USER MOD reduce.3.24.130724 H: found=0, std=0, add=787, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 789 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 99 TYR OH : rot 130:sc= 0.57 USER MOD Set 1.2: A 120 SER OG : rot -175:sc= 0.056 USER MOD Set 2.1: A 45 GLN : amide:sc= 0 X(o=1.2,f=1.2) USER MOD Set 2.2: A 131 THR OG1 : rot 17:sc= 1.16 USER MOD Set 3.1: A 43 LYS NZ :NH3+ 166:sc= 0.848 (180deg=0.81) USER MOD Set 3.2: A 85 ASN : amide:sc= -0.612 K(o=0.24,f=-1.6) USER MOD Single : A 27 SER OG : rot -63:sc= 1.22 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -1.15 K(o=-1.1,f=0) USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 140:sc= -0.211 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0.811 USER MOD Single : A 47 GLN : amide:sc= -0.211 K(o=-0.21,f=0.3) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 155:sc= 1.28 (180deg=1.11) USER MOD Single : A 57 HIS : no HD1:sc= -1.21 X(o=-1.2,f=-0.84) USER MOD Single : A 58 MET CE :methyl 135:sc= -0.325 (180deg=-1.81) USER MOD Single : A 61 SER OG : rot 116:sc= 1.3 USER MOD Single : A 62 GLN : amide:sc= -0.922 K(o=-0.92,f=1.3) USER MOD Single : A 63 SER OG : rot -10:sc= 0.783 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 42:sc= 0.0145 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -0.877 K(o=-0.88,f=0) USER MOD Single : A 75 SER OG : rot -46:sc= 1.22 USER MOD Single : A 76 GLN : amide:sc= -1.38 K(o=-1.4,f=-0.37) USER MOD Single : A 78 SER OG : rot 180:sc= 0.015 USER MOD Single : A 79 LYS NZ :NH3+ -149:sc= 2.08 (180deg=0.553) USER MOD Single : A 82 GLN : amide:sc= -0.0238 K(o=-0.024,f=-1.6) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot -142:sc= 0.295 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 170:sc= 0.926 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -1.97! K(o=-2!,f=-0.55) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HE2:sc= 1.15 K(o=1.1,f=-3.4!) USER MOD Single : A 126 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 127 SER OG : rot 30:sc= 0.032 USER MOD ----------------------------------------------------------------- ATOM 25 N LEU A 26 -100.632 -10.454 -24.359 1.00 0.00 N ATOM 26 CA LEU A 26 -100.506 -9.210 -25.113 1.00 0.00 C ATOM 27 C LEU A 26 -100.100 -9.516 -26.551 1.00 0.00 C ATOM 28 O LEU A 26 -99.505 -10.558 -26.810 1.00 0.00 O ATOM 29 CB LEU A 26 -99.457 -8.301 -24.460 1.00 0.00 C ATOM 30 CG LEU A 26 -99.524 -8.206 -22.931 1.00 0.00 C ATOM 31 CD1 LEU A 26 -98.490 -7.219 -22.417 1.00 0.00 C ATOM 32 CD2 LEU A 26 -100.915 -7.810 -22.465 1.00 0.00 C ATOM 0 HA LEU A 26 -101.468 -8.698 -25.112 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -98.466 -8.659 -24.741 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -99.563 -7.298 -24.874 1.00 0.00 H new ATOM 0 HG LEU A 26 -99.302 -9.192 -22.522 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -98.550 -7.162 -21.330 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -97.494 -7.551 -22.709 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -98.684 -6.234 -22.843 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -100.931 -7.751 -21.377 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -101.177 -6.839 -22.885 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -101.637 -8.556 -22.798 1.00 0.00 H new ATOM 44 N SER A 27 -100.418 -8.632 -27.483 1.00 0.00 N ATOM 45 CA SER A 27 -100.043 -8.847 -28.871 1.00 0.00 C ATOM 46 C SER A 27 -99.693 -7.519 -29.544 1.00 0.00 C ATOM 47 O SER A 27 -100.249 -6.479 -29.194 1.00 0.00 O ATOM 48 CB SER A 27 -101.179 -9.555 -29.612 1.00 0.00 C ATOM 49 OG SER A 27 -102.289 -8.694 -29.798 1.00 0.00 O ATOM 0 H SER A 27 -100.930 -7.767 -27.307 1.00 0.00 H new ATOM 0 HA SER A 27 -99.158 -9.482 -28.906 1.00 0.00 H new ATOM 0 HB2 SER A 27 -100.822 -9.905 -30.580 1.00 0.00 H new ATOM 0 HB3 SER A 27 -101.490 -10.436 -29.050 1.00 0.00 H new ATOM 0 HG SER A 27 -102.652 -8.435 -28.925 1.00 0.00 H new ATOM 55 N TRP A 28 -98.780 -7.554 -30.513 1.00 0.00 N ATOM 56 CA TRP A 28 -98.297 -6.326 -31.149 1.00 0.00 C ATOM 57 C TRP A 28 -99.367 -5.662 -32.015 1.00 0.00 C ATOM 58 O TRP A 28 -99.238 -4.491 -32.373 1.00 0.00 O ATOM 59 CB TRP A 28 -97.019 -6.579 -31.975 1.00 0.00 C ATOM 60 CG TRP A 28 -97.154 -7.566 -33.109 1.00 0.00 C ATOM 61 CD1 TRP A 28 -98.209 -8.392 -33.380 1.00 0.00 C ATOM 62 CD2 TRP A 28 -96.173 -7.830 -34.125 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.950 -9.141 -34.501 1.00 0.00 N ATOM 64 CE2 TRP A 28 -96.707 -8.816 -34.976 1.00 0.00 C ATOM 65 CE3 TRP A 28 -94.895 -7.325 -34.401 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -96.012 -9.307 -36.079 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -94.205 -7.816 -35.498 1.00 0.00 C ATOM 68 CH2 TRP A 28 -94.766 -8.797 -36.323 1.00 0.00 C ATOM 0 H TRP A 28 -98.361 -8.411 -30.874 1.00 0.00 H new ATOM 0 HA TRP A 28 -98.053 -5.638 -30.340 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -96.680 -5.628 -32.385 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -96.238 -6.933 -31.302 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -99.116 -8.447 -32.796 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -98.581 -9.828 -34.913 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -94.456 -6.567 -33.770 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -96.442 -10.064 -36.719 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -93.219 -7.435 -35.720 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -94.203 -9.159 -37.171 1.00 0.00 H new ATOM 79 N TYR A 29 -100.432 -6.391 -32.334 1.00 0.00 N ATOM 80 CA TYR A 29 -101.486 -5.837 -33.173 1.00 0.00 C ATOM 81 C TYR A 29 -102.589 -5.197 -32.334 1.00 0.00 C ATOM 82 O TYR A 29 -103.553 -4.660 -32.876 1.00 0.00 O ATOM 83 CB TYR A 29 -102.056 -6.884 -34.146 1.00 0.00 C ATOM 84 CG TYR A 29 -102.423 -8.218 -33.531 1.00 0.00 C ATOM 85 CD1 TYR A 29 -103.642 -8.406 -32.892 1.00 0.00 C ATOM 86 CD2 TYR A 29 -101.552 -9.298 -33.613 1.00 0.00 C ATOM 87 CE1 TYR A 29 -103.979 -9.632 -32.350 1.00 0.00 C ATOM 88 CE2 TYR A 29 -101.884 -10.527 -33.077 1.00 0.00 C ATOM 89 CZ TYR A 29 -103.097 -10.689 -32.446 1.00 0.00 C ATOM 90 OH TYR A 29 -103.427 -11.910 -31.905 1.00 0.00 O ATOM 0 H TYR A 29 -100.586 -7.352 -32.029 1.00 0.00 H new ATOM 0 HA TYR A 29 -101.033 -5.051 -33.777 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -102.944 -6.467 -34.621 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -101.324 -7.057 -34.935 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -104.336 -7.582 -32.818 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -100.598 -9.174 -34.105 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -104.929 -9.762 -31.853 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -101.196 -11.356 -33.152 1.00 0.00 H new ATOM 0 HH TYR A 29 -102.697 -12.545 -32.061 1.00 0.00 H new ATOM 100 N ASP A 30 -102.435 -5.235 -31.013 1.00 0.00 N ATOM 101 CA ASP A 30 -103.327 -4.501 -30.130 1.00 0.00 C ATOM 102 C ASP A 30 -103.048 -3.011 -30.264 1.00 0.00 C ATOM 103 O ASP A 30 -101.906 -2.576 -30.111 1.00 0.00 O ATOM 104 CB ASP A 30 -103.141 -4.927 -28.668 1.00 0.00 C ATOM 105 CG ASP A 30 -103.732 -6.285 -28.354 1.00 0.00 C ATOM 106 OD1 ASP A 30 -104.933 -6.493 -28.620 1.00 0.00 O ATOM 107 OD2 ASP A 30 -103.001 -7.152 -27.824 1.00 0.00 O ATOM 0 H ASP A 30 -101.705 -5.764 -30.536 1.00 0.00 H new ATOM 0 HA ASP A 30 -104.355 -4.721 -30.418 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -102.076 -4.940 -28.435 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -103.600 -4.181 -28.019 1.00 0.00 H new ATOM 112 N PRO A 31 -104.072 -2.210 -30.585 1.00 0.00 N ATOM 113 CA PRO A 31 -103.925 -0.758 -30.748 1.00 0.00 C ATOM 114 C PRO A 31 -103.332 -0.091 -29.510 1.00 0.00 C ATOM 115 O PRO A 31 -102.481 0.792 -29.616 1.00 0.00 O ATOM 116 CB PRO A 31 -105.359 -0.274 -30.980 1.00 0.00 C ATOM 117 CG PRO A 31 -106.081 -1.467 -31.502 1.00 0.00 C ATOM 118 CD PRO A 31 -105.455 -2.653 -30.825 1.00 0.00 C ATOM 0 HA PRO A 31 -103.242 -0.510 -31.560 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -105.809 0.088 -30.056 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -105.388 0.550 -31.693 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -107.146 -1.407 -31.280 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -105.985 -1.539 -32.585 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.966 -2.902 -29.895 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -105.490 -3.542 -31.455 1.00 0.00 H new ATOM 126 N ASP A 32 -103.765 -0.542 -28.340 1.00 0.00 N ATOM 127 CA ASP A 32 -103.316 0.037 -27.078 1.00 0.00 C ATOM 128 C ASP A 32 -101.955 -0.516 -26.668 1.00 0.00 C ATOM 129 O ASP A 32 -101.315 0.010 -25.753 1.00 0.00 O ATOM 130 CB ASP A 32 -104.339 -0.233 -25.972 1.00 0.00 C ATOM 131 CG ASP A 32 -104.411 -1.699 -25.594 1.00 0.00 C ATOM 132 OD1 ASP A 32 -104.881 -2.507 -26.418 1.00 0.00 O ATOM 133 OD2 ASP A 32 -104.002 -2.048 -24.466 1.00 0.00 O ATOM 0 H ASP A 32 -104.429 -1.310 -28.237 1.00 0.00 H new ATOM 0 HA ASP A 32 -103.220 1.113 -27.224 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -104.080 0.354 -25.091 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -105.322 0.103 -26.301 1.00 0.00 H new ATOM 138 N PHE A 33 -101.515 -1.571 -27.344 1.00 0.00 N ATOM 139 CA PHE A 33 -100.220 -2.174 -27.059 1.00 0.00 C ATOM 140 C PHE A 33 -99.104 -1.322 -27.645 1.00 0.00 C ATOM 141 O PHE A 33 -99.106 -1.007 -28.840 1.00 0.00 O ATOM 142 CB PHE A 33 -100.149 -3.599 -27.614 1.00 0.00 C ATOM 143 CG PHE A 33 -98.862 -4.313 -27.299 1.00 0.00 C ATOM 144 CD1 PHE A 33 -98.683 -4.934 -26.075 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.835 -4.367 -28.231 1.00 0.00 C ATOM 146 CE1 PHE A 33 -97.506 -5.595 -25.785 1.00 0.00 C ATOM 147 CE2 PHE A 33 -96.655 -5.027 -27.943 1.00 0.00 C ATOM 148 CZ PHE A 33 -96.490 -5.642 -26.719 1.00 0.00 C ATOM 0 H PHE A 33 -102.037 -2.026 -28.093 1.00 0.00 H new ATOM 0 HA PHE A 33 -100.095 -2.223 -25.977 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.981 -4.177 -27.212 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -100.278 -3.564 -28.696 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -99.473 -4.901 -25.339 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.959 -3.888 -29.191 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -97.380 -6.076 -24.826 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -95.862 -5.061 -28.676 1.00 0.00 H new ATOM 0 HZ PHE A 33 -95.569 -6.159 -26.492 1.00 0.00 H new ATOM 158 N GLN A 34 -98.152 -0.964 -26.801 1.00 0.00 N ATOM 159 CA GLN A 34 -97.069 -0.079 -27.189 1.00 0.00 C ATOM 160 C GLN A 34 -95.913 -0.877 -27.788 1.00 0.00 C ATOM 161 O GLN A 34 -95.290 -1.701 -27.107 1.00 0.00 O ATOM 162 CB GLN A 34 -96.598 0.705 -25.969 1.00 0.00 C ATOM 163 CG GLN A 34 -95.825 1.965 -26.308 1.00 0.00 C ATOM 164 CD GLN A 34 -95.538 2.802 -25.079 1.00 0.00 C ATOM 165 OE1 GLN A 34 -95.433 4.024 -25.156 1.00 0.00 O ATOM 166 NE2 GLN A 34 -95.418 2.148 -23.932 1.00 0.00 N ATOM 0 H GLN A 34 -98.108 -1.277 -25.831 1.00 0.00 H new ATOM 0 HA GLN A 34 -97.428 0.616 -27.948 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -97.465 0.974 -25.365 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -95.970 0.060 -25.355 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -94.886 1.695 -26.790 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -96.393 2.557 -27.025 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -95.512 1.133 -23.912 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -95.231 2.660 -23.070 1.00 0.00 H new ATOM 175 N ALA A 35 -95.632 -0.623 -29.058 1.00 0.00 N ATOM 176 CA ALA A 35 -94.591 -1.339 -29.775 1.00 0.00 C ATOM 177 C ALA A 35 -93.999 -0.465 -30.873 1.00 0.00 C ATOM 178 O ALA A 35 -94.694 0.381 -31.436 1.00 0.00 O ATOM 179 CB ALA A 35 -95.150 -2.626 -30.366 1.00 0.00 C ATOM 0 H ALA A 35 -96.116 0.080 -29.616 1.00 0.00 H new ATOM 0 HA ALA A 35 -93.797 -1.592 -29.072 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -94.360 -3.154 -30.901 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -95.531 -3.259 -29.565 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -95.959 -2.388 -31.056 1.00 0.00 H new ATOM 185 N ARG A 36 -92.716 -0.670 -31.157 1.00 0.00 N ATOM 186 CA ARG A 36 -92.011 0.072 -32.202 1.00 0.00 C ATOM 187 C ARG A 36 -90.596 -0.473 -32.315 1.00 0.00 C ATOM 188 O ARG A 36 -90.266 -1.446 -31.660 1.00 0.00 O ATOM 189 CB ARG A 36 -91.971 1.584 -31.902 1.00 0.00 C ATOM 190 CG ARG A 36 -90.806 2.020 -31.015 1.00 0.00 C ATOM 191 CD ARG A 36 -90.970 1.594 -29.566 1.00 0.00 C ATOM 192 NE ARG A 36 -91.846 2.504 -28.835 1.00 0.00 N ATOM 193 CZ ARG A 36 -91.477 3.172 -27.742 1.00 0.00 C ATOM 194 NH1 ARG A 36 -90.307 2.919 -27.162 1.00 0.00 N ATOM 195 NH2 ARG A 36 -92.290 4.076 -27.212 1.00 0.00 N ATOM 0 H ARG A 36 -92.135 -1.353 -30.671 1.00 0.00 H new ATOM 0 HA ARG A 36 -92.546 -0.057 -33.143 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -91.917 2.128 -32.845 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -92.906 1.872 -31.421 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -89.880 1.600 -31.409 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -90.709 3.105 -31.060 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -91.379 0.584 -29.527 