATOM 0 H ALA A 2 -15.449 -14.577 12.646 1.00 0.00 H new ATOM 0 HA ALA A 2 -12.602 -14.246 12.451 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -13.200 -13.043 10.376 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -14.027 -14.615 10.487 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -14.918 -13.115 10.837 1.00 0.00 H new ATOM 37 N ILE A 3 -12.328 -11.635 12.548 1.00 0.00 N ATOM 38 CA ILE A 3 -12.047 -10.295 13.043 1.00 0.00 C ATOM 39 C ILE A 3 -11.860 -9.313 11.888 1.00 0.00 C ATOM 40 O ILE A 3 -11.095 -9.577 10.959 1.00 0.00 O ATOM 41 CB ILE A 3 -10.783 -10.268 13.927 1.00 0.00 C ATOM 42 CG1 ILE A 3 -10.759 -11.474 14.869 1.00 0.00 C ATOM 43 CG2 ILE A 3 -10.719 -8.970 14.717 1.00 0.00 C ATOM 44 CD1 ILE A 3 -11.878 -11.469 15.888 1.00 0.00 C ATOM 0 H ILE A 3 -11.662 -11.977 11.855 1.00 0.00 H new ATOM 0 HA ILE A 3 -12.906 -9.997 13.643 1.00 0.00 H new ATOM 0 HB ILE A 3 -9.907 -10.323 13.281 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -10.821 -12.388 14.278 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -9.803 -11.497 15.392 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -9.822 -8.965 15.336 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -10.689 -8.126 14.028 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -11.600 -8.888 15.354 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -11.798 -12.353 16.521 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -11.805 -10.573 16.505 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -12.839 -11.477 15.373 1.00 0.00 H new ATOM 56 N PRO A 4 -12.553 -8.160 11.926 1.00 0.00 N ATOM 57 CA PRO A 4 -12.450 -7.145 10.872 1.00 0.00 C ATOM 58 C PRO A 4 -11.029 -6.615 10.721 1.00 0.00 C ATOM 59 O PRO A 4 -10.415 -6.169 11.690 1.00 0.00 O ATOM 60 CB PRO A 4 -13.388 -6.027 11.342 1.00 0.00 C ATOM 61 CG PRO A 4 -14.292 -6.669 12.338 1.00 0.00 C ATOM 62 CD PRO A 4 -13.486 -7.754 12.990 1.00 0.00 C ATOM 0 HA PRO A 4 -12.714 -7.551 9.895 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -12.828 -5.206 11.790 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -13.953 -5.610 10.508 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -14.638 -5.944 13.075 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -15.178 -7.079 11.853 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -12.959 -7.390 13.872 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -14.114 -8.584 13.314 1.00 0.00 H new ATOM 70 N ILE A 5 -10.517 -6.663 9.499 1.00 0.00 N ATOM 71 CA ILE A 5 -9.170 -6.182 9.215 1.00 0.00 C ATOM 72 C ILE A 5 -9.189 -4.718 8.771 1.00 0.00 C ATOM 73 O ILE A 5 -8.174 -4.029 8.849 1.00 0.00 O ATOM 74 CB ILE A 5 -8.473 -7.043 8.137 1.00 0.00 C ATOM 75 CG1 ILE A 5 -8.206 -8.446 8.676 1.00 0.00 C ATOM 76 CG2 ILE A 5 -7.170 -6.402 7.685 1.00 0.00 C ATOM 77 CD1 ILE A 5 -9.351 -9.404 8.456 1.00 0.00 C ATOM 0 H ILE A 5 -11.014 -7.030 8.687 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.603 -6.264 10.142 1.00 0.00 H new ATOM 0 HB ILE A 5 -9.137 -7.111 7.275 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.311 -8.846 8.198 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.996 -8.382 9.744 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -6.700 -7.028 6.927 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.375 -5.417 7.266 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.499 -6.301 8.538 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -9.092 -10.381 8.864 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -10.242 -9.027 8.957 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -9.547 -9.497 7.388 1.00 0.00 H new ATOM 89 N LYS A 6 -10.351 -4.248 8.324 1.00 0.00 N ATOM 90 CA LYS A 6 -10.504 -2.863 7.891 1.00 0.00 C ATOM 91 C LYS A 6 -11.942 -2.605 7.504 1.00 0.00 C ATOM 92 O LYS A 6 -12.410 -3.094 6.494 1.00 0.00 O ATOM 93 CB LYS A 6 -9.603 -2.552 6.683 1.00 0.00 C ATOM 94 CG LYS A 6 -8.698 -1.343 6.860 1.00 0.00 C ATOM 95 CD LYS A 6 -7.903 -1.397 8.156 1.00 0.00 C ATOM 96 CE LYS A 6 -7.524 -0.003 8.633 1.00 0.00 C ATOM 97 NZ LYS A 6 -7.619 0.123 10.114 1.00 0.00 N ATOM 0 H LYS A 6 -11.201 -4.807 8.252 1.00 0.00 H new ATOM 0 HA LYS A 6 -10.213 -2.220 8.721 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -8.984 -3.425 6.474 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -10.233 -2.392 5.808 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.010 -1.282 6.017 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -9.302 -0.436 6.845 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -8.491 -1.899 8.925 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -7.001 -1.990 8.007 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -6.507 0.226 8.314 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -8.178 0.732 8.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -7.353 1.087 10.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -8.595 -0.070 10.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -6.976 -0.560 10.562 1.00 0.00 H new ATOM 111 N GLN A 7 -12.633 -1.820 8.296 1.00 0.00 N ATOM 112 CA GLN A 7 -14.019 -1.497 8.002 1.00 0.00 C ATOM 113 C GLN A 7 -14.248 0.006 8.090 1.00 0.00 C ATOM 114 O GLN A 7 -14.173 0.594 9.169 1.00 0.00 O ATOM 115 CB GLN A 7 -14.959 -2.231 8.961 1.00 0.00 C ATOM 116 CG GLN A 7 -14.763 -1.845 10.418 1.00 0.00 C ATOM 117 CD GLN A 7 -15.478 -2.785 11.370 1.00 0.00 C ATOM 118 OE1 GLN A 7 -14.719 -3.419 12.256 1.00 0.00 O flip ATOM 119 NE2 GLN A 7 -16.697 -2.939 11.310 1.00 0.00 N flip ATOM 0 H GLN A 7 -12.265 -1.392 9.146 1.00 0.00 H new ATOM 0 HA GLN A 7 -14.236 -1.824 6.985 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -15.990 -2.025 8.675 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -14.807 -3.305 8.855 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -13.698 -1.840 10.649 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -15.127 -0.830 10.574 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -17.241 -2.431 10.613 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -17.163 -3.574 11.957 1.00 0.00 H new ATOM 128 N SER A 8 -14.518 0.626 6.948 1.00 0.00 N ATOM 129 CA SER A 8 -14.747 2.064 6.902 1.00 0.00 C ATOM 130 C SER A 8 -15.399 2.479 5.588 1.00 0.00 C ATOM 131 O SER A 8 -15.751 1.636 4.765 1.00 0.00 O ATOM 132 CB SER A 8 -13.428 2.818 7.089 1.00 0.00 C ATOM 133 OG SER A 8 -12.325 2.017 6.698 1.00 0.00 O ATOM 0 H SER A 8 -14.584 0.157 6.044 1.00 0.00 H new ATOM 0 HA SER A 8 -15.426 2.319 7.716 1.00 0.00 H new ATOM 0 HB2 SER A 8 -13.443 3.735 6.500 1.00 0.00 H new ATOM 0 HB3 SER A 8 -13.317 3.111 8.133 1.00 0.00 H new ATOM 0 HG SER A 8 -11.641 2.037 7.400 1.00 0.00 H new ATOM 139 N PHE A 9 -15.560 3.786 5.404 1.00 0.00 N ATOM 140 CA PHE A 9 -16.172 4.318 4.194 1.00 0.00 C ATOM 141 C PHE A 9 -15.136 4.517 3.094 1.00 0.00 C ATOM 142 O PHE A 9 -14.103 5.150 3.307 1.00 0.00 O ATOM 143 CB PHE A 9 -16.873 5.646 4.491 1.00 0.00 C ATOM 144 CG PHE A 9 -17.650 5.649 5.776 1.00 0.00 C ATOM 145 CD1 PHE A 9 -18.351 4.524 6.181 1.00 0.00 C ATOM 146 CD2 PHE A 9 -17.679 6.777 6.580 1.00 0.00 C ATOM 147 CE1 PHE A 9 -19.066 4.525 7.364 1.00 0.00 C ATOM 148 CE2 PHE A 9 -18.391 6.784 7.763 1.00 0.00 C ATOM 149 CZ PHE A 9 -19.086 5.657 8.155 1.00 0.00 C ATOM 0 H PHE A 9 -15.274 4.496 6.079 1.00 0.00 H new ATOM 0 HA PHE A 9 -16.908 3.593 3.847 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -16.127 6.440 4.527 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -17.549 5.881 3.669 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -18.338 3.637 5.565 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -17.138 7.662 6.278 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -19.608 3.642 7.669 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -18.404 7.670 8.381 1.00 0.00 H new ATOM 0 HZ PHE A 9 -19.645 5.661 9.079 1.00 0.00 H new ATOM 159 N LEU A 10 -15.430 3.980 1.917 1.00 0.00 N ATOM 160 CA LEU A 10 -14.536 4.102 0.773 1.00 0.00 C ATOM 161 C LEU A 10 -15.246 4.803 -0.375 1.00 0.00 C ATOM 162 O LEU A 10 -16.472 4.769 -0.468 1.00 0.00 O ATOM 163 CB LEU A 10 -14.066 2.720 0.312 1.00 0.00 C ATOM 164 CG LEU A 10 -12.785 2.210 0.975 1.00 0.00 C ATOM 165 CD1 LEU A 10 -13.067 1.763 2.402 1.00 0.00 C ATOM 166 CD2 LEU A 10 -12.185 1.069 0.165 1.00 0.00 C ATOM 0 H LEU A 10 -16.284 3.454 1.729 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.670 4.691 1.076 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -14.864 2.002 0.500 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -13.911 2.748 -0.767 1.00 0.00 H new ATOM 0 HG LEU A 10 -12.063 3.026 1.007 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.145 1.403 2.859 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -13.453 2.604 2.977 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -13.805 0.961 2.393 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -11.274 0.718 0.650 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -12.902 0.250 0.103 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -11.948 1.421 -0.839 1.00 0.00 H new ATOM 178 N LEU A 11 -14.479 5.429 -1.255 1.00 0.00 N ATOM 179 CA LEU A 11 -15.066 6.120 -2.398 1.00 0.00 C ATOM 180 C LEU A 11 -15.176 5.168 -3.586 1.00 0.00 C ATOM 181 O LEU A 11 -14.252 4.402 -3.864 1.00 0.00 O ATOM 182 CB LEU A 11 -14.237 7.352 -2.771 1.00 0.00 C ATOM 183 CG LEU A 11 -15.013 8.671 -2.787 1.00 0.00 C ATOM 184 CD1 LEU A 11 -15.702 8.902 -1.452 1.00 0.00 C ATOM 185 CD2 LEU A 11 -14.086 9.831 -3.121 1.00 0.00 C ATOM 0 H LEU A 11 -13.461 5.474 -1.203 1.00 0.00 H new ATOM 0 HA LEU A 11 -16.066 6.456 -2.124 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -13.410 7.442 -2.066 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -13.800 7.193 -3.757 1.00 0.00 H new ATOM 0 HG LEU A 11 -15.779 8.611 -3.560 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -16.248 9.845 -1.483 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -16.397 8.086 -1.255 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -14.955 8.941 -0.659 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -14.655 10.761 -3.128 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.297 9.894 -2.371 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -13.641 9.670 -4.103 1.00 0.00 H new ATOM 197 N LYS A 12 -16.313 5.210 -4.274 1.00 0.00 N ATOM 198 CA LYS A 12 -16.541 4.338 -5.423 1.00 0.00 C ATOM 199 C LYS A 12 -16.865 5.148 -6.675 1.00 0.00 C ATOM 200 O LYS A 12 -17.903 5.806 -6.749 1.00 0.00 O ATOM 201 CB LYS A 12 -17.678 3.358 -5.124 1.00 0.00 C ATOM 202 CG LYS A 12 -17.998 2.423 -6.280 1.00 0.00 C ATOM 203 CD LYS A 12 -16.932 1.349 -6.443 1.00 0.00 C ATOM 204 CE LYS A 12 -16.122 1.556 -7.712 1.00 0.00 C ATOM 205 NZ LYS A 12 -16.963 1.436 -8.934 1.00 0.00 N ATOM 0 H LYS A 12 -17.089 5.836 -4.057 1.00 0.00 H new ATOM 0 HA LYS A 12 -15.624 3.778 -5.609 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -17.413 2.763 -4.250 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -18.574 3.922 -4.866 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -18.967 1.952 -6.111 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -18.080 2.998 -7.202 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -16.267 1.361 -5.580 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -17.404 0.367 -6.468 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -15.655 2.541 -7.688 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -15.317 0.822 -7.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -16.462 0.867 -9.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -17.863 0.974 -8.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -17.153 2.383 -9.319 1.00 0.00 H new ATOM 219 N ARG A 13 -15.973 5.087 -7.657 1.00 0.00 N ATOM 220 CA ARG A 13 -16.160 5.810 -8.911 1.00 0.00 C ATOM 221 C ARG A 13 -17.420 5.336 -9.628 1.00 0.00 C ATOM 222 O ARG A 13 -17.802 4.170 -9.530 1.00 0.00 O ATOM 223 CB ARG A 13 -14.942 5.623 -9.817 1.00 0.00 C ATOM 224 CG ARG A 13 -14.471 4.180 -9.913 1.00 0.00 C ATOM 225 CD ARG A 13 -13.516 3.981 -11.079 1.00 0.00 C ATOM 226 NE ARG A 13 -14.218 3.609 -12.304 1.00 0.00 N ATOM 227 CZ ARG A 13 -14.882 2.466 -12.460 1.00 0.00 C ATOM 228 NH1 ARG A 13 -14.937 1.582 -11.471 1.00 0.00 N ATOM 229 NH2 ARG A 13 -15.493 2.205 -13.608 1.00 0.00 N ATOM 0 H ARG A 13 -15.111 4.543 -7.609 1.00 0.00 H new ATOM 0 HA ARG A 13 -16.272 6.869 -8.679 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -15.184 5.985 -10.816 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -14.124 6.239 -9.444 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -13.977 3.895 -8.984 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -15.332 3.522 -10.031 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -12.954 4.899 -11.248 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -12.792 3.206 -10.826 1.00 0.00 H new ATOM 0 HE ARG A 13 -14.198 4.263 -13.086 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -14.469 1.777 -10.586 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -15.447 0.708 -11.596 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -15.454 2.880 -14.371 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -16.002 1.329 -13.727 1.00 0.00 H new ATOM 243 N SER A 14 -18.062 6.248 -10.350 1.00 0.00 N ATOM 244 CA SER A 14 -19.279 5.925 -11.086 1.00 0.00 C ATOM 245 C SER A 14 -18.973 5.650 -12.554 1.00 0.00 C ATOM 246 O SER A 14 -19.145 4.530 -13.035 1.00 0.00 O ATOM 247 CB SER A 14 -20.289 7.069 -10.969 1.00 0.00 C ATOM 248 OG SER A 14 -21.477 6.775 -11.681 1.00 0.00 O ATOM 0 H SER A 14 -17.760 7.218 -10.441 1.00 0.00 H new ATOM 0 HA SER A 14 -19.708 5.023 -10.649 1.00 0.00 H new ATOM 0 HB2 SER A 14 -20.524 7.244 -9.919 1.00 0.00 H new ATOM 0 HB3 SER A 14 -19.848 7.988 -11.355 1.00 0.00 H new ATOM 0 HG SER A 14 -22.106 7.520 -11.589 1.00 0.00 H new ATOM 254 N GLY A 15 -18.516 6.679 -13.261 1.00 0.00 N ATOM 255 CA GLY A 15 -18.193 6.527 -14.668 1.00 0.00 C ATOM 256 C GLY A 15 -17.446 7.723 -15.224 1.00 0.00 C ATOM 257 O GLY A 15 -16.778 8.446 -14.484 1.00 0.00 O ATOM 0 H GLY A 15 -18.364 7.615 -12.885 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -17.589 5.630 -14.804 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -19.112 6.381 -15.235 1.00 0.00 H new ATOM 261 N ASN A 16 -17.559 7.931 -16.531 1.00 0.00 N ATOM 262 CA ASN A 16 -16.888 9.048 -17.189 1.00 0.00 C ATOM 263 C ASN A 16 -15.374 8.939 -17.039 1.00 0.00 C ATOM 264 O ASN A 16 -14.840 9.046 -15.935 1.00 0.00 O ATOM 265 CB ASN A 16 -17.375 10.376 -16.607 1.00 0.00 C ATOM 266 CG ASN A 16 -18.878 10.547 -16.733 1.00 0.00 C ATOM 267 OD1 ASN A 16 -19.634 10.144 -15.849 1.00 0.00 O ATOM 268 ND2 ASN A 16 -19.315 11.144 -17.834 1.00 0.00 N ATOM 0 H ASN A 16 -18.108 7.342 -17.156 1.00 0.00 H new ATOM 0 HA ASN A 16 -17.133 9.012 -18.251 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -17.092 10.434 -15.556 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -16.874 11.199 -17.118 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -20.315 11.285 -17.975 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -18.651 11.462 -18.540 1.00 0.00 H new ATOM 275 N SER A 17 -14.687 8.726 -18.157 1.00 0.00 N ATOM 276 CA SER A 17 -13.234 