USER MOD reduce.3.24.130724 H: found=0, std=0, add=787, rem=0, adj=32 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 58 MET CE :methyl -179:sc= -1.62 (180deg=-1.52) USER MOD Set 1.2: A 104 SER OG : rot 180:sc= -0.0963 USER MOD Set 2.1: A 43 LYS NZ :NH3+ 153:sc= 1.23 (180deg=0) USER MOD Set 2.2: A 85 ASN : amide:sc= 0.405 K(o=1.6,f=-12!) USER MOD Set 3.1: A 62 GLN : amide:sc= -2.98! C(o=-1.8!,f=-6.1!) USER MOD Set 3.2: A 63 SER OG : rot -7:sc= 0.212 USER MOD Set 3.3: A 67 SER OG : rot 180:sc= 1 USER MOD Set 4.1: A 27 SER OG : rot -149:sc= 0.242 USER MOD Set 4.2: A 29 TYR OH : rot 180:sc= 0.162 USER MOD Single : A 34 GLN : amide:sc= -2.18! C(o=-2.2!,f=-7!) USER MOD Single : A 38 THR OG1 : rot 162:sc= -1.2! USER MOD Single : A 40 SER OG : rot 179:sc= -0.541 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.0463 X(o=-0.046,f=0) USER MOD Single : A 47 GLN : amide:sc= -0.366 X(o=-0.37,f=-0.48) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 164:sc= -0.0438 (180deg=-0.309) USER MOD Single : A 57 HIS : no HE2:sc= -0.711 K(o=-0.71,f=-2.2) USER MOD Single : A 61 SER OG : rot -90:sc= -0.0126 USER MOD Single : A 68 SER OG : rot 140:sc= 0.0531 USER MOD Single : A 69 LYS NZ :NH3+ 164:sc= -0.057 (180deg=-0.301) USER MOD Single : A 70 GLN : amide:sc= -1.34! K(o=-1.3!,f=-0.03) USER MOD Single : A 75 SER OG : rot 23:sc= 0.989 USER MOD Single : A 76 GLN : amide:sc= -0.959 K(o=-0.96,f=-0.084) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00619) USER MOD Single : A 82 GLN : amide:sc= -1.4 K(o=-1.4,f=0) USER MOD Single : A 91 SER OG : rot 108:sc= 1.22 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 68:sc= -0.379 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.108 USER MOD Single : A 102 GLN : amide:sc= -4.67! K(o=-4.7!,f=-0.69) 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 110 GLN : amide:sc= -1.04 K(o=-1,f=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 118 SER OG : rot 180:sc= -0.084 USER MOD Single : A 119 HIS : no HE2:sc= 0.518 K(o=0.52,f=-1.7!) USER MOD Single : A 120 SER OG : rot 100:sc= 0.222 USER MOD Single : A 126 HIS : no HD1:sc= -0.0898 X(o=-0.09,f=-0.09) USER MOD Single : A 127 SER OG : rot 18:sc= 0.574 USER MOD Single : A 131 THR OG1 : rot 28:sc= 1.2 USER MOD ----------------------------------------------------------------- ATOM 25 N LEU A 26 -101.489 -9.248 -24.944 1.00 0.00 N ATOM 26 CA LEU A 26 -100.099 -8.879 -25.206 1.00 0.00 C ATOM 27 C LEU A 26 -99.773 -9.115 -26.675 1.00 0.00 C ATOM 28 O LEU A 26 -98.676 -9.544 -27.026 1.00 0.00 O ATOM 29 CB LEU A 26 -99.155 -9.688 -24.310 1.00 0.00 C ATOM 30 CG LEU A 26 -99.331 -9.454 -22.810 1.00 0.00 C ATOM 31 CD1 LEU A 26 -98.396 -10.350 -22.014 1.00 0.00 C ATOM 32 CD2 LEU A 26 -99.084 -7.993 -22.467 1.00 0.00 C ATOM 0 HA LEU A 26 -99.962 -7.822 -24.979 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -99.301 -10.748 -24.517 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -98.127 -9.449 -24.582 1.00 0.00 H new ATOM 0 HG LEU A 26 -100.358 -9.705 -22.543 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -98.537 -10.168 -20.949 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -98.616 -11.394 -22.236 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -97.363 -10.131 -22.286 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -99.214 -7.844 -21.395 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -98.068 -7.719 -22.751 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -99.793 -7.367 -23.009 1.00 0.00 H new ATOM 44 N SER A 27 -100.735 -8.823 -27.528 1.00 0.00 N ATOM 45 CA SER A 27 -100.610 -9.115 -28.939 1.00 0.00 C ATOM 46 C SER A 27 -100.264 -7.859 -29.731 1.00 0.00 C ATOM 47 O SER A 27 -100.883 -6.812 -29.548 1.00 0.00 O ATOM 48 CB SER A 27 -101.914 -9.721 -29.446 1.00 0.00 C ATOM 49 OG SER A 27 -102.277 -10.871 -28.695 1.00 0.00 O ATOM 0 H SER A 27 -101.616 -8.381 -27.265 1.00 0.00 H new ATOM 0 HA SER A 27 -99.798 -9.829 -29.079 1.00 0.00 H new ATOM 0 HB2 SER A 27 -102.710 -8.979 -29.385 1.00 0.00 H new ATOM 0 HB3 SER A 27 -101.808 -9.989 -30.497 1.00 0.00 H new ATOM 0 HG SER A 27 -102.766 -11.496 -29.270 1.00 0.00 H new ATOM 55 N TRP A 28 -99.289 -7.973 -30.631 1.00 0.00 N ATOM 56 CA TRP A 28 -98.814 -6.821 -31.396 1.00 0.00 C ATOM 57 C TRP A 28 -99.782 -6.447 -32.518 1.00 0.00 C ATOM 58 O TRP A 28 -99.572 -5.468 -33.230 1.00 0.00 O ATOM 59 CB TRP A 28 -97.412 -7.083 -31.966 1.00 0.00 C ATOM 60 CG TRP A 28 -97.348 -8.125 -33.054 1.00 0.00 C ATOM 61 CD1 TRP A 28 -98.178 -9.196 -33.238 1.00 0.00 C ATOM 62 CD2 TRP A 28 -96.372 -8.193 -34.101 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.789 -9.911 -34.345 1.00 0.00 N ATOM 64 CE2 TRP A 28 -96.678 -9.316 -34.890 1.00 0.00 C ATOM 65 CE3 TRP A 28 -95.273 -7.404 -34.450 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -95.921 -9.670 -36.006 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -94.522 -7.757 -35.556 1.00 0.00 C ATOM 68 CH2 TRP A 28 -94.848 -8.880 -36.323 1.00 0.00 C ATOM 0 H TRP A 28 -98.813 -8.849 -30.848 1.00 0.00 H new ATOM 0 HA TRP A 28 -98.760 -5.977 -30.708 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -97.015 -6.146 -32.358 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -96.757 -7.391 -31.151 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -99.017 -9.444 -32.605 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -98.250 -10.747 -34.703 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -95.014 -6.533 -33.866 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -96.172 -10.537 -36.600 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -93.669 -7.155 -35.832 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -94.242 -9.129 -37.182 1.00 0.00 H new ATOM 79 N TYR A 29 -100.841 -7.229 -32.676 1.00 0.00 N ATOM 80 CA TYR A 29 -101.862 -6.915 -33.664 1.00 0.00 C ATOM 81 C TYR A 29 -103.001 -6.143 -33.010 1.00 0.00 C ATOM 82 O TYR A 29 -104.002 -5.816 -33.650 1.00 0.00 O ATOM 83 CB TYR A 29 -102.374 -8.179 -34.371 1.00 0.00 C ATOM 84 CG TYR A 29 -102.759 -9.316 -33.450 1.00 0.00 C ATOM 85 CD1 TYR A 29 -104.002 -9.349 -32.833 1.00 0.00 C ATOM 86 CD2 TYR A 29 -101.877 -10.362 -33.207 1.00 0.00 C ATOM 87 CE1 TYR A 29 -104.356 -10.391 -31.994 1.00 0.00 C ATOM 88 CE2 TYR A 29 -102.222 -11.405 -32.373 1.00 0.00 C ATOM 89 CZ TYR A 29 -103.462 -11.415 -31.769 1.00 0.00 C ATOM 90 OH TYR A 29 -103.799 -12.448 -30.926 1.00 0.00 O ATOM 0 H TYR A 29 -101.014 -8.078 -32.138 1.00 0.00 H new ATOM 0 HA TYR A 29 -101.413 -6.285 -34.432 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -103.240 -7.913 -34.976 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -101.603 -8.532 -35.056 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -104.704 -8.548 -33.011 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -100.906 -10.358 -33.679 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -105.326 -10.401 -31.519 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -101.525 -12.210 -32.194 1.00 0.00 H new ATOM 0 HH TYR A 29 -103.057 -13.087 -30.878 1.00 0.00 H new ATOM 100 N ASP A 30 -102.834 -5.858 -31.726 1.00 0.00 N ATOM 101 CA ASP A 30 -103.742 -4.988 -31.011 1.00 0.00 C ATOM 102 C ASP A 30 -103.233 -3.559 -31.110 1.00 0.00 C ATOM 103 O ASP A 30 -102.059 -3.295 -30.846 1.00 0.00 O ATOM 104 CB ASP A 30 -103.862 -5.410 -29.545 1.00 0.00 C ATOM 105 CG ASP A 30 -104.717 -6.647 -29.356 1.00 0.00 C ATOM 106 OD1 ASP A 30 -105.947 -6.561 -29.565 1.00 0.00 O ATOM 107 OD2 ASP A 30 -104.173 -7.704 -28.982 1.00 0.00 O ATOM 0 H ASP A 30 -102.069 -6.223 -31.159 1.00 0.00 H new ATOM 0 HA ASP A 30 -104.734 -5.058 -31.458 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -102.866 -5.598 -29.143 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -104.288 -4.588 -28.969 1.00 0.00 H new ATOM 112 N PRO A 31 -104.109 -2.618 -31.477 1.00 0.00 N ATOM 113 CA PRO A 31 -103.714 -1.239 -31.801 1.00 0.00 C ATOM 114 C PRO A 31 -103.120 -0.482 -30.617 1.00 0.00 C ATOM 115 O PRO A 31 -102.426 0.520 -30.797 1.00 0.00 O ATOM 116 CB PRO A 31 -105.027 -0.584 -32.243 1.00 0.00 C ATOM 117 CG PRO A 31 -106.096 -1.417 -31.626 1.00 0.00 C ATOM 118 CD PRO A 31 -105.560 -2.817 -31.601 1.00 0.00 C ATOM 0 HA PRO A 31 -102.928 -1.224 -32.557 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -105.087 0.450 -31.904 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -105.115 -0.569 -33.329 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -106.330 -1.070 -30.620 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -107.018 -1.362 -32.205 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.961 -3.387 -30.763 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -105.816 -3.362 -32.509 1.00 0.00 H new ATOM 126 N ASP A 32 -103.382 -0.966 -29.412 1.00 0.00 N ATOM 127 CA ASP A 32 -102.948 -0.271 -28.205 1.00 0.00 C ATOM 128 C ASP A 32 -101.618 -0.821 -27.694 1.00 0.00 C ATOM 129 O ASP A 32 -100.984 -0.228 -26.822 1.00 0.00 O ATOM 130 CB ASP A 32 -104.016 -0.381 -27.112 1.00 0.00 C ATOM 131 CG ASP A 32 -103.742 0.532 -25.931 1.00 0.00 C ATOM 132 OD1 ASP A 32 -103.997 1.751 -26.050 1.00 0.00 O ATOM 133 OD2 ASP A 32 -103.295 0.038 -24.874 1.00 0.00 O ATOM 0 H ASP A 32 -103.891 -1.834 -29.242 1.00 0.00 H new ATOM 0 HA ASP A 32 -102.805 0.779 -28.460 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -104.990 -0.137 -27.536 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -104.069 -1.413 -26.764 1.00 0.00 H new ATOM 138 N PHE A 33 -101.182 -1.944 -28.251 1.00 0.00 N ATOM 139 CA PHE A 33 -99.948 -2.572 -27.805 1.00 0.00 C ATOM 140 C PHE A 33 -98.752 -1.777 -28.312 1.00 0.00 C ATOM 141 O PHE A 33 -98.617 -1.543 -29.513 1.00 0.00 O ATOM 142 CB PHE A 33 -99.874 -4.024 -28.281 1.00 0.00 C ATOM 143 CG PHE A 33 -98.866 -4.843 -27.530 1.00 0.00 C ATOM 144 CD1 PHE A 33 -99.117 -5.228 -26.225 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.675 -5.231 -28.122 1.00 0.00 C ATOM 146 CE1 PHE A 33 -98.201 -5.983 -25.523 1.00 0.00 C ATOM 147 CE2 PHE A 33 -96.758 -5.986 -27.425 1.00 0.00 C ATOM 148 CZ PHE A 33 -97.019 -6.365 -26.125 1.00 0.00 C ATOM 0 H PHE A 33 -101.661 -2.434 -29.006 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.931 -2.577 -26.715 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.857 -4.484 -28.176 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -99.626 -4.039 -29.342 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -100.041 -4.934 -25.750 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.464 -4.939 -29.140 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -98.408 -6.275 -24.504 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -95.833 -6.282 -27.897 1.00 0.00 H new ATOM 0 HZ PHE A 33 -96.301 -6.959 -25.579 1.00 0.00 H new ATOM 158 N GLN A 34 -97.901 -1.345 -27.396 1.00 0.00 N ATOM 159 CA GLN A 34 -96.768 -0.511 -27.756 1.00 0.00 C ATOM 160 C GLN A 34 -95.602 -1.330 -28.272 1.00 0.00 C ATOM 161 O GLN A 34 -95.127 -2.258 -27.618 1.00 0.00 O ATOM 162 CB GLN A 34 -96.321 0.350 -26.581 1.00 0.00 C ATOM 163 CG GLN A 34 -97.220 1.550 -26.328 1.00 0.00 C ATOM 164 CD GLN A 34 -97.237 2.545 -27.481 1.00 0.00 C ATOM 165 OE1 GLN A 34 -97.057 2.183 -28.643 1.00 0.00 O ATOM 166 NE2 GLN A 34 -97.450 3.813 -27.163 1.00 0.00 N ATOM 0 H GLN A 34 -97.973 -1.557 -26.401 1.00 0.00 H new ATOM 0 HA GLN A 34 -97.104 0.142 -28.562 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -96.289 -0.265 -25.682 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -95.305 0.700 -26.764 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -98.236 1.201 -26.143 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -96.888 2.059 -25.423 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -97.595 4.077 -26.189 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -97.469 4.526 -27.893 1.00 0.00 H new ATOM 175 N ALA A 35 -95.141 -0.944 -29.441 1.00 0.00 N ATOM 176 CA ALA A 35 -94.042 -1.612 -30.115 1.00 0.00 C ATOM 177 C ALA A 35 -93.383 -0.636 -31.070 1.00 0.00 C ATOM 178 O ALA A 35 -94.031 0.303 -31.530 1.00 0.00 O ATOM 179 CB ALA A 35 -94.536 -2.845 -30.861 1.00 0.00 C ATOM 0 H ALA A 35 -95.520 -0.151 -29.958 1.00 0.00 H new ATOM 0 HA ALA A 35 -93.313 -1.944 -29.376 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -93.696 -3.330 -31.359 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -94.990 -3.540 -30.155 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -95.276 -2.548 -31.604 1.00 0.00 H new ATOM 185 N ARG A 36 -92.105 -0.843 -31.354 1.00 0.00 N ATOM 186 CA ARG A 36 -91.347 0.101 -32.165 1.00 0.00 C ATOM 187 C ARG A 36 -89.940 -0.415 -32.419 1.00 0.00 C ATOM 188 O ARG A 36 -89.583 -1.520 -32.017 1.00 0.00 O ATOM 189 CB ARG A 36 -91.239 1.442 -31.433 1.00 0.00 C ATOM 190 CG ARG A 36 -90.452 1.309 -30.141 1.00 0.00 C ATOM 191 CD ARG A 36 -90.239 2.630 -29.432 1.00 0.00 C ATOM 192 NE ARG A 36 -89.341 2.454 -28.294 1.00 0.00 N ATOM 193 CZ ARG A 36 -89.341 3.205 -27.198 1.00 0.00 C ATOM 194 NH1 ARG A 36 -90.176 4.230 -27.078 1.00 0.00 N ATOM 195 NH2 ARG A 36 -88.500 2.916 -26.213 1.00 0.00 N ATOM 0 H ARG A 36 -91.572 -1.653 -31.037 1.00 0.00 H new ATOM 0 HA ARG A 36 -91.868 0.223 -33.115 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -90.756 2.173 -32.081 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -92.238 1.820 -31.215 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -90.976 