USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 815 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ -144:sc= -0.277 (180deg=-2.57!) USER MOD Single : A 15 THR OG1 : rot -74:sc= -0.203 USER MOD Single : A 17 THR OG1 : rot -40:sc= 1.14 USER MOD Single : A 19 LYS NZ :NH3+ 154:sc= -0.103 (180deg=-0.535) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 52:sc= 0.0205 USER MOD Single : A 30 THR OG1 : rot -179:sc= -1.06 USER MOD Single : A 33 ASN : amide:sc= -0.245 X(o=-0.24,f=-0.047) USER MOD Single : A 35 LYS NZ :NH3+ 138:sc= -0.839 (180deg=-2.08!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= -1.08 K(o=-1.1,f=-5.8!) USER MOD Single : A 49 GLN : amide:sc= -3.47 K(o=-3.5,f=-6.3!) USER MOD Single : A 56 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0103) USER MOD Single : A 57 GLN : amide:sc= -0.134 K(o=-0.13,f=-4.2!) USER MOD Single : A 63 THR OG1 : rot 56:sc= 0.781 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 GLN : amide:sc= -0.0224 X(o=-0.022,f=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot -70:sc=-0.00904 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 96 HIS : no HE2:sc= 0.498 K(o=0.5,f=-3.9!) USER MOD Single : A 97 HIS : no HD1:sc= -0.211 X(o=-0.21,f=-0.089) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -0.119 K(o=-0.12,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.040 12.510 -2.585 1.00 0.00 N ATOM 2 CA GLY A 1 5.698 11.393 -3.445 1.00 0.00 C ATOM 3 C GLY A 1 6.879 10.907 -4.262 1.00 0.00 C ATOM 4 O GLY A 1 7.531 11.691 -4.950 1.00 0.00 O ATOM 0 H1 GLY A 1 5.200 12.805 -2.048 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.790 12.222 -1.924 1.00 0.00 H new ATOM 0 H3 GLY A 1 6.376 13.305 -3.165 1.00 0.00 H new ATOM 0 HA2 GLY A 1 5.319 10.572 -2.836 1.00 0.00 H new ATOM 0 HA3 GLY A 1 4.893 11.689 -4.117 1.00 0.00 H new ATOM 8 N SER A 2 7.156 9.609 -4.184 1.00 0.00 N ATOM 9 CA SER A 2 8.270 9.020 -4.917 1.00 0.00 C ATOM 10 C SER A 2 7.915 8.836 -6.389 1.00 0.00 C ATOM 11 O SER A 2 8.688 9.200 -7.276 1.00 0.00 O ATOM 12 CB SER A 2 8.658 7.674 -4.302 1.00 0.00 C ATOM 13 OG SER A 2 9.860 7.181 -4.869 1.00 0.00 O ATOM 0 H SER A 2 6.624 8.946 -3.621 1.00 0.00 H new ATOM 0 HA SER A 2 9.118 9.701 -4.848 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.779 7.785 -3.224 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.855 6.954 -4.460 1.00 0.00 H new ATOM 0 HG SER A 2 10.087 6.321 -4.458 1.00 0.00 H new ATOM 19 N LEU A 3 6.741 8.269 -6.641 1.00 0.00 N ATOM 20 CA LEU A 3 6.281 8.035 -8.006 1.00 0.00 C ATOM 21 C LEU A 3 4.892 8.626 -8.221 1.00 0.00 C ATOM 22 O LEU A 3 4.003 8.472 -7.383 1.00 0.00 O ATOM 23 CB LEU A 3 6.263 6.536 -8.309 1.00 0.00 C ATOM 24 CG LEU A 3 5.925 6.147 -9.749 1.00 0.00 C ATOM 25 CD1 LEU A 3 7.127 6.360 -10.656 1.00 0.00 C ATOM 26 CD2 LEU A 3 5.454 4.701 -9.814 1.00 0.00 C ATOM 0 H LEU A 3 6.090 7.962 -5.918 1.00 0.00 H new ATOM 0 HA LEU A 3 6.975 8.528 -8.687 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.242 6.124 -8.062 1.00 0.00 H new ATOM 0 HB3 LEU A 3 5.540 6.060 -7.646 1.00 0.00 H new ATOM 0 HG LEU A 3 5.115 6.788 -10.098 1.00 0.00 H new ATOM 0 HD11 LEU A 3 6.867 6.078 -11.676 1.00 0.00 H new ATOM 0 HD12 LEU A 3 7.419 7.410 -10.633 1.00 0.00 H new ATOM 0 HD13 LEU A 3 7.958 5.745 -10.310 1.00 0.00 H new ATOM 0 HD21 LEU A 3 5.218 4.441 -10.846 1.00 0.00 H new ATOM 0 HD22 LEU A 3 6.243 4.045 -9.446 1.00 0.00 H new ATOM 0 HD23 LEU A 3 4.564 4.580 -9.197 1.00 0.00 H new ATOM 38 N VAL A 4 4.710 9.302 -9.352 1.00 0.00 N ATOM 39 CA VAL A 4 3.428 9.913 -9.679 1.00 0.00 C ATOM 40 C VAL A 4 2.803 9.256 -10.905 1.00 0.00 C ATOM 41 O VAL A 4 3.488 8.667 -11.741 1.00 0.00 O ATOM 42 CB VAL A 4 3.576 11.424 -9.940 1.00 0.00 C ATOM 43 CG1 VAL A 4 3.704 12.182 -8.627 1.00 0.00 C ATOM 44 CG2 VAL A 4 4.773 11.694 -10.839 1.00 0.00 C ATOM 0 H VAL A 4 5.435 9.440 -10.056 1.00 0.00 H new ATOM 0 HA VAL A 4 2.777 9.763 -8.818 1.00 0.00 H new ATOM 0 HB VAL A 4 2.680 11.777 -10.450 1.00 0.00 H new ATOM 0 HG11 VAL A 4 3.808 13.248 -8.831 1.00 0.00 H new ATOM 0 HG12 VAL A 4 2.814 12.013 -8.021 1.00 0.00 H new ATOM 0 HG13 VAL A 4 4.583 11.829 -8.087 1.00 0.00 H new ATOM 0 HG21 VAL A 4 4.863 12.766 -11.013 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.680 11.327 -10.358 1.00 0.00 H new ATOM 0 HG23 VAL A 4 4.636 11.182 -11.791 1.00 0.00 H new ATOM 54 N PRO A 5 1.470 9.359 -11.017 1.00 0.00 N ATOM 55 CA PRO A 5 0.723 8.782 -12.139 1.00 0.00 C ATOM 56 C PRO A 5 0.989 9.515 -13.450 1.00 0.00 C ATOM 57 O PRO A 5 1.058 10.743 -13.482 1.00 0.00 O ATOM 58 CB PRO A 5 -0.738 8.953 -11.717 1.00 0.00 C ATOM 59 CG PRO A 5 -0.728 10.110 -10.778 1.00 0.00 C ATOM 60 CD PRO A 5 0.590 10.048 -10.058 1.00 0.00 C ATOM 0 HA PRO A 5 1.007 7.747 -12.330 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -1.379 9.147 -12.577 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -1.118 8.053 -11.233 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -0.834 11.051 -11.317 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -1.559 10.050 -10.076 1.00 0.00 H new ATOM 0 HD2 PRO A 5 0.962 11.043 -9.814 1.00 0.00 H new ATOM 0 HD3 PRO A 5 0.510 9.499 -9.120 1.00 0.00 H new ATOM 68 N ARG A 6 1.135 8.753 -14.529 1.00 0.00 N ATOM 69 CA ARG A 6 1.393 9.330 -15.843 1.00 0.00 C ATOM 70 C ARG A 6 0.088 9.705 -16.538 1.00 0.00 C ATOM 71 O ARG A 6 0.006 10.727 -17.217 1.00 0.00 O ATOM 72 CB ARG A 6 2.181 8.346 -16.710 1.00 0.00 C ATOM 73 CG ARG A 6 3.658 8.272 -16.359 1.00 0.00 C ATOM 74 CD ARG A 6 3.914 7.281 -15.234 1.00 0.00 C ATOM 75 NE ARG A 6 5.265 6.728 -15.289 1.00 0.00 N ATOM 76 CZ ARG A 6 5.672 5.707 -14.544 1.00 0.00 C ATOM 77 NH1 ARG A 6 4.836 5.129 -13.691 1.00 0.00 N ATOM 78 NH2 ARG A 6 6.917 5.260 -14.650 1.00 0.00 N ATOM 0 H ARG A 6 1.079 7.735 -14.519 1.00 0.00 H new ATOM 0 HA ARG A 6 1.984 10.235 -15.705 1.00 0.00 H new ATOM 0 HB2 ARG A 6 1.742 7.353 -16.609 1.00 0.00 H new ATOM 0 HB3 ARG A 6 2.079 8.634 -17.756 1.00 0.00 H new ATOM 0 HG2 ARG A 6 4.228 7.979 -17.240 1.00 0.00 H new ATOM 0 HG3 ARG A 6 4.013 9.259 -16.063 1.00 0.00 H new ATOM 0 HD2 ARG A 6 3.763 7.775 -14.274 1.00 0.00 H new ATOM 0 HD3 ARG A 6 3.188 6.470 -15.293 1.00 0.00 H new ATOM 0 HE ARG A 6 5.932 7.149 -15.935 1.00 0.00 H new ATOM 0 HH11 ARG A 6 3.878 5.469 -13.606 1.00 0.00 H new ATOM 0 HH12 ARG A 6 5.151 4.345 -13.120 1.00 0.00 H new ATOM 0 HH21 ARG A 6 7.563 5.701 -15.305 1.00 0.00 H new ATOM 0 HH22 ARG A 6 7.228 4.476 -14.077 1.00 0.00 H new ATOM 92 N GLY A 7 -0.932 8.869 -16.363 1.00 0.00 N ATOM 93 CA GLY A 7 -2.219 9.130 -16.980 1.00 0.00 C ATOM 94 C GLY A 7 -3.222 9.714 -16.005 1.00 0.00 C ATOM 95 O GLY A 7 -3.108 9.518 -14.795 1.00 0.00 O ATOM 0 H GLY A 7 -0.889 8.016 -15.805 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.085 9.818 -17.815 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.616 8.202 -17.392 1.00 0.00 H new ATOM 99 N SER A 8 -4.206 10.436 -16.531 1.00 0.00 N ATOM 100 CA SER A 8 -5.230 11.055 -15.698 1.00 0.00 C ATOM 101 C SER A 8 -6.289 11.739 -16.558 1.00 0.00 C ATOM 102 O SER A 8 -6.026 12.125 -17.696 1.00 0.00 O ATOM 103 CB SER A 8 -4.596 12.071 -14.746 1.00 0.00 C ATOM 104 OG SER A 8 -3.907 13.081 -15.462 1.00 0.00 O ATOM 0 H SER A 8 -4.316 10.607 -17.531 1.00 0.00 H new ATOM 0 HA SER A 8 -5.712 10.271 -15.114 1.00 0.00 H new ATOM 0 HB2 SER A 8 -5.369 12.524 -14.125 1.00 0.00 H new ATOM 0 HB3 SER A 8 -3.905 11.562 -14.074 1.00 0.00 H new ATOM 0 HG SER A 8 -3.513 13.718 -14.831 1.00 0.00 H new ATOM 110 N MET A 9 -7.488 11.884 -16.003 1.00 0.00 N ATOM 111 CA MET A 9 -8.588 12.522 -16.718 1.00 0.00 C ATOM 112 C MET A 9 -9.592 13.127 -15.742 1.00 0.00 C ATOM 113 O MET A 9 -9.968 12.496 -14.755 1.00 0.00 O ATOM 114 CB MET A 9 -9.288 11.511 -17.628 1.00 0.00 C ATOM 115 CG MET A 9 -10.587 12.028 -18.225 1.00 0.00 C ATOM 116 SD MET A 9 -11.219 10.967 -19.538 1.00 0.00 S ATOM 117 CE MET A 9 -11.896 9.612 -18.583 1.00 0.00 C ATOM 0 H MET A 9 -7.723 11.569 -15.062 1.00 0.00 H new ATOM 0 HA MET A 9 -8.174 13.324 -17.330 1.00 0.00 H new ATOM 0 HB2 MET A 9 -8.612 11.233 -18.436 1.00 0.00 H new ATOM 0 HB3 MET A 9 -9.495 10.605 -17.059 1.00 0.00 H new ATOM 0 HG2 MET A 9 -11.336 12.111 -17.438 1.00 0.00 H new ATOM 0 HG3 MET A 9 -10.427 13.031 -18.620 1.00 0.00 H new ATOM 0 HE1 MET A 9 -12.325 8.871 -19.257 1.00 0.00 H new ATOM 0 HE2 MET A 9 -11.104 9.151 -17.994 1.00 0.00 H new ATOM 0 HE3 MET A 9 -12.672 9.989 -17.916 1.00 0.00 H new ATOM 127 N GLN A 10 -10.021 14.353 -16.025 1.00 0.00 N ATOM 128 CA GLN A 10 -10.981 15.042 -15.171 1.00 0.00 C ATOM 129 C GLN A 10 -12.395 14.914 -15.728 1.00 0.00 C ATOM 130 O GLN A 10 -12.605 14.990 -16.939 1.00 0.00 O ATOM 131 CB GLN A 10 -10.606 16.518 -15.034 1.00 0.00 C ATOM 132 CG GLN A 10 -10.925 17.344 -16.269 1.00 0.00 C ATOM 133 CD GLN A 10 -9.830 18.337 -16.607 1.00 0.00 C ATOM 134 OE1 GLN A 10 -9.440 19.155 -15.773 1.00 0.00 O ATOM 135 NE2 GLN A 10 -9.328 18.270 -17.834 1.00 0.00 N ATOM 0 H GLN A 10 -9.719 14.889 -16.839 1.00 0.00 H new ATOM 0 HA GLN A 10 -10.954 14.575 -14.187 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -11.133 16.940 -14.179 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -9.540 16.595 -14.821 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -11.080 16.677 -17.117 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -11.860 17.881 -16.111 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -9.682 17.576 -18.492 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -8.589 18.913 -18.118 1.00 0.00 H new ATOM 144 N ILE A 11 -13.361 14.719 -14.837 1.00 0.00 N ATOM 145 CA ILE A 11 -14.755 14.581 -15.240 1.00 0.00 C ATOM 146 C ILE A 11 -15.643 15.573 -14.496 1.00 0.00 C ATOM 147 O ILE A 11 -15.200 16.238 -13.559 1.00 0.00 O ATOM 148 CB ILE A 11 -15.276 13.154 -14.987 1.00 0.00 C ATOM 149 CG1 ILE A 11 -15.349 12.873 -13.485 1.00 0.00 C ATOM 150 CG2 ILE A 11 -14.385 12.134 -15.680 1.00 0.00 C ATOM 151 CD1 ILE A 11 -15.874 11.493 -13.153 1.00 0.00 C ATOM 0 H ILE A 11 -13.204 14.653 -13.831 1.00 0.00 H new ATOM 0 HA ILE A 11 -14.796 14.790 -16.309 1.00 0.00 H new ATOM 0 HB ILE A 11 -16.280 13.071 -15.402 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -14.355 12.988 -13.053 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -15.989 13.619 -13.015 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -14.766 11.130 -15.492 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -14.380 12.325 -16.753 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -13.370 12.215 -15.292 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -15.898 11.364 -12.071 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -16.881 11.380 -13.555 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -15.221 10.740 -13.594 1.00 0.00 H new ATOM 163 N PHE A 12 -16.899 15.667 -14.919 1.00 0.00 N ATOM 164 CA PHE A 12 -17.851 16.578 -14.292 1.00 0.00 C ATOM 165 C PHE A 12 -18.933 15.804 -13.546 1.00 0.00 C ATOM 166 O PHE A 12 -19.569 14.909 -14.103 1.00 0.00 O ATOM 167 CB PHE A 12 -18.491 17.484 -15.346 1.00 0.00 C ATOM 168 CG PHE A 12 -17.504 18.366 -16.057 1.00 0.00 C ATOM 169 CD1 PHE A 12 -16.821 19.357 -15.371 1.00 0.00 C ATOM 170 CD2 PHE A 12 -17.261 18.203 -17.411 1.00 0.00 C ATOM 171 CE1 PHE A 12 -15.913 20.169 -16.024 1.00 0.00 C ATOM 172 CE2 PHE A 12 -16.354 19.012 -18.069 1.00 0.00 C ATOM 173 CZ PHE A 12 -15.678 19.996 -17.374 1.00 0.00 C ATOM 0 H PHE A 12 -17.282 15.124 -15.693 1.00 0.00 H new ATOM 0 HA PHE A 12 -17.309 17.194 -13.574 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -19.008 16.866 -16.080 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -19.245 18.108 -14.867 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -17.000 19.496 -14.315 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -17.786 17.435 -17.959 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -15.387 20.939 -15.479 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -16.174 18.875 -19.125 1.00 0.00 H new ATOM 0 HZ PHE A 12 -14.967 20.629 -17.885 1.00 0.00 H new ATOM 183 N VAL A 13 -19.137 16.155 -12.280 1.00 0.00 N ATOM 184 CA VAL A 13 -20.143 15.495 -11.456 1.00 0.00 C ATOM 185 C VAL A 13 -21.073 16.512 -10.804 1.00 0.00 C ATOM 186 O VAL A 13 -20.624 17.512 -10.244 1.00 0.00 O ATOM 187 CB VAL A 13 -19.491 14.634 -10.357 1.00 0.00 C ATOM 188 CG1 VAL A 13 -20.540 13.794 -9.644 1.00 0.00 C ATOM 189 CG2 VAL A 13 -18.402 13.752 -10.948 1.00 0.00 C ATOM 0 H VAL A 13 -18.619 16.893 -11.803 1.00 0.00 H new ATOM 0 HA VAL A 13 -20.721 14.850 -12.118 1.00 0.00 H new ATOM 0 HB VAL A 13 -19.032 15.298 -9.624 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -20.061 13.193 -8.871 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -21.281 14.449 -9.186 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -21.030 13.138 -10.363 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -17.952 13.151 -10.158 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -18.835 13.095 -11.702 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -17.637 14.377 -11.408 1.00 0.00 H new ATOM 199 N LYS A 14 -22.374 16.250 -10.881 1.00 0.00 N ATOM 200 CA LYS A 14 -23.370 17.140 -10.297 1.00 0.00 C ATOM 201 C LYS A 14 -23.845 16.614 -8.947 1.00 0.00 C ATOM 202 O LYS A 14 -24.214 15.446 -8.818 1.00 0.00 O ATOM 203 CB LYS A 14 -24.562 17.296 -11.244 1.00 0.00 C ATOM 204 CG LYS A 14 -24.341 18.330 -12.335 1.00 0.00 C ATOM 205 CD LYS A 14 -23.433 17.798 -13.431 1.00 0.00 C ATOM 206 CE LYS A 14 -23.509 18.657 -14.684 1.00 0.00 C ATOM 207 NZ LYS A 14 -24.859 18.605 -15.311 1.00 0.00 N ATOM 0 H LYS A 14 -22.763 15.428 -11.343 1.00 0.00 H new ATOM 0 HA LYS A 14 -22.905 18.114 -10.144 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -24.777 16.332 -11.706 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -25.442 17.574 -10.664 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.301 18.618 -12.764 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -23.902 19.229 -11.902 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -22.405 17.769 -13.071 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -23.715 16.773 -13.673 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -23.265 19.689 -14.432 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -22.762 18.319 -15.