8.602 -18.149 1.00 0.00 C ATOM 277 C SER A 17 -12.572 9.975 -18.119 1.00 0.00 C ATOM 278 O SER A 17 -11.520 10.155 -17.506 1.00 0.00 O ATOM 279 CB SER A 17 -12.762 7.823 -19.378 1.00 0.00 C ATOM 280 OG SER A 17 -11.387 7.494 -19.275 1.00 0.00 O ATOM 0 H SER A 17 -15.113 8.636 -19.079 1.00 0.00 H new ATOM 0 HA SER A 17 -12.945 8.059 -17.249 1.00 0.00 H new ATOM 0 HB2 SER A 17 -13.351 6.912 -19.483 1.00 0.00 H new ATOM 0 HB3 SER A 17 -12.931 8.417 -20.276 1.00 0.00 H new ATOM 0 HG SER A 17 -11.109 6.995 -20.072 1.00 0.00 H new ATOM 286 N LEU A 18 -13.197 10.942 -18.784 1.00 0.00 N ATOM 287 CA LEU A 18 -12.667 12.301 -18.833 1.00 0.00 C ATOM 288 C LEU A 18 -12.662 12.931 -17.444 1.00 0.00 C ATOM 289 O LEU A 18 -11.793 13.743 -17.123 1.00 0.00 O ATOM 290 CB LEU A 18 -13.494 13.156 -19.797 1.00 0.00 C ATOM 291 CG LEU A 18 -12.685 13.879 -20.875 1.00 0.00 C ATOM 292 CD1 LEU A 18 -12.488 12.979 -22.085 1.00 0.00 C ATOM 293 CD2 LEU A 18 -13.375 15.174 -21.278 1.00 0.00 C ATOM 0 H LEU A 18 -14.070 10.810 -19.296 1.00 0.00 H new ATOM 0 HA LEU A 18 -11.639 12.255 -19.192 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -14.231 12.518 -20.284 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -14.046 13.898 -19.219 1.00 0.00 H new ATOM 0 HG LEU A 18 -11.705 14.124 -20.466 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -11.910 13.509 -22.842 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -11.953 12.078 -21.785 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -13.459 12.704 -22.496 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -12.786 15.676 -22.046 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -14.367 14.951 -21.670 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -13.466 15.824 -20.408 1.00 0.00 H new ATOM 305 N ASN A 19 -13.637 12.553 -16.624 1.00 0.00 N ATOM 306 CA ASN A 19 -13.744 13.079 -15.268 1.00 0.00 C ATOM 307 C ASN A 19 -14.379 12.051 -14.337 1.00 0.00 C ATOM 308 O ASN A 19 -15.576 11.774 -14.425 1.00 0.00 O ATOM 309 CB ASN A 19 -14.570 14.368 -15.263 1.00 0.00 C ATOM 310 CG ASN A 19 -14.283 15.232 -14.050 1.00 0.00 C ATOM 311 OD1 ASN A 19 -15.138 15.407 -13.183 1.00 0.00 O ATOM 312 ND2 ASN A 19 -13.073 15.776 -13.983 1.00 0.00 N ATOM 0 H ASN A 19 -14.365 11.884 -16.875 1.00 0.00 H new ATOM 0 HA ASN A 19 -12.739 13.298 -14.908 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -14.358 14.936 -16.169 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -15.631 14.117 -15.285 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -12.822 16.366 -13.189 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -12.395 15.604 -14.725 1.00 0.00 H new ATOM 319 N LYS A 20 -13.571 11.487 -13.446 1.00 0.00 N ATOM 320 CA LYS A 20 -14.054 10.488 -12.500 1.00 0.00 C ATOM 321 C LYS A 20 -15.166 11.056 -11.624 1.00 0.00 C ATOM 322 O LYS A 20 -15.502 12.236 -11.711 1.00 0.00 O ATOM 323 CB LYS A 20 -12.905 9.984 -11.624 1.00 0.00 C ATOM 324 CG LYS A 20 -12.389 8.604 -12.016 1.00 0.00 C ATOM 325 CD LYS A 20 -13.510 7.576 -12.070 1.00 0.00 C ATOM 326 CE LYS A 20 -13.537 6.845 -13.402 1.00 0.00 C ATOM 327 NZ LYS A 20 -14.926 6.644 -13.898 1.00 0.00 N ATOM 0 H LYS A 20 -12.578 11.705 -13.359 1.00 0.00 H new ATOM 0 HA LYS A 20 -14.459 9.653 -13.071 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -12.082 10.697 -11.676 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -13.238 9.956 -10.586 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -11.901 8.661 -12.989 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -11.634 8.281 -11.299 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -13.383 6.856 -11.262 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -14.467 8.072 -11.907 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -12.967 7.412 -14.138 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -13.046 5.878 -13.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -14.903 6.413 -14.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.372 5.863 -13.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.475 7.515 -13.754 1.00 0.00 H new ATOM 341 N GLU A 21 -15.728 10.200 -10.779 1.00 0.00 N ATOM 342 CA GLU A 21 -16.799 10.593 -9.875 1.00 0.00 C ATOM 343 C GLU A 21 -17.042 9.492 -8.851 1.00 0.00 C ATOM 344 O GLU A 21 -17.708 8.498 -9.136 1.00 0.00 O ATOM 345 CB GLU A 21 -18.083 10.881 -10.655 1.00 0.00 C ATOM 346 CG GLU A 21 -19.115 11.666 -9.862 1.00 0.00 C ATOM 347 CD GLU A 21 -20.024 12.495 -10.748 1.00 0.00 C ATOM 348 OE1 GLU A 21 -19.521 13.084 -11.729 1.00 0.00 O ATOM 349 OE2 GLU A 21 -21.238 12.556 -10.462 1.00 0.00 O ATOM 0 H GLU A 21 -15.455 9.220 -10.702 1.00 0.00 H new ATOM 0 HA GLU A 21 -16.501 11.504 -9.356 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -17.832 11.437 -11.559 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -18.524 9.936 -10.974 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -19.719 10.975 -9.274 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -18.604 12.322 -9.157 1.00 0.00 H new ATOM 356 N TRP A 22 -16.478 9.671 -7.664 1.00 0.00 N ATOM 357 CA TRP A 22 -16.610 8.688 -6.601 1.00 0.00 C ATOM 358 C TRP A 22 -17.639 9.129 -5.565 1.00 0.00 C ATOM 359 O TRP A 22 -17.742 10.312 -5.241 1.00 0.00 O ATOM 360 CB TRP A 22 -15.256 8.458 -5.924 1.00 0.00 C ATOM 361 CG TRP A 22 -14.112 8.321 -6.886 1.00 0.00 C ATOM 362 CD1 TRP A 22 -13.740 9.212 -7.855 1.00 0.00 C ATOM 363 CD2 TRP A 22 -13.185 7.233 -6.967 1.00 0.00 C ATOM 364 NE1 TRP A 22 -12.643 8.740 -8.532 1.00 0.00 N ATOM 365 CE2 TRP A 22 -12.285 7.530 -8.007 1.00 0.00 C ATOM 366 CE3 TRP A 22 -13.025 6.034 -6.263 1.00 0.00 C ATOM 367 CZ2 TRP A 22 -11.246 6.677 -8.360 1.00 0.00 C ATOM 368 CZ3 TRP A 22 -11.989 5.187 -6.619 1.00 0.00 C ATOM 369 CH2 TRP A 22 -11.118 5.515 -7.654 1.00 0.00 C ATOM 0 H TRP A 22 -15.924 10.490 -7.414 1.00 0.00 H new ATOM 0 HA TRP A 22 -16.954 7.755 -7.048 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -15.053 9.289 -5.248 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -15.314 7.557 -5.313 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -14.237 10.149 -8.058 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -12.172 9.215 -9.302 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -13.696 5.774 -5.458 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -10.566 6.924 -9.162 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -11.855 4.258 -6.085 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -10.320 4.832 -7.905 1.00 0.00 H new ATOM 380 N LYS A 23 -18.391 8.165 -5.046 1.00 0.00 N ATOM 381 CA LYS A 23 -19.408 8.445 -4.042 1.00 0.00 C ATOM 382 C LYS A 23 -19.071 7.740 -2.731 1.00 0.00 C ATOM 383 O LYS A 23 -18.280 6.798 -2.709 1.00 0.00 O ATOM 384 CB LYS A 23 -20.784 7.997 -4.537 1.00 0.00 C ATOM 385 CG LYS A 23 -21.393 8.936 -5.569 1.00 0.00 C ATOM 386 CD LYS A 23 -22.871 9.174 -5.303 1.00 0.00 C ATOM 387 CE LYS A 23 -23.742 8.295 -6.189 1.00 0.00 C ATOM 388 NZ LYS A 23 -24.989 8.992 -6.613 1.00 0.00 N ATOM 0 H LYS A 23 -18.314 7.181 -5.305 1.00 0.00 H new ATOM 0 HA LYS A 23 -19.430 9.521 -3.867 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -20.699 7.000 -4.970 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -21.460 7.918 -3.685 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -20.862 9.888 -5.555 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -21.265 8.515 -6.566 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -23.091 8.969 -4.255 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -23.110 10.223 -5.480 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -23.176 7.996 -7.071 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -24.001 7.383 -5.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -25.553 8.359 -7.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -25.542 9.255 -5.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -24.743 9.849 -7.148 1.00 0.00 H new ATOM 402 N LYS A 24 -19.675 8.203 -1.642 1.00 0.00 N ATOM 403 CA LYS A 24 -19.431 7.613 -0.332 1.00 0.00 C ATOM 404 C LYS A 24 -19.892 6.159 -0.297 1.00 0.00 C ATOM 405 O LYS A 24 -21.076 5.867 -0.467 1.00 0.00 O ATOM 406 CB LYS A 24 -20.145 8.420 0.755 1.00 0.00 C ATOM 407 CG LYS A 24 -19.212 9.302 1.568 1.00 0.00 C ATOM 408 CD LYS A 24 -18.234 8.474 2.388 1.00 0.00 C ATOM 409 CE LYS A 24 -17.018 9.290 2.797 1.00 0.00 C ATOM 410 NZ LYS A 24 -15.753 8.528 2.617 1.00 0.00 N ATOM 0 H LYS A 24 -20.334 8.981 -1.640 1.00 0.00 H new ATOM 0 HA LYS A 24 -18.358 7.637 -0.142 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -20.909 9.044 0.290 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -20.660 7.733 1.427 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -18.660 9.962 0.899 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -19.798 9.938 2.232 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -18.735 8.094 3.279 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.914 7.608 1.809 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -16.978 10.204 2.205 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.116 9.590 3.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -15.090 8.770 3.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -15.955 7.508 2.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -15.328 8.773 1.700 1.00 0.00 H new ATOM 424 N LYS A 25 -18.946 5.252 -0.079 1.00 0.00 N ATOM 425 CA LYS A 25 -19.244 3.827 -0.022 1.00 0.00 C ATOM 426 C LYS A 25 -18.891 3.254 1.345 1.00 0.00 C ATOM 427 O LYS A 25 -18.391 3.965 2.218 1.00 0.00 O ATOM 428 CB LYS A 25 -18.478 3.080 -1.119 1.00 0.00 C ATOM 429 CG LYS A 25 -19.327 2.077 -1.880 1.00 0.00 C ATOM 430 CD LYS A 25 -20.478 2.754 -2.605 1.00 0.00 C ATOM 431 CE LYS A 25 -20.994 1.901 -3.753 1.00 0.00 C ATOM 432 NZ LYS A 25 -22.090 2.577 -4.500 1.00 0.00 N ATOM 0 H LYS A 25 -17.962 5.481 0.062 1.00 0.00 H new ATOM 0 HA LYS A 25 -20.314 3.696 -0.184 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -18.069 3.805 -1.823 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -17.632 2.560 -0.670 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -18.705 1.545 -2.600 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -19.720 1.333 -1.188 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -21.288 2.948 -1.902 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -20.150 3.720 -2.988 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -20.174 1.677 -4.436 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -21.354 0.949 -3.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -22.538 1.899 -5.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -22.799 2.934 -3.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -21.699 3.371 -5.046 1.00 0.00 H new ATOM 446 N TYR A 26 -19.155 1.967 1.524 1.00 0.00 N ATOM 447 CA TYR A 26 -18.871 1.289 2.782 1.00 0.00 C ATOM 448 C TYR A 26 -18.222 -0.065 2.519 1.00 0.00 C ATOM 449 O TYR A 26 -18.741 -0.863 1.743 1.00 0.00 O ATOM 450 CB TYR A 26 -20.167 1.109 3.576 1.00 0.00 C ATOM 451 CG TYR A 26 -19.970 0.556 4.968 1.00 0.00 C ATOM 452 CD1 TYR A 26 -19.928 -0.814 5.193 1.00 0.00 C ATOM 453 CD2 TYR A 26 -19.836 1.403 6.059 1.00 0.00 C ATOM 454 CE1 TYR A 26 -19.758 -1.323 6.465 1.00 0.00 C ATOM 455 CE2 TYR A 26 -19.664 0.903 7.334 1.00 0.00 C ATOM 456 CZ TYR A 26 -19.624 -0.461 7.532 1.00 0.00 C ATOM 457 OH TYR A 26 -19.455 -0.964 8.802 1.00 0.00 O ATOM 0 H TYR A 26 -19.568 1.368 0.809 1.00 0.00 H new ATOM 0 HA TYR A 26 -18.178 1.897 3.364 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -20.672 2.072 3.648 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -20.829 0.443 3.023 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -20.030 -1.492 4.359 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -19.867 2.472 5.908 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -19.730 -2.391 6.623 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -19.561 1.576 8.172 1.00 0.00 H new ATOM 0 HH TYR A 26 -20.249 -1.477 9.059 1.00 0.00 H new ATOM 467 N VAL A 27 -17.083 -0.316 3.158 1.00 0.00 N ATOM 468 CA VAL A 27 -16.370 -1.579 2.970 1.00 0.00 C ATOM 469 C VAL A 27 -15.865 -2.143 4.285 1.00 0.00 C ATOM 470 O VAL A 27 -15.428 -1.401 5.165 1.00 0.00 O ATOM 471 CB VAL A 27 -15.152 -1.432 2.033 1.00 0.00 C ATOM 472 CG1 VAL A 27 -14.883 -2.740 1.305 1.00 0.00 C ATOM 473 CG2 VAL A 27 -15.356 -0.298 1.040 1.00 0.00 C ATOM 0 H VAL A 27 -16.635 0.332 3.806 1.00 0.00 H new ATOM 0 HA VAL A 27 -17.100 -2.254 2.523 1.00 0.00 H new ATOM 0 HB VAL A 27 -14.283 -1.188 2.644 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.021 -2.620 0.648 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.679 -3.526 2.032 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -15.756 -3.013 0.712 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -14.482 -0.219 0.394 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -16.239 -0.500 0.433 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -15.494 0.639 1.580 1.00 0.00 H new ATOM 483 N THR A 28 -15.886 -3.463 4.393 1.00 0.00 N ATOM 484 CA THR A 28 -15.385 -4.130 5.580 1.00 0.00 C ATOM 485 C THR A 28 -14.589 -5.373 5.210 1.00 0.00 C ATOM 486 O THR A 28 -15.142 -6.365 4.725 1.00 0.00 O ATOM 487 CB THR A 28 -16.507 -4.517 6.543 1.00 0.00 C ATOM 488 OG1 THR A 28 -17.215 -3.370 6.979 1.00 0.00 O ATOM 489 CG2 THR A 28 -15.991 -5.244 7.773 1.00 0.00 C ATOM 0 H THR A 28 -16.244 -4.090 3.673 1.00 0.00 H new ATOM 0 HA THR A 28 -14.734 -3.416 6.085 1.00 0.00 H new ATOM 0 HB THR A 28 -17.163 -5.185 5.986 1.00 0.00 H new ATOM 0 HG1 THR A 28 -17.942 -3.177 6.352 1.00 0.00 H new ATOM 0 HG21 THR A 28 -16.828 -5.496 8.424 1.00 0.00 H new ATOM 0 HG22 THR A 28 -15.480 -6.157 7.468 1.00 0.00 H new ATOM 0 HG23 THR A 28 -15.294 -4.601 8.310 1.00 0.00 H new ATOM 497 N LEU A 29 -13.296 -5.317 5.469 1.00 0.00 N ATOM 498 CA LEU A 29 -12.413 -6.431 5.215 1.00 0.00 C ATOM 499 C LEU A 29 -12.381 -7.303 6.454 1.00 0.00 C ATOM 500 O LEU A 29 -11.928 -6.864 7.512 1.00 0.00 O ATOM 501 CB LEU A 29 -11.007 -5.938 4.880 1.00 0.00 C ATOM 502 CG LEU A 29 -10.403 -6.548 3.622 1.00 0.00 C ATOM 503 CD1 LEU A 29 -10.306 -8.056 3.763 1.00 0.00 C ATOM 504 CD2 LEU A 29 -11.225 -6.176 2.400 1.00 0.00 C ATOM 0 H LEU A 29 -12.832 -4.497 5.861 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.777 -7.003 4.362 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -11.034 -4.854 4.765 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -10.351 -6.153 5.723 1.00 0.00 H new ATOM 0 HG LEU A 29 -9.398 -6.147 3.490 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -9.873 -8.479 2.857 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -9.674 -8.302 4.616 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -11.302 -8.472 3.917 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.778 -6.621 1.511 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -12.243 -6.548 2.519 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -11.245 -5.092 2.292 1.00 0.00 H new ATOM 516 N SER A 30 -12.889 -8.518 6.325 1.00 0.00 N ATOM 517 CA SER A 30 -12.943 -9.442 7.448 1.00 0.00 C ATOM 518 C SER A 30 -11.850 -10.492 7.350 1.00 0.00 C ATOM 519 O SER A 30 -11.271 -10.707 6.285 1.00 0.00 O