0.626 -29.473 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -89.483 0.861 -30.358 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -89.820 3.359 -30.125 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -91.196 3.026 -29.092 1.00 0.00 H new ATOM 0 HE ARG A 36 -88.661 1.696 -28.344 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -90.827 4.448 -27.832 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -90.166 4.799 -26.232 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -87.863 2.125 -26.302 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -88.491 3.485 -25.367 1.00 0.00 H new ATOM 209 N LEU A 37 -89.153 0.400 -33.097 1.00 0.00 N ATOM 210 CA LEU A 37 -87.747 0.123 -33.301 1.00 0.00 C ATOM 211 C LEU A 37 -86.926 1.072 -32.449 1.00 0.00 C ATOM 212 O LEU A 37 -87.235 2.264 -32.375 1.00 0.00 O ATOM 213 CB LEU A 37 -87.405 0.303 -34.772 1.00 0.00 C ATOM 214 CG LEU A 37 -88.363 -0.409 -35.720 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.124 0.039 -37.141 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.202 -1.915 -35.595 1.00 0.00 C ATOM 0 H LEU A 37 -89.472 1.271 -33.521 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.522 -0.903 -33.011 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.401 1.367 -35.007 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.394 -0.066 -34.948 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.386 -0.149 -35.448 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -88.815 -0.478 -37.807 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.284 1.115 -37.215 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.099 -0.196 -37.429 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -88.892 -2.412 -36.277 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.179 -2.194 -35.846 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.420 -2.221 -34.572 1.00 0.00 H new ATOM 228 N THR A 38 -85.892 0.557 -31.806 1.00 0.00 N ATOM 229 CA THR A 38 -85.107 1.365 -30.885 1.00 0.00 C ATOM 230 C THR A 38 -83.661 0.883 -30.848 1.00 0.00 C ATOM 231 O THR A 38 -83.305 -0.074 -31.541 1.00 0.00 O ATOM 232 CB THR A 38 -85.695 1.349 -29.455 1.00 0.00 C ATOM 233 OG1 THR A 38 -87.056 0.900 -29.471 1.00 0.00 O ATOM 234 CG2 THR A 38 -85.654 2.740 -28.840 1.00 0.00 C ATOM 0 H THR A 38 -85.577 -0.408 -31.902 1.00 0.00 H new ATOM 0 HA THR A 38 -85.140 2.391 -31.253 1.00 0.00 H new ATOM 0 HB THR A 38 -85.089 0.666 -28.861 1.00 0.00 H new ATOM 0 HG1 THR A 38 -87.321 0.626 -28.568 1.00 0.00 H new ATOM 0 HG21 THR A 38 -86.073 2.706 -27.834 1.00 0.00 H new ATOM 0 HG22 THR A 38 -84.622 3.086 -28.792 1.00 0.00 H new ATOM 0 HG23 THR A 38 -86.239 3.426 -29.453 1.00 0.00 H new ATOM 242 N ARG A 39 -82.829 1.557 -30.041 1.00 0.00 N ATOM 243 CA ARG A 39 -81.386 1.318 -30.019 1.00 0.00 C ATOM 244 C ARG A 39 -80.802 1.627 -31.386 1.00 0.00 C ATOM 245 O ARG A 39 -79.739 1.140 -31.767 1.00 0.00 O ATOM 246 CB ARG A 39 -81.062 -0.113 -29.582 1.00 0.00 C ATOM 247 CG ARG A 39 -81.447 -0.385 -28.139 1.00 0.00 C ATOM 248 CD ARG A 39 -80.770 0.594 -27.196 1.00 0.00 C ATOM 249 NE ARG A 39 -81.202 0.414 -25.813 1.00 0.00 N ATOM 250 CZ ARG A 39 -81.387 1.422 -24.958 1.00 0.00 C ATOM 251 NH1 ARG A 39 -81.247 2.677 -25.365 1.00 0.00 N ATOM 252 NH2 ARG A 39 -81.730 1.167 -23.700 1.00 0.00 N ATOM 0 H ARG A 39 -83.139 2.278 -29.390 1.00 0.00 H new ATOM 0 HA ARG A 39 -80.930 1.981 -29.283 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -81.585 -0.814 -30.232 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -79.995 -0.295 -29.710 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -82.529 -0.311 -28.028 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -81.168 -1.404 -27.871 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -79.689 0.467 -27.257 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -80.989 1.613 -27.514 1.00 0.00 H new ATOM 0 HE ARG A 39 -81.372 -0.536 -25.482 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -80.997 2.874 -26.334 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -81.389 3.445 -24.709 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -81.851 0.203 -23.390 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -81.872 1.935 -23.044 1.00 0.00 H new ATOM 266 N SER A 40 -81.538 2.450 -32.109 1.00 0.00 N ATOM 267 CA SER A 40 -81.157 2.935 -33.416 1.00 0.00 C ATOM 268 C SER A 40 -81.863 4.269 -33.631 1.00 0.00 C ATOM 269 O SER A 40 -82.821 4.581 -32.917 1.00 0.00 O ATOM 270 CB SER A 40 -81.543 1.920 -34.499 1.00 0.00 C ATOM 271 OG SER A 40 -80.882 0.678 -34.293 1.00 0.00 O ATOM 0 H SER A 40 -82.440 2.807 -31.793 1.00 0.00 H new ATOM 0 HA SER A 40 -80.077 3.070 -33.479 1.00 0.00 H new ATOM 0 HB2 SER A 40 -82.622 1.767 -34.491 1.00 0.00 H new ATOM 0 HB3 SER A 40 -81.284 2.315 -35.481 1.00 0.00 H new ATOM 0 HG SER A 40 -81.158 0.042 -34.986 1.00 0.00 H new ATOM 277 N ASN A 41 -81.392 5.063 -34.575 1.00 0.00 N ATOM 278 CA ASN A 41 -81.948 6.396 -34.773 1.00 0.00 C ATOM 279 C ASN A 41 -83.172 6.352 -35.688 1.00 0.00 C ATOM 280 O ASN A 41 -84.064 7.197 -35.593 1.00 0.00 O ATOM 281 CB ASN A 41 -80.883 7.337 -35.345 1.00 0.00 C ATOM 282 CG ASN A 41 -81.279 8.795 -35.223 1.00 0.00 C ATOM 283 OD1 ASN A 41 -81.009 9.439 -34.209 1.00 0.00 O ATOM 284 ND2 ASN A 41 -81.909 9.330 -36.253 1.00 0.00 N ATOM 0 H ASN A 41 -80.635 4.816 -35.212 1.00 0.00 H new ATOM 0 HA ASN A 41 -82.268 6.777 -33.803 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -79.940 7.174 -34.824 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -80.713 7.095 -36.394 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -82.190 10.310 -36.226 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -82.115 8.763 -37.076 1.00 0.00 H new ATOM 291 N SER A 42 -83.219 5.357 -36.559 1.00 0.00 N ATOM 292 CA SER A 42 -84.317 5.219 -37.507 1.00 0.00 C ATOM 293 C SER A 42 -85.570 4.685 -36.826 1.00 0.00 C ATOM 294 O SER A 42 -85.603 3.552 -36.357 1.00 0.00 O ATOM 295 CB SER A 42 -83.893 4.305 -38.657 1.00 0.00 C ATOM 296 OG SER A 42 -82.663 4.736 -39.220 1.00 0.00 O ATOM 0 H SER A 42 -82.508 4.630 -36.631 1.00 0.00 H new ATOM 0 HA SER A 42 -84.557 6.205 -37.906 1.00 0.00 H new ATOM 0 HB2 SER A 42 -83.793 3.282 -38.295 1.00 0.00 H new ATOM 0 HB3 SER A 42 -84.666 4.298 -39.425 1.00 0.00 H new ATOM 0 HG SER A 42 -82.410 4.136 -39.952 1.00 0.00 H new ATOM 302 N LYS A 43 -86.600 5.522 -36.765 1.00 0.00 N ATOM 303 CA LYS A 43 -87.880 5.118 -36.194 1.00 0.00 C ATOM 304 C LYS A 43 -88.483 3.985 -37.009 1.00 0.00 C ATOM 305 O LYS A 43 -89.151 3.103 -36.476 1.00 0.00 O ATOM 306 CB LYS A 43 -88.864 6.288 -36.187 1.00 0.00 C ATOM 307 CG LYS A 43 -88.433 7.478 -35.350 1.00 0.00 C ATOM 308 CD LYS A 43 -89.458 8.597 -35.441 1.00 0.00 C ATOM 309 CE LYS A 43 -89.586 9.114 -36.866 1.00 0.00 C ATOM 310 NZ LYS A 43 -90.741 10.033 -37.036 1.00 0.00 N ATOM 0 H LYS A 43 -86.574 6.484 -37.104 1.00 0.00 H new ATOM 0 HA LYS A 43 -87.700 4.789 -35.171 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -89.018 6.621 -37.213 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -89.826 5.933 -35.819 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -88.311 7.173 -34.311 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -87.463 7.838 -35.692 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -90.426 8.235 -35.095 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -89.168 9.414 -34.780 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -88.669 9.633 -37.145 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -89.694 8.270 -37.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -90.549 10.691 -37.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -91.596 9.481 -37.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -90.888 10.571 -36.158 1.00 0.00 H new ATOM 324 N CYS A 44 -88.235 4.021 -38.307 1.00 0.00 N ATOM 325 CA CYS A 44 -88.838 3.069 -39.215 1.00 0.00 C ATOM 326 C CYS A 44 -87.805 2.051 -39.703 1.00 0.00 C ATOM 327 O CYS A 44 -88.039 1.350 -40.680 1.00 0.00 O ATOM 328 CB CYS A 44 -89.479 3.810 -40.393 1.00 0.00 C ATOM 329 SG CYS A 44 -90.048 5.483 -39.964 1.00 0.00 S ATOM 0 H CYS A 44 -87.619 4.701 -38.753 1.00 0.00 H new ATOM 0 HA CYS A 44 -89.615 2.519 -38.684 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -88.758 3.876 -41.208 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.324 3.229 -40.762 1.00 0.00 H new ATOM 334 N GLN A 45 -86.672 1.955 -39.003 1.00 0.00 N ATOM 335 CA GLN A 45 -85.690 0.897 -39.265 1.00 0.00 C ATOM 336 C GLN A 45 -84.838 0.664 -38.015 1.00 0.00 C ATOM 337 O GLN A 45 -84.194 1.581 -37.515 1.00 0.00 O ATOM 338 CB GLN A 45 -84.805 1.263 -40.462 1.00 0.00 C ATOM 339 CG GLN A 45 -83.783 0.197 -40.815 1.00 0.00 C ATOM 340 CD GLN A 45 -82.942 0.571 -42.018 1.00 0.00 C ATOM 341 OE1 GLN A 45 -83.289 0.256 -43.157 1.00 0.00 O ATOM 342 NE2 GLN A 45 -81.832 1.247 -41.775 1.00 0.00 N ATOM 0 H GLN A 45 -86.411 2.594 -38.252 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.220 -0.024 -39.509 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -85.440 1.446 -41.329 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -84.284 2.196 -40.245 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -83.130 0.027 -39.959 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -84.298 -0.743 -41.014 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -81.581 1.488 -40.816 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -81.227 1.528 -42.546 1.00 0.00 H new ATOM 351 N GLY A 46 -84.815 -0.570 -37.528 1.00 0.00 N ATOM 352 CA GLY A 46 -84.168 -0.846 -36.257 1.00 0.00 C ATOM 353 C GLY A 46 -84.523 -2.216 -35.720 1.00 0.00 C ATOM 354 O GLY A 46 -85.257 -2.969 -36.359 1.00 0.00 O ATOM 0 H GLY A 46 -85.230 -1.381 -37.986 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.087 -0.774 -36.378 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.458 -0.087 -35.531 1.00 0.00 H new ATOM 358 N GLN A 47 -83.970 -2.559 -34.569 1.00 0.00 N ATOM 359 CA GLN A 47 -84.339 -3.793 -33.897 1.00 0.00 C ATOM 360 C GLN A 47 -85.636 -3.586 -33.130 1.00 0.00 C ATOM 361 O GLN A 47 -85.855 -2.524 -32.540 1.00 0.00 O ATOM 362 CB GLN A 47 -83.218 -4.262 -32.968 1.00 0.00 C ATOM 363 CG GLN A 47 -82.037 -4.864 -33.715 1.00 0.00 C ATOM 364 CD GLN A 47 -82.434 -6.091 -34.518 1.00 0.00 C ATOM 365 OE1 GLN A 47 -83.337 -6.832 -34.135 1.00 0.00 O ATOM 366 NE2 GLN A 47 -81.770 -6.304 -35.644 1.00 0.00 N ATOM 0 H GLN A 47 -83.267 -2.003 -34.082 1.00 0.00 H new ATOM 0 HA GLN A 47 -84.493 -4.573 -34.643 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -82.871 -3.418 -32.372 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -83.616 -5.001 -32.273 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -81.612 -4.116 -34.384 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -81.258 -5.134 -33.003 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -81.027 -5.665 -35.927 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -82.002 -7.107 -36.229 1.00 0.00 H new ATOM 375 N LEU A 48 -86.497 -4.591 -33.157 1.00 0.00 N ATOM 376 CA LEU A 48 -87.834 -4.462 -32.602 1.00 0.00 C ATOM 377 C LEU A 48 -87.816 -4.472 -31.077 1.00 0.00 C ATOM 378 O LEU A 48 -87.569 -5.497 -30.444 1.00 0.00 O ATOM 379 CB LEU A 48 -88.739 -5.575 -33.138 1.00 0.00 C ATOM 380 CG LEU A 48 -90.203 -5.505 -32.687 1.00 0.00 C ATOM 381 CD1 LEU A 48 -90.873 -4.246 -33.213 1.00 0.00 C ATOM 382 CD2 LEU A 48 -90.966 -6.737 -33.146 1.00 0.00 C ATOM 0 H LEU A 48 -86.293 -5.506 -33.558 1.00 0.00 H new ATOM 0 HA LEU A 48 -88.234 -3.498 -32.916 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -88.710 -5.551 -34.227 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -88.327 -6.536 -32.830 1.00 0.00 H new ATOM 0 HG LEU A 48 -90.217 -5.473 -31.598 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -91.910 -4.220 -32.880 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.348 -3.369 -32.835 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -90.842 -4.245 -34.303 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -92.002 -6.667 -32.816 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -90.935 -6.800 -34.234 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.508 -7.629 -32.718 1.00 0.00 H new ATOM 394 N GLU A 49 -88.080 -3.316 -30.501 1.00 0.00 N ATOM 395 CA GLU A 49 -88.208 -3.186 -29.066 1.00 0.00 C ATOM 396 C GLU A 49 -89.682 -3.015 -28.731 1.00 0.00 C ATOM 397 O GLU A 49 -90.322 -2.058 -29.170 1.00 0.00 O ATOM 398 CB GLU A 49 -87.393 -1.991 -28.573 1.00 0.00 C ATOM 399 CG GLU A 49 -87.412 -1.807 -27.067 1.00 0.00 C ATOM 400 CD GLU A 49 -86.681 -0.555 -26.632 1.00 0.00 C ATOM 401 OE1 GLU A 49 -87.232 0.550 -26.814 1.00 0.00 O ATOM 402 OE2 GLU A 49 -85.552 -0.665 -26.111 1.00 0.00 O ATOM 0 H GLU A 49 -88.211 -2.444 -31.014 1.00 0.00 H new ATOM 0 HA GLU A 49 -87.824 -4.077 -28.569 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -86.360 -2.109 -28.901 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -87.775 -1.085 -29.044 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -88.445 -1.760 -26.722 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -86.956 -2.675 -26.591 1.00 0.00 H new ATOM 409 N VAL A 50 -90.229 -3.961 -27.988 1.00 0.00 N ATOM 410 CA VAL A 50 -91.663 -3.985 -27.737 1.00 0.00 C ATOM 411 C VAL A 50 -91.954 -3.912 -26.247 