USER MOD reduce.3.24.130724 H: found=0, std=0, add=988, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 980 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: B 180 HIS : no HE2:sc= -5.77! C(o=-7.5!,f=-13!) USER MOD Set 1.2: B 192 CYS SG : rot 117:sc= -1.71! USER MOD Set 2.1: B 157 MET CE :methyl 171:sc= -3.06 (180deg=-3.8) USER MOD Set 2.2: B 174 SER OG : rot -170:sc= -3.77! USER MOD Set 3.1: B 156 HIS : no HE2:sc= -15.5! C(o=-37!,f=-40!) USER MOD Set 3.2: B 160 CYS SG : rot 90:sc= -7.56! USER MOD Set 3.3: B 166 CYS SG : rot 125:sc= -10.3! USER MOD Set 3.4: B 171 CYS SG : rot -129:sc= -3.69 USER MOD Set 4.1: B 119 GLN : amide:sc= -2.04 X(o=-2,f=-2.1) USER MOD Set 4.2: B 150 MET CE :methyl 179:sc= 0 (180deg=-0.00049) USER MOD Set 5.1: B 125 HIS : no HE2:sc= -7.7! C(o=-11!,f=-20!) USER MOD Set 5.2: B 129 CYS SG : rot 157:sc= -0.616! USER MOD Set 5.3: B 142 CYS SG : rot 160:sc= -0.446 USER MOD Set 5.4: B 147 CYS SG : rot 162:sc= -2.26 USER MOD Set 6.1: A 27 ASN : amide:sc= -9.2! C(o=-13!,f=-19!) USER MOD Set 6.2: B 183 ASN :FLIP amide:sc= -3.35 F(o=-13,f=-13) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 THR OG1 : rot 113:sc= 0.673 USER MOD Single : A 13 SER OG : rot -140:sc= -0.715 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 CYS SG : rot 130:sc= -1.07 USER MOD Single : A 19 ASN : amide:sc= -1.74 K(o=-1.7,f=-4.1!) USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.0744 X(o=-0.074,f=-0.51) USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : B 112 LYS NZ :NH3+ -178:sc= 0.00365 (180deg=0.00346) USER MOD Single : B 114 LYS NZ :NH3+ -105:sc= -1.15 (180deg=-2.95!) USER MOD Single : B 117 GLN : amide:sc= -1.92 K(o=-1.9,f=-5!) USER MOD Single : B 118 GLN : amide:sc= -0.0223 X(o=-0.022,f=-0.01) USER MOD Single : B 127 HIS : no HE2:sc= -2.96! C(o=-3!,f=-5.7!) USER MOD Single : B 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 130 GLN : amide:sc= -0.253 K(o=-0.25,f=-0.97) USER MOD Single : B 134 GLN : amide:sc= -0.519 K(o=-0.52,f=-3!) USER MOD Single : B 136 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 141 GLN : amide:sc= -0.144 X(o=-0.14,f=-0.0074) USER MOD Single : B 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 146 HIS : no HE2:sc= -0.338 X(o=-0.34,f=-0.14) USER MOD Single : B 149 THR OG1 : rot 102:sc= 1.28 USER MOD Single : B 151 LYS NZ :NH3+ 180:sc= -0.0738 (180deg=-0.0738) USER MOD Single : B 152 ASN : amide:sc= 0.542 K(o=0.54,f=-8.2!) USER MOD Single : B 155 ASN : amide:sc= 0 X(o=0,f=0.033) USER MOD Single : B 158 THR OG1 : rot 96:sc= 1.14 USER MOD Single : B 159 HIS : no HD1:sc= -0.254 X(o=-0.25,f=-0.085) USER MOD Single : B 161 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 162 SER OG : rot 180:sc= 0 USER MOD Single : B 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 165 SER OG : rot -52:sc= 0.0404 USER MOD Single : B 167 GLN : amide:sc= -0.0315 X(o=-0.032,f=-0.084) USER MOD Single : B 170 HIS :FLIP no HD1:sc= -7.7! C(o=-8.5!,f=-7.7!) USER MOD Single : B 173 SER OG : rot -167:sc= 0.458 USER MOD Single : B 176 GLN :FLIP amide:sc= -0.818 F(o=-1.8,f=-0.82) USER MOD Single : B 179 SER OG : rot 113:sc= 1.09 USER MOD Single : B 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 