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 110 GLN : amide:sc= -0.91! K(o=-0.66!,f=0.35) USER MOD Set 1.2: A 113 SER OG : rot -120:sc= 0.248 USER MOD Set 2.1: A 58 MET CE :methyl 139:sc= -2.23 (180deg=-4.69!) USER MOD Set 2.2: A 104 SER OG : rot 180:sc= -0.51 USER MOD Set 3.1: A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 85 ASN : amide:sc= -1.47 K(o=-1.5,f=-4.3!) USER MOD Set 4.1: A 62 GLN : amide:sc= -3.62! C(o=-2.2!,f=-8.7!) USER MOD Set 4.2: A 63 SER OG : rot -3:sc= 0.436 USER MOD Set 4.3: A 67 SER OG : rot 100:sc= 1 USER MOD Single : A 27 SER OG : rot 180:sc= -0.611 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -1.02 K(o=-1,f=-5.1!) USER MOD Single : A 38 THR OG1 : rot -62:sc= -1.19 USER MOD Single : A 40 SER OG : rot 71:sc= 0.371 USER MOD Single : A 41 ASN : amide:sc=-0.00458 K(o=-0.0046,f=-1.5) USER MOD Single : A 42 SER OG : rot 180:sc= -0.0757 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 GLN : amide:sc= -0.809 X(o=-0.81,f=-0.6) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 166:sc= -0.019 (180deg=-0.234) USER MOD Single : A 57 HIS : no HE2:sc= -7.3! C(o=-7.3!,f=-6.1!) USER MOD Single : A 61 SER OG : rot 134:sc= 1.29 USER MOD Single : A 68 SER OG : rot 180:sc= 0.0538 USER MOD Single : A 69 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0566) USER MOD Single : A 70 GLN : amide:sc= -1.05 K(o=-1,f=0) USER MOD Single : A 75 SER OG : rot 19:sc= 1.22 USER MOD Single : A 76 GLN : amide:sc= -1.25! K(o=-1.3!,f=-0.049) USER MOD Single : A 78 SER OG : rot 180:sc= -0.236 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= -0.891 K(o=-0.89,f=0) USER MOD Single : A 91 SER OG : rot 113:sc= 1.26 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 TYR OH : rot -110:sc= -1.4 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -4.02! K(o=-4!,f=-0.51) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 118 SER OG : rot 180:sc=-0.00978 USER MOD Single : A 119 HIS : no HE2:sc= -0.0264 K(o=-0.026,f=-0.63) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 127 SER OG : rot -172:sc= 1.28 USER MOD Single : A 131 THR OG1 : rot 4:sc= 0.72 USER MOD ----------------------------------------------------------------- ATOM 25 N LEU A 26 -101.093 -8.425 -24.735 1.00 0.00 N ATOM 26 CA LEU A 26 -99.734 -8.284 -25.254 1.00 0.00 C ATOM 27 C LEU A 26 -99.644 -8.820 -26.678 1.00 0.00 C ATOM 28 O LEU A 26 -99.227 -9.954 -26.907 1.00 0.00 O ATOM 29 CB LEU A 26 -98.721 -8.996 -24.348 1.00 0.00 C ATOM 30 CG LEU A 26 -98.723 -8.538 -22.887 1.00 0.00 C ATOM 31 CD1 LEU A 26 -97.732 -9.349 -22.067 1.00 0.00 C ATOM 32 CD2 LEU A 26 -98.406 -7.054 -22.795 1.00 0.00 C ATOM 0 HA LEU A 26 -99.489 -7.222 -25.267 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -98.921 -10.067 -24.377 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -97.722 -8.847 -24.758 1.00 0.00 H new ATOM 0 HG LEU A 26 -99.719 -8.704 -22.477 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -97.750 -9.007 -21.032 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -98.005 -10.404 -22.105 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -96.730 -9.219 -22.475 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -98.412 -6.745 -21.750 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -97.422 -6.865 -23.224 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -99.157 -6.487 -23.345 1.00 0.00 H new ATOM 44 N SER A 27 -100.067 -8.002 -27.626 1.00 0.00 N ATOM 45 CA SER A 27 -100.074 -8.386 -29.027 1.00 0.00 C ATOM 46 C SER A 27 -99.644 -7.209 -29.902 1.00 0.00 C ATOM 47 O SER A 27 -100.170 -6.107 -29.765 1.00 0.00 O ATOM 48 CB SER A 27 -101.475 -8.877 -29.413 1.00 0.00 C ATOM 49 OG SER A 27 -102.480 -8.008 -28.904 1.00 0.00 O ATOM 0 H SER A 27 -100.413 -7.059 -27.448 1.00 0.00 H new ATOM 0 HA SER A 27 -99.363 -9.196 -29.186 1.00 0.00 H new ATOM 0 HB2 SER A 27 -101.557 -8.936 -30.498 1.00 0.00 H new ATOM 0 HB3 SER A 27 -101.630 -9.884 -29.026 1.00 0.00 H new ATOM 0 HG SER A 27 -103.364 -8.342 -29.165 1.00 0.00 H new ATOM 55 N TRP A 28 -98.696 -7.443 -30.812 1.00 0.00 N ATOM 56 CA TRP A 28 -98.117 -6.357 -31.612 1.00 0.00 C ATOM 57 C TRP A 28 -99.022 -5.955 -32.780 1.00 0.00 C ATOM 58 O TRP A 28 -98.552 -5.607 -33.859 1.00 0.00 O ATOM 59 CB TRP A 28 -96.707 -6.725 -32.106 1.00 0.00 C ATOM 60 CG TRP A 28 -96.641 -7.849 -33.104 1.00 0.00 C ATOM 61 CD1 TRP A 28 -97.494 -8.908 -33.227 1.00 0.00 C ATOM 62 CD2 TRP A 28 -95.635 -8.027 -34.109 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.087 -9.725 -34.253 1.00 0.00 N ATOM 64 CE2 TRP A 28 -95.948 -9.205 -34.810 1.00 0.00 C ATOM 65 CE3 TRP A 28 -94.501 -7.302 -34.488 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -95.170 -9.672 -35.864 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -93.730 -7.768 -35.536 1.00 0.00 C ATOM 68 CH2 TRP A 28 -94.069 -8.943 -36.214 1.00 0.00 C ATOM 0 H TRP A 28 -98.314 -8.367 -31.014 1.00 0.00 H new ATOM 0 HA TRP A 28 -98.033 -5.488 -30.959 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -96.255 -5.839 -32.553 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -96.097 -6.993 -31.243 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -98.362 -9.078 -32.608 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -97.556 -10.580 -34.552 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -94.232 -6.393 -33.970 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -95.428 -10.580 -36.388 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -92.852 -7.216 -35.836 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -93.448 -9.281 -37.031 1.00 0.00 H new ATOM 79 N TYR A 29 -100.321 -5.995 -32.547 1.00 0.00 N ATOM 80 CA TYR A 29 -101.293 -5.459 -33.486 1.00 0.00 C ATOM 81 C TYR A 29 -102.418 -4.788 -32.705 1.00 0.00 C ATOM 82 O TYR A 29 -103.459 -4.426 -33.254 1.00 0.00 O ATOM 83 CB TYR A 29 -101.835 -6.558 -34.414 1.00 0.00 C ATOM 84 CG TYR A 29 -102.438 -7.755 -33.706 1.00 0.00 C ATOM 85 CD1 TYR A 29 -103.767 -7.755 -33.303 1.00 0.00 C ATOM 86 CD2 TYR A 29 -101.680 -8.894 -33.458 1.00 0.00 C ATOM 87 CE1 TYR A 29 -104.324 -8.851 -32.675 1.00 0.00 C ATOM 88 CE2 TYR A 29 -102.230 -9.993 -32.827 1.00 0.00 C ATOM 89 CZ TYR A 29 -103.552 -9.967 -32.439 1.00 0.00 C ATOM 90 OH TYR A 29 -104.110 -11.063 -31.819 1.00 0.00 O ATOM 0 H TYR A 29 -100.732 -6.398 -31.705 1.00 0.00 H new ATOM 0 HA TYR A 29 -100.808 -4.719 -34.123 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -102.592 -6.121 -35.066 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -101.024 -6.904 -35.054 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -104.376 -6.882 -33.484 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -100.644 -8.920 -33.764 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -105.360 -8.833 -32.370 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -101.627 -10.869 -32.639 1.00 0.00 H new ATOM 0 HH TYR A 29 -103.434 -11.767 -31.727 1.00 0.00 H new ATOM 100 N ASP A 30 -102.170 -4.606 -31.414 1.00 0.00 N ATOM 101 CA ASP A 30 -103.150 -4.029 -30.504 1.00 0.00 C ATOM 102 C ASP A 30 -102.895 -2.537 -30.334 1.00 0.00 C ATOM 103 O ASP A 30 -101.758 -2.121 -30.109 1.00 0.00 O ATOM 104 CB ASP A 30 -103.063 -4.724 -29.144 1.00 0.00 C ATOM 105 CG ASP A 30 -104.208 -4.359 -28.225 1.00 0.00 C ATOM 106 OD1 ASP A 30 -105.239 -5.057 -28.253 1.00 0.00 O ATOM 107 OD2 ASP A 30 -104.077 -3.388 -27.457 1.00 0.00 O ATOM 0 H ASP A 30 -101.286 -4.854 -30.970 1.00 0.00 H new ATOM 0 HA ASP A 30 -104.147 -4.172 -30.922 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -103.053 -5.804 -29.293 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -102.120 -4.459 -28.665 1.00 0.00 H new ATOM 112 N PRO A 31 -103.950 -1.711 -30.425 1.00 0.00 N ATOM 113 CA PRO A 31 -103.824 -0.250 -30.345 1.00 0.00 C ATOM 114 C PRO A 31 -103.307 0.234 -28.989 1.00 0.00 C ATOM 115 O PRO A 31 -102.849 1.372 -28.857 1.00 0.00 O ATOM 116 CB PRO A 31 -105.251 0.251 -30.587 1.00 0.00 C ATOM 117 CG PRO A 31 -106.129 -0.901 -30.246 1.00 0.00 C ATOM 118 CD PRO A 31 -105.351 -2.132 -30.611 1.00 0.00 C ATOM 0 HA PRO A 31 -103.097 0.126 -31.066 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -105.476 1.116 -29.964 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -105.390 0.560 -31.623 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -106.382 -0.899 -29.186 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -107.068 -0.854 -30.798 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.607 -2.975 -29.969 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -105.546 -2.442 -31.638 1.00 0.00 H new ATOM 126 N ASP A 32 -103.378 -0.630 -27.985 1.00 0.00 N ATOM 127 CA ASP A 32 -102.889 -0.294 -26.652 1.00 0.00 C ATOM 128 C ASP A 32 -101.441 -0.733 -26.474 1.00 0.00 C ATOM 129 O ASP A 32 -100.667 -0.081 -25.770 1.00 0.00 O ATOM 130 CB ASP A 32 -103.768 -0.949 -25.583 1.00 0.00 C ATOM 131 CG ASP A 32 -103.134 -0.931 -24.204 1.00 0.00 C ATOM 132 OD1 ASP A 32 -103.174 0.123 -23.532 1.00 0.00 O ATOM 133 OD2 ASP A 32 -102.598 -1.977 -23.783 1.00 0.00 O ATOM 0 H ASP A 32 -103.769 -1.568 -28.067 1.00 0.00 H new ATOM 0 HA ASP A 32 -102.936 0.789 -26.539 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -104.727 -0.433 -25.543 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -103.972 -1.981 -25.870 1.00 0.00 H new ATOM 138 N PHE A 33 -101.075 -1.820 -27.137 1.00 0.00 N ATOM 139 CA PHE A 33 -99.756 -2.414 -26.964 1.00 0.00 C ATOM 140 C PHE A 33 -98.670 -1.500 -27.521 1.00 0.00 C ATOM 141 O PHE A 33 -98.781 -1.002 -28.641 1.00 0.00 O ATOM 142 CB PHE A 33 -99.693 -3.780 -27.649 1.00 0.00 C ATOM 143 CG PHE A 33 -98.403 -4.513 -27.404 1.00 0.00 C ATOM 144 CD1 PHE A 33 -98.137 -5.080 -26.169 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.459 -4.633 -28.410 1.00 0.00 C ATOM 146 CE1 PHE A 33 -96.953 -5.752 -25.941 1.00 0.00 C ATOM 147 CE2 PHE A 33 -96.273 -5.305 -28.188 1.00 0.00 C ATOM 148 CZ PHE A 33 -96.019 -5.865 -26.951 1.00 0.00 C ATOM 0 H PHE A 33 -101.674 -2.310 -27.801 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.582 -2.545 -25.896 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.523 -4.393 -27.297 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -99.828 -3.646 -28.722 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -98.864 -4.995 -25.375 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.652 -4.196 -29.379 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -96.758 -6.189 -24.973 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -95.545 -5.393 -28.981 1.00 0.00 H new ATOM 0 HZ PHE A 33 -95.092 -6.390 -26.775 1.00 0.00 H new ATOM 158 N GLN A 34 -97.635 -1.269 -26.730 1.00 0.00 N ATOM 159 CA GLN A 34 -96.510 -0.461 -27.173 1.00 0.00 C ATOM 160 C GLN A 34 -95.490 -1.301 -27.919 1.00 0.00 C ATOM 161 O GLN A 34 -94.970 -2.291 -27.399 1.00 0.00 O ATOM 162 CB GLN A 34 -95.842 0.249 -26.002 1.00 0.00 C ATOM 163 CG GLN A 34 -96.439 1.609 -25.697 1.00 0.00 C ATOM 164 CD GLN A 34 -96.142 2.645 -26.769 1.00 0.00 C ATOM 165 OE1 GLN A 34 -95.990 2.323 -27.950 1.00 0.00 O ATOM 166 NE2 GLN A 34 -96.059 3.902 -26.364 1.00 0.00 N ATOM 0 H GLN A 34 -97.550 -1.629 -25.779 1.00 0.00 H new ATOM 0 HA GLN A 34 -96.905 0.293 -27.854 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -95.919 -0.380 -25.115 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -94.780 0.368 -26.218 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -97.519 1.509 -25.587 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -96.052 1.963 -24.741 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -96.191 4.130 -25.379 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -95.863 4.643 -27.037 1.00 0.00 H new ATOM 175 N ALA A 35 -95.199 -0.878 -29.131 1.00 0.00 N ATOM 176 CA ALA A 35 -94.267 -1.583 -29.994 1.00 0.00 C ATOM 177 C ALA A 35 -93.660 -0.620 -30.997 1.00 0.00 C ATOM 178 O ALA A 35 -94.334 0.303 -31.458 1.00 0.00 O ATOM 179 CB ALA A 35 -94.967 -2.726 -30.714 1.00 0.00 C ATOM 0 H ALA A 35 -95.600 -0.038 -29.548 1.00 0.00 H new ATOM 0 HA ALA A 35 -93.470 -2.002 -29.380 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -94.254 -3.243 -31.356 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -95.369 -3.426 -29.981 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -95.781 -2.329 -31.321 1.00 0.00 H new ATOM 185 N ARG A 36 -92.388 -0.826 -31.317 1.00 0.00 N ATOM 186 CA ARG A 36 -91.666 0.081 -32.199 1.00 0.00 C ATOM 187 C ARG A 36 -90.260 -0.436 -32.462 1.00 0.00 C ATOM 188 O ARG A 36 -89.878 -1.505 -31.988 1.00 0.00 O ATOM 189 CB ARG A 36 -91.545 1.455 -31.537 1.00 0.00 C ATOM 190 CG ARG A 36 -90.719 1.385 -30.259 1.00 0.00 C ATOM 191 CD ARG A 36 -90.437 2.742 -29.648 1.00 0.00 C ATOM 192 NE ARG A 36 -89.552 2.605 -28.492 1.00 0.00 N ATOM 193 CZ ARG A 36 -89.272 3.574 -27.630 1.00 0.00 C ATOM 194 NH1 ARG A 36 -89.811 4.778 -27.772 1.00 0.00 N ATOM 195 NH2 ARG A 36 -88.447 3.331 -26.620 1.00 0.00 N ATOM 0 H ARG A 36 -91.836 -1.614 -30.978 1.00 0.00 H new ATOM 0 HA ARG A 36 -92.217 0.151 -33.137 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -91.084 2.156 -32.232 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -92.539 1.840 -31.309 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -91.244 0.769 -29.529 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -89.773 0.888 -30.474 