ATOM 520 CB SER A 30 -14.313 -10.121 7.510 1.00 0.00 C ATOM 521 OG SER A 30 -14.394 -11.008 8.613 1.00 0.00 O ATOM 0 H SER A 30 -13.270 -8.888 5.454 1.00 0.00 H new ATOM 0 HA SER A 30 -12.784 -8.868 8.361 1.00 0.00 H new ATOM 0 HB2 SER A 30 -15.094 -9.365 7.590 1.00 0.00 H new ATOM 0 HB3 SER A 30 -14.493 -10.669 6.585 1.00 0.00 H new ATOM 0 HG SER A 30 -15.279 -11.428 8.631 1.00 0.00 H new ATOM 527 N SER A 31 -11.573 -11.146 8.472 1.00 0.00 N ATOM 528 CA SER A 31 -10.545 -12.176 8.517 1.00 0.00 C ATOM 529 C SER A 31 -11.052 -13.497 7.930 1.00 0.00 C ATOM 530 O SER A 31 -10.343 -14.504 7.950 1.00 0.00 O ATOM 531 CB SER A 31 -10.075 -12.397 9.956 1.00 0.00 C ATOM 532 OG SER A 31 -8.801 -13.019 9.986 1.00 0.00 O ATOM 0 H SER A 31 -12.046 -10.981 9.361 1.00 0.00 H new ATOM 0 HA SER A 31 -9.706 -11.832 7.912 1.00 0.00 H new ATOM 0 HB2 SER A 31 -10.029 -11.441 10.478 1.00 0.00 H new ATOM 0 HB3 SER A 31 -10.798 -13.016 10.487 1.00 0.00 H new ATOM 0 HG SER A 31 -8.760 -13.713 9.296 1.00 0.00 H new ATOM 538 N ASN A 32 -12.279 -13.491 7.407 1.00 0.00 N ATOM 539 CA ASN A 32 -12.872 -14.688 6.820 1.00 0.00 C ATOM 540 C ASN A 32 -12.593 -14.768 5.326 1.00 0.00 C ATOM 541 O ASN A 32 -13.354 -15.381 4.576 1.00 0.00 O ATOM 542 CB ASN A 32 -14.380 -14.715 7.073 1.00 0.00 C ATOM 543 CG ASN A 32 -14.909 -16.123 7.266 1.00 0.00 C ATOM 544 OD1 ASN A 32 -14.478 -17.059 6.592 1.00 0.00 O ATOM 545 ND2 ASN A 32 -15.848 -16.280 8.191 1.00 0.00 N ATOM 0 H ASN A 32 -12.880 -12.668 7.379 1.00 0.00 H new ATOM 0 HA ASN A 32 -12.414 -15.554 7.298 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -14.608 -14.120 7.957 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -14.895 -14.248 6.233 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -16.242 -17.205 8.366 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -16.176 -15.476 8.726 1.00 0.00 H new ATOM 552 N GLY A 33 -11.503 -14.146 4.895 1.00 0.00 N ATOM 553 CA GLY A 33 -11.154 -14.159 3.488 1.00 0.00 C ATOM 554 C GLY A 33 -12.302 -13.691 2.623 1.00 0.00 C ATOM 555 O GLY A 33 -12.567 -14.257 1.563 1.00 0.00 O ATOM 0 H GLY A 33 -10.855 -13.634 5.494 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -10.288 -13.518 3.322 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -10.865 -15.168 3.194 1.00 0.00 H new ATOM 559 N PHE A 34 -12.995 -12.658 3.090 1.00 0.00 N ATOM 560 CA PHE A 34 -14.132 -12.115 2.366 1.00 0.00 C ATOM 561 C PHE A 34 -14.149 -10.592 2.427 1.00 0.00 C ATOM 562 O PHE A 34 -14.169 -10.002 3.506 1.00 0.00 O ATOM 563 CB PHE A 34 -15.433 -12.669 2.948 1.00 0.00 C ATOM 564 CG PHE A 34 -16.293 -13.361 1.934 1.00 0.00 C ATOM 565 CD1 PHE A 34 -16.625 -12.734 0.746 1.00 0.00 C ATOM 566 CD2 PHE A 34 -16.767 -14.640 2.171 1.00 0.00 C ATOM 567 CE1 PHE A 34 -17.417 -13.371 -0.191 1.00 0.00 C ATOM 568 CE2 PHE A 34 -17.559 -15.283 1.239 1.00 0.00 C ATOM 569 CZ PHE A 34 -17.885 -14.648 0.057 1.00 0.00 C ATOM 0 H PHE A 34 -12.787 -12.182 3.968 1.00 0.00 H new ATOM 0 HA PHE A 34 -14.042 -12.414 1.322 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -15.195 -13.369 3.749 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -15.999 -11.852 3.396 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -16.261 -11.736 0.549 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -16.515 -15.141 3.094 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -17.670 -12.872 -1.115 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -17.923 -16.281 1.435 1.00 0.00 H new ATOM 0 HZ PHE A 34 -18.505 -15.148 -0.673 1.00 0.00 H new ATOM 579 N LEU A 35 -14.157 -9.964 1.259 1.00 0.00 N ATOM 580 CA LEU A 35 -14.195 -8.511 1.174 1.00 0.00 C ATOM 581 C LEU A 35 -15.625 -8.055 0.909 1.00 0.00 C ATOM 582 O LEU A 35 -16.205 -8.389 -0.122 1.00 0.00 O ATOM 583 CB LEU A 35 -13.254 -8.023 0.064 1.00 0.00 C ATOM 584 CG LEU A 35 -13.570 -6.639 -0.512 1.00 0.00 C ATOM 585 CD1 LEU A 35 -13.727 -5.613 0.600 1.00 0.00 C ATOM 586 CD2 LEU A 35 -12.484 -6.211 -1.489 1.00 0.00 C ATOM 0 H LEU A 35 -14.138 -10.439 0.357 1.00 0.00 H new ATOM 0 HA LEU A 35 -13.858 -8.082 2.118 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -12.237 -8.010 0.455 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -13.274 -8.748 -0.749 1.00 0.00 H new ATOM 0 HG LEU A 35 -14.516 -6.700 -1.051 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -13.951 -4.638 0.167 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -14.542 -5.913 1.259 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -12.801 -5.552 1.172 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -12.723 -5.226 -1.890 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -11.525 -6.170 -0.972 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.425 -6.930 -2.306 1.00 0.00 H new ATOM 598 N LEU A 36 -16.198 -7.305 1.843 1.00 0.00 N ATOM 599 CA LEU A 36 -17.571 -6.838 1.688 1.00 0.00 C ATOM 600 C LEU A 36 -17.632 -5.327 1.504 1.00 0.00 C ATOM 601 O LEU A 36 -16.838 -4.586 2.083 1.00 0.00 O ATOM 602 CB LEU A 36 -18.410 -7.246 2.901 1.00 0.00 C ATOM 603 CG LEU A 36 -18.119 -8.647 3.450 1.00 0.00 C ATOM 604 CD1 LEU A 36 -17.728 -8.577 4.919 1.00 0.00 C ATOM 605 CD2 LEU A 36 -19.325 -9.557 3.261 1.00 0.00 C ATOM 0 H LEU A 36 -15.740 -7.010 2.706 1.00 0.00 H new ATOM 0 HA LEU A 36 -17.978 -7.305 0.791 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -18.247 -6.519 3.697 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -19.464 -7.191 2.630 1.00 0.00 H new ATOM 0 HG LEU A 36 -17.281 -9.066 2.892 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -17.526 -9.582 5.290 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -16.834 -7.963 5.029 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -18.544 -8.136 5.492 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -19.099 -10.547 3.657 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -20.182 -9.141 3.791 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -19.559 -9.635 2.199 1.00 0.00 H new ATOM 617 N TYR A 37 -18.592 -4.880 0.702 1.00 0.00 N ATOM 618 CA TYR A 37 -18.774 -3.459 0.446 1.00 0.00 C ATOM 619 C TYR A 37 -20.218 -3.171 0.043 1.00 0.00 C ATOM 620 O TYR A 37 -20.793 -3.867 -0.797 1.00 0.00 O ATOM 621 CB TYR A 37 -17.781 -2.970 -0.622 1.00 0.00 C ATOM 622 CG TYR A 37 -18.360 -2.791 -2.011 1.00 0.00 C ATOM 623 CD1 TYR A 37 -18.781 -3.882 -2.758 1.00 0.00 C ATOM 624 CD2 TYR A 37 -18.472 -1.526 -2.576 1.00 0.00 C ATOM 625 CE1 TYR A 37 -19.300 -3.720 -4.031 1.00 0.00 C ATOM 626 CE2 TYR A 37 -18.989 -1.357 -3.848 1.00 0.00 C ATOM 627 CZ TYR A 37 -19.400 -2.456 -4.569 1.00 0.00 C ATOM 628 OH TYR A 37 -19.916 -2.290 -5.835 1.00 0.00 O ATOM 0 H TYR A 37 -19.256 -5.484 0.218 1.00 0.00 H new ATOM 0 HA TYR A 37 -18.568 -2.908 1.364 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -17.361 -2.018 -0.296 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -16.956 -3.680 -0.679 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -18.702 -4.874 -2.339 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -18.151 -0.662 -2.013 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -19.625 -4.579 -4.599 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -19.070 -0.368 -4.274 1.00 0.00 H new ATOM 0 HH TYR A 37 -19.919 -1.337 -6.065 1.00 0.00 H new ATOM 638 N HIS A 38 -20.804 -2.151 0.659 1.00 0.00 N ATOM 639 CA HIS A 38 -22.185 -1.778 0.377 1.00 0.00 C ATOM 640 C HIS A 38 -22.269 -0.344 -0.140 1.00 0.00 C ATOM 641 O HIS A 38 -21.348 0.450 0.054 1.00 0.00 O ATOM 642 CB HIS A 38 -23.048 -1.923 1.634 1.00 0.00 C ATOM 643 CG HIS A 38 -22.685 -3.094 2.498 1.00 0.00 C ATOM 644 ND1 HIS A 38 -21.426 -3.279 3.032 1.00 0.00 N ATOM 645 CD2 HIS A 38 -23.431 -4.141 2.928 1.00 0.00 C ATOM 646 CE1 HIS A 38 -21.413 -4.389 3.749 1.00 0.00 C ATOM 647 NE2 HIS A 38 -22.616 -4.929 3.703 1.00 0.00 N ATOM 0 H HIS A 38 -20.344 -1.567 1.357 1.00 0.00 H new ATOM 0 HA HIS A 38 -22.560 -2.450 -0.394 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -22.966 -1.011 2.225 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -24.092 -2.016 1.335 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -24.472 -4.322 2.703 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -20.562 -4.787 4.282 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -22.896 -5.793 4.168 1.00 0.00 H new ATOM 656 N PRO A 39 -23.382 0.007 -0.805 1.00 0.00 N ATOM 657 CA PRO A 39 -23.588 1.352 -1.352 1.00 0.00 C ATOM 658 C PRO A 39 -23.374 2.444 -0.307 1.00 0.00 C ATOM 659 O PRO A 39 -23.007 3.572 -0.641 1.00 0.00 O ATOM 660 CB PRO A 39 -25.047 1.331 -1.811 1.00 0.00 C ATOM 661 CG PRO A 39 -25.339 -0.106 -2.077 1.00 0.00 C ATOM 662 CD PRO A 39 -24.527 -0.882 -1.078 1.00 0.00 C ATOM 0 HA PRO A 39 -22.880 1.579 -2.149 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -25.709 1.734 -1.045 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -25.189 1.936 -2.706 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -26.403 -0.316 -1.964 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -25.067 -0.378 -3.097 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -25.097 -1.092 -0.173 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -24.204 -1.842 -1.481 1.00 0.00 H new ATOM 670 N SER A 40 -23.606 2.107 0.958 1.00 0.00 N ATOM 671 CA SER A 40 -23.438 3.065 2.046 1.00 0.00 C ATOM 672 C SER A 40 -23.586 2.382 3.403 1.00 0.00 C ATOM 673 O SER A 40 -23.721 1.162 3.483 1.00 0.00 O ATOM 674 CB SER A 40 -24.459 4.195 1.919 1.00 0.00 C ATOM 675 OG SER A 40 -23.887 5.442 2.279 1.00 0.00 O ATOM 0 H SER A 40 -23.910 1.180 1.255 1.00 0.00 H new ATOM 0 HA SER A 40 -22.433 3.481 1.977 1.00 0.00 H new ATOM 0 HB2 SER A 40 -24.828 4.243 0.894 1.00 0.00 H new ATOM 0 HB3 SER A 40 -25.318 3.987 2.558 1.00 0.00 H new ATOM 0 HG SER A 40 -24.560 6.149 2.188 1.00 0.00 H new ATOM 681 N ILE A 41 -23.559 3.179 4.468 1.00 0.00 N ATOM 682 CA ILE A 41 -23.692 2.649 5.820 1.00 0.00 C ATOM 683 C ILE A 41 -25.061 2.007 6.022 1.00 0.00 C ATOM 684 O ILE A 41 -25.162 0.897 6.544 1.00 0.00 O ATOM 685 CB ILE A 41 -23.467 3.750 6.881 1.00 0.00 C ATOM 686 CG1 ILE A 41 -22.003 4.192 6.869 1.00 0.00 C ATOM 687 CG2 ILE A 41 -23.860 3.258 8.268 1.00 0.00 C ATOM 688 CD1 ILE A 41 -21.670 5.161 5.756 1.00 0.00 C ATOM 0 H ILE A 41 -23.446 4.192 4.420 1.00 0.00 H new ATOM 0 HA ILE A 41 -22.923 1.887 5.946 1.00 0.00 H new ATOM 0 HB ILE A 41 -24.100 4.603 6.634 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -21.765 4.656 7.826 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -21.367 3.311 6.775 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -23.692 4.051 8.997 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -24.914 2.980 8.270 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -23.255 2.390 8.531 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -20.615 5.430 5.811 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -21.876 4.694 4.793 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -22.279 6.059 5.861 1.00 0.00 H new ATOM 700 N ASN A 42 -26.113 2.701 5.597 1.00 0.00 N ATOM 701 CA ASN A 42 -27.471 2.180 5.724 1.00 0.00 C ATOM 702 C ASN A 42 -27.555 0.771 5.136 1.00 0.00 C ATOM 703 O ASN A 42 -28.372 -0.047 5.554 1.00 0.00 O ATOM 704 CB ASN A 42 -28.462 3.103 5.011 1.00 0.00 C ATOM 705 CG ASN A 42 -28.277 4.558 5.394 1.00 0.00 C ATOM 706 OD1 ASN A 42 -27.482 4.882 6.276 1.00 0.00 O ATOM 707 ND2 ASN A 42 -29.012 5.443 4.730 1.00 0.00 N ATOM 0 H ASN A 42 -26.052 3.622 5.163 1.00 0.00 H new ATOM 0 HA ASN A 42 -27.728 2.137 6.782 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -28.342 2.996 3.933 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -29.479 2.794 5.251 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -28.930 6.437 4.944 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -29.658 5.129 4.006 1.00 0.00 H new ATOM 714 N ASP A 43 -26.698 0.494 4.162 1.00 0.00 N ATOM 715 CA ASP A 43 -26.672 -0.814 3.525 1.00 0.00 C ATOM 716 C ASP A 43 -25.979 -1.839 4.421 1.00 0.00 C ATOM 717 O ASP A 43 -26.419 -2.981 4.525 1.00 0.00 O ATOM 718 CB ASP A 43 -25.968 -0.730 2.171 1.00 0.00 C ATOM 719 CG ASP A 43 -26.581 0.322 1.268 1.00 0.00 C ATOM 720 OD1 ASP A 43 -26.573 1.511 1.650 1.00 0.00 O ATOM 721 OD2 ASP A 43 -27.071 -0.043 0.178 1.00 0.00 O ATOM 0 H ASP A 43 -26.014 1.156 3.797 1.00 0.00 H new ATOM 0 HA ASP A 43 -27.700 -1.139 3.366 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -24.913 -0.503 2.326 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -26.016 -1.701 1.678 1.00 0.00 H new ATOM 726 N TYR A 44 -24.897 -1.420 5.072 1.00 0.00 N ATOM 727 CA TYR A 44 -24.152 -2.301 5.968 1.00 0.00 C ATOM 728 C TYR A 44 -24.967 -2.581 7.229 1.00 0.00 C ATOM 729 O TYR A 44 -25.159 -3.731 7.621 1.00 0.00 O ATOM 730 CB TYR A 44 -22.802 -1.663 6.328 1.00 0.00 C ATOM 731 CG TYR A 44 -22.386 -1.845 7.774 1.00 0.00 C ATOM 732 CD1 TYR A 44 -21.816 -3.034 8.210 1.00 0.00 C ATOM 733 CD2 TYR A 44 -22.564 -0.824 8.702 1.00 0.00 C ATOM 734 CE1 TYR A 44 -21.436 -3.203 9.528 1.00 0.00 C ATOM 735 CE2 TYR A 44 -22.187 -0.986 10.022 1.00 0.00 C ATOM 736 CZ TYR A 44 -21.624 -2.177 10.429 1.00 0.00 C ATOM 737 OH TYR A 44 -21.246 -2.342 11.742 1.00 0.00 O ATOM 0 H TYR A 44 -24.516 -0.477 4.996 1.00 0.00 H new ATOM 0 HA TYR A 44 -23.965 -3.248 5.462 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -22.031 -2.088 5.685 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -22.848 -0.596 6.108 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -21.667 -3.840 7.507 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -23.004 0.110 8.386 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -20.994 -4.134 9.850 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -22.333 -0.184 10.731 1.00 0.00 H new ATOM 0 HH TYR A 44 -21.446 -1.525 12.245 1.00 0.00 H new ATOM 747 N ILE A 45 -25.441 -1.510 7.848 1.00 0.00 N ATOM 748 CA ILE A 45 -26.242 -1.598 9.062 1.00 0.00 C ATOM 749 C ILE A 45 -27.497 -2.430 8.832 1.00 0.00 C ATOM 750 O ILE A 45 -27.710 -3.463 9.469 1.00 0.00 O ATOM 751 CB ILE A 45 -26.653 -0.180 9.533 1.00 0.00 C ATOM 752 CG1 ILE A 45 -25.499 0.484 10.283 1.00 0.00 C ATOM 753 CG2 ILE A 45 -27.913 -0.209 10.399 1.00 0.00 C ATOM 754 CD1 ILE A 45 -25.672 1.979 10.446 1.00 0.00 C ATOM 0 H ILE A 45 -25.282 -0.556 7.524 1.00 0.00 H new ATOM 0 HA ILE A 45 -25.635 -2.081 9.828 1.00 0.00 H new ATOM 0 HB ILE A 45 -26.885 0.409 8.645 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -25.404 0.027 11.268 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -24.568 0.289 9.750 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -28.166 0.805 10.708 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -28.739 -0.630 9.826 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -27.734 -0.823 11.282 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -24.818 2.387 10.987 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -25.737 2.447 9.464 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -26.586 2.181 11.005 1.00 0.00 H new ATOM 766 N HIS A 46 -28.328 -1.942 7.932 1.00 0.00 N ATOM 767 CA HIS A 46 -29.592 -2.579 7.599 1.00 0.00 C ATOM 768 C HIS A 46 -29.398 -3.847 6.769 1.00 0.00 C ATOM 769 O HIS A 46 -30.249 -4.736 