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 113 SER OG : rot 180:sc= 0.0786 USER MOD Set 1.2: A 115 SER OG : rot 103:sc= 0.0748 USER MOD Set 2.1: A 104 SER OG : rot -14:sc= -0.616 USER MOD Set 2.2: A 120 SER OG : rot -92:sc= -1.65! USER MOD Set 3.1: A 27 SER OG : rot 170:sc= 0 USER MOD Set 3.2: A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -0.165 K(o=-0.16,f=-1.4) USER MOD Single : A 38 THR OG1 : rot 21:sc= 0.605 USER MOD Single : A 40 SER OG : rot -124:sc= 0.236 USER MOD Single : A 41 ASN : amide:sc= -0.134 K(o=-0.13,f=-1.3) USER MOD Single : A 42 SER OG : rot 180:sc=0.000673 USER MOD Single : A 43 LYS NZ :NH3+ -165:sc= -0.043 (180deg=-0.308) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 GLN : amide:sc= -2.55! C(o=-2.6!,f=-6.8!) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 HIS : no HE2:sc= -1.09 K(o=-1.1,f=-3.6!) USER MOD Single : A 58 MET CE :methyl -151:sc= -1.2 (180deg=-3.32!) USER MOD Single : A 61 SER OG : rot 122:sc= 1.35 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 63 SER OG : rot -13:sc= 1.42 USER MOD Single : A 67 SER OG : rot 160:sc= 0.0822 USER MOD Single : A 68 SER OG : rot 180:sc= 0.0312 USER MOD Single : A 69 LYS NZ :NH3+ 162:sc= -1.91! (180deg=-2.18!) USER MOD Single : A 70 GLN : amide:sc= -1.4! K(o=-1.4!,f=-0.029) USER MOD Single : A 75 SER OG : rot -15:sc= 0.917 USER MOD Single : A 76 GLN : amide:sc= 0.835 K(o=0.84,f=-6.7!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= -0.643 K(o=-0.64,f=-0.009) USER MOD Single : A 85 ASN : amide:sc= -1.44 K(o=-1.4,f=-3.9!) USER MOD Single : A 91 SER OG : rot -133:sc= 0.679 USER MOD Single : A 97 LYS NZ :NH3+ 177:sc= 1.31 (180deg=1.12) USER MOD Single : A 98 THR OG1 : rot 39:sc= 0.0264 USER MOD Single : A 99 TYR OH : rot 165:sc= -3.19! USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -1.36! K(o=-1.4!,f=-0.015) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 110:sc= 0.135 USER MOD Single : A 110 GLN : amide:sc= -1.94! K(o=-1.9!,f=-0.73) USER MOD Single : A 116 ASN : amide:sc= 0.775 K(o=0.78,f=-0.066) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HD1:sc= -0.185 X(o=-0.18,f=-0.008) USER MOD Single : A 126 HIS : no HD1:sc= 0 X(o=0,f=-0.0026) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 25 N LEU A 26 -101.451 -11.365 -24.847 1.00 0.00 N ATOM 26 CA LEU A 26 -101.116 -10.084 -25.457 1.00 0.00 C ATOM 27 C LEU A 26 -100.462 -10.333 -26.811 1.00 0.00 C ATOM 28 O LEU A 26 -99.765 -11.332 -26.984 1.00 0.00 O ATOM 29 CB LEU A 26 -100.163 -9.276 -24.560 1.00 0.00 C ATOM 30 CG LEU A 26 -100.709 -8.862 -23.183 1.00 0.00 C ATOM 31 CD1 LEU A 26 -100.734 -10.041 -22.220 1.00 0.00 C ATOM 32 CD2 LEU A 26 -99.877 -7.728 -22.606 1.00 0.00 C ATOM 0 HA LEU A 26 -102.032 -9.506 -25.584 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -99.258 -9.863 -24.406 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -99.870 -8.374 -25.097 1.00 0.00 H new ATOM 0 HG LEU A 26 -101.734 -8.518 -23.318 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -101.125 -9.715 -21.256 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -101.372 -10.827 -22.624 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -99.723 -10.426 -22.090 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -100.274 -7.445 -21.631 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -98.843 -8.055 -22.495 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -99.916 -6.870 -23.277 1.00 0.00 H new ATOM 44 N SER A 27 -100.695 -9.457 -27.773 1.00 0.00 N ATOM 45 CA SER A 27 -100.095 -9.612 -29.088 1.00 0.00 C ATOM 46 C SER A 27 -99.701 -8.265 -29.679 1.00 0.00 C ATOM 47 O SER A 27 -100.213 -7.224 -29.273 1.00 0.00 O ATOM 48 CB SER A 27 -101.055 -10.353 -30.016 1.00 0.00 C ATOM 49 OG SER A 27 -101.304 -11.662 -29.536 1.00 0.00 O ATOM 0 H SER A 27 -101.291 -8.636 -27.670 1.00 0.00 H new ATOM 0 HA SER A 27 -99.184 -10.201 -28.982 1.00 0.00 H new ATOM 0 HB2 SER A 27 -101.993 -9.803 -30.091 1.00 0.00 H new ATOM 0 HB3 SER A 27 -100.633 -10.402 -31.020 1.00 0.00 H new ATOM 0 HG SER A 27 -102.038 -12.064 -30.047 1.00 0.00 H new ATOM 55 N TRP A 28 -98.795 -8.292 -30.653 1.00 0.00 N ATOM 56 CA TRP A 28 -98.235 -7.058 -31.213 1.00 0.00 C ATOM 57 C TRP A 28 -99.172 -6.393 -32.221 1.00 0.00 C ATOM 58 O TRP A 28 -98.790 -5.434 -32.890 1.00 0.00 O ATOM 59 CB TRP A 28 -96.858 -7.313 -31.850 1.00 0.00 C ATOM 60 CG TRP A 28 -96.846 -8.283 -33.003 1.00 0.00 C ATOM 61 CD1 TRP A 28 -97.804 -9.197 -33.337 1.00 0.00 C ATOM 62 CD2 TRP A 28 -95.797 -8.433 -33.968 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.420 -9.898 -34.454 1.00 0.00 N ATOM 64 CE2 TRP A 28 -96.191 -9.446 -34.861 1.00 0.00 C ATOM 65 CE3 TRP A 28 -94.567 -7.801 -34.165 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -95.394 -9.842 -35.935 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -93.776 -8.196 -35.229 1.00 0.00 C ATOM 68 CH2 TRP A 28 -94.193 -9.206 -36.102 1.00 0.00 C ATOM 0 H TRP A 28 -98.432 -9.149 -31.071 1.00 0.00 H new ATOM 0 HA TRP A 28 -98.114 -6.367 -30.378 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -96.455 -6.361 -32.195 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -96.183 -7.684 -31.079 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -98.729 -9.347 -32.801 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -97.961 -10.635 -34.907 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -94.239 -7.017 -33.498 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -95.713 -10.622 -36.610 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -92.821 -7.717 -35.388 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -93.554 -9.490 -36.925 1.00 0.00 H new ATOM 79 N TYR A 29 -100.395 -6.892 -32.324 1.00 0.00 N ATOM 80 CA TYR A 29 -101.387 -6.273 -33.191 1.00 0.00 C ATOM 81 C TYR A 29 -102.542 -5.709 -32.371 1.00 0.00 C ATOM 82 O TYR A 29 -103.573 -5.312 -32.918 1.00 0.00 O ATOM 83 CB TYR A 29 -101.895 -7.258 -34.257 1.00 0.00 C ATOM 84 CG TYR A 29 -102.259 -8.632 -33.737 1.00 0.00 C ATOM 85 CD1 TYR A 29 -103.488 -8.874 -33.139 1.00 0.00 C ATOM 86 CD2 TYR A 29 -101.373 -9.693 -33.865 1.00 0.00 C ATOM 87 CE1 TYR A 29 -103.823 -10.133 -32.678 1.00 0.00 C ATOM 88 CE2 TYR A 29 -101.699 -10.952 -33.407 1.00 0.00 C ATOM 89 CZ TYR A 29 -102.924 -11.170 -32.815 1.00 0.00 C ATOM 90 OH TYR A 29 -103.245 -12.426 -32.358 1.00 0.00 O ATOM 0 H TYR A 29 -100.723 -7.717 -31.822 1.00 0.00 H new ATOM 0 HA TYR A 29 -100.905 -5.447 -33.714 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -102.771 -6.826 -34.742 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -101.128 -7.368 -35.024 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -104.195 -8.064 -33.032 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -100.413 -9.530 -34.331 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -104.783 -10.304 -32.213 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -100.996 -11.765 -33.512 1.00 0.00 H new ATOM 0 HH TYR A 29 -102.501 -13.038 -32.534 1.00 0.00 H new ATOM 100 N ASP A 30 -102.361 -5.663 -31.056 1.00 0.00 N ATOM 101 CA ASP A 30 -103.351 -5.069 -30.173 1.00 0.00 C ATOM 102 C ASP A 30 -103.288 -3.548 -30.269 1.00 0.00 C ATOM 103 O ASP A 30 -102.205 -2.971 -30.325 1.00 0.00 O ATOM 104 CB ASP A 30 -103.130 -5.513 -28.726 1.00 0.00 C ATOM 105 CG ASP A 30 -103.597 -6.932 -28.458 1.00 0.00 C ATOM 106 OD1 ASP A 30 -104.663 -7.322 -28.982 1.00 0.00 O ATOM 107 OD2 ASP A 30 -102.910 -7.660 -27.710 1.00 0.00 O ATOM 0 H ASP A 30 -101.537 -6.031 -30.580 1.00 0.00 H new ATOM 0 HA ASP A 30 -104.338 -5.409 -30.487 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -102.069 -5.435 -28.487 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -103.658 -4.832 -28.059 1.00 0.00 H new ATOM 112 N PRO A 31 -104.451 -2.875 -30.291 1.00 0.00 N ATOM 113 CA PRO A 31 -104.528 -1.416 -30.464 1.00 0.00 C ATOM 114 C PRO A 31 -103.796 -0.636 -29.370 1.00 0.00 C ATOM 115 O PRO A 31 -103.236 0.429 -29.630 1.00 0.00 O ATOM 116 CB PRO A 31 -106.034 -1.123 -30.411 1.00 0.00 C ATOM 117 CG PRO A 31 -106.692 -2.423 -30.722 1.00 0.00 C ATOM 118 CD PRO A 31 -105.787 -3.483 -30.166 1.00 0.00 C ATOM 0 HA PRO A 31 -104.047 -1.105 -31.391 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -106.330 -0.756 -29.428 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -106.313 -0.357 -31.135 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -107.682 -2.478 -30.270 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -106.825 -2.547 -31.797 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -106.029 -3.717 -29.129 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -105.862 -4.414 -30.729 1.00 0.00 H new ATOM 126 N ASP A 32 -103.798 -1.171 -28.155 1.00 0.00 N ATOM 127 CA ASP A 32 -103.169 -0.497 -27.023 1.00 0.00 C ATOM 128 C ASP A 32 -101.678 -0.817 -26.959 1.00 0.00 C ATOM 129 O ASP A 32 -100.894 -0.073 -26.368 1.00 0.00 O ATOM 130 CB ASP A 32 -103.849 -0.907 -25.711 1.00 0.00 C ATOM 131 CG ASP A 32 -103.341 -0.121 -24.517 1.00 0.00 C ATOM 132 OD1 ASP A 32 -103.709 1.067 -24.380 1.00 0.00 O ATOM 133 OD2 ASP A 32 -102.589 -0.688 -23.698 1.00 0.00 O ATOM 0 H ASP A 32 -104.227 -2.068 -27.927 1.00 0.00 H new ATOM 0 HA ASP A 32 -103.286 0.578 -27.163 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -104.925 -0.763 -25.804 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -103.684 -1.970 -25.538 1.00 0.00 H new ATOM 138 N PHE A 33 -101.290 -1.899 -27.616 1.00 0.00 N ATOM 139 CA PHE A 33 -99.928 -2.405 -27.537 1.00 0.00 C ATOM 140 C PHE A 33 -98.970 -1.516 -28.328 1.00 0.00 C ATOM 141 O PHE A 33 -99.326 -0.985 -29.382 1.00 0.00 O ATOM 142 CB PHE A 33 -99.887 -3.839 -28.062 1.00 0.00 C ATOM 143 CG PHE A 33 -98.951 -4.733 -27.306 1.00 0.00 C ATOM 144 CD1 PHE A 33 -99.159 -4.990 -25.961 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.875 -5.331 -27.938 1.00 0.00 C ATOM 146 CE1 PHE A 33 -98.309 -5.823 -25.261 1.00 0.00 C ATOM 147 CE2 PHE A 33 -97.022 -6.162 -27.243 1.00 0.00 C ATOM 148 CZ PHE A 33 -97.238 -6.410 -25.903 1.00 0.00 C ATOM 0 H PHE A 33 -101.906 -2.448 -28.216 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.607 -2.395 -26.495 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.891 -4.261 -28.019 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -99.592 -3.824 -29.111 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -99.996 -4.533 -25.454 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.701 -5.145 -28.988 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -98.482 -6.015 -24.212 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -96.184 -6.619 -27.748 1.00 0.00 H new ATOM 0 HZ PHE A 33 -96.571 -7.062 -25.358 1.00 0.00 H new ATOM 158 N GLN A 34 -97.759 -1.354 -27.816 1.00 0.00 N ATOM 159 CA GLN A 34 -96.798 -0.440 -28.416 1.00 0.00 C ATOM 160 C GLN A 34 -95.494 -1.154 -28.753 1.00 0.00 C ATOM 161 O GLN A 34 -94.948 -1.884 -27.931 1.00 0.00 O ATOM 162 CB GLN A 34 -96.525 0.725 -27.458 1.00 0.00 C ATOM 163 CG GLN A 34 -95.629 1.815 -28.031 1.00 0.00 C ATOM 164 CD GLN A 34 -96.152 2.392 -29.337 1.00 0.00 C ATOM 165 OE1 GLN A 34 -97.357 2.414 -29.588 1.00 0.00 O ATOM 166 NE2 GLN A 34 -95.249 2.881 -30.171 1.00 0.00 N ATOM 0 H GLN A 34 -97.419 -1.843 -26.988 1.00 0.00 H new ATOM 0 HA GLN A 34 -97.223 -0.058 -29.344 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -97.476 1.170 -27.166 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -96.065 0.333 -26.551 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -95.530 2.617 -27.300 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -94.631 1.408 -28.194 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -94.259 2.845 -29.929 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -95.543 3.294 -31.056 1.00 0.00 H new ATOM 175 N ALA A 35 -95.011 -0.939 -29.967 1.00 0.00 N ATOM 176 CA ALA A 35 -93.725 -1.464 -30.398 1.00 0.00 C ATOM 177 C ALA A 35 -93.029 -0.430 -31.265 1.00 0.00 C ATOM 178 O ALA A 35 -93.689 0.397 -31.889 1.00 0.00 O ATOM 179 CB ALA A 35 -93.895 -2.771 -31.154 1.00 0.00 C ATOM 0 H ALA A 35 -95.499 -0.397 -30.680 1.00 0.00 H new ATOM 0 HA ALA A 35 -93.113 -1.671 -29.520 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -92.918 -3.141 -31.465 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -94.373 -3.506 -30.507 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -94.516 -2.604 -32.034 1.00 0.00 H new ATOM 185 N ARG A 36 -91.707 -0.467 -31.291 1.00 0.00 N ATOM 186 CA ARG A 36 -90.933 0.534 -32.009 1.00 0.00 C ATOM 187 C ARG A 36 -89.579 -0.013 -32.419 1.00 0.00 C ATOM 188 O ARG A 36 -89.261 -1.170 -32.167 1.00 0.00 O ATOM 189 CB ARG A 36 -90.720 1.762 -31.118 1.00 0.00 C ATOM 190 CG ARG A 36 -89.920 1.438 -29.865 1.00 0.00 C ATOM 191 CD ARG A 36 -89.675 2.664 -29.000 1.00 0.00 C ATOM 192 NE ARG A 36 -88.936 2.320 -27.786 1.00 0.00 N ATOM 193 CZ ARG A 36 -88.897 3.069 -26.690 1.00 0.00 C ATOM 194 NH1 ARG A 36 -89.535 4.231 -26.638 1.00 0.00 N ATOM 195 NH2 ARG A 36 -88.211 2.648 -25.640 1.00 0.00 N ATOM 0 H ARG A 36 -91.147 -1.179 -30.823 1.00 0.00 H new ATOM 0 HA ARG A 36 -91.489 0.809 -32.905 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -90.202 2.535 -31.687 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -91.688 2.172 -30.832 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -90.452 0.686 -29.282 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -88.963 1.002 -30.151 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -89.117 3.407 -29.569 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -90.629 3.118 -28.731 1.00 0.00 H new ATOM 0 HE ARG A 36 -88.414 1.444 -27.781 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -90.064 4.559 -27.446 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -89.497 4.796 -25.790 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -87.718 1.756 -25.677 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -88.175 3.216 -24.793 1.00 0.00 H new ATOM 209 N LEU A 37 -88.786 0.836 -33.049 1.00 0.00 N ATOM 210 CA LEU A 37 -87.450 0.468 -33.480 1.00 0.00 C ATOM 211 C LEU A 37 -86.408 1.095 -32.567 1.00 0.00 C ATOM 212 O LEU A 37 -86.532 2.260 -32.186 1.00 0.00 O ATOM 213 CB LEU A 37 -87.225 0.944 -34.909 1.00 0.00 C ATOM 214 CG LEU A 37 -88.355 0.618 -35.874 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.096 1.273 -37.212 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.506 -0.885 -36.031 1.00 0.00 C ATOM 0 H LEU A 37 -89.049 1.795 -33.275 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.353 -0.617 -33.435 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.075 2.024 -34.898 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.304 0.498 -35.285 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.288 1.010 -35.469 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -88.909 1.035 -37.897 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.035 2.354 -37.082 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.156 0.903 -37.622 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -89.319 -1.098 -36.725 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.578 -1.305 -36.419 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.729 -1.331 -35.062 1.00 0.00 H new ATOM 228 N THR A 38 -85.388 0.328 -32.222 1.00 0.00 N ATOM 229 CA THR A 38 -84.317 0.822 -31.372 1.00 0.00 C ATOM 230 C THR A 38 -82.969 0.295 -31.844 1.00 0.00 C ATOM 231 O THR A 38 -82.913 -0.562 -32.732 1.00 0.00 O ATOM 232 CB THR A 38 -84.531 0.416 -29.903 1.00 0.00 C ATOM 233 OG1 THR A 38 -84.822 -0.987 -29.824 1.00 0.00 O ATOM 234 CG2 THR A 38 -85.652 1.223 -29.263 1.00 0.00 C ATOM 0 H THR A 38 -85.278 -0.642 -32.518 1.00 0.00 H new ATOM 0 HA THR A 38 -84.328 1.910 -31.440 1.00 0.00 H new ATOM 0 HB THR A 38 -83.613 0.627 -29.354 1.00 0.00 H new ATOM 0 HG1 THR A 38 -84.502 -1.434 -30.636 1.00 0.00 H new ATOM 0 HG21 THR A 38 -85.778 0.912 -28.226 1.00 0.00 H new ATOM 0 HG22 THR A 38 -85.402 2.283 -29.296 1.00 0.00 H new ATOM 0 HG23 THR A 38 -86.580 1.052 -29.808 1.00 0.00 H new ATOM 242 N ARG A 39 -81.896 0.823 -31.248 1.00 0.00 N ATOM 243 CA ARG A 39 -80.517 0.430 -31.558 1.00 0.00 C ATOM 244 C ARG A 39 -80.104 0.902 -32.952 1.00 0.00 C ATOM 245 O ARG A 39 -79.068 1.545 -33.119 1.00 0.00 O ATOM 246 CB ARG A 39 -80.306 -1.088 -31.393 1.00 0.00 C ATOM 247 CG ARG A 39 -80.227 -1.540 -29.934 1.00 0.00 C ATOM 248 CD ARG A 39 -81.560 -1.389 -29.210 1.00 0.00 C ATOM 249 NE ARG A 39 -81.437 -1.569 -27.762 1.00 0.00 N ATOM 250 CZ ARG A 39 -82.464 -1.518 -26.907 1.00 0.00 C ATOM 251 NH1 ARG A 39 -83.703 -1.351 -27.352 1.00 0.00 N ATOM 252 NH2 ARG A 39 -82.246 -1.654 -25.605 1.00 0.00 N ATOM 0 H ARG A 39 -81.960 1.543 -30.529 1.00 0.00 H new ATOM 0 HA ARG A 39 -79.869 0.926 -30.836 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -81.124 -1.616 -31.884 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -79.388 -1.376 -31.904 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -79.911 -2.582 -29.895 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -79.466 -0.957 -29.416 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -81.971 -0.401 -29.416 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -82.268 -2.118 -29.604 1.00 0.00 H new ATOM 0 HE ARG A 39 -80.507 -1.745 -27.381 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -83.878 -1.260 -28.353 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -84.481 -1.313 -26.693 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -81.297 -1.797 -25.259 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -83.027 -1.616 -24.950 1.00 0.00 H new ATOM 266 N SER A 40 -80.909 0.586 -33.951 1.00 0.00 N ATOM 267 CA SER A 40 -80.705 1.110 -35.287 1.00 0.00 C ATOM 268 C SER A 40 -81.118 2.578 -35.320 1.00 0.00 C ATOM 269 O SER A 40 -80.405 3.421 -35.864 1.00 0.00 O ATOM 270 CB SER A 40 -81.524 0.302 -36.287 1.00 0.00 C ATOM 271 OG SER A 40 -81.444 -1.085 -35.998 1.00 0.00 O ATOM 0 H SER A 40 -81.714 -0.034 -33.860 1.00 0.00 H new ATOM 0 HA SER A 40 -79.652 1.031 -35.558 1.00 0.00 H new ATOM 0 HB2 SER A 40 -82.565 0.625 -36.257 1.00 0.00 H new ATOM 0 HB3 SER A 40 -81.161 0.489 -37.297 1.00 0.00 H new ATOM 0 HG SER A 40 -81.116 -1.565 -36.787 1.00 0.00 H new ATOM 277 N ASN A 41 -82.282 2.858 -34.721 1.00 0.00 N ATOM 278 CA ASN A 41 -82.766 4.228 -34.520 1.00 0.00 C ATOM 279 C ASN A 41 -82.868 4.996 -35.835 1.00 0.00 C ATOM 280 O ASN A 41 -82.611 6.198 -35.881 1.00 0.00 O ATOM 281 CB ASN A 41 -81.836 4.970 -33.550 1.00 0.00 C ATOM 282 CG ASN A 41 -81.852 4.374 -32.154 1.00 0.00 C ATOM 283 OD1 ASN A 41 -82.877 3.868 -31.692 1.00 0.00 O ATOM 284 ND2 ASN A 41 -80.712 4.409 -31.479 1.00 0.00 N ATOM 0 H ASN A 41 -82.914 2.142 -34.363 1.00 0.00 H new ATOM 0 HA ASN A 41 -83.769 4.167 -34.097 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -80.818 4.947 -33.939 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -82.133 6.017 -33.497 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -80.661 4.008 -30.542 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -79.885 4.837 -31.896 1.00 0.00 H new ATOM 291 N SER A 42 -83.276 4.313 -36.895 1.00 0.00 N ATOM 292 CA SER A 42 -83.323 4.933 -38.205 1.00 0.00 C ATOM 293 C SER A 42 -84.763 5.096 -38.692 1.00 0.00 C ATOM 294 O SER A 42 -85.703 4.590 -38.073 1.00 0.00 O ATOM 295 CB SER A 42 -82.486 4.123 -39.198 1.00 0.00 C ATOM 296 OG SER A 42 -82.314 4.820 -40.421 1.00 0.00 O ATOM 0 H SER A 42 -83.576 3.338 -36.872 1.00 0.00 H new ATOM 0 HA SER A 42 -82.896 5.933 -38.130 1.00 0.00 H new ATOM 0 HB2 SER A 42 -81.511 3.905 -38.762 1.00 0.00 H new ATOM 0 HB3 SER A 42 -82.971 3.166 -39.388 1.00 0.00 H new ATOM 0 HG SER A 42 -81.774 4.278 -41.033 1.00 0.00 H new ATOM 302 N LYS A 43 -84.916 5.795 -39.813 1.00 0.00 N ATOM 303 CA LYS A 43 -86.224 6.214 -40.312 1.00 0.00 C ATOM 304 C LYS A 43 -87.087 5.025 -40.706 1.00 0.00 C ATOM 305 O LYS A 43 -86.955 4.486 -41.806 1.00 0.00 O ATOM 306 CB LYS A 43 -86.079 7.158 -41.512 1.00 0.00 C ATOM 307 CG LYS A 43 -85.427 8.494 -41.189 1.00 0.00 C ATOM 308 CD LYS A 43 -83.925 8.366 -40.987 1.00 0.00 C ATOM 309 CE LYS A 43 -83.284 9.715 -40.712 1.00 0.00 C ATOM 310 NZ LYS A 43 -83.483 10.667 -41.837 1.00 0.00 N ATOM 0 H LYS A 43 -84.137 6.088 -40.402 1.00 0.00 H new ATOM 0 HA LYS A 43 -86.717 6.742 -39.496 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -85.492 6.658 -42.282 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -87.067 7.343 -41.934 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -85.625 9.198 -41.998 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -85.879 8.909 -40.288 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -83.725 7.690 -40.155 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -83.474 7.922 -41.874 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -83.706 10.138 -39.800 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -82.217 9.580 -40.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -82.831 11.471 -41.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -83.294 10.184 -42.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -84.464 11.013 -41.829 1.00 0.00 H new ATOM 324 N CYS A 44 -87.959 4.622 -39.787 1.00 0.00 N ATOM 325 CA CYS A 44 -88.890 3.519 -40.005 1.00 0.00 C ATOM 326 C CYS A 44 -88.147 2.233 -40.372 1.00 0.00 C ATOM 327 O CYS A 44 -88.715 1.332 -40.980 1.00 0.00 O ATOM 328 CB CYS A 44 -89.914 3.892 -41.085 1.00 0.00 C ATOM 329 SG CYS A 44 -90.679 5.522 -40.825 1.00 0.00 S ATOM 0 H CYS A 44 -88.040 5.053 -38.866 1.00 0.00 H new ATOM 0 HA CYS A 44 -89.425 3.334 -39.073 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -89.424 3.880 -42.059 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.695 3.133 -41.112 1.00 0.00 H new ATOM 334 N GLN A 45 -86.881 2.150 -39.967 1.00 0.00 N ATOM 335 CA GLN A 45 -86.079 0.947 -40.161 1.00 0.00 C ATOM 336 C GLN A 45 -85.207 0.714 -38.928 1.00 0.00 C ATOM 337 O GLN A 45 -84.489 1.615 -38.483 1.00 0.00 O ATOM 338 CB GLN A 45 -85.229 1.064 -41.434 1.00 0.00 C ATOM 339 CG GLN A 45 -84.349 2.298 -41.485 1.00 0.00 C ATOM 340 CD GLN A 45 -83.688 2.490 -42.834 1.00 0.00 C ATOM 341 OE1 GLN A 45 -82.582 2.002 -43.077 1.00 0.00 O ATOM 342 NE2 GLN A 45 -84.361 3.206 -43.721 1.00 0.00 N ATOM 0 H GLN A 45 -86.387 2.909 -39.499 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.738 0.088 -40.288 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -84.599 0.179 -41.519 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -85.891 1.068 -42.300 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -84.949 3.177 -41.251 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -83.580 2.223 -40.716 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -85.274 3.592 -43.478 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -83.967 3.372 -44.647 1.00 0.00 H new ATOM 351 N GLY A 46 -85.289 -0.477 -38.352 1.00 0.00 N ATOM 352 CA GLY A 46 -84.605 -0.720 -37.100 1.00 0.00 C ATOM 353 C GLY A 46 -84.811 -2.121 -36.573 1.00 0.00 C ATOM 354 O GLY A 46 -85.428 -2.958 -37.223 1.00 0.00 O ATOM 0 H GLY A 46 -85.811 -1.270 -38.724 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.538 -0.543 -37.236 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.955 -0.004 -36.357 1.00 0.00 H new ATOM 358 N GLN A 47 -84.227 -2.394 -35.423 1.00 0.00 N ATOM 359 CA GLN A 47 -84.470 -3.641 -34.722 1.00 0.00 C ATOM 360 C GLN A 47 -85.580 -3.427 -33.695 1.00 0.00 C ATOM 361 O GLN A 47 -85.609 -2.402 -33.006 1.00 0.00 O ATOM 362 CB GLN A 47 -83.170 -4.127 -34.087 1.00 0.00 C ATOM 363 CG GLN A 47 -82.085 -4.348 -35.131 1.00 0.00 C ATOM 364 CD GLN A 47 -80.681 -4.323 -34.570 1.00 0.00 C ATOM 365 OE1 GLN A 47 -79.749 -3.894 -35.245 1.00 0.00 O ATOM 366 NE2 GLN A 47 -80.512 -4.794 -33.344 1.00 0.00 N ATOM 0 H GLN A 47 -83.577 -1.765 -34.951 1.00 0.00 H new ATOM 0 HA GLN A 47 -84.803 -4.417 -35.411 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -82.827 -3.397 -33.354 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -83.353 -5.057 -33.549 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -82.254 -5.308 -35.619 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -82.172 -3.580 -35.900 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -81.313 -5.141 -32.816 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -79.581 -4.809 -32.927 1.00 0.00 H new ATOM 375 N LEU A 48 -86.499 -4.378 -33.617 1.00 0.00 N ATOM 376 CA LEU A 48 -87.763 -4.169 -32.917 1.00 0.00 C ATOM 377 C LEU A 48 -87.627 -4.247 -31.396 1.00 0.00 C ATOM 378 O LEU A 48 -86.937 -5.109 -30.855 1.00 0.00 O ATOM 379 CB LEU A 48 -88.803 -5.184 -33.401 1.00 0.00 C ATOM 380 CG LEU A 48 -90.228 -4.958 -32.891 1.00 0.00 C ATOM 381 CD1 LEU A 48 -90.807 -3.673 -33.459 1.00 0.00 C ATOM 382 CD2 LEU A 48 -91.113 -6.141 -33.248 1.00 0.00 C ATOM 0 H LEU A 48 -86.395 -5.305 -34.030 1.00 0.00 H new ATOM 0 HA LEU A 48 -88.089 -3.156 -33.153 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -88.819 -5.171 -34.491 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -88.481 -6.181 -33.099 1.00 0.00 H new ATOM 0 HG LEU A 48 -90.191 -4.865 -31.806 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -91.820 -3.533 -33.083 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.187 -2.829 -33.155 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -90.829 -3.734 -34.547 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -92.123 -5.964 -32.878 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -91.139 -6.262 -34.331 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.712 -7.046 -32.791 1.00 0.00 H new ATOM 394 N GLU A 49 -88.304 -3.323 -30.731 1.00 0.00 N ATOM 395 CA GLU A 49 -88.442 -3.315 -29.283 1.00 0.00 C ATOM 396 C GLU A 49 -89.918 -3.117 -28.948 1.00 0.00 C ATOM 397 O GLU A 49 -90.532 -2.142 -29.388 1.00 0.00 O ATOM 398 CB GLU A 49 -87.601 -2.193 -28.664 1.00 0.00 C ATOM 399 CG GLU A 49 -87.737 -2.088 -27.154 1.00 0.00 C ATOM 400 CD GLU A 49 -86.963 -0.920 -26.575 1.00 0.00 C ATOM 401 OE1 GLU A 49 -87.424 0.232 -26.714 1.00 0.00 O ATOM 402 OE2 GLU A 49 -85.895 -1.148 -25.967 1.00 0.00 O ATOM 0 H GLU A 49 -88.780 -2.546 -31.189 1.00 0.00 H new ATOM 0 HA GLU A 49 -88.085 -4.260 -28.872 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -86.553 -2.356 -28.915 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -87.892 -1.243 -29.113 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -88.791 -1.984 -26.895 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -87.386 -3.013 -26.697 1.00 0.00 H new ATOM 409 N VAL A 50 -90.494 -4.048 -28.204 1.00 0.00 N ATOM 410 CA VAL A 50 -91.924 -4.011 -27.925 1.00 0.00 C ATOM 411 C VAL A 50 -92.185 -3.803 -26.439 1.00 0.00 C ATOM 