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -89.993 1.561 -29.083 1.00 0.00 H new ATOM 0 HE ARG A 36 -92.796 2.637 -29.181 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -89.686 2.210 -27.553 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -90.030 3.434 -26.326 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -93.197 4.260 -27.641 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -92.008 4.587 -26.376 1.00 0.00 H new ATOM 209 N LEU A 37 -89.778 0.123 -33.161 1.00 0.00 N ATOM 210 CA LEU A 37 -88.390 -0.277 -33.263 1.00 0.00 C ATOM 211 C LEU A 37 -87.553 0.438 -32.225 1.00 0.00 C ATOM 212 O LEU A 37 -87.878 1.546 -31.796 1.00 0.00 O ATOM 213 CB LEU A 37 -87.844 0.026 -34.650 1.00 0.00 C ATOM 214 CG LEU A 37 -88.672 -0.552 -35.780 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.302 0.110 -37.086 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.452 -2.050 -35.853 1.00 0.00 C ATOM 0 H LEU A 37 -90.050 0.883 -33.785 1.00 0.00 H new ATOM 0 HA LEU A 37 -88.337 -1.351 -33.087 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.781 1.107 -34.776 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.828 -0.363 -34.722 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.729 -0.362 -35.591 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -88.903 -0.313 -37.891 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.490 1.181 -37.017 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.246 -0.060 -37.294 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -89.047 -2.466 -36.666 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.397 -2.254 -36.035 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.753 -2.508 -34.911 1.00 0.00 H new ATOM 228 N THR A 38 -86.483 -0.207 -31.823 1.00 0.00 N ATOM 229 CA THR A 38 -85.536 0.374 -30.903 1.00 0.00 C ATOM 230 C THR A 38 -84.931 1.632 -31.508 1.00 0.00 C ATOM 231 O THR A 38 -84.753 1.707 -32.728 1.00 0.00 O ATOM 232 CB THR A 38 -84.423 -0.638 -30.597 1.00 0.00 C ATOM 233 OG1 THR A 38 -83.723 -0.968 -31.808 1.00 0.00 O ATOM 234 CG2 THR A 38 -85.023 -1.896 -30.000 1.00 0.00 C ATOM 0 H THR A 38 -86.245 -1.151 -32.126 1.00 0.00 H new ATOM 0 HA THR A 38 -86.051 0.634 -29.978 1.00 0.00 H new ATOM 0 HB THR A 38 -83.726 -0.198 -29.884 1.00 0.00 H new ATOM 0 HG1 THR A 38 -83.012 -1.613 -31.610 1.00 0.00 H new ATOM 0 HG21 THR A 38 -84.229 -2.611 -29.785 1.00 0.00 H new ATOM 0 HG22 THR A 38 -85.547 -1.647 -29.077 1.00 0.00 H new ATOM 0 HG23 THR A 38 -85.725 -2.336 -30.708 1.00 0.00 H new ATOM 242 N ARG A 39 -84.630 2.614 -30.673 1.00 0.00 N ATOM 243 CA ARG A 39 -83.999 3.844 -31.136 1.00 0.00 C ATOM 244 C ARG A 39 -82.534 3.598 -31.502 1.00 0.00 C ATOM 245 O ARG A 39 -81.617 4.177 -30.917 1.00 0.00 O ATOM 246 CB ARG A 39 -84.124 4.938 -30.073 1.00 0.00 C ATOM 247 CG ARG A 39 -83.705 4.493 -28.680 1.00 0.00 C ATOM 248 CD ARG A 39 -83.940 5.582 -27.652 1.00 0.00 C ATOM 249 NE ARG A 39 -83.087 6.750 -27.868 1.00 0.00 N ATOM 250 CZ ARG A 39 -82.816 7.648 -26.924 1.00 0.00 C ATOM 251 NH1 ARG A 39 -83.363 7.535 -25.718 1.00 0.00 N ATOM 252 NH2 ARG A 39 -82.007 8.665 -27.190 1.00 0.00 N ATOM 0 H ARG A 39 -84.812 2.585 -29.670 1.00 0.00 H new ATOM 0 HA ARG A 39 -84.515 4.181 -32.035 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -83.514 5.791 -30.370 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -85.158 5.281 -30.039 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -84.264 3.600 -28.399 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -82.650 4.220 -28.687 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -84.985 5.889 -27.685 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -83.757 5.182 -26.655 1.00 0.00 H new ATOM 0 HE ARG A 39 -82.677 6.884 -28.793 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -83.992 6.759 -25.514 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -83.154 8.225 -24.996 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -81.593 8.758 -28.118 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -81.799 9.354 -26.467 1.00 0.00 H new ATOM 266 N SER A 40 -82.333 2.722 -32.476 1.00 0.00 N ATOM 267 CA SER A 40 -81.009 2.351 -32.928 1.00 0.00 C ATOM 268 C SER A 40 -80.525 3.333 -33.982 1.00 0.00 C ATOM 269 O SER A 40 -79.490 3.979 -33.826 1.00 0.00 O ATOM 270 CB SER A 40 -81.041 0.923 -33.492 1.00 0.00 C ATOM 271 OG SER A 40 -81.879 0.824 -34.635 1.00 0.00 O ATOM 0 H SER A 40 -83.088 2.250 -32.973 1.00 0.00 H new ATOM 0 HA SER A 40 -80.316 2.382 -32.087 1.00 0.00 H new ATOM 0 HB2 SER A 40 -80.029 0.614 -33.755 1.00 0.00 H new ATOM 0 HB3 SER A 40 -81.394 0.236 -32.722 1.00 0.00 H new ATOM 0 HG SER A 40 -81.457 0.241 -35.300 1.00 0.00 H new ATOM 277 N ASN A 41 -81.297 3.443 -35.049 1.00 0.00 N ATOM 278 CA ASN A 41 -80.982 4.348 -36.137 1.00 0.00 C ATOM 279 C ASN A 41 -82.217 5.119 -36.569 1.00 0.00 C ATOM 280 O ASN A 41 -82.116 6.264 -37.007 1.00 0.00 O ATOM 281 CB ASN A 41 -80.405 3.580 -37.331 1.00 0.00 C ATOM 282 CG ASN A 41 -78.997 3.073 -37.077 1.00 0.00 C ATOM 283 OD1 ASN A 41 -78.803 1.964 -36.579 1.00 0.00 O ATOM 284 ND2 ASN A 41 -78.005 3.882 -37.420 1.00 0.00 N ATOM 0 H ASN A 41 -82.156 2.909 -35.184 1.00 0.00 H new ATOM 0 HA ASN A 41 -80.234 5.055 -35.779 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -81.054 2.736 -37.563 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -80.401 4.229 -38.207 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -77.038 3.593 -37.274 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -78.209 4.793 -37.830 1.00 0.00 H new ATOM 291 N SER A 42 -83.386 4.501 -36.438 1.00 0.00 N ATOM 292 CA SER A 42 -84.614 5.135 -36.895 1.00 0.00 C ATOM 293 C SER A 42 -85.841 4.601 -36.175 1.00 0.00 C ATOM 294 O SER A 42 -85.871 3.465 -35.708 1.00 0.00 O ATOM 295 CB SER A 42 -84.774 4.947 -38.406 1.00 0.00 C ATOM 296 OG SER A 42 -86.005 5.479 -38.865 1.00 0.00 O ATOM 0 H SER A 42 -83.508 3.576 -36.026 1.00 0.00 H new ATOM 0 HA SER A 42 -84.534 6.197 -36.663 1.00 0.00 H new ATOM 0 HB2 SER A 42 -83.949 5.435 -38.924 1.00 0.00 H new ATOM 0 HB3 SER A 42 -84.721 3.886 -38.650 1.00 0.00 H new ATOM 0 HG SER A 42 -86.078 5.346 -39.833 1.00 0.00 H new ATOM 302 N LYS A 43 -86.852 5.452 -36.089 1.00 0.00 N ATOM 303 CA LYS A 43 -88.162 5.055 -35.608 1.00 0.00 C ATOM 304 C LYS A 43 -88.814 4.113 -36.613 1.00 0.00 C ATOM 305 O LYS A 43 -89.727 3.361 -36.277 1.00 0.00 O ATOM 306 CB LYS A 43 -89.044 6.290 -35.392 1.00 0.00 C ATOM 307 CG LYS A 43 -88.914 7.330 -36.500 1.00 0.00 C ATOM 308 CD LYS A 43 -89.942 8.442 -36.368 1.00 0.00 C ATOM 309 CE LYS A 43 -91.325 7.967 -36.782 1.00 0.00 C ATOM 310 NZ LYS A 43 -92.332 9.057 -36.736 1.00 0.00 N ATOM 0 H LYS A 43 -86.785 6.436 -36.351 1.00 0.00 H new ATOM 0 HA LYS A 43 -88.050 4.538 -34.655 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -90.085 5.975 -35.320 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -88.784 6.751 -34.439 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -87.912 7.759 -36.477 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -89.030 6.843 -37.468 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -89.970 8.794 -35.337 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -89.646 9.289 -36.986 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -91.280 7.560 -37.792 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -91.640 7.156 -36.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -93.190 8.759 -37.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -92.571 9.268 -35.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -91.942 9.909 -37.187 1.00 0.00 H new ATOM 324 N CYS A 44 -88.330 4.156 -37.850 1.00 0.00 N ATOM 325 CA CYS A 44 -88.861 3.305 -38.898 1.00 0.00 C ATOM 326 C CYS A 44 -87.787 2.320 -39.385 1.00 0.00 C ATOM 327 O CYS A 44 -87.945 1.685 -40.425 1.00 0.00 O ATOM 328 CB CYS A 44 -89.392 4.160 -40.062 1.00 0.00 C ATOM 329 SG CYS A 44 -90.146 5.738 -39.540 1.00 0.00 S ATOM 0 H CYS A 44 -87.572 4.771 -38.147 1.00 0.00 H new ATOM 0 HA CYS A 44 -89.692 2.727 -38.493 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -88.572 4.371 -40.748 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.131 3.582 -40.616 1.00 0.00 H new ATOM 334 N GLN A 45 -86.698 2.177 -38.613 1.00 0.00 N ATOM 335 CA GLN A 45 -85.690 1.141 -38.880 1.00 0.00 C ATOM 336 C GLN A 45 -84.931 0.790 -37.594 1.00 0.00 C ATOM 337 O GLN A 45 -84.316 1.656 -36.973 1.00 0.00 O ATOM 338 CB GLN A 45 -84.706 1.607 -39.961 1.00 0.00 C ATOM 339 CG GLN A 45 -83.661 0.568 -40.333 1.00 0.00 C ATOM 340 CD GLN A 45 -82.659 1.082 -41.348 1.00 0.00 C ATOM 341 OE1 GLN A 45 -82.866 0.971 -42.555 1.00 0.00 O ATOM 342 NE2 GLN A 45 -81.557 1.636 -40.865 1.00 0.00 N ATOM 0 H GLN A 45 -86.494 2.763 -37.803 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.205 0.250 -39.240 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -85.267 1.880 -40.855 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -84.200 2.508 -39.614 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -83.132 0.253 -39.434 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -84.159 -0.314 -40.735 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -81.423 1.709 -39.857 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -80.843 1.989 -41.502 1.00 0.00 H new ATOM 351 N GLY A 46 -84.942 -0.489 -37.222 1.00 0.00 N ATOM 352 CA GLY A 46 -84.328 -0.908 -35.972 1.00 0.00 C ATOM 353 C GLY A 46 -84.762 -2.302 -35.553 1.00 0.00 C ATOM 354 O GLY A 46 -85.513 -2.961 -36.270 1.00 0.00 O ATOM 0 H GLY A 46 -85.365 -1.242 -37.764 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.243 -0.884 -36.077 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.588 -0.198 -35.187 1.00 0.00 H new ATOM 358 N GLN A 47 -84.252 -2.774 -34.420 1.00 0.00 N ATOM 359 CA GLN A 47 -84.718 -4.031 -33.837 1.00 0.00 C ATOM 360 C GLN A 47 -86.118 -3.831 -33.262 1.00 0.00 C ATOM 361 O GLN A 47 -86.514 -2.701 -32.989 1.00 0.00 O ATOM 362 CB GLN A 47 -83.764 -4.504 -32.733 1.00 0.00 C ATOM 363 CG GLN A 47 -82.347 -4.791 -33.211 1.00 0.00 C ATOM 364 CD GLN A 47 -82.275 -5.943 -34.195 1.00 0.00 C ATOM 365 OE1 GLN A 47 -82.126 -7.101 -33.808 1.00 0.00 O ATOM 366 NE2 GLN A 47 -82.356 -5.632 -35.475 1.00 0.00 N ATOM 0 H GLN A 47 -83.518 -2.308 -33.887 1.00 0.00 H new ATOM 0 HA GLN A 47 -84.744 -4.793 -34.616 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -83.725 -3.744 -31.952 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -84.172 -5.407 -32.279 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -81.939 -3.895 -33.679 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -81.718 -5.016 -32.350 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -82.480 -4.660 -35.757 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -82.295 -6.364 -36.183 1.00 0.00 H new ATOM 375 N LEU A 48 -86.867 -4.908 -33.080 1.00 0.00 N ATOM 376 CA LEU A 48 -88.228 -4.787 -32.571 1.00 0.00 C ATOM 377 C LEU A 48 -88.233 -4.614 -31.056 1.00 0.00 C ATOM 378 O LEU A 48 -87.693 -5.435 -30.315 1.00 0.00 O ATOM 379 CB LEU A 48 -89.081 -5.992 -32.976 1.00 0.00 C ATOM 380 CG LEU A 48 -90.561 -5.904 -32.591 1.00 0.00 C ATOM 381 CD1 LEU A 48 -91.213 -4.697 -33.247 1.00 0.00 C ATOM 382 CD2 LEU A 48 -91.293 -7.179 -32.985 1.00 0.00 C ATOM 0 H LEU A 48 -86.563 -5.862 -33.273 1.00 0.00 H new ATOM 0 HA LEU A 48 -88.667 -3.896 -33.019 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -89.010 -6.120 -34.056 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -88.656 -6.887 -32.521 1.00 0.00 H new ATOM 0 HG LEU A 48 -90.626 -5.788 -31.509 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -92.264 -4.651 -32.962 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.708 -3.788 -32.920 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -91.135 -4.785 -34.331 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -92.343 -7.098 -32.703 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -91.216 -7.324 -34.063 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.845 -8.029 -32.471 1.00 0.00 H new ATOM 394 N GLU A 49 -88.857 -3.533 -30.620 1.00 0.00 N ATOM 395 CA GLU A 49 -88.925 -3.164 -29.215 1.00 0.00 C ATOM 396 C GLU A 49 -90.380 -3.169 -28.754 1.00 0.00 C ATOM 397 O GLU A 49 -91.184 -2.339 -29.189 1.00 0.00 O ATOM 398 CB GLU A 49 -88.322 -1.772 -29.041 1.00 0.00 C ATOM 399 CG GLU A 49 -88.143 -1.332 -27.600 1.00 0.00 C ATOM 400 CD GLU A 49 -87.610 0.083 -27.508 1.00 0.00 C ATOM 401 OE1 GLU A 49 -88.422 1.037 -27.516 1.00 0.00 O ATOM 402 OE2 GLU A 49 -86.378 0.258 -27.450 1.00 0.00 O ATOM 0 H GLU A 49 -89.337 -2.879 -31.238 1.00 0.00 H new ATOM 0 HA GLU A 49 -88.365 -3.880 -28.613 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -87.352 -1.747 -29.537 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -88.959 -1.049 -29.550 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -89.098 -1.396 -27.079 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -87.458 -2.012 -27.094 1.00 0.00 H new ATOM 409 N VAL A 50 -90.726 -4.112 -27.893 1.00 0.00 N ATOM 410 CA VAL A 50 -92.105 -4.255 -27.446 1.00 0.00 C ATOM 411 C VAL A 50 -92.198 -4.283 -25.924 1.00 0.00 C ATOM 412 O VAL A 50 -91.391 -4.925 -25.254 1.00 0.00 O ATOM 413 CB VAL A 50 -92.752 -5.525 -28.036 1.00 0.00 C ATOM 414 CG1 VAL A 50 -93.043 -5.331 -29.515 1.00 0.00 C ATOM 415 CG2 VAL