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -24.762 18.636 -16.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -25.337 17.724 -15.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -25.422 19.419 -14.991 1.00 0.00 H new ATOM 221 N THR A 15 -23.836 17.483 -7.941 1.00 0.00 N ATOM 222 CA THR A 15 -24.267 17.106 -6.601 1.00 0.00 C ATOM 223 C THR A 15 -25.735 17.450 -6.378 1.00 0.00 C ATOM 224 O THR A 15 -26.359 18.120 -7.203 1.00 0.00 O ATOM 225 CB THR A 15 -23.418 17.804 -5.521 1.00 0.00 C ATOM 226 OG1 THR A 15 -23.581 19.224 -5.612 1.00 0.00 O ATOM 227 CG2 THR A 15 -21.948 17.447 -5.673 1.00 0.00 C ATOM 0 H THR A 15 -23.535 18.453 -8.029 1.00 0.00 H new ATOM 0 HA THR A 15 -24.133 16.027 -6.518 1.00 0.00 H new ATOM 0 HB THR A 15 -23.759 17.461 -4.544 1.00 0.00 H new ATOM 0 HG1 THR A 15 -23.093 19.560 -6.393 1.00 0.00 H new ATOM 0 HG21 THR A 15 -21.369 17.952 -4.899 1.00 0.00 H new ATOM 0 HG22 THR A 15 -21.823 16.369 -5.574 1.00 0.00 H new ATOM 0 HG23 THR A 15 -21.596 17.764 -6.655 1.00 0.00 H new ATOM 235 N LEU A 16 -26.282 16.989 -5.259 1.00 0.00 N ATOM 236 CA LEU A 16 -27.679 17.248 -4.927 1.00 0.00 C ATOM 237 C LEU A 16 -27.896 18.722 -4.599 1.00 0.00 C ATOM 238 O LEU A 16 -29.023 19.218 -4.633 1.00 0.00 O ATOM 239 CB LEU A 16 -28.112 16.382 -3.743 1.00 0.00 C ATOM 240 CG LEU A 16 -27.383 16.635 -2.424 1.00 0.00 C ATOM 241 CD1 LEU A 16 -28.377 16.762 -1.280 1.00 0.00 C ATOM 242 CD2 LEU A 16 -26.384 15.522 -2.144 1.00 0.00 C ATOM 0 H LEU A 16 -25.780 16.434 -4.566 1.00 0.00 H new ATOM 0 HA LEU A 16 -28.286 16.994 -5.796 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -29.179 16.533 -3.580 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -27.976 15.335 -4.015 1.00 0.00 H new ATOM 0 HG LEU A 16 -26.836 17.574 -2.508 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -27.839 16.942 -0.349 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -29.052 17.595 -1.476 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -28.953 15.840 -1.194 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -25.874 15.719 -1.201 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -26.909 14.569 -2.080 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -25.652 15.479 -2.950 1.00 0.00 H new ATOM 254 N THR A 17 -26.809 19.419 -4.283 1.00 0.00 N ATOM 255 CA THR A 17 -26.880 20.836 -3.951 1.00 0.00 C ATOM 256 C THR A 17 -26.650 21.703 -5.184 1.00 0.00 C ATOM 257 O THR A 17 -26.345 22.889 -5.073 1.00 0.00 O ATOM 258 CB THR A 17 -25.846 21.213 -2.873 1.00 0.00 C ATOM 259 OG1 THR A 17 -25.982 22.595 -2.525 1.00 0.00 O ATOM 260 CG2 THR A 17 -24.431 20.946 -3.364 1.00 0.00 C ATOM 0 H THR A 17 -25.869 19.025 -4.250 1.00 0.00 H new ATOM 0 HA THR A 17 -27.882 21.019 -3.563 1.00 0.00 H new ATOM 0 HB THR A 17 -26.031 20.597 -1.993 1.00 0.00 H new ATOM 0 HG1 THR A 17 -26.152 23.121 -3.334 1.00 0.00 H new ATOM 0 HG21 THR A 17 -23.718 21.220 -2.586 1.00 0.00 H new ATOM 0 HG22 THR A 17 -24.322 19.888 -3.600 1.00 0.00 H new ATOM 0 HG23 THR A 17 -24.238 21.539 -4.258 1.00 0.00 H new ATOM 268 N GLY A 18 -26.800 21.102 -6.360 1.00 0.00 N ATOM 269 CA GLY A 18 -26.606 21.834 -7.598 1.00 0.00 C ATOM 270 C GLY A 18 -25.187 22.344 -7.753 1.00 0.00 C ATOM 271 O GLY A 18 -24.936 23.286 -8.505 1.00 0.00 O ATOM 0 H GLY A 18 -27.053 20.121 -6.478 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -26.851 21.188 -8.441 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -27.297 22.676 -7.631 1.00 0.00 H new ATOM 275 N LYS A 19 -24.255 21.723 -7.038 1.00 0.00 N ATOM 276 CA LYS A 19 -22.853 22.118 -7.098 1.00 0.00 C ATOM 277 C LYS A 19 -22.060 21.176 -7.999 1.00 0.00 C ATOM 278 O LYS A 19 -22.032 19.965 -7.777 1.00 0.00 O ATOM 279 CB LYS A 19 -22.244 22.131 -5.694 1.00 0.00 C ATOM 280 CG LYS A 19 -20.751 22.409 -5.681 1.00 0.00 C ATOM 281 CD LYS A 19 -19.944 21.122 -5.681 1.00 0.00 C ATOM 282 CE LYS A 19 -18.627 21.289 -4.940 1.00 0.00 C ATOM 283 NZ LYS A 19 -18.836 21.552 -3.489 1.00 0.00 N ATOM 0 H LYS A 19 -24.446 20.943 -6.409 1.00 0.00 H new ATOM 0 HA LYS A 19 -22.803 23.123 -7.518 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -22.751 22.887 -5.094 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -22.430 21.168 -5.218 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -20.484 23.007 -6.552 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -20.497 22.998 -4.800 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -20.526 20.327 -5.216 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -19.748 20.814 -6.708 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -18.025 20.389 -5.063 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -18.064 22.112 -5.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -18.003 21.233 -2.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -18.975 22.572 -3.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -19.677 21.036 -3.160 1.00 0.00 H new ATOM 297 N THR A 20 -21.415 21.740 -9.016 1.00 0.00 N ATOM 298 CA THR A 20 -20.622 20.951 -9.949 1.00 0.00 C ATOM 299 C THR A 20 -19.190 20.788 -9.453 1.00 0.00 C ATOM 300 O THR A 20 -18.472 21.771 -9.266 1.00 0.00 O ATOM 301 CB THR A 20 -20.598 21.594 -11.349 1.00 0.00 C ATOM 302 OG1 THR A 20 -21.807 22.329 -11.572 1.00 0.00 O ATOM 303 CG2 THR A 20 -20.436 20.535 -12.429 1.00 0.00 C ATOM 0 H THR A 20 -21.427 22.741 -9.214 1.00 0.00 H new ATOM 0 HA THR A 20 -21.094 19.971 -10.015 1.00 0.00 H new ATOM 0 HB THR A 20 -19.746 22.273 -11.398 1.00 0.00 H new ATOM 0 HG1 THR A 20 -21.783 22.736 -12.463 1.00 0.00 H new ATOM 0 HG21 THR A 20 -20.422 21.013 -13.408 1.00 0.00 H new ATOM 0 HG22 THR A 20 -19.500 19.998 -12.274 1.00 0.00 H new ATOM 0 HG23 THR A 20 -21.269 19.834 -12.379 1.00 0.00 H new ATOM 311 N ILE A 21 -18.780 19.542 -9.242 1.00 0.00 N ATOM 312 CA ILE A 21 -17.433 19.251 -8.769 1.00 0.00 C ATOM 313 C ILE A 21 -16.665 18.407 -9.780 1.00 0.00 C ATOM 314 O ILE A 21 -17.186 17.425 -10.309 1.00 0.00 O ATOM 315 CB ILE A 21 -17.458 18.515 -7.416 1.00 0.00 C ATOM 316 CG1 ILE A 21 -16.040 18.113 -7.003 1.00 0.00 C ATOM 317 CG2 ILE A 21 -18.359 17.292 -7.495 1.00 0.00 C ATOM 318 CD1 ILE A 21 -15.671 16.702 -7.404 1.00 0.00 C ATOM 0 H ILE A 21 -19.362 18.718 -9.391 1.00 0.00 H new ATOM 0 HA ILE A 21 -16.929 20.209 -8.643 1.00 0.00 H new ATOM 0 HB ILE A 21 -17.859 19.189 -6.660 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -15.329 18.807 -7.451 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -15.943 18.212 -5.922 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -18.366 16.783 -6.531 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -19.372 17.603 -7.749 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -17.985 16.613 -8.261 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -14.653 16.486 -7.079 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -16.359 15.999 -6.934 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -15.735 16.603 -8.488 1.00 0.00 H new ATOM 330 N THR A 22 -15.421 18.795 -10.044 1.00 0.00 N ATOM 331 CA THR A 22 -14.580 18.074 -10.991 1.00 0.00 C ATOM 332 C THR A 22 -13.777 16.982 -10.293 1.00 0.00 C ATOM 333 O THR A 22 -13.028 17.252 -9.353 1.00 0.00 O ATOM 334 CB THR A 22 -13.609 19.024 -11.717 1.00 0.00 C ATOM 335 OG1 THR A 22 -14.272 20.254 -12.032 1.00 0.00 O ATOM 336 CG2 THR A 22 -13.080 18.386 -12.993 1.00 0.00 C ATOM 0 H THR A 22 -14.974 19.605 -9.615 1.00 0.00 H new ATOM 0 HA THR A 22 -15.247 17.619 -11.723 1.00 0.00 H new ATOM 0 HB THR A 22 -12.767 19.224 -11.054 1.00 0.00 H new ATOM 0 HG1 THR A 22 -13.648 20.854 -12.492 1.00 0.00 H new ATOM 0 HG21 THR A 22 -12.396 19.076 -13.488 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.551 17.465 -12.747 1.00 0.00 H new ATOM 0 HG23 THR A 22 -13.913 18.160 -13.659 1.00 0.00 H new ATOM 344 N LEU A 23 -13.937 15.748 -10.758 1.00 0.00 N ATOM 345 CA LEU A 23 -13.226 14.613 -10.179 1.00 0.00 C ATOM 346 C LEU A 23 -12.159 14.092 -11.137 1.00 0.00 C ATOM 347 O LEU A 23 -12.281 14.235 -12.353 1.00 0.00 O ATOM 348 CB LEU A 23 -14.208 13.493 -9.833 1.00 0.00 C ATOM 349 CG LEU A 23 -13.807 12.584 -8.671 1.00 0.00 C ATOM 350 CD1 LEU A 23 -13.800 13.360 -7.363 1.00 0.00 C ATOM 351 CD2 LEU A 23 -14.746 11.390 -8.579 1.00 0.00 C ATOM 0 H LEU A 23 -14.553 15.508 -11.535 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.735 14.951 -9.267 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -15.173 13.943 -9.600 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -14.350 12.875 -10.719 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.798 12.215 -8.856 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -13.512 12.696 -6.548 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -13.087 14.181 -7.431 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -14.796 13.759 -7.171 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -14.445 10.754 -7.746 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -15.766 11.740 -8.418 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -14.701 10.819 -9.506 1.00 0.00 H new ATOM 363 N GLU A 24 -11.116 13.486 -10.580 1.00 0.00 N ATOM 364 CA GLU A 24 -10.029 12.942 -11.385 1.00 0.00 C ATOM 365 C GLU A 24 -10.046 11.417 -11.364 1.00 0.00 C ATOM 366 O GLU A 24 -9.890 10.798 -10.311 1.00 0.00 O ATOM 367 CB GLU A 24 -8.681 13.456 -10.876 1.00 0.00 C ATOM 368 CG GLU A 24 -8.387 14.893 -11.273 1.00 0.00 C ATOM 369 CD GLU A 24 -7.290 15.518 -10.433 1.00 0.00 C ATOM 370 OE1 GLU A 24 -7.608 16.082 -9.366 1.00 0.00 O ATOM 371 OE2 GLU A 24 -6.113 15.442 -10.845 1.00 0.00 O ATOM 0 H GLU A 24 -11.001 13.359 -9.575 1.00 0.00 H new ATOM 0 HA GLU A 24 -10.171 13.275 -12.413 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -8.659 13.377 -9.789 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -7.889 12.813 -11.259 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -8.097 14.924 -12.323 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -9.296 15.486 -11.176 1.00 0.00 H new ATOM 378 N VAL A 25 -10.237 10.816 -12.534 1.00 0.00 N ATOM 379 CA VAL A 25 -10.274 9.363 -12.650 1.00 0.00 C ATOM 380 C VAL A 25 -9.639 8.900 -13.957 1.00 0.00 C ATOM 381 O VAL A 25 -9.750 9.570 -14.983 1.00 0.00 O ATOM 382 CB VAL A 25 -11.718 8.831 -12.577 1.00 0.00 C ATOM 383 CG1 VAL A 25 -12.587 9.496 -13.633 1.00 0.00 C ATOM 384 CG2 VAL A 25 -11.736 7.318 -12.734 1.00 0.00 C ATOM 0 H VAL A 25 -10.369 11.313 -13.415 1.00 0.00 H new ATOM 0 HA VAL A 25 -9.704 8.963 -11.811 1.00 0.00 H new ATOM 0 HB VAL A 25 -12.128 9.077 -11.598 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -13.603 9.107 -13.566 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.599 10.573 -13.469 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -12.183 9.285 -14.623 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -12.764 6.959 -12.680 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.307 7.047 -13.699 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.150 6.862 -11.936 1.00 0.00 H new ATOM 394 N GLU A 26 -8.974 7.750 -13.910 1.00 0.00 N ATOM 395 CA GLU A 26 -8.321 7.198 -15.092 1.00 0.00 C ATOM 396 C GLU A 26 -9.334 6.504 -15.998 1.00 0.00 C ATOM 397 O GLU A 26 -10.383 6.037 -15.556 1.00 0.00 O ATOM 398 CB GLU A 26 -7.227 6.210 -14.682 1.00 0.00 C ATOM 399 CG GLU A 26 -6.371 6.696 -13.523 1.00 0.00 C ATOM 