6.781 1.00 0.00 O ATOM 770 CB HIS A 46 -30.480 -1.561 6.886 1.00 0.00 C ATOM 771 CG HIS A 46 -30.523 -0.248 7.613 1.00 0.00 C ATOM 772 ND1 HIS A 46 -29.565 0.695 7.798 1.00 0.00 N flip ATOM 773 CD2 HIS A 46 -31.626 0.200 8.305 1.00 0.00 C flip ATOM 774 CE1 HIS A 46 -30.099 1.676 8.585 1.00 0.00 C flip ATOM 775 NE2 HIS A 46 -31.340 1.357 8.880 1.00 0.00 N flip ATOM 0 H HIS A 46 -28.146 -1.087 7.407 1.00 0.00 H new ATOM 0 HA HIS A 46 -30.080 -2.902 8.518 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -30.110 -1.403 5.873 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -31.490 -1.960 6.797 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -32.575 -0.312 8.368 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -29.585 2.568 8.912 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -31.976 1.909 9.456 1.00 0.00 H new ATOM 784 N SER A 47 -28.276 -3.929 6.055 1.00 0.00 N ATOM 785 CA SER A 47 -27.964 -5.094 5.226 1.00 0.00 C ATOM 786 C SER A 47 -28.738 -5.065 3.911 1.00 0.00 C ATOM 787 O SER A 47 -29.702 -5.806 3.722 1.00 0.00 O ATOM 788 CB SER A 47 -28.241 -6.400 5.989 1.00 0.00 C ATOM 789 OG SER A 47 -29.580 -6.832 5.814 1.00 0.00 O ATOM 0 H SER A 47 -27.564 -3.199 6.034 1.00 0.00 H new ATOM 0 HA SER A 47 -26.901 -5.054 4.989 1.00 0.00 H new ATOM 0 HB2 SER A 47 -27.559 -7.176 5.642 1.00 0.00 H new ATOM 0 HB3 SER A 47 -28.042 -6.252 7.050 1.00 0.00 H new ATOM 0 HG SER A 47 -30.148 -6.061 5.608 1.00 0.00 H new ATOM 795 N THR A 48 -28.302 -4.202 2.997 1.00 0.00 N ATOM 796 CA THR A 48 -28.944 -4.078 1.696 1.00 0.00 C ATOM 797 C THR A 48 -27.972 -4.427 0.574 1.00 0.00 C ATOM 798 O THR A 48 -26.951 -3.765 0.393 1.00 0.00 O ATOM 799 CB THR A 48 -29.485 -2.663 1.497 1.00 0.00 C ATOM 800 OG1 THR A 48 -28.426 -1.729 1.393 1.00 0.00 O ATOM 801 CG2 THR A 48 -30.393 -2.211 2.619 1.00 0.00 C ATOM 0 H THR A 48 -27.506 -3.579 3.136 1.00 0.00 H new ATOM 0 HA THR A 48 -29.776 -4.781 1.664 1.00 0.00 H new ATOM 0 HB THR A 48 -30.064 -2.700 0.575 1.00 0.00 H new ATOM 0 HG1 THR A 48 -28.468 -1.282 0.522 1.00 0.00 H new ATOM 0 HG21 THR A 48 -30.744 -1.199 2.418 1.00 0.00 H new ATOM 0 HG22 THR A 48 -31.248 -2.884 2.689 1.00 0.00 H new ATOM 0 HG23 THR A 48 -29.843 -2.224 3.560 1.00 0.00 H new ATOM 809 N HIS A 49 -28.299 -5.480 -0.172 1.00 0.00 N ATOM 810 CA HIS A 49 -27.468 -5.946 -1.281 1.00 0.00 C ATOM 811 C HIS A 49 -26.206 -6.620 -0.763 1.00 0.00 C ATOM 812 O HIS A 49 -25.953 -7.793 -1.036 1.00 0.00 O ATOM 813 CB HIS A 49 -27.101 -4.788 -2.215 1.00 0.00 C ATOM 814 CG HIS A 49 -28.287 -4.030 -2.727 1.00 0.00 C ATOM 815 ND1 HIS A 49 -29.449 -3.682 -2.122 1.00 0.00 N flip ATOM 816 CD2 HIS A 49 -28.365 -3.534 -4.012 1.00 0.00 C flip ATOM 817 CE1 HIS A 49 -30.196 -2.991 -3.045 1.00 0.00 C flip ATOM 818 NE2 HIS A 49 -29.519 -2.915 -4.175 1.00 0.00 N flip ATOM 0 H HIS A 49 -29.144 -6.033 -0.026 1.00 0.00 H new ATOM 0 HA HIS A 49 -28.047 -6.676 -1.847 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -26.442 -4.100 -1.685 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -26.538 -5.180 -3.062 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -27.600 -3.636 -4.768 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -31.179 -2.577 -2.873 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -29.834 -2.456 -5.029 1.00 0.00 H new ATOM 827 N GLY A 50 -25.424 -5.867 -0.007 1.00 0.00 N ATOM 828 CA GLY A 50 -24.192 -6.389 0.558 1.00 0.00 C ATOM 829 C GLY A 50 -23.339 -7.125 -0.456 1.00 0.00 C ATOM 830 O GLY A 50 -23.489 -8.333 -0.645 1.00 0.00 O ATOM 0 H GLY A 50 -25.620 -4.894 0.229 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -23.615 -5.566 0.980 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -24.433 -7.064 1.379 1.00 0.00 H new ATOM 834 N LYS A 51 -22.437 -6.398 -1.105 1.00 0.00 N ATOM 835 CA LYS A 51 -21.553 -6.992 -2.102 1.00 0.00 C ATOM 836 C LYS A 51 -20.340 -7.634 -1.434 1.00 0.00 C ATOM 837 O LYS A 51 -19.706 -7.028 -0.568 1.00 0.00 O ATOM 838 CB LYS A 51 -21.098 -5.932 -3.108 1.00 0.00 C ATOM 839 CG LYS A 51 -21.793 -6.034 -4.456 1.00 0.00 C ATOM 840 CD LYS A 51 -21.454 -7.336 -5.161 1.00 0.00 C ATOM 841 CE LYS A 51 -20.369 -7.138 -6.207 1.00 0.00 C ATOM 842 NZ LYS A 51 -20.498 -8.104 -7.333 1.00 0.00 N ATOM 0 H LYS A 51 -22.298 -5.398 -0.959 1.00 0.00 H new ATOM 0 HA LYS A 51 -22.108 -7.767 -2.631 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -21.281 -4.943 -2.688 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -20.022 -6.022 -3.256 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -22.872 -5.965 -4.316 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -21.498 -5.192 -5.083 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -21.124 -8.072 -4.428 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -22.349 -7.738 -5.636 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -20.420 -6.120 -6.594 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -19.390 -7.253 -5.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -19.739 -7.935 -8.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -20.424 -9.075 -6.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -21.421 -7.978 -7.795 1.00 0.00 H new ATOM 856 N GLU A 52 -20.024 -8.861 -1.836 1.00 0.00 N ATOM 857 CA GLU A 52 -18.887 -9.582 -1.273 1.00 0.00 C ATOM 858 C GLU A 52 -18.032 -10.200 -2.372 1.00 0.00 C ATOM 859 O GLU A 52 -18.544 -10.830 -3.297 1.00 0.00 O ATOM 860 CB GLU A 52 -19.368 -10.668 -0.310 1.00 0.00 C ATOM 861 CG GLU A 52 -20.222 -11.737 -0.974 1.00 0.00 C ATOM 862 CD GLU A 52 -21.646 -11.756 -0.451 1.00 0.00 C ATOM 863 OE1 GLU A 52 -21.837 -11.500 0.757 1.00 0.00 O ATOM 864 OE2 GLU A 52 -22.568 -12.024 -1.248 1.00 0.00 O ATOM 0 H GLU A 52 -20.539 -9.377 -2.549 1.00 0.00 H new ATOM 0 HA GLU A 52 -18.275 -8.867 -0.724 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -18.502 -11.142 0.152 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -19.942 -10.203 0.492 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -20.237 -11.568 -2.051 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -19.766 -12.714 -0.811 1.00 0.00 H new ATOM 871 N MET A 53 -16.724 -10.012 -2.257 1.00 0.00 N ATOM 872 CA MET A 53 -15.780 -10.542 -3.228 1.00 0.00 C ATOM 873 C MET A 53 -14.876 -11.586 -2.574 1.00 0.00 C ATOM 874 O MET A 53 -14.144 -11.284 -1.631 1.00 0.00 O ATOM 875 CB MET A 53 -14.953 -9.396 -3.824 1.00 0.00 C ATOM 876 CG MET A 53 -13.525 -9.771 -4.199 1.00 0.00 C ATOM 877 SD MET A 53 -12.888 -8.827 -5.597 1.00 0.00 S ATOM 878 CE MET A 53 -13.821 -7.312 -5.435 1.00 0.00 C ATOM 0 H MET A 53 -16.291 -9.492 -1.494 1.00 0.00 H new ATOM 0 HA MET A 53 -16.329 -11.030 -4.034 1.00 0.00 H new ATOM 0 HB2 MET A 53 -15.462 -9.023 -4.713 1.00 0.00 H new ATOM 0 HB3 MET A 53 -14.923 -8.576 -3.106 1.00 0.00 H new ATOM 0 HG2 MET A 53 -12.877 -9.614 -3.337 1.00 0.00 H new ATOM 0 HG3 MET A 53 -13.486 -10.834 -4.438 1.00 0.00 H new ATOM 0 HE1 MET A 53 -13.428 -6.567 -6.127 1.00 0.00 H new ATOM 0 HE2 MET A 53 -14.869 -7.504 -5.664 1.00 0.00 H new ATOM 0 HE3 MET A 53 -13.735 -6.939 -4.414 1.00 0.00 H new ATOM 888 N ASP A 54 -14.935 -12.815 -3.078 1.00 0.00 N ATOM 889 CA ASP A 54 -14.123 -13.902 -2.541 1.00 0.00 C ATOM 890 C ASP A 54 -12.642 -13.542 -2.578 1.00 0.00 C ATOM 891 O ASP A 54 -12.127 -13.095 -3.603 1.00 0.00 O ATOM 892 CB ASP A 54 -14.368 -15.189 -3.329 1.00 0.00 C ATOM 893 CG ASP A 54 -14.371 -16.419 -2.443 1.00 0.00 C ATOM 894 OD1 ASP A 54 -13.340 -16.683 -1.789 1.00 0.00 O ATOM 895 OD2 ASP A 54 -15.405 -17.120 -2.402 1.00 0.00 O ATOM 0 H ASP A 54 -15.536 -13.083 -3.857 1.00 0.00 H new ATOM 0 HA ASP A 54 -14.414 -14.061 -1.503 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -15.323 -15.117 -3.849 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -13.597 -15.297 -4.092 1.00 0.00 H new ATOM 900 N LEU A 55 -11.961 -13.736 -1.452 1.00 0.00 N ATOM 901 CA LEU A 55 -10.541 -13.424 -1.360 1.00 0.00 C ATOM 902 C LEU A 55 -9.687 -14.675 -1.544 1.00 0.00 C ATOM 903 O LEU A 55 -8.622 -14.799 -0.947 1.00 0.00 O ATOM 904 CB LEU A 55 -10.223 -12.779 -0.009 1.00 0.00 C ATOM 905 CG LEU A 55 -10.647 -11.315 0.126 1.00 0.00 C ATOM 906 CD1 LEU A 55 -10.784 -10.929 1.592 1.00 0.00 C ATOM 907 CD2 LEU A 55 -9.651 -10.408 -0.578 1.00 0.00 C ATOM 0 H LEU A 55 -12.369 -14.107 -0.594 1.00 0.00 H new ATOM 0 HA LEU A 55 -10.304 -12.723 -2.160 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.711 -13.357 0.776 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.149 -12.848 0.165 1.00 0.00 H new ATOM 0 HG LEU A 55 -11.620 -11.192 -0.350 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -11.086 -9.884 1.666 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -11.537 -11.559 2.065 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -9.827 -11.067 2.095 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -9.967 -9.370 -0.473 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.665 -10.534 -0.131 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -9.606 -10.668 -1.636 1.00 0.00 H new ATOM 919 N LEU A 56 -10.157 -15.598 -2.373 1.00 0.00 N ATOM 920 CA LEU A 56 -9.422 -16.833 -2.628 1.00 0.00 C ATOM 921 C LEU A 56 -8.352 -16.617 -3.693 1.00 0.00 C ATOM 922 O LEU A 56 -7.186 -16.954 -3.492 1.00 0.00 O ATOM 923 CB LEU A 56 -10.379 -17.945 -3.062 1.00 0.00 C ATOM 924 CG LEU A 56 -9.871 -19.367 -2.820 1.00 0.00 C ATOM 925 CD1 LEU A 56 -9.747 -19.645 -1.328 1.00 0.00 C ATOM 926 CD2 LEU A 56 -10.793 -20.382 -3.479 1.00 0.00 C ATOM 0 H LEU A 56 -11.039 -15.517 -2.879 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.932 -17.132 -1.702 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -11.323 -17.818 -2.533 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -10.591 -17.827 -4.125 1.00 0.00 H new ATOM 0 HG LEU A 56 -8.882 -19.460 -3.268 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.384 -20.662 -1.176 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -9.045 -18.939 -0.883 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -10.723 -19.534 -0.855 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -10.416 -21.388 -3.296 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -11.795 -20.289 -3.061 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -10.829 -20.197 -4.553 1.00 0.00 H new ATOM 938 N ARG A 57 -8.758 -16.051 -4.824 1.00 0.00 N ATOM 939 CA ARG A 57 -7.836 -15.783 -5.920 1.00 0.00 C ATOM 940 C ARG A 57 -8.005 -14.354 -6.426 1.00 0.00 C ATOM 941 O ARG A 57 -8.100 -14.117 -7.630 1.00 0.00 O ATOM 942 CB ARG A 57 -8.067 -16.776 -7.062 1.00 0.00 C ATOM 943 CG ARG A 57 -7.333 -18.095 -6.880 1.00 0.00 C ATOM 944 CD ARG A 57 -6.941 -18.703 -8.217 1.00 0.00 C ATOM 945 NE ARG A 57 -8.026 -19.489 -8.800 1.00 0.00 N ATOM 946 CZ ARG A 57 -8.343 -20.721 -8.409 1.00 0.00 C ATOM 947 NH1 ARG A 57 -7.662 -21.310 -7.433 1.00 0.00 N ATOM 948 NH2 ARG A 57 -9.344 -21.365 -8.993 1.00 0.00 N ATOM 0 H ARG A 57 -9.721 -15.769 -5.005 1.00 0.00 H new ATOM 0 HA ARG A 57 -6.818 -15.902 -5.549 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -9.135 -16.974 -7.150 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.749 -16.319 -7.999 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.440 -17.935 -6.276 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.967 -18.793 -6.333 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -6.657 -17.909 -8.907 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -6.065 -19.337 -8.084 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.573 -19.068 -9.551 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -6.892 -20.818 -6.979 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -7.909 -22.254 -7.137 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -9.871 -20.916 -9.742 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -9.587 -22.309 -8.693 1.00 0.00 H new ATOM 962 N THR A 58 -8.049 -13.407 -5.495 1.00 0.00 N ATOM 963 CA THR A 58 -8.215 -12.001 -5.842 1.00 0.00 C ATOM 964 C THR A 58 -6.867 -11.326 -6.068 1.00 0.00 C ATOM 965 O THR A 58 -5.828 -11.829 -5.642 1.00 0.00 O ATOM 966 CB THR A 58 -8.980 -11.267 -4.741 1.00 0.00 C ATOM 967 OG1 THR A 58 -8.772 -11.892 -3.488 1.00 0.00 O ATOM 968 CG2 THR A 58 -10.472 -11.208 -4.982 1.00 0.00 C ATOM 0 H THR A 58 -7.972 -13.588 -4.494 1.00 0.00 H new ATOM 0 HA THR A 58 -8.785 -11.953 -6.770 1.00 0.00 H new ATOM 0 HB THR A 58 -8.589 -10.249 -4.747 1.00 0.00 H new ATOM 0 HG1 THR A 58 -9.188 -12.779 -3.492 1.00 0.00 H new ATOM 0 HG21 THR A 58 -10.952 -10.673 -4.162 1.00 0.00 H new ATOM 0 HG22 THR A 58 -10.669 -10.688 -5.919 1.00 0.00 H new ATOM 0 HG23 THR A 58 -10.872 -12.220 -5.038 1.00 0.00 H new ATOM 976 N THR A 59 -6.899 -10.179 -6.738 1.00 0.00 N ATOM 977 CA THR A 59 -5.686 -9.420 -7.019 1.00 0.00 C ATOM 978 C THR A 59 -5.861 -7.961 -6.610 1.00 0.00 C ATOM 979 O THR A 59 -6.960 -7.536 -6.253 1.00 0.00 O ATOM 980 CB THR A 59 -5.334 -9.507 -8.504 1.00 0.00 C ATOM 981 OG1 THR A 59 -5.936 -10.644 -9.098 1.00 0.00 O ATOM 982 CG2 THR A 59 -3.847 -9.587 -8.763 1.00 0.00 C ATOM 0 H THR A 59 -7.754 -9.754 -7.097 1.00 0.00 H new ATOM 0 HA THR A 59 -4.871 -9.851 -6.438 1.00 0.00 H new ATOM 0 HB THR A 59 -5.714 -8.585 -8.944 1.00 0.00 H new ATOM 0 HG1 THR A 59 -5.700 -10.680 -10.048 1.00 0.00 H new ATOM 0 HG21 THR A 59 -3.667 -9.647 -9.836 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.360 -8.698 -8.362 1.00 0.00 H new ATOM 0 HG23 THR A 59 -3.440 -10.474 -8.277 1.00 0.00 H new ATOM 990 N VAL A 60 -4.775 -7.201 -6.664 1.00 0.00 N ATOM 991 CA VAL A 60 -4.813 -5.790 -6.299 1.00 0.00 C ATOM 992 C VAL A 60 -4.239 -4.922 -7.412 1.00 0.00 C ATOM 993 O VAL A 60 -3.097 -5.111 -7.832 1.00 0.00 O ATOM 994 CB VAL A 60 -4.034 -5.523 -4.998 1.00 0.00 C ATOM 995 CG1 VAL A 60 -4.304 -4.111 -4.494 1.00 0.00 C ATOM 996 CG2 VAL A 60 -4.395 -6.551 -3.937 1.00 0.00 C ATOM 0 H VAL A 60 -3.857 -7.537 -6.957 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.860 -5.531 -6.142 1.00 0.00 H new ATOM 0 HB VAL A 60 -2.969 -5.613 -5.210 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -3.745 -3.940 -3.574 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -3.991 -3.389 -5.248 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -5.370 -3.992 -4.299 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -3.834 -6.345 -3.025 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -5.463 -6.497 -3.726 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -4.147 -7.549 -4.298 1.00 0.00 H new ATOM 1006 N LYS A 61 -5.039 -3.976 -7.892 1.00 0.00 N ATOM 1007 CA LYS A 61 -4.607 -3.084 -8.963 1.00 0.00 C ATOM 1008 C LYS A 61 -4.436 -1.657 -8.452 1.00 0.00 C ATOM 1009 O LYS A 61 -5.156 -1.215 -7.555 1.00 0.00 O ATOM 1010 CB LYS A 61 -5.615 -3.114 -10.114 1.00 0.00 C ATOM 1011 CG LYS A 61 -5.019 -3.590 -11.430 1.00 0.00 C ATOM 1012 CD LYS A 61 -6.044 -4.335 -12.269 1.00 0.00 C ATOM 1013 CE LYS A 61 -5.873 -5.841 -12.152 1.00 0.00 C ATOM 1014 NZ LYS A 61 -4.980 -6.384 -13.211 1.00 0.00 N ATOM 0 H LYS A 61 -5.988 -3.807 -7.558 1.00 0.00 H new ATOM 0 HA LYS A 61 -3.641 -3.433 -9.326 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -6.445 -3.767 -9.843 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -6.027 -2.114 -10.251 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -4.641 -2.735 -11.990 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -4.168 -4.241 -11.231 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -7.048 -4.056 -11.950 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -5.947 -4.037 -13.313 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -5.463 -6.084 -11.172 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -6.848 -6.323 -12.