A 50 -91.849 -6.734 -27.833 1.00 0.00 C ATOM 0 H VAL A 50 -90.076 -4.787 -27.490 1.00 0.00 H new ATOM 0 HA VAL A 50 -92.651 -3.384 -27.808 1.00 0.00 H new ATOM 0 HB VAL A 50 -93.691 -5.704 -27.513 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -93.499 -6.235 -29.918 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -93.726 -4.491 -29.644 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -92.113 -5.127 -30.045 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -92.325 -7.619 -28.257 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -90.894 -6.562 -28.330 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -91.681 -6.888 -26.767 1.00 0.00 H new ATOM 425 N TYR A 51 -93.184 -3.578 -25.381 1.00 0.00 N ATOM 426 CA TYR A 51 -93.348 -3.489 -23.934 1.00 0.00 C ATOM 427 C TYR A 51 -94.318 -4.552 -23.436 1.00 0.00 C ATOM 428 O TYR A 51 -95.532 -4.410 -23.587 1.00 0.00 O ATOM 429 CB TYR A 51 -93.860 -2.101 -23.539 1.00 0.00 C ATOM 430 CG TYR A 51 -93.901 -1.872 -22.044 1.00 0.00 C ATOM 431 CD1 TYR A 51 -92.728 -1.806 -21.300 1.00 0.00 C ATOM 432 CD2 TYR A 51 -95.110 -1.716 -21.378 1.00 0.00 C ATOM 433 CE1 TYR A 51 -92.762 -1.591 -19.937 1.00 0.00 C ATOM 434 CE2 TYR A 51 -95.151 -1.501 -20.014 1.00 0.00 C ATOM 435 CZ TYR A 51 -93.973 -1.438 -19.299 1.00 0.00 C ATOM 436 OH TYR A 51 -94.006 -1.214 -17.942 1.00 0.00 O ATOM 0 H TYR A 51 -93.880 -3.061 -25.918 1.00 0.00 H new ATOM 0 HA TYR A 51 -92.375 -3.656 -23.473 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -93.223 -1.344 -23.996 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -94.861 -1.963 -23.947 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -91.776 -1.925 -21.796 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -96.033 -1.764 -21.936 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -91.842 -1.543 -19.373 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -96.099 -1.383 -19.511 1.00 0.00 H new ATOM 0 HH TYR A 51 -94.937 -1.127 -17.647 1.00 0.00 H new ATOM 446 N LEU A 52 -93.790 -5.618 -22.842 1.00 0.00 N ATOM 447 CA LEU A 52 -94.640 -6.693 -22.344 1.00 0.00 C ATOM 448 C LEU A 52 -94.066 -7.354 -21.114 1.00 0.00 C ATOM 449 O LEU A 52 -92.843 -7.458 -20.969 1.00 0.00 O ATOM 450 CB LEU A 52 -94.941 -7.730 -23.441 1.00 0.00 C ATOM 451 CG LEU A 52 -93.794 -8.615 -24.000 1.00 0.00 C ATOM 452 CD1 LEU A 52 -92.586 -7.796 -24.423 1.00 0.00 C ATOM 453 CD2 LEU A 52 -93.391 -9.710 -23.019 1.00 0.00 C ATOM 0 H LEU A 52 -92.791 -5.760 -22.695 1.00 0.00 H new ATOM 0 HA LEU A 52 -95.583 -6.233 -22.050 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -95.709 -8.399 -23.054 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -95.379 -7.195 -24.283 1.00 0.00 H new ATOM 0 HG LEU A 52 -94.189 -9.097 -24.894 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -91.812 -8.461 -24.807 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -92.878 -7.092 -25.202 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -92.200 -7.247 -23.564 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -92.586 -10.306 -23.449 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -93.050 -9.257 -22.088 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -94.249 -10.351 -22.817 1.00 0.00 H new ATOM 465 N LYS A 53 -94.975 -7.771 -20.229 1.00 0.00 N ATOM 466 CA LYS A 53 -94.646 -8.438 -18.967 1.00 0.00 C ATOM 467 C LYS A 53 -93.981 -7.463 -18.003 1.00 0.00 C ATOM 468 O LYS A 53 -94.315 -7.419 -16.817 1.00 0.00 O ATOM 469 CB LYS A 53 -93.751 -9.668 -19.209 1.00 0.00 C ATOM 470 CG LYS A 53 -93.859 -10.754 -18.140 1.00 0.00 C ATOM 471 CD LYS A 53 -93.266 -10.325 -16.803 1.00 0.00 C ATOM 472 CE LYS A 53 -92.060 -11.170 -16.414 1.00 0.00 C ATOM 473 NZ LYS A 53 -90.949 -11.048 -17.393 1.00 0.00 N ATOM 0 H LYS A 53 -95.978 -7.652 -20.372 1.00 0.00 H new ATOM 0 HA LYS A 53 -95.575 -8.785 -18.515 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -94.006 -10.102 -20.176 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -92.714 -9.339 -19.271 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -94.907 -11.017 -18.000 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -93.349 -11.652 -18.488 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -92.972 -9.277 -16.857 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -94.028 -10.402 -16.027 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -91.708 -10.866 -15.428 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -92.361 -12.215 -16.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -90.047 -11.263 -16.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -91.100 -11.717 -18.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -90.922 -10.078 -17.768 1.00 0.00 H new ATOM 487 N ASP A 54 -93.080 -6.653 -18.534 1.00 0.00 N ATOM 488 CA ASP A 54 -92.232 -5.790 -17.713 1.00 0.00 C ATOM 489 C ASP A 54 -91.215 -5.069 -18.575 1.00 0.00 C ATOM 490 O ASP A 54 -90.895 -3.906 -18.340 1.00 0.00 O ATOM 491 CB ASP A 54 -91.481 -6.615 -16.650 1.00 0.00 C ATOM 492 CG ASP A 54 -90.386 -7.496 -17.237 1.00 0.00 C ATOM 493 OD1 ASP A 54 -90.708 -8.442 -17.990 1.00 0.00 O ATOM 494 OD2 ASP A 54 -89.197 -7.252 -16.941 1.00 0.00 O ATOM 0 H ASP A 54 -92.913 -6.572 -19.537 1.00 0.00 H new ATOM 0 HA ASP A 54 -92.879 -5.064 -17.221 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -91.040 -5.938 -15.919 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -92.195 -7.242 -16.115 1.00 0.00 H new ATOM 499 N GLY A 55 -90.729 -5.762 -19.586 1.00 0.00 N ATOM 500 CA GLY A 55 -89.585 -5.281 -20.327 1.00 0.00 C ATOM 501 C GLY A 55 -89.935 -4.677 -21.654 1.00 0.00 C ATOM 502 O GLY A 55 -90.833 -5.160 -22.350 1.00 0.00 O ATOM 0 H GLY A 55 -91.106 -6.653 -19.910 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -89.061 -4.537 -19.726 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -88.893 -6.108 -20.486 1.00 0.00 H new ATOM 506 N TRP A 56 -89.239 -3.600 -21.993 1.00 0.00 N ATOM 507 CA TRP A 56 -89.152 -3.163 -23.370 1.00 0.00 C ATOM 508 C TRP A 56 -88.259 -4.147 -24.090 1.00 0.00 C ATOM 509 O TRP A 56 -87.093 -3.873 -24.359 1.00 0.00 O ATOM 510 CB TRP A 56 -88.578 -1.750 -23.479 1.00 0.00 C ATOM 511 CG TRP A 56 -89.605 -0.679 -23.331 1.00 0.00 C ATOM 512 CD1 TRP A 56 -89.789 0.150 -22.265 1.00 0.00 C ATOM 513 CD2 TRP A 56 -90.598 -0.327 -24.293 1.00 0.00 C ATOM 514 NE1 TRP A 56 -90.837 1.002 -22.509 1.00 0.00 N ATOM 515 CE2 TRP A 56 -91.351 0.726 -23.750 1.00 0.00 C ATOM 516 CE3 TRP A 56 -90.920 -0.804 -25.566 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -92.408 1.310 -24.438 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -91.969 -0.225 -26.246 1.00 0.00 C ATOM 519 CH2 TRP A 56 -92.701 0.822 -25.682 1.00 0.00 C ATOM 0 H TRP A 56 -88.729 -3.017 -21.330 1.00 0.00 H new ATOM 0 HA TRP A 56 -90.147 -3.131 -23.813 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -87.813 -1.617 -22.714 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -88.086 -1.640 -24.445 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -89.197 0.138 -21.362 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -91.178 1.722 -21.872 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -90.357 -1.612 -26.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -92.977 2.120 -24.006 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -92.229 -0.586 -27.230 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -93.517 1.256 -26.241 1.00 0.00 H new ATOM 530 N HIS A 57 -88.807 -5.319 -24.335 1.00 0.00 N ATOM 531 CA HIS A 57 -88.019 -6.447 -24.760 1.00 0.00 C ATOM 532 C HIS A 57 -87.553 -6.265 -26.190 1.00 0.00 C ATOM 533 O HIS A 57 -88.363 -6.243 -27.118 1.00 0.00 O ATOM 534 CB HIS A 57 -88.809 -7.753 -24.612 1.00 0.00 C ATOM 535 CG HIS A 57 -88.879 -8.252 -23.199 1.00 0.00 C ATOM 536 ND1 HIS A 57 -87.771 -8.659 -22.491 1.00 0.00 N ATOM 537 CD2 HIS A 57 -89.933 -8.403 -22.360 1.00 0.00 C ATOM 538 CE1 HIS A 57 -88.138 -9.043 -21.283 1.00 0.00 C ATOM 539 NE2 HIS A 57 -89.444 -8.897 -21.175 1.00 0.00 N ATOM 0 H HIS A 57 -89.805 -5.512 -24.245 1.00 0.00 H new ATOM 0 HA HIS A 57 -87.141 -6.507 -24.117 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.821 -7.600 -24.986 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -88.350 -8.519 -25.237 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -90.965 -8.177 -22.582 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -87.479 -9.415 -20.512 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -90.000 -9.115 -20.348 1.00 0.00 H new ATOM 548 N MET A 58 -86.252 -6.093 -26.355 1.00 0.00 N ATOM 549 CA MET A 58 -85.662 -6.011 -27.678 1.00 0.00 C ATOM 550 C MET A 58 -85.584 -7.411 -28.262 1.00 0.00 C ATOM 551 O MET A 58 -84.691 -8.190 -27.912 1.00 0.00 O ATOM 552 CB MET A 58 -84.257 -5.394 -27.632 1.00 0.00 C ATOM 553 CG MET A 58 -84.162 -4.103 -26.830 1.00 0.00 C ATOM 554 SD MET A 58 -84.053 -4.390 -25.046 1.00 0.00 S ATOM 555 CE MET A 58 -82.517 -5.309 -24.942 1.00 0.00 C ATOM 0 H MET A 58 -85.585 -6.008 -25.588 1.00 0.00 H new ATOM 0 HA MET A 58 -86.286 -5.369 -28.299 1.00 0.00 H new ATOM 0 HB2 MET A 58 -83.567 -6.123 -27.207 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.926 -5.199 -28.652 1.00 0.00 H new ATOM 0 HG2 MET A 58 -83.287 -3.541 -27.157 1.00 0.00 H new ATOM 0 HG3 MET A 58 -85.035 -3.485 -27.041 1.00 0.00 H new ATOM 0 HE1 MET A 58 -81.914 -4.919 -24.122 1.00 0.00 H new ATOM 0 HE2 MET A 58 -82.734 -6.362 -24.763 1.00 0.00 H new ATOM 0 HE3 MET A 58 -81.967 -5.206 -25.878 1.00 0.00 H new ATOM 565 N VAL A 59 -86.533 -7.742 -29.120 1.00 0.00 N ATOM 566 CA VAL A 59 -86.609 -9.080 -29.682 1.00 0.00 C ATOM 567 C VAL A 59 -85.749 -9.173 -30.936 1.00 0.00 C ATOM 568 O VAL A 59 -85.290 -8.156 -31.459 1.00 0.00 O ATOM 569 CB VAL A 59 -88.067 -9.485 -30.013 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.982 -9.241 -28.826 1.00 0.00 C ATOM 571 CG2 VAL A 59 -88.583 -8.750 -31.235 1.00 0.00 C ATOM 0 H VAL A 59 -87.261 -7.104 -29.443 1.00 0.00 H new ATOM 0 HA VAL A 59 -86.233 -9.773 -28.929 1.00 0.00 H new ATOM 0 HB VAL A 59 -88.065 -10.552 -30.236 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -90.000 -9.534 -29.085 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.640 -9.831 -27.976 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -88.964 -8.183 -28.564 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -89.609 -9.058 -31.439 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -88.556 -7.676 -31.052 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.955 -8.987 -32.094 1.00 0.00 H new ATOM 581 N CYS A 60 -85.540 -10.385 -31.427 1.00 0.00 N ATOM 582 CA CYS A 60 -84.730 -10.579 -32.621 1.00 0.00 C ATOM 583 C CYS A 60 -85.599 -10.489 -33.875 1.00 0.00 C ATOM 584 O CYS A 60 -85.207 -10.944 -34.951 1.00 0.00 O ATOM 585 CB CYS A 60 -83.996 -11.923 -32.563 1.00 0.00 C ATOM 586 SG CYS A 60 -85.055 -13.391 -32.698 1.00 0.00 S ATOM 0 H CYS A 60 -85.916 -11.242 -31.022 1.00 0.00 H new ATOM 0 HA CYS A 60 -83.983 -9.787 -32.664 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -83.260 -11.951 -33.366 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -83.445 -11.977 -31.624 1.00 0.00 H new ATOM 591 N SER A 61 -86.786 -9.896 -33.702 1.00 0.00 N ATOM 592 CA SER A 61 -87.738 -9.638 -34.786 1.00 0.00 C ATOM 593 C SER A 61 -88.412 -10.918 -35.295 1.00 0.00 C ATOM 594 O SER A 61 -89.631 -10.952 -35.445 1.00 0.00 O ATOM 595 CB SER A 61 -87.061 -8.880 -35.925 1.00 0.00 C ATOM 596 OG SER A 61 -86.504 -7.660 -35.460 1.00 0.00 O ATOM 0 H SER A 61 -87.116 -9.578 -32.791 1.00 0.00 H new ATOM 0 HA SER A 61 -88.531 -9.014 -34.375 1.00 0.00 H new ATOM 0 HB2 SER A 61 -86.278 -9.498 -36.364 1.00 0.00 H new ATOM 0 HB3 SER A 61 -87.786 -8.677 -36.713 1.00 0.00 H new ATOM 0 HG SER A 61 -85.529 -7.687 -35.559 1.00 0.00 H new ATOM 602 N GLN A 62 -87.637 -11.969 -35.544 1.00 0.00 N ATOM 603 CA GLN A 62 -88.207 -13.239 -35.993 1.00 0.00 C ATOM 604 C GLN A 62 -88.594 -14.102 -34.799 1.00 0.00 C ATOM 605 O GLN A 62 -88.813 -15.300 -34.935 1.00 0.00 O ATOM 606 CB GLN A 62 -87.234 -14.011 -36.887 1.00 0.00 C ATOM 607 CG GLN A 62 -85.970 -14.458 -36.173 1.00 0.00 C ATOM 608 CD GLN A 62 -85.706 -15.946 -36.324 1.00 0.00 C ATOM 609 OE1 GLN A 62 -85.161 -16.585 -35.430 1.00 0.00 O ATOM 610 NE2 GLN A 62 -86.071 -16.503 -37.465 1.00 0.00 N ATOM 0 H GLN A 62 -86.622 -11.970 -35.444 1.00 0.00 H new ATOM 0 HA GLN A 62 -89.097 -13.005 -36.577 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -87.742 -14.887 -37.290 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -86.959 -13.384 -37.735 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -85.120 -13.901 -36.566 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -86.050 -14.213 -35.114 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -86.522 -15.940 -38.186 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -85.902 -17.496 -37.625 1.00 0.00 H new ATOM 619 N SER A 63 -88.669 -13.492 -33.628 1.00 0.00 N ATOM 620 CA SER A 63 -89.130 -14.193 -32.442 1.00 0.00 C ATOM 621 C SER A 63 -90.578 -14.653 -32.657 1.00 0.00 C ATOM 622 O SER A 63 -91.260 -14.140 -33.550 1.00 0.00 O ATOM 623 CB SER A 63 -89.016 -13.271 -31.227 1.00 0.00 C ATOM 624 OG SER A 63 -87.695 -12.772 -31.091 1.00 0.00 O ATOM 0 H SER A 63 -88.417 -12.516 -33.473 1.00 0.00 H new ATOM 0 HA SER A 63 -88.512 -15.072 -32.261 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.714 -12.440 -31.330 1.00 0.00 H new ATOM 0 HB3 SER A 63 -89.298 -13.815 -30.325 1.00 0.00 H new ATOM 0 HG SER A 63 -87.101 -13.245 -31.711 1.00 0.00 H new ATOM 630 N TRP A 64 -91.037 -15.615 -31.852 1.00 0.00 N ATOM 631 CA TRP A 64 -92.383 -16.185 -31.989 1.00 0.00 C ATOM 632 C TRP A 64 -92.498 -17.038 -33.253 1.00 0.00 C ATOM 633 O TRP A 64 -92.358 -18.260 -33.200 1.00 0.00 O ATOM 634 CB TRP A 64 -93.469 -15.097 -32.003 1.00 0.00 C ATOM 635 CG TRP A 64 -93.584 -14.333 -30.723 1.00 0.00 C ATOM 636 CD1 TRP A 64 -94.307 -14.692 -29.627 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.968 -13.078 -30.405 1.00 0.00 C ATOM 638 NE1 TRP A 64 -94.171 -13.746 -28.646 1.00 0.00 N ATOM 639 CE2 TRP A 64 -93.355 -12.746 -29.098 1.00 0.00 C ATOM 640 CE3 TRP A 64 -92.125 -12.206 -31.099 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.927 -11.583 -28.468 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.699 -11.052 -30.470 1.00 0.00 C ATOM 643 CH2 TRP A 64 -92.100 -10.749 -29.166 1.00 0.00 C ATOM 0 H TRP A 64 -90.491 -16.020 -31.091 1.00 0.00 H new ATOM 0 HA TRP A 64 -92.542 -16.818 -31.116 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -93.258 -14.399 -32.813 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -94.430 -15.561 -32.224 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.900 -15.590 -29.543 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.608 -13.782 -27.725 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.812 -12.430 -32.108 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -93.238 -11.347 -27.461 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -91.045 -10.372 -30.995 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.750 -9.839 -28.702 1.00 0.00 H new ATOM 654 N GLY A 65 -92.713 -16.380 -34.388 1.00 0.00 N ATOM 655 CA GLY A 65 -92.961 -17.087 -35.632 1.00 0.00 C ATOM 656 C GLY A 65 -91.733 -17.800 -36.161 1.00 0.00 C ATOM 657 O GLY A 65 -91.841 -18.898 -36.711 1.00 0.00 O ATOM 0 H GLY A 65 -92.720 -15.363 -34.468 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -93.759 -17.814 -35.478 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -93.315 -16.379 -36.382 1.00 0.00 H new ATOM 661 N ARG A 66 -90.571 -17.172 -35.981 1.00 0.00 N ATOM 662 CA ARG A 66 -89.287 -17.713 -36.438 1.00 0.00 C ATOM 663 C ARG A 66 -89.214 -17.741 -37.962 1.00 0.00 C ATOM 664 O ARG A 66 -88.679 -16.820 -38.576 1.00 0.00 O ATOM 665 CB ARG A 66 -89.044 -19.109 -35.855 1.00 0.00 C ATOM 666 CG ARG A 66 -89.027 -19.134 -34.335 1.00 0.00 C ATOM 667 CD ARG A 66 -89.122 -20.553 -33.807 1.00 0.00 C ATOM 668 NE ARG A 66 -90.368 -21.201 -34.224 1.00 0.00 N ATOM 669 CZ ARG A 66 -90.470 -22.491 -34.532 1.00 0.00 C ATOM 670 NH1 ARG A 66 -89.415 -23.287 -34.419 1.00 0.00 N ATOM 671 NH2 ARG A 66 -91.635 -22.991 -34.930 1.00 0.00 N ATOM 0 H ARG A 66 -90.492 -16.270 -35.512 1.00 0.00 H new ATOM 0 HA ARG A 66 -88.499 -17.053 -36.077 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -89.821 -19.785 -36.213 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -88.093 -19.490 -36.228 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -88.111 -18.669 -33.972 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -89.859 -18.544 -33.950 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -88.272 -21.133 -34.166 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -89.064 -20.542 -32.719 1.00 0.00 H new ATOM 0 HE ARG A 66 -91.209 -20.627 -34.282 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -88.524 -22.910 -34.096 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -89.495 -24.276 -34.656 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -92.453 -22.385 -35.000 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -91.711 -23.980 -35.166 1.00 0.00 H new ATOM 685 N SER A 67 -89.780 -18.787 -38.551 1.00 0.00 N ATOM 686 CA SER A 67 -89.800 -18.983 -40.001 1.00 0.00 C ATOM 687 C SER A 67 -88.387 -19.109 -40.589 1.00 0.00 C ATOM 688 O SER A 67 -87.889 -20.216 -40.794 1.00 0.00 O ATOM 689 CB SER A 67 -90.574 -17.853 -40.690 1.00 0.00 C ATOM 690 OG SER A 67 -91.892 -17.748 -40.176 1.00 0.00 O ATOM 0 H SER A 67 -90.244 -19.533 -38.033 1.00 0.00 H new ATOM 0 HA SER A 67 -90.313 -19.926 -40.191 1.00 0.00 H new ATOM 0 HB2 SER A 67 -90.049 -16.909 -40.547 1.00 0.00 H new ATOM 0 HB3 SER A 67 -90.613 -18.037 -41.764 1.00 0.00 H new ATOM 0 HG SER A 67 -92.363 -17.019 -40.631 1.00 0.00 H new ATOM 696 N SER A 68 -87.737 -17.980 -40.830 1.00 0.00 N ATOM 697 CA SER A 68 -86.456 -17.961 -41.514 1.00 0.00 C ATOM 698 C SER A 68 -85.720 -16.658 -41.196 1.00 0.00 C ATOM 699 O SER A 68 -86.174 -15.876 -40.361 1.00 0.00 O ATOM 700 CB SER A 68 -86.686 -18.100 -43.028 1.00 0.00 C ATOM 701 OG SER A 68 -85.465 -18.189 -43.746 1.00 0.00 O ATOM 0 H SER A 68 -88.081 -17.059 -40.559 1.00 0.00 H new ATOM 0 HA SER A 68 -85.842 -18.795 -41.173 1.00 0.00 H new ATOM 0 HB2 SER A 68 -87.287 -18.988 -43.223 1.00 0.00 H new ATOM 0 HB3 SER A 68 -87.257 -17.244 -43.388 1.00 0.00 H new ATOM 0 HG SER A 68 -84.844 -18.774 -43.264 1.00 0.00 H new ATOM 707 N LYS A 69 -84.590 -16.427 -41.865 1.00 0.00 N ATOM 708 CA LYS A 69 -83.824 -15.196 -41.680 1.00 0.00 C ATOM 709 C LYS A 69 -84.530 -14.028 -42.357 1.00 0.00 C ATOM 710 O LYS A 69 -84.207 -12.864 -42.120 1.00 0.00 O ATOM 711 CB LYS A 69 -82.396 -15.330 -42.229 1.00 0.00 C ATOM 712 CG LYS A 69 -81.511 -16.294 -41.445 1.00 0.00 C ATOM 713 CD LYS A 69 -81.626 -17.726 -41.948 1.00 0.00 C ATOM 714 CE LYS A 69 -81.053 -17.873 -43.352 1.00 0.00 C ATOM 715 NZ LYS A 69 -81.056 -19.287 -43.809 1.00 0.00 N ATOM 0 H LYS A 69 -84.186 -17.077 -42.540 1.00 0.00 H new ATOM 0 HA LYS A 69 -83.757 -15.008 -40.608 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -82.447 -15.663 -43.266 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -81.927 -14.346 -42.233 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -80.473 -15.969 -41.516 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -81.785 -16.259 -40.391 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -81.100 -18.395 -41.267 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -82.673 -18.030 -41.948 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -81.634 -17.266 -44.046 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -80.033 -17.488 -43.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -80.658 -19.343 -44.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -80.480 -19.862 -43.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -82.032 -19.647 -43.817 1.00 0.00 H new ATOM 729 N GLN A 70 -85.486 -14.352 -43.210 1.00 0.00 N ATOM 730 CA GLN A 70 -86.318 -13.352 -43.846 1.00 0.00 C ATOM 731 C GLN A 70 -87.755 -13.846 -43.870 1.00 0.00 C ATOM 732 O GLN A 70 -88.028 -14.947 -44.349 1.00 0.00 O ATOM 733 CB GLN A 70 -85.830 -13.066 -45.269 1.00 0.00 C ATOM 734 CG GLN A 70 -86.530 -11.886 -45.926 1.00 0.00 C ATOM 735 CD GLN A 70 -86.022 -11.601 -47.328 1.00 0.00 C ATOM 736 OE1 GLN A 70 -85.994 -10.452 -47.767 1.00 0.00 O ATOM 737 NE2 GLN A 70 -85.647 -12.645 -48.053 1.00 0.00 N ATOM 0 H GLN A 70 -85.705 -15.311 -43.479 1.00 0.00 H new ATOM 0 HA GLN A 70 -86.259 -12.423 -43.279 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -84.757 -12.874 -45.245 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -85.981 -13.955 -45.882 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -87.601 -12.083 -45.967 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -86.392 -10.999 -45.308 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -85.684 -13.583 -47.654 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -85.321 -12.511 -49.010 1.00 0.00 H new ATOM 746 N TRP A 71 -88.664 -13.051 -43.328 1.00 0.00 N ATOM 747 CA TRP A 71 -90.066 -13.433 -43.278 1.00 0.00 C ATOM 748 C TRP A 71 -90.737 -13.229 -44.622 1.00 0.00 C ATOM 749 O TRP A 71 -90.579 -12.185 -45.260 1.00 0.00 O ATOM 750 CB TRP A 71 -90.816 -12.647 -42.201 1.00 0.00 C ATOM 751 CG TRP A 71 -90.701 -13.249 -40.837 1.00 0.00 C ATOM 752 CD1 TRP A 71 -89.833 -14.222 -40.439 1.00 0.00 C ATOM 753 CD2 TRP A 71 -91.485 -12.917 -39.688 1.00 0.00 C ATOM 754 NE1 TRP A 71 -90.031 -14.517 -39.114 1.00 0.00 N ATOM 755 CE2 TRP A 71 -91.040 -13.727 -38.629 1.00 0.00 C ATOM 756 CE3 TRP A 71 -92.522 -12.011 -39.454 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -91.594 -13.659 -37.353 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -93.073 -11.943 -38.188 1.00 0.00 C ATOM 759 CH2 TRP A 71 -92.607 -12.762 -37.152 1.00 0.00 C ATOM 0 H TRP A 71 -88.457 -12.140 -42.918 1.00 0.00 H new ATOM 0 HA TRP A 71 -90.102 -14.493 -43.026 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -90.433 -11.627 -42.173 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -91.869 -12.584 -42.475 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -89.097 -14.692 -41.074 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -89.512 -15.212 -38.577 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -92.887 -11.375 -40.247 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -91.237 -14.290 -36.553 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -93.876 -11.247 -37.995 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -93.057 -12.684 -36.173 1.00 0.00 H new ATOM 770 N GLU A 72 -91.472 -14.243 -45.051 1.00 0.00 N ATOM 771 CA GLU A 72 -92.283 -14.151 -46.253 1.00 0.00 C ATOM 772 C GLU A 72 -93.403 -13.138 -46.046 1.00 0.00 C ATOM 773 O GLU A 72 -93.849 -12.481 -46.985 1.00 0.00 O ATOM 774 CB GLU A 72 -92.866 -15.525 -46.593 1.00 0.00 C ATOM 775 CG GLU A 72 -93.592 -16.176 -45.425 1.00 0.00 C ATOM 776 CD GLU A 72 -94.181 -17.526 -45.776 1.00 0.00 C ATOM 777 OE1 GLU A 72 -93.438 -18.528 -45.754 1.00 0.00 O ATOM 778 OE2 GLU A 72 -95.394 -17.594 -46.055 1.00 0.00 O ATOM 0 H GLU A 72 -91.523 -15.146 -44.579 1.00 0.00 H new ATOM 0 HA GLU A 72 -91.659 -13.819 -47.083 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -93.557 -15.422 -47.430 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -92.061 -16.182 -46.923 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -92.898 -16.293 -44.592 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -94.389 -15.515 -45.085 1.00 0.00 H new ATOM 785 N ASP A 73 -93.830 -13.002 -44.797 1.00 0.00 N ATOM 786 CA ASP A 73 -94.913 -12.097 -44.452 1.00 0.00 C ATOM 787 C ASP A 73 -94.537 -11.253 -43.238 1.00 0.00 C ATOM 788 O ASP A 73 -94.557 -11.734 -42.107 1.00 0.00 O ATOM 789 CB ASP A 73 -96.187 -12.888 -44.160 1.00 0.00 C ATOM 790 CG ASP A 73 -97.382 -11.986 -43.960 1.00 0.00 C ATOM 791 OD1 ASP A 73 -97.567 -11.476 -42.837 1.00 0.00 O ATOM 792 OD2 ASP A 73 -98.138 -11.776 -44.933 1.00 0.00 O ATOM 0 H ASP A 73 -93.439 -13.511 -44.004 1.00 0.00 H new ATOM 0 HA ASP A 73 -95.091 -11.434 -45.298 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -96.385 -13.574 -44.984 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -96.039 -13.496 -43.268 1.00 0.00 H new ATOM 797 N PRO A 74 -94.141 -9.995 -43.467 1.00 0.00 N ATOM 798 CA PRO A 74 -93.802 -9.047 -42.410 1.00 0.00 C ATOM 799 C PRO A 74 -94.954 -8.100 -42.057 1.00 0.00 C ATOM 800 O PRO A 74 -94.727 -6.967 -41.632 1.00 0.00 O ATOM 801 CB PRO A 74 -92.678 -8.281 -43.076 1.00 0.00 C ATOM 802 CG PRO A 74 -93.180 -8.118 -44.456 1.00 0.00 C ATOM 803 CD PRO A 74 -93.925 -9.389 -44.790 1.00 0.00 C ATOM 0 HA PRO A 74 -93.557 -9.528 -41.463 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -92.499 -7.321 -42.593 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -91.738 -8.832 -43.048 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -93.837 -7.251 -44.531 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -92.357 -7.955 -45.152 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -94.866 -9.184 -45.300 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -93.343 -10.039 -45.443 1.00 0.00 H new ATOM 811 N SER A 75 -96.189 -8.559 -42.225 1.00 0.00 N ATOM 812 CA SER A 75 -97.336 -7.706 -42.011 1.00 0.00 C ATOM 813 C SER A 75 -97.853 -7.837 -40.580 1.00 0.00 C ATOM 814 O SER A 75 -97.111 -8.208 -39.668 1.00 0.00 O ATOM 815 CB SER A 75 -98.439 -8.050 -43.023 1.00 0.00 C ATOM 816 OG SER A 75 -98.990 -9.334 -42.782 1.00 0.00 O ATOM 0 H SER A 75 -96.414 -9.513 -42.507 1.00 0.00 H new ATOM 0 HA SER A 75 -97.033 -6.670 -42.161 1.00 0.00 H new ATOM 0 HB2 SER A 75 -99.228 -7.300 -42.970 1.00 0.00 H new ATOM 0 HB3 SER A 75 -98.031 -8.013 -44.033 1.00 0.00 H new ATOM 0 HG SER A 75 -98.266 -9.977 -42.628 1.00 0.00 H new ATOM 822 N GLN A 76 -99.132 -7.514 -40.414 1.00 0.00 N ATOM 823 CA GLN A 76 -99.825 -7.508 -39.124 1.00 0.00 C ATOM 824 C GLN A 76 -99.345 -6.384 -38.197 1.00 0.00 C ATOM 825 O GLN A 76 -100.123 -5.855 -37.406 1.00 0.00 O ATOM 826 CB GLN A 76 -99.718 -8.866 -38.432 1.00 0.00 C ATOM 827 CG GLN A 76 -100.406 -9.992 -39.192 1.00 0.00 C ATOM 828 CD GLN A 76 -101.856 -9.683 -39.533 1.00 0.00 C ATOM 829 OE1 GLN A 76 -102.372 -10.140 -40.552 1.00 0.00 O ATOM 830 NE2 GLN A 76 -102.528 -8.919 -38.683 1.00 0.00 N ATOM 0 H GLN A 76 -99.733 -7.242 -41.192 1.00 0.00 H new ATOM 0 HA GLN A 76 -100.875 -7.312 -39.340 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -98.665 -9.117 -38.302 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -100.153 -8.792 -37.435 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -99.857 -10.190 -40.113 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -100.366 -10.903 -38.595 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -102.067 -8.558 -37.848 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -103.506 -8.693 -38.864 1.00 0.00 H new ATOM 839 N ALA A 77 -98.077 -6.014 -38.302 1.00 0.00 N ATOM 840 CA ALA A 77 -97.532 -4.902 -37.534 1.00 0.00 C ATOM 841 C ALA A 77 -97.790 -3.579 -38.249 1.00 0.00 C ATOM 842 O ALA A 77 -97.180 -2.550 -37.934 1.00 0.00 O ATOM 843 CB ALA A 77 -96.046 -5.101 -37.299 1.00 0.00 C ATOM 0 H ALA A 77 -97.402 -6.470 -38.915 1.00 0.00 H new ATOM 0 HA ALA A 77 -98.034 -4.871 -36.567 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -95.653 -4.262 -36.724 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -95.886 -6.027 -36.746 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.530 -5.157 -38.258 1.00 0.00 H new ATOM 849 N SER A 78 -98.707 -3.617 -39.207 1.00 0.00 N ATOM 850 CA SER A 78 -99.098 -2.439 -39.961 1.00 0.00 C ATOM 851 C SER A 78 -99.551 -1.334 -39.014 1.00 0.00 C ATOM 852 O SER A 78 -99.119 -0.191 -39.132 1.00 0.00 O ATOM 853 CB SER A 78 -100.225 -2.810 -40.922 1.00 0.00 C ATOM 854 OG SER A 78 -99.932 -4.029 -41.590 1.00 0.00 O ATOM 0 H SER A 78 -99.199 -4.467 -39.481 1.00 0.00 H new ATOM 0 HA SER A 78 -98.244 -2.072 -40.531 1.00 0.00 H new ATOM 0 HB2 SER A 78 -101.162 -2.906 -40.373 1.00 0.00 H new ATOM 0 HB3 SER A 78 -100.364 -2.013 -41.653 1.00 0.00 H new ATOM 0 HG SER A 78 -100.666 -4.252 -42.200 1.00 0.00 H new ATOM 860 N LYS A 79 -100.389 -1.709 -38.047 1.00 0.00 N ATOM 861 CA LYS A 79 -100.904 -0.783 -37.040 1.00 0.00 C ATOM 862 C LYS A 79 -99.759 -0.091 -36.301 1.00 0.00 C ATOM 863 O LYS A 79 -99.856 1.082 -35.938 1.00 0.00 O ATOM 864 CB LYS A 79 -101.803 -1.560 -36.059 1.00 0.00 C ATOM 865 CG LYS A 79 -102.406 -0.735 -34.921 1.00 0.00 C ATOM 866 CD LYS A 79 -101.458 -0.594 -33.732 1.00 0.00 C ATOM 867 CE LYS A 79 -101.021 -1.950 -33.201 1.00 0.00 C ATOM 868 NZ LYS A 79 -100.107 -1.833 -32.030 1.00 0.00 N ATOM 0 H LYS A 79 -100.730 -2.665 -37.940 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.492 -0.006 -37.529 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -102.616 -2.017 -36.623 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -101.220 -2.373 -35.625 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -102.666 0.256 -35.294 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -103.332 -1.203 -34.589 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -100.581 -0.020 -34.031 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -101.950 -0.033 -32.938 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -101.901 -2.526 -32.916 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -100.521 -2.504 -33.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -99.447 -2.637 -32.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -99.570 -0.945 -32.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -100.665 -1.835 -31.152 1.00 0.00 H new ATOM 882 N VAL A 80 -98.669 -0.822 -36.100 1.00 0.00 N ATOM 883 CA VAL A 80 -97.531 -0.313 -35.353 1.00 0.00 C ATOM 884 C VAL A 80 -96.873 0.852 -36.089 1.00 0.00 C ATOM 885 O VAL A 80 -96.851 1.981 -35.596 1.00 0.00 O ATOM 886 CB VAL A 80 -96.491 -1.430 -35.100 1.00 0.00 C ATOM 887 CG1 VAL A 80 -95.330 -0.920 -34.263 1.00 0.00 C ATOM 888 CG2 VAL A 80 -97.143 -2.629 -34.428 1.00 0.00 C ATOM 0 H VAL A 80 -98.552 -1.774 -36.447 1.00 0.00 H new ATOM 0 HA VAL A 80 -97.901 0.044 -34.392 1.00 0.00 H new ATOM 0 HB VAL A 80 -96.098 -1.744 -36.067 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -94.616 -1.727 -34.102 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -94.838 -0.099 -34.785 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -95.702 -0.567 -33.301 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -96.394 -3.403 -34.259 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -97.570 -2.323 -33.473 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -97.932 -3.021 -35.070 1.00 0.00 H new ATOM 898 N CYS A 81 -96.381 0.592 -37.291 1.00 0.00 N ATOM 899 CA CYS A 81 -95.672 1.623 -38.039 1.00 0.00 C ATOM 900 C CYS A 81 -96.634 2.687 -38.557 1.00 0.00 C ATOM 901 O CYS A 81 -96.249 3.843 -38.718 1.00 0.00 O ATOM 902 CB CYS A 81 -94.859 1.010 -39.178 1.00 0.00 C ATOM 903 SG CYS A 81 -93.651 -0.215 -38.596 1.00 0.00 S ATOM 0 H CYS A 81 -96.457 -0.308 -37.765 1.00 0.00 H new ATOM 0 HA CYS A 81 -94.976 2.112 -37.358 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.536 0.537 -39.889 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.337 1.803 -39.714 1.00 0.00 H new ATOM 908 N GLN A 82 -97.889 2.301 -38.788 1.00 0.00 N ATOM 909 CA GLN A 82 -98.927 3.257 -39.168 1.00 0.00 C ATOM 910 C GLN A 82 -99.047 4.339 -38.104 1.00 0.00 C ATOM 911 O GLN A 82 -99.115 5.529 -38.412 1.00 0.00 O ATOM 912 CB GLN A 82 -100.274 2.549 -39.331 1.00 0.00 C ATOM 913 CG GLN A 82 -101.418 3.474 -39.719 1.00 0.00 C ATOM 914 CD GLN A 82 -102.771 2.793 -39.635 1.00 0.00 C ATOM 915 OE1 GLN A 82 -102.984 1.906 -38.807 1.00 0.00 O ATOM 916 NE2 GLN A 82 -103.700 3.203 -40.485 1.00 0.00 N ATOM 0 H GLN A 82 -98.210 1.335 -38.719 1.00 0.00 H new ATOM 0 HA GLN A 82 -98.649 3.710 -40.120 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.175 1.773 -40.090 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.526 2.050 -38.395 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -101.413 4.346 -39.066 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -101.260 3.836 -40.735 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -103.487 3.940 -41.157 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -104.629 2.782 -40.468 1.00 0.00 H new ATOM 925 N ARG A 83 -99.050 3.911 -36.847 1.00 0.00 N ATOM 926 CA ARG A 83 -99.150 4.830 -35.723 1.00 0.00 C ATOM 927 C ARG A 83 -97.883 5.669 -35.599 1.00 0.00 C ATOM 928 O ARG A 83 -97.925 6.812 -35.141 1.00 0.00 O ATOM 929 CB ARG A 83 -99.423 4.053 -34.430 1.00 0.00 C ATOM 930 CG ARG A 83 -99.587 4.935 -33.204 1.00 0.00 C ATOM 931 CD ARG A 83 -100.214 4.170 -32.051 1.00 0.00 C ATOM 932 NE ARG A 83 -101.589 3.764 -32.348 1.00 0.00 N ATOM 933 CZ ARG A 83 -102.536 3.615 -31.422 1.00 0.00 C ATOM 934 NH1 ARG A 83 -102.254 3.818 -30.140 1.00 0.00 N ATOM 935 NH2 ARG A 83 -103.754 3.233 -31.774 1.00 0.00 N ATOM 0 H ARG A 83 -98.984 2.928 -36.581 1.00 0.00 H new ATOM 0 HA ARG A 83 -99.984 5.510 -35.899 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -100.326 3.457 -34.560 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -98.603 3.356 -34.257 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -98.615 5.322 -32.900 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -100.209 5.795 -33.453 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -99.614 3.287 -31.833 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -100.204 4.791 -31.155 1.00 0.00 H new ATOM 0 HE ARG A 83 -101.837 3.585 -33.321 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -101.311 4.089 -29.862 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -102.981 3.703 -29.434 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -103.968 3.052 -32.755 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -104.478 3.119 -31.064 1.00 0.00 H new ATOM 949 N LEU A 84 -96.760 5.117 -36.044 1.00 0.00 N ATOM 950 CA LEU A 84 -95.500 5.850 -36.026 1.00 0.00 C ATOM 951 C LEU A 84 -95.294 6.608 -37.329 1.00 0.00 C ATOM 952 O LEU A 84 -94.208 7.128 -37.576 1.00 0.00 O ATOM 953 CB LEU A 84 -94.316 4.916 -35.786 1.00 0.00 C ATOM 954 CG LEU A 84 -94.002 4.637 -34.318 1.00 0.00 C ATOM 955 CD1 LEU A 84 -94.911 3.560 -33.749 1.00 0.00 C ATOM 956 CD2 LEU A 84 -92.542 4.258 -34.162 1.00 0.00 C ATOM 0 H LEU A 84 -96.696 4.171 -36.419 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.554 6.563 -35.203 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -94.513 3.968 -36.286 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -93.432 5.347 -36.256 1.00 0.00 H new ATOM 0 HG LEU A 84 -94.189 5.548 -33.749 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -94.659 3.387 -32.703 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -95.949 3.883 -33.824 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -94.777 2.636 -34.312 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -92.327 4.061 -33.112 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -92.334 3.364 -34.749 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -91.914 5.077 -34.513 1.00 0.00 H new ATOM 968 N ASN A 85 -96.355 6.678 -38.139 1.00 0.00 N ATOM 969 CA ASN A 85 -96.325 7.322 -39.462 1.00 0.00 C ATOM 970 C ASN A 85 -95.053 6.983 -40.238 1.00 0.00 C ATOM 971 O ASN A 85 -94.343 7.865 -40.724 1.00 0.00 O ATOM 972 CB ASN A 85 -96.538 8.850 -39.387 1.00 0.00 C ATOM 973 CG ASN A 85 -95.756 9.544 -38.286 1.00 0.00 C ATOM 974 OD1 ASN A 85 -94.590 9.898 -38.453 1.00 0.00 O ATOM 975 ND2 ASN A 85 -96.404 9.768 -37.151 1.00 0.00 N ATOM 0 H ASN A 85 -97.266 6.288 -37.896 1.00 0.00 H new ATOM 0 HA ASN A 85 -97.170 6.909 -40.013 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -96.260 9.290 -40.345 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -97.600 9.049 -39.241 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -95.935 10.248 -36.382 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -97.371 9.461 -37.047 1.00 0.00 H new ATOM 982 N CYS A 86 -94.776 5.690 -40.349 1.00 0.00 N ATOM 983 CA CYS A 86 -93.642 5.210 -41.126 1.00 0.00 C ATOM 984 C CYS A 86 -94.128 4.429 -42.350 1.00 0.00 C ATOM 985 O CYS A 86 -93.332 3.826 -43.068 1.00 0.00 O ATOM 986 CB CYS A 86 -92.724 4.335 -40.259 1.00 0.00 C ATOM 987 SG CYS A 86 -91.973 5.202 -38.848 1.00 0.00 S ATOM 0 H CYS A 86 -95.325 4.952 -39.908 1.00 0.00 H new ATOM 0 HA CYS A 86 -93.069 6.072 -41.469 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -93.298 3.487 -39.885 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -91.929 3.931 -40.886 1.00 0.00 H new ATOM 992 N GLY A 87 -95.439 4.452 -42.583 1.00 0.00 N ATOM 993 CA GLY A 87 -96.005 3.799 -43.749 1.00 0.00 C ATOM 994 C GLY A 87 -96.522 2.409 -43.444 1.00 0.00 C ATOM 995 O GLY A 87 -97.257 2.208 -42.474 1.00 0.00 O ATOM 0 H GLY A 87 -96.121 4.914 -41.981 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -96.819 4.407 -44.142 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -95.247 3.738 -44.530 1.00 0.00 H new ATOM 999 N ASP A 88 -96.135 1.453 -44.277 1.00 0.00 N ATOM 1000 CA ASP A 88 -96.491 0.050 -44.076 1.00 0.00 C ATOM 1001 C ASP A 88 -95.596 -0.542 -42.992 1.00 0.00 C ATOM 1002 O ASP A 88 -94.667 0.132 -42.536 1.00 0.00 O ATOM 1003 CB ASP A 88 -96.329 -0.722 -45.393 1.00 0.00 C ATOM 1004 CG ASP A 88 -97.500 -0.535 -46.334 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -97.475 0.412 -47.148 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -98.445 -1.350 -46.282 1.00 0.00 O ATOM 0 H ASP A 88 -95.568 1.624 -45.108 1.00 0.00 H new ATOM 0 HA ASP A 88 -97.531 -0.027 -43.760 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -95.415 -0.396 -45.889 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -96.211 -1.783 -45.174 1.00 0.00 H new ATOM 1011 N PRO A 89 -95.842 -1.782 -42.524 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.030 -2.349 -41.464 1.00 0.00 C ATOM 1013 C PRO A 89 -93.626 -2.664 -41.886 1.00 0.00 C ATOM 1014 O PRO A 89 -93.344 -2.990 -43.042 1.00 0.00 O ATOM 1015 CB PRO A 89 -95.729 -3.631 -41.073 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.527 -4.008 -42.264 1.00 0.00 C ATOM 1017 CD PRO A 89 -96.914 -2.713 -42.941 1.00 0.00 C ATOM 0 HA PRO A 89 -94.937 -1.629 -40.651 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.011 -4.410 -40.816 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.366 -3.484 -40.201 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -95.947 -4.640 -42.936 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.412 -4.576 -41.976 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -96.955 -2.821 -44.025 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -97.896 -2.367 -42.618 1.00 0.00 H new ATOM 1025 N LEU A 90 -92.768 -2.492 -40.920 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.406 -2.912 -40.954 1.00 0.00 C ATOM 1027 C LEU A 90 -91.216 -4.228 -41.677 1.00 0.00 C ATOM 1028 O LEU A 90 -91.752 -5.265 -41.302 1.00 0.00 O ATOM 1029 CB LEU A 90 -90.858 -2.949 -39.522 1.00 0.00 C ATOM 1030 CG LEU A 90 -91.923 -3.009 -38.406 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -92.878 -4.165 -38.591 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -91.281 -3.090 -37.040 1.00 0.00 C ATOM 0 H LEU A 90 -93.018 -2.031 -40.045 1.00 0.00 H new ATOM 0 HA LEU A 90 -90.835 -2.188 -41.534 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.204 -3.816 -39.424 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.241 -2.065 -39.364 1.00 0.00 H new ATOM 0 HG LEU A 90 -92.495 -2.084 -38.475 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.609 -4.166 -37.782 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.394 -4.062 -39.546 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.322 -5.102 -38.579 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -92.057 -3.131 -36.275 