400 CD GLU A 26 -5.210 5.767 -13.226 1.00 0.00 C ATOM 401 OE1 GLU A 26 -4.646 5.197 -14.183 1.00 0.00 O ATOM 402 OE2 GLU A 26 -4.865 5.612 -12.036 1.00 0.00 O ATOM 0 H GLU A 26 -8.873 7.183 -13.068 1.00 0.00 H new ATOM 0 HA GLU A 26 -7.869 8.022 -15.645 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -7.690 5.262 -14.408 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -6.584 6.015 -15.541 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -5.987 7.690 -13.752 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -6.992 6.792 -12.632 1.00 0.00 H new ATOM 409 N PRO A 27 -9.013 6.435 -17.299 1.00 0.00 N ATOM 410 CA PRO A 27 -9.880 5.801 -18.296 1.00 0.00 C ATOM 411 C PRO A 27 -9.942 4.286 -18.130 1.00 0.00 C ATOM 412 O PRO A 27 -10.816 3.626 -18.693 1.00 0.00 O ATOM 413 CB PRO A 27 -9.218 6.167 -19.627 1.00 0.00 C ATOM 414 CG PRO A 27 -7.786 6.397 -19.286 1.00 0.00 C ATOM 415 CD PRO A 27 -7.778 6.971 -17.896 1.00 0.00 C ATOM 0 HA PRO A 27 -10.913 6.139 -18.212 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -9.327 5.365 -20.357 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -9.670 7.058 -20.062 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -7.221 5.466 -19.327 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -7.322 7.083 -19.994 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -6.894 6.661 -17.338 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -7.779 8.061 -17.911 1.00 0.00 H new ATOM 423 N SER A 28 -9.010 3.741 -17.355 1.00 0.00 N ATOM 424 CA SER A 28 -8.957 2.304 -17.118 1.00 0.00 C ATOM 425 C SER A 28 -9.485 1.962 -15.728 1.00 0.00 C ATOM 426 O SER A 28 -9.776 0.804 -15.430 1.00 0.00 O ATOM 427 CB SER A 28 -7.523 1.792 -17.272 1.00 0.00 C ATOM 428 OG SER A 28 -6.584 2.809 -16.969 1.00 0.00 O ATOM 0 H SER A 28 -8.281 4.274 -16.880 1.00 0.00 H new ATOM 0 HA SER A 28 -9.591 1.816 -17.858 1.00 0.00 H new ATOM 0 HB2 SER A 28 -7.365 0.939 -16.612 1.00 0.00 H new ATOM 0 HB3 SER A 28 -7.367 1.440 -18.292 1.00 0.00 H new ATOM 0 HG SER A 28 -6.794 3.198 -16.094 1.00 0.00 H new ATOM 434 N ASP A 29 -9.604 2.979 -14.882 1.00 0.00 N ATOM 435 CA ASP A 29 -10.097 2.789 -13.522 1.00 0.00 C ATOM 436 C ASP A 29 -11.560 2.355 -13.531 1.00 0.00 C ATOM 437 O ASP A 29 -12.224 2.389 -14.567 1.00 0.00 O ATOM 438 CB ASP A 29 -9.940 4.078 -12.715 1.00 0.00 C ATOM 439 CG ASP A 29 -8.563 4.206 -12.092 1.00 0.00 C ATOM 440 OD1 ASP A 29 -7.642 3.491 -12.538 1.00 0.00 O ATOM 441 OD2 ASP A 29 -8.408 5.022 -11.159 1.00 0.00 O ATOM 0 H ASP A 29 -9.366 3.943 -15.113 1.00 0.00 H new ATOM 0 HA ASP A 29 -9.505 2.002 -13.054 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -10.123 4.934 -13.364 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -10.695 4.106 -11.930 1.00 0.00 H new ATOM 446 N THR A 30 -12.056 1.944 -12.368 1.00 0.00 N ATOM 447 CA THR A 30 -13.439 1.501 -12.241 1.00 0.00 C ATOM 448 C THR A 30 -14.237 2.438 -11.342 1.00 0.00 C ATOM 449 O THR A 30 -13.675 3.330 -10.706 1.00 0.00 O ATOM 450 CB THR A 30 -13.521 0.071 -11.675 1.00 0.00 C ATOM 451 OG1 THR A 30 -12.652 -0.059 -10.544 1.00 0.00 O ATOM 452 CG2 THR A 30 -13.140 -0.953 -12.733 1.00 0.00 C ATOM 0 H THR A 30 -11.520 1.909 -11.501 1.00 0.00 H new ATOM 0 HA THR A 30 -13.867 1.512 -13.243 1.00 0.00 H new ATOM 0 HB THR A 30 -14.550 -0.115 -11.366 1.00 0.00 H new ATOM 0 HG1 THR A 30 -12.699 -0.975 -10.199 1.00 0.00 H new ATOM 0 HG21 THR A 30 -13.205 -1.955 -12.310 1.00 0.00 H new ATOM 0 HG22 THR A 30 -13.821 -0.872 -13.580 1.00 0.00 H new ATOM 0 HG23 THR A 30 -12.120 -0.767 -13.069 1.00 0.00 H new ATOM 460 N ILE A 31 -15.548 2.230 -11.293 1.00 0.00 N ATOM 461 CA ILE A 31 -16.422 3.055 -10.469 1.00 0.00 C ATOM 462 C ILE A 31 -15.928 3.111 -9.027 1.00 0.00 C ATOM 463 O ILE A 31 -15.884 4.178 -8.417 1.00 0.00 O ATOM 464 CB ILE A 31 -17.870 2.531 -10.483 1.00 0.00 C ATOM 465 CG1 ILE A 31 -18.381 2.422 -11.921 1.00 0.00 C ATOM 466 CG2 ILE A 31 -18.771 3.442 -9.663 1.00 0.00 C ATOM 467 CD1 ILE A 31 -18.307 3.722 -12.690 1.00 0.00 C ATOM 0 H ILE A 31 -16.029 1.497 -11.814 1.00 0.00 H new ATOM 0 HA ILE A 31 -16.403 4.058 -10.896 1.00 0.00 H new ATOM 0 HB ILE A 31 -17.886 1.538 -10.035 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -17.800 1.665 -12.448 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -19.415 2.077 -11.905 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -19.791 3.058 -9.683 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -18.415 3.474 -8.633 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -18.753 4.447 -10.085 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -18.686 3.569 -13.701 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -18.911 4.477 -12.187 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -17.271 4.058 -12.738 1.00 0.00 H new ATOM 479 N GLU A 32 -15.555 1.953 -8.490 1.00 0.00 N ATOM 480 CA GLU A 32 -15.063 1.871 -7.120 1.00 0.00 C ATOM 481 C GLU A 32 -13.929 2.866 -6.889 1.00 0.00 C ATOM 482 O GLU A 32 -13.773 3.402 -5.793 1.00 0.00 O ATOM 483 CB GLU A 32 -14.581 0.451 -6.812 1.00 0.00 C ATOM 484 CG GLU A 32 -13.559 -0.074 -7.806 1.00 0.00 C ATOM 485 CD GLU A 32 -12.883 -1.345 -7.331 1.00 0.00 C ATOM 486 OE1 GLU A 32 -12.166 -1.291 -6.310 1.00 0.00 O ATOM 487 OE2 GLU A 32 -13.071 -2.395 -7.981 1.00 0.00 O ATOM 0 H GLU A 32 -15.584 1.060 -8.982 1.00 0.00 H new ATOM 0 HA GLU A 32 -15.885 2.121 -6.450 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -14.146 0.433 -5.813 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -15.440 -0.220 -6.798 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -14.050 -0.263 -8.761 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -12.803 0.691 -7.982 1.00 0.00 H new ATOM 494 N ASN A 33 -13.139 3.106 -7.930 1.00 0.00 N ATOM 495 CA ASN A 33 -12.018 4.035 -7.841 1.00 0.00 C ATOM 496 C ASN A 33 -12.507 5.480 -7.855 1.00 0.00 C ATOM 497 O ASN A 33 -11.892 6.361 -7.254 1.00 0.00 O ATOM 498 CB ASN A 33 -11.044 3.804 -8.998 1.00 0.00 C ATOM 499 CG ASN A 33 -9.814 3.026 -8.571 1.00 0.00 C ATOM 500 OD1 ASN A 33 -9.461 2.017 -9.182 1.00 0.00 O ATOM 501 ND2 ASN A 33 -9.155 3.493 -7.517 1.00 0.00 N ATOM 0 H ASN A 33 -13.254 2.670 -8.845 1.00 0.00 H new ATOM 0 HA ASN A 33 -11.502 3.853 -6.898 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -11.553 3.264 -9.796 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -10.738 4.766 -9.409 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -8.320 3.012 -7.183 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -9.484 4.333 -7.041 1.00 0.00 H new ATOM 508 N VAL A 34 -13.619 5.717 -8.544 1.00 0.00 N ATOM 509 CA VAL A 34 -14.193 7.054 -8.634 1.00 0.00 C ATOM 510 C VAL A 34 -14.692 7.531 -7.275 1.00 0.00 C ATOM 511 O VAL A 34 -14.463 8.676 -6.884 1.00 0.00 O ATOM 512 CB VAL A 34 -15.357 7.098 -9.642 1.00 0.00 C ATOM 513 CG1 VAL A 34 -15.909 8.511 -9.758 1.00 0.00 C ATOM 514 CG2 VAL A 34 -14.907 6.579 -10.999 1.00 0.00 C ATOM 0 H VAL A 34 -14.140 5.000 -9.048 1.00 0.00 H new ATOM 0 HA VAL A 34 -13.399 7.717 -8.978 1.00 0.00 H new ATOM 0 HB VAL A 34 -16.155 6.451 -9.278 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -16.730 8.523 -10.474 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -16.272 8.841 -8.784 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -15.121 9.183 -10.098 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -15.742 6.617 -11.698 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -14.092 7.198 -11.373 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -14.564 5.549 -10.899 1.00 0.00 H new ATOM 524 N LYS A 35 -15.376 6.646 -6.559 1.00 0.00 N ATOM 525 CA LYS A 35 -15.908 6.974 -5.241 1.00 0.00 C ATOM 526 C LYS A 35 -14.786 7.358 -4.282 1.00 0.00 C ATOM 527 O LYS A 35 -14.993 8.130 -3.346 1.00 0.00 O ATOM 528 CB LYS A 35 -16.694 5.789 -4.676 1.00 0.00 C ATOM 529 CG LYS A 35 -18.047 5.586 -5.337 1.00 0.00 C ATOM 530 CD LYS A 35 -18.729 4.325 -4.834 1.00 0.00 C ATOM 531 CE LYS A 35 -18.004 3.074 -5.306 1.00 0.00 C ATOM 532 NZ LYS A 35 -17.036 2.578 -4.289 1.00 0.00 N ATOM 0 H LYS A 35 -15.576 5.695 -6.869 1.00 0.00 H new ATOM 0 HA LYS A 35 -16.578 7.827 -5.349 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -16.102 4.882 -4.794 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -16.840 5.938 -3.606 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -18.683 6.449 -5.139 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.920 5.526 -6.418 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -18.763 4.338 -3.745 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -19.761 4.303 -5.185 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -18.732 2.293 -5.526 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -17.477 3.289 -6.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -17.096 1.541 -4.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -16.072 2.854 -4.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -17.263 2.992 -3.362 1.00 0.00 H new ATOM 546 N ALA A 36 -13.597 6.814 -4.521 1.00 0.00 N ATOM 547 CA ALA A 36 -12.442 7.102 -3.680 1.00 0.00 C ATOM 548 C ALA A 36 -12.185 8.603 -3.597 1.00 0.00 C ATOM 549 O ALA A 36 -11.910 9.137 -2.522 1.00 0.00 O ATOM 550 CB ALA A 36 -11.211 6.382 -4.210 1.00 0.00 C ATOM 0 H ALA A 36 -13.409 6.171 -5.290 1.00 0.00 H new ATOM 0 HA ALA A 36 -12.656 6.740 -2.674 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -10.356 6.606 -3.572 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -11.391 5.307 -4.212 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -11.003 6.717 -5.226 1.00 0.00 H new ATOM 556 N LYS A 37 -12.275 9.278 -4.737 1.00 0.00 N ATOM 557 CA LYS A 37 -12.052 10.718 -4.794 1.00 0.00 C ATOM 558 C LYS A 37 -13.255 11.476 -4.242 1.00 0.00 C ATOM 559 O LYS A 37 -13.113 12.571 -3.697 1.00 0.00 O ATOM 560 CB LYS A 37 -11.777 11.156 -6.234 1.00 0.00 C ATOM 561 CG LYS A 37 -10.520 10.543 -6.826 1.00 0.00 C ATOM 562 CD LYS A 37 -9.272 11.023 -6.106 1.00 0.00 C ATOM 563 CE LYS A 37 -8.011 10.680 -6.885 1.00 0.00 C ATOM 564 NZ LYS A 37 -6.838 11.467 -6.416 1.00 0.00 N ATOM 0 H LYS A 37 -12.501 8.851 -5.635 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.183 10.951 -4.178 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -12.630 10.887 -6.856 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -11.691 12.242 -6.264 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -10.581 9.456 -6.765 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -10.452 10.800 -7.883 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -9.328 12.102 -5.959 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -9.224 10.569 -5.116 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -7.799 9.616 -6.782 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -8.176 10.871 -7.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -5.999 11.204 -6.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -7.030 12.482 -6.