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -4.890 -7.414 -13.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -5.384 -6.175 -14.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -4.041 -5.944 -13.133 1.00 0.00 H new ATOM 1028 N VAL A 62 -3.479 -0.938 -9.033 1.00 0.00 N ATOM 1029 CA VAL A 62 -3.211 0.440 -8.644 1.00 0.00 C ATOM 1030 C VAL A 62 -3.182 1.357 -9.865 1.00 0.00 C ATOM 1031 O VAL A 62 -2.402 1.139 -10.792 1.00 0.00 O ATOM 1032 CB VAL A 62 -1.871 0.561 -7.895 1.00 0.00 C ATOM 1033 CG1 VAL A 62 -1.704 1.959 -7.321 1.00 0.00 C ATOM 1034 CG2 VAL A 62 -1.775 -0.489 -6.799 1.00 0.00 C ATOM 0 H VAL A 62 -2.876 -1.290 -9.777 1.00 0.00 H new ATOM 0 HA VAL A 62 -4.019 0.746 -7.979 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.062 0.386 -8.605 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -0.751 2.025 -6.795 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -1.724 2.689 -8.130 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -2.517 2.166 -6.625 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -0.821 -0.388 -6.281 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -2.590 -0.350 -6.089 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -1.844 -1.483 -7.240 1.00 0.00 H new ATOM 1044 N PRO A 63 -4.033 2.400 -9.887 1.00 0.00 N ATOM 1045 CA PRO A 63 -4.091 3.343 -11.007 1.00 0.00 C ATOM 1046 C PRO A 63 -2.887 4.278 -11.044 1.00 0.00 C ATOM 1047 O PRO A 63 -3.027 5.495 -10.915 1.00 0.00 O ATOM 1048 CB PRO A 63 -5.374 4.131 -10.736 1.00 0.00 C ATOM 1049 CG PRO A 63 -5.543 4.076 -9.259 1.00 0.00 C ATOM 1050 CD PRO A 63 -5.002 2.740 -8.828 1.00 0.00 C ATOM 0 HA PRO A 63 -4.081 2.834 -11.971 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -5.289 5.159 -11.087 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -6.227 3.688 -11.249 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -5.004 4.890 -8.774 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -6.592 4.179 -8.982 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -4.524 2.798 -7.850 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -5.792 1.993 -8.753 1.00 0.00 H new ATOM 1058 N GLY A 64 -1.703 3.702 -11.220 1.00 0.00 N ATOM 1059 CA GLY A 64 -0.490 4.497 -11.270 1.00 0.00 C ATOM 1060 C GLY A 64 0.397 4.283 -10.060 1.00 0.00 C ATOM 1061 O GLY A 64 0.041 4.665 -8.945 1.00 0.00 O ATOM 0 H GLY A 64 -1.561 2.698 -11.329 1.00 0.00 H new ATOM 0 HA2 GLY A 64 0.067 4.247 -12.173 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -0.754 5.552 -11.340 1.00 0.00 H new ATOM 1065 N LYS A 65 1.557 3.673 -10.280 1.00 0.00 N ATOM 1066 CA LYS A 65 2.499 3.408 -9.198 1.00 0.00 C ATOM 1067 C LYS A 65 2.997 4.712 -8.582 1.00 0.00 C ATOM 1068 O LYS A 65 2.724 5.797 -9.096 1.00 0.00 O ATOM 1069 CB LYS A 65 3.684 2.589 -9.714 1.00 0.00 C ATOM 1070 CG LYS A 65 3.352 1.124 -9.954 1.00 0.00 C ATOM 1071 CD LYS A 65 3.963 0.230 -8.887 1.00 0.00 C ATOM 1072 CE LYS A 65 3.150 -1.038 -8.689 1.00 0.00 C ATOM 1073 NZ LYS A 65 3.431 -1.679 -7.375 1.00 0.00 N ATOM 0 H LYS A 65 1.867 3.353 -11.197 1.00 0.00 H new ATOM 0 HA LYS A 65 1.980 2.837 -8.428 1.00 0.00 H new ATOM 0 HB2 LYS A 65 4.042 3.029 -10.645 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.501 2.655 -8.996 1.00 0.00 H new ATOM 0 HG2 LYS A 65 2.270 0.992 -9.964 1.00 0.00 H new ATOM 0 HG3 LYS A 65 3.719 0.823 -10.935 1.00 0.00 H new ATOM 0 HD2 LYS A 65 4.983 -0.031 -9.170 1.00 0.00 H new ATOM 0 HD3 LYS A 65 4.023 0.775 -7.945 1.00 0.00 H new ATOM 0 HE2 LYS A 65 2.088 -0.803 -8.758 1.00 0.00 H new ATOM 0 HE3 LYS A 65 3.374 -1.741 -9.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.857 -2.541 -7.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 4.439 -1.927 -7.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 3.194 -1.018 -6.608 1.00 0.00 H new ATOM 1087 N ARG A 66 3.727 4.598 -7.478 1.00 0.00 N ATOM 1088 CA ARG A 66 4.261 5.769 -6.792 1.00 0.00 C ATOM 1089 C ARG A 66 3.137 6.697 -6.342 1.00 0.00 C ATOM 1090 O ARG A 66 2.015 6.616 -6.845 1.00 0.00 O ATOM 1091 CB ARG A 66 5.227 6.525 -7.708 1.00 0.00 C ATOM 1092 CG ARG A 66 6.352 5.659 -8.250 1.00 0.00 C ATOM 1093 CD ARG A 66 7.563 6.494 -8.633 1.00 0.00 C ATOM 1094 NE ARG A 66 8.557 5.714 -9.368 1.00 0.00 N ATOM 1095 CZ ARG A 66 8.424 5.356 -10.642 1.00 0.00 C ATOM 1096 NH1 ARG A 66 7.340 5.704 -11.327 1.00 0.00 N ATOM 1097 NH2 ARG A 66 9.375 4.647 -11.234 1.00 0.00 N ATOM 0 H ARG A 66 3.962 3.708 -7.039 1.00 0.00 H new ATOM 0 HA ARG A 66 4.800 5.427 -5.908 1.00 0.00 H new ATOM 0 HB2 ARG A 66 4.668 6.946 -8.544 1.00 0.00 H new ATOM 0 HB3 ARG A 66 5.656 7.362 -7.158 1.00 0.00 H new ATOM 0 HG2 ARG A 66 6.639 4.922 -7.500 1.00 0.00 H new ATOM 0 HG3 ARG A 66 6.000 5.106 -9.121 1.00 0.00 H new ATOM 0 HD2 ARG A 66 7.242 7.339 -9.243 1.00 0.00 H new ATOM 0 HD3 ARG A 66 8.019 6.905 -7.732 1.00 0.00 H new ATOM 0 HE ARG A 66 9.403 5.427 -8.875 1.00 0.00 H new ATOM 0 HH11 ARG A 66 6.605 6.248 -10.876 1.00 0.00 H new ATOM 0 HH12 ARG A 66 7.243 5.427 -12.304 1.00 0.00 H new ATOM 0 HH21 ARG A 66 10.209 4.376 -10.712 1.00 0.00 H new ATOM 0 HH22 ARG A 66 9.273 4.372 -12.211 1.00 0.00 H new ATOM 1111 N PRO A 67 3.421 7.597 -5.383 1.00 0.00 N ATOM 1112 CA PRO A 67 2.423 8.540 -4.868 1.00 0.00 C ATOM 1113 C PRO A 67 1.736 9.326 -5.985 1.00 0.00 C ATOM 1114 O PRO A 67 2.390 10.057 -6.728 1.00 0.00 O ATOM 1115 CB PRO A 67 3.246 9.481 -3.985 1.00 0.00 C ATOM 1116 CG PRO A 67 4.428 8.674 -3.570 1.00 0.00 C ATOM 1117 CD PRO A 67 4.731 7.762 -4.727 1.00 0.00 C ATOM 0 HA PRO A 67 1.617 8.031 -4.339 1.00 0.00 H new ATOM 0 HB2 PRO A 67 3.549 10.374 -4.532 1.00 0.00 H new ATOM 0 HB3 PRO A 67 2.672 9.816 -3.121 1.00 0.00 H new ATOM 0 HG2 PRO A 67 5.280 9.316 -3.345 1.00 0.00 H new ATOM 0 HG3 PRO A 67 4.213 8.102 -2.667 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.466 8.200 -5.402 1.00 0.00 H new ATOM 0 HD3 PRO A 67 5.135 6.807 -4.391 1.00 0.00 H new ATOM 1125 N PRO A 68 0.404 9.183 -6.121 1.00 0.00 N ATOM 1126 CA PRO A 68 -0.361 9.886 -7.158 1.00 0.00 C ATOM 1127 C PRO A 68 -0.248 11.401 -7.035 1.00 0.00 C ATOM 1128 O PRO A 68 -0.056 11.932 -5.940 1.00 0.00 O ATOM 1129 CB PRO A 68 -1.807 9.439 -6.913 1.00 0.00 C ATOM 1130 CG PRO A 68 -1.696 8.181 -6.120 1.00 0.00 C ATOM 1131 CD PRO A 68 -0.458 8.331 -5.285 1.00 0.00 C ATOM 0 HA PRO A 68 0.006 9.650 -8.157 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -2.368 10.199 -6.369 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -2.331 9.267 -7.853 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -2.575 8.036 -5.493 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -1.624 7.312 -6.774 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -0.674 8.796 -4.323 1.00 0.00 H new ATOM 0 HD3 PRO A 68 0.007 7.368 -5.076 1.00 0.00 H new ATOM 1139 N ARG A 69 -0.369 12.093 -8.163 1.00 0.00 N ATOM 1140 CA ARG A 69 -0.283 13.547 -8.180 1.00 0.00 C ATOM 1141 C ARG A 69 -1.594 14.175 -7.719 1.00 0.00 C ATOM 1142 O ARG A 69 -2.531 13.473 -7.341 1.00 0.00 O ATOM 1143 CB ARG A 69 0.067 14.039 -9.587 1.00 0.00 C ATOM 1144 CG ARG A 69 1.560 14.060 -9.868 1.00 0.00 C ATOM 1145 CD ARG A 69 2.047 12.717 -10.386 1.00 0.00 C ATOM 1146 NE ARG A 69 3.217 12.855 -11.250 1.00 0.00 N ATOM 1147 CZ ARG A 69 4.447 13.097 -10.800 1.00 0.00 C ATOM 1148 NH1 ARG A 69 4.670 13.225 -9.499 1.00 0.00 N ATOM 1149 NH2 ARG A 69 5.455 13.209 -11.654 1.00 0.00 N ATOM 0 H ARG A 69 -0.527 11.669 -9.077 1.00 0.00 H new ATOM 0 HA ARG A 69 0.504 13.849 -7.490 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -0.424 13.398 -10.320 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -0.334 15.043 -9.722 1.00 0.00 H new ATOM 0 HG2 ARG A 69 1.783 14.836 -10.600 1.00 0.00 H new ATOM 0 HG3 ARG A 69 2.100 14.317 -8.956 1.00 0.00 H new ATOM 0 HD2 ARG A 69 2.293 12.071 -9.543 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.244 12.229 -10.938 1.00 0.00 H new ATOM 0 HE ARG A 69 3.084 12.760 -12.257 1.00 0.00 H new ATOM 0 HH11 ARG A 69 3.898 13.138 -8.838 1.00 0.00 H new ATOM 0 HH12 ARG A 69 5.614 13.410 -9.159 1.00 0.00 H new ATOM 0 HH21 ARG A 69 5.288 13.110 -12.655 1.00 0.00 H new ATOM 0 HH22 ARG A 69 6.397 13.394 -11.310 1.00 0.00 H new ATOM 1163 N ALA A 70 -1.652 15.503 -7.752 1.00 0.00 N ATOM 1164 CA ALA A 70 -2.850 16.224 -7.335 1.00 0.00 C ATOM 1165 C ALA A 70 -3.831 16.378 -8.493 1.00 0.00 C ATOM 1166 O ALA A 70 -5.016 16.071 -8.361 1.00 0.00 O ATOM 1167 CB ALA A 70 -2.474 17.588 -6.774 1.00 0.00 C ATOM 0 H ALA A 70 -0.886 16.100 -8.062 1.00 0.00 H new ATOM 0 HA ALA A 70 -3.341 15.643 -6.554 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -3.376 18.116 -6.466 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -1.818 17.459 -5.913 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -1.958 18.167 -7.540 1.00 0.00 H new ATOM 1173 N ILE A 71 -3.331 16.856 -9.629 1.00 0.00 N ATOM 1174 CA ILE A 71 -4.165 17.051 -10.808 1.00 0.00 C ATOM 1175 C ILE A 71 -4.232 15.784 -11.651 1.00 0.00 C ATOM 1176 O ILE A 71 -5.312 15.345 -12.048 1.00 0.00 O ATOM 1177 CB ILE A 71 -3.643 18.207 -11.682 1.00 0.00 C ATOM 1178 CG1 ILE A 71 -3.375 19.443 -10.821 1.00 0.00 C ATOM 1179 CG2 ILE A 71 -4.638 18.529 -12.786 1.00 0.00 C ATOM 1180 CD1 ILE A 71 -4.613 19.987 -10.142 1.00 0.00 C ATOM 0 H ILE A 71 -2.353 17.115 -9.757 1.00 0.00 H new ATOM 0 HA ILE A 71 -5.164 17.299 -10.449 1.00 0.00 H new ATOM 0 HB ILE A 71 -2.706 17.899 -12.145 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -2.634 19.193 -10.062 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -2.940 20.224 -11.446 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -4.254 19.348 -13.394 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -4.784 17.649 -13.412 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -5.590 18.821 -12.344 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -4.348 20.862 -9.549 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -5.348 20.269 -10.896 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -5.037 19.222 -9.491 1.00 0.00 H new ATOM 1192 N SER A 72 -3.071 15.203 -11.921 1.00 0.00 N ATOM 1193 CA SER A 72 -2.991 13.985 -12.720 1.00 0.00 C ATOM 1194 C SER A 72 -1.549 13.504 -12.834 1.00 0.00 C ATOM 1195 O SER A 72 -0.620 14.183 -12.396 1.00 0.00 O ATOM 1196 CB SER A 72 -3.572 14.225 -14.115 1.00 0.00 C ATOM 1197 OG SER A 72 -4.951 13.909 -14.155 1.00 0.00 O ATOM 0 H SER A 72 -2.170 15.555 -11.599 1.00 0.00 H new ATOM 0 HA SER A 72 -3.575 13.213 -12.219 1.00 0.00 H new ATOM 0 HB2 SER A 72 -3.426 15.267 -14.398 1.00 0.00 H new ATOM 0 HB3 SER A 72 -3.036 13.618 -14.845 1.00 0.00 H new ATOM 0 HG SER A 72 -5.444 14.522 -13.570 1.00 0.00 H new ATOM 1203 N ALA A 73 -1.367 12.326 -13.425 1.00 0.00 N ATOM 1204 CA ALA A 73 -0.037 11.752 -13.597 1.00 0.00 C ATOM 1205 C ALA A 73 0.568 12.125 -14.944 1.00 0.00 C ATOM 1206 O ALA A 73 1.519 11.494 -15.408 1.00 0.00 O ATOM 1207 CB ALA A 73 -0.080 10.242 -13.427 1.00 0.00 C ATOM 0 H ALA A 73 -2.125 11.751 -13.793 1.00 0.00 H new ATOM 0 HA ALA A 73 0.605 12.172 -12.823 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.921 9.832 -13.559 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -0.443 9.998 -12.429 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -0.749 9.811 -14.172 1.00 0.00 H new ATOM 1213 N PHE A 74 0.008 13.150 -15.564 1.00 0.00 N ATOM 1214 CA PHE A 74 0.485 13.617 -16.862 1.00 0.00 C ATOM 1215 C PHE A 74 -0.064 15.005 -17.174 1.00 0.00 C ATOM 1216 O PHE A 74 -1.138 15.143 -17.761 1.00 0.00 O ATOM 1217 CB PHE A 74 0.079 12.632 -17.961 1.00 0.00 C ATOM 1218 CG PHE A 74 1.248 12.031 -18.690 1.00 0.00 C ATOM 1219 CD1 PHE A 74 2.173 12.843 -19.328 1.00 0.00 C ATOM 1220 CD2 PHE A 74 1.421 10.659 -18.737 1.00 0.00 C ATOM 1221 CE1 PHE A 74 3.250 12.294 -19.999 1.00 0.00 C ATOM 1222 CE2 PHE A 74 2.495 10.103 -19.406 1.00 0.00 C ATOM 1223 CZ PHE A 74 3.411 10.922 -20.037 1.00 0.00 C ATOM 0 H PHE A 74 -0.780 13.679 -15.191 1.00 0.00 H new ATOM 0 HA PHE A 74 1.573 13.678 -16.824 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.514 11.831 -17.519 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -0.562 13.144 -18.678 1.00 0.00 H new ATOM 0 HD1 PHE A 74 2.051 13.916 -19.301 1.00 0.00 H new ATOM 0 HD2 PHE A 74 0.708 10.014 -18.245 1.00 0.00 H new ATOM 0 HE1 PHE A 74 3.964 12.936 -20.493 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.618 9.030 -19.435 1.00 0.00 H new ATOM 0 HZ PHE A 74 4.252 10.491 -20.559 1.00 0.00 H new ATOM 1233 N GLY A 75 0.682 16.032 -16.778 1.00 0.00 N ATOM 1234 CA GLY A 75 0.254 17.397 -17.025 1.00 0.00 C ATOM 1235 C GLY A 75 1.421 18.363 -17.115 1.00 0.00 C ATOM 1236 O GLY A 75 1.793 18.984 -16.120 1.00 0.00 O ATOM 0 H GLY A 75 1.574 15.943 -16.291 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -0.316 17.433 -17.953 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -0.416 17.715 -16.226 1.00 0.00 H new ATOM 1240 N PRO A 76 2.025 18.512 -18.307 1.00 0.00 N ATOM 1241 CA PRO A 76 3.161 19.416 -18.510 1.00 0.00 C ATOM 1242 C PRO A 76 2.875 20.827 -18.007 1.00 0.00 C ATOM 1243 O PRO A 76 1.722 21.258 -17.960 1.00 0.00 O ATOM 1244 CB PRO A 76 3.350 19.418 -20.027 1.00 0.00 C ATOM 1245 CG PRO A 76 2.788 18.116 -20.481 1.00 0.00 C ATOM 1246 CD PRO A 76 1.648 17.811 -19.549 1.00 0.00 C ATOM 0 HA PRO A 76 4.043 19.090 -17.959 1.00 0.00 H new ATOM 0 HB2 PRO A 76 2.829 20.257 -20.490 1.00 0.00 H new ATOM 0 HB3 PRO A 76 4.403 19.510 -20.295 1.00 0.00 H new ATOM 0 HG2 PRO A 76 2.443 18.178 -21.513 1.00 0.00 H new ATOM 0 HG3 PRO A 76 3.543 17.331 -20.444 1.00 0.00 H new ATOM 0 HD2 PRO A 76 0.699 18.174 -19.943 1.00 0.00 H new ATOM 0 HD3 PRO A 76 1.537 16.739 -19.387 1.00 0.00 H new ATOM 1254 N SER A 77 3.929 21.542 -17.630 1.00 0.00 N ATOM 1255 CA SER A 77 3.790 22.904 -17.131 1.00 0.00 C ATOM 1256 C SER A 77 5.114 23.656 -17.231 1.00 0.00 C ATOM 1257 O SER A 77 6.143 23.191 -16.742 1.00 0.00 O ATOM 1258 CB SER A 77 3.308 22.890 -15.679 1.00 0.00 C ATOM 1259 OG SER A 77 4.369 22.585 -14.790 1.00 0.00 O ATOM 0 H SER A 77 4.890 21.200 -17.661 1.00 0.00 H new ATOM 0 HA SER A 77 3.052 23.418 -17.747 1.00 0.00 H new ATOM 0 HB2 SER A 77 2.884 23.861 -15.424 1.00 0.00 H new ATOM 0 HB3 SER A 77 2.511 22.155 -15.565 1.00 0.00 H new ATOM 0 HG SER A 77 5.226 22.764 -15.230 1.00 0.00 H new ATOM 1265 N ALA A 78 5.078 24.823 -17.869 1.00 0.00 N ATOM 1266 CA ALA A 78 6.274 25.639 -18.035 1.00 0.00 C ATOM 1267 C ALA A 78 6.704 26.257 -16.708 1.00 0.00 C ATOM 1268 O ALA A 78 7.894 26.452 -16.459 1.00 0.00 O ATOM 1269 CB ALA A 78 6.031 26.726 -19.071 1.00 0.00 C ATOM 0 H ALA A 78 4.234 25.223 -18.279 1.00 0.00 H new ATOM 0 HA ALA A 78 7.080 24.993 -18.384 1.00 0.00 H new ATOM 0 HB1 ALA A 78 6.932 27.328 -19.185 1.00 0.00 H new ATOM 0 HB2 