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.665 -3.987 -36.980 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -90.658 -2.210 -36.878 1.00 0.00 H new ATOM 1044 N SER A 91 -90.497 -4.129 -42.765 1.00 0.00 N ATOM 1045 CA SER A 91 -90.067 -5.290 -43.518 1.00 0.00 C ATOM 1046 C SER A 91 -88.954 -5.978 -42.738 1.00 0.00 C ATOM 1047 O SER A 91 -88.230 -5.320 -41.989 1.00 0.00 O ATOM 1048 CB SER A 91 -89.576 -4.872 -44.906 1.00 0.00 C ATOM 1049 OG SER A 91 -89.516 -5.983 -45.787 1.00 0.00 O ATOM 0 H SER A 91 -90.190 -3.240 -43.159 1.00 0.00 H new ATOM 0 HA SER A 91 -90.901 -5.978 -43.656 1.00 0.00 H new ATOM 0 HB2 SER A 91 -90.243 -4.114 -45.317 1.00 0.00 H new ATOM 0 HB3 SER A 91 -88.589 -4.417 -44.823 1.00 0.00 H new ATOM 0 HG SER A 91 -89.201 -5.687 -46.666 1.00 0.00 H new ATOM 1055 N LEU A 92 -88.818 -7.286 -42.891 1.00 0.00 N ATOM 1056 CA LEU A 92 -87.878 -8.027 -42.071 1.00 0.00 C ATOM 1057 C LEU A 92 -86.733 -8.601 -42.898 1.00 0.00 C ATOM 1058 O LEU A 92 -86.938 -9.114 -43.998 1.00 0.00 O ATOM 1059 CB LEU A 92 -88.594 -9.150 -41.321 1.00 0.00 C ATOM 1060 CG LEU A 92 -87.760 -9.816 -40.228 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -87.330 -8.792 -39.201 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -88.540 -10.931 -39.559 1.00 0.00 C ATOM 0 H LEU A 92 -89.338 -7.848 -43.565 1.00 0.00 H new ATOM 0 HA LEU A 92 -87.452 -7.327 -41.352 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -89.503 -8.748 -40.873 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -88.902 -9.910 -42.039 1.00 0.00 H new ATOM 0 HG LEU A 92 -86.873 -10.248 -40.691 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -86.736 -9.279 -38.428 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -86.732 -8.020 -39.685 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -88.212 -8.337 -38.749 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -87.926 -11.391 -38.784 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -89.445 -10.523 -39.110 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -88.810 -11.682 -40.301 1.00 0.00 H new ATOM 1074 N GLY A 93 -85.531 -8.490 -42.352 1.00 0.00 N ATOM 1075 CA GLY A 93 -84.354 -9.063 -42.972 1.00 0.00 C ATOM 1076 C GLY A 93 -83.191 -9.071 -42.003 1.00 0.00 C ATOM 1077 O GLY A 93 -83.334 -8.588 -40.884 1.00 0.00 O ATOM 0 H GLY A 93 -85.349 -8.004 -41.474 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -84.568 -10.080 -43.300 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.090 -8.490 -43.861 1.00 0.00 H new ATOM 1081 N PRO A 94 -82.026 -9.608 -42.386 1.00 0.00 N ATOM 1082 CA PRO A 94 -80.846 -9.601 -41.518 1.00 0.00 C ATOM 1083 C PRO A 94 -80.276 -8.190 -41.359 1.00 0.00 C ATOM 1084 O PRO A 94 -79.873 -7.555 -42.335 1.00 0.00 O ATOM 1085 CB PRO A 94 -79.865 -10.526 -42.242 1.00 0.00 C ATOM 1086 CG PRO A 94 -80.266 -10.450 -43.677 1.00 0.00 C ATOM 1087 CD PRO A 94 -81.759 -10.255 -43.683 1.00 0.00 C ATOM 0 HA PRO A 94 -81.066 -9.931 -40.503 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -78.835 -10.200 -42.100 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -79.931 -11.547 -41.865 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -79.763 -9.624 -44.179 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -79.990 -11.361 -44.208 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -82.079 -9.630 -44.517 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -82.287 -11.204 -43.775 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.255 -7.700 -40.125 1.00 0.00 N ATOM 1096 CA PHE A 95 -79.838 -6.331 -39.852 1.00 0.00 C ATOM 1097 C PHE A 95 -78.378 -6.304 -39.408 1.00 0.00 C ATOM 1098 O PHE A 95 -77.955 -5.417 -38.664 1.00 0.00 O ATOM 1099 CB PHE A 95 -80.749 -5.716 -38.781 1.00 0.00 C ATOM 1100 CG PHE A 95 -80.779 -4.208 -38.792 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -80.824 -3.512 -39.989 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -80.762 -3.492 -37.607 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -80.853 -2.130 -40.002 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -80.790 -2.110 -37.614 1.00 0.00 C ATOM 1105 CZ PHE A 95 -80.836 -1.429 -38.812 1.00 0.00 C ATOM 0 H PHE A 95 -80.522 -8.232 -39.297 1.00 0.00 H new ATOM 0 HA PHE A 95 -79.925 -5.739 -40.763 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -81.763 -6.090 -38.923 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -80.418 -6.055 -37.799 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -80.837 -4.055 -40.922 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -80.726 -4.020 -36.665 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -80.889 -1.599 -40.942 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -80.776 -1.564 -36.682 1.00 0.00 H new ATOM 0 HZ PHE A 95 -80.859 -0.349 -38.820 1.00 0.00 H new ATOM 1115 N LEU A 96 -77.621 -7.286 -39.895 1.00 0.00 N ATOM 1116 CA LEU A 96 -76.189 -7.403 -39.628 1.00 0.00 C ATOM 1117 C LEU A 96 -75.912 -7.731 -38.161 1.00 0.00 C ATOM 1118 O LEU A 96 -75.815 -8.900 -37.790 1.00 0.00 O ATOM 1119 CB LEU A 96 -75.438 -6.126 -40.040 1.00 0.00 C ATOM 1120 CG LEU A 96 -75.570 -5.733 -41.514 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -74.814 -4.440 -41.785 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -75.062 -6.853 -42.412 1.00 0.00 C ATOM 0 H LEU A 96 -77.988 -8.028 -40.491 1.00 0.00 H new ATOM 0 HA LEU A 96 -75.820 -8.231 -40.234 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -75.798 -5.299 -39.428 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -74.381 -6.256 -39.810 1.00 0.00 H new ATOM 0 HG LEU A 96 -76.624 -5.569 -41.738 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -74.916 -4.172 -42.837 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -75.224 -3.642 -41.166 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -73.759 -4.578 -41.547 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -75.163 -6.557 -43.456 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -74.013 -7.049 -42.191 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -75.646 -7.756 -42.233 1.00 0.00 H new ATOM 1134 N LYS A 97 -75.804 -6.697 -37.338 1.00 0.00 N ATOM 1135 CA LYS A 97 -75.462 -6.854 -35.930 1.00 0.00 C ATOM 1136 C LYS A 97 -75.867 -5.602 -35.162 1.00 0.00 C ATOM 1137 O LYS A 97 -75.342 -4.516 -35.414 1.00 0.00 O ATOM 1138 CB LYS A 97 -73.956 -7.104 -35.794 1.00 0.00 C ATOM 1139 CG LYS A 97 -73.453 -7.194 -34.362 1.00 0.00 C ATOM 1140 CD LYS A 97 -71.953 -7.431 -34.336 1.00 0.00 C ATOM 1141 CE LYS A 97 -71.395 -7.357 -32.925 1.00 0.00 C ATOM 1142 NZ LYS A 97 -69.933 -7.616 -32.906 1.00 0.00 N ATOM 0 H LYS A 97 -75.950 -5.729 -37.625 1.00 0.00 H new ATOM 0 HA LYS A 97 -75.999 -7.707 -35.515 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -73.707 -8.031 -36.311 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -73.421 -6.302 -36.303 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -73.690 -6.273 -33.829 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -73.964 -8.004 -33.842 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -71.732 -8.409 -34.764 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -71.457 -6.690 -34.963 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -71.597 -6.372 -32.503 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -71.903 -8.085 -32.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -69.583 -7.558 -31.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -69.744 -8.565 -33.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -69.447 -6.906 -33.490 1.00 0.00 H new ATOM 1156 N THR A 98 -76.807 -5.742 -34.240 1.00 0.00 N ATOM 1157 CA THR A 98 -77.316 -4.589 -33.513 1.00 0.00 C ATOM 1158 C THR A 98 -77.321 -4.816 -32.000 1.00 0.00 C ATOM 1159 O THR A 98 -76.737 -4.035 -31.247 1.00 0.00 O ATOM 1160 CB THR A 98 -78.742 -4.237 -33.975 1.00 0.00 C ATOM 1161 OG1 THR A 98 -78.802 -4.224 -35.405 1.00 0.00 O ATOM 1162 CG2 THR A 98 -79.168 -2.879 -33.438 1.00 0.00 C ATOM 0 H THR A 98 -77.230 -6.633 -33.979 1.00 0.00 H new ATOM 0 HA THR A 98 -76.642 -3.761 -33.733 1.00 0.00 H new ATOM 0 HB THR A 98 -79.422 -4.995 -33.586 1.00 0.00 H new ATOM 0 HG1 THR A 98 -79.386 -3.495 -35.701 1.00 0.00 H new ATOM 0 HG21 THR A 98 -80.179 -2.654 -33.779 1.00 0.00 H new ATOM 0 HG22 THR A 98 -79.148 -2.896 -32.348 1.00 0.00 H new ATOM 0 HG23 THR A 98 -78.483 -2.113 -33.802 1.00 0.00 H new ATOM 1170 N TYR A 99 -77.978 -5.883 -31.555 1.00 0.00 N ATOM 1171 CA TYR A 99 -78.162 -6.110 -30.127 1.00 0.00 C ATOM 1172 C TYR A 99 -77.000 -6.893 -29.514 1.00 0.00 C ATOM 1173 O TYR A 99 -75.970 -7.104 -30.156 1.00 0.00 O ATOM 1174 CB TYR A 99 -79.503 -6.809 -29.851 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.723 -8.143 -30.547 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -78.760 -9.148 -30.533 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -80.928 -8.406 -31.183 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -78.991 -10.368 -31.136 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -81.164 -9.621 -31.792 1.00 0.00 C ATOM 1180 CZ TYR A 99 -80.193 -10.599 -31.763 1.00 0.00 C ATOM 1181 OH TYR A 99 -80.426 -11.811 -32.368 1.00 0.00 O ATOM 0 H TYR A 99 -78.388 -6.597 -32.157 1.00 0.00 H new ATOM 0 HA TYR A 99 -78.178 -5.132 -29.646 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -79.593 -6.965 -28.776 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -80.307 -6.134 -30.143 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -77.815 -8.970 -30.041 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -81.695 -7.646 -31.202 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -78.232 -11.136 -31.116 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -82.105 -9.805 -32.289 1.00 0.00 H new ATOM 0 HH TYR A 99 -81.289 -12.166 -32.068 1.00 0.00 H new ATOM 1191 N THR A 100 -77.181 -7.320 -28.270 1.00 0.00 N ATOM 1192 CA THR A 100 -76.137 -8.002 -27.525 1.00 0.00 C ATOM 1193 C THR A 100 -76.693 -9.264 -26.875 1.00 0.00 C ATOM 1194 O THR A 100 -77.458 -9.181 -25.910 1.00 0.00 O ATOM 1195 CB THR A 100 -75.546 -7.083 -26.433 1.00 0.00 C ATOM 1196 OG1 THR A 100 -75.007 -5.894 -27.029 1.00 0.00 O ATOM 1197 CG2 THR A 100 -74.456 -7.794 -25.639 1.00 0.00 C ATOM 0 H THR A 100 -78.053 -7.203 -27.754 1.00 0.00 H new ATOM 0 HA THR A 100 -75.346 -8.269 -28.225 1.00 0.00 H new ATOM 0 HB THR A 100 -76.352 -6.818 -25.749 1.00 0.00 H new ATOM 0 HG1 THR A 100 -74.636 -5.317 -26.329 1.00 0.00 H new ATOM 0 HG21 THR A 100 -74.061 -7.120 -24.879 1.00 0.00 H new ATOM 0 HG22 THR A 100 -74.874 -8.678 -25.158 1.00 0.00 H new ATOM 0 HG23 THR A 100 -73.652 -8.093 -26.312 1.00 0.00 H new ATOM 1205 N PRO A 101 -76.340 -10.439 -27.433 1.00 0.00 N ATOM 1206 CA PRO A 101 -76.757 -11.750 -26.919 1.00 0.00 C ATOM 1207 C PRO A 101 -76.457 -11.915 -25.435 1.00 0.00 C ATOM 1208 O PRO A 101 -75.389 -12.398 -25.048 1.00 0.00 O ATOM 1209 CB PRO A 101 -75.947 -12.755 -27.750 1.00 0.00 C ATOM 1210 CG PRO A 101 -74.928 -11.945 -28.482 1.00 0.00 C ATOM 1211 CD PRO A 101 -75.517 -10.575 -28.634 1.00 0.00 C ATOM 0 HA PRO A 101 -77.835 -11.889 -27.008 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -75.471 -13.498 -27.110 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -76.589 -13.297 -28.444 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -73.990 -11.907 -27.929 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -74.707 -12.384 -29.455 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -74.745 -9.807 -28.684 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -76.112 -10.489 -29.543 1.00 0.00 H new ATOM 1219 N GLN A 102 -77.423 -11.498 -24.627 1.00 0.00 N ATOM 1220 CA GLN A 102 -77.288 -11.413 -23.181 1.00 0.00 C ATOM 1221 C GLN A 102 -78.450 -10.594 -22.650 1.00 0.00 C ATOM 1222 O GLN A 102 -79.264 -11.067 -21.855 1.00 0.00 O ATOM 1223 CB GLN A 102 -75.966 -10.734 -22.805 1.00 0.00 C ATOM 1224 CG GLN A 102 -75.772 -10.520 -21.315 1.00 0.00 C ATOM 1225 CD GLN A 102 -74.456 -9.840 -21.005 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -73.438 -10.500 -20.795 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -74.463 -8.516 -20.982 1.00 0.00 N ATOM 0 H GLN A 102 -78.339 -11.204 -24.966 1.00 0.00 H new ATOM 0 HA GLN A 102 -77.292 -12.414 -22.749 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -75.141 -11.338 -23.183 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -75.911 -9.769 -23.308 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -76.592 -9.916 -20.926 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -75.813 -11.481 -20.803 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -75.329 -8.007 -21.162 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -73.603 -8.005 -20.785 1.00 0.00 H new ATOM 1236 N SER A 103 -78.530 -9.366 -23.141 1.00 0.00 N ATOM 1237 CA SER A 103 -79.588 -8.446 -22.769 1.00 0.00 C ATOM 1238 C SER A 103 -80.734 -8.528 -23.772 1.00 0.00 C ATOM 1239 O SER A 103 -81.901 -8.340 -23.417 1.00 0.00 O ATOM 1240 CB SER A 103 -79.031 -7.024 -22.705 1.00 0.00 C ATOM 1241 OG SER A 103 -77.856 -6.982 -21.911 1.00 0.00 O ATOM 0 H SER A 103 -77.862 -8.982 -23.809 1.00 0.00 H new ATOM 0 HA SER A 103 -79.974 -8.719 -21.787 1.00 0.00 H new ATOM 0 HB2 SER A 103 -78.809 -6.669 -23.711 1.00 0.00 H new ATOM 0 HB3 SER A 103 -79.782 -6.352 -22.289 1.00 0.00 H