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -89.978 3.394 -30.391 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -91.372 3.213 -29.345 1.00 0.00 H new ATOM 0 HE ARG A 36 -89.117 1.696 -28.337 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -90.446 4.964 -28.548 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -89.591 5.517 -27.105 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -88.033 2.405 -26.511 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -88.226 4.070 -25.953 1.00 0.00 H new ATOM 209 N LEU A 37 -89.501 0.340 -33.216 1.00 0.00 N ATOM 210 CA LEU A 37 -88.094 0.067 -33.423 1.00 0.00 C ATOM 211 C LEU A 37 -87.273 1.043 -32.603 1.00 0.00 C ATOM 212 O LEU A 37 -87.595 2.234 -32.538 1.00 0.00 O ATOM 213 CB LEU A 37 -87.753 0.206 -34.898 1.00 0.00 C ATOM 214 CG LEU A 37 -88.704 -0.535 -35.819 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.468 -0.124 -37.252 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.526 -2.034 -35.651 1.00 0.00 C ATOM 0 H LEU A 37 -89.842 1.172 -33.698 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.867 -0.951 -33.107 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.755 1.263 -35.164 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.741 -0.163 -35.064 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.730 -0.277 -35.555 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -89.156 -0.663 -37.903 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.635 0.948 -37.355 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.442 -0.360 -37.534 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -89.212 -2.559 -36.316 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.501 -2.309 -35.898 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.737 -2.312 -34.618 1.00 0.00 H new ATOM 228 N THR A 38 -86.225 0.548 -31.976 1.00 0.00 N ATOM 229 CA THR A 38 -85.417 1.371 -31.096 1.00 0.00 C ATOM 230 C THR A 38 -83.970 0.900 -31.143 1.00 0.00 C ATOM 231 O THR A 38 -83.655 -0.070 -31.842 1.00 0.00 O ATOM 232 CB THR A 38 -85.934 1.316 -29.640 1.00 0.00 C ATOM 233 OG1 THR A 38 -87.329 0.989 -29.614 1.00 0.00 O ATOM 234 CG2 THR A 38 -85.737 2.654 -28.941 1.00 0.00 C ATOM 0 H THR A 38 -85.912 -0.419 -32.059 1.00 0.00 H new ATOM 0 HA THR A 38 -85.484 2.403 -31.440 1.00 0.00 H new ATOM 0 HB THR A 38 -85.363 0.547 -29.120 1.00 0.00 H new ATOM 0 HG1 THR A 38 -87.837 1.688 -30.076 1.00 0.00 H new ATOM 0 HG21 THR A 38 -86.109 2.589 -27.918 1.00 0.00 H new ATOM 0 HG22 THR A 38 -84.676 2.904 -28.926 1.00 0.00 H new ATOM 0 HG23 THR A 38 -86.285 3.429 -29.477 1.00 0.00 H new ATOM 242 N ARG A 39 -83.091 1.606 -30.426 1.00 0.00 N ATOM 243 CA ARG A 39 -81.670 1.265 -30.354 1.00 0.00 C ATOM 244 C ARG A 39 -81.027 1.469 -31.721 1.00 0.00 C ATOM 245 O ARG A 39 -79.910 1.023 -31.976 1.00 0.00 O ATOM 246 CB ARG A 39 -81.470 -0.181 -29.873 1.00 0.00 C ATOM 247 CG ARG A 39 -82.309 -0.552 -28.655 1.00 0.00 C ATOM 248 CD ARG A 39 -81.949 0.269 -27.425 1.00 0.00 C ATOM 249 NE ARG A 39 -82.836 -0.035 -26.301 1.00 0.00 N ATOM 250 CZ ARG A 39 -82.444 -0.113 -25.029 1.00 0.00 C ATOM 251 NH1 ARG A 39 -81.175 0.105 -24.695 1.00 0.00 N ATOM 252 NH2 ARG A 39 -83.331 -0.404 -24.087 1.00 0.00 N ATOM 0 H ARG A 39 -83.346 2.429 -29.880 1.00 0.00 H new ATOM 0 HA ARG A 39 -81.190 1.922 -29.629 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -81.713 -0.861 -30.689 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -80.417 -0.331 -29.635 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -83.364 -0.408 -28.888 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -82.173 -1.611 -28.433 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -80.916 0.067 -27.140 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -82.012 1.331 -27.663 1.00 0.00 H new ATOM 0 HE ARG A 39 -83.822 -0.198 -26.505 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -80.490 0.335 -25.415 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -80.887 0.043 -23.719 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -84.306 -0.567 -24.338 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -83.038 -0.465 -23.112 1.00 0.00 H new ATOM 266 N SER A 40 -81.750 2.168 -32.587 1.00 0.00 N ATOM 267 CA SER A 40 -81.322 2.412 -33.949 1.00 0.00 C ATOM 268 C SER A 40 -81.628 3.863 -34.319 1.00 0.00 C ATOM 269 O SER A 40 -82.194 4.600 -33.511 1.00 0.00 O ATOM 270 CB SER A 40 -82.042 1.449 -34.893 1.00 0.00 C ATOM 271 OG SER A 40 -82.004 0.123 -34.385 1.00 0.00 O ATOM 0 H SER A 40 -82.654 2.582 -32.358 1.00 0.00 H new ATOM 0 HA SER A 40 -80.249 2.244 -34.039 1.00 0.00 H new ATOM 0 HB2 SER A 40 -83.077 1.765 -35.022 1.00 0.00 H new ATOM 0 HB3 SER A 40 -81.575 1.480 -35.877 1.00 0.00 H new ATOM 0 HG SER A 40 -82.588 0.056 -33.601 1.00 0.00 H new ATOM 277 N ASN A 41 -81.270 4.269 -35.528 1.00 0.00 N ATOM 278 CA ASN A 41 -81.424 5.664 -35.945 1.00 0.00 C ATOM 279 C ASN A 41 -82.744 5.906 -36.673 1.00 0.00 C ATOM 280 O ASN A 41 -82.885 6.899 -37.389 1.00 0.00 O ATOM 281 CB ASN A 41 -80.261 6.078 -36.854 1.00 0.00 C ATOM 282 CG ASN A 41 -78.953 6.256 -36.106 1.00 0.00 C ATOM 283 OD1 ASN A 41 -78.705 5.609 -35.087 1.00 0.00 O ATOM 284 ND2 ASN A 41 -78.104 7.134 -36.615 1.00 0.00 N ATOM 0 H ASN A 41 -80.871 3.657 -36.240 1.00 0.00 H new ATOM 0 HA ASN A 41 -81.423 6.269 -35.039 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -80.129 5.324 -37.630 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -80.515 7.011 -37.356 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -77.205 7.296 -36.162 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -78.349 7.649 -37.461 1.00 0.00 H new ATOM 291 N SER A 42 -83.709 5.016 -36.501 1.00 0.00 N ATOM 292 CA SER A 42 -84.995 5.172 -37.169 1.00 0.00 C ATOM 293 C SER A 42 -86.131 4.524 -36.386 1.00 0.00 C ATOM 294 O SER A 42 -86.033 3.380 -35.951 1.00 0.00 O ATOM 295 CB SER A 42 -84.928 4.596 -38.586 1.00 0.00 C ATOM 296 OG SER A 42 -83.932 5.246 -39.362 1.00 0.00 O ATOM 0 H SER A 42 -83.630 4.187 -35.912 1.00 0.00 H new ATOM 0 HA SER A 42 -85.208 6.240 -37.224 1.00 0.00 H new ATOM 0 HB2 SER A 42 -84.714 3.528 -38.537 1.00 0.00 H new ATOM 0 HB3 SER A 42 -85.898 4.705 -39.071 1.00 0.00 H new ATOM 0 HG SER A 42 -83.911 4.856 -40.261 1.00 0.00 H new ATOM 302 N LYS A 43 -87.206 5.279 -36.202 1.00 0.00 N ATOM 303 CA LYS A 43 -88.435 4.738 -35.640 1.00 0.00 C ATOM 304 C LYS A 43 -88.996 3.708 -36.604 1.00 0.00 C ATOM 305 O LYS A 43 -89.618 2.727 -36.205 1.00 0.00 O ATOM 306 CB LYS A 43 -89.474 5.845 -35.444 1.00 0.00 C ATOM 307 CG LYS A 43 -88.987 7.039 -34.641 1.00 0.00 C ATOM 308 CD LYS A 43 -89.990 8.181 -34.706 1.00 0.00 C ATOM 309 CE LYS A 43 -90.239 8.620 -36.142 1.00 0.00 C ATOM 310 NZ LYS A 43 -91.323 9.630 -36.240 1.00 0.00 N ATOM 0 H LYS A 43 -87.251 6.271 -36.435 1.00 0.00 H new ATOM 0 HA LYS A 43 -88.214 4.287 -34.673 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -89.803 6.193 -36.423 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -90.346 5.421 -34.946 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -88.831 6.745 -33.603 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -88.024 7.373 -35.026 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -90.930 7.868 -34.251 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -89.620 9.026 -34.125 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -89.320 9.034 -36.558 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -90.499 7.751 -36.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -91.458 9.899 -37.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -92.207 9.228 -35.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -91.065 10.471 -35.686 1.00 0.00 H new ATOM 324 N CYS A 44 -88.757 3.954 -37.885 1.00 0.00 N ATOM 325 CA CYS A 44 -89.274 3.106 -38.941 1.00 0.00 C ATOM 326 C CYS A 44 -88.161 2.226 -39.523 1.00 0.00 C ATOM 327 O CYS A 44 -88.304 1.675 -40.611 1.00 0.00 O ATOM 328 CB CYS A 44 -89.917 3.976 -40.029 1.00 0.00 C ATOM 329 SG CYS A 44 -90.603 5.541 -39.398 1.00 0.00 S ATOM 0 H CYS A 44 -88.202 4.743 -38.216 1.00 0.00 H new ATOM 0 HA CYS A 44 -90.034 2.443 -38.528 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -89.172 4.197 -40.793 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.712 3.409 -40.513 1.00 0.00 H new ATOM 334 N GLN A 45 -87.055 2.090 -38.786 1.00 0.00 N ATOM 335 CA GLN A 45 -86.003 1.123 -39.125 1.00 0.00 C ATOM 336 C GLN A 45 -85.158 0.810 -37.887 1.00 0.00 C ATOM 337 O GLN A 45 -84.550 1.707 -37.307 1.00 0.00 O ATOM 338 CB GLN A 45 -85.109 1.663 -40.245 1.00 0.00 C ATOM 339 CG GLN A 45 -83.879 0.810 -40.506 1.00 0.00 C ATOM 340 CD GLN A 45 -82.958 1.419 -41.540 1.00 0.00 C ATOM 341 OE1 GLN A 45 -83.076 1.144 -42.731 1.00 0.00 O ATOM 342 NE2 GLN A 45 -82.038 2.257 -41.094 1.00 0.00 N ATOM 0 H GLN A 45 -86.863 2.639 -37.948 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.479 0.207 -39.475 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -85.693 1.734 -41.163 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -84.792 2.674 -39.990 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -83.332 0.673 -39.573 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -84.192 -0.179 -40.841 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -81.973 2.459 -40.096 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -81.393 2.702 -41.748 1.00 0.00 H new ATOM 351 N GLY A 46 -85.077 -0.463 -37.515 1.00 0.00 N ATOM 352 CA GLY A 46 -84.389 -0.816 -36.286 1.00 0.00 C ATOM 353 C GLY A 46 -84.733 -2.205 -35.798 1.00 0.00 C ATOM 354 O GLY A 46 -85.492 -2.927 -36.441 1.00 0.00 O ATOM 0 H GLY A 46 -85.470 -1.248 -38.034 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.313 -0.748 -36.446 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.643 -0.091 -35.512 1.00 0.00 H new ATOM 358 N GLN A 47 -84.135 -2.599 -34.686 1.00 0.00 N ATOM 359 CA GLN A 47 -84.511 -3.837 -34.026 1.00 0.00 C ATOM 360 C GLN A 47 -85.780 -3.606 -33.212 1.00 0.00 C ATOM 361 O GLN A 47 -85.969 -2.526 -32.645 1.00 0.00 O ATOM 362 CB GLN A 47 -83.372 -4.347 -33.136 1.00 0.00 C ATOM 363 CG GLN A 47 -82.204 -4.926 -33.923 1.00 0.00 C ATOM 364 CD GLN A 47 -82.591 -6.169 -34.701 1.00 0.00 C ATOM 365 OE1 GLN A 47 -82.483 -7.288 -34.205 1.00 0.00 O ATOM 366 NE2 GLN A 47 -83.049 -5.980 -35.927 1.00 0.00 N ATOM 0 H GLN A 47 -83.389 -2.081 -34.223 1.00 0.00 H new ATOM 0 HA GLN A 47 -84.705 -4.602 -34.778 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -83.011 -3.527 -32.515 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -83.761 -5.111 -32.462 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -81.825 -4.172 -34.613 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -81.392 -5.168 -33.238 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -83.124 -5.035 -36.303 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -83.327 -6.779 -36.496 1.00 0.00 H new ATOM 375 N LEU A 48 -86.648 -4.609 -33.169 1.00 0.00 N ATOM 376 CA LEU A 48 -87.959 -4.458 -32.547 1.00 0.00 C ATOM 377 C LEU A 48 -87.855 -4.401 -31.031 1.00 0.00 C ATOM 378 O LEU A 48 -87.367 -5.330 -30.387 1.00 0.00 O ATOM 379 CB LEU A 48 -88.889 -5.601 -32.967 1.00 0.00 C ATOM 380 CG LEU A 48 -90.337 -5.487 -32.473 1.00 0.00 C ATOM 381 CD1 LEU A 48 -91.026 -4.284 -33.097 1.00 0.00 C ATOM 382 CD2 LEU A 48 -91.109 -6.760 -32.785 1.00 0.00 C ATOM 0 H LEU A 48 -86.469 -5.535 -33.557 1.00 0.00 H new ATOM 0 HA LEU A 48 -88.378 -3.513 -32.892 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -88.898 -5.658 -34.055 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -88.471 -6.539 -32.602 1.00 0.00 H new ATOM 0 HG LEU A 48 -90.318 -5.349 -31.392 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -92.051 -4.223 -32.733 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.489 -3.375 -32.825 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -91.032 -4.390 -34.182 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -92.134 -6.661 -32.427 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -91.115 -6.927 -33.862 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.632 -7.606 -32.289 1.00 0.00 H new ATOM 394 N GLU A 49 -88.319 -3.294 -30.477 1.00 0.00 N ATOM 395 CA GLU A 49 -88.393 -3.119 -29.043 1.00 0.00 C ATOM 396 C GLU A 49 -89.861 -2.988 -28.651 1.00 0.00 C ATOM 397 O GLU A 49 -90.560 -2.085 -29.117 1.00 0.00 O ATOM 398 CB GLU A 49 -87.603 -1.879 -28.621 1.00 0.00 C ATOM 399 CG GLU A 49 -87.433 -1.726 -27.119 1.00 0.00 C ATOM 400 CD GLU A 49 -86.761 -0.418 -26.743 1.00 0.00 C ATOM 401 OE1 GLU A 49 -87.466 0.613 -26.654 1.00 0.00 O ATOM 402 OE2 GLU A 49 -85.527 -0.407 -26.542 1.00 0.00 O ATOM 0 H GLU A 49 -88.654 -2.493 -31.012 1.00 0.00 H new ATOM 0 HA GLU A 49 -87.955 -3.978 -28.535 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -86.617 -1.916 -29.084 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -88.105 -0.993 -29.010 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -88.410 -1.781 -26.638 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -86.842 -2.558 -26.736 1.00 0.00 H new ATOM 409 N VAL A 50 -90.330 -3.908 -27.827 1.00 0.00 N ATOM 410 CA VAL A 50 -91.744 -3.972 -27.483 1.00 0.00 C ATOM 411 C VAL A 50 -91.959 -3.917 -25.980 1.00 0.00 C ATOM 412 O VAL A 50 -91.253 -4.574 -25.217 1.00 0.00 O ATOM 413 CB VAL A 50 -92.395 -5.247 -28.050 1.00 0.00 C ATOM 414 CG1 VAL A 50 -92.629 -5.097 -29.540 1.00 0.00 C ATOM 415 CG2 VAL A 50 -91.524 -6.464 -27.775 1.00 0.00 C ATOM 0 H VAL A 50 -89.754 -4.623 -27.382 1.00 0.00 H new ATOM 0 HA VAL A 50 -92.218 -3.099 -27.932 1.00 0.00 H new ATOM 0 HB VAL A 50 -93.355 -5.392 -27.554 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -93.090 -6.005 -29.929 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -93.289 -4.249 -29.721 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -91.677 -4.929 -30.043 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -92.003 -7.354 -28.184 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -90.550 -6.328 -28.244 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -91.395 -6.583 -26.699 1.00 0.00 H new ATOM 425 N TYR A 51 -92.940 -3.138 -25.557 1.00 0.00 N ATOM 426 CA TYR A 51 -93.203 -2.959 -24.139 1.00 0.00 C ATOM 427 C TYR A 51 -94.281 -3.914 -23.673 1.00 0.00 C ATOM 428 O TYR A 51 -95.467 -3.584 -23.674 1.00 0.00 O ATOM 429 CB TYR A 51 -93.620 -1.520 -23.833 1.00 0.00 C ATOM 430 CG TYR A 51 -93.754 -1.216 -22.352 1.00 0.00 C ATOM 431 CD1 TYR A 51 -92.835 -1.711 -21.433 1.00 0.00 C ATOM 432 CD2 TYR A 51 -94.791 -0.420 -21.879 1.00 0.00 C ATOM 433 CE1 TYR A 51 -92.948 -1.423 -20.087 1.00 0.00 C ATOM 434 CE2 TYR A 51 -94.910 -0.130 -20.533 1.00 0.00 C ATOM 435 CZ TYR A 51 -93.986 -0.633 -19.641 1.00 0.00 C ATOM 436 OH TYR A 51 -94.092 -0.338 -18.300 1.00 0.00 O ATOM 0 H TYR A 51 -93.566 -2.620 -26.174 1.00 0.00 H new ATOM 0 HA TYR A 51 -92.279 -3.174 -23.602 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -92.887 -0.840 -24.268 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -94.573 -1.317 -24.322 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -92.020 -2.330 -21.777 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -95.515 -0.022 -22.574 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -92.226 -1.815 -19.386 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -95.723 0.488 -20.181 1.00 0.00 H new ATOM 0 HH TYR A 51 -94.877 0.230 -18.151 1.00 0.00 H new ATOM 446 N LEU A 52 -93.869 -5.107 -23.300 1.00 0.00 N ATOM 447 CA LEU A 52 -94.796 -6.076 -22.759 1.00 0.00 C ATOM 448 C LEU A 52 -94.763 -6.075 -21.254 1.00 0.00 C ATOM 449 O LEU A 52 -94.087 -6.900 -20.653 1.00 0.00 O ATOM 450 CB LEU A 52 -94.529 -7.482 -23.283 1.00 0.00 C ATOM 451 CG LEU A 52 -93.065 -7.848 -23.540 1.00 0.00 C ATOM 452 CD1 LEU A 52 -92.547 -8.759 -22.440 1.00 0.00 C ATOM 453 CD2 LEU A 52 -92.912 -8.516 -24.897 1.00 0.00 C ATOM 0 H LEU A 52 -92.903 -5.427 -23.361 1.00 0.00 H new ATOM 0 HA LEU A 52 -95.790 -5.778 -23.093 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -94.939 -8.196 -22.569 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -95.081 -7.610 -24.214 1.00 0.00 H new ATOM 0 HG LEU A 52 -92.475 -6.931 -23.539 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -91.505 -9.011 -22.637 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -92.622 -8.249 -21.480 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -93.142 -9.672 -22.413 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -91.865 -8.769 -25.062 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -93.513 -9.425 -24.925 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -93.248 -7.834 -25.678 1.00 0.00 H new ATOM 465 N LYS A 53 -95.461 -5.096 -20.682 1.00 0.00 N ATOM 466 CA LYS A 53 -95.701 -4.976 -19.238 1.00 0.00 C ATOM 467 C LYS A 53 -94.419 -4.925 -18.396 1.00 0.00 C ATOM 468 O LYS A 53 -94.161 -3.936 -17.711 1.00 0.00 O ATOM 469 CB LYS A 53 -96.614 -6.107 -18.753 1.00 0.00 C ATOM 470 CG LYS A 53 -98.013 -6.047 -19.354 1.00 0.00 C ATOM 471 CD LYS A 53 -98.928 -7.121 -18.783 1.00 0.00 C ATOM 472 CE LYS A 53 -99.198 -6.908 -17.301 1.00 0.00 C ATOM 473 NZ LYS A 53 -99.867 -5.605 -17.035 1.00 0.00 N ATOM 0 H LYS A 53 -95.888 -4.343 -21.221 1.00 0.00 H new ATOM 0 HA LYS A 53 -96.194 -4.014 -19.094 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -96.159 -7.065 -19.003 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -96.690 -6.064 -17.667 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -98.446 -5.065 -19.166 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -97.948 -6.164 -20.436 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -99.872 -7.120 -19.328 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -98.475 -8.101 -18.932 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -99.823 -7.719 -16.927 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -98.257 -6.951 -16.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -100.243 -5.600 -16.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -99.179 -4.833 -17.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -100.647 -5.471 -17.710 1.00 0.00 H new ATOM 487 N ASP A 54 -93.617 -5.975 -18.458 1.00 0.00 N ATOM 488 CA ASP A 54 -92.471 -6.110 -17.568 1.00 0.00 C ATOM 489 C ASP A 54 -91.180 -5.681 -18.254 1.00 0.00 C ATOM 490 O ASP A 54 -90.198 -5.346 -17.589 1.00 0.00 O ATOM 491 CB ASP A 54 -92.331 -7.553 -17.054 1.00 0.00 C ATOM 492 CG ASP A 54 -91.758 -8.515 -18.081 1.00 0.00 C ATOM 493 OD1 ASP A 54 -90.515 -8.661 -18.143 1.00 0.00 O ATOM 494 OD2 ASP A 54 -92.546 -9.154 -18.807 1.00 0.00 O ATOM 0 H ASP A 54 -93.736 -6.747 -19.114 1.00 0.00 H new ATOM 0 HA ASP A 54 -92.649 -5.451 -16.718 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -91.691 -7.554 -16.172 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -93.310 -7.913 -16.738 1.00 0.00 H new ATOM 499 N GLY A 55 -91.175 -5.676 -19.582 1.00 0.00 N ATOM 500 CA GLY A 55 -89.940 -5.382 -20.285 1.00 0.00 C ATOM 501 C GLY A 55 -90.135 -4.772 -21.648 1.00 0.00 C ATOM 502 O GLY A 55 -90.886 -5.306 -22.468 1.00 0.00 O ATOM 0 H GLY A 55 -91.984 -5.866 -20.174 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -89.342 -4.702 -19.677 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -89.367 -6.303 -20.390 1.00 0.00 H new ATOM 506 N TRP A 56 -89.467 -3.640 -21.878 1.00 0.00 N ATOM 507 CA TRP A 56 -89.229 -3.153 -23.231 1.00 0.00 C ATOM 508 C TRP A 56 -88.236 -4.096 -23.889 1.00 0.00 C ATOM 509 O TRP A 56 -87.044 -3.807 -23.969 1.00 0.00 O ATOM 510 CB TRP A 56 -88.660 -1.727 -23.235 1.00 0.00 C ATOM 511 CG TRP A 56 -89.689 -0.641 -23.348 1.00 0.00 C ATOM 512 CD1 TRP A 56 -90.106 0.207 -22.363 1.00 0.00 C ATOM 513 CD2 TRP A 56 -90.414 -0.275 -24.527 1.00 0.00 C ATOM 514 NE1 TRP A 56 -91.054 1.072 -22.856 1.00 0.00 N ATOM 515 CE2 TRP A 56 -91.261 0.794 -24.184 1.00 0.00 C ATOM 516 CE3 TRP A 56 -90.432 -0.753 -25.839 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -92.117 1.392 -25.111 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -91.279 -0.162 -26.754 1.00 0.00 C ATOM 519 CH2 TRP A 56 -92.112 0.900 -26.390 1.00 0.00 C ATOM 0 H TRP A 56 -89.083 -3.046 -21.143 1.00 0.00 H new ATOM 0 HA TRP A 56 -90.175 -3.124 -23.772 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -88.091 -1.575 -22.318 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -87.959 -1.632 -24.065 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -89.744 0.200 -21.345 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -91.526 1.801 -22.322 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -89.793 -1.573 -26.133 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -92.760 2.213 -24.830 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -91.299 -0.527 -27.770 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -92.763 1.341 -27.130 1.00 0.00 H new ATOM 530 N HIS A 57 -88.726 -5.245 -24.309 1.00 0.00 N ATOM 531 CA HIS A 57 -87.859 -6.319 -24.735 1.00 0.00 C ATOM 532 C HIS A 57 -87.289 -6.055 -26.118 1.00 0.00 C ATOM 533 O HIS A 57 -88.026 -5.743 -27.053 1.00 0.00 O ATOM 534 CB HIS A 57 -88.599 -7.659 -24.713 1.00 0.00 C ATOM 535 CG HIS A 57 -88.582 -8.328 -23.375 1.00 0.00 C ATOM 536 ND1 HIS A 57 -89.514 -8.075 -22.395 1.00 0.00 N ATOM 537 CD2 HIS A 57 -87.739 -9.254 -22.856 1.00 0.00 C ATOM 538 CE1 HIS A 57 -89.245 -8.812 -21.332 1.00 0.00 C ATOM 539 NE2 HIS A 57 -88.174 -9.535 -21.588 1.00 0.00 N ATOM 0 H HIS A 57 -89.722 -5.457 -24.364 1.00 0.00 H new ATOM 0 HA HIS A 57 -87.029 -6.368 -24.030 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.633 -7.499 -25.017 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -88.150 -8.325 -25.449 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -90.292 -7.420 -22.476 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -86.883 -9.689 -23.351 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -89.807 -8.820 -20.410 1.00 0.00 H new ATOM 548 N MET A 58 -85.976 -6.170 -26.229 1.00 0.00 N ATOM 549 CA MET A 58 -85.298 -6.019 -27.506 1.00 0.00 C ATOM 550 C MET A 58 -85.252 -7.364 -28.210 1.00 0.00 C ATOM 551 O MET A 58 -84.413 -8.207 -27.888 1.00 0.00 O ATOM 552 CB MET A 58 -83.873 -5.500 -27.299 1.00 0.00 C ATOM 553 CG MET A 58 -83.803 -4.141 -26.624 1.00 0.00 C ATOM 554 SD MET A 58 -82.119 -3.680 -26.169 1.00 0.00 S ATOM 555 CE MET A 58 -81.290 -3.821 -27.750 1.00 0.00 C ATOM 0 H MET A 58 -85.355 -6.369 -25.445 1.00 0.00 H new ATOM 0 HA MET A 58 -85.846 -5.299 -28.115 1.00 0.00 H new ATOM 0 HB2 MET A 58 -83.318 -6.221 -26.699 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.375 -5.440 -28.267 1.00 0.00 H new ATOM 0 HG2 MET A 58 -84.215 -3.385 -27.293 1.00 0.00 H new ATOM 0 HG3 MET A 58 -84.427 -4.150 -25.731 1.00 0.00 H new ATOM 0 HE1 MET A 58 -80.595 -2.990 -27.872 1.00 0.00 H new ATOM 0 HE2 MET A 58 -80.741 -4.762 -27.791 1.00 0.00 H new ATOM 0 HE3 MET A 58 -82.028 -3.797 -28.551 1.00 0.00 H new ATOM 565 N VAL A 59 -86.154 -7.575 -29.153 1.00 0.00 N ATOM 566 CA VAL A 59 -86.269 -8.878 -29.788 1.00 0.00 C ATOM 567 C VAL A 59 -85.447 -8.920 -31.067 1.00 0.00 C ATOM 568 O VAL A 59 -85.131 -7.880 -31.646 1.00 0.00 O ATOM 569 CB VAL A 59 -87.737 -9.242 -30.117 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.640 -9.019 -28.915 1.00 0.00 C ATOM 571 CG2 VAL A 59 -88.240 -8.456 -31.311 1.00 0.00 C ATOM 0 H VAL A 59 -86.810 -6.872 -29.493 1.00 0.00 H new ATOM 0 HA VAL A 59 -85.889 -9.610 -29.075 1.00 0.00 H new ATOM 0 HB VAL A 59 -87.763 -10.302 -30.371 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -89.665 -9.283 -29.176 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.304 -9.643 -28.087 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -88.600 -7.971 -28.619 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -89.274 -8.732 -31.519 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -88.186 -7.389 -31.093 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.622 -8.680 -32.181 1.00 0.00 H new ATOM 581 N CYS A 60 -85.106 -10.121 -31.507 1.00 0.00 N ATOM 582 CA CYS A 60 -84.400 -10.289 -32.766 1.00 0.00 C ATOM 583 C CYS A 60 -85.366 -10.471 -33.939 1.00 0.00 C ATOM 584 O CYS A 60 -84.995 -11.020 -34.979 1.00 0.00 O ATOM 585 CB CYS A 60 -83.394 -11.444 -32.679 1.00 0.00 C ATOM 586 SG CYS A 60 -83.775 -12.758 -31.511 1.00 0.00 S ATOM 0 H CYS A 60 -85.306 -10.990 -31.013 1.00 0.00 H new ATOM 0 HA CYS A 60 -83.841 -9.373 -32.956 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -83.297 -11.887 -33.670 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -82.420 -11.029 -32.419 1.00 0.00 H new ATOM 591 N SER A 61 -86.601 -9.983 -33.756 1.00 0.00 N ATOM 592 CA SER A 61 -87.633 -9.939 -34.807 1.00 0.00 C ATOM 593 C SER A 61 -88.179 -11.329 -35.157 1.00 0.00 C ATOM 594 O SER A 61 -89.390 -11.518 -35.240 1.00 0.00 O ATOM 595 CB SER A 61 -87.090 -9.253 -36.062 1.00 0.00 C ATOM 596 OG SER A 61 -86.577 -7.966 -35.753 1.00 0.00 O ATOM 0 H SER A 61 -86.917 -9.603 -32.864 1.00 0.00 H new ATOM 0 HA SER A 61 -88.465 -9.359 -34.408 1.00 0.00 H new ATOM 0 HB2 SER A 61 -86.305 -9.865 -36.505 1.00 0.00 H new ATOM 0 HB3 SER A 61 -87.883 -9.164 -36.805 1.00 0.00 H new ATOM 0 HG SER A 61 -85.705 -7.849 -36.185 1.00 0.00 H new ATOM 602 N GLN A 62 -87.286 -12.297 -35.339 1.00 0.00 N ATOM 603 CA GLN A 62 -87.665 -13.654 -35.736 1.00 0.00 C ATOM 604 C GLN A 62 -88.280 -14.435 -34.581 1.00 0.00 C ATOM 605 O GLN A 62 -88.635 -15.604 -34.731 1.00 0.00 O ATOM 606 CB GLN A 62 -86.440 -14.403 -36.282 1.00 0.00 C ATOM 607 CG GLN A 62 -85.187 -14.314 -35.404 1.00 0.00 C ATOM 608 CD GLN A 62 -85.351 -14.935 -34.024 1.00 0.00 C ATOM 609 OE1 GLN A 62 -85.723 -14.259 -33.067 1.00 0.00 O ATOM 610 NE2 GLN A 62 -85.069 -16.219 -33.911 1.00 0.00 N ATOM 0 H GLN A 62 -86.282 -12.166 -35.217 1.00 0.00 H new ATOM 0 HA GLN A 62 -88.421 -13.569 -36.516 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -86.702 -15.453 -36.411 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -86.202 -14.010 -37.270 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -84.361 -14.807 -35.917 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -84.911 -13.266 -35.289 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -84.763 -16.748 -34.728 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -85.157 -16.683 -33.007 1.00 0.00 H new ATOM 619 N SER A 63 -88.386 -13.784 -33.434 1.00 0.00 N ATOM 620 CA SER A 63 -88.862 -14.424 -32.224 1.00 0.00 C ATOM 621 C SER A 63 -90.308 -14.894 -32.399 1.00 0.00 C ATOM 622 O SER A 63 -91.011 -14.403 -33.289 1.00 0.00 O ATOM 623 CB SER A 63 -88.740 -13.439 -31.066 1.00 0.00 C ATOM 624 OG SER A 63 -87.410 -12.950 -30.958 1.00 0.00 O ATOM 0 H SER A 63 -88.145 -12.800 -33.318 1.00 0.00 H new ATOM 0 HA SER A 63 -88.257 -15.305 -32.010 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.427 -12.607 -31.217 1.00 0.00 H new ATOM 0 HB3 SER A 63 -89.030 -13.927 -30.135 1.00 0.00 H new ATOM 0 HG SER A 63 -86.843 -13.396 -31.621 1.00 0.00 H new ATOM 630 N TRP A 64 -90.746 -15.834 -31.548 1.00 0.00 N ATOM 631 CA TRP A 64 -92.072 -16.461 -31.660 1.00 0.00 C ATOM 632 C TRP A 64 -92.115 -17.433 -32.843 1.00 0.00 C ATOM 633 O TRP A 64 -92.398 -18.622 -32.672 1.00 0.00 O ATOM 634 CB TRP A 64 -93.189 -15.412 -31.785 1.00 0.00 C ATOM 635 CG TRP A 64 -93.360 -14.567 -30.555 1.00 0.00 C ATOM 636 CD1 TRP A 64 -94.112 -14.869 -29.460 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.766 -13.287 -30.291 1.00 0.00 C ATOM 638 NE1 TRP A 64 -94.025 -13.861 -28.534 1.00 0.00 N ATOM 639 CE2 TRP A 64 -93.201 -12.881 -29.018 1.00 0.00 C ATOM 640 CE3 TRP A 64 -91.907 -12.446 -31.005 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.807 -11.675 -28.445 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.512 -11.252 -30.434 1.00 0.00 C ATOM 643 CH2 TRP A 64 -91.960 -10.876 -29.165 1.00 0.00 C ATOM 0 H TRP A 64 -90.193 -16.180 -30.764 1.00 0.00 H new ATOM 0 HA TRP A 64 -92.245 -17.021 -30.741 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -92.974 -14.763 -32.634 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -94.129 -15.919 -32.001 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.693 -15.772 -29.339 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.498 -13.844 -27.630 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.558 -12.726 -31.988 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -93.157 -11.380 -27.467 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -90.846 -10.598 -30.977 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.632 -9.937 -28.744 1.00 0.00 H new ATOM 654 N GLY A 65 -91.834 -16.923 -34.033 1.00 0.00 N ATOM 655 CA GLY A 65 -91.755 -17.759 -35.213 1.00 0.00 C ATOM 656 C GLY A 65 -90.404 -18.441 -35.343 1.00 0.00 C ATOM 657 O GLY A 65 -89.990 -19.183 -34.451 1.00 0.00 O ATOM 0 H GLY A 65 -91.657 -15.933 -34.203 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -92.539 -18.515 -35.174 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -91.941 -17.152 -36.099 1.00 0.00 H new ATOM 661 N ARG A 66 -89.713 -18.188 -36.451 1.00 0.00 N ATOM 662 CA ARG A 66 -88.409 -18.801 -36.701 1.00 0.00 C ATOM 663 C ARG A 66 -87.476 -17.817 -37.400 1.00 0.00 C ATOM 664 O ARG A 66 -87.931 -16.841 -38.002 1.00 0.00 O ATOM 665 CB ARG A 66 -88.548 -20.051 -37.575 1.00 0.00 C ATOM 666 CG ARG A 66 -89.402 -21.154 -36.972 1.00 0.00 C ATOM 667 CD ARG A 66 -89.427 -22.373 -37.874 1.00 0.00 C ATOM 668 NE ARG A 66 -90.393 -23.377 -37.434 1.00 0.00 N ATOM 669 CZ ARG A 66 -90.739 -24.434 -38.169 1.00 0.00 C ATOM 670 NH1 ARG A 66 -90.138 -24.654 -39.337 1.00 0.00 N ATOM 671 NH2 ARG A 66 -91.664 -25.281 -37.731 1.00 0.00 N ATOM 0 H ARG A 66 -90.033 -17.563 -37.191 1.00 0.00 H new ATOM 0 HA ARG A 66 -87.991 -19.081 -35.734 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -88.977 -19.761 -38.534 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -87.554 -20.449 -37.777 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -89.010 -21.429 -35.993 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -90.418 -20.790 -36.818 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -89.668 -22.063 -38.891 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -88.433 -22.819 -37.904 1.00 0.00 H new ATOM 0 HE ARG A 66 -90.825 -23.263 -36.517 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -89.415 -24.015 -39.667 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -90.401 -25.462 -39.902 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -92.113 -25.124 -36.829 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -91.925 -26.088 -38.297 1.00 0.00 H new ATOM 685 N SER A 67 -86.177 -18.083 -37.329 1.00 0.00 N ATOM 686 CA SER A 67 -85.185 -17.266 -38.016 1.00 0.00 C ATOM 687 C SER A 67 -85.177 -17.581 -39.511 1.00 0.00 C ATOM 688 O SER A 67 -84.522 -18.526 -39.955 1.00 0.00 O ATOM 689 CB SER A 67 -83.796 -17.510 -37.421 1.00 0.00 C ATOM 690 OG SER A 67 -83.784 -17.234 -36.031 1.00 0.00 O ATOM 0 H SER A 67 -85.785 -18.862 -36.800 1.00 0.00 H new ATOM 0 HA SER A 67 -85.448 -16.217 -37.882 1.00 0.00 H new ATOM 0 HB2 SER A 67 -83.499 -18.545 -37.593 1.00 0.00 H new ATOM 0 HB3 SER A 67 -83.064 -16.881 -37.927 1.00 0.00 H new ATOM 0 HG SER A 67 -83.853 -18.074 -35.530 1.00 0.00 H new ATOM 696 N SER A 68 -85.925 -16.805 -40.280 1.00 0.00 N ATOM 697 CA SER A 68 -86.054 -17.047 -41.709 1.00 0.00 C ATOM 698 C SER A 68 -85.227 -16.038 -42.505 1.00 0.00 C ATOM 699 O SER A 68 -84.516 -15.207 -41.932 1.00 0.00 O ATOM 700 CB SER A 68 -87.529 -16.972 -42.117 1.00 0.00 C ATOM 701 OG SER A 68 -87.733 -17.496 -43.419 1.00 0.00 O ATOM 0 H SER A 68 -86.452 -16.002 -39.938 1.00 0.00 H new ATOM 0 HA SER A 68 -85.675 -18.044 -41.931 1.00 0.00 H new ATOM 0 HB2 SER A 68 -88.135 -17.527 -41.401 1.00 0.00 H new ATOM 0 HB3 SER A 68 -87.865 -15.936 -42.083 1.00 0.00 H new ATOM 0 HG SER A 68 -88.683 -17.436 -43.651 1.00 0.00 H new ATOM 707 N LYS A 69 -85.327 -16.115 -43.824 1.00 0.00 N ATOM 708 CA LYS A 69 -84.594 -15.219 -44.705 1.00 0.00 C ATOM 709 C LYS A 69 -85.558 -14.326 -45.475 1.00 0.00 C ATOM 710 O LYS A 69 -86.513 -14.812 -46.084 1.00 0.00 O ATOM 711 CB LYS A 69 -83.724 -16.012 -45.686 1.00 0.00 C ATOM 712 CG LYS A 69 -83.054 -15.145 -46.745 1.00 0.00 C ATOM 713 CD LYS A 69 -82.236 -15.975 -47.720 1.00 0.00 C ATOM 714 CE LYS A 69 -81.703 -15.130 -48.869 1.00 0.00 C ATOM 715 NZ LYS A 69 -80.821 -14.027 -48.402 1.00 0.00 N ATOM 0 H LYS A 69 -85.913 -16.794 -44.310 1.00 0.00 H new ATOM 0 HA LYS A 69 -83.946 -14.596 -44.089 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -82.956 -16.547 -45.127 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -84.340 -16.763 -46.180 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -83.814 -14.587 -47.292 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -82.408 -14.413 -46.260 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -81.403 -16.440 -47.193 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -82.852 -16.782 -48.117 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -81.149 -15.767 -49.558 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -82.540 -14.710 -49.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -80.390 -13.556 -49.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -81.383 -13.338 -47.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -80.072 -14.415 -47.794 1.00 0.00 H new ATOM 729 N GLN A 70 -85.294 -13.023 -45.437 1.00 0.00 N ATOM 730 CA GLN A 70 -86.082 -12.035 -46.167 1.00 0.00 C ATOM 731 C GLN A 70 -87.516 -11.966 -45.646 1.00 0.00 C ATOM 732 O GLN A 70 -87.744 -11.672 -44.473 1.00 0.00 O ATOM 733 CB GLN A 70 -86.065 -12.320 -47.675 1.00 0.00 C ATOM 734 CG GLN A 70 -84.686 -12.197 -48.298 1.00 0.00 C ATOM 735 CD GLN A 70 -84.671 -12.529 -49.778 1.00 0.00 C ATOM 736 OE1 GLN A 70 -83.869 -11.989 -50.537 1.00 0.00 O ATOM 737 NE2 GLN A 70 -85.553 -13.422 -50.202 1.00 0.00 N ATOM 0 H GLN A 70 -84.526 -12.622 -44.898 1.00 0.00 H new ATOM 0 HA GLN A 70 -85.620 -11.062 -45.999 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -86.446 -13.326 -47.851 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -86.744 -11.629 -48.175 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -84.319 -11.181 -48.156 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -83.997 -12.861 -47.776 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -86.203 -13.849 -49.543 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -85.582 -13.682 -51.188 1.00 0.00 H new ATOM 746 N TRP A 71 -88.480 -12.263 -46.508 1.00 0.00 N ATOM 747 CA TRP A 71 -89.878 -12.049 -46.174 1.00 0.00 C ATOM 748 C TRP A 71 -90.657 -13.357 -46.137 1.00 0.00 C ATOM 749 O TRP A 71 -90.751 -14.066 -47.141 1.00 0.00 O ATOM 750 CB TRP A 71 -90.530 -11.109 -47.192 1.00 0.00 C ATOM 751 CG TRP A 71 -89.780 -9.831 -47.410 1.00 0.00 C ATOM 752 CD1 TRP A 71 -89.794 -8.721 -46.616 1.00 0.00 C ATOM 753 CD2 TRP A 71 -88.908 -9.530 -48.507 1.00 0.00 C ATOM 754 NE1 TRP A 71 -88.981 -7.750 -47.149 1.00 0.00 N ATOM 755 CE2 TRP A 71 -88.427 -8.223 -48.309 1.00 0.00 C ATOM 756 CE3 TRP A 71 -88.488 -10.242 -49.635 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -87.545 -7.614 -49.198 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -87.614 -9.635 -50.516 1.00 0.00 C ATOM 759 CH2 TRP A 71 -87.150 -8.333 -50.293 1.00 0.00 C ATOM 0 H TRP A 71 -88.319 -12.650 -47.438 1.00 0.00 H new ATOM 0 HA TRP A 71 -89.906 -11.601 -45.181 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -90.623 -11.630 -48.145 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -91.540 -10.873 -46.858 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -90.361 -8.621 -45.702 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -88.817 -6.827 -46.746 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -88.840 -11.247 -49.814 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -87.185 -6.610 -49.029 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -87.283 -10.174 -51.392 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -86.466 -7.887 -51.000 1.00 0.00 H new ATOM 770 N GLU A 72 -91.199 -13.678 -44.973 1.00 0.00 N ATOM 771 CA GLU A 72 -92.185 -14.741 -44.866 1.00 0.00 C ATOM 772 C GLU A 72 -93.546 -14.105 -44.605 1.00 0.00 C ATOM 773 O GLU A 72 -94.508 -14.350 -45.328 1.00 0.00 O ATOM 774 CB GLU A 72 -91.810 -15.740 -43.768 1.00 0.00 C ATOM 775 CG GLU A 72 -92.711 -16.964 -43.729 1.00 0.00 C ATOM 776 CD GLU A 72 -92.049 -18.151 -43.061 1.00 0.00 C ATOM 777 OE1 GLU A 72 -92.076 -18.237 -41.820 1.00 0.00 O ATOM 778 OE2 GLU A 72 -91.493 -19.007 -43.786 1.00 0.00 O ATOM 0 H GLU A 72 -90.973 -13.219 -44.091 1.00 0.00 H new ATOM 0 HA GLU A 72 -92.220 -15.307 -45.797 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -90.779 -16.062 -43.917 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -91.850 -15.238 -42.801 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -93.630 -16.718 -43.197 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -92.994 -17.235 -44.746 1.00 0.00 H new ATOM 785 N ASP A 73 -93.610 -13.266 -43.574 1.00 0.00 N ATOM 786 CA ASP A 73 -94.754 -12.381 -43.366 1.00 0.00 C ATOM 787 C ASP A 73 -94.324 -11.158 -42.569 1.00 0.00 C ATOM 788 O ASP A 73 -94.227 -11.205 -41.344 1.00 0.00 O ATOM 789 CB ASP A 73 -95.910 -13.075 -42.643 1.00 0.00 C ATOM 790 CG ASP A 73 -97.188 -12.252 -42.703 1.00 0.00 C ATOM 791 OD1 ASP A 73 -97.219 -11.129 -42.155 1.00 0.00 O ATOM 792 OD2 ASP A 73 -98.170 -12.725 -43.315 1.00 0.00 O ATOM 0 H ASP A 73 -92.880 -13.180 -42.867 1.00 0.00 H new ATOM 0 HA ASP A 73 -95.112 -12.086 -44.352 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -96.085 -14.052 -43.092 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -95.637 -13.247 -41.602 1.00 0.00 H new ATOM 797 N PRO A 74 -94.023 -10.056 -43.262 1.00 0.00 N ATOM 798 CA PRO A 74 -93.645 -8.793 -42.632 1.00 0.00 C ATOM 799 C PRO A 74 -94.851 -7.886 -42.353 1.00 0.00 C ATOM 800 O PRO A 74 -94.695 -6.688 -42.126 1.00 0.00 O ATOM 801 CB PRO A 74 -92.761 -8.180 -43.702 1.00 0.00 C ATOM 802 CG PRO A 74 -93.465 -8.547 -44.948 1.00 0.00 C ATOM 803 CD PRO A 74 -93.991 -9.943 -44.731 1.00 0.00 C ATOM 0 HA PRO A 74 -93.174 -8.926 -41.658 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -92.675 -7.099 -43.588 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -91.749 -8.585 -43.673 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -94.278 -7.852 -45.156 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -92.789 -8.513 -45.803 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -94.981 -10.075 -45.168 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -93.341 -10.694 -45.180 1.00 0.00 H new ATOM 811 N SER A 75 -96.054 -8.457 -42.363 1.00 0.00 N ATOM 812 CA SER A 75 -97.269 -7.652 -42.309 1.00 0.00 C ATOM 813 C SER A 75 -98.077 -7.881 -41.028 1.00 0.00 C ATOM 814 O SER A 75 -99.211 -7.421 -40.913 1.00 0.00 O ATOM 815 CB SER A 75 -98.132 -7.935 -43.545 1.00 0.00 C ATOM 816 OG SER A 75 -98.302 -9.331 -43.758 1.00 0.00 O ATOM 0 H SER A 75 -96.211 -9.464 -42.408 1.00 0.00 H new ATOM 0 HA SER A 75 -96.965 -6.605 -42.301 1.00 0.00 H new ATOM 0 HB2 SER A 75 -99.107 -7.464 -43.424 1.00 0.00 H new ATOM 0 HB3 SER A 75 -97.668 -7.486 -44.423 1.00 0.00 H new ATOM 0 HG SER A 75 -98.100 -9.815 -42.930 1.00 0.00 H new ATOM 822 N GLN A 76 -97.491 -8.553 -40.052 1.00 0.00 N ATOM 823 CA GLN A 76 -98.198 -8.859 -38.807 1.00 0.00 C ATOM 824 C GLN A 76 -98.166 -7.682 -37.823 1.00 0.00 C ATOM 825 O GLN A 76 -98.394 -7.865 -36.630 1.00 0.00 O ATOM 826 CB GLN A 76 -97.593 -10.103 -38.150 1.00 0.00 C ATOM 827 CG GLN A 76 -97.842 -11.392 -38.918 1.00 0.00 C ATOM 828 CD GLN A 76 -99.297 -11.828 -38.890 1.00 0.00 C ATOM 829 OE1 GLN A 76 -99.796 -12.431 -39.840 1.00 0.00 O ATOM 830 NE2 GLN A 76 -99.983 -11.558 -37.792 1.00 0.00 N ATOM 0 H GLN A 76 -96.532 -8.898 -40.091 1.00 0.00 H new ATOM 0 HA GLN A 76 -99.241 -9.049 -39.062 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -96.518 -9.958 -38.043 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -98.003 -10.206 -37.145 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -97.528 -11.258 -39.953 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -97.223 -12.184 -38.497 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -99.538 -11.056 -37.023 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -100.957 -11.852 -37.714 1.00 0.00 H new ATOM 839 N ALA A 77 -97.923 -6.472 -38.330 1.00 0.00 N ATOM 840 CA ALA A 77 -97.789 -5.295 -37.464 1.00 0.00 C ATOM 841 C ALA A 77 -98.149 -4.004 -38.204 1.00 0.00 C ATOM 842 O ALA A 77 -97.623 -2.923 -37.898 1.00 0.00 O ATOM 843 CB ALA A 77 -96.370 -5.213 -36.922 1.00 0.00 C ATOM 0 H ALA A 77 -97.815 -6.280 -39.326 1.00 0.00 H new ATOM 0 HA ALA A 77 -98.489 -5.405 -36.636 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -96.276 -4.337 -36.280 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -96.148 -6.111 -36.346 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.668 -5.132 -37.752 1.00 0.00 H new ATOM 849 N SER A 78 -99.067 -4.117 -39.158 1.00 0.00 N ATOM 850 CA SER A 78 -99.464 -2.983 -39.988 1.00 0.00 C ATOM 851 C SER A 78 -100.011 -1.834 -39.142 1.00 0.00 C ATOM 852 O SER A 78 -99.657 -0.673 -39.353 1.00 0.00 O ATOM 853 CB SER A 78 -100.507 -3.438 -41.008 1.00 0.00 C ATOM 854 OG SER A 78 -100.035 -4.558 -41.737 1.00 0.00 O ATOM 0 H SER A 78 -99.553 -4.987 -39.377 1.00 0.00 H new ATOM 0 HA SER A 78 -98.582 -2.613 -40.510 1.00 0.00 H new ATOM 0 HB2 SER A 78 -101.435 -3.694 -40.498 1.00 0.00 H new ATOM 0 HB3 SER A 78 -100.735 -2.621 -41.693 1.00 0.00 H new ATOM 0 HG SER A 78 -100.716 -4.837 -42.384 1.00 0.00 H new ATOM 860 N LYS A 79 -100.858 -2.169 -38.176 1.00 0.00 N ATOM 861 CA LYS A 79 -101.461 -1.174 -37.297 1.00 0.00 C ATOM 862 C LYS A 79 -100.389 -0.426 -36.500 1.00 0.00 C ATOM 863 O LYS A 79 -100.537 0.764 -36.213 1.00 0.00 O ATOM 864 CB LYS A 79 -102.446 -1.855 -36.339 1.00 0.00 C ATOM 865 CG LYS A 79 -103.454 -0.911 -35.702 1.00 0.00 C ATOM 866 CD LYS A 79 -104.402 -0.330 -36.739 1.00 0.00 C ATOM 867 CE LYS A 79 -105.568 0.401 -36.089 1.00 0.00 C ATOM 868 NZ LYS A 79 -105.133 1.599 -35.321 1.00 0.00 N ATOM 0 H LYS A 79 -101.144 -3.128 -37.981 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.996 -0.450 -37.912 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -102.985 -2.631 -36.882 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -101.882 -2.352 -35.550 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -104.026 -1.445 -34.943 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -102.928 -0.103 -35.195 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -103.857 0.357 -37.386 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -104.783 -1.131 -37.373 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -106.277 0.705 -36.859 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -106.095 -0.282 -35.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -105.963 2.061 -34.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -104.477 1.309 -34.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -104.654 2.266 -35.960 1.00 0.00 H new ATOM 882 N VAL A 80 -99.301 -1.121 -36.178 1.00 0.00 N ATOM 883 CA VAL A 80 -98.243 -0.559 -35.343 1.00 0.00 C ATOM 884 C VAL A 80 -97.482 0.547 -36.061 1.00 0.00 C ATOM 885 O VAL A 80 -97.407 1.670 -35.571 1.00 0.00 O ATOM 886 CB VAL A 80 -97.251 -1.642 -34.872 1.00 0.00 C ATOM 887 CG1 VAL A 80 -96.085 -1.026 -34.114 1.00 0.00 C ATOM 888 CG2 VAL A 80 -97.963 -2.662 -34.003 1.00 0.00 C ATOM 0 H VAL A 80 -99.129 -2.079 -36.484 1.00 0.00 H new ATOM 0 HA VAL A 80 -98.738 -0.133 -34.470 1.00 0.00 H new ATOM 0 HB VAL A 80 -96.853 -2.143 -35.754 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -95.402 -1.813 -33.794 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -95.556 -0.329 -34.764 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -96.460 -0.494 -33.240 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -97.252 -3.421 -33.677 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -98.388 -2.164 -33.131 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -98.761 -3.134 -34.576 1.00 0.00 H new ATOM 898 N CYS A 81 -96.923 0.258 -37.223 1.00 0.00 N ATOM 899 CA CYS A 81 -96.149 1.279 -37.923 1.00 0.00 C ATOM 900 C CYS A 81 -97.057 2.374 -38.466 1.00 0.00 C ATOM 901 O CYS A 81 -96.623 3.506 -38.667 1.00 0.00 O ATOM 902 CB CYS A 81 -95.292 0.673 -39.030 1.00 0.00 C ATOM 903 SG CYS A 81 -94.089 -0.539 -38.412 1.00 0.00 S ATOM 0 H CYS A 81 -96.984 -0.645 -37.694 1.00 0.00 H new ATOM 0 HA CYS A 81 -95.471 1.732 -37.199 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.941 0.192 -39.762 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.762 1.471 -39.549 1.00 0.00 H new ATOM 908 N GLN A 82 -98.328 2.052 -38.664 1.00 0.00 N ATOM 909 CA GLN A 82 -99.295 3.043 -39.116 1.00 0.00 C ATOM 910 C GLN A 82 -99.534 4.082 -38.022 1.00 0.00 C ATOM 911 O GLN A 82 -99.551 5.284 -38.289 1.00 0.00 O ATOM 912 CB GLN A 82 -100.604 2.367 -39.515 1.00 0.00 C ATOM 913 CG GLN A 82 -101.584 3.301 -40.200 1.00 0.00 C ATOM 914 CD GLN A 82 -102.802 2.577 -40.733 1.00 0.00 C ATOM 915 OE1 GLN A 82 -103.389 2.984 -41.736 1.00 0.00 O ATOM 916 NE2 GLN A 82 -103.190 1.501 -40.071 1.00 0.00 N ATOM 0 H GLN A 82 -98.712 1.118 -38.520 1.00 0.00 H new ATOM 0 HA GLN A 82 -98.894 3.551 -39.993 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.384 1.532 -40.181 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -101.074 1.950 -38.625 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -101.902 4.069 -39.495 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -101.081 3.811 -41.021 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -102.675 1.198 -39.244 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -104.004 0.974 -40.387 1.00 0.00 H new ATOM 925 N ARG A 83 -99.686 3.620 -36.782 1.00 0.00 N ATOM 926 CA ARG A 83 -99.813 4.529 -35.640 1.00 0.00 C ATOM 927 C ARG A 83 -98.451 5.134 -35.303 1.00 0.00 C ATOM 928 O ARG A 83 -98.347 6.066 -34.505 1.00 0.00 O ATOM 929 CB ARG A 83 -100.399 3.813 -34.414 1.00 0.00 C ATOM 930 CG ARG A 83 -99.539 2.672 -33.902 1.00 0.00 C ATOM 931 CD ARG A 83 -100.162 1.975 -32.707 1.00 0.00 C ATOM 932 NE ARG A 83 -100.142 2.809 -31.507 1.00 0.00 N ATOM 933 CZ ARG A 83 -99.966 2.330 -30.277 1.00 0.00 C ATOM 934 NH1 ARG A 83 -99.812 1.023 -30.092 1.00 0.00 N ATOM 935 NH2 ARG A 83 -99.948 3.161 -29.240 1.00 0.00 N ATOM 0 H ARG A 83 -99.724 2.629 -36.542 1.00 0.00 H new ATOM 0 HA ARG A 83 -100.502 5.327 -35.916 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -100.538 4.539 -33.613 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -101.386 3.426 -34.668 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -99.385 1.948 -34.702 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -98.557 3.056 -33.625 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -101.192 1.705 -32.942 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -99.626 1.046 -32.511 1.00 0.00 H new ATOM 0 HE ARG A 83 -100.270 3.815 -31.618 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -99.829 0.389 -30.891 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -99.677 0.654 -29.151 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -100.069 4.163 -29.387 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -99.813 2.797 -28.297 1.00 0.00 H new ATOM 949 N LEU A 84 -97.409 4.582 -35.915 1.00 0.00 N ATOM 950 CA LEU A 84 -96.057 5.101 -35.772 1.00 0.00 C ATOM 951 C LEU A 84 -95.793 6.132 -36.868 1.00 0.00 C ATOM 952 O LEU A 84 -94.709 6.695 -36.956 1.00 0.00 O ATOM 953 CB LEU A 84 -95.061 3.955 -35.862 1.00 0.00 C ATOM 954 CG LEU A 84 -93.657 4.271 -35.360 1.00 0.00 C ATOM 955 CD1 LEU A 84 -93.684 4.745 -33.918 1.00 0.00 C ATOM 956 CD2 LEU A 84 -92.798 3.041 -35.481 1.00 0.00 C ATOM 0 H LEU A 84 -97.479 3.765 -36.522 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.944 5.584 -34.801 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -95.451 3.111 -35.293 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -94.994 3.635 -36.902 1.00 0.00 H new ATOM 0 HG LEU A 84 -93.242 5.074 -35.969 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -92.668 4.963 -33.588 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -94.291 5.647 -33.843 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -94.112 3.966 -33.287 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -91.793 3.263 -35.123 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -93.227 2.237 -34.883 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -92.751 2.731 -36.525 1.00 0.00 H new ATOM 968 N ASN A 85 -96.828 6.349 -37.694 1.00 0.00 N ATOM 969 CA ASN A 85 -96.814 7.267 -38.847 1.00 0.00 C ATOM 970 C ASN A 85 -95.717 6.915 -39.857 1.00 0.00 C ATOM 971 O ASN A 85 -95.367 7.722 -40.718 1.00 0.00 O ATOM 972 CB ASN A 85 -96.761 8.758 -38.411 1.00 0.00 C ATOM 973 CG ASN A 85 -95.402 9.286 -37.951 1.00 0.00 C ATOM 974 OD1 ASN A 85 -94.347 8.916 -38.468 1.00 0.00 O ATOM 975 ND2 ASN A 85 -95.427 10.172 -36.964 1.00 0.00 N ATOM 0 H ASN A 85 -97.725 5.878 -37.576 1.00 0.00 H new ATOM 0 HA ASN A 85 -97.764 7.130 -39.364 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -97.100 9.370 -39.247 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -97.475 8.902 -37.600 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -94.555 10.568 -36.612 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -96.318 10.458 -36.557 1.00 0.00 H new ATOM 982 N CYS A 86 -95.228 5.682 -39.785 1.00 0.00 N ATOM 983 CA CYS A 86 -94.191 5.209 -40.696 1.00 0.00 C ATOM 984 C CYS A 86 -94.810 4.539 -41.923 1.00 0.00 C ATOM 985 O CYS A 86 -94.107 4.174 -42.865 1.00 0.00 O ATOM 986 CB CYS A 86 -93.256 4.236 -39.965 1.00 0.00 C ATOM 987 SG CYS A 86 -92.361 4.982 -38.571 1.00 0.00 S ATOM 0 H CYS A 86 -95.534 4.989 -39.102 1.00 0.00 H new ATOM 0 HA CYS A 86 -93.611 6.066 -41.038 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -93.840 3.392 -39.599 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -92.533 3.838 -40.677 1.00 0.00 H new ATOM 992 N GLY A 87 -96.131 4.380 -41.901 1.00 0.00 N ATOM 993 CA GLY A 87 -96.839 3.820 -43.038 1.00 0.00 C ATOM 994 C GLY A 87 -97.195 2.363 -42.836 1.00 0.00 C ATOM 995 O GLY A 87 -97.876 2.009 -41.874 1.00 0.00 O ATOM 0 H GLY A 87 -96.726 4.631 -41.111 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -97.750 4.393 -43.213 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -96.223 3.920 -43.931 1.00 0.00 H new ATOM 999 N ASP A 88 -96.718 1.519 -43.740 1.00 0.00 N ATOM 1000 CA ASP A 88 -96.951 0.079 -43.661 1.00 0.00 C ATOM 1001 C ASP A 88 -96.005 -0.524 -42.627 1.00 0.00 C ATOM 1002 O ASP A 88 -95.114 0.174 -42.136 1.00 0.00 O ATOM 1003 CB ASP A 88 -96.728 -0.564 -45.037 1.00 0.00 C ATOM 1004 CG ASP A 88 -97.816 -0.227 -46.035 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -98.837 -0.947 -46.076 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -97.651 0.745 -46.800 1.00 0.00 O ATOM 0 H ASP A 88 -96.162 1.808 -44.545 1.00 0.00 H new ATOM 0 HA ASP A 88 -97.980 -0.112 -43.357 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -95.767 -0.236 -45.433 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -96.673 -1.646 -44.921 1.00 0.00 H new ATOM 1011 N PRO A 89 -96.167 -1.806 -42.240 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.331 -2.381 -41.203 1.00 0.00 C ATOM 1013 C PRO A 89 -93.922 -2.657 -41.646 1.00 0.00 C ATOM 1014 O PRO A 89 -93.640 -2.900 -42.820 1.00 0.00 O ATOM 1015 CB PRO A 89 -95.999 -3.686 -40.846 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.751 -4.074 -42.063 1.00 0.00 C ATOM 1017 CD PRO A 89 -97.149 -2.788 -42.751 1.00 0.00 C ATOM 0 HA PRO A 89 -95.244 -1.680 -40.373 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.265 -4.445 -40.576 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.665 -3.568 -39.991 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -96.136 -4.690 -42.719 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.630 -4.663 -41.804 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -97.097 -2.880 -43.836 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -98.171 -2.500 -42.504 1.00 0.00 H new ATOM 1025 N LEU A 90 -93.056 -2.550 -40.672 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.690 -2.966 -40.751 1.00 0.00 C ATOM 1027 C LEU A 90 -91.518 -4.250 -41.537 1.00 0.00 C ATOM 1028 O LEU A 90 -91.956 -5.324 -41.142 1.00 0.00 O ATOM 1029 CB LEU A 90 -91.079 -3.066 -39.343 1.00 0.00 C ATOM 1030 CG LEU A 90 -92.070 -3.086 -38.160 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -93.154 -4.128 -38.329 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -91.341 -3.313 -36.853 1.00 0.00 C ATOM 0 H LEU A 90 -93.300 -2.152 -39.765 1.00 0.00 H new ATOM 0 HA LEU A 90 -91.144 -2.203 -41.306 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.475 -3.972 -39.297 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.401 -2.224 -39.205 1.00 0.00 H new ATOM 0 HG LEU A 90 -92.552 -2.109 -38.143 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.823 -4.099 -37.469 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.720 -3.920 -39.237 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.700 -5.116 -38.403 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -92.059 -3.323 -36.033 