185 THR OG1 : rot 180:sc= -0.375 USER MOD Single : B 187 HIS : no HD1:sc= -0.312 X(o=-0.31,f=-0.8) USER MOD Single : B 196 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 83 N LEU A 8 1.435 1.485 -23.367 1.00 0.00 N ATOM 84 CA LEU A 8 1.884 1.468 -21.986 1.00 0.00 C ATOM 85 C LEU A 8 1.754 2.839 -21.340 1.00 0.00 C ATOM 86 O LEU A 8 2.217 3.839 -21.889 1.00 0.00 O ATOM 87 CB LEU A 8 3.343 1.034 -21.927 1.00 0.00 C ATOM 88 CG LEU A 8 3.762 0.302 -20.655 1.00 0.00 C ATOM 89 CD1 LEU A 8 3.779 1.244 -19.458 1.00 0.00 C ATOM 90 CD2 LEU A 8 2.847 -0.884 -20.392 1.00 0.00 C ATOM 0 HA LEU A 8 1.254 0.765 -21.441 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.546 0.387 -22.781 1.00 0.00 H new ATOM 0 HB3 LEU A 8 3.971 1.918 -22.040 1.00 0.00 H new ATOM 0 HG LEU A 8 4.776 -0.071 -20.802 1.00 0.00 H new ATOM 0 HD11 LEU A 8 4.081 0.694 -18.567 1.00 0.00 H new ATOM 0 HD12 LEU A 8 4.485 2.053 -19.642 1.00 0.00 H new ATOM 0 HD13 LEU A 8 2.783 1.659 -19.308 1.00 0.00 H new ATOM 0 HD21 LEU A 8 3.163 -1.392 -19.481 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.822 -0.534 -20.275 1.00 0.00 H new ATOM 0 HD23 LEU A 8 2.900 -1.578 -21.231 1.00 0.00 H new ATOM 102 N PRO A 9 1.150 2.907 -20.144 1.00 0.00 N ATOM 103 CA PRO A 9 1.005 4.168 -19.424 1.00 0.00 C ATOM 104 C PRO A 9 2.371 4.731 -19.056 1.00 0.00 C ATOM 105 O PRO A 9 3.033 4.236 -18.144 1.00 0.00 O ATOM 106 CB PRO A 9 0.223 3.781 -18.163 1.00 0.00 C ATOM 107 CG PRO A 9 0.434 2.313 -18.006 1.00 0.00 C ATOM 108 CD PRO A 9 0.594 1.767 -19.395 1.00 0.00 C ATOM 0 HA PRO A 9 0.504 4.937 -20.012 1.00 0.00 H new ATOM 0 HB2 PRO A 9 0.586 4.326 -17.292 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -0.836 4.017 -18.268 1.00 0.00 H new ATOM 0 HG2 PRO A 9 1.318 2.108 -17.402 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -0.412 1.849 -17.500 1.00 0.00 H new ATOM 0 HD2 PRO A 9 1.264 0.907 -19.415 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -0.359 1.439 -19.811 1.00 0.00 H new ATOM 116 N GLN A 10 2.800 5.756 -19.783 1.00 0.00 N ATOM 117 CA GLN A 10 4.100 6.368 -19.541 1.00 0.00 C ATOM 118 C GLN A 10 3.962 7.641 -18.708 1.00 0.00 C ATOM 119 O GLN A 10 3.047 8.437 -18.919 1.00 0.00 O ATOM 120 CB GLN A 10 4.790 6.677 -20.873 1.00 0.00 C ATOM 121 CG GLN A 10 6.077 7.476 -20.729 1.00 0.00 C ATOM 122 CD GLN A 10 6.711 7.808 -22.065 1.00 0.00 C ATOM 123 OE1 GLN A 10 6.879 8.976 -22.413 1.00 0.00 O ATOM 124 NE2 GLN A 10 7.067 6.778 -22.824 1.00 0.00 N ATOM 0 H GLN A 10 2.268 6.180 -20.543 1.00 0.00 H new ATOM 0 HA GLN A 10 4.711 5.662 -18.978 1.00 0.00 H new ATOM 0 HB2 GLN A 10 5.011 5.739 -21.383 1.00 0.00 H new ATOM 0 HB3 GLN A 10 4.099 7.231 -21.509 1.00 0.00 H new ATOM 0 HG2 GLN A 10 5.868 8.401 -20.191 1.00 0.00 H new ATOM 0 HG3 GLN A 10 6.786 6.909 -20.126 1.00 0.00 H new ATOM 0 HE21 GLN A 10 6.909 5.825 -22.497 1.00 0.00 H new ATOM 0 HE22 GLN A 10 7.498 6.940 -23.734 1.00 0.00 H new ATOM 133 N LEU A 11 4.880 7.825 -17.765 1.00 0.00 N ATOM 134 CA LEU A 11 4.867 8.997 -16.903 1.00 0.00 C ATOM 135 C LEU A 11 6.230 9.686 -16.900 1.00 0.00 C ATOM 136 O LEU A 11 7.244 9.073 -17.232 1.00 0.00 O ATOM 137 CB LEU A 11 4.473 8.605 -15.477 1.00 0.00 C ATOM 138 CG