new ATOM 0 HG SER A 103 -77.513 -6.064 -21.883 1.00 0.00 H new ATOM 1247 N SER A 104 -80.400 -8.817 -25.030 1.00 0.00 N ATOM 1248 CA SER A 104 -81.411 -8.984 -26.058 1.00 0.00 C ATOM 1249 C SER A 104 -82.103 -10.325 -25.888 1.00 0.00 C ATOM 1250 O SER A 104 -81.513 -11.275 -25.360 1.00 0.00 O ATOM 1251 CB SER A 104 -80.773 -8.890 -27.437 1.00 0.00 C ATOM 1252 OG SER A 104 -79.676 -9.780 -27.549 1.00 0.00 O ATOM 0 H SER A 104 -79.441 -8.939 -25.354 1.00 0.00 H new ATOM 0 HA SER A 104 -82.152 -8.191 -25.962 1.00 0.00 H new ATOM 0 HB2 SER A 104 -81.514 -9.122 -28.202 1.00 0.00 H new ATOM 0 HB3 SER A 104 -80.438 -7.869 -27.618 1.00 0.00 H new ATOM 0 HG SER A 104 -79.383 -9.822 -28.483 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.344 -10.417 -26.329 1.00 0.00 N ATOM 1259 CA ILE A 105 -84.102 -11.632 -26.131 1.00 0.00 C ATOM 1260 C ILE A 105 -84.713 -12.149 -27.430 1.00 0.00 C ATOM 1261 O ILE A 105 -84.863 -11.421 -28.409 1.00 0.00 O ATOM 1262 CB ILE A 105 -85.200 -11.459 -25.044 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -86.099 -10.247 -25.305 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -84.569 -11.335 -23.666 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -87.126 -10.458 -26.388 1.00 0.00 C ATOM 0 H ILE A 105 -83.841 -9.674 -26.820 1.00 0.00 H new ATOM 0 HA ILE A 105 -83.392 -12.380 -25.778 1.00 0.00 H new ATOM 0 HB ILE A 105 -85.825 -12.351 -25.087 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.612 -9.984 -24.380 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.473 -9.396 -25.575 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -85.352 -11.215 -22.917 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -83.993 -12.234 -23.447 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -83.910 -10.467 -23.645 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.720 -9.552 -26.508 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.623 -10.689 -27.327 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.780 -11.286 -26.113 1.00 0.00 H new ATOM 1277 N ILE A 106 -85.037 -13.425 -27.416 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.742 -14.078 -28.499 1.00 0.00 C ATOM 1279 C ILE A 106 -86.978 -14.757 -27.917 1.00 0.00 C ATOM 1280 O ILE A 106 -86.858 -15.762 -27.218 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.861 -15.144 -29.187 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.612 -14.494 -29.784 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.653 -15.873 -30.267 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.630 -15.483 -30.377 1.00 0.00 C ATOM 0 H ILE A 106 -84.814 -14.048 -26.639 1.00 0.00 H new ATOM 0 HA ILE A 106 -86.012 -13.331 -29.246 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.548 -15.873 -28.439 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.916 -13.790 -30.558 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -83.108 -13.917 -29.008 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -85.018 -16.621 -30.742 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.516 -16.363 -29.817 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.992 -15.157 -31.015 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.771 -14.946 -30.780 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.296 -16.173 -29.602 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -83.115 -16.043 -31.176 1.00 0.00 H new ATOM 1296 N CYS A 107 -88.154 -14.198 -28.149 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.368 -14.801 -27.613 1.00 0.00 C ATOM 1298 C CYS A 107 -89.842 -15.914 -28.535 1.00 0.00 C ATOM 1299 O CYS A 107 -89.396 -16.012 -29.680 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.485 -13.770 -27.443 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.961 -12.135 -26.859 1.00 0.00 S ATOM 0 H CYS A 107 -88.296 -13.346 -28.692 1.00 0.00 H new ATOM 0 HA CYS A 107 -89.130 -15.207 -26.630 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.992 -13.649 -28.400 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -91.219 -14.168 -26.742 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.737 -16.751 -28.042 1.00 0.00 N ATOM 1307 CA TYR A 108 -91.251 -17.859 -28.830 1.00 0.00 C ATOM 1308 C TYR A 108 -92.756 -17.980 -28.652 1.00 0.00 C ATOM 1309 O TYR A 108 -93.375 -17.161 -27.973 1.00 0.00 O ATOM 1310 CB TYR A 108 -90.577 -19.170 -28.427 1.00 0.00 C ATOM 1311 CG TYR A 108 -89.074 -19.184 -28.609 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -88.505 -19.258 -29.876 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -88.227 -19.129 -27.511 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -87.132 -19.277 -30.039 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -86.855 -19.145 -27.666 1.00 0.00 C ATOM 1316 CZ TYR A 108 -86.313 -19.218 -28.931 1.00 0.00 C ATOM 1317 OH TYR A 108 -84.947 -19.239 -29.087 1.00 0.00 O ATOM 0 H TYR A 108 -91.123 -16.686 -27.100 1.00 0.00 H new ATOM 0 HA TYR A 108 -91.029 -17.660 -29.878 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -90.806 -19.375 -27.381 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -91.009 -19.981 -29.013 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -89.145 -19.301 -30.745 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -88.648 -19.073 -26.518 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -86.703 -19.338 -31.028 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -86.210 -19.101 -26.801 1.00 0.00 H new ATOM 0 HH TYR A 108 -84.517 -19.189 -28.208 1.00 0.00 H new ATOM 1327 N GLY A 109 -93.332 -19.008 -29.254 1.00 0.00 N ATOM 1328 CA GLY A 109 -94.764 -19.198 -29.193 1.00 0.00 C ATOM 1329 C GLY A 109 -95.429 -18.779 -30.481 1.00 0.00 C ATOM 1330 O GLY A 109 -94.778 -18.716 -31.524 1.00 0.00 O ATOM 0 H GLY A 109 -92.829 -19.718 -29.787 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -94.985 -20.246 -28.991 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -95.175 -18.620 -28.365 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.717 -18.487 -30.421 1.00 0.00 N ATOM 1335 CA GLN A 110 -97.441 -18.056 -31.604 1.00 0.00 C ATOM 1336 C GLN A 110 -97.249 -16.563 -31.815 1.00 0.00 C ATOM 1337 O GLN A 110 -97.051 -15.811 -30.856 1.00 0.00 O ATOM 1338 CB GLN A 110 -98.937 -18.387 -31.504 1.00 0.00 C ATOM 1339 CG GLN A 110 -99.237 -19.876 -31.400 1.00 0.00 C ATOM 1340 CD GLN A 110 -99.047 -20.425 -29.998 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -98.635 -21.571 -29.816 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -99.386 -19.627 -28.996 1.00 0.00 N ATOM 0 H GLN A 110 -97.280 -18.540 -29.572 1.00 0.00 H new ATOM 0 HA GLN A 110 -97.038 -18.598 -32.459 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -99.353 -17.881 -30.632 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -99.447 -17.985 -32.379 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -100.264 -20.057 -31.719 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -98.589 -20.420 -32.088 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -99.723 -18.684 -29.187 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -99.310 -19.956 -28.034 1.00 0.00 H new ATOM 1351 N LEU A 111 -97.298 -16.141 -33.069 1.00 0.00 N ATOM 1352 CA LEU A 111 -97.128 -14.740 -33.412 1.00 0.00 C ATOM 1353 C LEU A 111 -98.268 -13.917 -32.837 1.00 0.00 C ATOM 1354 O LEU A 111 -99.396 -13.949 -33.335 1.00 0.00 O ATOM 1355 CB LEU A 111 -97.057 -14.560 -34.930 1.00 0.00 C ATOM 1356 CG LEU A 111 -96.759 -13.134 -35.402 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -95.417 -12.664 -34.856 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -96.781 -13.062 -36.923 1.00 0.00 C ATOM 0 H LEU A 111 -97.455 -16.754 -33.869 1.00 0.00 H new ATOM 0 HA LEU A 111 -96.190 -14.391 -32.981 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -96.288 -15.225 -35.323 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -98.005 -14.879 -35.363 1.00 0.00 H new ATOM 0 HG LEU A 111 -97.534 -12.470 -35.019 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -95.219 -11.649 -35.200 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -95.442 -12.679 -33.766 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -94.628 -13.327 -35.210 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -96.567 -12.042 -37.242 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -96.026 -13.735 -37.330 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -97.765 -13.357 -37.287 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.972 -13.194 -31.774 1.00 0.00 N ATOM 1371 CA GLY A 112 -98.982 -12.402 -31.123 1.00 0.00 C ATOM 1372 C GLY A 112 -99.166 -12.780 -29.669 1.00 0.00 C ATOM 1373 O GLY A 112 -100.136 -12.368 -29.040 1.00 0.00 O ATOM 0 H GLY A 112 -97.046 -13.142 -31.350 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -98.712 -11.348 -31.190 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -99.929 -12.522 -31.649 1.00 0.00 H new ATOM 1377 N SER A 113 -98.254 -13.576 -29.129 1.00 0.00 N ATOM 1378 CA SER A 113 -98.293 -13.888 -27.713 1.00 0.00 C ATOM 1379 C SER A 113 -97.077 -13.291 -27.007 1.00 0.00 C ATOM 1380 O SER A 113 -96.068 -13.956 -26.772 1.00 0.00 O ATOM 1381 CB SER A 113 -98.376 -15.398 -27.483 1.00 0.00 C ATOM 1382 OG SER A 113 -98.651 -15.695 -26.123 1.00 0.00 O ATOM 0 H SER A 113 -97.489 -14.011 -29.644 1.00 0.00 H new ATOM 0 HA SER A 113 -99.192 -13.442 -27.288 1.00 0.00 H new ATOM 0 HB2 SER A 113 -99.155 -15.823 -28.116 1.00 0.00 H new ATOM 0 HB3 SER A 113 -97.436 -15.866 -27.777 1.00 0.00 H new ATOM 0 HG SER A 113 -98.700 -16.666 -26.004 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.191 -12.021 -26.679 1.00 0.00 N ATOM 1389 CA PHE A 114 -96.118 -11.265 -26.070 1.00 0.00 C ATOM 1390 C PHE A 114 -96.237 -11.369 -24.566 1.00 0.00 C ATOM 1391 O PHE A 114 -96.742 -10.468 -23.898 1.00 0.00 O ATOM 1392 CB PHE A 114 -96.184 -9.797 -26.507 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.836 -9.578 -27.952 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -96.575 -10.172 -28.965 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.754 -8.790 -28.296 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -96.240 -9.980 -30.289 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -94.415 -8.595 -29.619 1.00 0.00 C ATOM 1398 CZ PHE A 114 -95.157 -9.191 -30.615 1.00 0.00 C ATOM 0 H PHE A 114 -98.042 -11.479 -26.830 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.159 -11.672 -26.391 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -97.189 -9.418 -26.324 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -95.505 -9.212 -25.887 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -97.423 -10.792 -28.714 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -94.167 -8.321 -27.520 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -96.824 -10.446 -31.068 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -93.568 -7.975 -29.874 1.00 0.00 H new ATOM 0 HZ PHE A 114 -94.891 -9.040 -31.651 1.00 0.00 H new ATOM 1408 N SER A 115 -95.867 -12.520 -24.052 1.00 0.00 N ATOM 1409 CA SER A 115 -95.925 -12.756 -22.619 1.00 0.00 C ATOM 1410 C SER A 115 -94.630 -13.377 -22.081 1.00 0.00 C ATOM 1411 O SER A 115 -94.199 -13.054 -20.975 1.00 0.00 O ATOM 1412 CB SER A 115 -97.127 -13.643 -22.312 1.00 0.00 C ATOM 1413 OG SER A 115 -98.265 -13.160 -23.007 1.00 0.00 O ATOM 0 H SER A 115 -95.523 -13.309 -24.600 1.00 0.00 H new ATOM 0 HA SER A 115 -96.037 -11.797 -22.114 1.00 0.00 H new ATOM 0 HB2 SER A 115 -96.918 -14.671 -22.607 1.00 0.00 H new ATOM 0 HB3 SER A 115 -97.320 -13.652 -21.239 1.00 0.00 H new ATOM 0 HG SER A 115 -99.036 -13.732 -22.810 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.001 -14.248 -22.863 1.00 0.00 N ATOM 1420 CA ASN A 116 -92.801 -14.947 -22.405 1.00 0.00 C ATOM 1421 C ASN A 116 -91.757 -15.027 -23.513 1.00 0.00 C ATOM 1422 O ASN A 116 -92.091 -15.243 -24.680 1.00 0.00 O ATOM 1423 CB ASN A 116 -93.166 -16.356 -21.920 1.00 0.00 C ATOM 1424 CG ASN A 116 -91.974 -17.123 -21.375 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -91.306 -17.858 -22.102 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -91.696 -16.952 -20.092 1.00 0.00 N ATOM 0 H ASN A 116 -94.297 -14.487 -23.809 1.00 0.00 H new ATOM 0 HA ASN A 116 -92.373 -14.383 -21.576 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -93.928 -16.281 -21.145 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -93.605 -16.916 -22.746 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -90.904 -17.438 -19.673 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -92.274 -16.334 -19.523 1.00 0.00 H new ATOM 1433 N CYS A 117 -90.494 -14.841 -23.145 1.00 0.00 N ATOM 1434 CA CYS A 117 -89.405 -14.899 -24.106 1.00 0.00 C ATOM 1435 C CYS A 117 -88.232 -15.704 -23.546 1.00 0.00 C ATOM 1436 O CYS A 117 -88.368 -16.422 -22.554 1.00 0.00 O ATOM 1437 CB CYS A 117 -88.918 -13.491 -24.445 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.211 -12.293 -24.866 1.00 0.00 S ATOM 0 H CYS A 117 -90.202 -14.649 -22.187 1.00 0.00 H new ATOM 0 HA CYS A 117 -89.781 -15.385 -25.006 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -88.355 -13.106 -23.595 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.224 -13.558 -25.283 1.00 0.00 H new ATOM 1443 N SER A 118 -87.082 -15.570 -24.191 1.00 0.00 N ATOM 1444 