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -6.664 11.266 -5.411 1.00 0.00 H new ATOM 578 N ILE A 38 -14.437 10.887 -4.385 1.00 0.00 N ATOM 579 CA ILE A 38 -15.664 11.506 -3.898 1.00 0.00 C ATOM 580 C ILE A 38 -15.654 11.624 -2.378 1.00 0.00 C ATOM 581 O ILE A 38 -16.243 12.545 -1.814 1.00 0.00 O ATOM 582 CB ILE A 38 -16.908 10.710 -4.333 1.00 0.00 C ATOM 583 CG1 ILE A 38 -16.990 10.642 -5.859 1.00 0.00 C ATOM 584 CG2 ILE A 38 -18.167 11.339 -3.757 1.00 0.00 C ATOM 585 CD1 ILE A 38 -17.140 11.996 -6.517 1.00 0.00 C ATOM 0 H ILE A 38 -14.571 9.981 -4.834 1.00 0.00 H new ATOM 0 HA ILE A 38 -15.710 12.503 -4.337 1.00 0.00 H new ATOM 0 HB ILE A 38 -16.824 9.694 -3.947 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -16.091 10.159 -6.242 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -17.835 10.014 -6.142 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -19.038 10.765 -4.073 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -18.108 11.339 -2.669 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -18.258 12.364 -4.116 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -17.192 11.871 -7.599 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -18.054 12.474 -6.163 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -16.283 12.620 -6.264 1.00 0.00 H new ATOM 597 N GLN A 39 -14.980 10.685 -1.722 1.00 0.00 N ATOM 598 CA GLN A 39 -14.893 10.684 -0.266 1.00 0.00 C ATOM 599 C GLN A 39 -14.370 12.021 0.249 1.00 0.00 C ATOM 600 O GLN A 39 -14.767 12.483 1.318 1.00 0.00 O ATOM 601 CB GLN A 39 -13.984 9.550 0.211 1.00 0.00 C ATOM 602 CG GLN A 39 -14.579 8.166 0.006 1.00 0.00 C ATOM 603 CD GLN A 39 -14.017 7.140 0.970 1.00 0.00 C ATOM 604 OE1 GLN A 39 -14.764 6.415 1.628 1.00 0.00 O ATOM 605 NE2 GLN A 39 -12.694 7.074 1.059 1.00 0.00 N ATOM 0 H GLN A 39 -14.487 9.916 -2.175 1.00 0.00 H new ATOM 0 HA GLN A 39 -15.896 10.529 0.132 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -13.034 9.610 -0.319 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -13.768 9.690 1.270 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -15.661 8.218 0.127 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -14.388 7.841 -1.017 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -12.113 7.694 0.495 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -12.258 6.403 1.692 1.00 0.00 H new ATOM 614 N ASP A 40 -13.478 12.637 -0.519 1.00 0.00 N ATOM 615 CA ASP A 40 -12.901 13.922 -0.141 1.00 0.00 C ATOM 616 C ASP A 40 -13.877 15.060 -0.423 1.00 0.00 C ATOM 617 O ASP A 40 -13.795 16.127 0.185 1.00 0.00 O ATOM 618 CB ASP A 40 -11.591 14.158 -0.894 1.00 0.00 C ATOM 619 CG ASP A 40 -10.771 15.281 -0.291 1.00 0.00 C ATOM 620 OD1 ASP A 40 -10.750 15.399 0.953 1.00 0.00 O ATOM 621 OD2 ASP A 40 -10.150 16.042 -1.062 1.00 0.00 O ATOM 0 H ASP A 40 -13.139 12.267 -1.407 1.00 0.00 H new ATOM 0 HA ASP A 40 -12.697 13.900 0.929 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -11.003 13.240 -0.890 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -11.811 14.392 -1.936 1.00 0.00 H new ATOM 626 N LYS A 41 -14.800 14.825 -1.349 1.00 0.00 N ATOM 627 CA LYS A 41 -15.793 15.829 -1.713 1.00 0.00 C ATOM 628 C LYS A 41 -16.941 15.847 -0.708 1.00 0.00 C ATOM 629 O LYS A 41 -17.309 16.902 -0.193 1.00 0.00 O ATOM 630 CB LYS A 41 -16.335 15.555 -3.117 1.00 0.00 C ATOM 631 CG LYS A 41 -15.254 15.219 -4.131 1.00 0.00 C ATOM 632 CD LYS A 41 -14.352 16.412 -4.400 1.00 0.00 C ATOM 633 CE LYS A 41 -13.146 16.418 -3.474 1.00 0.00 C ATOM 634 NZ LYS A 41 -12.045 17.269 -4.004 1.00 0.00 N ATOM 0 H LYS A 41 -14.881 13.947 -1.862 1.00 0.00 H new ATOM 0 HA LYS A 41 -15.308 16.805 -1.702 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -17.045 14.730 -3.069 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -16.886 16.430 -3.462 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -14.656 14.385 -3.764 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -15.716 14.894 -5.063 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -14.016 16.389 -5.437 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -14.918 17.334 -4.269 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -13.445 16.781 -2.491 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.785 15.398 -3.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -11.241 17.247 -3.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -11.742 16.908 -4.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.382 18.248 -4.107 1.00 0.00 H new ATOM 648 N GLU A 42 -17.501 14.673 -0.435 1.00 0.00 N ATOM 649 CA GLU A 42 -18.607 14.556 0.509 1.00 0.00 C ATOM 650 C GLU A 42 -18.254 13.601 1.645 1.00 0.00 C ATOM 651 O GLU A 42 -18.661 13.802 2.788 1.00 0.00 O ATOM 652 CB GLU A 42 -19.869 14.070 -0.208 1.00 0.00 C ATOM 653 CG GLU A 42 -20.480 15.107 -1.135 1.00 0.00 C ATOM 654 CD GLU A 42 -20.961 16.340 -0.395 1.00 0.00 C ATOM 655 OE1 GLU A 42 -21.459 16.193 0.740 1.00 0.00 O ATOM 656 OE2 GLU A 42 -20.839 17.452 -0.951 1.00 0.00 O ATOM 0 H GLU A 42 -17.208 13.790 -0.853 1.00 0.00 H new ATOM 0 HA GLU A 42 -18.796 15.542 0.933 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -19.628 13.177 -0.784 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -20.610 13.779 0.536 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -19.742 15.401 -1.882 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -21.317 14.661 -1.672 1.00 0.00 H new ATOM 663 N GLY A 43 -17.494 12.559 1.320 1.00 0.00 N ATOM 664 CA GLY A 43 -17.099 11.588 2.323 1.00 0.00 C ATOM 665 C GLY A 43 -18.251 10.704 2.759 1.00 0.00 C ATOM 666 O GLY A 43 -18.729 10.809 3.889 1.00 0.00 O ATOM 0 H GLY A 43 -17.145 12.371 0.380 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -16.297 10.965 1.926 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -16.697 12.110 3.191 1.00 0.00 H new ATOM 670 N ILE A 44 -18.699 9.833 1.862 1.00 0.00 N ATOM 671 CA ILE A 44 -19.803 8.928 2.161 1.00 0.00 C ATOM 672 C ILE A 44 -19.406 7.477 1.913 1.00 0.00 C ATOM 673 O ILE A 44 -18.554 7.174 1.078 1.00 0.00 O ATOM 674 CB ILE A 44 -21.047 9.261 1.316 1.00 0.00 C ATOM 675 CG1 ILE A 44 -20.664 9.419 -0.156 1.00 0.00 C ATOM 676 CG2 ILE A 44 -21.717 10.525 1.834 1.00 0.00 C ATOM 677 CD1 ILE A 44 -21.852 9.596 -1.075 1.00 0.00 C ATOM 0 H ILE A 44 -18.315 9.734 0.922 1.00 0.00 H new ATOM 0 HA ILE A 44 -20.044 9.060 3.216 1.00 0.00 H new ATOM 0 HB ILE A 44 -21.756 8.437 1.400 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -20.003 10.279 -0.260 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -20.098 8.542 -0.472 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -22.594 10.747 1.226 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -22.021 10.377 2.870 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -21.016 11.358 1.777 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -21.504 9.702 -2.103 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -22.503 8.725 -1.000 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -22.406 10.489 -0.786 1.00 0.00 H new ATOM 689 N PRO A 45 -20.041 6.556 2.653 1.00 0.00 N ATOM 690 CA PRO A 45 -19.773 5.120 2.530 1.00 0.00 C ATOM 691 C PRO A 45 -20.276 4.547 1.210 1.00 0.00 C ATOM 692 O PRO A 45 -21.108 5.142 0.525 1.00 0.00 O ATOM 693 CB PRO A 45 -20.544 4.513 3.705 1.00 0.00 C ATOM 694 CG PRO A 45 -21.634 5.489 3.987 1.00 0.00 C ATOM 695 CD PRO A 45 -21.069 6.845 3.667 1.00 0.00 C ATOM 0 HA PRO A 45 -18.705 4.902 2.545 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -20.947 3.533 3.450 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -19.900 4.377 4.574 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -22.513 5.279 3.378 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -21.948 5.433 5.029 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -21.835 7.519 3.282 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -20.641 7.320 4.549 1.00 0.00 H new ATOM 703 N PRO A 46 -19.762 3.364 0.842 1.00 0.00 N ATOM 704 CA PRO A 46 -20.146 2.685 -0.399 1.00 0.00 C ATOM 705 C PRO A 46 -21.577 2.159 -0.352 1.00 0.00 C ATOM 706 O PRO A 46 -22.191 1.911 -1.390 1.00 0.00 O ATOM 707 CB PRO A 46 -19.152 1.524 -0.490 1.00 0.00 C ATOM 708 CG PRO A 46 -18.744 1.263 0.918 1.00 0.00 C ATOM 709 CD PRO A 46 -18.765 2.599 1.610 1.00 0.00 C ATOM 0 HA PRO A 46 -20.118 3.356 -1.257 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -19.612 0.643 -0.938 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -18.294 1.785 -1.109 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -19.428 0.564 1.399 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -17.750 0.817 0.960 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -19.051 2.505 2.658 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -17.786 3.079 1.588 1.00 0.00 H new ATOM 717 N ASP A 47 -22.101 1.991 0.857 1.00 0.00 N ATOM 718 CA ASP A 47 -23.461 1.496 1.038 1.00 0.00 C ATOM 719 C ASP A 47 -24.483 2.572 0.682 1.00 0.00 C ATOM 720 O ASP A 47 -25.534 2.277 0.114 1.00 0.00 O ATOM 721 CB ASP A 47 -23.670 1.034 2.481 1.00 0.00 C ATOM 722 CG ASP A 47 -22.727 -0.086 2.872 1.00 0.00 C ATOM 723 OD1 ASP A 47 -23.058 -1.261 2.607 1.00 0.00 O ATOM 724 OD2 ASP A 47 -21.657 0.211 3.445 1.00 0.00 O ATOM 0 H ASP A 47 -21.605 2.190 1.726 1.00 0.00 H new ATOM 0 HA ASP A 47 -23.605 0.648 0.369 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -23.525 1.879 3.155 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -24.700 0.699 2.607 1.00 0.00 H new ATOM 729 N GLN A 48 -24.166 3.817 1.021 1.00 0.00 N ATOM 730 CA GLN A 48 -25.058 4.935 0.739 1.00 0.00 C ATOM 731 C GLN A 48 -24.669 5.627 -0.563 1.00 0.00 C ATOM 732 O GLN A 48 -25.498 6.267 -1.209 1.00 0.00 O ATOM 733 CB GLN A 48 -25.032 5.940 1.892 1.00 0.00 C ATOM 734 CG GLN A 48 -25.995 5.600 3.018 1.00 0.00 C ATOM 735 CD GLN A 48 -25.552 4.393 3.820 1.00 0.00 C ATOM 736 OE1 GLN A 48 -24.380 4.265 4.175 1.00 0.00 O ATOM 737 NE2 GLN A 48 -26.490 3.498 4.110 1.00 0.00 N ATOM 0 H GLN A 48 -23.299 4.077 1.491 1.00 0.00 H new ATOM 0 HA GLN A 48 -26.069 4.542 0.632 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -24.020 5.993 2.294 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -25.273 6.930 1.505 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -26.088 6.459 3.683 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -26.984 5.411 2.601 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -27.449 3.644 3.796 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -26.251 2.665 4.647 1.00 0.00 H new ATOM 746 N GLN A 49 -23.402 5.494 -0.942 1.00 0.00 N ATOM 747 CA GLN A 49 -22.903 6.108 -2.167 1.00 0.00 C ATOM 748 C GLN A 49 -23.450 5.391 -3.397 1.00 0.00 C ATOM 749 O GLN A 49 -23.573 4.166 -3.410 1.00 0.00 O ATOM 750 CB GLN A 49 -21.373 6.085 -2.187 1.00 0.00 C ATOM 751 CG GLN A 49 -20.770 6.795 -3.389 1.00 0.00 C ATOM 752 CD GLN A 49 -19.512 7.565 -3.041 1.00 0.00 C ATOM 753 OE1 GLN A 49 -19.332 8.707 -3.464 1.00 0.00 O ATOM 754 NE2 GLN A 49 -18.632 6.942 -2.266 1.00 0.00 N ATOM 0 H GLN A 49 -22.703 4.967 -0.419 1.00 0.00 H new ATOM 0 HA GLN A 49 -23.244 7.143 -2.190 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -20.999 6.550 -1.275 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -21.033 5.049 -2.179 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -20.540 6.062 -4.162 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -21.507 7.480 -3.809 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -18.822 5.995 -1.938 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -17.766 7.410 -1.999 1.00 0.00 H new ATOM 763 N ARG A 50 -23.777 6.162 -4.428 1.00 0.00 N ATOM 764 CA ARG A 50 -24.313 5.601 -5.663 1.00 0.00 C ATOM 765 C ARG A 50 -24.182 6.594 -6.814 1.00 0.00 C ATOM 766 O ARG A 50 -24.779 7.671 -6.790 1.00 0.00 O ATOM 767 CB ARG A 50 -25.781 5.212 -5.476 1.00 0.00 C ATOM 768 CG ARG A 50 -25.977 3.777 -5.014 1.00 0.00 C ATOM 769 CD ARG A 50 -27.310 3.218 -5.484 1.00 0.00 C ATOM 770 NE ARG A 50 -27.393 1.771 -5.300 1.00 0.00 N ATOM 771 CZ ARG A 50 -26.855 0.892 -6.137 1.00 0.00 C ATOM 772 NH1 ARG A 50 -26.200 1.309 -7.211 1.00 0.00 N ATOM 773 NH2 ARG A 50 -26.973 -0.409 -5.901 1.00 0.00 N ATOM 0 H ARG A 50 -23.680 7.177 -4.433 1.00 0.00 H new ATOM 0 HA ARG A 50 -23.736 4.710 -5.908 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -26.236 5.884 -4.749 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -26.309 5.357 -6.418 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -25.166 3.157 -5.396 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -25.926 3.734 -3.926 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -28.119 3.700 -4.935 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -27.452 3.458 -6.538 1.00 0.00 H new ATOM 0 HE ARG A 50 -27.892 1.417 -4.484 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -26.108 2.308 -7.396 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -25.788 0.631 -7.852 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -27.477 -0.734 -5.076 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -26.559 -1.084 -6.545 1.00 0.00 H new ATOM 787 N LEU A 51 -23.396 6.225 -7.819 1.00 0.00 N ATOM 788 CA LEU A 51 -23.185 7.084 -8.980 1.00 0.00 C ATOM 789 C LEU A 51 -24.148 6.723 -10.106 1.00 0.00 C ATOM 790 O LEU A 51 -24.424 5.547 -10.347 1.00 0.00 O ATOM 791 CB LEU A 51 -21.741 6.965 -9.471 1.00 0.00 C ATOM 792 CG LEU A 51 -20.697 7.757 -8.682 1.00 0.00 C ATOM 793 CD1 LEU A 51 -21.050 9.236 -8.665 1.00 0.00 C ATOM 794 CD2 LEU A 51 -20.579 7.219 -7.264 1.00 0.00 C ATOM 0 H LEU A 51 -22.894 5.338 -7.854 1.00 0.00 H new ATOM 0 HA LEU A 51 -23.376 8.114 -8.679 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -21.458 5.912 -9.455 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -21.704 7.289 -10.511 1.00 0.00 H new ATOM 0 HG LEU A 51 -19.732 7.640 -9.175 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -20.296 9.784 -8.099 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -21.082 9.614 -9.687 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -22.025 9.372 -8.197 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -19.832 7.794 -6.718 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -21.542 7.305 -6.761 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -20.278 6.172 -7.296 1.00 0.00 H new ATOM 806 N ILE A 52 -24.655 7.741 -10.794 1.00 0.00 N ATOM 807 CA ILE A 52 -25.584 7.530 -11.896 1.00 0.00 C ATOM 808 C ILE A 52 -25.017 8.072 -13.204 1.00 0.00 C ATOM 809 O ILE A 52 -24.300 9.072 -13.215 1.00 0.00 O ATOM 810 CB ILE A 52 -26.944 8.200 -11.623 1.00 0.00 C ATOM 811 CG1 ILE A 52 -27.387 7.934 -10.183 1.00 0.00 C ATOM 812 CG2 ILE A 52 -27.990 7.696 -12.606 1.00 0.00 C ATOM 813 CD1 ILE A 52 -27.467 6.463 -9.837 1.00 0.00 C ATOM 0 H ILE A 52 -24.438 8.720 -10.607 1.00 0.00 H new ATOM 0 HA ILE A 52 -25.730 6.453 -11.984 1.00 0.00 H new ATOM 0 HB ILE A 52 -26.836 9.276 -11.758 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -26.690 8.422 -9.501 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -28.364 8.391 -10.022 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -28.945 8.179 -12.400 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -27.677 7.931 -13.623 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -28.099 6.617 -12.500 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -27.787 6.350 -8.801 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -28.185 5.973 -10.494 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -26.486 6.005 -9.966 1.00 0.00 H new ATOM 825 N PHE A 53 -25.345 7.405 -14.306 1.00 0.00 N ATOM 826 CA PHE A 53 -24.869 7.820 -15.621 1.00 0.00 C ATOM 827 C PHE A 53 -25.954 7.627 -16.677 1.00 0.00 C ATOM 828 O PHE A 53 -26.357 6.502 -16.969 1.00 0.00 O ATOM 829 CB PHE A 53 -23.619 7.027 -16.007 1.00 0.00 C ATOM 830 CG PHE A 53 -23.046 7.423 -17.338 1.00 0.00 C ATOM 831 CD1 PHE A 53 -22.150 8.474 -17.437 1.00 0.00 C ATOM 832 CD2 PHE A 53 -23.404 6.742 -18.491 1.00 0.00 C ATOM 833 CE1 PHE A 53 -21.623 8.841 -18.661 1.00 0.00 C ATOM 834 CE2 PHE A 53 -22.880 7.103 -19.718 1.00 0.00 C ATOM 835 CZ PHE A 53 -21.987 8.154 -19.803 1.00 0.00 C ATOM 0 H PHE A 53 -25.938 6.575 -14.315 1.00 0.00 H new ATOM 0 HA PHE A 53 -24.618 8.880 -15.572 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -22.859 7.164 -15.238 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -23.864 5.965 -16.027 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -21.860 9.013 -16.548 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -24.101 5.919 -18.430 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -20.927 9.664 -18.725 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -23.168 6.565 -20.609 1.00 0.00 H new ATOM 0 HZ PHE A 53 -21.575 8.438 -20.760 1.00 0.00 H new ATOM 845 N ALA A 54 -26.421 8.734 -17.245 1.00 0.00 N ATOM 846 CA ALA A 54 -27.456 8.688 -18.270 1.00 0.00 C ATOM 847 C ALA A 54 -28.705 7.978 -17.757 1.00 0.00 C ATOM 848 O ALA A 54 -29.421 7.332 -18.521 1.00 0.00 O ATOM 849 CB ALA A 54 -26.931 8.000 -19.521 1.00 0.00 C ATOM 0 H ALA A 54 -26.099 9.673 -17.013 1.00 0.00 H new ATOM 0 HA ALA A 54 -27.730 9.713 -18.521 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -27.715 7.973 -20.278 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -26.073 8.551 -19.907 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -26.628 6.982 -19.276 1.00 0.00 H new ATOM 855 N GLY A 55 -28.959 8.101 -16.458 1.00 0.00 N ATOM 856 CA GLY A 55 -30.121 7.465 -15.866 1.00 0.00 C ATOM 857 C GLY A 55 -29.837 6.046 -15.415 1.00 0.00 C ATOM 858 O GLY A 55 -30.643 5.437 -14.709 1.00 0.00 O ATOM 0 H GLY A 55 -28.381 8.630 -15.805 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -30.459 8.054 -15.013 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -30.936 7.457 -16.590 1.00 0.00 H new ATOM 862 N LYS A 56 -28.690 5.514 -15.823 1.00 0.00 N ATOM 863 CA LYS A 56 -28.301 4.157 -15.458 1.00 0.00 C ATOM 864 C LYS A 56 -27.315 4.169 -14.295 1.00 0.00 C ATOM 865 O LYS A 56 -26.271 4.818 -14.361 1.00 0.00 O ATOM 866 CB LYS A 56 -27.681 3.442 -16.660 1.00 0.00 C ATOM 867 CG LYS A 56 -27.586 1.935 -16.488 1.00 0.00 C ATOM 868 CD LYS A 56 -28.826 1.234 -17.018 1.00 0.00 C ATOM 869 CE LYS A 56 -28.540 -0.220 -17.360 1.00 0.00 C ATOM 870 NZ LYS A 56 -28.143 -1.005 -16.158 1.00 0.00 N ATOM 0 H LYS A 56 -28.012 6.003 -16.408 1.00 0.00 H new ATOM 0 HA LYS A 56 -29.197 3.620 -15.146 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -28.274 3.661 -17.548 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -26.683 3.843 -16.836 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -26.705 1.563 -17.011 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -27.455 1.696 -15.433 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -29.620 1.284 -16.273 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -29.188 1.753 -17.905 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -29.426 -0.668 -17.810 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -27.745 -0.268 -18.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -28.023 -2.004 -16.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -27.247 -0.635 -15.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -28.882 -0.925 -15.431 1.00 0.00 H new ATOM 884 N GLN A 57 -27.651 3.445 -13.232 1.00 0.00 N ATOM 885 CA GLN A 57 -26.794 3.372 -12.055 1.00 0.00 C ATOM 886 C GLN A 57 -25.475 2.679 -12.385 1.00 0.00 C ATOM 887 O GLN A 57 -25.416 1.822 -13.267 1.00 0.00 O ATOM 888 CB GLN A 57 -27.506 2.628 -10.924 1.00 0.00 C ATOM 889 CG GLN A 57 -27.883 1.199 -11.279 1.00 0.00 C ATOM 890 CD GLN A 57 -29.286 1.089 -11.844 1.00 0.00 C ATOM 891 OE1 GLN A 57 -29.945 2.097 -12.100 1.00 0.00 O ATOM 892 NE2 GLN A 57 -29.750 -0.140 -12.041 1.00 0.00 N ATOM 0 H GLN A 57 -28.511 2.901 -13.162 1.00 0.00 H new ATOM 0 HA GLN A 57 -26.578 4.390 -11.730 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -26.861 2.617 -10.045 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -28.408 3.176 -10.651 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -27.171 0.809 -12.006 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -27.804 0.575 -10.389 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -29.169 -0.947 -11.815 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -30.688 -0.277 -12.419 1.00 0.00 H new ATOM 901 N LEU A 58 -24.420 3.056 -11.671 1.00 0.00 N ATOM 902 CA LEU A 58 -23.102 2.471 -11.887 1.00 0.00 C ATOM 903 C LEU A 58 -22.673 1.635 -10.685 1.00 0.00 C ATOM 904 O LEU A 58 -23.087 1.897 -9.556 1.00 0.00 O ATOM 905 CB LEU A 58 -22.072 3.570 -12.152 1.00 0.00 C ATOM 906 CG LEU A 58 -22.510 4.686 -13.101 1.00 0.00 C ATOM 907 CD1 LEU A 58 -21.572 5.878 -12.993 1.00 0.00 C ATOM 908 CD2 LEU A 58 -22.565 4.176 -14.534 1.00 0.00 C ATOM 0 H LEU A 58 -24.452 3.764 -10.938 1.00 0.00 H new ATOM 0 HA LEU A 58 -23.160 1.818 -12.758 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -21.796 4.019 -11.198 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -21.173 3.107 -12.558 1.00 0.00 H new ATOM 0 HG LEU A 58 -23.510 5.010 -12.813 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -21.900 6.662 -13.676 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -21.583 6.258 -11.972 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -20.560 5.569 -13.254 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -22.879 4.983 -15.196 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -21.578 3.824 -14.833 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -23.278 3.355 -14.601 1.00 0.00 H new ATOM 920 N GLU A 59 -21.839 0.631 -10.936 1.00 0.00 N ATOM 921 CA GLU A 59 -21.353 -0.242 -9.874 1.00 0.00 C ATOM 922 C GLU A 59 -19.916 -0.678 -10.142 1.00 0.00 C ATOM 923 O GLU A 59 -19.288 -0.227 -11.100 1.00 0.00 O ATOM 924 CB GLU A 59 -22.254 -1.471 -9.741 1.00 0.00 C ATOM 925 CG GLU A 59 -22.400 -2.261 -11.031 1.00 0.00 C ATOM 926 CD GLU A 59 -23.175 -3.551 -10.841 1.00 0.00 C ATOM 927 OE1 GLU A 59 -22.556 -4.560 -10.442 1.00 0.00 O ATOM 928 OE2 GLU A 59 -24.398 -3.551 -11.091 1.00 0.00 O ATOM 0 H GLU A 59 -21.486 0.402 -11.865 1.00 0.00 H new ATOM 0 HA GLU A 59 -21.376 0.319 -8.940 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -21.850 -2.125 -8.968 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -23.241 -1.153 -9.406 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -22.905 -1.645 -11.775 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -21.410 -2.491 -11.426 1.00 0.00 H new ATOM 935 N ASP A 60 -19.401 -1.557 -9.290 1.00 0.00 N ATOM 936 CA ASP A 60 -18.038 -2.055 -9.434 1.00 0.00 C ATOM 937 C ASP A 60 -17.976 -3.176 -10.467 1.00 0.00 C ATOM 938 O ASP A 60 -18.832 -4.059 -10.492 1.00 0.00 O ATOM 939 CB ASP A 60 -17.510 -2.555 -8.089 1.00 0.00 C ATOM 940 CG ASP A 60 -17.971 -1.694 -6.929 1.00 0.00 C ATOM 941 OD1 ASP A 60 -18.101 -0.466 -7.117 1.00 0.00 O ATOM 942 OD2 ASP A 60 -18.203 -2.248 -5.835 1.00 0.00 O ATOM 0 H ASP A 60 -19.907 -1.940 -8.492 1.00 0.00 H new ATOM 0 HA ASP A 60 -17.411 -1.232 -9.778 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -17.842 -3.581 -7.930 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -16.420 -2.573 -8.114 1.00 0.00 H new ATOM 947 N GLY A 61 -16.957 -3.132 -11.320 1.00 0.00 N ATOM 948 CA GLY A 61 -16.802 -4.148 -12.345 1.00 0.00 C ATOM 949 C GLY A 61 -16.254 -3.585 -13.641 1.00 0.00 C ATOM 950 O GLY A 61 -15.182 -3.986 -14.095 1.00 0.00 O ATOM 0 H GLY A 61 -16.236 -2.411 -11.319 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -16.134 -4.929 -11.980 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -17.767 -4.618 -12.536 1.00 0.00 H new ATOM 954 N ARG A 62 -16.991 -2.656 -14.240 1.00 0.00 N ATOM 955 CA ARG A 62 -16.574 -2.040 -15.493 1.00 0.00 C ATOM 956 C ARG A 62 -15.702 -0.815 -15.233 1.00 0.00 C ATOM 957 O ARG A 62 -15.608 -0.334 -14.103 1.00 0.00 O ATOM 958 CB ARG A 62 -17.796 -1.642 -16.323 1.00 0.00 C ATOM 959 CG ARG A 62 -18.730 -2.802 -16.625 1.00 0.00 C ATOM 960 CD ARG A 62 -18.008 -3.922 -17.358 1.00 0.00 C ATOM 961 NE ARG A 62 -18.940 -4.876 -17.953 1.00 0.00 N ATOM 962 CZ ARG A 62 -18.563 -5.882 -18.735 1.00 0.00 C ATOM 963 NH1 ARG A 62 -17.279 -6.063 -19.014 1.00 0.00 N ATOM 964 NH2 ARG A 62 -19.470 -6.708 -19.239 1.00 0.00 N ATOM 0 H ARG A 62 -17.881 -2.313 -13.877 1.00 0.00 H new ATOM 0 HA ARG A 62 -15.988 -2.771 -16.050 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -18.350 -0.869 -15.791 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -17.460 -1.203 -17.262 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -19.149 -3.185 -15.694 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -19.566 -2.450 -17.229 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -17.377 -3.497 -18.138 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -17.349 -4.444 -16.664 1.00 0.00 H new ATOM 0 HE ARG A 62 -19.935 -4.764 -17.758 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -16.579 -5.429 -18.628 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -16.992 -6.836 -19.614 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -20.458 -6.571 -19.026 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -19.179 -7.480 -19.839 1.00 0.00 H new ATOM 978 N THR A 63 -15.064 -0.314 -16.287 1.00 0.00 N ATOM 979 CA THR A 63 -14.198 0.853 -16.173 1.00 0.00 C ATOM 980 C THR A 63 -14.896 2.107 -16.686 1.00 0.00 C ATOM 981 O THR A 63 -15.860 2.026 -17.449 1.00 0.00 O ATOM 982 CB THR A 63 -12.884 0.656 -16.952 1.00 0.00 C ATOM 983 OG1 THR A 63 -12.198 1.906 -17.080 1.00 0.00 O ATOM 984 CG2 THR A 63 -13.155 0.076 -18.333 1.00 0.00 C ATOM 0 H THR A 63 -15.131 -0.699 -17.229 1.00 0.00 H new ATOM 0 HA THR A 63 -13.969 0.975 -15.114 1.00 0.00 H new ATOM 0 HB THR A 63 -12.260 -0.045 -16.397 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.056 2.294 -16.191 1.00 0.00 H new ATOM 0 HG21 THR A 63 -12.212 -0.054 -18.864 1.00 0.00 H new ATOM 0 HG22 THR A 63 -13.651 -0.889 -18.231 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.797 0.756 -18.894 1.00 0.00 H new ATOM 992 N LEU A 64 -14.405 3.267 -16.262 1.00 0.00 N ATOM 993 CA LEU A 64 -14.982 4.540 -16.680 1.00 0.00 C ATOM 994 C LEU A 64 -15.082 4.620 -18.199 1.00 0.00 C ATOM 995 O LEU A 64 -16.013 5.219 -18.739 1.00 0.00 O ATOM 996 CB LEU A 64 -14.139 5.702 -16.151 1.00 0.00 C ATOM 997 CG LEU A 64 -14.313 6.038 -14.669 1.00 0.00 C ATOM 998 CD1 LEU A 64 -15.780 6.268 -14.343 1.00 0.00 C ATOM 999 CD2 LEU A 64 -13.739 4.929 -13.800 1.00 0.00 C ATOM 0 H LEU A 64 -13.609 3.352 -15.630 1.00 0.00 H new ATOM 0 HA LEU A 64 -15.987 4.609 -16.264 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -13.088 5.473 -16.330 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -14.376 6.592 -16.735 1.00 0.00 H new ATOM 0 HG LEU A 64 -13.767 6.957 -14.458 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -15.885 6.506 -13.284 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -16.160 7.097 -14.940 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -16.349 5.366 -14.570 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -13.872 5.185 -12.749 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -14.257 3.994 -14.014 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -12.677 4.812 -14.014 1.00 0.00 H new ATOM 1011 N SER A 65 -14.120 4.011 -18.884 1.00 0.00 N ATOM 1012 CA SER A 65 -14.099 4.015 -20.342 1.00 0.00 C ATOM 1013 C SER A 65 -15.199 3.120 -20.904 1.00 0.00 C ATOM 1014 O SER A 65 -15.754 3.393 -21.967 1.00 