1.00 0.00 C ATOM 412 O VAL A 50 -91.253 -4.520 -25.444 1.00 0.00 O ATOM 413 CB VAL A 50 -92.298 -5.259 -28.320 1.00 0.00 C ATOM 414 CG1 VAL A 50 -93.803 -5.115 -28.415 1.00 0.00 C ATOM 415 CG2 VAL A 50 -91.693 -5.577 -29.675 1.00 0.00 C ATOM 0 H VAL A 50 -89.707 -4.720 -27.549 1.00 0.00 H new ATOM 0 HA VAL A 50 -92.097 -3.113 -28.227 1.00 0.00 H new ATOM 0 HB VAL A 50 -92.086 -6.091 -27.648 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -94.230 -6.028 -28.830 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -94.215 -4.940 -27.421 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -94.048 -4.273 -29.062 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -92.152 -6.481 -30.075 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -91.872 -4.746 -30.358 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -90.620 -5.732 -29.567 1.00 0.00 H new ATOM 425 N TYR A 51 -92.997 -3.179 -25.888 1.00 0.00 N ATOM 426 CA TYR A 51 -93.320 -2.938 -24.492 1.00 0.00 C ATOM 427 C TYR A 51 -94.398 -3.899 -24.011 1.00 0.00 C ATOM 428 O TYR A 51 -95.580 -3.725 -24.316 1.00 0.00 O ATOM 429 CB TYR A 51 -93.786 -1.492 -24.317 1.00 0.00 C ATOM 430 CG TYR A 51 -93.992 -1.065 -22.881 1.00 0.00 C ATOM 431 CD1 TYR A 51 -92.964 -1.156 -21.952 1.00 0.00 C ATOM 432 CD2 TYR A 51 -95.210 -0.545 -22.463 1.00 0.00 C ATOM 433 CE1 TYR A 51 -93.144 -0.741 -20.645 1.00 0.00 C ATOM 434 CE2 TYR A 51 -95.399 -0.131 -21.159 1.00 0.00 C ATOM 435 CZ TYR A 51 -94.365 -0.230 -20.253 1.00 0.00 C ATOM 436 OH TYR A 51 -94.554 0.195 -18.955 1.00 0.00 O ATOM 0 H TYR A 51 -93.637 -2.739 -26.549 1.00 0.00 H new ATOM 0 HA TYR A 51 -92.426 -3.106 -23.892 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -93.053 -0.830 -24.777 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -94.722 -1.358 -24.860 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -92.008 -1.557 -22.255 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -96.023 -0.463 -23.169 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -92.334 -0.816 -19.935 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -96.354 0.269 -20.850 1.00 0.00 H new ATOM 0 HH TYR A 51 -95.470 0.527 -18.850 1.00 0.00 H new ATOM 446 N LEU A 52 -93.986 -4.920 -23.272 1.00 0.00 N ATOM 447 CA LEU A 52 -94.927 -5.885 -22.726 1.00 0.00 C ATOM 448 C LEU A 52 -95.005 -5.798 -21.223 1.00 0.00 C ATOM 449 O LEU A 52 -94.173 -6.374 -20.520 1.00 0.00 O ATOM 450 CB LEU A 52 -94.589 -7.317 -23.140 1.00 0.00 C ATOM 451 CG LEU A 52 -93.128 -7.763 -22.992 1.00 0.00 C ATOM 452 CD1 LEU A 52 -93.062 -9.262 -22.740 1.00 0.00 C ATOM 453 CD2 LEU A 52 -92.330 -7.421 -24.245 1.00 0.00 C ATOM 0 H LEU A 52 -93.010 -5.100 -23.038 1.00 0.00 H new ATOM 0 HA LEU A 52 -95.900 -5.628 -23.144 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -95.210 -7.994 -22.553 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -94.877 -7.444 -24.184 1.00 0.00 H new ATOM 0 HG LEU A 52 -92.694 -7.233 -22.144 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -92.021 -9.568 -22.637 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -93.603 -9.501 -21.825 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -93.514 -9.792 -23.578 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -91.297 -7.746 -24.119 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -92.767 -7.929 -25.105 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -92.354 -6.344 -24.409 1.00 0.00 H new ATOM 465 N LYS A 53 -96.006 -5.060 -20.750 1.00 0.00 N ATOM 466 CA LYS A 53 -96.318 -4.922 -19.326 1.00 0.00 C ATOM 467 C LYS A 53 -95.240 -4.168 -18.561 1.00 0.00 C ATOM 468 O LYS A 53 -95.538 -3.240 -17.812 1.00 0.00 O ATOM 469 CB LYS A 53 -96.556 -6.289 -18.670 1.00 0.00 C ATOM 470 CG LYS A 53 -97.696 -7.081 -19.288 1.00 0.00 C ATOM 471 CD LYS A 53 -97.967 -8.367 -18.520 1.00 0.00 C ATOM 472 CE LYS A 53 -98.517 -8.088 -17.129 1.00 0.00 C ATOM 473 NZ LYS A 53 -99.825 -7.384 -17.182 1.00 0.00 N ATOM 0 H LYS A 53 -96.635 -4.531 -21.354 1.00 0.00 H new ATOM 0 HA LYS A 53 -97.236 -4.336 -19.275 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -95.641 -6.877 -18.737 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -96.763 -6.141 -17.610 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -98.598 -6.469 -19.304 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -97.454 -7.319 -20.324 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -98.677 -8.980 -19.076 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -97.045 -8.943 -18.438 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -98.632 -9.028 -16.589 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -97.802 -7.484 -16.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -100.293 -7.450 -16.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -99.671 -6.384 -17.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -100.427 -7.825 -17.906 1.00 0.00 H new ATOM 487 N ASP A 54 -93.998 -4.564 -18.746 1.00 0.00 N ATOM 488 CA ASP A 54 -92.907 -4.008 -17.944 1.00 0.00 C ATOM 489 C ASP A 54 -91.597 -3.928 -18.716 1.00 0.00 C ATOM 490 O ASP A 54 -90.688 -3.191 -18.326 1.00 0.00 O ATOM 491 CB ASP A 54 -92.688 -4.851 -16.680 1.00 0.00 C ATOM 492 CG ASP A 54 -92.073 -6.211 -16.974 1.00 0.00 C ATOM 493 OD1 ASP A 54 -92.815 -7.134 -17.365 1.00 0.00 O ATOM 494 OD2 ASP A 54 -90.842 -6.362 -16.809 1.00 0.00 O ATOM 0 H ASP A 54 -93.712 -5.260 -19.434 1.00 0.00 H new ATOM 0 HA ASP A 54 -93.205 -2.994 -17.676 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -92.040 -4.306 -15.994 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -93.643 -4.992 -16.173 1.00 0.00 H new ATOM 499 N GLY A 55 -91.496 -4.670 -19.801 1.00 0.00 N ATOM 500 CA GLY A 55 -90.232 -4.792 -20.488 1.00 0.00 C ATOM 501 C GLY A 55 -90.280 -4.307 -21.907 1.00 0.00 C ATOM 502 O GLY A 55 -91.020 -4.854 -22.721 1.00 0.00 O ATOM 0 H GLY A 55 -92.266 -5.191 -20.220 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -89.474 -4.228 -19.944 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -89.920 -5.836 -20.478 1.00 0.00 H new ATOM 506 N TRP A 56 -89.508 -3.270 -22.198 1.00 0.00 N ATOM 507 CA TRP A 56 -89.181 -2.937 -23.570 1.00 0.00 C ATOM 508 C TRP A 56 -88.208 -3.986 -24.079 1.00 0.00 C ATOM 509 O TRP A 56 -86.994 -3.778 -24.097 1.00 0.00 O ATOM 510 CB TRP A 56 -88.558 -1.539 -23.686 1.00 0.00 C ATOM 511 CG TRP A 56 -89.553 -0.420 -23.739 1.00 0.00 C ATOM 512 CD1 TRP A 56 -89.814 0.497 -22.760 1.00 0.00 C ATOM 513 CD2 TRP A 56 -90.406 -0.089 -24.839 1.00 0.00 C ATOM 514 NE1 TRP A 56 -90.780 1.379 -23.189 1.00 0.00 N ATOM 515 CE2 TRP A 56 -91.162 1.036 -24.461 1.00 0.00 C ATOM 516 CE3 TRP A 56 -90.605 -0.637 -26.110 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -92.099 1.622 -25.310 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -91.537 -0.059 -26.948 1.00 0.00 C ATOM 519 CH2 TRP A 56 -92.273 1.061 -26.546 1.00 0.00 C ATOM 0 H TRP A 56 -89.099 -2.648 -21.501 1.00 0.00 H new ATOM 0 HA TRP A 56 -90.094 -2.926 -24.166 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -87.894 -1.379 -22.836 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -87.941 -1.503 -24.584 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -89.334 0.526 -21.793 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -91.151 2.160 -22.649 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -90.038 -1.499 -26.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -92.667 2.488 -25.004 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -91.701 -0.478 -27.930 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -92.994 1.492 -27.225 1.00 0.00 H new ATOM 530 N HIS A 57 -88.746 -5.145 -24.428 1.00 0.00 N ATOM 531 CA HIS A 57 -87.923 -6.277 -24.800 1.00 0.00 C ATOM 532 C HIS A 57 -87.350 -6.079 -26.192 1.00 0.00 C ATOM 533 O HIS A 57 -88.101 -5.902 -27.153 1.00 0.00 O ATOM 534 CB HIS A 57 -88.725 -7.588 -24.759 1.00 0.00 C ATOM 535 CG HIS A 57 -88.866 -8.183 -23.391 1.00 0.00 C ATOM 536 ND1 HIS A 57 -89.379 -9.444 -23.170 1.00 0.00 N ATOM 537 CD2 HIS A 57 -88.570 -7.681 -22.167 1.00 0.00 C ATOM 538 CE1 HIS A 57 -89.391 -9.689 -21.872 1.00 0.00 C ATOM 539 NE2 HIS A 57 -88.905 -8.636 -21.239 1.00 0.00 N ATOM 0 H HIS A 57 -89.750 -5.323 -24.460 1.00 0.00 H new ATOM 0 HA HIS A 57 -87.110 -6.345 -24.077 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.719 -7.405 -25.167 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -88.242 -8.316 -25.411 1.00 0.00 H new ATOM 0 HD1 HIS A 57 -89.699 -10.086 -23.895 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -88.148 -6.709 -21.960 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -89.740 -10.599 -21.406 1.00 0.00 H new ATOM 548 N MET A 58 -86.033 -6.084 -26.294 1.00 0.00 N ATOM 549 CA MET A 58 -85.377 -6.026 -27.590 1.00 0.00 C ATOM 550 C MET A 58 -85.403 -7.399 -28.230 1.00 0.00 C ATOM 551 O MET A 58 -84.594 -8.258 -27.892 1.00 0.00 O ATOM 552 CB MET A 58 -83.926 -5.559 -27.457 1.00 0.00 C ATOM 553 CG MET A 58 -83.774 -4.126 -26.990 1.00 0.00 C ATOM 554 SD MET A 58 -82.044 -3.632 -26.841 1.00 0.00 S ATOM 555 CE MET A 58 -81.470 -3.881 -28.522 1.00 0.00 C ATOM 0 H MET A 58 -85.397 -6.127 -25.498 1.00 0.00 H new ATOM 0 HA MET A 58 -85.914 -5.309 -28.212 1.00 0.00 H new ATOM 0 HB2 MET A 58 -83.408 -6.214 -26.756 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.431 -5.669 -28.422 1.00 0.00 H new ATOM 0 HG2 MET A 58 -84.280 -3.462 -27.691 1.00 0.00 H new ATOM 0 HG3 MET A 58 -84.268 -4.006 -26.026 1.00 0.00 H new ATOM 0 HE1 MET A 58 -80.410 -3.634 -28.585 1.00 0.00 H new ATOM 0 HE2 MET A 58 -81.618 -4.923 -28.806 1.00 0.00 H new ATOM 0 HE3 MET A 58 -82.033 -3.237 -29.198 1.00 0.00 H new ATOM 565 N VAL A 59 -86.334 -7.616 -29.136 1.00 0.00 N ATOM 566 CA VAL A 59 -86.457 -8.913 -29.770 1.00 0.00 C ATOM 567 C VAL A 59 -85.597 -8.944 -31.019 1.00 0.00 C ATOM 568 O VAL A 59 -85.151 -7.901 -31.497 1.00 0.00 O ATOM 569 CB VAL A 59 -87.917 -9.245 -30.147 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.865 -8.966 -28.987 1.00 0.00 C ATOM 571 CG2 VAL A 59 -88.329 -8.477 -31.387 1.00 0.00 C ATOM 0 H VAL A 59 -87.010 -6.919 -29.448 1.00 0.00 H new ATOM 0 HA VAL A 59 -86.123 -9.663 -29.053 1.00 0.00 H new ATOM 0 HB VAL A 59 -87.978 -10.311 -30.368 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -89.885 -9.210 -29.284 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.581 -9.577 -28.130 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -88.808 -7.912 -28.716 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -89.361 -8.721 -31.640 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -88.246 -7.407 -31.197 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.677 -8.749 -32.217 1.00 0.00 H new ATOM 581 N CYS A 60 -85.358 -10.126 -31.552 1.00 0.00 N ATOM 582 CA CYS A 60 -84.607 -10.233 -32.785 1.00 0.00 C ATOM 583 C CYS A 60 -85.511 -10.534 -33.971 1.00 0.00 C ATOM 584 O CYS A 60 -85.082 -11.164 -34.939 1.00 0.00 O ATOM 585 CB CYS A 60 -83.488 -11.263 -32.670 1.00 0.00 C ATOM 586 SG CYS A 60 -83.763 -12.638 -31.546 1.00 0.00 S ATOM 0 H CYS A 60 -85.668 -11.014 -31.157 1.00 0.00 H new ATOM 0 HA CYS A 60 -84.146 -9.262 -32.964 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -83.297 -11.669 -33.663 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -82.581 -10.745 -32.358 1.00 0.00 H new ATOM 591 N SER A 61 -86.758 -10.064 -33.884 1.00 0.00 N ATOM 592 CA SER A 61 -87.719 -10.099 -34.996 1.00 0.00 C ATOM 593 C SER A 61 -88.215 -11.517 -35.315 1.00 0.00 C ATOM 594 O SER A 61 -89.418 -11.750 -35.401 1.00 0.00 O ATOM 595 CB SER A 61 -87.103 -9.455 -36.239 1.00 0.00 C ATOM 596 OG SER A 61 -86.601 -8.164 -35.937 1.00 0.00 O ATOM 0 H SER A 61 -87.135 -9.644 -33.034 1.00 0.00 H new ATOM 0 HA SER A 61 -88.593 -9.529 -34.681 1.00 0.00 H new ATOM 0 HB2 SER A 61 -86.298 -10.084 -36.620 1.00 0.00 H new ATOM 0 HB3 SER A 61 -87.852 -9.384 -37.027 1.00 0.00 H new ATOM 0 HG SER A 61 -87.304 -7.497 -36.084 1.00 0.00 H new ATOM 602 N GLN A 62 -87.289 -12.457 -35.468 1.00 0.00 N ATOM 603 CA GLN A 62 -87.622 -13.832 -35.841 1.00 0.00 C ATOM 604 C GLN A 62 -88.172 -14.622 -34.658 1.00 0.00 C ATOM 605 O GLN A 62 -88.440 -15.818 -34.765 1.00 0.00 O ATOM 606 CB GLN A 62 -86.384 -14.531 -36.421 1.00 0.00 C ATOM 607 CG GLN A 62 -85.105 -14.379 -35.594 1.00 0.00 C ATOM 608 CD GLN A 62 -85.176 -15.035 -34.224 1.00 0.00 C ATOM 609 OE1 GLN A 62 -85.547 -14.402 -33.235 1.00 0.00 O ATOM 610 NE2 GLN A 62 -84.808 -16.302 -34.154 1.00 0.00 N ATOM 0 H GLN A 62 -86.291 -12.292 -35.338 1.00 0.00 H new ATOM 0 HA GLN A 62 -88.404 -13.793 -36.599 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -86.603 -15.593 -36.530 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -86.200 -14.139 -37.421 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -84.272 -14.809 -36.149 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -84.890 -13.318 -35.467 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -84.507 -16.793 -34.996 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -84.825 -16.789 -33.258 1.00 0.00 H new ATOM 619 N SER A 63 -88.327 -13.945 -33.535 1.00 0.00 N ATOM 620 CA SER A 63 -88.788 -14.577 -32.317 1.00 0.00 C ATOM 621 C SER A 63 -90.235 -15.043 -32.474 1.00 0.00 C ATOM 622 O SER A 63 -90.918 -14.625 -33.415 1.00 0.00 O ATOM 623 CB SER A 63 -88.648 -13.586 -31.168 1.00 0.00 C