CA SER A 118 -85.853 -16.190 -23.733 1.00 0.00 C ATOM 1445 C SER A 118 -84.708 -15.259 -24.094 1.00 0.00 C ATOM 1446 O SER A 118 -84.917 -14.306 -24.831 1.00 0.00 O ATOM 1447 CB SER A 118 -85.669 -17.562 -24.385 1.00 0.00 C ATOM 1448 OG SER A 118 -84.638 -18.294 -23.750 1.00 0.00 O ATOM 0 H SER A 118 -86.978 -15.027 -25.048 1.00 0.00 H new ATOM 0 HA SER A 118 -85.882 -16.348 -22.655 1.00 0.00 H new ATOM 0 HB2 SER A 118 -86.603 -18.122 -24.331 1.00 0.00 H new ATOM 0 HB3 SER A 118 -85.433 -17.437 -25.442 1.00 0.00 H new ATOM 0 HG SER A 118 -84.542 -19.167 -24.184 1.00 0.00 H new ATOM 1454 N HIS A 119 -83.512 -15.510 -23.592 1.00 0.00 N ATOM 1455 CA HIS A 119 -82.400 -14.592 -23.832 1.00 0.00 C ATOM 1456 C HIS A 119 -81.571 -15.030 -25.030 1.00 0.00 C ATOM 1457 O HIS A 119 -81.312 -16.215 -25.222 1.00 0.00 O ATOM 1458 CB HIS A 119 -81.522 -14.451 -22.585 1.00 0.00 C ATOM 1459 CG HIS A 119 -82.150 -13.613 -21.513 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -81.616 -12.418 -21.076 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -83.289 -13.794 -20.803 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -82.401 -11.901 -20.147 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -83.423 -12.716 -19.964 1.00 0.00 N ATOM 0 H HIS A 119 -83.282 -16.326 -23.024 1.00 0.00 H new ATOM 0 HA HIS A 119 -82.824 -13.614 -24.059 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -81.309 -15.442 -22.184 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -80.567 -14.010 -22.869 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -80.751 -11.999 -21.417 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -83.966 -14.631 -20.882 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -82.235 -10.970 -19.626 1.00 0.00 H new ATOM 1472 N SER A 120 -81.162 -14.055 -25.833 1.00 0.00 N ATOM 1473 CA SER A 120 -80.412 -14.319 -27.050 1.00 0.00 C ATOM 1474 C SER A 120 -79.027 -14.871 -26.717 1.00 0.00 C ATOM 1475 O SER A 120 -78.277 -14.260 -25.958 1.00 0.00 O ATOM 1476 CB SER A 120 -80.285 -13.025 -27.872 1.00 0.00 C ATOM 1477 OG SER A 120 -79.729 -13.271 -29.154 1.00 0.00 O ATOM 0 H SER A 120 -81.341 -13.066 -25.659 1.00 0.00 H new ATOM 0 HA SER A 120 -80.946 -15.066 -27.638 1.00 0.00 H new ATOM 0 HB2 SER A 120 -81.268 -12.566 -27.983 1.00 0.00 H new ATOM 0 HB3 SER A 120 -79.660 -12.312 -27.335 1.00 0.00 H new ATOM 0 HG SER A 120 -79.583 -12.419 -29.616 1.00 0.00 H new ATOM 1483 N ARG A 121 -78.707 -16.043 -27.255 1.00 0.00 N ATOM 1484 CA ARG A 121 -77.377 -16.620 -27.094 1.00 0.00 C ATOM 1485 C ARG A 121 -76.736 -16.805 -28.465 1.00 0.00 C ATOM 1486 O ARG A 121 -75.861 -16.037 -28.869 1.00 0.00 O ATOM 1487 CB ARG A 121 -77.451 -17.967 -26.364 1.00 0.00 C ATOM 1488 CG ARG A 121 -78.217 -17.916 -25.052 1.00 0.00 C ATOM 1489 CD ARG A 121 -77.565 -16.972 -24.060 1.00 0.00 C ATOM 1490 NE ARG A 121 -78.350 -16.836 -22.836 1.00 0.00 N ATOM 1491 CZ ARG A 121 -78.147 -15.888 -21.925 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -77.168 -15.003 -22.090 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -78.922 -15.822 -20.849 1.00 0.00 N ATOM 0 H ARG A 121 -79.350 -16.612 -27.806 1.00 0.00 H new ATOM 0 HA ARG A 121 -76.771 -15.941 -26.494 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -77.922 -18.699 -27.020 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -76.438 -18.319 -26.168 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -79.242 -17.595 -25.241 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -78.270 -18.916 -24.622 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -76.569 -17.338 -23.813 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -77.439 -15.992 -24.521 1.00 0.00 H new ATOM 0 HE ARG A 121 -79.099 -17.508 -22.670 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -76.571 -15.050 -22.916 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -77.014 -14.277 -21.391 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -79.674 -16.499 -20.720 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -78.765 -15.095 -20.151 1.00 0.00 H new ATOM 1550 N CYS A 125 -82.078 -16.275 -35.217 1.00 0.00 N ATOM 1551 CA CYS A 125 -81.958 -14.861 -35.542 1.00 0.00 C ATOM 1552 C CYS A 125 -80.599 -14.292 -35.165 1.00 0.00 C ATOM 1553 O CYS A 125 -80.264 -14.168 -33.987 1.00 0.00 O ATOM 1554 CB CYS A 125 -83.081 -14.055 -34.878 1.00 0.00 C ATOM 1555 SG CYS A 125 -83.731 -14.784 -33.343 1.00 0.00 S ATOM 0 HA CYS A 125 -82.052 -14.775 -36.625 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.711 -13.053 -34.661 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -83.901 -13.945 -35.588 1.00 0.00 H new ATOM 1560 N HIS A 126 -79.816 -13.959 -36.184 1.00 0.00 N ATOM 1561 CA HIS A 126 -78.588 -13.206 -35.991 1.00 0.00 C ATOM 1562 C HIS A 126 -78.916 -11.720 -36.087 1.00 0.00 C ATOM 1563 O HIS A 126 -78.548 -11.052 -37.051 1.00 0.00 O ATOM 1564 CB HIS A 126 -77.536 -13.593 -37.041 1.00 0.00 C ATOM 1565 CG HIS A 126 -76.170 -13.033 -36.770 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -75.605 -12.028 -37.525 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -75.251 -13.346 -35.825 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -74.405 -11.748 -37.059 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -74.163 -12.532 -36.025 1.00 0.00 N ATOM 0 H HIS A 126 -80.013 -14.201 -37.155 1.00 0.00 H new ATOM 0 HA HIS A 126 -78.170 -13.434 -35.011 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -77.469 -14.680 -37.090 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -77.871 -13.250 -38.020 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -75.355 -14.097 -35.056 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -73.732 -11.002 -37.456 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -73.309 -12.533 -35.467 1.00 0.00 H new ATOM 1578 N SER A 127 -79.642 -11.232 -35.084 1.00 0.00 N ATOM 1579 CA SER A 127 -80.178 -9.872 -35.065 1.00 0.00 C ATOM 1580 C SER A 127 -80.884 -9.507 -36.371 1.00 0.00 C ATOM 1581 O SER A 127 -80.337 -8.793 -37.216 1.00 0.00 O ATOM 1582 CB SER A 127 -79.097 -8.837 -34.701 1.00 0.00 C ATOM 1583 OG SER A 127 -77.887 -9.044 -35.411 1.00 0.00 O ATOM 0 H SER A 127 -79.877 -11.775 -34.253 1.00 0.00 H new ATOM 0 HA SER A 127 -80.933 -9.848 -34.280 1.00 0.00 H new ATOM 0 HB2 SER A 127 -79.472 -7.835 -34.912 1.00 0.00 H new ATOM 0 HB3 SER A 127 -78.899 -8.884 -33.630 1.00 0.00 H new ATOM 0 HG SER A 127 -78.083 -9.452 -36.280 1.00 0.00 H new ATOM 1589 N LEU A 128 -82.095 -10.031 -36.545 1.00 0.00 N ATOM 1590 CA LEU A 128 -82.918 -9.659 -37.683 1.00 0.00 C ATOM 1591 C LEU A 128 -83.591 -8.329 -37.392 1.00 0.00 C ATOM 1592 O LEU A 128 -84.013 -8.078 -36.265 1.00 0.00 O ATOM 1593 CB LEU A 128 -83.959 -10.735 -37.997 1.00 0.00 C ATOM 1594 CG LEU A 128 -83.392 -12.112 -38.346 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -84.499 -13.029 -38.830 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -82.295 -12.000 -39.394 1.00 0.00 C ATOM 0 H LEU A 128 -82.522 -10.710 -35.915 1.00 0.00 H new ATOM 0 HA LEU A 128 -82.281 -9.563 -38.563 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -84.620 -10.840 -37.136 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -84.573 -10.391 -38.830 1.00 0.00 H new ATOM 0 HG LEU A 128 -82.953 -12.539 -37.444 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -84.081 -14.006 -39.075 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -85.248 -13.141 -38.046 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -84.964 -12.600 -39.718 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -81.909 -12.993 -39.624 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -82.702 -11.550 -40.300 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -81.487 -11.377 -39.010 1.00 0.00 H new ATOM 1608 N GLY A 129 -83.668 -7.475 -38.391 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.135 -6.132 -38.171 1.00 0.00 C ATOM 1610 C GLY A 129 -85.372 -5.826 -38.965 1.00 0.00 C ATOM 1611 O GLY A 129 -85.512 -6.260 -40.110 1.00 0.00 O ATOM 0 H GLY A 129 -83.414 -7.689 -39.355 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.341 -5.990 -37.110 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.349 -5.427 -38.440 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.267 -5.085 -38.351 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.494 -4.676 -38.990 1.00 0.00 C ATOM 1617 C LEU A 130 -87.381 -3.210 -39.394 1.00 0.00 C ATOM 1618 O LEU A 130 -86.762 -2.414 -38.689 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.670 -4.880 -38.032 1.00 0.00 C ATOM 1620 CG LEU A 130 -89.260 -6.291 -37.989 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -90.128 -6.471 -36.753 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -90.076 -6.562 -39.248 1.00 0.00 C ATOM 0 H LEU A 130 -86.163 -4.749 -37.393 1.00 0.00 H new ATOM 0 HA LEU A 130 -87.667 -5.280 -39.881 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -88.345 -4.612 -37.027 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.462 -4.184 -38.307 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.438 -7.005 -37.942 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -90.538 -7.481 -36.741 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -89.525 -6.313 -35.859 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.944 -5.748 -36.773 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.490 -7.569 -39.204 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -90.889 -5.839 -39.318 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.434 -6.472 -40.124 1.00 0.00 H new ATOM 1634 N THR A 131 -87.947 -2.850 -40.529 1.00 0.00 N ATOM 1635 CA THR A 131 -87.890 -1.471 -40.973 1.00 0.00 C ATOM 1636 C THR A 131 -89.197 -1.053 -41.638 1.00 0.00 C ATOM 1637 O THR A 131 -89.529 -1.514 -42.728 1.00 0.00 O ATOM 1638 CB THR A 131 -86.676 -1.266 -41.890 1.00 0.00 C ATOM 1639 OG1 THR A 131 -86.502 0.120 -42.208 1.00 0.00 O ATOM 1640 CG2 THR A 131 -86.762 -2.080 -43.175 1.00 0.00 C ATOM 0 H THR A 131 -88.446 -3.484 -41.154 1.00 0.00 H new ATOM 0 HA THR A 131 -87.764 -0.823 -40.106 1.00 0.00 H new ATOM 0 HB THR A 131 -85.811 -1.623 -41.332 1.00 0.00 H new ATOM 0 HG1 THR A 131 -87.014 0.667 -41.577 1.00 0.00 H new ATOM 0 HG21 THR A 131 -85.877 -1.895 -43.783 1.00 0.00 H new ATOM 0 HG22 THR A 131 -86.819 -3.141 -42.931 1.00 0.00 H new ATOM 0 HG23 THR A 131 -87.652 -1.788 -43.732 1.00 0.00 H new ATOM 1648 N CYS A 132 -89.957 -0.213 -40.923 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.336 0.129 -41.286 1.00 0.00 C ATOM 1650 C CYS A 132 -91.472 0.453 -42.759 1.00 0.00 C ATOM 1651 O CYS A 132 -91.096 1.531 -43.220 1.00 0.00 O ATOM 1652 CB CYS A 132 -91.834 1.273 -40.420 1.00 0.00 C ATOM 1653 SG CYS A 132 -91.923 0.831 -38.662 1.00 0.00 S ATOM 0 H CYS A 132 -89.631 0.249 -40.074 1.00 0.00 H new ATOM 0 HA CYS A 132 -91.959 -0.746 -41.101 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.172 2.131 -40.542 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -92.822 1.581 -40.764 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.011 -0.530 -43.466 1.00 0.00 N ATOM 1659 CA LEU A 133 -92.162 -0.517 -44.904 1.00 0.00 C ATOM 1660 C LEU A 133 -90.802 -0.632 -45.597 1.00 0.00 C ATOM 1661 O LEU A 133 -90.464 -1.678 -46.156 1.00 0.00 O ATOM 1662 CB LEU A 133 -92.924 0.733 -45.381 1.00 0.00 C ATOM 1663 CG LEU A 133 -93.000 0.924 -46.901 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -93.664 -0.271 -47.569 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -93.748 2.206 -47.233 1.00 0.00 C ATOM 0 H LEU A 133 -92.365 -1.384 -43.035 1.00 0.00 H new ATOM 0 HA LEU A 133 -92.757 -1.387 -45.181 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -93.939 0.690 -44.987 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -92.451 1.613 -44.946 1.00 0.00 H new ATOM 0 HG LEU A 133 -91.984 1.002 -47.287 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -93.705 -0.109 -48.646 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -93.088 -1.172 -47.359 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -94.676 -0.389 -47.181 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -93.795 2.330 -48.315 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -94.759 2.152 -46.830 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -93.227 3.056 -46.793 1.00 0.00 H new ATOM 1677 N GLU A 134 -90.028 0.441 -45.545 1.00 0.00 N ATOM 1678 CA GLU A 134 -88.692 0.463 -46.129 1.00 0.00 C ATOM 1679 C GLU A 134 -87.761 1.390 -45.351 1.00 0.00 C ATOM 1680 O GLU A 134 -86.562 1.121 -45.234 1.00 0.00 O ATOM 1681 CB GLU A 134 -88.745 0.865 -47.612 1.00 0.00 C ATOM 1682 CG GLU A 134 -89.704 2.008 -47.941 1.00 0.00 C ATOM 1683 CD GLU A 134 -89.334 3.320 -47.282 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -88.221 3.830 -47.540 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -90.157 3.851 -46.506 1.00 0.00 O ATOM 0 H GLU A 134 -90.304 1.317 -45.100 1.00 0.00 H new ATOM 0 HA GLU A 134 -88.288 -0.547 -46.064 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -87.742 1.150 -47.931 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -89.030 -0.008 -48.199 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -89.731 2.149 -49.022 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -90.711 1.727 -47.631 1.00 0.00 H new