0.00 O ATOM 1015 CB SER A 65 -12.735 3.549 -20.855 1.00 0.00 C ATOM 1016 OG SER A 65 -12.743 3.404 -22.265 1.00 0.00 O ATOM 0 H SER A 65 -13.344 3.508 -18.453 1.00 0.00 H new ATOM 0 HA SER A 65 -14.277 5.036 -20.680 1.00 0.00 H new ATOM 0 HB2 SER A 65 -11.969 4.268 -20.564 1.00 0.00 H new ATOM 0 HB3 SER A 65 -12.473 2.599 -20.390 1.00 0.00 H new ATOM 0 HG SER A 65 -11.860 3.107 -22.568 1.00 0.00 H new ATOM 1022 N GLU A 66 -15.509 2.048 -20.180 1.00 0.00 N ATOM 1023 CA GLU A 66 -16.542 1.112 -20.606 1.00 0.00 C ATOM 1024 C GLU A 66 -17.933 1.702 -20.393 1.00 0.00 C ATOM 1025 O GLU A 66 -18.892 1.315 -21.061 1.00 0.00 O ATOM 1026 CB GLU A 66 -16.413 -0.207 -19.841 1.00 0.00 C ATOM 1027 CG GLU A 66 -15.372 -1.149 -20.422 1.00 0.00 C ATOM 1028 CD GLU A 66 -15.851 -1.842 -21.682 1.00 0.00 C ATOM 1029 OE1 GLU A 66 -17.009 -2.310 -21.697 1.00 0.00 O ATOM 1030 OE2 GLU A 66 -15.070 -1.916 -22.653 1.00 0.00 O ATOM 0 H GLU A 66 -15.059 1.807 -19.297 1.00 0.00 H new ATOM 0 HA GLU A 66 -16.406 0.921 -21.671 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -16.157 0.008 -18.804 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -17.381 -0.709 -19.833 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -14.464 -0.589 -20.643 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -15.110 -1.900 -19.676 1.00 0.00 H new ATOM 1037 N TYR A 67 -18.034 2.641 -19.459 1.00 0.00 N ATOM 1038 CA TYR A 67 -19.307 3.283 -19.155 1.00 0.00 C ATOM 1039 C TYR A 67 -19.499 4.539 -20.000 1.00 0.00 C ATOM 1040 O TYR A 67 -20.385 5.350 -19.734 1.00 0.00 O ATOM 1041 CB TYR A 67 -19.382 3.638 -17.669 1.00 0.00 C ATOM 1042 CG TYR A 67 -19.979 2.543 -16.814 1.00 0.00 C ATOM 1043 CD1 TYR A 67 -21.219 1.994 -17.120 1.00 0.00 C ATOM 1044 CD2 TYR A 67 -19.306 2.058 -15.700 1.00 0.00 C ATOM 1045 CE1 TYR A 67 -21.769 0.994 -16.342 1.00 0.00 C ATOM 1046 CE2 TYR A 67 -19.848 1.058 -14.917 1.00 0.00 C ATOM 1047 CZ TYR A 67 -21.079 0.529 -15.242 1.00 0.00 C ATOM 1048 OH TYR A 67 -21.623 -0.467 -14.463 1.00 0.00 O ATOM 0 H TYR A 67 -17.249 2.975 -18.899 1.00 0.00 H new ATOM 0 HA TYR A 67 -20.105 2.580 -19.394 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -18.379 3.864 -17.307 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -19.975 4.545 -17.550 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -21.762 2.356 -17.981 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -18.342 2.470 -15.442 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -22.734 0.579 -16.594 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -19.310 0.692 -14.055 1.00 0.00 H new ATOM 0 HH TYR A 67 -21.010 -0.680 -13.729 1.00 0.00 H new ATOM 1058 N ASN A 68 -18.661 4.692 -21.020 1.00 0.00 N ATOM 1059 CA ASN A 68 -18.737 5.848 -21.905 1.00 0.00 C ATOM 1060 C ASN A 68 -18.545 7.145 -21.124 1.00 0.00 C ATOM 1061 O ASN A 68 -18.977 8.213 -21.558 1.00 0.00 O ATOM 1062 CB ASN A 68 -20.083 5.872 -22.632 1.00 0.00 C ATOM 1063 CG ASN A 68 -20.418 4.539 -23.272 1.00 0.00 C ATOM 1064 OD1 ASN A 68 -21.196 3.755 -22.727 1.00 0.00 O ATOM 1065 ND2 ASN A 68 -19.831 4.276 -24.434 1.00 0.00 N ATOM 0 H ASN A 68 -17.921 4.030 -21.254 1.00 0.00 H new ATOM 0 HA ASN A 68 -17.936 5.765 -22.640 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -20.869 6.141 -21.927 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -20.065 6.646 -23.399 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -20.018 3.395 -24.912 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -19.193 4.956 -24.849 1.00 0.00 H new ATOM 1072 N ILE A 69 -17.895 7.043 -19.969 1.00 0.00 N ATOM 1073 CA ILE A 69 -17.645 8.207 -19.129 1.00 0.00 C ATOM 1074 C ILE A 69 -16.372 8.930 -19.556 1.00 0.00 C ATOM 1075 O ILE A 69 -15.267 8.530 -19.190 1.00 0.00 O ATOM 1076 CB ILE A 69 -17.525 7.814 -17.644 1.00 0.00 C ATOM 1077 CG1 ILE A 69 -18.813 7.140 -17.167 1.00 0.00 C ATOM 1078 CG2 ILE A 69 -17.216 9.038 -16.796 1.00 0.00 C ATOM 1079 CD1 ILE A 69 -18.614 6.237 -15.970 1.00 0.00 C ATOM 0 H ILE A 69 -17.532 6.166 -19.594 1.00 0.00 H new ATOM 0 HA ILE A 69 -18.498 8.874 -19.252 1.00 0.00 H new ATOM 0 HB ILE A 69 -16.704 7.105 -17.536 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -19.544 7.908 -16.915 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -19.233 6.557 -17.986 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -17.134 8.744 -15.749 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -16.275 9.479 -17.124 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -18.017 9.769 -16.906 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -19.568 5.793 -15.686 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -17.907 5.447 -16.224 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -18.223 6.819 -15.136 1.00 0.00 H new ATOM 1091 N GLN A 70 -16.537 9.998 -20.330 1.00 0.00 N ATOM 1092 CA GLN A 70 -15.400 10.778 -20.806 1.00 0.00 C ATOM 1093 C GLN A 70 -15.031 11.868 -19.806 1.00 0.00 C ATOM 1094 O GLN A 70 -15.531 11.888 -18.681 1.00 0.00 O ATOM 1095 CB GLN A 70 -15.717 11.403 -22.166 1.00 0.00 C ATOM 1096 CG GLN A 70 -16.259 10.409 -23.181 1.00 0.00 C ATOM 1097 CD GLN A 70 -16.521 11.042 -24.534 1.00 0.00 C ATOM 1098 OE1 GLN A 70 -15.990 10.599 -25.553 1.00 0.00 O ATOM 1099 NE2 GLN A 70 -17.345 12.083 -24.551 1.00 0.00 N ATOM 0 H GLN A 70 -17.445 10.343 -20.641 1.00 0.00 H new ATOM 0 HA GLN A 70 -14.549 10.105 -20.913 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -16.445 12.202 -22.028 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -14.812 11.861 -22.566 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -15.548 9.591 -23.298 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -17.184 9.976 -22.801 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -17.763 12.417 -23.683 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -17.560 12.549 -25.433 1.00 0.00 H new ATOM 1108 N LYS A 71 -14.152 12.773 -20.222 1.00 0.00 N ATOM 1109 CA LYS A 71 -13.715 13.868 -19.364 1.00 0.00 C ATOM 1110 C LYS A 71 -14.785 14.951 -19.277 1.00 0.00 C ATOM 1111 O LYS A 71 -14.757 15.793 -18.380 1.00 0.00 O ATOM 1112 CB LYS A 71 -12.409 14.467 -19.891 1.00 0.00 C ATOM 1113 CG LYS A 71 -12.560 15.172 -21.228 1.00 0.00 C ATOM 1114 CD LYS A 71 -11.746 14.488 -22.314 1.00 0.00 C ATOM 1115 CE LYS A 71 -10.472 15.258 -22.624 1.00 0.00 C ATOM 1116 NZ LYS A 71 -10.012 15.030 -24.022 1.00 0.00 N ATOM 0 H LYS A 71 -13.728 12.770 -21.150 1.00 0.00 H new ATOM 0 HA LYS A 71 -13.546 13.468 -18.364 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -12.022 15.175 -19.158 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -11.669 13.673 -19.990 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -13.611 15.188 -21.515 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -12.240 16.210 -21.131 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -11.493 13.476 -21.998 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -12.347 14.398 -23.219 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -10.644 16.323 -22.468 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -9.688 14.957 -21.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -9.141 15.572 -24.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -9.823 14.017 -24.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -10.750 15.341 -24.685 1.00 0.00 H new ATOM 1130 N GLU A 72 -15.728 14.922 -20.214 1.00 0.00 N ATOM 1131 CA GLU A 72 -16.807 15.902 -20.241 1.00 0.00 C ATOM 1132 C GLU A 72 -18.155 15.234 -19.988 1.00 0.00 C ATOM 1133 O GLU A 72 -19.200 15.749 -20.388 1.00 0.00 O ATOM 1134 CB GLU A 72 -16.831 16.631 -21.586 1.00 0.00 C ATOM 1135 CG GLU A 72 -15.666 17.586 -21.782 1.00 0.00 C ATOM 1136 CD GLU A 72 -15.603 18.150 -23.188 1.00 0.00 C ATOM 1137 OE1 GLU A 72 -15.254 17.391 -24.116 1.00 0.00 O ATOM 1138 OE2 GLU A 72 -15.904 19.350 -23.361 1.00 0.00 O ATOM 0 H GLU A 72 -15.766 14.231 -20.963 1.00 0.00 H new ATOM 0 HA GLU A 72 -16.625 16.626 -19.447 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -16.825 15.894 -22.389 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -17.764 17.188 -21.671 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -15.750 18.406 -21.069 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -14.734 17.066 -21.561 1.00 0.00 H new ATOM 1145 N SER A 73 -18.124 14.084 -19.323 1.00 0.00 N ATOM 1146 CA SER A 73 -19.342 13.342 -19.020 1.00 0.00 C ATOM 1147 C SER A 73 -20.114 14.006 -17.883 1.00 0.00 C ATOM 1148 O SER A 73 -19.659 14.990 -17.299 1.00 0.00 O ATOM 1149 CB SER A 73 -19.005 11.897 -18.647 1.00 0.00 C ATOM 1150 OG SER A 73 -19.018 11.059 -19.790 1.00 0.00 O ATOM 0 H SER A 73 -17.268 13.645 -18.983 1.00 0.00 H new ATOM 0 HA SER A 73 -19.970 13.343 -19.911 1.00 0.00 H new ATOM 0 HB2 SER A 73 -18.023 11.859 -18.176 1.00 0.00 H new ATOM 0 HB3 SER A 73 -19.724 11.530 -17.915 1.00 0.00 H new ATOM 0 HG SER A 73 -19.940 10.949 -20.105 1.00 0.00 H new ATOM 1156 N THR A 74 -21.286 13.459 -17.574 1.00 0.00 N ATOM 1157 CA THR A 74 -22.123 13.998 -16.509 1.00 0.00 C ATOM 1158 C THR A 74 -22.488 12.917 -15.498 1.00 0.00 C ATOM 1159 O THR A 74 -23.215 11.975 -15.816 1.00 0.00 O ATOM 1160 CB THR A 74 -23.416 14.618 -17.070 1.00 0.00 C ATOM 1161 OG1 THR A 74 -23.206 15.053 -18.418 1.00 0.00 O ATOM 1162 CG2 THR A 74 -23.866 15.794 -16.217 1.00 0.00 C ATOM 0 H THR A 74 -21.677 12.644 -18.046 1.00 0.00 H new ATOM 0 HA THR A 74 -21.542 14.776 -16.013 1.00 0.00 H new ATOM 0 HB THR A 74 -24.196 13.857 -17.052 1.00 0.00 H new ATOM 0 HG1 THR A 74 -24.033 15.444 -18.768 1.00 0.00 H new ATOM 0 HG21 THR A 74 -24.781 16.216 -16.633 1.00 0.00 H new ATOM 0 HG22 THR A 74 -24.053 15.454 -15.198 1.00 0.00 H new ATOM 0 HG23 THR A 74 -23.087 16.556 -16.208 1.00 0.00 H new ATOM 1170 N LEU A 75 -21.980 13.058 -14.279 1.00 0.00 N ATOM 1171 CA LEU A 75 -22.253 12.094 -13.219 1.00 0.00 C ATOM 1172 C LEU A 75 -23.217 12.675 -12.189 1.00 0.00 C ATOM 1173 O LEU A 75 -23.291 13.891 -12.010 1.00 0.00 O ATOM 1174 CB LEU A 75 -20.951 11.674 -12.536 1.00 0.00 C ATOM 1175 CG LEU A 75 -20.280 10.414 -13.086 1.00 0.00 C ATOM 1176 CD1 LEU A 75 -21.107 9.181 -12.756 1.00 0.00 C ATOM 1177 CD2 LEU A 75 -20.074 10.534 -14.589 1.00 0.00 C ATOM 0 H LEU A 75 -21.376 13.831 -14.000 1.00 0.00 H new ATOM 0 HA LEU A 75 -22.718 11.218 -13.670 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -20.243 12.500 -12.609 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -21.153 11.520 -11.476 1.00 0.00 H new ATOM 0 HG LEU A 75 -19.304 10.308 -12.612 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -20.614 8.295 -13.155 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -21.203 9.086 -11.674 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -22.097 9.277 -13.202 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -19.596 9.629 -14.964 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -21.039 10.664 -15.079 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -19.440 11.395 -14.802 1.00 0.00 H new ATOM 1189 N HIS A 76 -23.951 11.798 -11.512 1.00 0.00 N ATOM 1190 CA HIS A 76 -24.908 12.224 -10.497 1.00 0.00 C ATOM 1191 C HIS A 76 -24.780 11.372 -9.238 1.00 0.00 C ATOM 1192 O HIS A 76 -24.769 10.142 -9.307 1.00 0.00 O ATOM 1193 CB HIS A 76 -26.334 12.138 -11.042 1.00 0.00 C ATOM 1194 CG HIS A 76 -26.787 13.386 -11.735 1.00 0.00 C ATOM 1195 ND1 HIS A 76 -27.688 14.270 -11.181 1.00 0.00 N ATOM 1196 CD2 HIS A 76 -26.455 13.898 -12.944 1.00 0.00 C ATOM 1197 CE1 HIS A 76 -27.894 15.270 -12.019 1.00 0.00 C ATOM 1198 NE2 HIS A 76 -27.157 15.069 -13.096 1.00 0.00 N ATOM 0 H HIS A 76 -23.902 10.788 -11.648 1.00 0.00 H new ATOM 0 HA HIS A 76 -24.688 13.260 -10.238 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -26.398 11.302 -11.738 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -27.016 11.921 -10.220 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -25.767 13.466 -13.656 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -28.553 16.109 -11.852 1.00 0.00 H new ATOM 0 HE2 HIS A 76 -27.116 15.684 -13.909 1.00 0.00 H new ATOM 1206 N LEU A 77 -24.683 12.032 -8.090 1.00 0.00 N ATOM 1207 CA LEU A 77 -24.555 11.336 -6.815 1.00 0.00 C ATOM 1208 C LEU A 77 -25.908 11.217 -6.120 1.00 0.00 C ATOM 1209 O LEU A 77 -26.516 12.221 -5.747 1.00 0.00 O ATOM 1210 CB LEU A 77 -23.566 12.069 -5.907 1.00 0.00 C ATOM 1211 CG LEU A 77 -22.235 12.465 -6.547 1.00 0.00 C ATOM 1212 CD1 LEU A 77 -22.249 13.933 -6.944 1.00 0.00 C ATOM 1213 CD2 LEU A 77 -21.081 12.179 -5.597 1.00 0.00 C ATOM 0 H LEU A 77 -24.691 13.049 -8.016 1.00 0.00 H new ATOM 0 HA LEU A 77 -24.180 10.332 -7.015 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -24.048 12.971 -5.531 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -23.358 11.436 -5.044 1.00 0.00 H new ATOM 0 HG LEU A 77 -22.095 11.868 -7.448 