ATOM 624 OG SER A 63 -87.332 -13.056 -31.116 1.00 0.00 O ATOM 0 H SER A 63 -88.137 -12.947 -33.444 1.00 0.00 H new ATOM 0 HA SER A 63 -88.183 -15.458 -32.103 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.366 -12.776 -31.291 1.00 0.00 H new ATOM 0 HB3 SER A 63 -88.883 -14.080 -30.225 1.00 0.00 H new ATOM 0 HG SER A 63 -86.764 -13.527 -31.761 1.00 0.00 H new ATOM 630 N TRP A 64 -90.695 -15.899 -31.551 1.00 0.00 N ATOM 631 CA TRP A 64 -92.019 -16.522 -31.637 1.00 0.00 C ATOM 632 C TRP A 64 -92.033 -17.601 -32.719 1.00 0.00 C ATOM 633 O TRP A 64 -92.377 -18.749 -32.452 1.00 0.00 O ATOM 634 CB TRP A 64 -93.126 -15.481 -31.884 1.00 0.00 C ATOM 635 CG TRP A 64 -93.360 -14.574 -30.711 1.00 0.00 C ATOM 636 CD1 TRP A 64 -94.222 -14.791 -29.679 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.722 -13.315 -30.440 1.00 0.00 C ATOM 638 NE1 TRP A 64 -94.157 -13.758 -28.782 1.00 0.00 N ATOM 639 CE2 TRP A 64 -93.244 -12.840 -29.225 1.00 0.00 C ATOM 640 CE3 TRP A 64 -91.759 -12.547 -31.102 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.833 -11.638 -28.657 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.352 -11.352 -30.538 1.00 0.00 C ATOM 643 CH2 TRP A 64 -91.887 -10.908 -29.325 1.00 0.00 C ATOM 0 H TRP A 64 -90.161 -16.177 -30.728 1.00 0.00 H new ATOM 0 HA TRP A 64 -92.227 -16.991 -30.675 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -92.861 -14.879 -32.753 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -94.055 -15.998 -32.125 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.864 -15.654 -29.582 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.701 -13.685 -27.922 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.340 -12.882 -32.039 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -93.246 -11.293 -27.721 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -90.609 -10.752 -31.042 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.548 -9.972 -28.907 1.00 0.00 H new ATOM 654 N GLY A 65 -91.639 -17.233 -33.930 1.00 0.00 N ATOM 655 CA GLY A 65 -91.554 -18.192 -35.010 1.00 0.00 C ATOM 656 C GLY A 65 -90.165 -18.795 -35.134 1.00 0.00 C ATOM 657 O GLY A 65 -89.693 -19.478 -34.223 1.00 0.00 O ATOM 0 H GLY A 65 -91.375 -16.281 -34.184 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -92.280 -18.988 -34.845 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -91.822 -17.705 -35.948 1.00 0.00 H new ATOM 661 N ARG A 66 -89.511 -18.539 -36.259 1.00 0.00 N ATOM 662 CA ARG A 66 -88.180 -19.070 -36.525 1.00 0.00 C ATOM 663 C ARG A 66 -87.325 -18.007 -37.194 1.00 0.00 C ATOM 664 O ARG A 66 -87.838 -16.965 -37.606 1.00 0.00 O ATOM 665 CB ARG A 66 -88.268 -20.296 -37.438 1.00 0.00 C ATOM 666 CG ARG A 66 -88.989 -21.479 -36.820 1.00 0.00 C ATOM 667 CD ARG A 66 -89.293 -22.541 -37.863 1.00 0.00 C ATOM 668 NE ARG A 66 -89.985 -23.691 -37.287 1.00 0.00 N ATOM 669 CZ ARG A 66 -91.291 -23.712 -37.013 1.00 0.00 C ATOM 670 NH1 ARG A 66 -92.041 -22.640 -37.246 1.00 0.00 N ATOM 671 NH2 ARG A 66 -91.848 -24.807 -36.505 1.00 0.00 N ATOM 0 H ARG A 66 -89.886 -17.960 -37.010 1.00 0.00 H new ATOM 0 HA ARG A 66 -87.727 -19.362 -35.577 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -88.779 -20.014 -38.359 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -87.259 -20.603 -37.714 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -88.376 -21.908 -36.027 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -89.917 -21.142 -36.358 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -89.906 -22.108 -38.654 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -88.363 -22.872 -38.325 1.00 0.00 H new ATOM 0 HE ARG A 66 -89.438 -24.527 -37.082 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -91.619 -21.797 -37.636 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -93.039 -22.660 -37.035 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -91.277 -25.633 -36.324 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -92.846 -24.821 -36.296 1.00 0.00 H new ATOM 685 N SER A 67 -86.029 -18.273 -37.315 1.00 0.00 N ATOM 686 CA SER A 67 -85.124 -17.369 -38.007 1.00 0.00 C ATOM 687 C SER A 67 -85.313 -17.498 -39.518 1.00 0.00 C ATOM 688 O SER A 67 -84.443 -17.999 -40.237 1.00 0.00 O ATOM 689 CB SER A 67 -83.673 -17.659 -37.611 1.00 0.00 C ATOM 690 OG SER A 67 -83.496 -17.504 -36.211 1.00 0.00 O ATOM 0 H SER A 67 -85.583 -19.110 -36.941 1.00 0.00 H new ATOM 0 HA SER A 67 -85.354 -16.344 -37.716 1.00 0.00 H new ATOM 0 HB2 SER A 67 -83.406 -18.674 -37.907 1.00 0.00 H new ATOM 0 HB3 SER A 67 -83.003 -16.985 -38.144 1.00 0.00 H new ATOM 0 HG SER A 67 -82.564 -17.694 -35.976 1.00 0.00 H new ATOM 696 N SER A 68 -86.480 -17.077 -39.979 1.00 0.00 N ATOM 697 CA SER A 68 -86.831 -17.130 -41.383 1.00 0.00 C ATOM 698 C SER A 68 -86.031 -16.104 -42.178 1.00 0.00 C ATOM 699 O SER A 68 -85.517 -15.130 -41.618 1.00 0.00 O ATOM 700 CB SER A 68 -88.331 -16.875 -41.523 1.00 0.00 C ATOM 701 OG SER A 68 -89.064 -17.740 -40.667 1.00 0.00 O ATOM 0 H SER A 68 -87.212 -16.688 -39.384 1.00 0.00 H new ATOM 0 HA SER A 68 -86.590 -18.115 -41.783 1.00 0.00 H new ATOM 0 HB2 SER A 68 -88.554 -15.837 -41.278 1.00 0.00 H new ATOM 0 HB3 SER A 68 -88.638 -17.031 -42.557 1.00 0.00 H new ATOM 0 HG SER A 68 -89.809 -17.247 -40.264 1.00 0.00 H new ATOM 707 N LYS A 69 -85.911 -16.332 -43.473 1.00 0.00 N ATOM 708 CA LYS A 69 -85.151 -15.444 -44.332 1.00 0.00 C ATOM 709 C LYS A 69 -86.092 -14.622 -45.200 1.00 0.00 C ATOM 710 O LYS A 69 -87.125 -15.124 -45.644 1.00 0.00 O ATOM 711 CB LYS A 69 -84.189 -16.258 -45.203 1.00 0.00 C ATOM 712 CG LYS A 69 -83.275 -15.407 -46.065 1.00 0.00 C ATOM 713 CD LYS A 69 -82.334 -16.262 -46.892 1.00 0.00 C ATOM 714 CE LYS A 69 -81.404 -15.404 -47.733 1.00 0.00 C ATOM 715 NZ LYS A 69 -80.544 -14.532 -46.890 1.00 0.00 N ATOM 0 H LYS A 69 -86.332 -17.127 -43.954 1.00 0.00 H new ATOM 0 HA LYS A 69 -84.569 -14.761 -43.713 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -83.579 -16.892 -44.560 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -84.768 -16.920 -45.847 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -83.875 -14.782 -46.726 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -82.696 -14.736 -45.430 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -81.746 -16.901 -46.233 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -82.912 -16.919 -47.541 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -80.776 -16.046 -48.350 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -81.993 -14.787 -48.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -79.752 -14.170 -47.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -81.105 -13.733 -46.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -80.172 -15.081 -46.089 1.00 0.00 H new ATOM 729 N GLN A 70 -85.734 -13.359 -45.423 1.00 0.00 N ATOM 730 CA GLN A 70 -86.523 -12.458 -46.261 1.00 0.00 C ATOM 731 C GLN A 70 -87.921 -12.255 -45.674 1.00 0.00 C ATOM 732 O GLN A 70 -88.062 -11.932 -44.494 1.00 0.00 O ATOM 733 CB GLN A 70 -86.604 -12.994 -47.698 1.00 0.00 C ATOM 734 CG GLN A 70 -85.253 -13.108 -48.385 1.00 0.00 C ATOM 735 CD GLN A 70 -85.349 -13.768 -49.745 1.00 0.00 C ATOM 736 OE1 GLN A 70 -84.595 -13.447 -50.660 1.00 0.00 O ATOM 737 NE2 GLN A 70 -86.259 -14.718 -49.877 1.00 0.00 N ATOM 0 H GLN A 70 -84.894 -12.933 -45.031 1.00 0.00 H new ATOM 0 HA GLN A 70 -86.026 -11.488 -46.286 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -87.078 -13.975 -47.684 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -87.246 -12.338 -48.285 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -84.821 -12.114 -48.497 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -84.575 -13.681 -47.753 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -86.866 -14.955 -49.093 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -86.354 -15.214 -50.763 1.00 0.00 H new ATOM 746 N TRP A 71 -88.951 -12.452 -46.486 1.00 0.00 N ATOM 747 CA TRP A 71 -90.315 -12.243 -46.039 1.00 0.00 C ATOM 748 C TRP A 71 -91.006 -13.568 -45.752 1.00 0.00 C ATOM 749 O TRP A 71 -91.064 -14.451 -46.610 1.00 0.00 O ATOM 750 CB TRP A 71 -91.121 -11.487 -47.095 1.00 0.00 C ATOM 751 CG TRP A 71 -90.572 -10.138 -47.449 1.00 0.00 C ATOM 752 CD1 TRP A 71 -90.868 -8.953 -46.845 1.00 0.00 C ATOM 753 CD2 TRP A 71 -89.650 -9.833 -48.503 1.00 0.00 C ATOM 754 NE1 TRP A 71 -90.188 -7.928 -47.458 1.00 0.00 N ATOM 755 CE2 TRP A 71 -89.431 -8.446 -48.479 1.00 0.00 C ATOM 756 CE3 TRP A 71 -88.987 -10.604 -49.466 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -88.580 -7.808 -49.379 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -88.142 -9.972 -50.358 1.00 0.00 C ATOM 759 CH2 TRP A 71 -87.944 -8.588 -50.309 1.00 0.00 C ATOM 0 H TRP A 71 -88.865 -12.756 -47.456 1.00 0.00 H new ATOM 0 HA TRP A 71 -90.269 -11.655 -45.123 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -91.170 -12.094 -47.999 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -92.143 -11.366 -46.736 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -91.539 -8.836 -46.007 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -90.238 -6.943 -47.197 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -89.134 -11.673 -49.511 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -88.427 -6.739 -49.345 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -87.626 -10.556 -51.105 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -87.276 -8.124 -51.019 1.00 0.00 H new ATOM 770 N GLU A 72 -91.511 -13.707 -44.537 1.00 0.00 N ATOM 771 CA GLU A 72 -92.400 -14.809 -44.201 1.00 0.00 C ATOM 772 C GLU A 72 -93.756 -14.232 -43.821 1.00 0.00 C ATOM 773 O GLU A 72 -94.768 -14.502 -44.472 1.00 0.00 O ATOM 774 CB GLU A 72 -91.822 -15.657 -43.066 1.00 0.00 C ATOM 775 CG GLU A 72 -92.651 -16.893 -42.745 1.00 0.00 C ATOM 776 CD GLU A 72 -91.931 -17.857 -41.827 1.00 0.00 C ATOM 777 OE1 GLU A 72 -92.014 -17.694 -40.593 1.00 0.00 O ATOM 778 OE2 GLU A 72 -91.279 -18.792 -42.338 1.00 0.00 O ATOM 0 H GLU A 72 -91.320 -13.069 -43.764 1.00 0.00 H new ATOM 0 HA GLU A 72 -92.511 -15.468 -45.062 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -90.812 -15.967 -43.333 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -91.740 -15.042 -42.170 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -93.588 -16.586 -42.280 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -92.908 -17.404 -43.673 1.00 0.00 H new ATOM 785 N ASP A 73 -93.760 -13.413 -42.774 1.00 0.00 N ATOM 786 CA ASP A 73 -94.922 -12.604 -42.434 1.00 0.00 C ATOM 787 C ASP A 73 -94.472 -11.360 -41.681 1.00 0.00 C ATOM 788 O ASP A 73 -94.380 -11.360 -40.459 1.00 0.00 O ATOM 789 CB ASP A 73 -95.940 -13.380 -41.596 1.00 0.00 C ATOM 790 CG ASP A 73 -97.295 -12.691 -41.570 1.00 0.00 C ATOM 791 OD1 ASP A 73 -97.432 -11.647 -40.899 1.00 0.00 O ATOM 792 OD2 ASP A 73 -98.225 -13.189 -42.245 1.00 0.00 O ATOM 0 H ASP A 73 -92.967 -13.293 -42.144 1.00 0.00 H new ATOM 0 HA ASP A 73 -95.415 -12.322 -43.364 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -96.052 -14.386 -42.000 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -95.567 -13.486 -40.577 1.00 0.00 H new ATOM 797 N PRO A 74 -94.124 -10.298 -42.418 1.00 0.00 N ATOM 798 CA PRO A 74 -93.690 -9.026 -41.841 1.00 0.00 C ATOM 799 C PRO A 74 -94.851 -8.061 -41.605 1.00 0.00 C ATOM 800 O PRO A 74 -94.684 -6.843 -41.663 1.00 0.00 O ATOM 801 CB PRO A 74 -92.779 -8.504 -42.931 1.00 0.00 C ATOM 802 CG PRO A 74 -93.503 -8.883 -44.160 1.00 0.00 C ATOM 803 CD PRO A 74 -94.090 -10.245 -43.889 1.00 0.00 C ATOM 0 HA PRO A 74 -93.226 -9.135 -40.861 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -92.637 -7.426 -42.860 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -91.790 -8.959 -42.886 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -94.285 -8.160 -44.392 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -92.830 -8.911 -45.017 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -95.085 -10.350 -44.321 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -93.475 -11.041 -44.308 1.00 0.00 H new ATOM 811 N SER A 75 -96.024 -8.607 -41.338 1.00 0.00 N ATOM 812 CA SER A 75 -97.212 -7.797 -41.192 1.00 0.00 C ATOM 813 C SER A 75 -97.794 -7.922 -39.787 1.00 0.00 C ATOM 814 O SER A 75 -97.059 -8.120 -38.820 1.00 0.00 O ATOM 815 CB SER A 75 -98.234 -8.209 -42.255 1.00 0.00 C ATOM 816 OG SER A 75 -98.371 -9.621 -42.329 1.00 0.00 O ATOM 0 H SER A 75 -96.176 -9.609 -41.219 1.00 0.00 H new ATOM 0 HA SER A 75 -96.951 -6.749 -41.336 1.00 0.00 H new ATOM 0 HB2 SER A 75 -99.200 -7.761 -42.025 1.00 0.00 H new ATOM 0 HB3 SER A 75 -97.926 -7.821 -43.226 1.00 0.00 H new ATOM 0 HG SER A 75 -98.084 -10.022 -41.482 1.00 0.00 H new ATOM 822 N GLN A 76 -99.115 -7.769 -39.692 1.00 0.00 N ATOM 823 CA GLN A 76 -99.860 -7.828 -38.434 1.00 0.00 C ATOM 824 C GLN A 76 -99.598 -6.604 -37.546 1.00 0.00 C ATOM 825 O GLN A 76 -100.425 -6.258 -36.706 1.00 0.00 O ATOM 826 CB GLN A 76 -99.545 -9.118 -37.681 1.00 0.00 C ATOM 827 CG GLN A 76 -99.882 -10.386 -38.456 1.00 0.00 C ATOM 828 CD GLN A 76 -101.352 -10.493 -38.833 1.00 0.00 C ATOM 829 OE1 GLN A 76 -101.698 -11.074 -39.862 1.00 0.00 O ATOM 830 NE2 GLN A 76 -102.226 -9.947 -38.001 1.00 0.00 N ATOM 0 H GLN A 76 -99.709 -7.597 -40.503 1.00 0.00 H new ATOM 0 HA GLN A 76 -100.920 -7.819 -38.688 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -98.485 -9.130 -37.429 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -100.096 -9.122 -36.741 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -99.279 -10.419 -39.363 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -99.604 -11.253 -37.857 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -101.901 -9.474 -37.158 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -103.224 -10.000 -38.203 1.00 0.00 H new ATOM 839 N ALA A 77 -98.462 -5.947 -37.748 1.00 0.00 N ATOM 840 CA ALA A 77 -98.102 -4.764 -36.973 1.00 0.00 C ATOM 841 C ALA A 77 -98.322 -3.488 -37.781 1.00 0.00 C ATOM 842 O ALA A 77 -97.665 -2.469 -37.551 1.00 0.00 O ATOM 843 CB ALA A 77 -96.653 -4.858 -36.524 1.00 0.00 C ATOM 0 H ALA A 77 -97.769 -6.215 -38.447 1.00 0.00 H new ATOM 0 HA ALA A 77 -98.747 -4.722 -36.095 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -96.393 -3.971 -35.946 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -96.521 -5.746 -35.905 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -96.005 -4.925 -37.398 1.00 0.00 H new ATOM 849 N SER A 78 -99.260 -3.543 -38.716 1.00 0.00 N ATOM 850 CA SER A 78 -99.557 -2.406 -39.577 1.00 0.00 C ATOM 851 C SER A 78 -100.000 -1.193 -38.761 1.00 0.00 C ATOM 852 O SER A 78 -99.557 -0.071 -39.005 1.00 0.00 O ATOM 853 CB SER A 78 -100.641 -2.791 -40.586 1.00 0.00 C ATOM 854 OG SER A 78 -100.276 -3.965 -41.293 1.00 0.00 O ATOM 0 H SER A 78 -99.832 -4.368 -38.899 1.00 0.00 H new ATOM 0 HA SER A 78 -98.647 -2.133 -40.111 1.00 0.00 H new ATOM 0 HB2 SER A 78 -101.586 -2.952 -40.068 1.00 0.00 H new ATOM 0 HB3 SER A 78 -100.798 -1.972 -41.288 1.00 0.00 H new ATOM 0 HG SER A 78 -100.983 -4.195 -41.932 1.00 0.00 H new ATOM 860 N LYS A 79 -100.854 -1.431 -37.775 1.00 0.00 N ATOM 861 CA LYS A 79 -101.375 -0.363 -36.931 1.00 0.00 C ATOM 862 C LYS A 79 -100.260 0.233 -36.071 1.00 0.00 C ATOM 863 O LYS A 79 -100.304 1.405 -35.698 1.00 0.00 O ATOM 864 CB LYS A 79 -102.490 -0.916 -36.038 1.00 0.00 C ATOM 865 CG LYS A 79 -103.399 0.146 -35.437 1.00 0.00 C ATOM 866 CD LYS A 79 -104.204 0.863 -36.510 1.00 0.00 C ATOM 867 CE LYS A 79 -105.319 1.711 -35.912 1.00 0.00 C ATOM 868 NZ LYS A 79 -104.803 2.775 -35.011 1.00 0.00 N ATOM 0 H LYS A 79 -101.203 -2.360 -37.539 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.777 0.426 -37.566 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -103.097 -1.608 -36.622 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -102.039 -1.491 -35.229 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -104.077 -0.317 -34.721 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -102.799 0.870 -34.886 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -103.541 1.498 -37.098 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -104.632 0.130 -37.193 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -105.895 2.168 -36.717 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -106.002 1.068 -35.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -105.597 3.345 -34.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -104.305 2.339 -34.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -104.146 3.386 -35.536 1.00 0.00 H new ATOM 882 N VAL A 80 -99.247 -0.582 -35.797 1.00 0.00 N ATOM 883 CA VAL A 80 -98.144 -0.192 -34.925 1.00 0.00 C ATOM 884 C VAL A 80 -97.257 0.862 -35.595 1.00 0.00 C ATOM 885 O VAL A 80 -97.120 1.976 -35.094 1.00 0.00 O ATOM 886 CB VAL A 80 -97.294 -1.417 -34.522 1.00 0.00 C ATOM 887 CG1 VAL A 80 -96.221 -1.033 -33.520 1.00 0.00 C ATOM 888 CG2 VAL A 80 -98.179 -2.519 -33.956 1.00 0.00 C ATOM 0 H VAL A 80 -99.167 -1.528 -36.171 1.00 0.00 H new ATOM 0 HA VAL A 80 -98.579 0.241 -34.024 1.00 0.00 H new ATOM 0 HB VAL A 80 -96.800 -1.792 -35.419 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -95.638 -1.915 -33.255 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -95.564 -0.283 -33.960 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -96.689 -0.624 -32.624 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -97.563 -3.374 -33.678 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -98.704 -2.148 -33.076 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -98.905 -2.825 -34.709 1.00 0.00 H new ATOM 898 N CYS A 81 -96.676 0.528 -36.742 1.00 0.00 N ATOM 899 CA CYS A 81 -95.819 1.478 -37.451 1.00 0.00 C ATOM 900 C CYS A 81 -96.637 2.651 -37.977 1.00 0.00 C ATOM 901 O CYS A 81 -96.107 3.745 -38.177 1.00 0.00 O ATOM 902 CB CYS A 81 -95.053 0.789 -38.583 1.00 0.00 C ATOM 903 SG CYS A 81 -93.933 -0.518 -37.995 1.00 0.00 S ATOM 0 H CYS A 81 -96.779 -0.379 -37.197 1.00 0.00 H new ATOM 0 HA CYS A 81 -95.086 1.866 -36.744 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.766 0.359 -39.287 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.476 1.535 -39.130 1.00 0.00 H new ATOM 908 N GLN A 82 -97.934 2.436 -38.169 1.00 0.00 N ATOM 909 CA GLN A 82 -98.823 3.506 -38.594 1.00 0.00 C ATOM 910 C GLN A 82 -98.905 4.585 -37.516 1.00 0.00 C ATOM 911 O GLN A 82 -98.819 5.775 -37.814 1.00 0.00 O ATOM 912 CB GLN A 82 -100.214 2.961 -38.920 1.00 0.00 C ATOM 913 CG GLN A 82 -101.159 4.008 -39.485 1.00 0.00 C ATOM 914 CD GLN A 82 -102.436 3.408 -40.036 1.00 0.00 C ATOM 915 OE1 GLN A 82 -103.026 3.937 -40.976 1.00 0.00 O ATOM 916 NE2 GLN A 82 -102.868 2.299 -39.461 1.00 0.00 N ATOM 0 H GLN A 82 -98.390 1.533 -38.037 1.00 0.00 H new ATOM 0 HA GLN A 82 -98.416 3.952 -39.501 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.117 2.146 -39.637 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.651 2.539 -38.015 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -101.408 4.726 -38.704 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -100.651 4.560 -40.276 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -102.349 1.892 -38.683 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -103.721 1.850 -39.795 1.00 0.00 H new ATOM 925 N ARG A 83 -99.036 4.167 -36.255 1.00 0.00 N ATOM 926 CA ARG A 83 -99.065 5.116 -35.143 1.00 0.00 C ATOM 927 C ARG A 83 -97.650 5.635 -34.873 1.00 0.00 C ATOM 928 O ARG A 83 -97.462 6.645 -34.192 1.00 0.00 O ATOM 929 CB ARG A 83 -99.669 4.479 -33.875 1.00 0.00 C ATOM 930 CG ARG A 83 -98.758 3.480 -33.174 1.00 0.00 C ATOM 931 CD ARG A 83 -99.479 2.739 -32.054 1.00 0.00 C ATOM 932 NE ARG A 83 -99.958 3.630 -30.994 1.00 0.00 N ATOM 933 CZ ARG A 83 -100.263 3.221 -29.757 1.00 0.00 C ATOM 934 NH1 ARG A 83 -100.120 1.944 -29.414 1.00 0.00 N ATOM 935 NH2 ARG A 83 -100.706 4.085 -28.856 1.00 0.00 N ATOM 0 H ARG A 83 -99.123 3.188 -35.981 1.00 0.00 H new ATOM 0 HA ARG A 83 -99.705 5.954 -35.419 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -99.926 5.272 -33.173 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -100.599 3.977 -34.143 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -98.381 2.761 -33.901 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -97.893 4.003 -32.765 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -100.325 2.194 -32.472 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -98.805 1.999 -31.622 1.00 0.00 H new ATOM 0 HE ARG A 83 -100.065 4.621 -31.212 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -99.776 1.268 -30.096 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -100.355 1.640 -28.469 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -100.816 5.068 -29.103 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -100.937 3.767 -27.915 1.00 0.00 H new ATOM 949 N LEU A 84 -96.663 4.945 -35.442 1.00 0.00 N ATOM 950 CA LEU A 84 -95.263 5.339 -35.331 1.00 0.00 C ATOM 951 C LEU A 84 -94.884 6.251 -36.501 1.00 0.00 C ATOM 952 O LEU A 84 -93.712 6.531 -36.724 1.00 0.00 O ATOM 953 CB LEU A 84 -94.382 4.095 -35.320 1.00 0.00 C ATOM 954 CG LEU A 84 -92.926 4.330 -34.932 1.00 0.00 C ATOM 955 CD1 LEU A 84 -92.828 5.052 -33.597 1.00 0.00 C ATOM 956 CD2 LEU A 84 -92.212 3.006 -34.855 1.00 0.00 C ATOM 0 H LEU A 84 -96.813 4.099 -35.992 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.113 5.887 -34.401 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -94.813 3.371 -34.628 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -94.408 3.643 -36.311 1.00 0.00 H new ATOM 0 HG LEU A 84 -92.458 4.958 -35.690 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -91.779 5.207 -33.343 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -93.331 6.016 -33.667 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -93.303 4.450 -32.822 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -91.171 3.170 -34.578 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -92.692 2.377 -34.106 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -92.256 2.512 -35.826 1.00 0.00 H new ATOM 968 N ASN A 85 -95.914 6.696 -37.234 1.00 0.00 N ATOM 969 CA ASN A 85 -95.787 7.536 -38.438 1.00 0.00 C ATOM 970 C ASN A 85 -94.701 7.040 -39.391 1.00 0.00 C ATOM 971 O ASN A 85 -93.970 7.824 -39.998 1.00 0.00 O ATOM 972 CB ASN A 85 -95.631 9.042 -38.101 1.00 0.00 C ATOM 973 CG ASN A 85 -94.362 9.450 -37.353 1.00 0.00 C ATOM 974 OD1 ASN A 85 -93.267 8.935 -37.574 1.00 0.00 O ATOM 975 ND2 ASN A 85 -94.507 10.416 -36.459 1.00 0.00 N ATOM 0 H ASN A 85 -96.883 6.478 -37.002 1.00 0.00 H new ATOM 0 HA ASN A 85 -96.732 7.437 -38.973 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -95.673 9.605 -39.033 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -96.491 9.348 -37.505 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -93.699 10.750 -35.934 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -95.427 10.826 -36.295 1.00 0.00 H new ATOM 982 N CYS A 86 -94.645 5.723 -39.553 1.00 0.00 N ATOM 983 CA CYS A 86 -93.734 5.095 -40.501 1.00 0.00 C ATOM 984 C CYS A 86 -94.515 4.303 -41.552 1.00 0.00 C ATOM 985 O CYS A 86 -93.939 3.572 -42.356 1.00 0.00 O ATOM 986 CB CYS A 86 -92.739 4.199 -39.755 1.00 0.00 C ATOM 987 SG CYS A 86 -91.582 5.123 -38.702 1.00 0.00 S ATOM 0 H CYS A 86 -95.226 5.065 -39.034 1.00 0.00 H new ATOM 0 HA CYS A 86 -93.172 5.870 -41.022 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -93.292 3.490 -39.139 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -92.172 3.616 -40.481 1.00 0.00 H new ATOM 992 N GLY A 87 -95.837 4.461 -41.532 1.00 0.00 N ATOM 993 CA GLY A 87 -96.685 3.864 -42.549 1.00 0.00 C ATOM 994 C GLY A 87 -97.058 2.425 -42.253 1.00 0.00 C ATOM 995 O GLY A 87 -97.632 2.122 -41.207 1.00 0.00 O ATOM 0 H GLY A 87 -96.338 4.996 -40.823 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -97.596 4.455 -42.645 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -96.173 3.909 -43.510 1.00 0.00 H new ATOM 999 N ASP A 88 -96.722 1.544 -43.185 1.00 0.00 N ATOM 1000 CA ASP A 88 -97.018 0.117 -43.071 1.00 0.00 C ATOM 1001 C ASP A 88 -96.014 -0.538 -42.129 1.00 0.00 C ATOM 1002 O ASP A 88 -95.050 0.111 -41.720 1.00 0.00 O ATOM 1003 CB ASP A 88 -96.969 -0.523 -44.463 1.00 0.00 C ATOM 1004 CG ASP A 88 -98.194 -0.203 -45.293 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -98.287 0.926 -45.817 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -99.073 -1.081 -45.429 1.00 0.00 O ATOM 0 H ASP A 88 -96.235 1.796 -44.045 1.00 0.00 H new ATOM 0 HA ASP A 88 -98.017 -0.027 -42.659 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -96.078 -0.176 -44.987 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -96.877 -1.604 -44.359 1.00 0.00 H new ATOM 1011 N PRO A 89 -96.204 -1.812 -41.732 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.325 -2.426 -40.757 1.00 0.00 C ATOM 1013 C PRO A 89 -93.962 -2.749 -41.291 1.00 0.00 C ATOM 1014 O PRO A 89 -93.763 -3.002 -42.483 1.00 0.00 O ATOM 1015 CB PRO A 89 -96.019 -3.707 -40.359 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.875 -4.053 -41.521 1.00 0.00 C ATOM 1017 CD PRO A 89 -97.265 -2.745 -42.169 1.00 0.00 C ATOM 0 HA PRO A 89 -95.156 -1.735 -39.931 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.299 -4.498 -40.149 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.614 -3.570 -39.456 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -96.337 -4.689 -42.224 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.758 -4.607 -41.202 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -97.302 -2.831 -43.255 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -98.250 -2.413 -41.842 1.00 0.00 H new ATOM 1025 N LEU A 90 -93.039 -2.684 -40.374 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.692 -3.111 -40.549 1.00 0.00 C ATOM 1027 C LEU A 90 -91.590 -4.425 -41.290 1.00 0.00 C ATOM 1028 O LEU A 90 -92.119 -5.452 -40.882 1.00 0.00 O ATOM 1029 CB LEU A 90 -90.989 -3.152 -39.186 1.00 0.00 C ATOM 1030 CG LEU A 90 -91.914 -3.153 -37.950 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -92.942 -4.265 -38.006 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -91.107 -3.250 -36.674 1.00 0.00 C ATOM 0 H LEU A 90 -93.221 -2.313 -39.441 1.00 0.00 H new ATOM 0 HA LEU A 90 -91.181 -2.386 -41.183 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.363 -4.044 -39.148 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.323 -2.292 -39.116 1.00 0.00 H new ATOM 0 HG LEU A 90 -92.454 -2.206 -37.957 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.570 -4.226 -37.116 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.563 -4.142 -38.893 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.434 -5.228 -38.049 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -91.780 -3.249 -35.817 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.528 -4.173 -36.679 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -90.431 -2.398 -36.605 1.00 0.00 H new ATOM 1044 N SER A 91 -90.952 -4.332 -42.424 1.00 0.00 N ATOM 1045 CA SER A 91 -90.623 -5.487 -43.236 1.00 0.00 C ATOM 1046 C SER A 91 -89.488 -6.277 -42.587 1.00 0.00 C ATOM 1047 O SER A 91 -88.626 -5.699 -41.921 1.00 0.00 O ATOM 1048 CB SER A 91 -90.231 -5.034 -44.644 1.00 0.00 C ATOM 1049 OG SER A 91 -91.273 -4.266 -45.234 1.00 0.00 O ATOM 0 H SER A 91 -90.639 -3.446 -42.821 1.00 0.00 H new ATOM 0 HA SER A 91 -91.495 -6.137 -43.309 1.00 0.00 H new ATOM 0 HB2 SER A 91 -89.317 -4.442 -44.600 1.00 0.00 H new ATOM 0 HB3 SER A 91 -90.018 -5.904 -45.265 1.00 0.00 H new ATOM 0 HG SER A 91 -91.007 -3.323 -45.266 1.00 0.00 H new ATOM 1055 N LEU A 92 -89.497 -7.589 -42.782 1.00 0.00 N ATOM 1056 CA LEU A 92 -88.518 -8.472 -42.162 1.00 0.00 C ATOM 1057 C LEU A 92 -87.307 -8.687 -43.058 1.00 0.00 C ATOM 1058 O LEU A 92 -87.429 -8.748 -44.283 1.00 0.00 O ATOM 1059 CB LEU A 92 -89.161 -9.819 -41.828 1.00 0.00 C ATOM 1060 CG LEU A 92 -89.845 -9.888 -40.465 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -90.730 -11.116 -40.374 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -88.801 -9.913 -39.358 1.00 0.00 C ATOM 0 H LEU A 92 -90.178 -8.069 -43.370 1.00 0.00 H new ATOM 0 HA LEU A 92 -88.176 -7.993 -41.245 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -89.895 -10.055 -42.598 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -88.393 -10.592 -41.872 1.00 0.00 H new ATOM 0 HG LEU A 92 -90.469 -9.002 -40.345 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -91.209 -11.148 -39.395 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -91.494 -11.072 -41.150 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -90.124 -12.012 -40.511 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -89.299 -9.962 -38.390 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -88.160 -10.786 -39.482 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -88.195 -9.008 -39.409 1.00 0.00 H new ATOM 1074 N GLY A 93 -86.145 -8.787 -42.430 1.00 0.00 N ATOM 1075 CA GLY A 93 -84.916 -9.061 -43.148 1.00 0.00 C ATOM 1076 C GLY A 93 -83.713 -8.909 -42.242 1.00 0.00 C ATOM 1077 O GLY A 93 -83.828 -8.309 -41.176 1.00 0.00 O ATOM 0 H GLY A 93 -86.031 -8.682 -41.422 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -84.945 -10.073 -43.553 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.826 -8.381 -43.995 1.00 0.00 H new ATOM 1081 N PRO A 94 -82.543 -9.444 -42.618 1.00 0.00 N ATOM 1082 CA PRO A 94 -81.331 -9.316 -41.809 1.00 0.00 C ATOM 1083 C PRO A 94 -80.845 -7.868 -41.765 1.00 0.00 C ATOM 1084 O PRO A 94 -80.466 -7.289 -42.787 1.00 0.00 O ATOM 1085 CB PRO A 94 -80.324 -10.230 -42.517 1.00 0.00 C ATOM 1086 CG PRO A 94 -80.803 -10.295 -43.927 1.00 0.00 C ATOM 1087 CD PRO A 94 -82.305 -10.202 -43.858 1.00 0.00 C ATOM 0 HA PRO A 94 -81.486 -9.595 -40.767 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -79.313 -9.826 -42.460 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -80.298 -11.220 -42.061 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -80.388 -9.479 -44.518 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -80.491 -11.224 -44.403 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -82.716 -9.689 -44.728 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -82.767 -11.188 -43.821 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.884 -7.283 -40.578 1.00 0.00 N ATOM 1096 CA PHE A 95 -80.572 -5.876 -40.407 1.00 0.00 C ATOM 1097 C PHE A 95 -79.127 -5.695 -39.960 1.00 0.00 C ATOM 1098 O PHE A 95 -78.598 -6.493 -39.186 1.00 0.00 O ATOM 1099 CB PHE A 95 -81.540 -5.255 -39.391 1.00 0.00 C ATOM 1100 CG PHE A 95 -81.284 -3.802 -39.102 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -81.268 -2.868 -40.127 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -81.059 -3.369 -37.806 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -81.028 -1.534 -39.863 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -80.821 -2.035 -37.537 1.00 0.00 C ATOM 1105 CZ PHE A 95 -80.806 -1.116 -38.568 1.00 0.00 C ATOM 0 H PHE A 95 -81.131 -7.766 -39.714 1.00 0.00 H new ATOM 0 HA PHE A 95 -80.689 -5.367 -41.364 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -82.559 -5.366 -39.763 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -81.478 -5.815 -38.458 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -81.445 -3.188 -41.143 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -81.070 -4.083 -36.996 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -81.014 -0.818 -40.671 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -80.647 -1.711 -36.522 1.00 0.00 H new ATOM 0 HZ PHE A 95 -80.621 -0.072 -38.360 1.00 0.00 H new ATOM 1115 N LEU A 96 -78.488 -4.652 -40.465 1.00 0.00 N ATOM 1116 CA LEU A 96 -77.110 -4.349 -40.110 1.00 0.00 C ATOM 1117 C LEU A 96 -77.029 -3.719 -38.718 1.00 0.00 C ATOM 1118 O LEU A 96 -77.013 -2.495 -38.565 1.00 0.00 O ATOM 1119 CB LEU A 96 -76.451 -3.442 -41.166 1.00 0.00 C ATOM 1120 CG LEU A 96 -77.198 -2.148 -41.520 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -76.254 -1.162 -42.183 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -78.371 -2.427 -42.448 1.00 0.00 C ATOM 0 H LEU A 96 -78.905 -3.997 -41.126 1.00 0.00 H new ATOM 0 HA LEU A 96 -76.557 -5.288 -40.086 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -75.455 -3.175 -40.813 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -76.320 -4.022 -42.080 1.00 0.00 H new ATOM 0 HG LEU A 96 -77.581 -1.721 -40.593 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -76.796 -0.249 -42.429 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -75.436 -0.927 -41.502 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -75.851 -1.602 -43.095 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -78.881 -1.492 -42.681 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -78.006 -2.881 -43.369 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -79.068 -3.108 -41.959 1.00 0.00 H new ATOM 1134 N LYS A 97 -77.021 -4.577 -37.709 1.00 0.00 N ATOM 1135 CA LYS A 97 -76.906 -4.154 -36.324 1.00 0.00 C ATOM 1136 C LYS A 97 -76.408 -5.319 -35.484 1.00 0.00 C ATOM 1137 O LYS A 97 -76.890 -6.443 -35.631 1.00 0.00 O ATOM 1138 CB LYS A 97 -78.259 -3.673 -35.796 1.00 0.00 C ATOM 1139 CG LYS A 97 -78.194 -3.008 -34.428 1.00 0.00 C ATOM 1140 CD LYS A 97 -77.429 -1.691 -34.473 1.00 0.00 C ATOM 1141 CE LYS A 97 -78.068 -0.709 -35.441 1.00 0.00 C ATOM 1142 NZ LYS A 97 -77.367 0.601 -35.463 1.00 0.00 N ATOM 0 H LYS A 97 -77.094 -5.587 -37.829 1.00 0.00 H new ATOM 0 HA LYS A 97 -76.198 -3.327 -36.262 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -78.686 -2.969 -36.510 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -78.939 -4.523 -35.742 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -79.205 -2.828 -34.063 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -77.714 -3.683 -33.719 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -77.398 -1.253 -33.476 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -76.397 -1.878 -34.771 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -78.065 -1.137 -36.444 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -79.111 -0.556 -35.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -77.839 1.236 -36.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -77.392 1.024 -34.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -76.378 0.461 -35.754 1.00 0.00 H new ATOM 1156 N THR A 98 -75.433 -5.060 -34.631 1.00 0.00 N ATOM 1157 CA THR A 98 -74.887 -6.098 -33.775 1.00 0.00 C ATOM 1158 C THR A 98 -75.880 -6.476 -32.675 1.00 0.00 C ATOM 1159 O THR A 98 -76.146 -5.692 -31.762 1.00 0.00 O ATOM 1160 CB THR A 98 -73.554 -5.654 -33.145 1.00 0.00 C ATOM 1161 OG1 THR A 98 -72.665 -5.180 -34.169 1.00 0.00 O ATOM 1162 CG2 THR A 98 -72.897 -6.802 -32.390 1.00 0.00 C ATOM 0 H THR A 98 -75.004 -4.142 -34.513 1.00 0.00 H new ATOM 0 HA THR A 98 -74.702 -6.973 -34.398 1.00 0.00 H new ATOM 0 HB THR A 98 -73.762 -4.851 -32.438 1.00 0.00 H new ATOM 0 HG1 THR A 98 -71.819 -4.897 -33.763 1.00 0.00 H new ATOM 0 HG21 THR A 98 -71.957 -6.461 -31.955 1.00 0.00 H new ATOM 0 HG22 THR A 98 -73.562 -7.143 -31.596 1.00 0.00 H new ATOM 0 HG23 THR A 98 -72.701 -7.625 -33.078 1.00 0.00 H new ATOM 1170 N TYR A 99 -76.435 -7.672 -32.790 1.00 0.00 N ATOM 1171 CA TYR A 99 -77.372 -8.189 -31.805 1.00 0.00 C ATOM 1172 C TYR A 99 -76.600 -8.742 -30.604 1.00 0.00 C ATOM 1173 O TYR A 99 -75.412 -9.050 -30.714 1.00 0.00 O ATOM 1174 CB TYR A 99 -78.254 -9.267 -32.461 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.216 -9.960 -31.518 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -80.492 -9.454 -31.274 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -78.840 -11.126 -30.865 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -81.354 -10.096 -30.407 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -79.695 -11.765 -29.999 1.00 0.00 C ATOM 1180 CZ TYR A 99 -80.949 -11.248 -29.772 1.00 0.00 C ATOM 1181 OH TYR A 99 -81.799 -11.889 -28.904 1.00 0.00 O ATOM 0 H TYR A 99 -76.250 -8.309 -33.565 1.00 0.00 H new ATOM 0 HA TYR A 99 -78.022 -7.392 -31.445 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -78.825 -8.808 -33.268 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -77.608 -10.018 -32.915 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -80.810 -8.549 -31.769 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -77.858 -11.539 -31.041 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -82.341 -9.696 -30.228 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -79.383 -12.670 -29.499 1.00 0.00 H new ATOM 0 HH TYR A 99 -82.557 -12.259 -29.402 1.00 0.00 H new ATOM 1191 N THR A 100 -77.264 -8.868 -29.464 1.00 0.00 N ATOM 1192 CA THR A 100 -76.606 -9.306 -28.250 1.00 0.00 C ATOM 1193 C THR A 100 -77.527 -10.200 -27.428 1.00 0.00 C ATOM 1194 O THR A 100 -78.673 -9.850 -27.160 1.00 0.00 O ATOM 1195 CB THR A 100 -76.139 -8.103 -27.395 1.00 0.00 C ATOM 1196 OG1 THR A 100 -75.630 -8.559 -26.135 1.00 0.00 O ATOM 1197 CG2 THR A 100 -77.271 -7.112 -27.162 1.00 0.00 C ATOM 0 H THR A 100 -78.259 -8.672 -29.358 1.00 0.00 H new ATOM 0 HA THR A 100 -75.727 -9.879 -28.545 1.00 0.00 H new ATOM 0 HB THR A 100 -75.348 -7.594 -27.945 1.00 0.00 H new ATOM 0 HG1 THR A 100 -75.336 -7.790 -25.603 1.00 0.00 H new ATOM 0 HG21 THR A 100 -76.908 -6.280 -26.558 1.00 0.00 H new ATOM 0 HG22 THR A 100 -77.628 -6.736 -28.121 1.00 0.00 H new ATOM 0 HG23 THR A 100 -78.088 -7.609 -26.640 1.00 0.00 H new ATOM 1205 N PRO A 101 -77.036 -11.375 -27.021 1.00 0.00 N ATOM 1206 CA PRO A 101 -77.798 -12.318 -26.208 1.00 0.00 C ATOM 1207 C PRO A 101 -77.792 -11.929 -24.741 1.00 0.00 C ATOM 1208 O PRO A 101 -78.289 -12.654 -23.877 1.00 0.00 O ATOM 1209 CB PRO A 101 -77.070 -13.656 -26.418 1.00 0.00 C ATOM 1210 CG PRO A 101 -75.948 -13.377 -27.372 1.00 0.00 C ATOM 1211 CD PRO A 101 -75.707 -11.895 -27.327 1.00 0.00 C ATOM 0 HA PRO A 101 -78.849 -12.352 -26.495 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -76.690 -14.045 -25.473 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -77.747 -14.408 -26.823 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -75.050 -13.925 -27.085 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -76.208 -13.697 -28.381 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -74.978 -11.624 -26.563 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -75.330 -11.515 -28.276 1.00 0.00 H new ATOM 1219 N GLN A 102 -77.238 -10.767 -24.480 1.00 0.00 N ATOM 1220 CA GLN A 102 -77.093 -10.267 -23.126 1.00 0.00 C ATOM 1221 C GLN A 102 -78.192 -9.258 -22.813 1.00 0.00 C ATOM 1222 O GLN A 102 -78.915 -9.396 -21.829 1.00 0.00 O ATOM 1223 CB GLN A 102 -75.716 -9.620 -22.948 1.00 0.00 C ATOM 1224 CG GLN A 102 -75.387 -9.247 -21.510 1.00 0.00 C ATOM 1225 CD GLN A 102 -74.976 -10.437 -20.657 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -74.199 -10.293 -19.712 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -75.479 -11.618 -20.981 1.00 0.00 N ATOM 0 H GLN A 102 -76.874 -10.140 -25.198 1.00 0.00 H new ATOM 0 HA GLN A 102 -77.181 -11.104 -22.433 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -74.954 -10.306 -23.318 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -75.665 -8.723 -23.566 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -74.582 -8.512 -21.508 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -76.256 -8.768 -21.059 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -76.120 -11.700 -21.770 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -75.226 -12.446 -20.441 1.00 0.00 H new ATOM 1236 N SER A 103 -78.314 -8.252 -23.664 1.00 0.00 N ATOM 1237 CA SER A 103 -79.293 -7.195 -23.455 1.00 0.00 C ATOM 1238 C SER A 103 -80.559 -7.439 -24.277 1.00 0.00 C ATOM 1239 O SER A 103 -81.640 -6.959 -23.927 1.00 0.00 O ATOM 1240 CB SER A 103 -78.676 -5.845 -23.823 1.00 0.00 C ATOM 1241 OG SER A 103 -77.426 -5.671 -23.174 1.00 0.00 O ATOM 0 H SER A 103 -77.748 -8.144 -24.506 1.00 0.00 H new ATOM 0 HA SER A 103 -79.576 -7.192 -22.402 1.00 0.00 H new ATOM 0 HB2 SER A 103 -78.542 -5.783 -24.903 1.00 0.00 H new ATOM 0 HB3 SER A 103 -79.354 -5.040 -23.539 1.00 0.00 H new ATOM 0 HG SER A 103 -77.046 -4.803 -23.423 1.00 0.00 H new ATOM 1247 N SER A 104 -80.427 -8.186 -25.367 1.00 0.00 N ATOM 1248 CA SER A 104 -81.562 -8.473 -26.226 1.00 0.00 C ATOM 1249 C SER A 104 -82.056 -9.898 -25.988 1.00 0.00 C ATOM 1250 O SER A 104 -81.370 -10.698 -25.344 1.00 0.00 O ATOM 1251 CB SER A 104 -81.175 -8.267 -27.688 1.00 0.00 C ATOM 1252 OG SER A 104 -80.612 -6.980 -27.879 1.00 0.00 O ATOM 0 H SER A 104 -79.547 -8.601 -25.673 1.00 0.00 H new ATOM 0 HA SER A 104 -82.374 -7.787 -25.986 1.00 0.00 H new ATOM 0 HB2 SER A 104 -80.460 -9.031 -27.992 1.00 0.00 H new ATOM 0 HB3 SER A 104 -82.054 -8.383 -28.322 1.00 0.00 H new ATOM 0 HG SER A 104 -80.368 -6.866 -28.821 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.236 -10.211 -26.502 1.00 0.00 N ATOM 1259 CA ILE A 105 -83.871 -11.491 -26.239 1.00 0.00 C ATOM 1260 C ILE A 105 -84.480 -12.102 -27.505 1.00 0.00 C ATOM 1261 O ILE A 105 -84.730 -11.411 -28.495 1.00 0.00 O ATOM 1262 CB ILE A 105 -84.972 -11.357 -25.145 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -85.929 -10.189 -25.423 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -84.352 -11.182 -23.769 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -86.954 -10.453 -26.500 1.00 0.00 C ATOM 0 H ILE A 105 -83.775 -9.591 -27.107 1.00 0.00 H new ATOM 0 HA ILE A 105 -83.087 -12.158 -25.881 1.00 0.00 H new ATOM 0 HB ILE A 105 -85.548 -12.282 -25.171 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.450 -9.937 -24.499 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.341 -9.316 -25.706 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -85.142 -11.091 -23.023 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -83.732 -12.048 -23.537 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -83.737 -10.282 -23.759 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.584 -9.573 -26.626 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.446 -10.673 -27.439 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.572 -11.304 -26.213 1.00 0.00 H new ATOM 1277 N ILE A 106 -84.684 -13.405 -27.461 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.481 -14.110 -28.450 1.00 0.00 C ATOM 1279 C ILE A 106 -86.781 -14.527 -27.764 1.00 0.00 C ATOM 1280 O ILE A 106 -86.743 -15.334 -26.836 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.801 -15.413 -28.934 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.460 -15.133 -29.594 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.710 -16.160 -29.905 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.695 -16.387 -29.960 1.00 0.00 C ATOM 0 H ILE A 106 -84.300 -14.009 -26.734 1.00 0.00 H new ATOM 0 HA ILE A 106 -85.625 -13.450 -29.306 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.623 -16.034 -28.056 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.623 -14.541 -30.494 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -82.852 -14.529 -28.921 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -85.216 -17.074 -30.236 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.646 -16.413 -29.406 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.918 -15.528 -30.768 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.749 -16.113 -30.426 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.500 -16.970 -29.060 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -83.284 -16.982 -30.658 1.00 0.00 H new ATOM 1296 N CYS A 107 -87.922 -13.992 -28.153 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.159 -14.466 -27.545 1.00 0.00 C ATOM 1298 C CYS A 107 -89.636 -15.729 -28.254 1.00 0.00 C ATOM 1299 O CYS A 107 -89.117 -16.084 -29.313 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.269 -13.420 -27.560 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.907 -11.853 -26.726 1.00 0.00 S ATOM 0 H CYS A 107 -88.024 -13.260 -28.856 1.00 0.00 H new ATOM 0 HA CYS A 107 -88.934 -14.680 -26.500 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.522 -13.205 -28.598 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -91.156 -13.856 -27.100 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.623 -16.405 -27.681 1.00 0.00 N ATOM 1307 CA TYR A 108 -91.106 -17.663 -28.239 1.00 0.00 C ATOM 1308 C TYR A 108 -92.623 -17.731 -28.176 1.00 0.00 C ATOM 1309 O TYR A 108 -93.267 -16.856 -27.597 1.00 0.00 O ATOM 1310 CB TYR A 108 -90.524 -18.851 -27.476 1.00 0.00 C ATOM 1311 CG TYR A 108 -89.020 -18.968 -27.542 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -88.399 -19.610 -28.606 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -88.221 -18.441 -26.537 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -87.024 -19.723 -28.664 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -86.846 -18.549 -26.590 1.00 0.00 C ATOM 1316 CZ TYR A 108 -86.254 -19.191 -27.655 1.00 0.00 C ATOM 1317 OH TYR A 108 -84.884 -19.302 -27.710 1.00 0.00 O ATOM 0 H TYR A 108 -91.104 -16.105 -26.833 1.00 0.00 H new ATOM 0 HA TYR A 108 -90.784 -17.708 -29.279 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -90.823 -18.776 -26.431 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -90.964 -19.768 -27.868 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -89.001 -20.027 -29.400 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -88.683 -17.938 -25.700 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -86.555 -20.226 -29.497 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -86.238 -18.132 -25.801 1.00 0.00 H new ATOM 0 HH TYR A 108 -84.489 -18.873 -26.922 1.00 0.00 H new ATOM 1327 N GLY A 109 -93.183 -18.783 -28.753 1.00 0.00 N ATOM 1328 CA GLY A 109 -94.618 -18.949 -28.753 1.00 0.00 C ATOM 1329 C GLY A 109 -95.187 -18.941 -30.150 1.00 0.00 C ATOM 1330 O GLY A 109 -94.695 -19.635 -31.035 1.00 0.00 O ATOM 0 H GLY A 109 -92.666 -19.526 -29.222 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -94.874 -19.888 -28.262 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -95.076 -18.149 -28.170 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.228 -18.164 -30.337 1.00 0.00 N ATOM 1335 CA GLN A 110 -96.819 -17.979 -31.651 1.00 0.00 C ATOM 1336 C GLN A 110 -96.743 -16.516 -32.039 1.00 0.00 C ATOM 1337 O GLN A 110 -96.907 -15.642 -31.185 1.00 0.00 O ATOM 1338 CB GLN A 110 -98.270 -18.457 -31.667 1.00 0.00 C ATOM 1339 CG GLN A 110 -98.419 -19.948 -31.431 1.00 0.00 C ATOM 1340 CD GLN A 110 -99.859 -20.411 -31.501 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -100.139 -21.548 -31.875 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -100.784 -19.535 -31.143 1.00 0.00 N ATOM 0 H GLN A 110 -96.690 -17.643 -29.591 1.00 0.00 H new ATOM 0 HA GLN A 110 -96.261 -18.574 -32.374 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -98.830 -17.919 -30.902 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -98.717 -18.203 -32.628 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -97.831 -20.489 -32.173 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -98.008 -20.200 -30.453 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -100.511 -18.601 -30.838 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -101.770 -19.794 -31.172 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.480 -16.259 -33.316 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.346 -14.896 -33.822 1.00 0.00 C ATOM 1353 C LEU A 111 -97.598 -14.074 -33.517 1.00 0.00 C ATOM 1354 O LEU A 111 -98.611 -14.180 -34.207 1.00 0.00 O ATOM 1355 CB LEU A 111 -96.087 -14.917 -35.332 1.00 0.00 C ATOM 1356 CG LEU A 111 -95.798 -13.553 -35.963 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -94.486 -12.991 -35.435 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -95.767 -13.666 -37.480 1.00 0.00 C ATOM 0 H LEU A 111 -96.355 -16.982 -34.025 1.00 0.00 H new ATOM 0 HA LEU A 111 -95.499 -14.428 -33.320 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -95.243 -15.577 -35.530 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -96.955 -15.352 -35.827 1.00 0.00 H new ATOM 0 HG LEU A 111 -96.598 -12.865 -35.689 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -94.295 -12.021 -35.894 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -94.549 -12.875 -34.353 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -93.673 -13.674 -35.680 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -95.560 -12.688 -37.914 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -94.986 -14.367 -37.777 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -96.732 -14.025 -37.838 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.530 -13.270 -32.466 1.00 0.00 N ATOM 1371 CA GLY A 112 -98.665 -12.469 -32.075 1.00 0.00 C ATOM 1372 C GLY A 112 -98.795 -12.336 -30.572 1.00 0.00 C ATOM 1373 O GLY A 112 -99.051 -11.247 -30.070 1.00 0.00 O ATOM 0 H GLY A 112 -96.705 -13.160 -31.877 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -98.574 -11.477 -32.517 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -99.575 -12.915 -32.476 1.00 0.00 H new ATOM 1377 N SER A 113 -98.599 -13.437 -29.852 1.00 0.00 N ATOM 1378 CA SER A 113 -98.787 -13.447 -28.403 1.00 0.00 C ATOM 1379 C SER A 113 -97.459 -13.235 -27.669 1.00 0.00 C ATOM 1380 O SER A 113 -96.656 -14.157 -27.528 1.00 0.00 O ATOM 1381 CB SER A 113 -99.432 -14.770 -27.973 1.00 0.00 C ATOM 1382 OG SER A 113 -100.645 -14.997 -28.677 1.00 0.00 O ATOM 0 H SER A 113 -98.311 -14.332 -30.246 1.00 0.00 H new ATOM 0 HA SER A 113 -99.448 -12.622 -28.136 1.00 0.00 H new ATOM 0 HB2 SER A 113 -98.741 -15.593 -28.157 1.00 0.00 H new ATOM 0 HB3 SER A 113 -99.627 -14.752 -26.901 1.00 0.00 H new ATOM 0 HG SER A 113 -101.037 -15.847 -28.387 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.241 -12.015 -27.194 1.00 0.00 N ATOM 1389 CA PHE A 114 -95.994 -11.643 -26.525 1.00 0.00 C ATOM 1390 C PHE A 114 -96.053 -11.981 -25.036 1.00 0.00 C ATOM 1391 O PHE A 114 -95.807 -11.131 -24.184 1.00 0.00 O ATOM 1392 CB PHE A 114 -95.729 -10.141 -26.704 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.408 -9.727 -28.116 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -96.058 -10.297 -29.200 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.438 -8.772 -28.355 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -95.748 -9.922 -30.490 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -94.125 -8.393 -29.644 1.00 0.00 C ATOM 1398 CZ PHE A 114 -94.779 -8.968 -30.712 1.00 0.00 C ATOM 0 H PHE A 114 -97.919 -11.256 -27.260 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.182 -12.211 -26.978 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -96.606 -9.588 -26.367 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -94.901 -9.851 -26.057 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -96.818 -11.046 -29.031 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -93.919 -8.318 -27.524 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -96.263 -10.375 -31.324 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -93.366 -7.644 -29.816 1.00 0.00 H new ATOM 0 HZ PHE A 114 -94.533 -8.671 -31.721 1.00 0.00 H new ATOM 1408 N SER A 115 -96.373 -13.230 -24.724 1.00 0.00 N ATOM 1409 CA SER A 115 -96.550 -13.640 -23.338 1.00 0.00 C ATOM 1410 C SER A 115 -95.349 -14.438 -22.817 1.00 0.00 C ATOM 1411 O SER A 115 -95.283 -14.760 -21.629 1.00 0.00 O ATOM 1412 CB SER A 115 -97.831 -14.462 -23.203 1.00 0.00 C ATOM 1413 OG SER A 115 -98.929 -13.770 -23.772 1.00 0.00 O ATOM 0 H SER A 115 -96.515 -13.973 -25.408 1.00 0.00 H new ATOM 0 HA SER A 115 -96.627 -12.738 -22.730 1.00 0.00 H new ATOM 0 HB2 SER A 115 -97.705 -15.425 -23.697 1.00 0.00 H new ATOM 0 HB3 SER A 115 -98.029 -14.667 -22.151 1.00 0.00 H new ATOM 0 HG SER A 115 -99.741 -14.311 -23.679 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.394 -14.749 -23.692 1.00 0.00 N ATOM 1420 CA ASN A 116 -93.242 -15.558 -23.291 1.00 0.00 C ATOM 1421 C ASN A 116 -92.000 -15.201 -24.103 1.00 0.00 C ATOM 1422 O ASN A 116 -92.057 -15.103 -25.329 1.00 0.00 O ATOM 1423 CB ASN A 116 -93.548 -17.051 -23.464 1.00 0.00 C ATOM 1424 CG ASN A 116 -92.437 -17.934 -22.923 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -91.791 -17.598 -21.930 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -92.204 -19.068 -23.570 1.00 0.00 N ATOM 0 H ASN A 116 -94.393 -14.459 -24.670 1.00 0.00 H new ATOM 0 HA ASN A 116 -93.044 -15.344 -22.241 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -94.480 -17.290 -22.953 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -93.699 -17.268 -24.521 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -91.468 -19.697 -23.248 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -92.761 -19.312 -24.389 1.00 0.00 H new ATOM 1433 N CYS A 117 -90.877 -15.011 -23.419 1.00 0.00 N ATOM 1434 CA CYS A 117 -89.617 -14.738 -24.095 1.00 0.00 C ATOM 1435 C CYS A 117 -88.459 -15.405 -23.357 1.00 0.00 C ATOM 1436 O CYS A 117 -88.640 -15.963 -22.273 1.00 0.00 O ATOM 1437 CB CYS A 117 -89.336 -13.233 -24.186 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.650 -12.205 -24.888 1.00 0.00 S ATOM 0 H CYS A 117 -90.815 -15.041 -22.401 1.00 0.00 H new ATOM 0 HA CYS A 117 -89.703 -15.143 -25.103 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -89.115 -12.866 -23.184 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.435 -13.090 -24.783 1.00 0.00 H new ATOM 1443 N SER A 118 -87.271 -15.340 -23.952 1.00 0.00 N ATOM 1444 CA SER A 118 -86.049 -15.839 -23.332 1.00 0.00 C ATOM 1445 C SER A 118 -84.849 -15.120 -23.944 1.00 0.00 C ATOM 1446 O SER A 118 -85.015 -14.294 -24.836 1.00 0.00 O ATOM 1447 CB SER A 118 -85.913 -17.350 -23.536 1.00 0.00 C ATOM 1448 OG SER A 118 -87.015 -18.048 -22.973 1.00 0.00 O ATOM 0 H SER A 118 -87.129 -14.939 -24.879 1.00 0.00 H new ATOM 0 HA SER A 118 -86.090 -15.645 -22.260 1.00 0.00 H new ATOM 0 HB2 SER A 118 -85.846 -17.571 -24.601 1.00 0.00 H new ATOM 0 HB3 SER A 118 -84.987 -17.699 -23.079 1.00 0.00 H new ATOM 0 HG SER A 118 -86.902 -19.010 -23.120 1.00 0.00 H new ATOM 1454 N HIS A 119 -83.650 -15.411 -23.458 1.00 0.00 N ATOM 1455 CA HIS A 119 -82.434 -14.845 -24.043 1.00 0.00 C ATOM 1456 C HIS A 119 -82.104 -15.530 -25.364 1.00 0.00 C ATOM 1457 O HIS A 119 -82.708 -16.544 -25.713 1.00 0.00 O ATOM 1458 CB HIS A 119 -81.246 -14.971 -23.083 1.00 0.00 C ATOM 1459 CG HIS A 119 -81.255 -13.974 -21.963 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -80.196 -13.134 -21.694 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -82.194 -13.694 -21.031 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -80.484 -12.383 -20.648 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -81.693 -12.702 -20.226 1.00 0.00 N ATOM 0 H HIS A 119 -83.490 -16.032 -22.665 1.00 0.00 H new ATOM 0 HA HIS A 119 -82.619 -13.787 -24.227 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -81.239 -15.976 -22.661 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -80.322 -14.857 -23.649 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -79.324 -13.098 -22.222 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -83.161 -14.165 -20.937 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -79.840 -11.634 -20.211 1.00 0.00 H new ATOM 1472 N SER A 120 -81.149 -14.972 -26.098 1.00 0.00 N ATOM 1473 CA SER A 120 -80.741 -15.541 -27.369 1.00 0.00 C ATOM 1474 C SER A 120 -79.913 -16.805 -27.133 1.00 0.00 C ATOM 1475 O SER A 120 -78.710 -16.733 -26.883 1.00 0.00 O ATOM 1476 CB SER A 120 -79.943 -14.510 -28.176 1.00 0.00 C ATOM 1477 OG SER A 120 -79.844 -14.885 -29.538 1.00 0.00 O ATOM 0 H SER A 120 -80.645 -14.126 -25.832 1.00 0.00 H new ATOM 0 HA SER A 120 -81.628 -15.812 -27.942 1.00 0.00 H new ATOM 0 HB2 SER A 120 -80.424 -13.535 -28.100 1.00 0.00 H new ATOM 0 HB3 SER A 120 -78.944 -14.407 -27.752 1.00 0.00 H new ATOM 0 HG SER A 120 -80.509 -14.392 -30.062 1.00 0.00 H new ATOM 1483 N ARG A 121 -80.572 -17.958 -27.177 1.00 0.00 N ATOM 1484 CA ARG A 121 -79.914 -19.222 -26.864 1.00 0.00 C ATOM 1485 C ARG A 121 -79.939 -20.194 -28.044 1.00 0.00 C ATOM 1486 O ARG A 121 -78.893 -20.593 -28.549 1.00 0.00 O ATOM 1487 CB ARG A 121 -80.595 -19.879 -25.660 1.00 0.00 C ATOM 1488 CG ARG A 121 -79.912 -21.152 -25.182 1.00 0.00 C ATOM 1489 CD ARG A 121 -80.793 -21.927 -24.213 1.00 0.00 C ATOM 1490 NE ARG A 121 -81.221 -21.112 -23.078 1.00 0.00 N ATOM 1491 CZ ARG A 121 -81.887 -21.590 -22.024 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -82.183 -22.884 -21.942 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -82.266 -20.767 -21.052 1.00 0.00 N ATOM 0 H ARG A 121 -81.558 -18.044 -27.425 1.00 0.00 H new ATOM 0 HA ARG A 121 -78.873 -18.995 -26.636 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -80.625 -19.164 -24.838 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -81.628 -20.109 -25.921 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -79.671 -21.781 -26.039 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -78.969 -20.900 -24.696 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -81.671 -22.299 -24.742 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -80.248 -22.798 -23.847 1.00 0.00 H new ATOM 0 HE ARG A 121 -80.997 -20.117 -23.092 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -81.901 -23.520 -22.688 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -82.692 -23.240 -21.133 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -82.048 -19.772 -21.112 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -82.775 -21.130 -20.246 1.00 0.00 H new ATOM 1550 N CYS A 125 -80.203 -15.453 -32.948 1.00 0.00 N ATOM 1551 CA CYS A 125 -80.817 -14.767 -34.081 1.00 0.00 C ATOM 1552 C CYS A 125 -79.852 -13.824 -34.788 1.00 0.00 C ATOM 1553 O CYS A 125 -79.303 -12.898 -34.186 1.00 0.00 O ATOM 1554 CB CYS A 125 -82.069 -14.041 -33.594 1.00 0.00 C ATOM 1555 SG CYS A 125 -82.008 -13.605 -31.829 1.00 0.00 S ATOM 0 HA CYS A 125 -81.095 -15.509 -34.830 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.205 -13.133 -34.181 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -82.940 -14.671 -33.775 1.00 0.00 H new ATOM 1560 N HIS A 126 -79.666 -14.081 -36.080 1.00 0.00 N ATOM 1561 CA HIS A 126 -78.642 -13.414 -36.885 1.00 0.00 C ATOM 1562 C HIS A 126 -79.059 -11.994 -37.242 1.00 0.00 C ATOM 1563 O HIS A 126 -79.266 -11.683 -38.415 1.00 0.00 O ATOM 1564 CB HIS A 126 -78.369 -14.197 -38.179 1.00 0.00 C ATOM 1565 CG HIS A 126 -78.368 -15.686 -38.005 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -77.542 -16.343 -37.123 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -79.133 -16.641 -38.583 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -77.799 -17.637 -37.163 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -78.758 -17.844 -38.040 1.00 0.00 N ATOM 0 H HIS A 126 -80.222 -14.759 -36.601 1.00 0.00 H new ATOM 0 HA HIS A 126 -77.733 -13.377 -36.284 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -79.123 -13.929 -38.919 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -77.404 -13.888 -38.581 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -79.896 -16.485 -39.332 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -77.306 -18.397 -36.575 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -79.158 -18.752 -38.278 1.00 0.00 H new ATOM 1578 N SER A 127 -79.203 -11.153 -36.222 1.00 0.00 N ATOM 1579 CA SER A 127 -79.522 -9.733 -36.387 1.00 0.00 C ATOM 1580 C SER A 127 -80.734 -9.499 -37.296 1.00 0.00 C ATOM 1581 O SER A 127 -80.809 -8.482 -37.986 1.00 0.00 O ATOM 1582 CB SER A 127 -78.299 -8.970 -36.914 1.00 0.00 C ATOM 1583 OG SER A 127 -77.808 -9.527 -38.124 1.00 0.00 O ATOM 0 H SER A 127 -79.101 -11.438 -35.248 1.00 0.00 H new ATOM 0 HA SER A 127 -79.790 -9.351 -35.402 1.00 0.00 H new ATOM 0 HB2 SER A 127 -78.565 -7.926 -37.077 1.00 0.00 H new ATOM 0 HB3 SER A 127 -77.510 -8.984 -36.162 1.00 0.00 H new ATOM 0 HG SER A 127 -78.498 -10.095 -38.526 1.00 0.00 H new ATOM 1589 N LEU A 128 -81.684 -10.432 -37.289 1.00 0.00 N ATOM 1590 CA LEU A 128 -82.924 -10.240 -38.029 1.00 0.00 C ATOM 1591 C LEU A 128 -83.616 -8.990 -37.519 1.00 0.00 C ATOM 1592 O LEU A 128 -83.797 -8.822 -36.315 1.00 0.00 O ATOM 1593 CB LEU A 128 -83.866 -11.448 -37.897 1.00 0.00 C ATOM 1594 CG LEU A 128 -83.510 -12.681 -38.741 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -83.314 -12.293 -40.198 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -82.275 -13.384 -38.201 1.00 0.00 C ATOM 0 H LEU A 128 -81.619 -11.317 -36.785 1.00 0.00 H new ATOM 0 HA LEU A 128 -82.677 -10.134 -39.085 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -83.895 -11.747 -36.849 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -84.873 -11.128 -38.165 1.00 0.00 H new ATOM 0 HG LEU A 128 -84.344 -13.381 -38.678 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -83.062 -13.180 -40.780 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -84.234 -11.854 -40.585 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -82.505 -11.567 -40.275 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -82.050 -14.252 -38.821 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -81.429 -12.697 -38.218 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -82.459 -13.708 -37.177 1.00 0.00 H new ATOM 1608 N GLY A 129 -83.986 -8.111 -38.427 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.526 -6.841 -38.029 1.00 0.00 C ATOM 1610 C GLY A 129 -85.811 -6.521 -38.738 1.00 0.00 C ATOM 1611 O GLY A 129 -86.255 -7.266 -39.617 1.00 0.00 O ATOM 0 H GLY A 129 -83.921 -8.256 -39.435 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.698 -6.843 -36.953 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.796 -6.058 -38.234 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.397 -5.410 -38.356 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.649 -4.961 -38.916 1.00 0.00 C ATOM 1617 C LEU A 130 -87.533 -3.492 -39.311 1.00 0.00 C ATOM 1618 O LEU A 130 -86.829 -2.719 -38.661 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.762 -5.158 -37.889 1.00 0.00 C ATOM 1620 CG LEU A 130 -89.372 -6.560 -37.834 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -90.107 -6.768 -36.524 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -90.323 -6.766 -39.002 1.00 0.00 C ATOM 0 H LEU A 130 -86.015 -4.789 -37.643 1.00 0.00 H new ATOM 0 HA LEU A 130 -87.888 -5.542 -39.807 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -88.368 -4.914 -36.902 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.557 -4.443 -38.101 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.565 -7.290 -37.902 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -90.535 -7.770 -36.502 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -89.410 -6.652 -35.694 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.905 -6.031 -36.434 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.750 -7.768 -38.951 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -91.123 -6.027 -38.954 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.778 -6.651 -39.939 1.00 0.00 H new ATOM 1634 N THR A 131 -88.196 -3.108 -40.383 1.00 0.00 N ATOM 1635 CA THR A 131 -88.137 -1.736 -40.849 1.00 0.00 C ATOM 1636 C THR A 131 -89.511 -1.262 -41.321 1.00 0.00 C ATOM 1637 O THR A 131 -89.985 -1.670 -42.382 1.00 0.00 O ATOM 1638 CB THR A 131 -87.071 -1.609 -41.950 1.00 0.00 C ATOM 1639 OG1 THR A 131 -87.009 -0.275 -42.468 1.00 0.00 O ATOM 1640 CG2 THR A 131 -87.301 -2.592 -43.088 1.00 0.00 C ATOM 0 H THR A 131 -88.781 -3.724 -40.947 1.00 0.00 H new ATOM 0 HA THR A 131 -87.848 -1.086 -40.023 1.00 0.00 H new ATOM 0 HB THR A 131 -86.117 -1.850 -41.481 1.00 0.00 H new ATOM 0 HG1 THR A 131 -87.286 0.359 -41.774 1.00 0.00 H new ATOM 0 HG21 THR A 131 -86.524 -2.465 -43.841 1.00 0.00 H new ATOM 0 HG22 THR A 131 -87.268 -3.611 -42.701 1.00 0.00 H new ATOM 0 HG23 THR A 131 -88.276 -2.406 -43.538 1.00 0.00 H new ATOM 1648 N CYS A 132 -90.160 -0.433 -40.483 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.570 -0.052 -40.670 1.00 0.00 C ATOM 1650 C CYS A 132 -91.834 0.384 -42.091 1.00 0.00 C ATOM 1651 O CYS A 132 -91.444 1.473 -42.515 1.00 0.00 O ATOM 1652 CB CYS A 132 -91.990 1.027 -39.674 1.00 0.00 C ATOM 1653 SG CYS A 132 -92.131 0.408 -37.972 1.00 0.00 S ATOM 0 H CYS A 132 -89.724 -0.011 -39.663 1.00 0.00 H new ATOM 0 HA CYS A 132 -92.179 -0.935 -40.476 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.264 1.840 -39.700 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -92.948 1.445 -39.983 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.488 -0.524 -42.803 1.00 0.00 N ATOM 1659 CA LEU A 133 -92.749 -0.427 -44.220 1.00 0.00 C ATOM 1660 C LEU A 133 -91.457 -0.603 -45.017 1.00 0.00 C ATOM 1661 O LEU A 133 -91.268 -1.610 -45.703 1.00 0.00 O ATOM 1662 CB LEU A 133 -93.452 0.892 -44.576 1.00 0.00 C ATOM 1663 CG LEU A 133 -93.624 1.164 -46.074 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -94.448 0.071 -46.740 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -94.267 2.522 -46.293 1.00 0.00 C ATOM 0 H LEU A 133 -92.862 -1.377 -42.388 1.00 0.00 H new ATOM 0 HA LEU A 133 -93.428 -1.235 -44.492 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -94.437 0.897 -44.108 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -92.887 1.715 -44.138 1.00 0.00 H new ATOM 0 HG LEU A 133 -92.635 1.165 -46.533 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -94.553 0.291 -47.802 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -93.947 -0.889 -46.616 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -95.435 0.027 -46.279 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -94.383 2.702 -47.362 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -95.246 2.543 -45.813 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -93.635 3.298 -45.861 1.00 0.00 H new ATOM 1677 N GLU A 134 -90.569 0.367 -44.900 1.00 0.00 N ATOM 1678 CA GLU A 134 -89.268 0.317 -45.553 1.00 0.00 C ATOM 1679 C GLU A 134 -88.333 1.348 -44.935 1.00 0.00 C ATOM 1680 O GLU A 134 -88.786 2.299 -44.289 1.00 0.00 O ATOM 1681 CB GLU A 134 -89.399 0.568 -47.055 1.00 0.00 C ATOM 1682 CG GLU A 134 -90.049 1.896 -47.403 1.00 0.00 C ATOM 1683 CD GLU A 134 -90.037 2.166 -48.889 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -90.841 1.549 -49.615 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -89.203 2.976 -49.346 1.00 0.00 O ATOM 0 H GLU A 134 -90.726 1.212 -44.351 1.00 0.00 H new ATOM 0 HA GLU A 134 -88.852 -0.680 -45.407 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -88.408 0.530 -47.507 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -89.983 -0.238 -47.499 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -91.078 1.900 -47.043 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -89.527 2.701 -46.885 1.00 0.00 H new