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.818 -4.269 -36.889 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -90.620 -2.511 -36.694 1.00 0.00 H new ATOM 1044 N SER A 91 -90.923 -4.080 -42.692 1.00 0.00 N ATOM 1045 CA SER A 91 -90.555 -5.189 -43.547 1.00 0.00 C ATOM 1046 C SER A 91 -89.398 -5.963 -42.928 1.00 0.00 C ATOM 1047 O SER A 91 -88.593 -5.400 -42.181 1.00 0.00 O ATOM 1048 CB SER A 91 -90.179 -4.670 -44.933 1.00 0.00 C ATOM 1049 OG SER A 91 -91.262 -3.961 -45.516 1.00 0.00 O ATOM 0 H SER A 91 -90.678 -3.165 -43.070 1.00 0.00 H new ATOM 0 HA SER A 91 -91.404 -5.865 -43.648 1.00 0.00 H new ATOM 0 HB2 SER A 91 -89.309 -4.017 -44.858 1.00 0.00 H new ATOM 0 HB3 SER A 91 -89.897 -5.505 -45.575 1.00 0.00 H new ATOM 0 HG SER A 91 -91.025 -3.014 -45.602 1.00 0.00 H new ATOM 1055 N LEU A 92 -89.323 -7.246 -43.240 1.00 0.00 N ATOM 1056 CA LEU A 92 -88.335 -8.129 -42.641 1.00 0.00 C ATOM 1057 C LEU A 92 -87.092 -8.264 -43.518 1.00 0.00 C ATOM 1058 O LEU A 92 -87.171 -8.673 -44.674 1.00 0.00 O ATOM 1059 CB LEU A 92 -88.969 -9.497 -42.380 1.00 0.00 C ATOM 1060 CG LEU A 92 -89.786 -9.596 -41.092 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -90.618 -10.866 -41.082 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -88.867 -9.569 -39.881 1.00 0.00 C ATOM 0 H LEU A 92 -89.941 -7.703 -43.911 1.00 0.00 H new ATOM 0 HA LEU A 92 -88.011 -7.694 -41.696 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -89.614 -9.748 -43.222 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -88.179 -10.247 -42.350 1.00 0.00 H new ATOM 0 HG LEU A 92 -90.458 -8.739 -41.047 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -91.192 -10.918 -40.157 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -91.300 -10.861 -41.932 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -89.960 -11.732 -41.150 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -89.462 -9.640 -38.971 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -88.176 -10.411 -39.930 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -88.303 -8.637 -39.873 1.00 0.00 H new ATOM 1074 N GLY A 93 -85.949 -7.891 -42.958 1.00 0.00 N ATOM 1075 CA GLY A 93 -84.683 -8.039 -43.650 1.00 0.00 C ATOM 1076 C GLY A 93 -83.517 -7.836 -42.702 1.00 0.00 C ATOM 1077 O GLY A 93 -83.537 -6.900 -41.908 1.00 0.00 O ATOM 0 H GLY A 93 -85.876 -7.484 -42.026 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -84.623 -9.031 -44.098 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.624 -7.317 -44.465 1.00 0.00 H new ATOM 1081 N PRO A 94 -82.485 -8.693 -42.758 1.00 0.00 N ATOM 1082 CA PRO A 94 -81.354 -8.647 -41.816 1.00 0.00 C ATOM 1083 C PRO A 94 -80.694 -7.269 -41.740 1.00 0.00 C ATOM 1084 O PRO A 94 -80.360 -6.661 -42.761 1.00 0.00 O ATOM 1085 CB PRO A 94 -80.375 -9.697 -42.361 1.00 0.00 C ATOM 1086 CG PRO A 94 -80.832 -9.978 -43.753 1.00 0.00 C ATOM 1087 CD PRO A 94 -82.319 -9.762 -43.749 1.00 0.00 C ATOM 0 HA PRO A 94 -81.679 -8.848 -40.795 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -79.351 -9.323 -42.351 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -80.389 -10.601 -41.752 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -80.343 -9.315 -44.466 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -80.586 -10.999 -44.046 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -82.688 -9.465 -44.731 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -82.859 -10.665 -43.465 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.510 -6.791 -40.517 1.00 0.00 N ATOM 1096 CA PHE A 95 -79.972 -5.462 -40.271 1.00 0.00 C ATOM 1097 C PHE A 95 -78.580 -5.583 -39.656 1.00 0.00 C ATOM 1098 O PHE A 95 -78.273 -6.582 -39.009 1.00 0.00 O ATOM 1099 CB PHE A 95 -80.920 -4.695 -39.339 1.00 0.00 C ATOM 1100 CG PHE A 95 -80.672 -3.211 -39.277 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -80.830 -2.422 -40.404 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -80.292 -2.606 -38.088 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -80.610 -1.057 -40.349 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -80.071 -1.243 -38.026 1.00 0.00 C ATOM 1105 CZ PHE A 95 -80.231 -0.469 -39.159 1.00 0.00 C ATOM 0 H PHE A 95 -80.729 -7.314 -39.669 1.00 0.00 H new ATOM 0 HA PHE A 95 -79.888 -4.912 -41.208 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -81.946 -4.865 -39.665 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -80.833 -5.107 -38.334 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -81.128 -2.877 -41.337 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -80.167 -3.207 -37.200 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -80.735 -0.453 -41.235 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -79.774 -0.784 -37.094 1.00 0.00 H new ATOM 0 HZ PHE A 95 -80.060 0.596 -39.114 1.00 0.00 H new ATOM 1115 N LEU A 96 -77.746 -4.568 -39.845 1.00 0.00 N ATOM 1116 CA LEU A 96 -76.346 -4.638 -39.420 1.00 0.00 C ATOM 1117 C LEU A 96 -76.175 -4.394 -37.918 1.00 0.00 C ATOM 1118 O LEU A 96 -75.053 -4.362 -37.420 1.00 0.00 O ATOM 1119 CB LEU A 96 -75.478 -3.638 -40.202 1.00 0.00 C ATOM 1120 CG LEU A 96 -75.649 -2.157 -39.835 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -74.508 -1.336 -40.414 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -76.981 -1.621 -40.334 1.00 0.00 C ATOM 0 H LEU A 96 -78.010 -3.688 -40.288 1.00 0.00 H new ATOM 0 HA LEU A 96 -76.015 -5.654 -39.636 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -74.432 -3.908 -40.058 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -75.694 -3.755 -41.264 1.00 0.00 H new ATOM 0 HG LEU A 96 -75.633 -2.075 -38.748 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -74.642 -0.288 -40.146 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -73.561 -1.695 -40.012 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -74.503 -1.435 -41.499 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -77.076 -0.570 -40.060 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -77.030 -1.719 -41.418 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -77.794 -2.189 -39.881 1.00 0.00 H new ATOM 1134 N LYS A 97 -77.277 -4.224 -37.200 1.00 0.00 N ATOM 1135 CA LYS A 97 -77.215 -4.029 -35.754 1.00 0.00 C ATOM 1136 C LYS A 97 -76.731 -5.307 -35.070 1.00 0.00 C ATOM 1137 O LYS A 97 -77.226 -6.394 -35.355 1.00 0.00 O ATOM 1138 CB LYS A 97 -78.588 -3.612 -35.207 1.00 0.00 C ATOM 1139 CG LYS A 97 -78.662 -3.555 -33.685 1.00 0.00 C ATOM 1140 CD LYS A 97 -77.668 -2.564 -33.096 1.00 0.00 C ATOM 1141 CE LYS A 97 -78.077 -1.123 -33.354 1.00 0.00 C ATOM 1142 NZ LYS A 97 -77.102 -0.166 -32.768 1.00 0.00 N ATOM 0 H LYS A 97 -78.220 -4.217 -37.590 1.00 0.00 H new ATOM 0 HA LYS A 97 -76.505 -3.230 -35.541 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -78.845 -2.632 -35.609 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -79.340 -4.313 -35.570 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -79.672 -3.277 -33.383 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -78.469 -4.547 -33.276 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -77.584 -2.730 -32.022 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -76.682 -2.743 -33.524 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -78.155 -0.953 -34.428 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -79.065 -0.943 -32.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -77.411 0.808 -32.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -77.046 -0.313 -31.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -76.165 -0.322 -33.191 1.00 0.00 H new ATOM 1156 N THR A 98 -75.755 -5.174 -34.186 1.00 0.00 N ATOM 1157 CA THR A 98 -75.185 -6.323 -33.505 1.00 0.00 C ATOM 1158 C THR A 98 -76.100 -6.808 -32.381 1.00 0.00 C ATOM 1159 O THR A 98 -76.272 -6.130 -31.366 1.00 0.00 O ATOM 1160 CB THR A 98 -73.799 -5.983 -32.927 1.00 0.00 C ATOM 1161 OG1 THR A 98 -73.021 -5.282 -33.910 1.00 0.00 O ATOM 1162 CG2 THR A 98 -73.059 -7.243 -32.499 1.00 0.00 C ATOM 0 H THR A 98 -75.341 -4.279 -33.924 1.00 0.00 H new ATOM 0 HA THR A 98 -75.081 -7.120 -34.241 1.00 0.00 H new ATOM 0 HB THR A 98 -73.943 -5.352 -32.050 1.00 0.00 H new ATOM 0 HG1 THR A 98 -72.141 -5.066 -33.537 1.00 0.00 H new ATOM 0 HG21 THR A 98 -72.084 -6.972 -32.095 1.00 0.00 H new ATOM 0 HG22 THR A 98 -73.637 -7.763 -31.735 1.00 0.00 H new ATOM 0 HG23 THR A 98 -72.926 -7.897 -33.361 1.00 0.00 H new ATOM 1170 N TYR A 99 -76.699 -7.974 -32.584 1.00 0.00 N ATOM 1171 CA TYR A 99 -77.537 -8.596 -31.569 1.00 0.00 C ATOM 1172 C TYR A 99 -76.663 -9.172 -30.450 1.00 0.00 C ATOM 1173 O TYR A 99 -75.502 -9.517 -30.677 1.00 0.00 O ATOM 1174 CB TYR A 99 -78.404 -9.690 -32.213 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.253 -10.467 -31.230 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -80.510 -10.014 -30.843 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -78.787 -11.653 -30.678 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -81.271 -10.724 -29.934 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -79.540 -12.363 -29.770 1.00 0.00 C ATOM 1180 CZ TYR A 99 -80.780 -11.896 -29.401 1.00 0.00 C ATOM 1181 OH TYR A 99 -81.532 -12.607 -28.496 1.00 0.00 O ATOM 0 H TYR A 99 -76.619 -8.510 -33.448 1.00 0.00 H new ATOM 0 HA TYR A 99 -78.197 -7.847 -31.131 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -79.056 -9.231 -32.956 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -77.755 -10.386 -32.745 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -80.896 -9.095 -31.259 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -77.815 -12.026 -30.967 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -82.246 -10.362 -29.643 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -79.159 -13.282 -29.350 1.00 0.00 H new ATOM 0 HH TYR A 99 -81.120 -12.546 -27.609 1.00 0.00 H new ATOM 1191 N THR A 100 -77.225 -9.277 -29.253 1.00 0.00 N ATOM 1192 CA THR A 100 -76.483 -9.751 -28.099 1.00 0.00 C ATOM 1193 C THR A 100 -77.398 -10.594 -27.205 1.00 0.00 C ATOM 1194 O THR A 100 -78.548 -10.228 -26.964 1.00 0.00 O ATOM 1195 CB THR A 100 -75.871 -8.564 -27.312 1.00 0.00 C ATOM 1196 OG1 THR A 100 -75.099 -9.038 -26.202 1.00 0.00 O ATOM 1197 CG2 THR A 100 -76.946 -7.608 -26.822 1.00 0.00 C ATOM 0 H THR A 100 -78.197 -9.038 -29.059 1.00 0.00 H new ATOM 0 HA THR A 100 -75.659 -10.377 -28.441 1.00 0.00 H new ATOM 0 HB THR A 100 -75.218 -8.022 -27.996 1.00 0.00 H new ATOM 0 HG1 THR A 100 -74.719 -8.275 -25.718 1.00 0.00 H new ATOM 0 HG21 THR A 100 -76.482 -6.788 -26.274 1.00 0.00 H new ATOM 0 HG22 THR A 100 -77.495 -7.210 -27.675 1.00 0.00 H new ATOM 0 HG23 THR A 100 -77.634 -8.140 -26.164 1.00 0.00 H new ATOM 1205 N PRO A 101 -76.905 -11.743 -26.713 1.00 0.00 N ATOM 1206 CA PRO A 101 -77.723 -12.730 -25.999 1.00 0.00 C ATOM 1207 C PRO A 101 -78.063 -12.336 -24.571 1.00 0.00 C ATOM 1208 O PRO A 101 -78.713 -13.090 -23.843 1.00 0.00 O ATOM 1209 CB PRO A 101 -76.857 -14.000 -26.005 1.00 0.00 C ATOM 1210 CG PRO A 101 -75.662 -13.683 -26.847 1.00 0.00 C ATOM 1211 CD PRO A 101 -75.514 -12.190 -26.822 1.00 0.00 C ATOM 0 HA PRO A 101 -78.692 -12.844 -26.484 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -76.559 -14.273 -24.993 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -77.409 -14.846 -26.414 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -74.769 -14.169 -26.454 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -75.798 -14.043 -27.867 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -74.911 -11.855 -25.978 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -75.035 -11.813 -27.726 1.00 0.00 H new ATOM 1219 N GLN A 102 -77.657 -11.151 -24.193 1.00 0.00 N ATOM 1220 CA GLN A 102 -77.855 -10.681 -22.831 1.00 0.00 C ATOM 1221 C GLN A 102 -78.760 -9.456 -22.809 1.00 0.00 C ATOM 1222 O GLN A 102 -79.849 -9.494 -22.240 1.00 0.00 O ATOM 1223 CB GLN A 102 -76.510 -10.359 -22.177 1.00 0.00 C ATOM 1224 CG GLN A 102 -76.604 -10.107 -20.679 1.00 0.00 C ATOM 1225 CD GLN A 102 -76.718 -11.380 -19.849 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -76.281 -11.418 -18.699 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -77.287 -12.436 -20.419 1.00 0.00 N ATOM 0 H GLN A 102 -77.185 -10.486 -24.806 1.00 0.00 H new ATOM 0 HA GLN A 102 -78.339 -11.475 -22.263 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -75.822 -11.185 -22.355 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -76.083 -9.479 -22.659 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -75.723 -9.552 -20.357 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -77.469 -9.475 -20.480 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -77.639 -12.372 -21.374 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -77.372 -13.311 -19.902 1.00 0.00 H new ATOM 1236 N SER A 103 -78.311 -8.380 -23.439 1.00 0.00 N ATOM 1237 CA SER A 103 -79.075 -7.143 -23.477 1.00 0.00 C ATOM 1238 C SER A 103 -80.318 -7.303 -24.354 1.00 0.00 C ATOM 1239 O SER A 103 -81.325 -6.625 -24.151 1.00 0.00 O ATOM 1240 CB SER A 103 -78.195 -6.009 -24.002 1.00 0.00 C ATOM 1241 OG SER A 103 -76.919 -6.027 -23.377 1.00 0.00 O ATOM 0 H SER A 103 -77.419 -8.340 -23.932 1.00 0.00 H new ATOM 0 HA SER A 103 -79.402 -6.901 -22.466 1.00 0.00 H new ATOM 0 HB2 SER A 103 -78.077 -6.105 -25.081 1.00 0.00 H new ATOM 0 HB3 SER A 103 -78.681 -5.051 -23.818 1.00 