412 O VAL A 50 -91.523 -4.406 -25.600 1.00 0.00 O ATOM 413 CB VAL A 50 -92.618 -5.311 -28.367 1.00 0.00 C ATOM 414 CG1 VAL A 50 -94.124 -5.124 -28.392 1.00 0.00 C ATOM 415 CG2 VAL A 50 -92.107 -5.776 -29.722 1.00 0.00 C ATOM 0 H VAL A 50 -89.999 -4.835 -27.784 1.00 0.00 H new ATOM 0 HA VAL A 50 -92.333 -3.174 -28.492 1.00 0.00 H new ATOM 0 HB VAL A 50 -92.378 -6.087 -27.640 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -94.601 -6.052 -28.707 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -94.474 -4.856 -27.395 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -94.380 -4.329 -29.092 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -92.616 -6.697 -30.007 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -92.304 -5.007 -30.469 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -91.034 -5.958 -29.663 1.00 0.00 H new ATOM 425 N TYR A 51 -93.159 -2.967 -26.118 1.00 0.00 N ATOM 426 CA TYR A 51 -93.475 -2.669 -24.732 1.00 0.00 C ATOM 427 C TYR A 51 -94.513 -3.632 -24.185 1.00 0.00 C ATOM 428 O TYR A 51 -95.665 -3.630 -24.618 1.00 0.00 O ATOM 429 CB TYR A 51 -93.993 -1.239 -24.584 1.00 0.00 C ATOM 430 CG TYR A 51 -94.275 -0.855 -23.145 1.00 0.00 C ATOM 431 CD1 TYR A 51 -93.259 -0.856 -22.196 1.00 0.00 C ATOM 432 CD2 TYR A 51 -95.553 -0.498 -22.737 1.00 0.00 C ATOM 433 CE1 TYR A 51 -93.510 -0.511 -20.881 1.00 0.00 C ATOM 434 CE2 TYR A 51 -95.812 -0.152 -21.423 1.00 0.00 C ATOM 435 CZ TYR A 51 -94.788 -0.160 -20.499 1.00 0.00 C ATOM 436 OH TYR A 51 -95.043 0.189 -19.189 1.00 0.00 O ATOM 0 H TYR A 51 -93.744 -2.483 -26.799 1.00 0.00 H new ATOM 0 HA TYR A 51 -92.552 -2.779 -24.162 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -93.260 -0.548 -25.001 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -94.906 -1.127 -25.169 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -92.257 -1.131 -22.491 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -96.358 -0.490 -23.457 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -92.709 -0.516 -20.156 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -96.812 0.123 -21.122 1.00 0.00 H new ATOM 0 HH TYR A 51 -95.992 0.410 -19.088 1.00 0.00 H new ATOM 446 N LEU A 52 -94.095 -4.458 -23.243 1.00 0.00 N ATOM 447 CA LEU A 52 -95.025 -5.264 -22.474 1.00 0.00 C ATOM 448 C LEU A 52 -95.135 -4.693 -21.063 1.00 0.00 C ATOM 449 O LEU A 52 -94.554 -3.646 -20.774 1.00 0.00 O ATOM 450 CB LEU A 52 -94.640 -6.757 -22.449 1.00 0.00 C ATOM 451 CG LEU A 52 -93.146 -7.096 -22.541 1.00 0.00 C ATOM 452 CD1 LEU A 52 -92.879 -8.469 -21.944 1.00 0.00 C ATOM 453 CD2 LEU A 52 -92.685 -7.082 -23.990 1.00 0.00 C ATOM 0 H LEU A 52 -93.115 -4.588 -22.992 1.00 0.00 H new ATOM 0 HA LEU A 52 -95.998 -5.218 -22.963 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -95.029 -7.191 -21.528 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -95.151 -7.252 -23.275 1.00 0.00 H new ATOM 0 HG LEU A 52 -92.592 -6.343 -21.981 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -91.815 -8.696 -22.016 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -93.181 -8.475 -20.897 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -93.449 -9.221 -22.491 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -91.623 -7.324 -24.036 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -93.251 -7.820 -24.559 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -92.850 -6.092 -24.415 1.00 0.00 H new ATOM 465 N LYS A 53 -95.855 -5.396 -20.196 1.00 0.00 N ATOM 466 CA LYS A 53 -96.249 -4.879 -18.882 1.00 0.00 C ATOM 467 C LYS A 53 -95.090 -4.270 -18.085 1.00 0.00 C ATOM 468 O LYS A 53 -95.270 -3.252 -17.416 1.00 0.00 O ATOM 469 CB LYS A 53 -96.914 -5.988 -18.062 1.00 0.00 C ATOM 470 CG LYS A 53 -98.237 -6.463 -18.644 1.00 0.00 C ATOM 471 CD LYS A 53 -99.278 -5.350 -18.648 1.00 0.00 C ATOM 472 CE LYS A 53 -100.609 -5.826 -19.212 1.00 0.00 C ATOM 473 NZ LYS A 53 -101.640 -4.755 -19.190 1.00 0.00 N ATOM 0 H LYS A 53 -96.185 -6.343 -20.381 1.00 0.00 H new ATOM 0 HA LYS A 53 -96.953 -4.069 -19.072 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -96.232 -6.835 -17.991 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -97.081 -5.628 -17.047 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -98.081 -6.820 -19.662 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -98.608 -7.308 -18.064 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -99.423 -4.984 -17.632 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -98.911 -4.511 -19.239 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -100.466 -6.170 -20.236 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -100.962 -6.681 -18.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -102.530 -5.122 -19.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -101.796 -4.444 -18.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -101.316 -3.949 -19.762 1.00 0.00 H new ATOM 487 N ASP A 54 -93.914 -4.883 -18.138 1.00 0.00 N ATOM 488 CA ASP A 54 -92.785 -4.394 -17.344 1.00 0.00 C ATOM 489 C ASP A 54 -91.500 -4.306 -18.161 1.00 0.00 C ATOM 490 O ASP A 54 -90.413 -4.165 -17.596 1.00 0.00 O ATOM 491 CB ASP A 54 -92.548 -5.298 -16.125 1.00 0.00 C ATOM 492 CG ASP A 54 -92.022 -6.678 -16.491 1.00 0.00 C ATOM 493 OD1 ASP A 54 -92.843 -7.571 -16.788 1.00 0.00 O ATOM 494 OD2 ASP A 54 -90.788 -6.881 -16.469 1.00 0.00 O ATOM 0 H ASP A 54 -93.715 -5.704 -18.709 1.00 0.00 H new ATOM 0 HA ASP A 54 -93.047 -3.389 -17.014 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -91.839 -4.813 -15.454 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -93.483 -5.407 -15.575 1.00 0.00 H new ATOM 499 N GLY A 55 -91.610 -4.343 -19.480 1.00 0.00 N ATOM 500 CA GLY A 55 -90.412 -4.441 -20.287 1.00 0.00 C ATOM 501 C GLY A 55 -90.551 -3.913 -21.689 1.00 0.00 C ATOM 502 O GLY A 55 -91.377 -4.398 -22.460 1.00 0.00 O ATOM 0 H GLY A 55 -92.488 -4.308 -19.998 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -89.609 -3.899 -19.788 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -90.108 -5.487 -20.336 1.00 0.00 H new ATOM 506 N TRP A 56 -89.745 -2.914 -22.017 1.00 0.00 N ATOM 507 CA TRP A 56 -89.478 -2.592 -23.405 1.00 0.00 C ATOM 508 C TRP A 56 -88.546 -3.664 -23.948 1.00 0.00 C ATOM 509 O TRP A 56 -87.325 -3.510 -23.954 1.00 0.00 O ATOM 510 CB TRP A 56 -88.841 -1.208 -23.561 1.00 0.00 C ATOM 511 CG TRP A 56 -89.827 -0.091 -23.721 1.00 0.00 C ATOM 512 CD1 TRP A 56 -90.143 0.867 -22.801 1.00 0.00 C ATOM 513 CD2 TRP A 56 -90.624 0.189 -24.879 1.00 0.00 C ATOM 514 NE1 TRP A 56 -91.078 1.729 -23.320 1.00 0.00 N ATOM 515 CE2 TRP A 56 -91.390 1.333 -24.593 1.00 0.00 C ATOM 516 CE3 TRP A 56 -90.756 -0.413 -26.132 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -92.281 1.883 -25.512 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -91.641 0.131 -27.042 1.00 0.00 C ATOM 519 CH2 TRP A 56 -92.390 1.272 -26.730 1.00 0.00 C ATOM 0 H TRP A 56 -89.268 -2.316 -21.342 1.00 0.00 H new ATOM 0 HA TRP A 56 -90.416 -2.566 -23.959 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -88.219 -1.006 -22.689 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -88.180 -1.221 -24.427 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -89.720 0.937 -21.810 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -91.476 2.534 -22.836 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -90.176 -1.288 -26.385 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -92.864 2.760 -25.271 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -91.757 -0.332 -28.011 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -93.068 1.678 -27.467 1.00 0.00 H new ATOM 530 N HIS A 57 -89.131 -4.780 -24.341 1.00 0.00 N ATOM 531 CA HIS A 57 -88.362 -5.946 -24.719 1.00 0.00 C ATOM 532 C HIS A 57 -87.816 -5.803 -26.130 1.00 0.00 C ATOM 533 O HIS A 57 -88.566 -5.907 -27.101 1.00 0.00 O ATOM 534 CB HIS A 57 -89.218 -7.214 -24.624 1.00 0.00 C ATOM 535 CG HIS A 57 -89.212 -7.857 -23.271 1.00 0.00 C ATOM 536 ND1 HIS A 57 -89.376 -9.212 -23.088 1.00 0.00 N ATOM 537 CD2 HIS A 57 -89.072 -7.326 -22.033 1.00 0.00 C ATOM 538 CE1 HIS A 57 -89.337 -9.487 -21.798 1.00 0.00 C ATOM 539 NE2 HIS A 57 -89.153 -8.361 -21.136 1.00 0.00 N ATOM 0 H HIS A 57 -90.142 -4.902 -24.406 1.00 0.00 H new ATOM 0 HA HIS A 57 -87.525 -6.029 -24.026 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -90.245 -6.967 -24.892 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -88.862 -7.936 -25.359 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -89.507 -9.896 -23.833 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -88.924 -6.283 -21.796 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -89.439 -10.468 -21.358 1.00 0.00 H new ATOM 548 N MET A 58 -86.523 -5.531 -26.242 1.00 0.00 N ATOM 549 CA MET A 58 -85.864 -5.542 -27.539 1.00 0.00 C ATOM 550 C MET A 58 -85.803 -6.976 -28.058 1.00 0.00 C ATOM 551 O MET A 58 -85.091 -7.825 -27.513 1.00 0.00 O ATOM 552 CB MET A 58 -84.458 -4.924 -27.455 1.00 0.00 C ATOM 553 CG MET A 58 -83.529 -5.614 -26.469 1.00 0.00 C ATOM 554 SD MET A 58 -81.864 -4.921 -26.463 1.00 0.00 S ATOM 555 CE MET A 58 -81.396 -5.150 -28.177 1.00 0.00 C ATOM 0 H MET A 58 -85.914 -5.302 -25.456 1.00 0.00 H new ATOM 0 HA MET A 58 -86.440 -4.933 -28.236 1.00 0.00 H new ATOM 0 HB2 MET A 58 -84.003 -4.951 -28.445 1.00 0.00 H new ATOM 0 HB3 MET A 58 -84.551 -3.875 -27.175 1.00 0.00 H new ATOM 0 HG2 MET A 58 -83.951 -5.538 -25.467 1.00 0.00 H new ATOM 0 HG3 MET A 58 -83.474 -6.675 -26.712 1.00 0.00 H new ATOM 0 HE1 MET A 58 -80.315 -5.271 -28.246 1.00 0.00 H new ATOM 0 HE2 MET A 58 -81.887 -6.039 -28.573 1.00 0.00 H new ATOM 0 HE3 MET A 58 -81.701 -4.279 -28.757 1.00 0.00 H new ATOM 565 N VAL A 59 -86.578 -7.251 -29.094 1.00 0.00 N ATOM 566 CA VAL A 59 -86.696 -8.601 -29.612 1.00 0.00 C ATOM 567 C VAL A 59 -85.691 -8.825 -30.731 1.00 0.00 C ATOM 568 O VAL A 59 -85.006 -7.897 -31.158 1.00 0.00 O ATOM 569 CB VAL A 59 -88.121 -8.896 -30.140 1.00 0.00 C ATOM 570 CG1 VAL A 59 -89.159 -8.719 -29.042 1.00 0.00 C ATOM 571 CG2 VAL A 59 -88.448 -8.013 -31.333 1.00 0.00 C ATOM 0 H VAL A 59 -87.134 -6.556 -29.592 1.00 0.00 H new ATOM 0 HA VAL A 59 -86.491 -9.281 -28.785 1.00 0.00 H new ATOM 0 HB VAL A 59 -88.148 -9.936 -30.465 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -90.151 -8.933 -29.441 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.942 -9.404 -28.222 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -89.129 -7.693 -28.675 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -89.454 -8.238 -31.687 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -88.393 -6.966 -31.036 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.731 -8.201 -32.132 1.00 0.00 H new ATOM 581 N CYS A 60 -85.604 -10.054 -31.206 1.00 0.00 N ATOM 582 CA CYS A 60 -84.717 -10.364 -32.312 1.00 0.00 C ATOM 583 C CYS A 60 -85.506 -10.417 -33.614 1.00 0.00 C ATOM 584 O CYS A 60 -85.054 -10.996 -34.598 1.00 0.00 O ATOM 585 CB CYS A 60 -83.980 -11.681 -32.060 1.00 0.00 C ATOM 586 SG CYS A 60 -84.987 -13.179 -32.237 1.00 0.00 S ATOM 0 H CYS A 60 -86.133 -10.849 -30.846 1.00 0.00 H new ATOM 0 HA CYS A 60 -83.969 -9.576 -32.395 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -83.139 -11.745 -32.750 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -83.565 -11.659 -31.052 1.00 0.00 H new ATOM 591 N SER A 61 -86.696 -9.803 -33.591 1.00 0.00 N ATOM 592 CA SER A 61 -87.571 -9.671 -34.763 1.00 0.00 C ATOM 593 C SER A 61 -88.204 -11.007 -35.178 1.00 0.00 C ATOM 594 O SER A 61 -89.415 -11.085 -35.374 1.00 0.00 O ATOM 595 CB SER A 61 -86.807 -9.045 -35.931 1.00 0.00 C ATOM 596 OG SER A 61 -86.248 -7.796 -35.551 1.00 0.00 O ATOM 0 H SER A 61 -87.083 -9.379 -32.748 1.00 0.00 H new ATOM 0 HA SER A 61 -88.390 -9.010 -34.480 1.00 0.00 H new ATOM 0 HB2 SER A 61 -86.015 -9.719 -36.258 1.00 0.00 H new ATOM 0 HB3 SER A 61 -87.478 -8.906 -36.779 1.00 0.00 H new ATOM 0 HG SER A 61 -85.277 -7.818 -35.683 1.00 0.00 H new ATOM 602 N GLN A 62 -87.395 -12.056 -35.291 1.00 0.00 N ATOM 603 CA GLN A 62 -87.891 -13.354 -35.743 1.00 0.00 C ATOM 604 C GLN A 62 -88.277 -14.249 -34.563 1.00 0.00 C ATOM 605 O GLN A 62 -88.474 -15.455 -34.725 1.00 0.00 O ATOM 606 CB GLN A 62 -86.850 -14.046 -36.638 1.00 0.00 C ATOM 607 CG GLN A 62 -85.548 -14.402 -35.941 1.00 0.00 C ATOM 608 CD GLN A 62 -85.374 -15.895 -35.736 1.00 0.00 C ATOM 609 OE1 GLN A 62 -85.759 -16.449 -34.711 1.00 0.00 O ATOM 610 NE2 GLN A 62 -84.786 -16.556 -36.722 1.00 0.00 N ATOM 0 H GLN A 62 -86.398 -12.035 -35.077 1.00 0.00 H new ATOM 0 HA GLN A 62 -88.793 -13.181 -36.331 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -87.289 -14.957 -37.045 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -86.627 -13.395 -37.483 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -84.712 -14.022 -36.528 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -85.512 -13.901 -34.973 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -84.480 -16.059 -37.558 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -84.639 -17.562 -36.645 1.00 0.00 H new ATOM 619 N SER A 63 -88.410 -13.640 -33.385 1.00 0.00 N ATOM 620 CA SER A 63 -88.827 -14.349 -32.179 1.00 0.00 C ATOM 621 C SER A 63 -90.196 -15.015 -32.384 1.00 0.00 C ATOM 622 O SER A 63 -90.917 -14.677 -33.327 1.00 0.00 O ATOM 623 CB SER A 63 -88.878 -13.368 -31.007 1.00 0.00 C ATOM 624 OG SER