ALA A 78 5.778 26.268 -20.027 1.00 0.00 H new ATOM 0 HB3 ALA A 78 5.209 27.362 -18.745 1.00 0.00 H new ATOM 1275 N SER A 79 5.728 26.562 -15.859 1.00 0.00 N ATOM 1276 CA SER A 79 6.005 27.157 -14.557 1.00 0.00 C ATOM 1277 C SER A 79 4.940 26.760 -13.539 1.00 0.00 C ATOM 1278 O SER A 79 3.961 27.479 -13.339 1.00 0.00 O ATOM 1279 CB SER A 79 6.075 28.680 -14.674 1.00 0.00 C ATOM 1280 OG SER A 79 7.107 29.208 -13.860 1.00 0.00 O ATOM 0 H SER A 79 4.738 26.407 -16.050 1.00 0.00 H new ATOM 0 HA SER A 79 6.968 26.782 -14.211 1.00 0.00 H new ATOM 0 HB2 SER A 79 6.248 28.960 -15.713 1.00 0.00 H new ATOM 0 HB3 SER A 79 5.119 29.114 -14.382 1.00 0.00 H new ATOM 0 HG SER A 79 7.132 30.183 -13.954 1.00 0.00 H new ATOM 1286 N GLY A 80 5.139 25.613 -12.899 1.00 0.00 N ATOM 1287 CA GLY A 80 4.187 25.142 -11.910 1.00 0.00 C ATOM 1288 C GLY A 80 4.560 25.556 -10.501 1.00 0.00 C ATOM 1289 O GLY A 80 5.738 25.739 -10.192 1.00 0.00 O ATOM 0 H GLY A 80 5.942 25.001 -13.047 1.00 0.00 H new ATOM 0 HA2 GLY A 80 3.197 25.531 -12.149 1.00 0.00 H new ATOM 0 HA3 GLY A 80 4.123 24.055 -11.961 1.00 0.00 H new ATOM 1293 N SER A 81 3.556 25.704 -9.643 1.00 0.00 N ATOM 1294 CA SER A 81 3.785 26.098 -8.257 1.00 0.00 C ATOM 1295 C SER A 81 3.225 25.055 -7.295 1.00 0.00 C ATOM 1296 O SER A 81 2.232 24.392 -7.592 1.00 0.00 O ATOM 1297 CB SER A 81 3.145 27.460 -7.982 1.00 0.00 C ATOM 1298 OG SER A 81 1.867 27.556 -8.587 1.00 0.00 O ATOM 0 H SER A 81 2.576 25.557 -9.883 1.00 0.00 H new ATOM 0 HA SER A 81 4.861 26.170 -8.098 1.00 0.00 H new ATOM 0 HB2 SER A 81 3.054 27.612 -6.906 1.00 0.00 H new ATOM 0 HB3 SER A 81 3.791 28.252 -8.362 1.00 0.00 H new ATOM 0 HG SER A 81 1.479 28.435 -8.395 1.00 0.00 H new ATOM 1304 N ALA A 82 3.869 24.917 -6.142 1.00 0.00 N ATOM 1305 CA ALA A 82 3.436 23.956 -5.134 1.00 0.00 C ATOM 1306 C ALA A 82 2.795 24.658 -3.944 1.00 0.00 C ATOM 1307 O ALA A 82 3.047 25.839 -3.697 1.00 0.00 O ATOM 1308 CB ALA A 82 4.611 23.105 -4.678 1.00 0.00 C ATOM 0 H ALA A 82 4.693 25.459 -5.882 1.00 0.00 H new ATOM 0 HA ALA A 82 2.685 23.308 -5.585 1.00 0.00 H new ATOM 0 HB1 ALA A 82 4.274 22.392 -3.926 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.022 22.565 -5.531 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.381 23.747 -4.250 1.00 0.00 H new ATOM 1314 N GLY A 83 1.963 23.927 -3.209 1.00 0.00 N ATOM 1315 CA GLY A 83 1.297 24.497 -2.053 1.00 0.00 C ATOM 1316 C GLY A 83 -0.091 25.012 -2.376 1.00 0.00 C ATOM 1317 O GLY A 83 -0.587 25.931 -1.725 1.00 0.00 O ATOM 0 H GLY A 83 1.738 22.949 -3.394 1.00 0.00 H new ATOM 0 HA2 GLY A 83 1.227 23.742 -1.270 1.00 0.00 H new ATOM 0 HA3 GLY A 83 1.900 25.314 -1.656 1.00 0.00 H new ATOM 1321 N GLN A 84 -0.719 24.418 -3.385 1.00 0.00 N ATOM 1322 CA GLN A 84 -2.060 24.823 -3.795 1.00 0.00 C ATOM 1323 C GLN A 84 -3.008 23.629 -3.813 1.00 0.00 C ATOM 1324 O GLN A 84 -4.147 23.720 -3.353 1.00 0.00 O ATOM 1325 CB GLN A 84 -2.020 25.476 -5.177 1.00 0.00 C ATOM 1326 CG GLN A 84 -1.247 26.784 -5.207 1.00 0.00 C ATOM 1327 CD GLN A 84 -1.688 27.698 -6.333 1.00 0.00 C ATOM 1328 OE1 GLN A 84 -2.181 28.801 -6.097 1.00 0.00 O ATOM 1329 NE2 GLN A 84 -1.516 27.241 -7.568 1.00 0.00 N ATOM 0 H GLN A 84 -0.322 23.655 -3.934 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.430 25.547 -3.069 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -1.570 24.781 -5.886 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -3.041 25.658 -5.514 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -1.375 27.299 -4.255 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -0.183 26.570 -5.313 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -1.103 26.320 -7.718 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -1.797 27.811 -8.366 1.00 0.00 H new ATOM 1338 N ALA A 85 -2.531 22.513 -4.348 1.00 0.00 N ATOM 1339 CA ALA A 85 -3.333 21.299 -4.430 1.00 0.00 C ATOM 1340 C ALA A 85 -2.527 20.076 -4.006 1.00 0.00 C ATOM 1341 O ALA A 85 -1.625 19.637 -4.721 1.00 0.00 O ATOM 1342 CB ALA A 85 -3.871 21.116 -5.841 1.00 0.00 C ATOM 0 H ALA A 85 -1.591 22.423 -4.733 1.00 0.00 H new ATOM 0 HA ALA A 85 -4.173 21.402 -3.743 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -4.468 20.205 -5.887 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -4.492 21.971 -6.107 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -3.039 21.040 -6.541 1.00 0.00 H new ATOM 1348 N GLU A 86 -2.859 19.529 -2.841 1.00 0.00 N ATOM 1349 CA GLU A 86 -2.167 18.356 -2.323 1.00 0.00 C ATOM 1350 C GLU A 86 -3.166 17.280 -1.904 1.00 0.00 C ATOM 1351 O GLU A 86 -3.159 16.821 -0.761 1.00 0.00 O ATOM 1352 CB GLU A 86 -1.282 18.743 -1.136 1.00 0.00 C ATOM 1353 CG GLU A 86 0.124 19.156 -1.535 1.00 0.00 C ATOM 1354 CD GLU A 86 1.103 19.085 -0.378 1.00 0.00 C ATOM 1355 OE1 GLU A 86 0.861 19.757 0.646 1.00 0.00 O ATOM 1356 OE2 GLU A 86 2.110 18.356 -0.497 1.00 0.00 O ATOM 0 H GLU A 86 -3.603 19.880 -2.238 1.00 0.00 H new ATOM 0 HA GLU A 86 -1.538 17.953 -3.116 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.753 19.564 -0.595 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -1.223 17.900 -0.448 1.00 0.00 H new ATOM 0 HG2 GLU A 86 0.473 18.511 -2.342 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.103 20.173 -1.926 1.00 0.00 H new ATOM 1363 N GLU A 87 -4.025 16.885 -2.838 1.00 0.00 N ATOM 1364 CA GLU A 87 -5.033 15.865 -2.568 1.00 0.00 C ATOM 1365 C GLU A 87 -4.383 14.553 -2.142 1.00 0.00 C ATOM 1366 O GLU A 87 -4.706 14.004 -1.089 1.00 0.00 O ATOM 1367 CB GLU A 87 -5.904 15.640 -3.805 1.00 0.00 C ATOM 1368 CG GLU A 87 -7.119 16.551 -3.866 1.00 0.00 C ATOM 1369 CD GLU A 87 -7.875 16.424 -5.174 1.00 0.00 C ATOM 1370 OE1 GLU A 87 -7.274 16.688 -6.237 1.00 0.00 O ATOM 1371 OE2 GLU A 87 -9.071 16.061 -5.136 1.00 0.00 O ATOM 0 H GLU A 87 -4.044 17.255 -3.788 1.00 0.00 H new ATOM 0 HA GLU A 87 -5.660 16.218 -1.750 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -5.299 15.795 -4.698 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -6.237 14.602 -3.821 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -7.788 16.314 -3.039 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -6.801 17.585 -3.733 1.00 0.00 H new ATOM 1378 N GLU A 88 -3.466 14.055 -2.969 1.00 0.00 N ATOM 1379 CA GLU A 88 -2.773 12.805 -2.678 1.00 0.00 C ATOM 1380 C GLU A 88 -3.765 11.677 -2.398 1.00 0.00 C ATOM 1381 O GLU A 88 -3.449 10.722 -1.689 1.00 0.00 O ATOM 1382 CB GLU A 88 -1.835 12.986 -1.482 1.00 0.00 C ATOM 1383 CG GLU A 88 -0.375 13.150 -1.873 1.00 0.00 C ATOM 1384 CD GLU A 88 0.566 12.955 -0.701 1.00 0.00 C ATOM 1385 OE1 GLU A 88 0.892 11.792 -0.388 1.00 0.00 O ATOM 1386 OE2 GLU A 88 0.977 13.969 -0.096 1.00 0.00 O ATOM 0 H GLU A 88 -3.187 14.498 -3.844 1.00 0.00 H new ATOM 0 HA GLU A 88 -2.186 12.533 -3.555 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -2.150 13.860 -0.913 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -1.931 12.124 -0.822 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -0.129 12.432 -2.655 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -0.225 14.144 -2.294 1.00 0.00 H new ATOM 1393 N ASN A 89 -4.963 11.795 -2.962 1.00 0.00 N ATOM 1394 CA ASN A 89 -5.999 10.785 -2.773 1.00 0.00 C ATOM 1395 C ASN A 89 -5.592 9.465 -3.416 1.00 0.00 C ATOM 1396 O ASN A 89 -5.527 9.351 -4.640 1.00 0.00 O ATOM 1397 CB ASN A 89 -7.325 11.268 -3.363 1.00 0.00 C ATOM 1398 CG ASN A 89 -8.142 12.070 -2.369 1.00 0.00 C ATOM 1399 OD1 ASN A 89 -7.505 13.044 -1.729 1.00 0.00 O flip ATOM 1400 ND2 ASN A 89 -9.331 11.816 -2.176 1.00 0.00 N flip ATOM 0 H ASN A 89 -5.240 12.579 -3.553 1.00 0.00 H new ATOM 0 HA ASN A 89 -6.125 10.623 -1.702 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -7.127 11.879 -4.243 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.906 10.408 -3.697 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -9.781 11.058 -2.690 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -9.867 12.363 -1.502 1.00 0.00 H new ATOM 1407 N PHE A 90 -5.317 8.468 -2.581 1.00 0.00 N ATOM 1408 CA PHE A 90 -4.913 7.153 -3.069 1.00 0.00 C ATOM 1409 C PHE A 90 -6.128 6.286 -3.388 1.00 0.00 C ATOM 1410 O PHE A 90 -7.161 6.379 -2.726 1.00 0.00 O ATOM 1411 CB PHE A 90 -4.028 6.454 -2.036 1.00 0.00 C ATOM 1412 CG PHE A 90 -2.963 7.344 -1.461 1.00 0.00 C ATOM 1413 CD1 PHE A 90 -2.213 8.171 -2.282 1.00 0.00 C ATOM 1414 CD2 PHE A 90 -2.715 7.353 -0.100 1.00 0.00 C ATOM 1415 CE1 PHE A 90 -1.233 8.991 -1.753 1.00 0.00 C ATOM 1416 CE2 PHE A 90 -1.737 8.169 0.433 1.00 0.00 C ATOM 1417 CZ PHE A 90 -0.996 8.988 -0.392 1.00 0.00 C ATOM 0 H PHE A 90 -5.366 8.545 -1.565 1.00 0.00 H new ATOM 0 HA PHE A 90 -4.346 7.296 -3.989 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -4.654 6.080 -1.226 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.556 5.588 -2.500 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.396 8.175 -3.346 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.293 6.715 0.553 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.655 9.632 -2.402 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -1.552 8.166 1.497 1.00 0.00 H new ATOM 0 HZ PHE A 90 -0.231 9.626 0.025 1.00 0.00 H new ATOM 1427 N GLU A 91 -5.995 5.447 -4.413 1.00 0.00 N ATOM 1428 CA GLU A 91 -7.081 4.565 -4.830 1.00 0.00 C ATOM 1429 C GLU A 91 -6.544 3.186 -5.207 1.00 0.00 C ATOM 1430 O GLU A 91 -5.568 3.071 -5.946 1.00 0.00 O ATOM 1431 CB GLU A 91 -7.834 5.177 -6.015 1.00 0.00 C ATOM 1432 CG GLU A 91 -7.940 6.693 -5.962 1.00 0.00 C ATOM 1433 CD GLU A 91 -6.806 7.382 -6.695 1.00 0.00 C ATOM 1434 OE1 GLU A 91 -5.668 6.869 -6.643 1.00 0.00 O ATOM 1435 OE2 GLU A 91 -7.055 8.434 -7.320 1.00 0.00 O ATOM 0 H GLU A 91 -5.145 5.360 -4.970 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.769 4.450 -3.993 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -7.332 4.890 -6.939 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -8.838 4.754 -6.053 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -8.890 7.003 -6.397 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.945 7.017 -4.921 1.00 0.00 H new ATOM 1442 N PHE A 92 -7.193 2.141 -4.697 1.00 0.00 N ATOM 1443 CA PHE A 92 -6.781 0.770 -4.984 1.00 0.00 C ATOM 1444 C PHE A 92 -7.934 -0.025 -5.594 1.00 0.00 C ATOM 1445 O PHE A 92 -9.097 0.355 -5.463 1.00 0.00 O ATOM 1446 CB PHE A 92 -6.269 0.083 -3.712 1.00 0.00 C ATOM 1447 CG PHE A 92 -7.318 -0.100 -2.651 1.00 0.00 C ATOM 1448 CD1 PHE A 92 -7.853 0.993 -1.987 1.00 0.00 C ATOM 1449 CD2 PHE A 92 -7.769 -1.367 -2.318 1.00 0.00 C ATOM 1450 CE1 PHE A 92 -8.819 0.824 -1.010 1.00 0.00 C ATOM 1451 CE2 PHE A 92 -8.733 -1.541 -1.343 1.00 0.00 C ATOM 1452 CZ PHE A 92 -9.259 -0.444 -0.688 1.00 0.00 C ATOM 0 H PHE A 92 -8.005 2.218 -4.084 1.00 0.00 H new ATOM 0 HA PHE A 92 -5.968 0.804 -5.709 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.861 -0.892 -3.977 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -5.448 0.670 -3.300 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -7.512 1.987 -2.235 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -7.362 -2.229 -2.826 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -9.228 1.684 -0.500 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -9.075 -2.534 -1.093 1.00 0.00 H new ATOM 0 HZ PHE A 92 -10.012 -0.578 0.074 1.00 0.00 H new ATOM 1462 N LEU A 93 -7.605 -1.121 -6.273 1.00 0.00 N ATOM 1463 CA LEU A 93 -8.620 -1.954 -6.916 1.00 0.00 C ATOM 1464 C LEU A 93 -8.604 -3.384 -6.380 1.00 0.00 C ATOM 1465 O LEU A 93 -7.557 -3.905 -5.992 1.00 0.00 O ATOM 1466 CB LEU A 93 -8.404 -1.971 -8.430 1.00 0.00 C ATOM 1467 CG LEU A 93 -8.812 -0.686 -9.159 1.00 0.00 C ATOM 1468 CD1 LEU A 93 -7.604 -0.037 -9.818 1.00 0.00 C ATOM 1469 CD2 LEU A 93 -9.891 -0.977 -10.192 1.00 0.00 C ATOM 0 H LEU A 93 -6.648 -1.453 -6.393 1.00 0.00 H new ATOM 0 HA LEU A 93 -9.593 -1.520 -6.687 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -7.350 -2.164 -8.629 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.966 -2.804 -8.852 1.00 0.00 H new ATOM 0 HG LEU A 93 -9.217 0.010 -8.425 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -7.914 0.874 -10.330 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -6.863 0.209 -9.057 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -7.168 -0.728 -10.539 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -10.168 -0.053 -10.699 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -9.512 -1.692 -10.922 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -10.767 -1.395 -9.696 1.00 0.00 H new ATOM 1481 N ILE A 94 -9.778 -4.012 -6.376 1.00 0.00 N ATOM 1482 CA ILE A 94 -9.929 -5.385 -5.904 1.00 0.00 C ATOM 1483 C ILE A 94 -10.472 -6.271 -7.023 1.00 0.00 C ATOM 1484 O ILE A 94 -11.633 -6.157 -7.398 1.00 0.00 O ATOM 1485 CB ILE A 94 -10.894 -5.454 -4.702 1.00 0.00 C ATOM 1486 CG1 ILE A 94 -10.612 -4.316 -3.718 1.00 0.00 C ATOM 1487 CG2 ILE A 94 -10.795 -6.800 -4.003 1.00 0.00 C ATOM 1488 CD1 ILE A 94 -9.224 -4.369 -3.117 1.00 0.00 C ATOM 0 H ILE A 94 -10.647 -3.585 -6.698 1.00 0.00 H new ATOM 0 HA ILE A 94 -8.946 -5.739 -5.594 1.00 0.00 H new ATOM 0 HB ILE A 94 -11.911 -5.341 -5.078 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -10.742 -3.363 -4.230 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -11.349 -4.349 -2.915 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -11.485 -6.823 -3.159 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -11.052 -7.594 -4.704 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -9.777 -6.949 -3.643 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -9.093 -3.533 -2.430 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -9.097 -5.307 -2.576 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -8.481 -4.305 -3.912 1.00 0.00 H new ATOM 1500 N VAL A 95 -9.632 -7.148 -7.562 1.00 0.00 N ATOM 1501 CA VAL A 95 -10.059 -8.027 -8.648 1.00 0.00 C ATOM 1502 C VAL A 95 -10.317 -9.447 -8.162 1.00 0.00 C ATOM 1503 O VAL A 95 -9.527 -10.011 -7.406 1.00 0.00 O ATOM 1504 CB VAL A 95 -9.019 -8.069 -9.785 1.00 0.00 C ATOM 1505 CG1 VAL A 95 -9.502 -8.958 -10.925 1.00 0.00 C ATOM 1506 CG2 VAL A 95 -8.723 -6.665 -10.289 1.00 0.00 C ATOM 0 H VAL A 95 -8.662 -7.270 -7.270 1.00 0.00 H new ATOM 0 HA VAL A 95 -10.991 -7.609 -9.028 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.097 -8.494 -9.389 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -8.753 -8.973 -11.717 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -9.660 -9.971 -10.555 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -10.439 -8.566 -11.320 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.987 -6.714 -11.091 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -9.640 -6.213 -10.665 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -8.329 -6.061 -9.472 1.00 0.00 H new ATOM 1516 N SER A 96 -11.426 -10.022 -8.620 1.00 0.00 N ATOM 1517 CA SER A 96 -11.796 -11.382 -8.256 1.00 0.00 C ATOM 1518 C SER A 96 -11.402 -12.351 -9.365 1.00 0.00 C ATOM 1519 O SER A 96 -10.754 -11.961 -10.337 1.00 0.00 O ATOM 1520 CB SER A 96 -13.302 -11.477 -7.995 1.00 0.00 C ATOM 1521 OG SER A 96 -13.679 -12.796 -7.645 1.00 0.00 O ATOM 0 H SER A 96 -12.086 -9.562 -9.247 1.00 0.00 H new ATOM 0 HA SER A 96 -11.264 -11.650 -7.343 