0.00 H new ATOM 0 HG SER A 103 -76.372 -5.294 -23.729 1.00 0.00 H new ATOM 1247 N SER A 104 -80.240 -8.208 -25.322 1.00 0.00 N ATOM 1248 CA SER A 104 -81.362 -8.482 -26.201 1.00 0.00 C ATOM 1249 C SER A 104 -81.889 -9.893 -25.947 1.00 0.00 C ATOM 1250 O SER A 104 -81.253 -10.679 -25.233 1.00 0.00 O ATOM 1251 CB SER A 104 -80.931 -8.314 -27.654 1.00 0.00 C ATOM 1252 OG SER A 104 -80.306 -7.056 -27.851 1.00 0.00 O ATOM 0 H SER A 104 -79.407 -8.764 -25.516 1.00 0.00 H new ATOM 0 HA SER A 104 -82.166 -7.775 -25.996 1.00 0.00 H new ATOM 0 HB2 SER A 104 -80.244 -9.114 -27.929 1.00 0.00 H new ATOM 0 HB3 SER A 104 -81.799 -8.401 -28.308 1.00 0.00 H new ATOM 0 HG SER A 104 -80.035 -6.968 -28.789 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.043 -10.215 -26.517 1.00 0.00 N ATOM 1259 CA ILE A 105 -83.705 -11.480 -26.230 1.00 0.00 C ATOM 1260 C ILE A 105 -84.340 -12.110 -27.475 1.00 0.00 C ATOM 1261 O ILE A 105 -84.568 -11.443 -28.486 1.00 0.00 O ATOM 1262 CB ILE A 105 -84.792 -11.300 -25.132 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -85.693 -10.098 -25.418 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -84.167 -11.146 -23.757 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -86.727 -10.337 -26.488 1.00 0.00 C ATOM 0 H ILE A 105 -83.539 -9.619 -27.179 1.00 0.00 H new ATOM 0 HA ILE A 105 -82.929 -12.156 -25.872 1.00 0.00 H new ATOM 0 HB ILE A 105 -85.402 -12.203 -25.147 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.200 -9.812 -24.497 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.070 -9.254 -25.714 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -84.953 -11.022 -23.012 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -83.581 -12.035 -23.522 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -83.518 -10.271 -23.748 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.322 -9.434 -26.627 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.230 -10.592 -27.424 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.378 -11.158 -26.188 1.00 0.00 H new ATOM 1277 N ILE A 106 -84.602 -13.407 -27.384 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.414 -14.122 -28.361 1.00 0.00 C ATOM 1279 C ILE A 106 -86.715 -14.522 -27.678 1.00 0.00 C ATOM 1280 O ILE A 106 -86.693 -15.375 -26.793 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.764 -15.447 -28.823 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.388 -15.222 -29.411 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.654 -16.134 -29.849 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.621 -16.504 -29.663 1.00 0.00 C ATOM 0 H ILE A 106 -84.256 -13.996 -26.627 1.00 0.00 H new ATOM 0 HA ILE A 106 -85.543 -13.463 -29.220 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.654 -16.084 -27.945 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.487 -14.677 -30.350 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -82.812 -14.590 -28.735 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -85.188 -17.066 -30.169 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.625 -16.348 -29.403 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.787 -15.480 -30.711 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.644 -16.267 -30.085 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.490 -17.040 -28.723 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -83.176 -17.129 -30.363 1.00 0.00 H new ATOM 1296 N CYS A 107 -87.840 -13.941 -28.030 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.078 -14.399 -27.417 1.00 0.00 C ATOM 1298 C CYS A 107 -89.588 -15.629 -28.158 1.00 0.00 C ATOM 1299 O CYS A 107 -89.182 -15.892 -29.288 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.165 -13.321 -27.385 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.668 -11.717 -26.698 1.00 0.00 S ATOM 0 H CYS A 107 -87.931 -13.183 -28.707 1.00 0.00 H new ATOM 0 HA CYS A 107 -88.851 -14.646 -26.380 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.524 -13.164 -28.402 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -91.007 -13.698 -26.805 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.463 -16.388 -27.522 1.00 0.00 N ATOM 1307 CA TYR A 108 -90.989 -17.604 -28.121 1.00 0.00 C ATOM 1308 C TYR A 108 -92.485 -17.696 -27.889 1.00 0.00 C ATOM 1309 O TYR A 108 -93.038 -16.974 -27.058 1.00 0.00 O ATOM 1310 CB TYR A 108 -90.316 -18.842 -27.530 1.00 0.00 C ATOM 1311 CG TYR A 108 -88.868 -19.042 -27.925 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -88.528 -19.537 -29.178 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -87.842 -18.761 -27.032 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -87.206 -19.739 -29.529 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -86.520 -18.965 -27.375 1.00 0.00 C ATOM 1316 CZ TYR A 108 -86.208 -19.454 -28.623 1.00 0.00 C ATOM 1317 OH TYR A 108 -84.892 -19.668 -28.961 1.00 0.00 O ATOM 0 H TYR A 108 -90.825 -16.184 -26.590 1.00 0.00 H new ATOM 0 HA TYR A 108 -90.782 -17.565 -29.190 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -90.374 -18.783 -26.443 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -90.883 -19.723 -27.832 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -89.308 -19.767 -29.888 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -88.082 -18.376 -26.052 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -86.957 -20.118 -30.509 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -85.735 -18.742 -26.668 1.00 0.00 H new ATOM 0 HH TYR A 108 -84.316 -19.414 -28.210 1.00 0.00 H new ATOM 1327 N GLY A 109 -93.130 -18.594 -28.606 1.00 0.00 N ATOM 1328 CA GLY A 109 -94.549 -18.784 -28.443 1.00 0.00 C ATOM 1329 C GLY A 109 -95.300 -18.485 -29.714 1.00 0.00 C ATOM 1330 O GLY A 109 -94.749 -18.590 -30.808 1.00 0.00 O ATOM 0 H GLY A 109 -92.693 -19.198 -29.302 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -94.746 -19.811 -28.137 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -94.913 -18.138 -27.644 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.559 -18.125 -29.577 1.00 0.00 N ATOM 1335 CA GLN A 110 -97.373 -17.770 -30.724 1.00 0.00 C ATOM 1336 C GLN A 110 -96.997 -16.382 -31.217 1.00 0.00 C ATOM 1337 O GLN A 110 -97.018 -15.431 -30.440 1.00 0.00 O ATOM 1338 CB GLN A 110 -98.853 -17.788 -30.347 1.00 0.00 C ATOM 1339 CG GLN A 110 -99.321 -19.103 -29.748 1.00 0.00 C ATOM 1340 CD GLN A 110 -100.773 -19.061 -29.314 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -101.471 -20.074 -29.350 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -101.239 -17.892 -28.896 1.00 0.00 N ATOM 0 H GLN A 110 -97.043 -18.070 -28.681 1.00 0.00 H new ATOM 0 HA GLN A 110 -97.195 -18.498 -31.515 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -99.046 -16.987 -29.634 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -99.447 -17.573 -31.236 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -99.187 -19.900 -30.480 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -98.696 -19.350 -28.890 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -100.628 -17.075 -28.881 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -102.208 -17.810 -28.589 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.623 -16.268 -32.487 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.387 -14.964 -33.087 1.00 0.00 C ATOM 1353 C LEU A 111 -97.592 -14.060 -32.853 1.00 0.00 C ATOM 1354 O LEU A 111 -98.690 -14.332 -33.341 1.00 0.00 O ATOM 1355 CB LEU A 111 -96.117 -15.104 -34.587 1.00 0.00 C ATOM 1356 CG LEU A 111 -95.821 -13.795 -35.319 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -94.546 -13.161 -34.785 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -95.713 -14.034 -36.817 1.00 0.00 C ATOM 0 H LEU A 111 -96.478 -17.058 -33.115 1.00 0.00 H new ATOM 0 HA LEU A 111 -95.510 -14.518 -32.619 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -95.273 -15.779 -34.727 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -96.982 -15.575 -35.053 1.00 0.00 H new ATOM 0 HG LEU A 111 -96.647 -13.107 -35.140 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -94.352 -12.230 -35.318 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -94.661 -12.953 -33.721 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -93.710 -13.845 -34.932 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -95.502 -13.091 -37.322 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -94.907 -14.740 -37.016 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -96.653 -14.442 -37.189 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.392 -13.012 -32.070 1.00 0.00 N ATOM 1371 CA GLY A 112 -98.480 -12.119 -31.743 1.00 0.00 C ATOM 1372 C GLY A 112 -98.829 -12.161 -30.269 1.00 0.00 C ATOM 1373 O GLY A 112 -99.514 -11.278 -29.766 1.00 0.00 O ATOM 0 H GLY A 112 -96.494 -12.764 -31.655 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -98.209 -11.101 -32.022 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -99.358 -12.388 -32.331 1.00 0.00 H new ATOM 1377 N SER A 113 -98.361 -13.190 -29.577 1.00 0.00 N ATOM 1378 CA SER A 113 -98.601 -13.327 -28.148 1.00 0.00 C ATOM 1379 C SER A 113 -97.316 -13.053 -27.366 1.00 0.00 C ATOM 1380 O SER A 113 -96.470 -13.929 -27.199 1.00 0.00 O ATOM 1381 CB SER A 113 -99.132 -14.727 -27.838 1.00 0.00 C ATOM 1382 OG SER A 113 -100.253 -15.028 -28.654 1.00 0.00 O ATOM 0 H SER A 113 -97.810 -13.946 -29.985 1.00 0.00 H new ATOM 0 HA SER A 113 -99.350 -12.596 -27.843 1.00 0.00 H new ATOM 0 HB2 SER A 113 -98.347 -15.465 -28.003 1.00 0.00 H new ATOM 0 HB3 SER A 113 -99.413 -14.791 -26.787 1.00 0.00 H new ATOM 0 HG SER A 113 -101.032 -15.206 -28.087 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.189 -11.828 -26.888 1.00 0.00 N ATOM 1389 CA PHE A 114 -95.956 -11.342 -26.276 1.00 0.00 C ATOM 1390 C PHE A 114 -95.937 -11.587 -24.769 1.00 0.00 C ATOM 1391 O PHE A 114 -95.425 -10.772 -24.005 1.00 0.00 O ATOM 1392 CB PHE A 114 -95.814 -9.844 -26.563 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.423 -9.535 -27.980 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -96.089 -10.114 -29.047 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.368 -8.680 -28.243 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -95.714 -9.844 -30.345 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -93.987 -8.410 -29.541 1.00 0.00 C ATOM 1398 CZ PHE A 114 -94.660 -8.993 -30.593 1.00 0.00 C ATOM 0 H PHE A 114 -97.938 -11.136 -26.911 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.119 -11.891 -26.707 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -96.759 -9.349 -26.340 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -95.067 -9.423 -25.889 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -96.913 -10.786 -28.859 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -93.837 -8.219 -27.423 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -96.246 -10.299 -31.167 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -93.161 -7.741 -29.733 1.00 0.00 H new ATOM 0 HZ PHE A 114 -94.362 -8.783 -31.609 1.00 0.00 H new ATOM 1408 N SER A 115 -96.467 -12.721 -24.346 1.00 0.00 N ATOM 1409 CA SER A 115 -96.537 -13.034 -22.927 1.00 0.00 C ATOM 1410 C SER A 115 -95.468 -14.054 -22.532 1.00 0.00 C ATOM 1411 O SER A 115 -95.579 -14.717 -21.500 1.00 0.00 O ATOM 1412 CB SER A 115 -97.929 -13.565 -22.592 1.00 0.00 C ATOM 1413 OG SER A 115 -98.931 -12.649 -23.005 1.00 0.00 O ATOM 0 H SER A 115 -96.854 -13.438 -24.960 1.00 0.00 H new ATOM 0 HA SER A 115 -96.349 -12.122 -22.360 1.00 0.00 H new ATOM 0 HB2 SER A 115 -98.084 -14.526 -23.082 1.00 0.00 H new ATOM 0 HB3 SER A 115 -98.008 -13.738 -21.519 1.00 0.00 H new ATOM 0 HG SER A 115 -99.815 -13.009 -22.783 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.428 -14.164 -23.350 1.00 0.00 N ATOM 1420 CA ASN A 116 -93.336 -15.097 -23.082 1.00 0.00 C ATOM 1421 C ASN A 116 -92.123 -14.774 -23.943 1.00 0.00 C ATOM 1422 O ASN A 116 -92.233 -14.650 -25.162 1.00 0.00 O ATOM 1423 CB ASN A 116 -93.781 -16.536 -23.358 1.00 0.00 C ATOM 1424 CG ASN A 116 -92.696 -17.551 -23.044 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -91.906 -17.373 -22.116 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -92.642 -18.617 -23.828 1.00 0.00 N ATOM 0 H ASN A 116 -94.316 -13.619 -24.205 1.00 0.00 H new ATOM 0 HA ASN A 116 -93.063 -14.996 -22.031 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -94.666 -16.760 -22.763 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -94.069 -16.629 -24.405 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -91.927 -19.328 -23.674 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -93.315 -18.727 -24.586 1.00 0.00 H new ATOM 1433 N CYS A 117 -90.970 -14.629 -23.308 1.00 0.00 N ATOM 1434 CA CYS A 117 -89.726 -14.440 -24.034 1.00 0.00 C ATOM 1435 C CYS A 117 -88.609 -15.286 -23.428 1.00 0.00 C ATOM 1436 O CYS A 117 -88.800 -15.963 -22.415 1.00 0.00 O ATOM 1437 CB CYS A 117 -89.295 -12.970 -24.041 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.439 -11.811 -24.837 1.00 0.00 S ATOM 0 H CYS A 117 -90.871 -14.639 -22.293 1.00 0.00 H new ATOM 0 HA CYS A 117 -89.906 -14.757 -25.061 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -89.145 -12.651 -23.010 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.329 -12.897 -24.541 1.00 0.00 H new ATOM 1443 N SER A 118 -87.447 -15.245 -24.065 1.00 