A 63 -87.630 -12.709 -30.841 1.00 0.00 O ATOM 0 H SER A 63 -88.232 -12.646 -33.242 1.00 0.00 H new ATOM 0 HA SER A 63 -88.104 -15.134 -31.960 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.663 -12.631 -31.179 1.00 0.00 H new ATOM 0 HB3 SER A 63 -89.136 -13.902 -30.092 1.00 0.00 H new ATOM 0 HG SER A 63 -86.946 -13.164 -31.376 1.00 0.00 H new ATOM 630 N TRP A 64 -90.541 -15.948 -31.495 1.00 0.00 N ATOM 631 CA TRP A 64 -91.790 -16.706 -31.575 1.00 0.00 C ATOM 632 C TRP A 64 -91.753 -17.691 -32.738 1.00 0.00 C ATOM 633 O TRP A 64 -91.507 -18.881 -32.537 1.00 0.00 O ATOM 634 CB TRP A 64 -93.022 -15.785 -31.672 1.00 0.00 C ATOM 635 CG TRP A 64 -93.305 -15.020 -30.410 1.00 0.00 C ATOM 636 CD1 TRP A 64 -94.042 -15.447 -29.341 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.856 -13.698 -30.083 1.00 0.00 C ATOM 638 NE1 TRP A 64 -94.074 -14.474 -28.371 1.00 0.00 N ATOM 639 CE2 TRP A 64 -93.352 -13.394 -28.801 1.00 0.00 C ATOM 640 CE3 TRP A 64 -92.080 -12.744 -30.746 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -93.093 -12.176 -28.174 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.823 -11.539 -30.121 1.00 0.00 C ATOM 643 CH2 TRP A 64 -92.327 -11.266 -28.846 1.00 0.00 C ATOM 0 H TRP A 64 -89.959 -16.200 -30.696 1.00 0.00 H new ATOM 0 HA TRP A 64 -91.884 -17.271 -30.647 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -92.873 -15.079 -32.489 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -93.895 -16.386 -31.925 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.528 -16.409 -29.269 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.558 -14.545 -27.476 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.687 -12.945 -31.732 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -93.484 -11.959 -27.191 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -91.223 -10.796 -30.626 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -92.106 -10.316 -28.383 1.00 0.00 H new ATOM 654 N GLY A 65 -91.959 -17.199 -33.949 1.00 0.00 N ATOM 655 CA GLY A 65 -91.988 -18.077 -35.098 1.00 0.00 C ATOM 656 C GLY A 65 -92.014 -17.330 -36.412 1.00 0.00 C ATOM 657 O GLY A 65 -92.951 -17.474 -37.195 1.00 0.00 O ATOM 0 H GLY A 65 -92.106 -16.211 -34.156 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -91.114 -18.727 -35.073 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -92.866 -18.720 -35.035 1.00 0.00 H new ATOM 661 N ARG A 66 -90.995 -16.523 -36.659 1.00 0.00 N ATOM 662 CA ARG A 66 -90.882 -15.828 -37.933 1.00 0.00 C ATOM 663 C ARG A 66 -89.846 -16.499 -38.819 1.00 0.00 C ATOM 664 O ARG A 66 -89.082 -17.357 -38.362 1.00 0.00 O ATOM 665 CB ARG A 66 -90.535 -14.356 -37.720 1.00 0.00 C ATOM 666 CG ARG A 66 -91.715 -13.530 -37.238 1.00 0.00 C ATOM 667 CD ARG A 66 -92.850 -13.564 -38.250 1.00 0.00 C ATOM 668 NE ARG A 66 -94.049 -12.892 -37.758 1.00 0.00 N ATOM 669 CZ ARG A 66 -95.195 -12.817 -38.437 1.00 0.00 C ATOM 670 NH1 ARG A 66 -95.290 -13.319 -39.664 1.00 0.00 N ATOM 671 NH2 ARG A 66 -96.242 -12.221 -37.888 1.00 0.00 N ATOM 0 H ARG A 66 -90.239 -16.333 -36.001 1.00 0.00 H new ATOM 0 HA ARG A 66 -91.848 -15.880 -38.435 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -89.726 -14.281 -36.994 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -90.164 -13.937 -38.655 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -92.065 -13.913 -36.280 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -91.400 -12.500 -37.073 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -92.524 -13.089 -39.175 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -93.089 -14.600 -38.490 1.00 0.00 H new ATOM 0 HE ARG A 66 -94.008 -12.453 -36.838 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -94.482 -13.767 -40.096 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -96.171 -13.256 -40.174 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -96.169 -11.823 -36.952 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -97.121 -12.160 -38.401 1.00 0.00 H new ATOM 685 N SER A 67 -89.822 -16.116 -40.083 1.00 0.00 N ATOM 686 CA SER A 67 -88.944 -16.748 -41.046 1.00 0.00 C ATOM 687 C SER A 67 -87.554 -16.112 -41.023 1.00 0.00 C ATOM 688 O SER A 67 -87.383 -14.973 -40.584 1.00 0.00 O ATOM 689 CB SER A 67 -89.550 -16.645 -42.451 1.00 0.00 C ATOM 690 OG SER A 67 -88.821 -17.424 -43.387 1.00 0.00 O ATOM 0 H SER A 67 -90.402 -15.369 -40.465 1.00 0.00 H new ATOM 0 HA SER A 67 -88.839 -17.799 -40.776 1.00 0.00 H new ATOM 0 HB2 SER A 67 -90.587 -16.979 -42.427 1.00 0.00 H new ATOM 0 HB3 SER A 67 -89.558 -15.603 -42.770 1.00 0.00 H new ATOM 0 HG SER A 67 -89.382 -17.604 -44.170 1.00 0.00 H new ATOM 696 N SER A 68 -86.563 -16.868 -41.476 1.00 0.00 N ATOM 697 CA SER A 68 -85.214 -16.354 -41.647 1.00 0.00 C ATOM 698 C SER A 68 -85.062 -15.772 -43.048 1.00 0.00 C ATOM 699 O SER A 68 -84.026 -15.201 -43.404 1.00 0.00 O ATOM 700 CB SER A 68 -84.207 -17.483 -41.416 1.00 0.00 C ATOM 701 OG SER A 68 -84.615 -18.670 -42.081 1.00 0.00 O ATOM 0 H SER A 68 -86.672 -17.849 -41.734 1.00 0.00 H new ATOM 0 HA SER A 68 -85.024 -15.563 -40.922 1.00 0.00 H new ATOM 0 HB2 SER A 68 -83.224 -17.179 -41.777 1.00 0.00 H new ATOM 0 HB3 SER A 68 -84.109 -17.675 -40.348 1.00 0.00 H new ATOM 0 HG SER A 68 -83.956 -19.378 -41.921 1.00 0.00 H new ATOM 707 N LYS A 69 -86.125 -15.919 -43.827 1.00 0.00 N ATOM 708 CA LYS A 69 -86.176 -15.438 -45.194 1.00 0.00 C ATOM 709 C LYS A 69 -86.658 -13.992 -45.235 1.00 0.00 C ATOM 710 O LYS A 69 -87.592 -13.619 -44.525 1.00 0.00 O ATOM 711 CB LYS A 69 -87.112 -16.335 -46.007 1.00 0.00 C ATOM 712 CG LYS A 69 -87.394 -15.844 -47.416 1.00 0.00 C ATOM 713 CD LYS A 69 -88.344 -16.784 -48.138 1.00 0.00 C ATOM 714 CE LYS A 69 -89.678 -16.911 -47.411 1.00 0.00 C ATOM 715 NZ LYS A 69 -90.495 -15.673 -47.517 1.00 0.00 N ATOM 0 H LYS A 69 -86.982 -16.380 -43.522 1.00 0.00 H new ATOM 0 HA LYS A 69 -85.175 -15.472 -45.625 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -86.678 -17.333 -46.065 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -88.058 -16.429 -45.473 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -87.825 -14.844 -47.377 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -86.460 -15.767 -47.972 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -88.516 -16.420 -49.151 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -87.884 -17.768 -48.227 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -90.237 -17.750 -47.825 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -89.497 -17.136 -46.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -91.486 -15.890 -47.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -90.134 -14.961 -46.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -90.437 -15.301 -48.487 1.00 0.00 H new ATOM 729 N GLN A 70 -86.013 -13.187 -46.063 1.00 0.00 N ATOM 730 CA GLN A 70 -86.374 -11.789 -46.205 1.00 0.00 C ATOM 731 C GLN A 70 -87.644 -11.654 -47.045 1.00 0.00 C ATOM 732 O GLN A 70 -87.773 -12.299 -48.087 1.00 0.00 O ATOM 733 CB GLN A 70 -85.216 -11.021 -46.844 1.00 0.00 C ATOM 734 CG GLN A 70 -85.439 -9.521 -46.934 1.00 0.00 C ATOM 735 CD GLN A 70 -84.227 -8.782 -47.465 1.00 0.00 C ATOM 736 OE1 GLN A 70 -84.352 -7.747 -48.119 1.00 0.00 O ATOM 737 NE2 GLN A 70 -83.041 -9.305 -47.183 1.00 0.00 N ATOM 0 H GLN A 70 -85.232 -13.481 -46.650 1.00 0.00 H new ATOM 0 HA GLN A 70 -86.572 -11.366 -45.220 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -84.309 -11.208 -46.269 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -85.044 -11.412 -47.847 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -86.293 -9.323 -47.581 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -85.691 -9.135 -45.946 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -82.979 -10.165 -46.638 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -82.191 -8.847 -47.511 1.00 0.00 H new ATOM 746 N TRP A 71 -88.576 -10.832 -46.562 1.00 0.00 N ATOM 747 CA TRP A 71 -89.853 -10.573 -47.246 1.00 0.00 C ATOM 748 C TRP A 71 -90.798 -11.777 -47.204 1.00 0.00 C ATOM 749 O TRP A 71 -90.417 -12.873 -46.787 1.00 0.00 O ATOM 750 CB TRP A 71 -89.639 -10.147 -48.705 1.00 0.00 C ATOM 751 CG TRP A 71 -89.160 -8.738 -48.870 1.00 0.00 C ATOM 752 CD1 TRP A 71 -87.867 -8.314 -48.983 1.00 0.00 C ATOM 753 CD2 TRP A 71 -89.977 -7.568 -48.962 1.00 0.00 C ATOM 754 NE1 TRP A 71 -87.832 -6.951 -49.134 1.00 0.00 N ATOM 755 CE2 TRP A 71 -89.115 -6.469 -49.125 1.00 0.00 C ATOM 756 CE3 TRP A 71 -91.356 -7.342 -48.921 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -89.587 -5.166 -49.247 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -91.823 -6.048 -49.043 1.00 0.00 C ATOM 759 CH2 TRP A 71 -90.941 -4.975 -49.205 1.00 0.00 C ATOM 0 H TRP A 71 -88.471 -10.324 -45.684 1.00 0.00 H new ATOM 0 HA TRP A 71 -90.319 -9.754 -46.698 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -88.917 -10.821 -49.166 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -90.577 -10.266 -49.248 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -87.000 -8.957 -48.957 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -86.988 -6.388 -49.236 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -92.044 -8.165 -48.796 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -88.909 -4.335 -49.370 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -92.886 -5.862 -49.013 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -91.337 -3.975 -49.299 1.00 0.00 H new ATOM 770 N GLU A 72 -92.037 -11.543 -47.648 1.00 0.00 N ATOM 771 CA GLU A 72 -93.082 -12.570 -47.698 1.00 0.00 C ATOM 772 C GLU A 72 -93.268 -13.230 -46.329 1.00 0.00 C ATOM 773 O GLU A 72 -93.053 -14.435 -46.169 1.00 0.00 O ATOM 774 CB GLU A 72 -92.755 -13.612 -48.772 1.00 0.00 C ATOM 775 CG GLU A 72 -92.460 -13.008 -50.141 1.00 0.00 C ATOM 776 CD GLU A 72 -93.643 -12.274 -50.744 1.00 0.00 C ATOM 777 OE1 GLU A 72 -93.887 -11.110 -50.366 1.00 0.00 O ATOM 778 OE2 GLU A 72 -94.331 -12.856 -51.608 1.00 0.00 O ATOM 0 H GLU A 72 -92.345 -10.631 -47.985 1.00 0.00 H new ATOM 0 HA GLU A 72 -94.024 -12.089 -47.964 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -91.893 -14.196 -48.449 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -93.593 -14.303 -48.862 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -91.621 -12.318 -50.052 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -92.150 -13.802 -50.821 1.00 0.00 H new ATOM 785 N ASP A 73 -93.653 -12.403 -45.358 1.00 0.00 N ATOM 786 CA ASP A 73 -93.848 -12.812 -43.957 1.00 0.00 C ATOM 787 C ASP A 73 -94.159 -11.575 -43.103 1.00 0.00 C ATOM 788 O ASP A 73 -95.080 -11.604 -42.287 1.00 0.00 O ATOM 789 CB ASP A 73 -92.612 -13.552 -43.407 1.00 0.00 C ATOM 790 CG ASP A 73 -92.819 -14.127 -42.013 1.00 0.00 C ATOM 791 OD1 ASP A 73 -93.956 -14.531 -41.686 1.00 0.00 O ATOM 792 OD2 ASP A 73 -91.839 -14.199 -41.240 1.00 0.00 O ATOM 0 H ASP A 73 -93.843 -11.414 -45.519 1.00 0.00 H new ATOM 0 HA ASP A 73 -94.688 -13.505 -43.913 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -92.349 -14.360 -44.089 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -91.766 -12.865 -43.386 1.00 0.00 H new ATOM 797 N PRO A 74 -93.371 -10.480 -43.268 1.00 0.00 N ATOM 798 CA PRO A 74 -93.655 -9.166 -42.680 1.00 0.00 C ATOM 799 C PRO A 74 -95.132 -8.773 -42.679 1.00 0.00 C ATOM 800 O PRO A 74 -95.652 -8.297 -43.691 1.00 0.00 O ATOM 801 CB PRO A 74 -92.896 -8.244 -43.605 1.00 0.00 C ATOM 802 CG PRO A 74 -91.670 -9.004 -43.901 1.00 0.00 C ATOM 803 CD PRO A 74 -92.077 -10.447 -43.974 1.00 0.00 C ATOM 0 HA PRO A 74 -93.374 -9.137 -41.627 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -93.463 -8.025 -44.510 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -92.673 -7.289 -43.129 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -91.227 -8.677 -44.842 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -90.920 -8.850 -43.125 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -92.175 -10.784 -45.006 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -91.343 -11.095 -43.495 1.00 0.00 H new ATOM 811 N SER A 75 -95.809 -9.002 -41.565 1.00 0.00 N ATOM 812 CA SER A 75 -97.185 -8.597 -41.404 1.00 0.00 C ATOM 813 C SER A 75 -97.537 -8.493 -39.923 1.00 0.00 C ATOM 814 O SER A 75 -96.737 -8.817 -39.047 1.00 0.00 O ATOM 815 CB SER A 75 -98.124 -9.602 -42.085 1.00 0.00 C ATOM 816 OG SER A 75 -97.862 -9.691 -43.475 1.00 0.00 O ATOM 0 H SER A 75 -95.415 -9.474 -40.751 1.00 0.00 H new ATOM 0 HA SER A 75 -97.310 -7.620 -41.872 1.00 0.00 H new ATOM 0 HB2 SER A 75 -98.004 -10.584 -41.627 1.00 0.00 H new ATOM 0 HB3 SER A 75 -99.159 -9.301 -41.926 1.00 0.00 H new ATOM 0 HG SER A 75 -97.311 -8.930 -43.753 1.00 0.00 H new ATOM 822 N GLN A 76 -98.726 -7.978 -39.684 1.00 0.00 N ATOM 823 CA GLN A 76 -99.398 -8.028 -38.385 1.00 0.00 C ATOM 824 C GLN A 76 -98.788 -7.100 -37.327 1.00 0.00 C ATOM 825 O GLN A 76 -99.277 -7.041 -36.202 1.00 0.00 O ATOM 826 CB GLN A 76 -99.450 -9.471 -37.894 1.00 0.00 C ATOM 827 CG GLN A 76 -100.342 -10.355 -38.757 1.00 0.00 C ATOM 828 CD GLN A 76 -100.042 -11.830 -38.599 1.00 0.00 C ATOM 829 OE1 GLN A 76 -98.904 -12.218 -38.340 1.00 0.00 O ATOM 830 NE2 GLN A 76 -101.054 -12.664 -38.763 1.00 0.00 N ATOM 0 H GLN A 76 -99.272 -7.499 -40.400 1.00 0.00 H new ATOM 0 HA GLN A 76 -100.409 -7.651 -38.537 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -98.441 -9.883 -37.882 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -99.814 -9.488 -36.867 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -101.385 -10.172 -38.498 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -100.219 -10.075 -39.803 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -101.983 -12.302 -38.977 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -100.906 -13.669 -38.676 1.00 0.00 H new ATOM 839 N ALA A 77 -97.731 -6.378 -37.679 1.00 0.00 N ATOM 840 CA ALA A 77 -97.212 -5.315 -36.812 1.00 0.00 C ATOM 841 C ALA A 77 -97.645 -3.951 -37.344 1.00 0.00 C ATOM 842 O ALA A 77 -97.120 -2.901 -36.951 1.00 0.00 O ATOM 843 CB ALA A 77 -95.695 -5.389 -36.706 1.00 0.00 C ATOM 0 H ALA A 77 -97.216 -6.504 -38.551 1.00 0.00 H new ATOM 0 HA ALA A 77 -97.624 -5.453 -35.812 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -95.336 -4.590 -36.058 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -95.406 -6.353 -36.288 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.255 -5.277 -37.697 1.00 0.00 H new ATOM 849 N SER A 78 -98.628 -3.981 -38.235 1.00 0.00 N ATOM 850 CA SER A 78 -99.114 -2.781 -38.896 1.00 0.00 C ATOM 851 C SER A 78 -99.581 -1.761 -37.866 1.00 0.00 C ATOM 852 O SER A 78 -99.390 -0.557 -38.039 1.00 0.00 O ATOM 853 CB SER A 78 -100.258 -3.147 -39.844 1.00 0.00 C ATOM 854 OG SER A 78 -100.682 -2.033 -40.603 1.00 0.00 O ATOM 0 H SER A 78 -99.108 -4.836 -38.518 1.00 0.00 H new ATOM 0 HA SER A 78 -98.303 -2.336 -39.472 1.00 0.00 H new ATOM 0 HB2 SER A 78 -99.935 -3.943 -40.515 1.00 0.00 H new ATOM 0 HB3 SER A 78 -101.098 -3.537 -39.268 1.00 0.00 H new ATOM 0 HG SER A 78 -101.412 -2.302 -41.199 1.00 0.00 H new ATOM 860 N LYS A 79 -100.167 -2.264 -36.786 1.00 0.00 N ATOM 861 CA LYS A 79 -100.658 -1.423 -35.707 1.00 0.00 C ATOM 862 C LYS A 79 -99.539 -0.581 -35.093 1.00 0.00 C ATOM 863 O LYS A 79 -99.685 0.630 -34.934 1.00 0.00 O ATOM 864 CB LYS A 79 -101.314 -2.288 -34.624 1.00 0.00 C ATOM 865 CG LYS A 79 -101.812 -1.504 -33.418 1.00 0.00 C ATOM 866 CD LYS A 79 -102.895 -0.507 -33.799 1.00 0.00 C ATOM 867 CE LYS A 79 -104.168 -1.200 -34.257 1.00 0.00 C ATOM 868 NZ LYS A 79 -105.216 -0.223 -34.651 1.00 0.00 N ATOM 0 H LYS A 79 -100.314 -3.262 -36.636 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.397 -0.741 -36.128 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -102.152 -2.828 -35.064 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -100.596 -3.035 -34.287 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -102.201 -2.195 -32.671 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -100.977 -0.975 -32.958 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -103.117 0.132 -32.944 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -102.528 0.141 -34.595 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -103.943 -1.852 -35.101 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -104.545 -1.834 -33.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -106.069 -0.733 -34.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -105.448 0.383 -33.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -104.865 0.366 -35.433 1.00 0.00 H new ATOM 882 N VAL A 80 -98.416 -1.215 -34.775 1.00 0.00 N ATOM 883 CA VAL A 80 -97.371 -0.552 -34.022 1.00 0.00 C ATOM 884 C VAL A 80 -96.676 0.534 -34.842 1.00 0.00 C ATOM 885 O VAL A 80 -96.480 1.651 -34.358 1.00 0.00 O ATOM 886 CB VAL A 80 -96.350 -1.566 -33.458 1.00 0.00 C ATOM 887 CG1 VAL A 80 -97.061 -2.589 -32.590 1.00 0.00 C ATOM 888 CG2 VAL A 80 -95.554 -2.258 -34.554 1.00 0.00 C ATOM 0 H VAL A 80 -98.211 -2.182 -35.028 1.00 0.00 H new ATOM 0 HA VAL A 80 -97.852 -0.060 -33.177 1.00 0.00 H new ATOM 0 HB VAL A 80 -95.636 -1.009 -32.852 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -96.335 -3.300 -32.196 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -97.558 -2.082 -31.763 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -97.802 -3.121 -33.187 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -94.851 -2.960 -34.105 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -96.235 -2.797 -35.213 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -95.005 -1.513 -35.130 1.00 0.00 H new ATOM 898 N CYS A 81 -96.344 0.244 -36.094 1.00 0.00 N ATOM 899 CA CYS A 81 -95.681 1.247 -36.919 1.00 0.00 C ATOM 900 C CYS A 81 -96.673 2.273 -37.443 1.00 0.00 C ATOM 901 O CYS A 81 -96.283 3.375 -37.802 1.00 0.00 O ATOM 902 CB CYS A 81 -94.860 0.604 -38.035 1.00 0.00 C ATOM 903 SG CYS A 81 -93.421 -0.298 -37.381 1.00 0.00 S ATOM 0 H CYS A 81 -96.517 -0.651 -36.551 1.00 0.00 H new ATOM 0 HA CYS A 81 -94.975 1.785 -36.287 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.491 -0.080 -38.602 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.522 1.375 -38.728 1.00 0.00 H new ATOM 908 N GLN A 82 -97.959 1.941 -37.442 1.00 0.00 N ATOM 909 CA GLN A 82 -98.983 2.946 -37.714 1.00 0.00 C ATOM 910 C GLN A 82 -98.933 4.024 -36.635 1.00 0.00 C ATOM 911 O GLN A 82 -99.045 5.219 -36.921 1.00 0.00 O ATOM 912 CB GLN A 82 -100.379 2.314 -37.763 1.00 0.00 C ATOM 913 CG GLN A 82 -101.513 3.328 -37.861 1.00 0.00 C ATOM 914 CD GLN A 82 -101.459 4.182 -39.119 1.00 0.00 C ATOM 915 OE1 GLN A 82 -101.852 5.350 -39.103 1.00 0.00 O ATOM 916 NE2 GLN A 82 -101.008 3.605 -40.220 1.00 0.00 N ATOM 0 H GLN A 82 -98.314 1.002 -37.260 1.00 0.00 H new ATOM 0 HA GLN A 82 -98.783 3.392 -38.688 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.432 1.640 -38.618 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.524 1.707 -36.869 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -102.466 2.799 -37.831 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -101.483 3.980 -36.988 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -100.691 2.636 -40.195 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -100.977 4.129 -41.095 1.00 0.00 H new ATOM 925 N ARG A 83 -98.734 3.591 -35.395 1.00 0.00 N ATOM 926 CA ARG A 83 -98.607 4.510 -34.272 1.00 0.00 C ATOM 927 C ARG A 83 -97.250 5.209 -34.318 1.00 0.00 C ATOM 928 O ARG A 83 -97.057 6.258 -33.707 1.00 0.00 O ATOM 929 CB ARG A 83 -98.777 3.762 -32.947 1.00 0.00 C ATOM 930 CG ARG A 83 -100.025 2.894 -32.898 1.00 0.00 C ATOM 931 CD ARG A 83 -100.163 2.173 -31.565 1.00 0.00 C ATOM 932 NE ARG A 83 -100.667 3.052 -30.507 1.00 0.00 N ATOM 933 CZ ARG A 83 -100.786 2.693 -29.225 1.00 0.00 C ATOM 934 NH1 ARG A 83 -100.385 1.493 -28.820 1.00 0.00 N ATOM 935 NH2 ARG A 83 -101.300 3.546 -28.348 1.00 0.00 N ATOM 0 H ARG A 83 -98.657 2.606 -35.143 1.00 0.00 H new ATOM 0 HA ARG A 83 -99.392 5.263 -34.345 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -97.901 3.136 -32.777 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -98.814 4.485 -32.132 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -100.905 3.514 -33.068 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -99.990 2.162 -33.705 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -100.837 1.325 -31.681 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -99.194 1.771 -31.270 1.00 0.00 H new ATOM 0 HE ARG A 83 -100.945 3.999 -30.765 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -99.982 0.837 -29.489 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -100.480 1.228 -27.840 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -101.602 4.471 -28.653 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -101.393 3.277 -27.369 1.00 0.00 H new ATOM 949 N LEU A 84 -96.314 4.617 -35.058 1.00 0.00 N ATOM 950 CA LEU A 84 -94.991 5.208 -35.255 1.00 0.00 C ATOM 951 C LEU A 84 -94.947 6.034 -36.538 1.00 0.00 C ATOM 952 O LEU A 84 -93.869 6.408 -36.987 1.00 0.00 O ATOM 953 CB LEU A 84 -93.923 4.117 -35.338 1.00 0.00 C ATOM 954 CG LEU A 84 -93.743 3.264 -34.087 1.00 0.00 C ATOM 955 CD1 LEU A 84 -92.733 2.163 -34.357 1.00 0.00 C ATOM 956 CD2 LEU A 84 -93.295 4.121 -32.912 1.00 0.00 C ATOM 0 H LEU A 84 -96.448 3.724 -35.533 1.00 0.00 H new ATOM 0 HA LEU A 84 -94.792 5.856 -34.401 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -94.168 3.458 -36.171 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -92.968 4.587 -35.574 1.00 0.00 H new ATOM 0 HG LEU A 84 -94.701 2.812 -33.830 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -92.608 1.556 -33.460 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -93.089 1.535 -35.173 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -91.776 2.607 -34.631 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -93.172 3.493 -32.030 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -92.345 4.599 -33.152 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -94.046 4.885 -32.712 1.00 0.00 H new ATOM 968 N ASN A 85 -96.126 6.273 -37.123 1.00 0.00 N ATOM 969 CA ASN A 85 -96.293 7.035 -38.380 1.00 0.00 C ATOM 970 C ASN A 85 -95.447 6.469 -39.530 1.00 0.00 C ATOM 971 O ASN A 85 -95.206 7.140 -40.533 1.00 0.00 O ATOM 972 CB ASN A 85 -96.043 8.556 -38.171 1.00 0.00 C ATOM 973 CG ASN A 85 -94.582 8.992 -38.028 1.00 0.00 C ATOM 974 OD1 ASN A 85 -93.673 8.478 -38.678 1.00 0.00 O ATOM 975 ND2 ASN A 85 -94.351 9.960 -37.155 1.00 0.00 N ATOM 0 H ASN A 85 -97.009 5.940 -36.736 1.00 0.00 H new ATOM 0 HA ASN A 85 -97.335 6.916 -38.677 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -96.479 9.093 -39.013 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -96.583 8.872 -37.278 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -93.400 10.298 -37.008 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -95.124 10.368 -36.630 1.00 0.00 H new ATOM 982 N CYS A 86 -95.062 5.206 -39.408 1.00 0.00 N ATOM 983 CA CYS A 86 -94.220 4.553 -40.401 1.00 0.00 C ATOM 984 C CYS A 86 -94.992 3.482 -41.171 1.00 0.00 C ATOM 985 O CYS A 86 -94.404 2.548 -41.708 1.00 0.00 O ATOM 986 CB CYS A 86 -92.981 3.962 -39.723 1.00 0.00 C ATOM 987 SG CYS A 86 -91.795 5.219 -39.168 1.00 0.00 S ATOM 0 H CYS A 86 -95.322 4.608 -38.623 1.00 0.00 H new ATOM 0 HA CYS A 86 -93.899 5.300 -41.127 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -93.294 3.365 -38.866 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -92.484 3.285 -40.418 1.00 0.00 H new ATOM 992 N GLY A 87 -96.313 3.622 -41.203 1.00 0.00 N ATOM 993 CA GLY A 87 -97.142 2.836 -42.107 1.00 0.00 C ATOM 994 C GLY A 87 -97.186 1.343 -41.812 1.00 0.00 C ATOM 995 O GLY A 87 -97.471 0.925 -40.687 1.00 0.00 O ATOM 0 H GLY A 87 -96.832 4.273 -40.613 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -98.159 3.227 -42.074 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -96.778 2.979 -43.125 1.00 0.00 H new ATOM 999 N ASP A 88 -96.890 0.548 -42.841 1.00 0.00 N ATOM 1000 CA ASP A 88 -97.079 -0.905 -42.806 1.00 0.00 C ATOM 1001 C ASP A 88 -95.955 -1.599 -42.043 1.00 0.00 C ATOM 1002 O ASP A 88 -94.930 -0.987 -41.753 1.00 0.00 O ATOM 1003 CB ASP A 88 -97.195 -1.451 -44.234 1.00 0.00 C ATOM 1004 CG ASP A 88 -98.563 -1.183 -44.832 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -99.489 -1.991 -44.595 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -98.729 -0.157 -45.528 1.00 0.00 O ATOM 0 H ASP A 88 -96.512 0.892 -43.724 1.00 0.00 H new ATOM 0 HA ASP A 88 -98.006 -1.116 -42.272 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -96.429 -0.994 -44.861 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -97.005 -2.524 -44.229 1.00 0.00 H new ATOM 1011 N PRO A 89 -96.143 -2.878 -41.670 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.234 -3.563 -40.766 1.00 0.00 C ATOM 1013 C PRO A 89 -94.010 -4.215 -41.381 1.00 0.00 C ATOM 1014 O PRO A 89 -94.025 -5.384 -41.763 1.00 0.00 O ATOM 1015 CB PRO A 89 -96.093 -4.618 -40.151 1.00 0.00 C ATOM 1016 CG PRO A 89 -97.021 -5.009 -41.245 1.00 0.00 C ATOM 1017 CD PRO A 89 -97.275 -3.749 -42.042 1.00 0.00 C ATOM 0 HA PRO A 89 -94.799 -2.829 -40.087 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.500 -5.466 -39.808 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.635 -4.237 -39.285 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -96.582 -5.786 -41.871 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.951 -5.411 -40.843 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -97.294 -3.948 -43.114 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -98.233 -3.296 -41.784 1.00 0.00 H new ATOM 1025 N LEU A 90 -93.009 -3.389 -41.517 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.602 -3.766 -41.446 1.00 0.00 C ATOM 1027 C LEU A 90 -91.209 -5.003 -42.240 1.00 0.00 C ATOM 1028 O LEU A 90 -91.565 -6.126 -41.897 1.00 0.00 O ATOM 1029 CB LEU A 90 -91.118 -3.961 -39.995 1.00 0.00 C ATOM 1030 CG LEU A 90 -91.587 -2.959 -38.902 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -93.066 -3.050 -38.610 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -90.828 -3.162 -37.604 1.00 0.00 C ATOM 0 H LEU A 90 -93.144 -2.392 -41.688 1.00 0.00 H new ATOM 0 HA LEU A 90 -91.110 -2.912 -41.911 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -91.421 -4.959 -39.678 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.028 -3.948 -40.007 1.00 0.00 H new ATOM 0 HG LEU A 90 -91.378 -1.970 -39.310 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.330 -2.326 -37.839 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.630 -2.836 -39.518 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -93.307 -4.054 -38.262 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -91.180 -2.446 -36.861 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.996 -4.175 -37.239 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -89.763 -3.011 -37.778 1.00 0.00 H new ATOM 1044 N SER A 91 -90.402 -4.788 -43.262 1.00 0.00 N ATOM 1045 CA SER A 91 -89.770 -5.887 -43.963 1.00 0.00 C ATOM 1046 C SER A 91 -88.842 -6.636 -43.006 1.00 0.00 C ATOM 1047 O SER A 91 -88.069 -6.022 -42.265 1.00 0.00 O ATOM 1048 CB SER A 91 -88.996 -5.365 -45.170 1.00 0.00 C ATOM 1049 OG SER A 91 -89.851 -4.629 -46.025 1.00 0.00 O ATOM 0 H SER A 91 -90.170 -3.863 -43.624 1.00 0.00 H new ATOM 0 HA SER A 91 -90.534 -6.576 -44.322 1.00 0.00 H new ATOM 0 HB2 SER A 91 -88.173 -4.733 -44.836 1.00 0.00 H new ATOM 0 HB3 SER A 91 -88.556 -6.199 -45.716 1.00 0.00 H new ATOM 0 HG SER A 91 -89.708 -4.912 -46.952 1.00 0.00 H new ATOM 1055 N LEU A 92 -88.955 -7.955 -43.011 1.00 0.00 N ATOM 1056 CA LEU A 92 -88.201 -8.810 -42.109 1.00 0.00 C ATOM 1057 C LEU A 92 -86.911 -9.274 -42.766 1.00 0.00 C ATOM 1058 O LEU A 92 -86.908 -9.661 -43.937 1.00 0.00 O ATOM 1059 CB LEU A 92 -89.052 -10.024 -41.717 1.00 0.00 C ATOM 1060 CG LEU A 92 -89.370 -10.158 -40.228 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -90.294 -11.341 -39.993 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -88.094 -10.311 -39.412 1.00 0.00 C ATOM 0 H LEU A 92 -89.574 -8.464 -43.642 1.00 0.00 H new ATOM 0 HA LEU A 92 -87.949 -8.240 -41.215 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -89.992 -9.979 -42.268 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -88.535 -10.927 -42.042 1.00 0.00 H new ATOM 0 HG LEU A 92 -89.874 -9.248 -39.902 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -90.513 -11.426 -38.929 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -91.223 -11.192 -40.544 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -89.810 -12.255 -40.338 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -88.347 -10.405 -38.356 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -87.559 -11.203 -39.737 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -87.462 -9.435 -39.558 1.00 0.00 H new ATOM 1074 N GLY A 93 -85.824 -9.214 -42.017 1.00 0.00 N ATOM 1075 CA GLY A 93 -84.541 -9.669 -42.518 1.00 0.00 C ATOM 1076 C GLY A 93 -83.411 -9.108 -41.691 1.00 0.00 C ATOM 1077 O GLY A 93 -83.589 -8.070 -41.061 1.00 0.00 O ATOM 0 H GLY A 93 -85.805 -8.856 -41.062 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -84.504 -10.758 -42.500 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.423 -9.363 -43.558 1.00 0.00 H new ATOM 1081 N PRO A 94 -82.236 -9.762 -41.663 1.00 0.00 N ATOM 1082 CA PRO A 94 -81.112 -9.316 -40.834 1.00 0.00 C ATOM 1083 C PRO A 94 -80.703 -7.887 -41.176 1.00 0.00 C ATOM 1084 O PRO A 94 -80.323 -7.588 -42.309 1.00 0.00 O ATOM 1085 CB PRO A 94 -79.994 -10.319 -41.152 1.00 0.00 C ATOM 1086 CG PRO A 94 -80.392 -10.938 -42.450 1.00 0.00 C ATOM 1087 CD PRO A 94 -81.895 -10.956 -42.453 1.00 0.00 C ATOM 0 HA PRO A 94 -81.357 -9.294 -39.772 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -79.027 -9.821 -41.231 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -79.902 -11.070 -40.368 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -80.006 -10.363 -43.292 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -79.989 -11.947 -42.542 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -82.298 -10.901 -43.464 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -82.290 -11.866 -42.002 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.811 -7.007 -40.191 1.00 0.00 N ATOM 1096 CA PHE A 95 -80.634 -5.583 -40.416 1.00 0.00 C ATOM 1097 C PHE A 95 -79.159 -5.225 -40.528 1.00 0.00 C ATOM 1098 O PHE A 95 -78.677 -4.916 -41.620 1.00 0.00 O ATOM 1099 CB PHE A 95 -81.306 -4.779 -39.297 1.00 0.00 C ATOM 1100 CG PHE A 95 -81.335 -3.297 -39.552 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -82.332 -2.741 -40.339 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -80.370 -2.463 -39.011 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -82.366 -1.382 -40.580 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -80.400 -1.104 -39.249 1.00 0.00 C ATOM 1105 CZ PHE A 95 -81.397 -0.562 -40.036 1.00 0.00 C ATOM 0 H PHE A 95 -81.021 -7.257 -39.225 1.00 0.00 H new ATOM 0 HA PHE A 95 -81.111 -5.326 -41.362 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -82.327 -5.137 -39.168 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -80.781 -4.968 -38.360 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -83.091 -3.378 -40.768 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -79.586 -2.881 -38.397 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -83.149 -0.961 -41.193 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -79.643 -0.464 -38.820 1.00 0.00 H new ATOM 0 HZ PHE A 95 -81.419 0.501 -40.226 1.00 0.00 H new ATOM 1115 N LEU A 96 -78.443 -5.280 -39.408 1.00 0.00 N ATOM 1116 CA LEU A 96 -77.033 -4.906 -39.396 1.00 0.00 C ATOM 1117 C LEU A 96 -76.411 -5.113 -38.019 1.00 0.00 C ATOM 1118 O LEU A 96 -75.456 -5.873 -37.870 1.00 0.00 O ATOM 1119 CB LEU A 96 -76.867 -3.441 -39.814 1.00 0.00 C ATOM 1120 CG LEU A 96 -75.425 -2.943 -39.915 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -74.647 -3.754 -40.941 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -75.405 -1.465 -40.272 1.00 0.00 C ATOM 0 H LEU A 96 -78.812 -5.577 -38.505 1.00 0.00 H new ATOM 0 HA LEU A 96 -76.518 -5.551 -40.108 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -77.350 -3.301 -40.781 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -77.400 -2.815 -39.098 1.00 0.00 H new ATOM 0 HG LEU A 96 -74.944 -3.073 -38.946 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -73.623 -3.383 -40.997 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -74.637 -4.803 -40.644 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -75.122 -3.657 -41.917 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -74.373 -1.121 -40.341 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -75.902 -1.315 -41.230 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -75.925 -0.897 -39.501 1.00 0.00 H new ATOM 1134 N LYS A 97 -76.951 -4.433 -37.015 1.00 0.00 N ATOM 1135 CA LYS A 97 -76.355 -4.448 -35.685 1.00 0.00 C ATOM 1136 C LYS A 97 -76.711 -5.723 -34.936 1.00 0.00 C ATOM 1137 O LYS A 97 -77.843 -6.206 -34.994 1.00 0.00 O ATOM 1138 CB LYS A 97 -76.796 -3.229 -34.870 1.00 0.00 C ATOM 1139 CG LYS A 97 -76.456 -1.896 -35.514 1.00 0.00 C ATOM 1140 CD LYS A 97 -76.755 -0.738 -34.577 1.00 0.00 C ATOM 1141 CE LYS A 97 -76.446 0.599 -35.229 1.00 0.00 C ATOM 1142 NZ LYS A 97 -76.577 1.732 -34.275 1.00 0.00 N ATOM 0 H LYS A 97 -77.796 -3.867 -37.095 1.00 0.00 H new ATOM 0 HA LYS A 97 -75.273 -4.411 -35.815 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -77.874 -3.280 -34.714 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -76.329 -3.275 -33.886 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -75.401 -1.881 -35.789 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -77.027 -1.778 -36.435 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -77.804 -0.767 -34.284 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -76.166 -0.844 -33.666 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -75.433 0.580 -35.631 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -77.120 0.755 -36.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -76.308 2.618 -34.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -77.562 1.799 -33.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -75.952 1.573 -33.459 1.00 0.00 H new ATOM 1156 N THR A 98 -75.734 -6.264 -34.234 1.00 0.00 N ATOM 1157 CA THR A 98 -75.944 -7.440 -33.419 1.00 0.00 C ATOM 1158 C THR A 98 -76.286 -7.045 -31.992 1.00 0.00 C ATOM 1159 O THR A 98 -75.584 -6.246 -31.372 1.00 0.00 O ATOM 1160 CB THR A 98 -74.698 -8.340 -33.425 1.00 0.00 C ATOM 1161 OG1 THR A 98 -73.522 -7.539 -33.249 1.00 0.00 O ATOM 1162 CG2 THR A 98 -74.607 -9.114 -34.727 1.00 0.00 C ATOM 0 H THR A 98 -74.780 -5.903 -34.214 1.00 0.00 H new ATOM 0 HA THR A 98 -76.779 -7.997 -33.844 1.00 0.00 H new ATOM 0 HB THR A 98 -74.776 -9.052 -32.604 1.00 0.00 H new ATOM 0 HG1 THR A 98 -73.705 -6.827 -32.601 1.00 0.00 H new ATOM 0 HG21 THR A 98 -73.719 -9.746 -34.713 1.00 0.00 H new ATOM 0 HG22 THR A 98 -75.494 -9.737 -34.843 1.00 0.00 H new ATOM 0 HG23 THR A 98 -74.543 -8.416 -35.562 1.00 0.00 H new ATOM 1170 N TYR A 99 -77.371 -7.597 -31.479 1.00 0.00 N ATOM 1171 CA TYR A 99 -77.792 -7.321 -30.116 1.00 0.00 C ATOM 1172 C TYR A 99 -76.964 -8.132 -29.123 1.00 0.00 C ATOM 1173 O TYR A 99 -75.960 -8.740 -29.495 1.00 0.00 O ATOM 1174 CB TYR A 99 -79.291 -7.597 -29.943 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.873 -8.521 -30.992 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -79.566 -9.876 -31.003 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -80.717 -8.028 -31.981 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -80.088 -10.713 -31.967 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -81.239 -8.860 -32.950 1.00 0.00 C ATOM 1180 CZ TYR A 99 -80.921 -10.199 -32.939 1.00 0.00 C ATOM 1181 OH TYR A 99 -81.433 -11.033 -33.903 1.00 0.00 O ATOM 0 H TYR A 99 -77.978 -8.241 -31.987 1.00 0.00 H new ATOM 0 HA TYR A 99 -77.622 -6.264 -29.911 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -79.458 -8.032 -28.958 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -79.830 -6.650 -29.969 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -78.910 -10.279 -30.246 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -80.968 -6.978 -31.991 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -79.846 -11.765 -31.961 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -81.893 -8.463 -33.712 1.00 0.00 H new ATOM 0 HH TYR A 99 -82.175 -10.586 -34.362 1.00 0.00 H new ATOM 1191 N THR A 100 -77.387 -8.152 -27.869 1.00 0.00 N ATOM 1192 CA THR A 100 -76.580 -8.735 -26.810 1.00 0.00 C ATOM 1193 C THR A 100 -77.220 -10.003 -26.257 1.00 0.00 C ATOM 1194 O THR A 100 -78.265 -9.939 -25.605 1.00 0.00 O ATOM 1195 CB THR A 100 -76.372 -7.727 -25.663 1.00 0.00 C ATOM 1196 OG1 THR A 100 -75.828 -6.509 -26.182 1.00 0.00 O ATOM 1197 CG2 THR A 100 -75.436 -8.290 -24.605 1.00 0.00 C ATOM 0 H THR A 100 -78.282 -7.772 -27.561 1.00 0.00 H new ATOM 0 HA THR A 100 -75.614 -8.992 -27.245 1.00 0.00 H new ATOM 0 HB THR A 100 -77.340 -7.532 -25.201 1.00 0.00 H new ATOM 0 HG1 THR A 100 -75.699 -5.870 -25.450 1.00 0.00 H new ATOM 0 HG21 THR A 100 -75.307 -7.559 -23.807 1.00 0.00 H new ATOM 0 HG22 THR A 100 -75.861 -9.205 -24.193 1.00 0.00 H new ATOM 0 HG23 THR A 100 -74.468 -8.511 -25.056 1.00 0.00 H new ATOM 1205 N PRO A 101 -76.596 -11.164 -26.521 1.00 0.00 N ATOM 1206 CA PRO A 101 -77.046 -12.467 -26.004 1.00 0.00 C ATOM 1207 C PRO A 101 -76.935 -12.544 -24.481 1.00 0.00 C ATOM 1208 O PRO A 101 -76.074 -13.240 -23.936 1.00 0.00 O ATOM 1209 CB PRO A 101 -76.105 -13.473 -26.678 1.00 0.00 C ATOM 1210 CG PRO A 101 -74.905 -12.680 -27.069 1.00 0.00 C ATOM 1211 CD PRO A 101 -75.400 -11.292 -27.362 1.00 0.00 C ATOM 0 HA PRO A 101 -78.097 -12.656 -26.222 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -75.839 -14.281 -25.997 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -76.575 -13.931 -27.548 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -74.167 -12.669 -26.267 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -74.420 -13.113 -27.943 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -74.652 -10.539 -27.112 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -75.638 -11.166 -28.418 1.00 0.00 H new ATOM 1219 N GLN A 102 -77.816 -11.801 -23.823 1.00 0.00 N ATOM 1220 CA GLN A 102 -77.833 -11.639 -22.375 1.00 0.00 C ATOM 1221 C GLN A 102 -78.806 -10.524 -22.023 1.00 0.00 C ATOM 1222 O GLN A 102 -79.607 -10.639 -21.099 1.00 0.00 O ATOM 1223 CB GLN A 102 -76.441 -11.280 -21.841 1.00 0.00 C ATOM 1224 CG GLN A 102 -76.409 -11.027 -20.341 1.00 0.00 C ATOM 1225 CD GLN A 102 -75.050 -10.566 -19.852 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -74.668 -10.825 -18.711 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -74.313 -9.872 -20.706 1.00 0.00 N ATOM 0 H GLN A 102 -78.557 -11.281 -24.294 1.00 0.00 H new ATOM 0 HA GLN A 102 -78.141 -12.580 -21.920 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -75.750 -12.089 -22.079 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -76.081 -10.391 -22.358 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -77.156 -10.274 -20.088 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -76.688 -11.941 -19.817 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -74.665 -9.678 -21.643 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -73.393 -9.532 -20.426 1.00 0.00 H new ATOM 1236 N SER A 103 -78.727 -9.446 -22.792 1.00 0.00 N ATOM 1237 CA SER A 103 -79.551 -8.273 -22.561 1.00 0.00 C ATOM 1238 C SER A 103 -80.796 -8.299 -23.442 1.00 0.00 C ATOM 1239 O SER A 103 -81.898 -8.008 -22.976 1.00 0.00 O ATOM 1240 CB SER A 103 -78.738 -7.012 -22.839 1.00 0.00 C ATOM 1241 OG SER A 103 -77.489 -7.060 -22.168 1.00 0.00 O ATOM 0 H SER A 103 -78.094 -9.363 -23.587 1.00 0.00 H new ATOM 0 HA SER A 103 -79.873 -8.275 -21.520 1.00 0.00 H new ATOM 0 HB2 SER A 103 -78.576 -6.908 -23.912 1.00 0.00 H new ATOM 0 HB3 SER A 103 -79.297 -6.134 -22.514 1.00 0.00 H new ATOM 0 HG SER A 103 -76.983 -6.243 -22.361 1.00 0.00 H new ATOM 1247 N SER A 104 -80.625 -8.647 -24.716 1.00 0.00 N ATOM 1248 CA SER A 104 -81.761 -8.730 -25.620 1.00 0.00 C ATOM 1249 C SER A 104 -82.496 -10.043 -25.408 1.00 0.00 C ATOM 1250 O SER A 104 -81.961 -10.967 -24.789 1.00 0.00 O ATOM 1251 CB SER A 104 -81.310 -8.588 -27.076 1.00 0.00 C ATOM 1252 OG SER A 104 -80.201 -9.422 -27.364 1.00 0.00 O ATOM 0 H SER A 104 -79.724 -8.872 -25.137 1.00 0.00 H new ATOM 0 HA SER A 104 -82.443 -7.908 -25.401 1.00 0.00 H new ATOM 0 HB2 SER A 104 -82.137 -8.840 -27.740 1.00 0.00 H new ATOM 0 HB3 SER A 104 -81.046 -7.549 -27.276 1.00 0.00 H new ATOM 0 HG SER A 104 -79.807 -9.744 -26.526 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.712 -10.138 -25.913 1.00 0.00 N ATOM 1259 CA ILE A 105 -84.500 -11.337 -25.715 1.00 0.00 C ATOM 1260 C ILE A 105 -84.977 -11.929 -27.035 1.00 0.00 C ATOM 1261 O ILE A 105 -85.113 -11.235 -28.043 1.00 0.00 O ATOM 1262 CB ILE A 105 -85.708 -11.098 -24.766 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -86.471 -9.816 -25.112 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -85.253 -11.048 -23.316 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -87.353 -9.920 -26.334 1.00 0.00 C ATOM 0 H ILE A 105 -84.170 -9.407 -26.457 1.00 0.00 H new ATOM 0 HA ILE A 105 -83.836 -12.058 -25.237 1.00 0.00 H new ATOM 0 HB ILE A 105 -86.387 -11.939 -24.904 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -87.087 -9.534 -24.258 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.752 -9.011 -25.266 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -86.115 -10.880 -22.670 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -84.779 -11.993 -23.051 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -84.538 -10.235 -23.187 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.854 -8.967 -26.503 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.743 -10.169 -27.203 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -88.099 -10.699 -26.179 1.00 0.00 H new ATOM 1277 N ILE A 106 -85.196 -13.223 -27.006 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.783 -13.954 -28.110 1.00 0.00 C ATOM 1279 C ILE A 106 -86.959 -14.743 -27.552 1.00 0.00 C ATOM 1280 O ILE A 106 -86.774 -15.821 -26.986 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.783 -14.936 -28.762 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.532 -14.190 -29.240 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.443 -15.677 -29.918 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.512 -15.074 -29.928 1.00 0.00 C ATOM 0 H ILE A 106 -84.968 -13.809 -26.203 1.00 0.00 H new ATOM 0 HA ILE A 106 -86.088 -13.246 -28.881 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.479 -15.668 -28.014 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.834 -13.399 -29.926 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -83.060 -13.707 -28.384 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -84.726 -16.364 -30.366 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.301 -16.238 -29.548 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.775 -14.959 -30.668 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.657 -14.472 -30.236 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.179 -15.850 -29.239 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -82.964 -15.537 -30.805 1.00 0.00 H new ATOM 1296 N CYS A 107 -88.157 -14.203 -27.668 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.305 -14.822 -27.025 1.00 0.00 C ATOM 1298 C CYS A 107 -89.883 -15.870 -27.950 1.00 0.00 C ATOM 1299 O CYS A 107 -90.533 -15.533 -28.925 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.396 -13.801 -26.686 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.815 -12.136 -26.264 1.00 0.00 S ATOM 0 H CYS A 107 -88.362 -13.352 -28.191 1.00 0.00 H new ATOM 0 HA CYS A 107 -88.963 -15.270 -26.092 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -91.073 -13.724 -27.537 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -90.979 -14.185 -25.849 1.00 0.00 H new ATOM 1306 N TYR A 108 -89.624 -17.131 -27.668 1.00 0.00 N ATOM 1307 CA TYR A 108 -90.128 -18.209 -28.505 1.00 0.00 C ATOM 1308 C TYR A 108 -91.619 -18.399 -28.256 1.00 0.00 C ATOM 1309 O TYR A 108 -92.159 -17.887 -27.277 1.00 0.00 O ATOM 1310 CB TYR A 108 -89.375 -19.504 -28.211 1.00 0.00 C ATOM 1311 CG TYR A 108 -87.873 -19.396 -28.362 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -87.265 -19.526 -29.604 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -87.061 -19.172 -27.257 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -85.893 -19.435 -29.740 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -85.688 -19.082 -27.385 1.00 0.00 C ATOM 1316 CZ TYR A 108 -85.109 -19.215 -28.629 1.00 0.00 C ATOM 1317 OH TYR A 108 -83.739 -19.132 -28.764 1.00 0.00 O ATOM 0 H TYR A 108 -89.069 -17.437 -26.869 1.00 0.00 H new ATOM 0 HA TYR A 108 -89.972 -17.948 -29.552 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -89.605 -19.822 -27.194 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -89.741 -20.284 -28.879 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -87.875 -19.701 -30.478 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -87.511 -19.066 -26.281 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -85.437 -19.536 -30.714 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -85.072 -18.908 -26.515 1.00 0.00 H new ATOM 0 HH TYR A 108 -83.451 -18.208 -28.610 1.00 0.00 H new ATOM 1327 N GLY A 109 -92.286 -19.132 -29.131 1.00 0.00 N ATOM 1328 CA GLY A 109 -93.709 -19.338 -28.965 1.00 0.00 C ATOM 1329 C GLY A 109 -94.463 -19.259 -30.268 1.00 0.00 C ATOM 1330 O GLY A 109 -93.995 -19.748 -31.294 1.00 0.00 O ATOM 0 H GLY A 109 -91.873 -19.585 -29.947 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -93.880 -20.313 -28.509 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -94.102 -18.591 -28.276 1.00 0.00 H new ATOM 1334 N GLN A 110 -95.635 -18.641 -30.224 1.00 0.00 N ATOM 1335 CA GLN A 110 -96.519 -18.591 -31.380 1.00 0.00 C ATOM 1336 C GLN A 110 -96.802 -17.153 -31.805 1.00 0.00 C ATOM 1337 O GLN A 110 -97.231 -16.335 -30.989 1.00 0.00 O ATOM 1338 CB GLN A 110 -97.845 -19.310 -31.084 1.00 0.00 C ATOM 1339 CG GLN A 110 -97.688 -20.773 -30.691 1.00 0.00 C ATOM 1340 CD GLN A 110 -97.254 -20.969 -29.246 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -96.521 -21.905 -28.932 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -97.729 -20.115 -28.352 1.00 0.00 N ATOM 0 H GLN A 110 -95.997 -18.166 -29.397 1.00 0.00 H new ATOM 0 HA GLN A 110 -96.009 -19.100 -32.198 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -98.360 -18.783 -30.281 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -98.483 -19.249 -31.966 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -98.635 -21.288 -30.851 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -96.956 -21.241 -31.349 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -98.335 -19.350 -28.649 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -97.489 -20.222 -27.366 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.546 -16.871 -33.084 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.860 -15.583 -33.716 1.00 0.00 C ATOM 1353 C LEU A 111 -96.248 -14.397 -32.968 1.00 0.00 C ATOM 1354 O LEU A 111 -95.109 -14.012 -33.221 1.00 0.00 O ATOM 1355 CB LEU A 111 -98.381 -15.412 -33.856 1.00 0.00 C ATOM 1356 CG LEU A 111 -98.859 -14.016 -34.274 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -98.205 -13.587 -35.575 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -100.371 -13.987 -34.395 1.00 0.00 C ATOM 0 H LEU A 111 -96.109 -17.538 -33.720 1.00 0.00 H new ATOM 0 HA LEU A 111 -96.410 -15.594 -34.709 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -98.743 -16.134 -34.588 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -98.845 -15.664 -32.903 1.00 0.00 H new ATOM 0 HG LEU A 111 -98.563 -13.307 -33.500 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -98.560 -12.594 -35.851 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -97.123 -13.563 -35.448 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -98.462 -14.296 -36.362 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -100.693 -12.989 -34.692 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -100.690 -14.710 -35.146 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -100.818 -14.241 -33.434 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.024 -13.812 -32.073 1.00 0.00 N ATOM 1371 CA GLY A 112 -96.570 -12.700 -31.295 1.00 0.00 C ATOM 1372 C GLY A 112 -97.327 -12.634 -30.004 1.00 0.00 C ATOM 1373 O GLY A 112 -97.938 -11.620 -29.683 1.00 0.00 O ATOM 0 H GLY A 112 -97.982 -14.102 -31.874 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -95.503 -12.797 -31.096 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -96.707 -11.774 -31.854 1.00 0.00 H new ATOM 1377 N SER A 113 -97.345 -13.745 -29.292 1.00 0.00 N ATOM 1378 CA SER A 113 -97.968 -13.784 -27.987 1.00 0.00 C ATOM 1379 C SER A 113 -96.981 -13.292 -26.937 1.00 0.00 C ATOM 1380 O SER A 113 -96.117 -14.039 -26.473 1.00 0.00 O ATOM 1381 CB SER A 113 -98.453 -15.199 -27.660 1.00 0.00 C ATOM 1382 OG SER A 113 -99.130 -15.234 -26.414 1.00 0.00 O ATOM 0 H SER A 113 -96.936 -14.629 -29.596 1.00 0.00 H new ATOM 0 HA SER A 113 -98.839 -13.128 -27.988 1.00 0.00 H new ATOM 0 HB2 SER A 113 -99.119 -15.549 -28.449 1.00 0.00 H new ATOM 0 HB3 SER A 113 -97.603 -15.881 -27.634 1.00 0.00 H new ATOM 0 HG SER A 113 -99.430 -16.149 -26.230 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.111 -12.024 -26.579 1.00 0.00 N ATOM 1389 CA PHE A 114 -96.225 -11.389 -25.613 1.00 0.00 C ATOM 1390 C PHE A 114 -96.656 -11.739 -24.197 1.00 0.00 C ATOM 1391 O PHE A 114 -96.864 -10.872 -23.351 1.00 0.00 O ATOM 1392 CB PHE A 114 -96.216 -9.873 -25.824 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.607 -9.466 -27.135 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -96.252 -9.744 -28.328 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.387 -8.819 -27.177 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -95.696 -9.387 -29.539 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -93.823 -8.457 -28.385 1.00 0.00 C ATOM 1398 CZ PHE A 114 -94.479 -8.742 -29.569 1.00 0.00 C ATOM 0 H PHE A 114 -97.833 -11.406 -26.949 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.211 -11.760 -25.762 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -97.238 -9.499 -25.773 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -95.663 -9.402 -25.011 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -97.207 -10.249 -28.310 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -93.869 -8.594 -26.256 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -96.213 -9.612 -30.460 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -92.869 -7.951 -28.405 1.00 0.00 H new ATOM 0 HZ PHE A 114 -94.039 -8.460 -30.514 1.00 0.00 H new ATOM 1408 N SER A 115 -96.805 -13.030 -23.965 1.00 0.00 N ATOM 1409 CA SER A 115 -97.183 -13.548 -22.667 1.00 0.00 C ATOM 1410 C SER A 115 -96.038 -14.388 -22.108 1.00 0.00 C ATOM 1411 O SER A 115 -96.145 -14.991 -21.039 1.00 0.00 O ATOM 1412 CB SER A 115 -98.461 -14.375 -22.812 1.00 0.00 C ATOM 1413 OG SER A 115 -99.400 -13.675 -23.619 1.00 0.00 O ATOM 0 H SER A 115 -96.666 -13.749 -24.675 1.00 0.00 H new ATOM 0 HA SER A 115 -97.378 -12.732 -21.971 1.00 0.00 H new ATOM 0 HB2 SER A 115 -98.231 -15.341 -23.261 1.00 0.00 H new ATOM 0 HB3 SER A 115 -98.889 -14.574 -21.830 1.00 0.00 H new ATOM 0 HG SER A 115 -99.412 -14.063 -24.519 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.941 -14.407 -22.855 1.00 0.00 N ATOM 1420 CA ASN A 116 -93.745 -15.137 -22.472 1.00 0.00 C ATOM 1421 C ASN A 116 -92.569 -14.684 -23.326 1.00 0.00 C ATOM 1422 O ASN A 116 -92.741 -14.327 -24.491 1.00 0.00 O ATOM 1423 CB ASN A 116 -93.946 -16.650 -22.632 1.00 0.00 C ATOM 1424 CG ASN A 116 -94.176 -17.073 -24.073 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -95.314 -17.142 -24.543 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -93.099 -17.373 -24.779 1.00 0.00 N ATOM 0 H ASN A 116 -94.858 -13.915 -23.745 1.00 0.00 H new ATOM 0 HA ASN A 116 -93.540 -14.927 -21.422 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -93.071 -17.170 -22.243 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -94.797 -16.963 -22.028 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -93.193 -17.674 -25.749 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -92.175 -17.303 -24.354 1.00 0.00 H new ATOM 1433 N CYS A 117 -91.391 -14.680 -22.733 1.00 0.00 N ATOM 1434 CA CYS A 117 -90.163 -14.371 -23.448 1.00 0.00 C ATOM 1435 C CYS A 117 -89.004 -15.143 -22.835 1.00 0.00 C ATOM 1436 O CYS A 117 -89.166 -15.825 -21.822 1.00 0.00 O ATOM 1437 CB CYS A 117 -89.845 -12.875 -23.398 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.784 -11.812 -24.525 1.00 0.00 S ATOM 0 H CYS A 117 -91.256 -14.890 -21.744 1.00 0.00 H new ATOM 0 HA CYS A 117 -90.303 -14.660 -24.489 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -90.012 -12.524 -22.380 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.784 -12.744 -23.610 1.00 0.00 H new ATOM 1443 N SER A 118 -87.840 -15.036 -23.452 1.00 