1.00 0.00 H new ATOM 0 HB2 SER A 96 -13.579 -10.792 -7.193 1.00 0.00 H new ATOM 0 HB3 SER A 96 -13.848 -11.164 -8.885 1.00 0.00 H new ATOM 0 HG SER A 96 -13.133 -13.103 -6.891 1.00 0.00 H new ATOM 1527 N SER A 97 -11.792 -13.610 -9.219 1.00 0.00 N ATOM 1528 CA SER A 97 -11.471 -14.621 -10.220 1.00 0.00 C ATOM 1529 C SER A 97 -12.531 -14.680 -11.315 1.00 0.00 C ATOM 1530 O SER A 97 -12.420 -15.472 -12.251 1.00 0.00 O ATOM 1531 CB SER A 97 -11.320 -15.994 -9.563 1.00 0.00 C ATOM 1532 OG SER A 97 -12.447 -16.302 -8.759 1.00 0.00 O ATOM 0 H SER A 97 -12.328 -13.955 -8.423 1.00 0.00 H new ATOM 0 HA SER A 97 -10.525 -14.339 -10.681 1.00 0.00 H new ATOM 0 HB2 SER A 97 -11.198 -16.757 -10.332 1.00 0.00 H new ATOM 0 HB3 SER A 97 -10.418 -16.011 -8.952 1.00 0.00 H new ATOM 0 HG SER A 97 -12.327 -17.185 -8.352 1.00 0.00 H new ATOM 1538 N THR A 98 -13.554 -13.838 -11.207 1.00 0.00 N ATOM 1539 CA THR A 98 -14.615 -13.805 -12.206 1.00 0.00 C ATOM 1540 C THR A 98 -14.618 -12.478 -12.951 1.00 0.00 C ATOM 1541 O THR A 98 -15.631 -12.075 -13.525 1.00 0.00 O ATOM 1542 CB THR A 98 -15.976 -14.050 -11.555 1.00 0.00 C ATOM 1543 OG1 THR A 98 -17.021 -13.885 -12.499 1.00 0.00 O ATOM 1544 CG2 THR A 98 -16.260 -13.124 -10.391 1.00 0.00 C ATOM 0 H THR A 98 -13.670 -13.173 -10.442 1.00 0.00 H new ATOM 0 HA THR A 98 -14.425 -14.602 -12.925 1.00 0.00 H new ATOM 0 HB THR A 98 -15.937 -15.074 -11.183 1.00 0.00 H new ATOM 0 HG1 THR A 98 -16.923 -13.019 -12.948 1.00 0.00 H new ATOM 0 HG21 THR A 98 -17.242 -13.352 -9.976 1.00 0.00 H new ATOM 0 HG22 THR A 98 -15.500 -13.262 -9.622 1.00 0.00 H new ATOM 0 HG23 THR A 98 -16.243 -12.090 -10.736 1.00 0.00 H new ATOM 1552 N GLY A 99 -13.473 -11.805 -12.945 1.00 0.00 N ATOM 1553 CA GLY A 99 -13.356 -10.530 -13.631 1.00 0.00 C ATOM 1554 C GLY A 99 -13.849 -9.355 -12.804 1.00 0.00 C ATOM 1555 O GLY A 99 -13.474 -8.211 -13.065 1.00 0.00 O ATOM 0 H GLY A 99 -12.623 -12.119 -12.477 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.313 -10.364 -13.899 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -13.922 -10.573 -14.562 1.00 0.00 H new ATOM 1559 N GLN A 100 -14.689 -9.625 -11.809 1.00 0.00 N ATOM 1560 CA GLN A 100 -15.226 -8.570 -10.954 1.00 0.00 C ATOM 1561 C GLN A 100 -14.102 -7.724 -10.364 1.00 0.00 C ATOM 1562 O GLN A 100 -13.146 -8.255 -9.798 1.00 0.00 O ATOM 1563 CB GLN A 100 -16.073 -9.174 -9.830 1.00 0.00 C ATOM 1564 CG GLN A 100 -17.425 -8.502 -9.661 1.00 0.00 C ATOM 1565 CD GLN A 100 -18.547 -9.282 -10.319 1.00 0.00 C ATOM 1566 OE1 GLN A 100 -18.741 -9.211 -11.532 1.00 0.00 O ATOM 1567 NE2 GLN A 100 -19.295 -10.031 -9.518 1.00 0.00 N ATOM 0 H GLN A 100 -15.012 -10.564 -11.575 1.00 0.00 H new ATOM 0 HA GLN A 100 -15.857 -7.926 -11.567 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.226 -10.234 -10.031 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.522 -9.104 -8.892 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.640 -8.388 -8.599 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.385 -7.500 -10.087 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.099 -10.061 -8.517 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.066 -10.577 -9.903 1.00 0.00 H new ATOM 1576 N THR A 101 -14.217 -6.406 -10.504 1.00 0.00 N ATOM 1577 CA THR A 101 -13.200 -5.500 -9.987 1.00 0.00 C ATOM 1578 C THR A 101 -13.819 -4.357 -9.187 1.00 0.00 C ATOM 1579 O THR A 101 -14.527 -3.512 -9.736 1.00 0.00 O ATOM 1580 CB THR A 101 -12.365 -4.935 -11.136 1.00 0.00 C ATOM 1581 OG1 THR A 101 -12.148 -5.919 -12.130 1.00 0.00 O ATOM 1582 CG2 THR A 101 -11.011 -4.420 -10.694 1.00 0.00 C ATOM 0 H THR A 101 -15.000 -5.945 -10.968 1.00 0.00 H new ATOM 0 HA THR A 101 -12.558 -6.072 -9.317 1.00 0.00 H new ATOM 0 HB THR A 101 -12.943 -4.099 -11.530 1.00 0.00 H new ATOM 0 HG1 THR A 101 -11.613 -5.537 -12.857 1.00 0.00 H new ATOM 0 HG21 THR A 101 -10.469 -4.033 -11.557 1.00 0.00 H new ATOM 0 HG22 THR A 101 -11.146 -3.623 -9.963 1.00 0.00 H new ATOM 0 HG23 THR A 101 -10.442 -5.233 -10.243 1.00 0.00 H new ATOM 1590 N TRP A 102 -13.528 -4.328 -7.891 1.00 0.00 N ATOM 1591 CA TRP A 102 -14.031 -3.284 -7.010 1.00 0.00 C ATOM 1592 C TRP A 102 -13.000 -2.176 -6.866 1.00 0.00 C ATOM 1593 O TRP A 102 -12.002 -2.345 -6.165 1.00 0.00 O ATOM 1594 CB TRP A 102 -14.326 -3.838 -5.621 1.00 0.00 C ATOM 1595 CG TRP A 102 -15.382 -4.893 -5.572 1.00 0.00 C ATOM 1596 CD1 TRP A 102 -16.008 -5.499 -6.623 1.00 0.00 C ATOM 1597 CD2 TRP A 102 -15.928 -5.473 -4.389 1.00 0.00 C ATOM 1598 NE1 TRP A 102 -16.914 -6.425 -6.156 1.00 0.00 N ATOM 1599 CE2 TRP A 102 -16.885 -6.422 -4.785 1.00 0.00 C ATOM 1600 CE3 TRP A 102 -15.696 -5.275 -3.027 1.00 0.00 C ATOM 1601 CZ2 TRP A 102 -17.610 -7.171 -3.861 1.00 0.00 C ATOM 1602 CZ3 TRP A 102 -16.418 -6.022 -2.118 1.00 0.00 C ATOM 1603 CH2 TRP A 102 -17.360 -6.952 -2.537 1.00 0.00 C ATOM 0 H TRP A 102 -12.942 -5.022 -7.426 1.00 0.00 H new ATOM 0 HA TRP A 102 -14.948 -2.895 -7.453 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -13.405 -4.248 -5.207 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -14.627 -3.014 -4.974 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -15.821 -5.284 -7.665 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -17.510 -7.017 -6.735 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -14.967 -4.552 -2.691 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -18.342 -7.898 -4.180 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -16.247 -5.880 -1.061 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -17.908 -7.516 -1.797 1.00 0.00 H new ATOM 1614 N HIS A 103 -13.234 -1.041 -7.508 1.00 0.00 N ATOM 1615 CA HIS A 103 -12.300 0.066 -7.402 1.00 0.00 C ATOM 1616 C HIS A 103 -12.738 1.028 -6.305 1.00 0.00 C ATOM 1617 O HIS A 103 -13.797 1.647 -6.395 1.00 0.00 O ATOM 1618 CB HIS A 103 -12.172 0.810 -8.733 1.00 0.00 C ATOM 1619 CG HIS A 103 -11.019 1.760 -8.744 1.00 0.00 C ATOM 1620 ND1 HIS A 103 -10.222 1.966 -7.640 1.00 0.00 N ATOM 1621 CD2 HIS A 103 -10.528 2.568 -9.716 1.00 0.00 C ATOM 1622 CE1 HIS A 103 -9.299 2.856 -7.922 1.00 0.00 C ATOM 1623 NE2 HIS A 103 -9.456 3.238 -9.177 1.00 0.00 N ATOM 0 H HIS A 103 -14.048 -0.865 -8.097 1.00 0.00 H new ATOM 0 HA HIS A 103 -11.323 -0.344 -7.145 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -12.052 0.087 -9.540 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -13.093 1.358 -8.930 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -10.907 2.666 -10.722 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -8.540 3.215 -7.243 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -8.876 3.919 -9.666 1.00 0.00 H new ATOM 1632 N PHE A 104 -11.919 1.151 -5.267 1.00 0.00 N ATOM 1633 CA PHE A 104 -12.232 2.037 -4.157 1.00 0.00 C ATOM 1634 C PHE A 104 -11.142 3.081 -3.956 1.00 0.00 C ATOM 1635 O PHE A 104 -10.035 2.957 -4.481 1.00 0.00 O ATOM 1636 CB PHE A 104 -12.403 1.241 -2.860 1.00 0.00 C ATOM 1637 CG PHE A 104 -13.433 0.147 -2.926 1.00 0.00 C ATOM 1638 CD1 PHE A 104 -14.663 0.365 -3.523 1.00 0.00 C ATOM 1639 CD2 PHE A 104 -13.171 -1.097 -2.373 1.00 0.00 C ATOM 1640 CE1 PHE A 104 -15.614 -0.639 -3.570 1.00 0.00 C ATOM 1641 CE2 PHE A 104 -14.116 -2.103 -2.416 1.00 0.00 C ATOM 1642 CZ PHE A 104 -15.340 -1.874 -3.014 1.00 0.00 C ATOM 0 H PHE A 104 -11.036 0.649 -5.173 1.00 0.00 H new ATOM 0 HA PHE A 104 -13.166 2.542 -4.403 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -11.443 0.802 -2.590 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -12.675 1.930 -2.060 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -14.883 1.329 -3.957 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.216 -1.282 -1.903 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -16.569 -0.458 -4.041 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -13.898 -3.068 -1.982 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.081 -2.659 -3.047 1.00 0.00 H new ATOM 1652 N GLU A 105 -11.466 4.100 -3.169 1.00 0.00 N ATOM 1653 CA GLU A 105 -10.526 5.166 -2.858 1.00 0.00 C ATOM 1654 C GLU A 105 -10.422 5.336 -1.348 1.00 0.00 C ATOM 1655 O GLU A 105 -11.348 5.833 -0.702 1.00 0.00 O ATOM 1656 CB GLU A 105 -10.965 6.478 -3.512 1.00 0.00 C ATOM 1657 CG GLU A 105 -10.082 7.664 -3.155 1.00 0.00 C ATOM 1658 CD GLU A 105 -10.416 8.904 -3.961 1.00 0.00 C ATOM 1659 OE1 GLU A 105 -10.551 8.789 -5.197 1.00 0.00 O ATOM 1660 OE2 GLU A 105 -10.544 9.989 -3.356 1.00 0.00 O ATOM 0 H GLU A 105 -12.381 4.209 -2.732 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.547 4.898 -3.255 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.968 6.351 -4.595 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -11.990 6.697 -3.214 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.190 7.886 -2.093 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.038 7.398 -3.321 1.00 0.00 H new ATOM 1667 N ALA A 106 -9.297 4.901 -0.790 1.00 0.00 N ATOM 1668 CA ALA A 106 -9.065 4.981 0.646 1.00 0.00 C ATOM 1669 C ALA A 106 -9.291 6.391 1.181 1.00 0.00 C ATOM 1670 O ALA A 106 -8.639 7.342 0.749 1.00 0.00 O ATOM 1671 CB ALA A 106 -7.653 4.516 0.971 1.00 0.00 C ATOM 0 H ALA A 106 -8.527 4.487 -1.316 1.00 0.00 H new ATOM 0 HA ALA A 106 -9.786 4.326 1.135 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -7.488 4.579 2.047 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -7.525 3.484 0.644 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -6.933 5.151 0.455 1.00 0.00 H new ATOM 1677 N ALA A 107 -10.212 6.516 2.133 1.00 0.00 N ATOM 1678 CA ALA A 107 -10.513 7.806 2.737 1.00 0.00 C ATOM 1679 C ALA A 107 -9.299 8.336 3.492 1.00 0.00 C ATOM 1680 O ALA A 107 -9.090 9.545 3.586 1.00 0.00 O ATOM 1681 CB ALA A 107 -11.712 7.689 3.667 1.00 0.00 C ATOM 0 H ALA A 107 -10.761 5.739 2.501 1.00 0.00 H new ATOM 0 HA ALA A 107 -10.760 8.512 1.944 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.924 8.662 4.111 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -12.580 7.351 3.101 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -11.491 6.970 4.456 1.00 0.00 H new ATOM 1687 N SER A 108 -8.497 7.414 4.018 1.00 0.00 N ATOM 1688 CA SER A 108 -7.295 7.771 4.757 1.00 0.00 C ATOM 1689 C SER A 108 -6.059 7.210 4.062 1.00 0.00 C ATOM 1690 O SER A 108 -6.114 6.151 3.437 1.00 0.00 O ATOM 1691 CB SER A 108 -7.376 7.249 6.192 1.00 0.00 C ATOM 1692 OG SER A 108 -7.873 8.243 7.071 1.00 0.00 O ATOM 0 H SER A 108 -8.661 6.410 3.944 1.00 0.00 H new ATOM 0 HA SER A 108 -7.217 8.858 4.786 1.00 0.00 H new ATOM 0 HB2 SER A 108 -8.023 6.372 6.227 1.00 0.00 H new ATOM 0 HB3 SER A 108 -6.388 6.929 6.522 1.00 0.00 H new ATOM 0 HG SER A 108 -7.916 7.883 7.981 1.00 0.00 H new ATOM 1698 N PHE A 109 -4.946 7.927 4.169 1.00 0.00 N ATOM 1699 CA PHE A 109 -3.700 7.497 3.543 1.00 0.00 C ATOM 1700 C PHE A 109 -3.178 6.212 4.175 1.00 0.00 C ATOM 1701 O PHE A 109 -2.658 5.338 3.481 1.00 0.00 O ATOM 1702 CB PHE A 109 -2.650 8.608 3.639 1.00 0.00 C ATOM 1703 CG PHE A 109 -2.932 9.795 2.749 1.00 0.00 C ATOM 1704 CD1 PHE A 109 -3.915 9.741 1.768 1.00 0.00 C ATOM 1705 CD2 PHE A 109 -2.208 10.969 2.896 1.00 0.00 C ATOM 1706 CE1 PHE A 109 -4.167 10.828 0.956 1.00 0.00 C ATOM 1707 CE2 PHE A 109 -2.458 12.061 2.087 1.00 0.00 C ATOM 1708 CZ PHE A 109 -3.440 11.989 1.116 1.00 0.00 C ATOM 0 H PHE A 109 -4.880 8.806 4.682 1.00 0.00 H new ATOM 0 HA PHE A 109 -3.902 7.292 2.492 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -2.588 8.948 4.673 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -1.675 8.196 3.380 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -4.490 8.836 1.639 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -1.439 11.030 3.652 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -4.932 10.770 0.196 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -1.887 12.969 2.213 1.00 0.00 H new ATOM 0 HZ PHE A 109 -3.638 12.842 0.483 1.00 0.00 H new ATOM 1718 N GLU A 110 -3.321 6.096 5.489 1.00 0.00 N ATOM 1719 CA GLU A 110 -2.867 4.907 6.201 1.00 0.00 C ATOM 1720 C GLU A 110 -3.802 3.730 5.933 1.00 0.00 C ATOM 1721 O GLU A 110 -3.364 2.584 5.812 1.00 0.00 O ATOM 1722 CB GLU A 110 -2.788 5.186 7.704 1.00 0.00 C ATOM 1723 CG GLU A 110 -1.412 4.935 8.300 1.00 0.00 C ATOM 1724 CD GLU A 110 -0.783 6.191 8.870 1.00 0.00 C ATOM 1725 OE1 GLU A 110 -1.095 6.537 10.030 1.00 0.00 O ATOM 1726 OE2 GLU A 110 0.019 6.830 8.158 1.00 0.00 O ATOM 0 H GLU A 110 -3.746 6.808 6.083 1.00 0.00 H new ATOM 0 HA GLU A 110 -1.872 4.648 5.838 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.070 6.223 7.888 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.517 4.561 8.220 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.493 4.185 9.087 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -0.758 4.522 7.532 1.00 0.00 H new ATOM 1733 N GLU A 111 -5.093 4.026 5.847 1.00 0.00 N ATOM 1734 CA GLU A 111 -6.100 3.003 5.597 1.00 0.00 C ATOM 1735 C GLU A 111 -5.893 2.335 4.242 1.00 0.00 C ATOM 1736 O GLU A 111 -6.131 1.140 4.088 1.00 0.00 O ATOM 1737 CB GLU A 111 -7.503 3.613 5.668 1.00 0.00 C ATOM 1738 CG GLU A 111 -8.554 2.659 6.212 1.00 0.00 C ATOM 1739 CD GLU A 111 -9.013 3.030 7.608 1.00 0.00 C ATOM 1740 OE1 GLU A 111 -8.190 3.559 8.384 1.00 0.00 O ATOM 1741 OE2 GLU A 111 -10.197 2.793 7.926 1.00 0.00 O ATOM 0 H GLU A 111 -5.468 4.969 5.947 1.00 0.00 H new ATOM 0 HA GLU A 111 -5.997 2.241 6.369 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -7.472 4.503 6.297 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -7.800 3.937 4.671 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -9.413 2.651 5.541 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -8.149 1.647 6.224 1.00 0.00 H new ATOM 1748 N ARG A 112 -5.452 3.113 3.256 1.00 0.00 N ATOM 1749 CA ARG A 112 -5.224 2.579 1.917 1.00 0.00 C ATOM 1750 C ARG A 112 -4.246 1.409 1.956 1.00 0.00 C ATOM 1751 O ARG A 112 -4.437 0.405 1.270 1.00 0.00 O ATOM 1752 CB ARG A 112 -4.712 3.680 0.975 1.00 0.00 C ATOM 1753 CG ARG A 112 -3.200 3.871 0.991 1.00 0.00 C ATOM 1754 CD ARG A 112 -2.501 2.905 0.045 1.00 0.00 C ATOM 1755 NE ARG A 112 -1.716 3.606 -0.970 1.00 0.00 N ATOM 1756 CZ ARG A 112 -0.732 3.043 -1.668 1.00 0.00 C ATOM 1757 NH1 ARG A 112 -0.408 1.772 -1.465 1.00 0.00 N ATOM 1758 NH2 ARG A 112 -0.069 3.753 -2.570 1.00 0.00 N ATOM 0 H ARG A 112 -5.247 4.107 3.358 1.00 0.00 H new ATOM 0 HA ARG A 112 -6.176 2.212 1.533 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -5.025 3.445 -0.042 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -5.188 4.623 1.246 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -2.960 4.896 0.708 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -2.825 3.724 2.004 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -1.848 2.246 0.617 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -3.244 2.274 -0.443 1.00 0.00 H new ATOM 0 HE ARG A 112 -1.935 4.585 -1.154 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -0.914 1.221 -0.771 1.00 0.00 H new ATOM 0 HH12 ARG A 112 0.347 1.346 -2.003 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -0.313 4.731 -2.729 1.00 0.00 H new ATOM 0 HH22 ARG A 112 0.685 3.322 -3.105 1.00 0.00 H new ATOM 1772 N ASP A 113 -3.201 1.540 2.767 1.00 0.00 N ATOM 1773 CA ASP A 113 -2.205 0.487 2.894 