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -21.294 14.196 -7.398 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -23.052 14.109 -7.660 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -22.412 14.548 -6.059 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -20.141 12.467 -6.069 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -21.216 12.750 -4.678 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -21.058 11.115 -5.362 1.00 0.00 H new ATOM 1225 N VAL A 78 -26.374 9.984 -5.949 1.00 0.00 N ATOM 1226 CA VAL A 78 -27.654 9.734 -5.297 1.00 0.00 C ATOM 1227 C VAL A 78 -27.462 8.998 -3.975 1.00 0.00 C ATOM 1228 O VAL A 78 -26.894 7.906 -3.936 1.00 0.00 O ATOM 1229 CB VAL A 78 -28.592 8.910 -6.198 1.00 0.00 C ATOM 1230 CG1 VAL A 78 -29.166 9.779 -7.307 1.00 0.00 C ATOM 1231 CG2 VAL A 78 -27.857 7.711 -6.777 1.00 0.00 C ATOM 0 H VAL A 78 -25.884 9.143 -6.253 1.00 0.00 H new ATOM 0 HA VAL A 78 -28.107 10.707 -5.107 1.00 0.00 H new ATOM 0 HB VAL A 78 -29.419 8.542 -5.591 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -29.826 9.180 -7.934 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -29.730 10.603 -6.869 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -28.353 10.178 -7.914 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -28.535 7.140 -7.411 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -27.009 8.055 -7.370 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -27.499 7.077 -5.966 1.00 0.00 H new ATOM 1241 N LEU A 79 -27.939 9.604 -2.893 1.00 0.00 N ATOM 1242 CA LEU A 79 -27.822 9.006 -1.567 1.00 0.00 C ATOM 1243 C LEU A 79 -29.165 8.461 -1.095 1.00 0.00 C ATOM 1244 O LEU A 79 -30.188 9.140 -1.183 1.00 0.00 O ATOM 1245 CB LEU A 79 -27.296 10.037 -0.567 1.00 0.00 C ATOM 1246 CG LEU A 79 -25.779 10.226 -0.532 1.00 0.00 C ATOM 1247 CD1 LEU A 79 -25.090 8.935 -0.116 1.00 0.00 C ATOM 1248 CD2 LEU A 79 -25.269 10.693 -1.887 1.00 0.00 C ATOM 0 H LEU A 79 -28.410 10.509 -2.908 1.00 0.00 H new ATOM 0 HA LEU A 79 -27.117 8.177 -1.630 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -27.757 10.999 -0.792 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -27.629 9.749 0.430 1.00 0.00 H new ATOM 0 HG LEU A 79 -25.544 10.993 0.206 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -24.011 9.088 -0.097 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -25.433 8.643 0.877 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -25.332 8.147 -0.830 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -24.188 10.822 -1.844 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -25.516 9.949 -2.645 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -25.738 11.643 -2.145 1.00 0.00 H new ATOM 1260 N ARG A 80 -29.155 7.231 -0.591 1.00 0.00 N ATOM 1261 CA ARG A 80 -30.372 6.595 -0.103 1.00 0.00 C ATOM 1262 C ARG A 80 -30.050 5.539 0.951 1.00 0.00 C ATOM 1263 O ARG A 80 -28.944 4.997 0.984 1.00 0.00 O ATOM 1264 CB ARG A 80 -31.139 5.955 -1.262 1.00 0.00 C ATOM 1265 CG ARG A 80 -32.291 6.805 -1.773 1.00 0.00 C ATOM 1266 CD ARG A 80 -31.890 7.604 -3.004 1.00 0.00 C ATOM 1267 NE ARG A 80 -32.259 6.923 -4.242 1.00 0.00 N ATOM 1268 CZ ARG A 80 -32.284 7.519 -5.429 1.00 0.00 C ATOM 1269 NH1 ARG A 80 -31.964 8.802 -5.538 1.00 0.00 N ATOM 1270 NH2 ARG A 80 -32.630 6.833 -6.510 1.00 0.00 N ATOM 0 H ARG A 80 -28.317 6.655 -0.510 1.00 0.00 H new ATOM 0 HA ARG A 80 -30.994 7.364 0.356 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -30.448 5.764 -2.083 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -31.527 4.988 -0.940 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -33.139 6.164 -2.014 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -32.619 7.485 -0.987 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -32.368 8.583 -2.972 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -30.813 7.774 -2.991 1.00 0.00 H new ATOM 0 HE ARG A 80 -32.511 5.936 -4.193 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -31.698 9.333 -4.709 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -31.984 9.257 -6.451 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -32.877 5.847 -6.431 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -32.649 7.292 -7.421 1.00 0.00 H new ATOM 1284 N LEU A 81 -31.021 5.253 1.811 1.00 0.00 N ATOM 1285 CA LEU A 81 -30.841 4.263 2.867 1.00 0.00 C ATOM 1286 C LEU A 81 -32.183 3.689 3.310 1.00 0.00 C ATOM 1287 O LEU A 81 -32.328 3.225 4.441 1.00 0.00 O ATOM 1288 CB LEU A 81 -30.121 4.889 4.062 1.00 0.00 C ATOM 1289 CG LEU A 81 -30.520 6.323 4.410 1.00 0.00 C ATOM 1290 CD1 LEU A 81 -29.862 7.307 3.455 1.00 0.00 C ATOM 1291 CD2 LEU A 81 -32.034 6.478 4.380 1.00 0.00 C ATOM 0 H LEU A 81 -31.941 5.693 1.798 1.00 0.00 H new ATOM 0 HA LEU A 81 -30.233 3.450 2.470 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -30.297 4.262 4.936 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -29.049 4.869 3.866 1.00 0.00 H new ATOM 0 HG LEU A 81 -30.173 6.541 5.420 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -30.158 8.323 3.718 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -28.778 7.214 3.527 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -30.178 7.090 2.435 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -32.300 7.505 4.630 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -32.404 6.240 3.383 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -32.484 5.800 5.105 1.00 0.00 H new ATOM 1303 N ARG A 82 -33.161 3.722 2.410 1.00 0.00 N ATOM 1304 CA ARG A 82 -34.491 3.204 2.708 1.00 0.00 C ATOM 1305 C ARG A 82 -34.555 1.699 2.468 1.00 0.00 C ATOM 1306 O ARG A 82 -34.962 0.937 3.343 1.00 0.00 O ATOM 1307 CB ARG A 82 -35.541 3.913 1.852 1.00 0.00 C ATOM 1308 CG ARG A 82 -36.969 3.667 2.311 1.00 0.00 C ATOM 1309 CD ARG A 82 -37.374 4.632 3.414 1.00 0.00 C ATOM 1310 NE ARG A 82 -37.292 6.025 2.980 1.00 0.00 N ATOM 1311 CZ ARG A 82 -37.317 7.057 3.816 1.00 0.00 C ATOM 1312 NH1 ARG A 82 -37.420 6.855 5.122 1.00 0.00 N ATOM 1313 NH2 ARG A 82 -37.237 8.295 3.345 1.00 0.00 N ATOM 0 H ARG A 82 -33.057 4.102 1.469 1.00 0.00 H new ATOM 0 HA ARG A 82 -34.701 3.396 3.760 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -35.344 4.985 1.865 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -35.439 3.582 0.818 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -37.648 3.774 1.465 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -37.066 2.642 2.669 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -38.393 4.411 3.733 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -36.729 4.484 4.280 1.00 0.00 H new ATOM 0 HE ARG A 82 -37.211 6.215 1.981 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -37.480 5.905 5.488 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -37.439 7.650 5.761 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -37.156 8.454 2.341 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -37.256 9.087 3.987 1.00 0.00 H new ATOM 1327 N GLY A 83 -34.149 1.278 1.274 1.00 0.00 N ATOM 1328 CA GLY A 83 -34.168 -0.134 0.939 1.00 0.00 C ATOM 1329 C GLY A 83 -35.575 -0.695 0.872 1.00 0.00 C ATOM 1330 O GLY A 83 -35.788 -1.886 1.100 1.00 0.00 O ATOM 0 H GLY A 83 -33.807 1.890 0.533 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -33.675 -0.283 -0.021 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -33.594 -0.688 1.682 1.00 0.00 H new ATOM 1334 N TYR A 84 -36.538 0.165 0.559 1.00 0.00 N ATOM 1335 CA TYR A 84 -37.933 -0.250 0.466 1.00 0.00 C ATOM 1336 C TYR A 84 -38.435 -0.775 1.808 1.00 0.00 C ATOM 1337 O TYR A 84 -39.086 -1.817 1.874 1.00 0.00 O ATOM 1338 CB TYR A 84 -38.096 -1.326 -0.609 1.00 0.00 C ATOM 1339 CG TYR A 84 -39.491 -1.396 -1.188 1.00 0.00 C ATOM 1340 CD1 TYR A 84 -39.935 -0.446 -2.099 1.00 0.00 C ATOM 1341 CD2 TYR A 84 -40.366 -2.412 -0.823 1.00 0.00 C ATOM 1342 CE1 TYR A 84 -41.208 -0.506 -2.631 1.00 0.00 C ATOM 1343 CE2 TYR A 84 -41.641 -2.481 -1.350 1.00 0.00 C ATOM 1344 CZ TYR A 84 -42.058 -1.525 -2.253 1.00 0.00 C ATOM 1345 OH TYR A 84 -43.327 -1.589 -2.780 1.00 0.00 O ATOM 0 H TYR A 84 -36.378 1.154 0.365 1.00 0.00 H new ATOM 0 HA TYR A 84 -38.528 0.621 0.191 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -37.387 -1.134 -1.414 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -37.839 -2.296 -0.183 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -39.273 0.354 -2.397 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -40.043 -3.161 -0.115 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -41.536 0.241 -3.339 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -42.307 -3.279 -1.057 1.00 0.00 H new ATOM 0 HH TYR A 84 -43.795 -2.367 -2.411 1.00 0.00 H new ATOM 1355 N ALA A 85 -38.128 -0.044 2.874 1.00 0.00 N ATOM 1356 CA ALA A 85 -38.549 -0.434 4.214 1.00 0.00 C ATOM 1357 C ALA A 85 -39.568 0.551 4.777 1.00 0.00 C ATOM 1358 O ALA A 85 -39.204 1.604 5.302 1.00 0.00 O ATOM 1359 CB ALA A 85 -37.344 -0.535 5.138 1.00 0.00 C ATOM 0 H ALA A 85 -37.589 0.821 2.836 1.00 0.00 H new ATOM 0 HA ALA A 85 -39.025 -1.412 4.148 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -37.674 -0.827 6.135 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -36.651 -1.282 4.752 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -36.843 0.432 5.190 1.00 0.00 H new ATOM 1365 N ASP A 86 -40.845 0.203 4.663 1.00 0.00 N ATOM 1366 CA ASP A 86 -41.918 1.057 5.161 1.00 0.00 C ATOM 1367 C ASP A 86 -42.086 0.895 6.668 1.00 0.00 C ATOM 1368 O ASP A 86 -41.402 0.086 7.297 1.00 0.00 O ATOM 1369 CB ASP A 86 -43.232 0.729 4.450 1.00 0.00 C ATOM 1370 CG ASP A 86 -43.743 -0.657 4.792 1.00 0.00 C ATOM 1371 OD1 ASP A 86 -43.098 -1.645 4.383 1.00 0.00 O ATOM 1372 OD2 ASP A 86 -44.790 -0.754 5.467 1.00 0.00 O ATOM 0 H ASP A 86 -41.163 -0.664 4.230 1.00 0.00 H new ATOM 0 HA ASP A 86 -41.651 2.093 4.953 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -43.985 1.469 4.723 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -43.088 0.805 3.372 1.00 0.00 H new ATOM 1377 N LEU A 87 -42.999 1.670 7.243 1.00 0.00 N ATOM 1378 CA LEU A 87 -43.257 1.614 8.678 1.00 0.00 C ATOM 1379 C LEU A 87 -44.390 0.642 8.990 1.00 0.00 C ATOM 1380 O LEU A 87 -44.859 -0.083 8.112 1.00 0.00 O ATOM 1381 CB LEU A 87 -43.602 3.006 9.209 1.00 0.00 C ATOM 1382 CG LEU A 87 -42.630 4.126 8.838 1.00 0.00 C ATOM 1383 CD1 LEU A 87 -43.089 5.449 9.431 1.00 0.00 C ATOM 1384 CD2 LEU A 87 -41.223 3.789 9.308 1.00 0.00 C ATOM 0 H LEU A 87 -43.573 2.345 6.738 1.00 0.00 H new ATOM 0 HA LEU A 87 -42.352 1.258 9.171 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -44.593 3.277 8.844 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -43.666 2.953 10.296 1.00 0.00 H new ATOM 0 HG LEU A 87 -42.615 4.223 7.752 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -42.385 6.235 9.156 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -44.078 5.697 9.045 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -43.134 5.365 10.517 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -40.545 4.598 9.035 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -41.221 3.664 10.391 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -40.893 2.864 8.835 1.00 0.00 H new ATOM 1396 N ARG A 88 -44.828 0.635 10.245 1.00 0.00 N ATOM 1397 CA ARG A 88 -45.908 -0.247 10.672 1.00 0.00 C ATOM 1398 C ARG A 88 -46.490 0.214 12.005 1.00 0.00 C ATOM 1399 O ARG A 88 -45.756 0.598 12.914 1.00 0.00 O ATOM 1400 CB ARG A 88 -45.402 -1.686 10.794 1.00 0.00 C ATOM 1401 CG ARG A 88 -46.484 -2.681 11.180 1.00 0.00 C ATOM 1402 CD ARG A 88 -45.887 -4.003 11.636 1.00 0.00 C ATOM 1403 NE ARG A 88 -45.269 -3.900 12.955 1.00 0.00 N ATOM 1404 CZ ARG A 88 -44.805 -4.943 13.633 1.00 0.00 C ATOM 1405 NH1 ARG A 88 -44.887 -6.163 13.118 1.00 0.00 N ATOM 1406 NH2 ARG A 88 -44.256 -4.769 14.828 1.00 0.00 N ATOM 0 H ARG A 88 -44.452 1.230 10.983 1.00 0.00 H new ATOM 0 HA ARG A 88 -46.695 -0.209 9.919 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -44.963 -1.990 9.844 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -44.606 -1.721 11.538 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -47.097 -2.262 11.978 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -47.143 -2.852 10.329 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -46.667 -4.764 11.660 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -45.142 -4.333 10.912 1.00 0.00 H new ATOM 0 HE ARG A 88 -45.189 -2.976 13.379 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -45.307 -6.301 12.199 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -44.530 -6.962 13.641 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -44.190 -3.833 15.227 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -43.900 -5.571 15.347 1.00 0.00 H new ATOM 1420 N GLU A 89 -47.815 0.172 12.112 1.00 0.00 N ATOM 1421 CA GLU A 89 -48.495 0.587 13.333 