0.00 N ATOM 1444 CA SER A 118 -86.261 -15.953 -23.601 1.00 0.00 C ATOM 1445 C SER A 118 -85.022 -15.207 -24.086 1.00 0.00 C ATOM 1446 O SER A 118 -85.144 -14.169 -24.727 1.00 0.00 O ATOM 1447 CB SER A 118 -86.260 -17.393 -24.122 1.00 0.00 C ATOM 1448 OG SER A 118 -87.400 -18.099 -23.659 1.00 0.00 O ATOM 0 H SER A 118 -87.299 -14.716 -24.924 1.00 0.00 H new ATOM 0 HA SER A 118 -86.260 -15.992 -22.512 1.00 0.00 H new ATOM 0 HB2 SER A 118 -86.247 -17.390 -25.212 1.00 0.00 H new ATOM 0 HB3 SER A 118 -85.354 -17.902 -23.794 1.00 0.00 H new ATOM 0 HG SER A 118 -87.380 -19.016 -24.005 1.00 0.00 H new ATOM 1454 N HIS A 119 -83.837 -15.706 -23.773 1.00 0.00 N ATOM 1455 CA HIS A 119 -82.613 -15.079 -24.260 1.00 0.00 C ATOM 1456 C HIS A 119 -82.055 -15.858 -25.443 1.00 0.00 C ATOM 1457 O HIS A 119 -82.554 -16.933 -25.776 1.00 0.00 O ATOM 1458 CB HIS A 119 -81.560 -14.979 -23.152 1.00 0.00 C ATOM 1459 CG HIS A 119 -81.818 -13.891 -22.155 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -81.307 -12.617 -22.287 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -82.519 -13.893 -20.996 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -81.679 -11.887 -21.253 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -82.418 -12.635 -20.452 1.00 0.00 N ATOM 0 H HIS A 119 -83.694 -16.532 -23.192 1.00 0.00 H new ATOM 0 HA HIS A 119 -82.861 -14.068 -24.583 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -81.510 -15.933 -22.627 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -80.584 -14.814 -23.608 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -80.731 -12.290 -23.063 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -83.058 -14.729 -20.576 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -81.422 -10.851 -21.088 1.00 0.00 H new ATOM 1472 N SER A 120 -81.037 -15.303 -26.091 1.00 0.00 N ATOM 1473 CA SER A 120 -80.378 -15.987 -27.190 1.00 0.00 C ATOM 1474 C SER A 120 -79.623 -17.201 -26.664 1.00 0.00 C ATOM 1475 O SER A 120 -78.497 -17.087 -26.175 1.00 0.00 O ATOM 1476 CB SER A 120 -79.425 -15.041 -27.927 1.00 0.00 C ATOM 1477 OG SER A 120 -78.809 -15.687 -29.028 1.00 0.00 O ATOM 0 H SER A 120 -80.653 -14.384 -25.873 1.00 0.00 H new ATOM 0 HA SER A 120 -81.136 -16.320 -27.899 1.00 0.00 H new ATOM 0 HB2 SER A 120 -79.975 -14.167 -28.276 1.00 0.00 H new ATOM 0 HB3 SER A 120 -78.660 -14.682 -27.238 1.00 0.00 H new ATOM 0 HG SER A 120 -78.208 -15.060 -29.481 1.00 0.00 H new ATOM 1483 N ARG A 121 -80.264 -18.357 -26.741 1.00 0.00 N ATOM 1484 CA ARG A 121 -79.702 -19.578 -26.191 1.00 0.00 C ATOM 1485 C ARG A 121 -79.490 -20.621 -27.282 1.00 0.00 C ATOM 1486 O ARG A 121 -78.371 -20.852 -27.731 1.00 0.00 O ATOM 1487 CB ARG A 121 -80.643 -20.141 -25.124 1.00 0.00 C ATOM 1488 CG ARG A 121 -80.022 -21.220 -24.255 1.00 0.00 C ATOM 1489 CD ARG A 121 -81.083 -21.988 -23.481 1.00 0.00 C ATOM 1490 NE ARG A 121 -82.035 -21.102 -22.805 1.00 0.00 N ATOM 1491 CZ ARG A 121 -83.111 -21.531 -22.145 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -83.342 -22.831 -22.010 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -83.950 -20.657 -21.606 1.00 0.00 N ATOM 0 H ARG A 121 -81.177 -18.474 -27.181 1.00 0.00 H new ATOM 0 HA ARG A 121 -78.736 -19.341 -25.746 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -80.980 -19.325 -24.485 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -81.527 -20.549 -25.614 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -79.454 -21.910 -24.879 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -79.317 -20.767 -23.558 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -81.623 -22.643 -24.164 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -80.599 -22.627 -22.743 1.00 0.00 H new ATOM 0 HE ARG A 121 -81.864 -20.097 -22.842 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -82.694 -23.509 -22.412 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -84.167 -23.152 -21.504 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -83.772 -19.657 -21.696 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -84.773 -20.985 -21.101 1.00 0.00 H new ATOM 1550 N CYS A 125 -80.359 -15.954 -32.660 1.00 0.00 N ATOM 1551 CA CYS A 125 -80.912 -15.249 -33.808 1.00 0.00 C ATOM 1552 C CYS A 125 -79.909 -14.313 -34.454 1.00 0.00 C ATOM 1553 O CYS A 125 -79.196 -13.570 -33.774 1.00 0.00 O ATOM 1554 CB CYS A 125 -82.148 -14.455 -33.388 1.00 0.00 C ATOM 1555 SG CYS A 125 -82.070 -13.835 -31.685 1.00 0.00 S ATOM 0 HA CYS A 125 -81.181 -16.005 -34.546 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.276 -13.612 -34.067 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -83.029 -15.087 -33.495 1.00 0.00 H new ATOM 1560 N HIS A 126 -79.840 -14.378 -35.775 1.00 0.00 N ATOM 1561 CA HIS A 126 -79.175 -13.345 -36.545 1.00 0.00 C ATOM 1562 C HIS A 126 -80.036 -12.097 -36.449 1.00 0.00 C ATOM 1563 O HIS A 126 -81.226 -12.197 -36.143 1.00 0.00 O ATOM 1564 CB HIS A 126 -79.000 -13.760 -38.013 1.00 0.00 C ATOM 1565 CG HIS A 126 -78.275 -15.064 -38.200 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -76.905 -15.161 -38.331 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -78.745 -16.332 -38.273 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -76.567 -16.430 -38.473 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -77.664 -17.158 -38.439 1.00 0.00 N ATOM 0 H HIS A 126 -80.236 -15.135 -36.333 1.00 0.00 H new ATOM 0 HA HIS A 126 -78.175 -13.168 -36.148 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -79.983 -13.833 -38.478 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -78.456 -12.975 -38.539 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -79.780 -16.636 -38.212 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -75.562 -16.806 -38.596 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -77.703 -18.174 -38.523 1.00 0.00 H new ATOM 1578 N SER A 127 -79.467 -10.935 -36.687 1.00 0.00 N ATOM 1579 CA SER A 127 -80.217 -9.704 -36.519 1.00 0.00 C ATOM 1580 C SER A 127 -81.197 -9.493 -37.670 1.00 0.00 C ATOM 1581 O SER A 127 -80.910 -8.763 -38.620 1.00 0.00 O ATOM 1582 CB SER A 127 -79.267 -8.517 -36.411 1.00 0.00 C ATOM 1583 OG SER A 127 -78.118 -8.859 -35.655 1.00 0.00 O ATOM 0 H SER A 127 -78.502 -10.814 -36.993 1.00 0.00 H new ATOM 0 HA SER A 127 -80.792 -9.783 -35.596 1.00 0.00 H new ATOM 0 HB2 SER A 127 -78.969 -8.192 -37.408 1.00 0.00 H new ATOM 0 HB3 SER A 127 -79.779 -7.677 -35.942 1.00 0.00 H new ATOM 0 HG SER A 127 -77.587 -8.053 -35.485 1.00 0.00 H new ATOM 1589 N LEU A 128 -82.335 -10.173 -37.607 1.00 0.00 N ATOM 1590 CA LEU A 128 -83.420 -9.902 -38.533 1.00 0.00 C ATOM 1591 C LEU A 128 -83.951 -8.512 -38.242 1.00 0.00 C ATOM 1592 O LEU A 128 -84.259 -8.186 -37.097 1.00 0.00 O ATOM 1593 CB LEU A 128 -84.543 -10.944 -38.420 1.00 0.00 C ATOM 1594 CG LEU A 128 -84.313 -12.263 -39.171 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -84.023 -12.001 -40.642 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -83.191 -13.074 -38.537 1.00 0.00 C ATOM 0 H LEU A 128 -82.527 -10.910 -36.929 1.00 0.00 H new ATOM 0 HA LEU A 128 -83.042 -9.961 -39.554 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -84.696 -11.171 -37.365 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -85.466 -10.496 -38.787 1.00 0.00 H new ATOM 0 HG LEU A 128 -85.229 -12.850 -39.099 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -83.863 -12.949 -41.156 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -84.869 -11.482 -41.093 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -83.129 -11.384 -40.732 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -83.054 -14.002 -39.093 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -82.267 -12.497 -38.561 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -83.448 -13.305 -37.503 1.00 0.00 H new ATOM 1608 N GLY A 129 -84.035 -7.688 -39.259 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.368 -6.307 -39.043 1.00 0.00 C ATOM 1610 C GLY A 129 -85.752 -5.979 -39.517 1.00 0.00 C ATOM 1611 O GLY A 129 -86.177 -6.421 -40.584 1.00 0.00 O ATOM 0 H GLY A 129 -83.879 -7.949 -40.233 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.285 -6.077 -37.981 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.648 -5.675 -39.563 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.461 -5.229 -38.707 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.765 -4.740 -39.070 1.00 0.00 C ATOM 1617 C LEU A 130 -87.666 -3.260 -39.410 1.00 0.00 C ATOM 1618 O LEU A 130 -86.976 -2.501 -38.731 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.748 -4.984 -37.925 1.00 0.00 C ATOM 1620 CG LEU A 130 -89.359 -6.386 -37.879 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -90.063 -6.622 -36.552 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -90.335 -6.574 -39.032 1.00 0.00 C ATOM 0 H LEU A 130 -86.148 -4.942 -37.779 1.00 0.00 H new ATOM 0 HA LEU A 130 -88.135 -5.273 -39.946 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -88.235 -4.797 -36.981 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.555 -4.255 -37.999 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.554 -7.114 -37.976 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -90.490 -7.625 -36.540 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -89.346 -6.524 -35.737 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.858 -5.887 -36.426 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.762 -7.576 -38.987 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -91.133 -5.835 -38.957 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.809 -6.446 -39.978 1.00 0.00 H new ATOM 1634 N THR A 131 -88.316 -2.854 -40.480 1.00 0.00 N ATOM 1635 CA THR A 131 -88.246 -1.474 -40.914 1.00 0.00 C ATOM 1636 C THR A 131 -89.591 -1.016 -41.480 1.00 0.00 C ATOM 1637 O THR A 131 -89.979 -1.407 -42.580 1.00 0.00 O ATOM 1638 CB THR A 131 -87.093 -1.321 -41.921 1.00 0.00 C ATOM 1639 OG1 THR A 131 -86.887 0.049 -42.273 1.00 0.00 O ATOM 1640 CG2 THR A 131 -87.306 -2.151 -43.181 1.00 0.00 C ATOM 0 H THR A 131 -88.897 -3.456 -41.063 1.00 0.00 H new ATOM 0 HA THR A 131 -88.037 -0.825 -40.064 1.00 0.00 H new ATOM 0 HB THR A 131 -86.201 -1.697 -41.420 1.00 0.00 H new ATOM 0 HG1 THR A 131 -87.486 0.616 -41.745 1.00 0.00 H new ATOM 0 HG21 THR A 131 -86.464 -2.007 -43.858 1.00 0.00 H new ATOM 0 HG22 THR A 131 -87.381 -3.205 -42.914 1.00 0.00 H new ATOM 0 HG23 THR A 131 -88.226 -1.835 -43.673 1.00 0.00 H new ATOM 1648 N CYS A 132 -90.320 -0.226 -40.675 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.718 0.123 -40.955 1.00 0.00 C ATOM 1650 C CYS A 132 -91.917 0.562 -42.389 1.00 0.00 C ATOM 1651 O CYS A 132 -91.580 1.682 -42.776 1.00 0.00 O ATOM 1652 CB CYS A 132 -92.217 1.179 -39.978 1.00 0.00 C ATOM 1653 SG CYS A 132 -92.386 0.548 -38.286 1.00 0.00 S ATOM 0 H CYS A 132 -89.957 0.186 -39.816 1.00 0.00 H new ATOM 0 HA CYS A 132 -92.314 -0.779 -40.815 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.527 2.023 -39.979 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -93.182 1.555 -40.318 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.466 -0.375 -43.146 1.00 0.00 N ATOM 1659 CA LEU A 133 -92.664 -0.275 -44.572 1.00 0.00 C ATOM 1660 C LEU A 133 -91.328 -0.313 -45.313 1.00 0.00 C ATOM 1661 O LEU A 133 -90.999 -1.298 -45.974 1.00 0.00 O ATOM 1662 CB LEU A 133 -93.466 0.981 -44.949 1.00 0.00 C ATOM 1663 CG LEU A 133 -93.553 1.291 -46.449 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -94.181 0.135 -47.213 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -94.338 2.573 -46.676 1.00 0.00 C ATOM 0 H LEU A 133 -92.797 -1.260 -42.762 1.00 0.00 H new ATOM 0 HA LEU A 133 -93.250 -1.140 -44.881 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -94.478 0.873 -44.560 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -93.021 1.839 -44.445 1.00 0.00 H new ATOM 0 HG LEU A 133 -92.540 1.429 -46.828 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -94.230 0.383 -48.273 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -93.576 -0.762 -47.078 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -95.188 -0.046 -46.836 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -94.393 2.782 -47.744 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -95.346 2.458 -46.277 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -93.839 3.399 -46.170 1.00 0.00 H new ATOM 1677 N GLU A 134 -90.557 0.753 -45.186 1.00 0.00 N ATOM 1678 CA GLU A 134 -89.250 0.830 -45.823 1.00 0.00 C ATOM 1679 C GLU A 134 -88.190 1.225 -44.804 1.00 0.00 C ATOM 1680 O GLU A 134 -88.508 1.814 -43.767 1.00 0.00 O ATOM 1681 CB GLU A 134 -89.254 1.836 -46.978 1.00 0.00 C ATOM 1682 CG GLU A 134 -89.387 3.284 -46.533 1.00 0.00 C ATOM 1683 CD GLU A 134 -89.018 4.261 -47.627 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -88.105 3.950 -48.423 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -89.618 5.355 -47.685 1.00 0.00 O ATOM 0 H GLU A 134 -90.813 1.580 -44.647 1.00 0.00 H new ATOM 0 HA GLU A 134 -89.017 -0.156 -46.226 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -88.331 1.724 -47.547 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -90.076 1.596 -47.653 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -90.413 3.470 -46.214 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -88.748 3.455 -45.667 1.00 0.00 H new