0.00 N ATOM 1444 CA SER A 118 -86.634 -15.644 -22.927 1.00 0.00 C ATOM 1445 C SER A 118 -85.428 -14.848 -23.397 1.00 0.00 C ATOM 1446 O SER A 118 -85.431 -14.322 -24.508 1.00 0.00 O ATOM 1447 CB SER A 118 -86.528 -17.101 -23.392 1.00 0.00 C ATOM 1448 OG SER A 118 -85.420 -17.756 -22.799 1.00 0.00 O ATOM 0 H SER A 118 -87.706 -14.528 -24.326 1.00 0.00 H new ATOM 0 HA SER A 118 -86.668 -15.636 -21.838 1.00 0.00 H new ATOM 0 HB2 SER A 118 -87.445 -17.633 -23.138 1.00 0.00 H new ATOM 0 HB3 SER A 118 -86.432 -17.132 -24.477 1.00 0.00 H new ATOM 0 HG SER A 118 -85.381 -18.683 -23.114 1.00 0.00 H new ATOM 1454 N HIS A 119 -84.422 -14.722 -22.540 1.00 0.00 N ATOM 1455 CA HIS A 119 -83.180 -14.041 -22.902 1.00 0.00 C ATOM 1456 C HIS A 119 -82.593 -14.643 -24.178 1.00 0.00 C ATOM 1457 O HIS A 119 -82.722 -15.846 -24.408 1.00 0.00 O ATOM 1458 CB HIS A 119 -82.156 -14.114 -21.753 1.00 0.00 C ATOM 1459 CG HIS A 119 -81.696 -15.503 -21.408 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -80.370 -15.882 -21.412 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -82.393 -16.603 -21.029 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -80.274 -17.148 -21.054 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -81.486 -17.608 -20.816 1.00 0.00 N ATOM 0 H HIS A 119 -84.440 -15.083 -21.586 1.00 0.00 H new ATOM 0 HA HIS A 119 -83.410 -12.991 -23.085 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -81.286 -13.514 -22.021 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -82.595 -13.660 -20.864 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -83.465 -16.674 -20.916 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -79.357 -17.712 -20.970 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -81.712 -18.558 -20.521 1.00 0.00 H new ATOM 1472 N SER A 120 -81.982 -13.794 -25.008 1.00 0.00 N ATOM 1473 CA SER A 120 -81.370 -14.230 -26.264 1.00 0.00 C ATOM 1474 C SER A 120 -80.512 -15.475 -26.045 1.00 0.00 C ATOM 1475 O SER A 120 -79.419 -15.410 -25.481 1.00 0.00 O ATOM 1476 CB SER A 120 -80.551 -13.084 -26.872 1.00 0.00 C ATOM 1477 OG SER A 120 -79.975 -12.277 -25.857 1.00 0.00 O ATOM 0 H SER A 120 -81.898 -12.793 -24.830 1.00 0.00 H new ATOM 0 HA SER A 120 -82.158 -14.498 -26.968 1.00 0.00 H new ATOM 0 HB2 SER A 120 -79.765 -13.491 -27.508 1.00 0.00 H new ATOM 0 HB3 SER A 120 -81.191 -12.473 -27.508 1.00 0.00 H new ATOM 0 HG SER A 120 -80.578 -11.533 -25.649 1.00 0.00 H new ATOM 1483 N ARG A 121 -81.041 -16.612 -26.481 1.00 0.00 N ATOM 1484 CA ARG A 121 -80.480 -17.909 -26.139 1.00 0.00 C ATOM 1485 C ARG A 121 -79.308 -18.283 -27.042 1.00 0.00 C ATOM 1486 O ARG A 121 -78.151 -18.172 -26.637 1.00 0.00 O ATOM 1487 CB ARG A 121 -81.572 -18.980 -26.210 1.00 0.00 C ATOM 1488 CG ARG A 121 -81.119 -20.360 -25.768 1.00 0.00 C ATOM 1489 CD ARG A 121 -82.252 -21.371 -25.855 1.00 0.00 C ATOM 1490 NE ARG A 121 -82.771 -21.504 -27.218 1.00 0.00 N ATOM 1491 CZ ARG A 121 -82.963 -22.676 -27.829 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -82.715 -23.811 -27.186 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -83.427 -22.709 -29.072 1.00 0.00 N ATOM 0 H ARG A 121 -81.866 -16.659 -27.078 1.00 0.00 H new ATOM 0 HA ARG A 121 -80.094 -17.848 -25.121 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -82.412 -18.669 -25.588 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -81.939 -19.041 -27.234 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -80.288 -20.689 -26.392 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -80.750 -20.312 -24.744 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -81.898 -22.341 -25.506 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -83.059 -21.068 -25.189 1.00 0.00 H new ATOM 0 HE ARG A 121 -82.999 -20.652 -27.730 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -82.377 -23.789 -26.224 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -82.862 -24.705 -27.654 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -83.637 -21.839 -29.561 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -83.573 -23.604 -29.538 1.00 0.00 H new ATOM 1550 N CYS A 125 -81.814 -15.910 -34.636 1.00 0.00 N ATOM 1551 CA CYS A 125 -81.753 -14.504 -34.986 1.00 0.00 C ATOM 1552 C CYS A 125 -80.424 -13.891 -34.573 1.00 0.00 C ATOM 1553 O CYS A 125 -80.203 -13.587 -33.404 1.00 0.00 O ATOM 1554 CB CYS A 125 -82.932 -13.749 -34.369 1.00 0.00 C ATOM 1555 SG CYS A 125 -83.606 -14.519 -32.865 1.00 0.00 S ATOM 0 HA CYS A 125 -81.825 -14.418 -36.070 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.615 -12.733 -34.133 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -83.727 -13.670 -35.111 1.00 0.00 H new ATOM 1560 N HIS A 126 -79.537 -13.730 -35.551 1.00 0.00 N ATOM 1561 CA HIS A 126 -78.232 -13.125 -35.310 1.00 0.00 C ATOM 1562 C HIS A 126 -78.375 -11.616 -35.231 1.00 0.00 C ATOM 1563 O HIS A 126 -77.811 -10.968 -34.351 1.00 0.00 O ATOM 1564 CB HIS A 126 -77.252 -13.490 -36.429 1.00 0.00 C ATOM 1565 CG HIS A 126 -77.059 -14.964 -36.604 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -77.678 -15.692 -37.595 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -76.307 -15.845 -35.907 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -77.316 -16.956 -37.497 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -76.486 -17.077 -36.482 1.00 0.00 N ATOM 0 H HIS A 126 -79.699 -14.010 -36.518 1.00 0.00 H new ATOM 0 HA HIS A 126 -77.842 -13.506 -34.366 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -77.611 -13.066 -37.367 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -76.287 -13.029 -36.219 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -75.682 -15.620 -35.056 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -77.645 -17.758 -38.141 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -76.048 -17.945 -36.174 1.00 0.00 H new ATOM 1578 N SER A 127 -79.150 -11.069 -36.157 1.00 0.00 N ATOM 1579 CA SER A 127 -79.368 -9.635 -36.224 1.00 0.00 C ATOM 1580 C SER A 127 -80.631 -9.316 -37.021 1.00 0.00 C ATOM 1581 O SER A 127 -80.681 -8.319 -37.740 1.00 0.00 O ATOM 1582 CB SER A 127 -78.147 -8.961 -36.859 1.00 0.00 C ATOM 1583 OG SER A 127 -77.762 -9.622 -38.054 1.00 0.00 O ATOM 0 H SER A 127 -79.640 -11.602 -36.875 1.00 0.00 H new ATOM 0 HA SER A 127 -79.504 -9.250 -35.213 1.00 0.00 H new ATOM 0 HB2 SER A 127 -78.375 -7.917 -37.075 1.00 0.00 H new ATOM 0 HB3 SER A 127 -77.317 -8.967 -36.153 1.00 0.00 H new ATOM 0 HG SER A 127 -76.982 -9.172 -38.440 1.00 0.00 H new ATOM 1589 N LEU A 128 -81.663 -10.153 -36.878 1.00 0.00 N ATOM 1590 CA LEU A 128 -82.900 -9.957 -37.627 1.00 0.00 C ATOM 1591 C LEU A 128 -83.506 -8.598 -37.308 1.00 0.00 C ATOM 1592 O LEU A 128 -83.663 -8.234 -36.144 1.00 0.00 O ATOM 1593 CB LEU A 128 -83.915 -11.066 -37.328 1.00 0.00 C ATOM 1594 CG LEU A 128 -83.806 -12.329 -38.190 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -84.078 -12.010 -39.649 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -82.442 -12.979 -38.039 1.00 0.00 C ATOM 0 H LEU A 128 -81.664 -10.962 -36.257 1.00 0.00 H new ATOM 0 HA LEU A 128 -82.654 -9.998 -38.688 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -83.810 -11.354 -36.282 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -84.918 -10.655 -37.447 1.00 0.00 H new ATOM 0 HG LEU A 128 -84.560 -13.034 -37.841 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -83.995 -12.921 -40.242 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -85.083 -11.601 -39.751 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -83.351 -11.279 -40.003 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -82.394 -13.872 -38.662 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -81.668 -12.277 -38.350 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -82.284 -13.255 -36.996 1.00 0.00 H new ATOM 1608 N GLY A 129 -83.830 -7.856 -38.349 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.356 -6.528 -38.184 1.00 0.00 C ATOM 1610 C GLY A 129 -85.760 -6.413 -38.727 1.00 0.00 C ATOM 1611 O GLY A 129 -86.285 -7.364 -39.318 1.00 0.00 O ATOM 0 H GLY A 129 -83.735 -8.158 -39.319 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.352 -6.264 -37.127 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.709 -5.814 -38.694 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.344 -5.240 -38.563 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.720 -4.999 -38.922 1.00 0.00 C ATOM 1617 C LEU A 130 -87.885 -3.532 -39.301 1.00 0.00 C ATOM 1618 O LEU A 130 -87.648 -2.626 -38.507 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.644 -5.386 -37.765 1.00 0.00 C ATOM 1620 CG LEU A 130 -89.212 -6.810 -37.811 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -89.922 -7.142 -36.510 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -90.177 -6.967 -38.980 1.00 0.00 C ATOM 0 H LEU A 130 -85.869 -4.425 -38.174 1.00 0.00 H new ATOM 0 HA LEU A 130 -87.994 -5.614 -39.779 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -88.096 -5.264 -36.831 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.477 -4.684 -37.740 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.380 -7.501 -37.947 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -90.319 -8.156 -36.560 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -89.217 -7.069 -35.682 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.741 -6.440 -36.353 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.568 -7.984 -38.995 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -91.001 -6.262 -38.869 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.652 -6.767 -39.914 1.00 0.00 H new ATOM 1634 N THR A 131 -88.282 -3.311 -40.523 1.00 0.00 N ATOM 1635 CA THR A 131 -88.281 -1.986 -41.110 1.00 0.00 C ATOM 1636 C THR A 131 -89.678 -1.566 -41.586 1.00 0.00 C ATOM 1637 O THR A 131 -90.072 -1.934 -42.696 1.00 0.00 O ATOM 1638 CB THR A 131 -87.324 -2.061 -42.287 1.00 0.00 C ATOM 1639 OG1 THR A 131 -85.971 -2.137 -41.818 1.00 0.00 O ATOM 1640 CG2 THR A 131 -87.492 -0.900 -43.249 1.00 0.00 C ATOM 0 H THR A 131 -88.618 -4.043 -41.148 1.00 0.00 H new ATOM 0 HA THR A 131 -87.977 -1.240 -40.375 1.00 0.00 H new ATOM 0 HB THR A 131 -87.565 -2.967 -42.843 1.00 0.00 H new ATOM 0 HG1 THR A 131 -85.362 -2.187 -42.584 1.00 0.00 H new ATOM 0 HG21 THR A 131 -86.784 -1.003 -44.071 1.00 0.00 H new ATOM 0 HG22 THR A 131 -88.508 -0.898 -43.643 1.00 0.00 H new ATOM 0 HG23 THR A 131 -87.305 0.037 -42.725 1.00 0.00 H new ATOM 1648 N CYS A 132 -90.415 -0.806 -40.745 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.858 -0.531 -40.948 1.00 0.00 C ATOM 1650 C CYS A 132 -92.169 -0.214 -42.416 1.00 0.00 C ATOM 1651 O CYS A 132 -92.502 -1.106 -43.204 1.00 0.00 O ATOM 1652 CB CYS A 132 -92.331 0.630 -40.056 1.00 0.00 C ATOM 1653 SG CYS A 132 -91.814 0.517 -38.316 1.00 0.00 S ATOM 0 H CYS A 132 -90.029 -0.367 -39.909 1.00 0.00 H new ATOM 0 HA CYS A 132 -92.398 -1.436 -40.668 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.955 1.565 -40.472 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -93.419 0.679 -40.094 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.043 1.039 -42.804 1.00 0.00 N ATOM 1659 CA LEU A 133 -92.295 1.387 -44.177 1.00 0.00 C ATOM 1660 C LEU A 133 -90.981 1.339 -44.938 1.00 0.00 C ATOM 1661 O LEU A 133 -90.267 2.339 -45.024 1.00 0.00 O ATOM 1662 CB LEU A 133 -92.951 2.772 -44.293 1.00 0.00 C ATOM 1663 CG LEU A 133 -93.817 3.006 -45.546 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -92.973 3.013 -46.815 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -94.910 1.950 -45.642 1.00 0.00 C ATOM 0 H LEU A 133 -91.773 1.815 -42.199 1.00 0.00 H new ATOM 0 HA LEU A 133 -92.995 0.671 -44.608 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -93.571 2.933 -43.411 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -92.165 3.527 -44.272 1.00 0.00 H new ATOM 0 HG LEU A 133 -94.282 3.987 -45.450 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -93.616 3.180 -47.679 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -92.232 3.810 -46.755 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -92.466 2.054 -46.920 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -95.512 2.130 -46.532 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -94.456 0.961 -45.705 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -95.545 2.002 -44.758 1.00 0.00 H new ATOM 1677 N GLU A 134 -90.644 0.151 -45.419 1.00 0.00 N ATOM 1678 CA GLU A 134 -89.426 -0.055 -46.206 1.00 0.00 C ATOM 1679 C GLU A 134 -89.269 1.005 -47.302 1.00 0.00 C ATOM 1680 O GLU A 134 -88.185 1.564 -47.494 1.00 0.00 O ATOM 1681 CB GLU A 134 -89.420 -1.469 -46.813 1.00 0.00 C ATOM 1682 CG GLU A 134 -90.632 -1.798 -47.681 1.00 0.00 C ATOM 1683 CD GLU A 134 -90.570 -1.170 -49.060 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -89.832 -1.689 -49.923 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -91.251 -0.150 -49.285 1.00 0.00 O ATOM 0 H GLU A 134 -91.198 -0.694 -45.279 1.00 0.00 H new ATOM 0 HA GLU A 134 -88.574 0.047 -45.534 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -88.518 -1.588 -47.413 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -89.362 -2.197 -46.003 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -90.713 -2.880 -47.785 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -91.536 -1.458 -47.175 1.00 0.00 H new