1.00 0.00 C ATOM 1422 C GLU A 89 -49.591 -0.406 13.709 1.00 0.00 C ATOM 1423 O GLU A 89 -50.567 -0.576 12.977 1.00 0.00 O ATOM 1424 CB GLU A 89 -49.094 1.984 13.160 1.00 0.00 C ATOM 1425 CG GLU A 89 -48.062 3.098 13.198 1.00 0.00 C ATOM 1426 CD GLU A 89 -47.312 3.155 14.514 1.00 0.00 C ATOM 1427 OE1 GLU A 89 -47.785 3.848 15.438 1.00 0.00 O ATOM 1428 OE2 GLU A 89 -46.251 2.504 14.621 1.00 0.00 O ATOM 0 H GLU A 89 -48.438 -0.145 11.369 1.00 0.00 H new ATOM 0 HA GLU A 89 -47.760 0.612 14.138 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -49.627 2.026 12.210 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -49.829 2.155 13.946 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -47.350 2.956 12.385 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -48.558 4.053 13.025 1.00 0.00 H new ATOM 1435 N ASP A 90 -49.423 -1.058 14.854 1.00 0.00 N ATOM 1436 CA ASP A 90 -50.398 -2.033 15.329 1.00 0.00 C ATOM 1437 C ASP A 90 -50.322 -2.184 16.845 1.00 0.00 C ATOM 1438 O ASP A 90 -49.320 -1.850 17.477 1.00 0.00 O ATOM 1439 CB ASP A 90 -50.165 -3.387 14.657 1.00 0.00 C ATOM 1440 CG ASP A 90 -48.694 -3.674 14.427 1.00 0.00 C ATOM 1441 OD1 ASP A 90 -47.875 -3.313 15.299 1.00 0.00 O ATOM 1442 OD2 ASP A 90 -48.361 -4.261 13.376 1.00 0.00 O ATOM 0 H ASP A 90 -48.621 -0.929 15.471 1.00 0.00 H new ATOM 0 HA ASP A 90 -51.393 -1.672 15.068 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -50.593 -4.175 15.276 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -50.690 -3.411 13.702 1.00 0.00 H new ATOM 1447 N PRO A 91 -51.406 -2.699 17.444 1.00 0.00 N ATOM 1448 CA PRO A 91 -51.487 -2.905 18.893 1.00 0.00 C ATOM 1449 C PRO A 91 -50.570 -4.026 19.371 1.00 0.00 C ATOM 1450 O PRO A 91 -50.225 -4.098 20.550 1.00 0.00 O ATOM 1451 CB PRO A 91 -52.953 -3.283 19.116 1.00 0.00 C ATOM 1452 CG PRO A 91 -53.398 -3.860 17.817 1.00 0.00 C ATOM 1453 CD PRO A 91 -52.636 -3.120 16.752 1.00 0.00 C ATOM 0 HA PRO A 91 -51.171 -2.022 19.448 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -53.057 -4.005 19.926 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -53.549 -2.412 19.387 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -53.191 -4.929 17.774 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -54.473 -3.738 17.684 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -52.417 -3.759 15.897 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -53.198 -2.265 16.376 1.00 0.00 H new ATOM 1461 N ASP A 92 -50.179 -4.898 18.448 1.00 0.00 N ATOM 1462 CA ASP A 92 -49.300 -6.015 18.776 1.00 0.00 C ATOM 1463 C ASP A 92 -48.579 -6.522 17.531 1.00 0.00 C ATOM 1464 O ASP A 92 -47.382 -6.289 17.356 1.00 0.00 O ATOM 1465 CB ASP A 92 -50.100 -7.151 19.415 1.00 0.00 C ATOM 1466 CG ASP A 92 -51.536 -7.191 18.931 1.00 0.00 C ATOM 1467 OD1 ASP A 92 -52.351 -6.383 19.424 1.00 0.00 O ATOM 1468 OD2 ASP A 92 -51.847 -8.030 18.060 1.00 0.00 O ATOM 0 H ASP A 92 -50.456 -4.853 17.467 1.00 0.00 H new ATOM 0 HA ASP A 92 -48.554 -5.662 19.488 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -49.617 -8.102 19.191 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -50.088 -7.035 20.499 1.00 0.00 H new ATOM 1473 N ARG A 93 -49.314 -7.217 16.669 1.00 0.00 N ATOM 1474 CA ARG A 93 -48.743 -7.759 15.442 1.00 0.00 C ATOM 1475 C ARG A 93 -49.832 -8.350 14.551 1.00 0.00 C ATOM 1476 O ARG A 93 -49.773 -8.239 13.327 1.00 0.00 O ATOM 1477 CB ARG A 93 -47.700 -8.829 15.768 1.00 0.00 C ATOM 1478 CG ARG A 93 -48.234 -9.956 16.637 1.00 0.00 C ATOM 1479 CD ARG A 93 -47.128 -10.598 17.459 1.00 0.00 C ATOM 1480 NE ARG A 93 -46.907 -11.992 17.086 1.00 0.00 N ATOM 1481 CZ ARG A 93 -46.150 -12.829 17.786 1.00 0.00 C ATOM 1482 NH1 ARG A 93 -45.544 -12.415 18.890 1.00 0.00 N ATOM 1483 NH2 ARG A 93 -45.998 -14.084 17.382 1.00 0.00 N ATOM 0 H ARG A 93 -50.306 -7.418 16.798 1.00 0.00 H new ATOM 0 HA ARG A 93 -48.260 -6.943 14.905 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -47.319 -9.249 14.837 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -46.857 -8.360 16.274 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -49.006 -9.569 17.303 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -48.705 -10.710 16.007 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -46.204 -10.036 17.324 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -47.384 -10.542 18.517 1.00 0.00 H new ATOM 0 HE ARG A 93 -47.359 -12.342 16.241 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -45.659 -11.451 19.204 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -44.963 -13.060 19.426 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -46.463 -14.406 16.533 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -45.416 -14.726 17.920 1.00 0.00 H new ATOM 1497 N GLN A 94 -50.824 -8.978 15.175 1.00 0.00 N ATOM 1498 CA GLN A 94 -51.925 -9.587 14.438 1.00 0.00 C ATOM 1499 C GLN A 94 -53.036 -8.574 14.183 1.00 0.00 C ATOM 1500 O GLN A 94 -53.145 -7.568 14.884 1.00 0.00 O ATOM 1501 CB GLN A 94 -52.479 -10.787 15.208 1.00 0.00 C ATOM 1502 CG GLN A 94 -53.186 -11.803 14.324 1.00 0.00 C ATOM 1503 CD GLN A 94 -53.781 -12.951 15.116 1.00 0.00 C ATOM 1504 OE1 GLN A 94 -53.208 -13.397 16.111 1.00 0.00 O ATOM 1505 NE2 GLN A 94 -54.936 -13.436 14.678 1.00 0.00 N ATOM 0 H GLN A 94 -50.888 -9.078 16.188 1.00 0.00 H new ATOM 0 HA GLN A 94 -51.541 -9.927 13.476 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -51.661 -11.281 15.732 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -53.176 -10.431 15.967 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -53.977 -11.304 13.764 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -52.479 -12.198 13.594 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -55.376 -13.036 13.849 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -55.384 -14.209 15.170 1.00 0.00 H new ATOM 1514 N ASP A 95 -53.859 -8.846 13.176 1.00 0.00 N ATOM 1515 CA ASP A 95 -54.963 -7.959 12.830 1.00 0.00 C ATOM 1516 C ASP A 95 -56.157 -8.754 12.311 1.00 0.00 C ATOM 1517 O ASP A 95 -56.240 -9.066 11.122 1.00 0.00 O ATOM 1518 CB ASP A 95 -54.516 -6.942 11.778 1.00 0.00 C ATOM 1519 CG ASP A 95 -55.562 -5.873 11.526 1.00 0.00 C ATOM 1520 OD1 ASP A 95 -55.558 -4.857 12.251 1.00 0.00 O ATOM 1521 OD2 ASP A 95 -56.385 -6.054 10.604 1.00 0.00 O ATOM 0 H ASP A 95 -53.782 -9.674 12.585 1.00 0.00 H new ATOM 0 HA ASP A 95 -55.267 -7.428 13.732 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -53.589 -6.470 12.104 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -54.298 -7.461 10.844 1.00 0.00 H new ATOM 1526 N HIS A 96 -57.079 -9.081 13.211 1.00 0.00 N ATOM 1527 CA HIS A 96 -58.269 -9.841 12.844 1.00 0.00 C ATOM 1528 C HIS A 96 -59.242 -8.977 12.047 1.00 0.00 C ATOM 1529 O HIS A 96 -59.114 -7.752 12.010 1.00 0.00 O ATOM 1530 CB HIS A 96 -58.959 -10.384 14.096 1.00 0.00 C ATOM 1531 CG HIS A 96 -59.403 -9.315 15.046 1.00 0.00 C ATOM 1532 ND1 HIS A 96 -60.477 -8.486 14.798 1.00 0.00 N ATOM 1533 CD2 HIS A 96 -58.913 -8.943 16.252 1.00 0.00 C ATOM 1534 CE1 HIS A 96 -60.627 -7.649 15.809 1.00 0.00 C ATOM 1535 NE2 HIS A 96 -59.691 -7.906 16.705 1.00 0.00 N ATOM 0 H HIS A 96 -57.025 -8.832 14.199 1.00 0.00 H new ATOM 0 HA HIS A 96 -57.957 -10.677 12.218 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -59.825 -10.975 13.796 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -58.277 -11.058 14.614 1.00 0.00 H new ATOM 0 HD1 HIS A 96 -61.064 -8.515 13.964 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -58.068 -9.380 16.763 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -61.386 -6.885 15.889 1.00 0.00 H new ATOM 1543 N HIS A 97 -60.213 -9.622 11.409 1.00 0.00 N ATOM 1544 CA HIS A 97 -61.207 -8.912 10.612 1.00 0.00 C ATOM 1545 C HIS A 97 -62.249 -8.249 11.508 1.00 0.00 C ATOM 1546 O HIS A 97 -62.422 -8.610 12.672 1.00 0.00 O ATOM 1547 CB HIS A 97 -61.892 -9.871 9.638 1.00 0.00 C ATOM 1548 CG HIS A 97 -61.269 -9.887 8.276 1.00 0.00 C ATOM 1549 ND1 HIS A 97 -61.853 -10.504 7.189 1.00 0.00 N ATOM 1550 CD2 HIS A 97 -60.109 -9.355 7.827 1.00 0.00 C ATOM 1551 CE1 HIS A 97 -61.077 -10.352 6.131 1.00 0.00 C ATOM 1552 NE2 HIS A 97 -60.012 -9.658 6.491 1.00 0.00 N ATOM 0 H HIS A 97 -60.333 -10.635 11.428 1.00 0.00 H new ATOM 0 HA HIS A 97 -60.694 -8.136 10.045 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -61.864 -10.879 10.053 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -62.942 -9.593 9.545 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -59.393 -8.796 8.411 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -61.279 -10.731 5.140 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -59.243 -9.391 5.877 1.00 0.00 H new ATOM 1560 N PRO A 98 -62.960 -7.255 10.955 1.00 0.00 N ATOM 1561 CA PRO A 98 -63.997 -6.521 11.687 1.00 0.00 C ATOM 1562 C PRO A 98 -65.227 -7.378 11.965 1.00 0.00 C ATOM 1563 O PRO A 98 -65.891 -7.845 11.041 1.00 0.00 O ATOM 1564 CB PRO A 98 -64.350 -5.369 10.743 1.00 0.00 C ATOM 1565 CG PRO A 98 -63.996 -5.871 9.385 1.00 0.00 C ATOM 1566 CD PRO A 98 -62.807 -6.771 9.573 1.00 0.00 C ATOM 0 HA PRO A 98 -63.650 -6.195 12.668 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -65.408 -5.114 10.808 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -63.789 -4.468 10.991 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -64.830 -6.414 8.940 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -63.758 -5.046 8.714 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -62.808 -7.593 8.857 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -61.870 -6.232 9.438 1.00 0.00 H new ATOM 1574 N GLY A 99 -65.526 -7.579 13.245 1.00 0.00 N ATOM 1575 CA GLY A 99 -66.676 -8.380 13.621 1.00 0.00 C ATOM 1576 C GLY A 99 -67.438 -7.787 14.790 1.00 0.00 C ATOM 1577 O GLY A 99 -67.003 -7.886 15.938 1.00 0.00 O ATOM 0 H GLY A 99 -64.992 -7.201 14.028 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -67.345 -8.474 12.765 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -66.345 -9.386 13.879 1.00 0.00 H new ATOM 1581 N SER A 100 -68.576 -7.166 14.499 1.00 0.00 N ATOM 1582 CA SER A 100 -69.397 -6.550 15.535 1.00 0.00 C ATOM 1583 C SER A 100 -70.875 -6.861 15.314 1.00 0.00 C ATOM 1584 O SER A 100 -71.379 -6.772 14.195 1.00 0.00 O ATOM 1585 CB SER A 100 -69.181 -5.035 15.553 1.00 0.00 C ATOM 1586 OG SER A 100 -67.901 -4.710 16.067 1.00 0.00 O ATOM 0 H SER A 100 -68.951 -7.076 13.555 1.00 0.00 H new ATOM 0 HA SER A 100 -69.096 -6.965 16.497 1.00 0.00 H new ATOM 0 HB2 SER A 100 -69.283 -4.638 14.543 1.00 0.00 H new ATOM 0 HB3 SER A 100 -69.952 -4.561 16.161 1.00 0.00 H new ATOM 0 HG SER A 100 -67.786 -3.737 16.067 1.00 0.00 H new ATOM 1592 N GLY A 101 -71.564 -7.227 16.390 1.00 0.00 N ATOM 1593 CA GLY A 101 -72.976 -7.546 16.294 1.00 0.00 C ATOM 1594 C GLY A 101 -73.852 -6.310 16.310 1.00 0.00 C ATOM 1595 O GLY A 101 -73.443 -5.245 15.849 1.00 0.00 O ATOM 0 H GLY A 101 -71.169 -7.308 17.327 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -73.158 -8.104 15.376 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -73.256 -8.196 17.123 1.00 0.00 H new ATOM 1599 N ALA A 102 -75.063 -6.451 16.840 1.00 0.00 N ATOM 1600 CA ALA A 102 -75.999 -5.336 16.914 1.00 0.00 C ATOM 1601 C ALA A 102 -76.918 -5.470 18.124 1.00 0.00 C ATOM 1602 O ALA A 102 -76.893 -6.483 18.823 1.00 0.00 O ATOM 1603 CB ALA A 102 -76.818 -5.249 15.634 1.00 0.00 C ATOM 0 H ALA A 102 -75.419 -7.326 17.224 1.00 0.00 H new ATOM 0 HA ALA A 102 -75.423 -4.417 17.028 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -77.513 -4.412 15.703 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -76.151 -5.098 14.785 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -77.377 -6.174 15.496 1.00 0.00 H new ATOM 1609 N GLN A 103 -77.726 -4.443 18.364 1.00 0.00 N ATOM 1610 CA GLN A 103 -78.652 -4.447 19.491 1.00 0.00 C ATOM 1611 C GLN A 103 -79.877 -5.301 19.185 1.00 0.00 C ATOM 1612 O GLN A 103 -80.621 -5.685 20.089 1.00 0.00 O ATOM 1613 CB GLN A 103 -79.082 -3.019 19.829 1.00 0.00 C ATOM 1614 CG GLN A 103 -79.648 -2.870 21.233 1.00 0.00 C ATOM 1615 CD GLN A 103 -79.495 -1.464 21.777 1.00 0.00 C ATOM 1616 OE1 GLN A 103 -78.537 -0.761 21.455 1.00 0.00 O ATOM 1617 NE2 GLN A 103 -80.442 -1.045 22.609 1.00 0.00 N ATOM 0 H GLN A 103 -77.759 -3.598 17.794 1.00 0.00 H new ATOM 0 HA GLN A 103 -78.138 -4.877 20.351 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -78.225 -2.355 19.719 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -79.832 -2.694 19.108 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -80.704 -3.140 21.225 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -79.145 -3.570 21.900 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -81.219 -1.661 22.849 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -80.392 -0.107 23.008 1.00 0.00 H new TER 1626 GLN A 103