1.00 0.00 C ATOM 1774 C ASP A 113 -2.752 -0.672 3.716 1.00 0.00 C ATOM 1775 O ASP A 113 -2.455 -1.835 3.444 1.00 0.00 O ATOM 1776 CB ASP A 113 -0.926 1.032 3.533 1.00 0.00 C ATOM 1777 CG ASP A 113 0.238 0.068 3.407 1.00 0.00 C ATOM 1778 OD1 ASP A 113 0.344 -0.603 2.360 1.00 0.00 O ATOM 1779 OD2 ASP A 113 1.045 -0.014 4.359 1.00 0.00 O ATOM 0 H ASP A 113 -3.024 2.363 3.343 1.00 0.00 H new ATOM 0 HA ASP A 113 -1.966 0.121 1.895 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -0.663 1.979 3.062 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -1.110 1.240 4.587 1.00 0.00 H new ATOM 1784 N ALA A 114 -3.563 -0.356 4.719 1.00 0.00 N ATOM 1785 CA ALA A 114 -4.151 -1.391 5.555 1.00 0.00 C ATOM 1786 C ALA A 114 -5.083 -2.261 4.726 1.00 0.00 C ATOM 1787 O ALA A 114 -5.023 -3.487 4.788 1.00 0.00 O ATOM 1788 CB ALA A 114 -4.890 -0.775 6.733 1.00 0.00 C ATOM 0 H ALA A 114 -3.825 0.597 4.970 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.352 -2.017 5.952 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.322 -1.566 7.345 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.193 -0.190 7.334 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.685 -0.126 6.365 1.00 0.00 H new ATOM 1794 N TRP A 115 -5.932 -1.613 3.937 1.00 0.00 N ATOM 1795 CA TRP A 115 -6.864 -2.317 3.072 1.00 0.00 C ATOM 1796 C TRP A 115 -6.118 -3.189 2.073 1.00 0.00 C ATOM 1797 O TRP A 115 -6.381 -4.386 1.968 1.00 0.00 O ATOM 1798 CB TRP A 115 -7.745 -1.315 2.342 1.00 0.00 C ATOM 1799 CG TRP A 115 -8.917 -0.893 3.162 1.00 0.00 C ATOM 1800 CD1 TRP A 115 -9.028 0.234 3.916 1.00 0.00 C ATOM 1801 CD2 TRP A 115 -10.132 -1.613 3.334 1.00 0.00 C ATOM 1802 NE1 TRP A 115 -10.251 0.272 4.528 1.00 0.00 N ATOM 1803 CE2 TRP A 115 -10.950 -0.853 4.185 1.00 0.00 C ATOM 1804 CE3 TRP A 115 -10.614 -2.823 2.841 1.00 0.00 C ATOM 1805 CZ2 TRP A 115 -12.221 -1.269 4.554 1.00 0.00 C ATOM 1806 CZ3 TRP A 115 -11.878 -3.229 3.217 1.00 0.00 C ATOM 1807 CH2 TRP A 115 -12.663 -2.460 4.057 1.00 0.00 C ATOM 0 H TRP A 115 -5.992 -0.596 3.880 1.00 0.00 H new ATOM 0 HA TRP A 115 -7.491 -2.964 3.686 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -7.154 -0.438 2.078 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -8.096 -1.755 1.409 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -8.262 0.989 4.017 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -10.586 1.016 5.139 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -10.013 -3.429 2.180 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -12.837 -0.672 5.210 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -12.263 -4.168 2.847 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -13.649 -2.811 4.326 1.00 0.00 H new ATOM 1818 N VAL A 116 -5.177 -2.591 1.343 1.00 0.00 N ATOM 1819 CA VAL A 116 -4.397 -3.339 0.368 1.00 0.00 C ATOM 1820 C VAL A 116 -3.754 -4.555 1.028 1.00 0.00 C ATOM 1821 O VAL A 116 -3.675 -5.633 0.435 1.00 0.00 O ATOM 1822 CB VAL A 116 -3.317 -2.458 -0.311 1.00 0.00 C ATOM 1823 CG1 VAL A 116 -2.064 -2.331 0.546 1.00 0.00 C ATOM 1824 CG2 VAL A 116 -2.973 -3.007 -1.686 1.00 0.00 C ATOM 0 H VAL A 116 -4.941 -1.601 1.409 1.00 0.00 H new ATOM 0 HA VAL A 116 -5.081 -3.674 -0.412 1.00 0.00 H new ATOM 0 HB VAL A 116 -3.734 -1.457 -0.424 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -1.334 -1.706 0.032 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -2.322 -1.877 1.503 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -1.638 -3.320 0.717 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -2.214 -2.377 -2.150 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -2.591 -4.023 -1.587 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -3.867 -3.015 -2.309 1.00 0.00 H new ATOM 1834 N GLN A 117 -3.315 -4.374 2.272 1.00 0.00 N ATOM 1835 CA GLN A 117 -2.699 -5.457 3.021 1.00 0.00 C ATOM 1836 C GLN A 117 -3.765 -6.414 3.538 1.00 0.00 C ATOM 1837 O GLN A 117 -3.530 -7.615 3.656 1.00 0.00 O ATOM 1838 CB GLN A 117 -1.874 -4.901 4.185 1.00 0.00 C ATOM 1839 CG GLN A 117 -0.373 -4.981 3.958 1.00 0.00 C ATOM 1840 CD GLN A 117 0.155 -6.400 4.048 1.00 0.00 C ATOM 1841 OE1 GLN A 117 -0.267 -7.177 4.903 1.00 0.00 O ATOM 1842 NE2 GLN A 117 1.082 -6.743 3.161 1.00 0.00 N ATOM 0 H GLN A 117 -3.376 -3.490 2.777 1.00 0.00 H new ATOM 0 HA GLN A 117 -2.032 -6.004 2.355 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -2.153 -3.861 4.353 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -2.126 -5.449 5.093 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -0.135 -4.570 2.977 1.00 0.00 H new ATOM 0 HG3 GLN A 117 0.136 -4.360 4.695 1.00 0.00 H new ATOM 0 HE21 GLN A 117 1.402 -6.065 2.470 1.00 0.00 H new ATOM 0 HE22 GLN A 117 1.474 -7.685 3.171 1.00 0.00 H new ATOM 1851 N ALA A 118 -4.941 -5.871 3.840 1.00 0.00 N ATOM 1852 CA ALA A 118 -6.046 -6.675 4.337 1.00 0.00 C ATOM 1853 C ALA A 118 -6.530 -7.645 3.272 1.00 0.00 C ATOM 1854 O ALA A 118 -6.719 -8.833 3.534 1.00 0.00 O ATOM 1855 CB ALA A 118 -7.187 -5.777 4.789 1.00 0.00 C ATOM 0 H ALA A 118 -5.150 -4.877 3.748 1.00 0.00 H new ATOM 0 HA ALA A 118 -5.692 -7.253 5.190 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -8.008 -6.391 5.159 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -6.839 -5.119 5.585 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -7.533 -5.177 3.947 1.00 0.00 H new ATOM 1861 N ILE A 119 -6.722 -7.130 2.067 1.00 0.00 N ATOM 1862 CA ILE A 119 -7.177 -7.947 0.955 1.00 0.00 C ATOM 1863 C ILE A 119 -6.136 -9.007 0.606 1.00 0.00 C ATOM 1864 O ILE A 119 -6.465 -10.185 0.475 1.00 0.00 O ATOM 1865 CB ILE A 119 -7.499 -7.079 -0.286 1.00 0.00 C ATOM 1866 CG1 ILE A 119 -8.827 -6.343 -0.083 1.00 0.00 C ATOM 1867 CG2 ILE A 119 -7.553 -7.928 -1.550 1.00 0.00 C ATOM 1868 CD1 ILE A 119 -8.707 -5.073 0.730 1.00 0.00 C ATOM 0 H ILE A 119 -6.569 -6.149 1.835 1.00 0.00 H new ATOM 0 HA ILE A 119 -8.095 -8.447 1.264 1.00 0.00 H new ATOM 0 HB ILE A 119 -6.701 -6.346 -0.406 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -9.249 -6.100 -1.058 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -9.531 -7.013 0.411 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -7.781 -7.292 -2.406 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -6.589 -8.412 -1.704 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -8.328 -8.687 -1.445 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -9.689 -4.610 0.829 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -8.316 -5.310 1.719 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -8.030 -4.382 0.228 1.00 0.00 H new ATOM 1880 N GLU A 120 -4.877 -8.594 0.473 1.00 0.00 N ATOM 1881 CA GLU A 120 -3.813 -9.537 0.154 1.00 0.00 C ATOM 1882 C GLU A 120 -3.577 -10.485 1.325 1.00 0.00 C ATOM 1883 O GLU A 120 -3.233 -11.651 1.131 1.00 0.00 O ATOM 1884 CB GLU A 120 -2.520 -8.801 -0.203 1.00 0.00 C ATOM 1885 CG GLU A 120 -1.900 -8.057 0.965 1.00 0.00 C ATOM 1886 CD GLU A 120 -0.813 -7.092 0.529 1.00 0.00 C ATOM 1887 OE1 GLU A 120 0.354 -7.524 0.415 1.00 0.00 O ATOM 1888 OE2 GLU A 120 -1.130 -5.905 0.303 1.00 0.00 O ATOM 0 H GLU A 120 -4.574 -7.626 0.580 1.00 0.00 H new ATOM 0 HA GLU A 120 -4.123 -10.120 -0.713 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -1.798 -9.520 -0.589 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -2.725 -8.093 -1.006 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -2.678 -7.507 1.495 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -1.482 -8.776 1.669 1.00 0.00 H new ATOM 1895 N SER A 121 -3.773 -9.982 2.542 1.00 0.00 N ATOM 1896 CA SER A 121 -3.591 -10.798 3.737 1.00 0.00 C ATOM 1897 C SER A 121 -4.636 -11.906 3.782 1.00 0.00 C ATOM 1898 O SER A 121 -4.344 -13.037 4.168 1.00 0.00 O ATOM 1899 CB SER A 121 -3.687 -9.938 4.998 1.00 0.00 C ATOM 1900 OG SER A 121 -2.478 -9.235 5.228 1.00 0.00 O ATOM 0 H SER A 121 -4.056 -9.019 2.725 1.00 0.00 H new ATOM 0 HA SER A 121 -2.598 -11.247 3.698 1.00 0.00 H new ATOM 0 HB2 SER A 121 -4.510 -9.230 4.898 1.00 0.00 H new ATOM 0 HB3 SER A 121 -3.913 -10.570 5.857 1.00 0.00 H new ATOM 0 HG SER A 121 -2.333 -8.588 4.506 1.00 0.00 H new ATOM 1906 N GLN A 122 -5.855 -11.569 3.372 1.00 0.00 N ATOM 1907 CA GLN A 122 -6.946 -12.533 3.353 1.00 0.00 C ATOM 1908 C GLN A 122 -6.703 -13.586 2.279 1.00 0.00 C ATOM 1909 O GLN A 122 -7.051 -14.755 2.448 1.00 0.00 O ATOM 1910 CB GLN A 122 -8.277 -11.824 3.101 1.00 0.00 C ATOM 1911 CG GLN A 122 -9.053 -11.517 4.371 1.00 0.00 C ATOM 1912 CD GLN A 122 -8.264 -10.661 5.341 1.00 0.00 C ATOM 1913 OE1 GLN A 122 -8.374 -9.434 5.336 1.00 0.00 O ATOM 1914 NE2 GLN A 122 -7.459 -11.305 6.178 1.00 0.00 N ATOM 0 H GLN A 122 -6.110 -10.636 3.049 1.00 0.00 H new ATOM 0 HA GLN A 122 -6.989 -13.026 4.324 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -8.088 -10.893 2.567 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -8.892 -12.445 2.450 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -9.980 -11.006 4.112 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -9.330 -12.452 4.859 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -7.399 -12.323 6.147 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -6.900 -10.782 6.852 1.00 0.00 H new ATOM 1923 N ILE A 123 -6.097 -13.163 1.175 1.00 0.00 N ATOM 1924 CA ILE A 123 -5.802 -14.065 0.071 1.00 0.00 C ATOM 1925 C ILE A 123 -4.713 -15.061 0.455 1.00 0.00 C ATOM 1926 O ILE A 123 -4.756 -16.225 0.060 1.00 0.00 O ATOM 1927 CB ILE A 123 -5.368 -13.289 -1.189 1.00 0.00 C ATOM 1928 CG1 ILE A 123 -6.451 -12.288 -1.594 1.00 0.00 C ATOM 1929 CG2 ILE A 123 -5.081 -14.246 -2.334 1.00 0.00 C ATOM 1930 CD1 ILE A 123 -5.912 -11.078 -2.328 1.00 0.00 C ATOM 0 H ILE A 123 -5.801 -12.199 1.022 1.00 0.00 H new ATOM 0 HA ILE A 123 -6.720 -14.609 -0.153 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.453 -12.742 -0.959 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.181 -12.792 -2.227 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.979 -11.955 -0.701 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -4.776 -13.680 -3.214 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -4.281 -14.928 -2.046 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -5.980 -14.818 -2.564 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.735 -10.411 -2.584 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.203 -10.551 -1.689 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.409 -11.400 -3.240 1.00 0.00 H new ATOM 1942 N LEU A 124 -3.740 -14.596 1.230 1.00 0.00 N ATOM 1943 CA LEU A 124 -2.644 -15.451 1.670 1.00 0.00 C ATOM 1944 C LEU A 124 -3.143 -16.506 2.651 1.00 0.00 C ATOM 1945 O LEU A 124 -2.742 -17.667 2.589 1.00 0.00 O ATOM 1946 CB LEU A 124 -1.541 -14.613 2.318 1.00 0.00 C ATOM 1947 CG LEU A 124 -0.235 -15.366 2.590 1.00 0.00 C ATOM 1948 CD1 LEU A 124 0.789 -15.068 1.505 1.00 0.00 C ATOM 1949 CD2 LEU A 124 0.317 -15.000 3.960 1.00 0.00 C ATOM 0 H LEU A 124 -3.688 -13.634 1.566 1.00 0.00 H new ATOM 0 HA LEU A 124 -2.235 -15.957 0.795 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -1.325 -13.762 1.673 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -1.915 -14.212 3.260 1.00 0.00 H new ATOM 0 HG LEU A 124 -0.446 -16.435 2.579 1.00 0.00 H new ATOM 0 HD11 LEU A 124 1.710 -15.611 1.715 1.00 0.00 H new ATOM 0 HD12 LEU A 124 0.396 -15.381 0.538 1.00 0.00 H new ATOM 0 HD13 LEU A 124 0.996 -13.998 1.484 1.00 0.00 H new ATOM 0 HD21 LEU A 124 1.245 -15.544 4.136 1.00 0.00 H new ATOM 0 HD22 LEU A 124 0.512 -13.928 3.999 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -0.410 -15.265 4.728 1.00 0.00 H new ATOM 1961 N ALA A 125 -4.024 -16.090 3.557 1.00 0.00 N ATOM 1962 CA ALA A 125 -4.581 -16.999 4.551 1.00 0.00 C ATOM 1963 C ALA A 125 -5.605 -17.938 3.924 1.00 0.00 C ATOM 1964 O ALA A 125 -5.806 -19.058 4.395 1.00 0.00 O ATOM 1965 CB ALA A 125 -5.213 -16.211 5.689 1.00 0.00 C ATOM 0 H ALA A 125 -4.366 -15.131 3.622 1.00 0.00 H new ATOM 0 HA ALA A 125 -3.768 -17.605 4.950 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -5.625 -16.902 6.425 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -4.456 -15.585 6.163 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -6.011 -15.581 5.296 1.00 0.00 H new ATOM 1971 N SER A 126 -6.249 -17.477 2.856 1.00 0.00 N ATOM 1972 CA SER A 126 -7.253 -18.276 2.164 1.00 0.00 C ATOM 1973 C SER A 126 -6.595 -19.295 1.237 1.00 0.00 C ATOM 1974 O SER A 126 -7.143 -20.370 0.996 1.00 0.00 O ATOM 1975 CB SER A 126 -8.191 -17.371 1.362 1.00 0.00 C ATOM 1976 OG SER A 126 -7.497 -16.722 0.310 1.00 0.00 O ATOM 0 H SER A 126 -6.093 -16.554 2.451 1.00 0.00 H new ATOM 0 HA SER A 126 -7.832 -18.815 2.914 1.00 0.00 H new ATOM 0 HB2 SER A 126 -9.009 -17.963 0.952 1.00 0.00 H new ATOM 0 HB3 SER A 126 -8.636 -16.626 2.022 1.00 0.00 H new ATOM 0 HG SER A 126 -8.078 -16.047 -0.098 1.00 0.00 H new ATOM 1982 N LEU A 127 -5.420 -18.950 0.722 1.00 0.00 N ATOM 1983 CA LEU A 127 -4.692 -19.838 -0.179 1.00 0.00 C ATOM 1984 C LEU A 127 -4.110 -21.024 0.583 1.00 0.00 C ATOM 1985 O LEU A 127 -4.103 -22.151 0.088 1.00 0.00 O ATOM 1986 CB LEU A 127 -3.575 -19.072 -0.893 1.00 0.00 C ATOM 1987 CG LEU A 127 -3.660 -19.082 -2.421 1.00 0.00 C ATOM 1988 CD1 LEU A 127 -2.501 -18.304 -3.024 1.00 0.00 C ATOM 1989 CD2 LEU A 127 -3.676 -20.510 -2.944 1.00 0.00 C ATOM 0 H LEU A 127 -4.952 -18.064 0.912 1.00 0.00 H new ATOM 0 HA LEU A 127 -5.393 -20.217 -0.923 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.587 -18.037 -0.550 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -2.616 -19.495 -0.594 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.590 -18.597 -2.718 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.577 -18.322 -4.111 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.535 -17.272 -2.675 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -1.559 -18.760 -2.719 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -3.737 -20.498 -4.032 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -2.763 -21.020 -2.637 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -4.540 -21.036 -2.538 1.00 0.00 H new ATOM 2001 N GLN A 128 -3.624 -20.761 1.789 1.00 0.00 N ATOM 2002 CA GLN A 128 -3.038 -21.803 2.623 1.00 0.00 C ATOM 2003 C GLN A 128 -4.109 -22.499 3.458 1.00 0.00 C ATOM 2004 O GLN A 128 -3.798 -23.545 4.066 1.00 0.00 O ATOM 2005 CB GLN A 128 -1.967 -21.211 3.540 1.00 0.00 C ATOM 2006 CG GLN A 128 -2.468 -20.052 4.386 1.00 0.00 C ATOM 2007 CD GLN A 128 -2.227 -20.263 5.869 1.00 0.00 C ATOM 2008 OE1 GLN A 128 -3.167 -20.310 6.662 1.00 0.00 O ATOM 2009 NE2 GLN A 128 -0.961 -20.393 6.249 1.00 0.00 N ATOM 2010 OXT GLN A 128 -5.250 -21.992 3.497 1.00 0.00 O ATOM 0 H GLN A 128 -3.624 -19.833 2.213 1.00 0.00 H new ATOM 0 HA GLN A 128 -2.577 -22.541 1.966 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -1.589 -21.994 4.197 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -1.127 -20.872 2.933 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -1.972 -19.135 4.068 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -3.535 -19.915 4.211 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -0.213 -20.347 5.557 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -0.736 -20.538 7.233 1.00 0.00 H new TER 2019 GLN A 128