LEU A 11 3.023 8.149 -15.309 1.00 0.00 C ATOM 139 CD1 LEU A 11 2.910 7.133 -14.183 1.00 0.00 C ATOM 140 CD2 LEU A 11 2.117 9.342 -15.048 1.00 0.00 C ATOM 0 H LEU A 11 5.643 7.175 -17.580 1.00 0.00 H new ATOM 0 HA LEU A 11 4.129 9.697 -17.294 1.00 0.00 H new ATOM 0 HB2 LEU A 11 5.131 7.803 -15.142 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.648 9.457 -14.820 1.00 0.00 H new ATOM 0 HG LEU A 11 2.702 7.671 -16.234 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.871 6.820 -14.078 1.00 0.00 H new ATOM 0 HD12 LEU A 11 3.529 6.266 -14.412 1.00 0.00 H new ATOM 0 HD13 LEU A 11 3.249 7.584 -13.250 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.089 8.999 -14.931 1.00 0.00 H new ATOM 0 HD22 LEU A 11 2.436 9.849 -14.138 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.175 10.034 -15.888 1.00 0.00 H new ATOM 152 N THR A 12 6.245 10.960 -16.523 1.00 0.00 N ATOM 153 CA THR A 12 7.481 11.730 -16.477 1.00 0.00 C ATOM 154 C THR A 12 8.210 11.508 -15.159 1.00 0.00 C ATOM 155 O THR A 12 7.586 11.303 -14.119 1.00 0.00 O ATOM 156 CB THR A 12 7.174 13.214 -16.652 1.00 0.00 C ATOM 157 OG1 THR A 12 6.377 13.430 -17.803 1.00 0.00 O ATOM 158 CG2 THR A 12 8.412 14.075 -16.783 1.00 0.00 C ATOM 0 H THR A 12 5.414 11.481 -16.245 1.00 0.00 H new ATOM 0 HA THR A 12 8.125 11.393 -17.289 1.00 0.00 H new ATOM 0 HB THR A 12 6.646 13.505 -15.744 1.00 0.00 H new ATOM 0 HG1 THR A 12 5.490 13.748 -17.532 1.00 0.00 H new ATOM 0 HG21 THR A 12 8.119 15.118 -16.904 1.00 0.00 H new ATOM 0 HG22 THR A 12 9.023 13.972 -15.887 1.00 0.00 H new ATOM 0 HG23 THR A 12 8.987 13.756 -17.653 1.00 0.00 H new ATOM 166 N SER A 13 9.538 11.555 -15.210 1.00 0.00 N ATOM 167 CA SER A 13 10.359 11.367 -14.027 1.00 0.00 C ATOM 168 C SER A 13 9.879 12.242 -12.870 1.00 0.00 C ATOM 169 O SER A 13 10.148 11.946 -11.705 1.00 0.00 O ATOM 170 CB SER A 13 11.822 11.678 -14.344 1.00 0.00 C ATOM 171 OG SER A 13 12.638 11.518 -13.196 1.00 0.00 O ATOM 0 H SER A 13 10.067 11.723 -16.065 1.00 0.00 H new ATOM 0 HA SER A 13 10.270 10.324 -13.722 1.00 0.00 H new ATOM 0 HB2 SER A 13 12.173 11.019 -15.138 1.00 0.00 H new ATOM 0 HB3 SER A 13 11.908 12.699 -14.715 1.00 0.00 H new ATOM 0 HG SER A 13 13.306 12.234 -13.167 1.00 0.00 H new ATOM 177 N TYR A 14 9.174 13.325 -13.196 1.00 0.00 N ATOM 178 CA TYR A 14 8.666 14.238 -12.177 1.00 0.00 C ATOM 179 C TYR A 14 7.216 13.920 -11.830 1.00 0.00 C ATOM 180 O TYR A 14 6.832 13.930 -10.660 1.00 0.00 O ATOM 181 CB TYR A 14 8.785 15.685 -12.659 1.00 0.00 C ATOM 182 CG TYR A 14 8.796 16.702 -11.539 1.00 0.00 C ATOM 183 CD1 TYR A 14 9.670 16.575 -10.467 1.00 0.00 C ATOM 184 CD2 TYR A 14 7.932 17.790 -11.557 1.00 0.00 C ATOM 185 CE1 TYR A 14 9.682 17.504 -9.444 1.00 0.00 C ATOM 186 CE2 TYR A 14 7.940 18.723 -10.538 1.00 0.00 C ATOM 187 CZ TYR A 14 8.816 18.576 -9.484 1.00 0.00 C ATOM 188 OH TYR A 14 8.826 19.503 -8.467 1.00 0.00 O ATOM 0 H TYR A 14 8.943 13.589 -14.154 1.00 0.00 H new ATOM 0 HA TYR A 14 9.268 14.110 -11.277 1.00 0.00 H new ATOM 0 HB2 TYR A 14 9.700 15.790 -13.242 1.00 0.00 H new ATOM 0 HB3 TYR A 14 7.954 15.905 -13.329 1.00 0.00 H new ATOM 0 HD1 TYR A 14 10.351 15.737 -10.432 1.00 0.00 H new ATOM 0 HD2 TYR A 14 7.243 17.908 -12.380 1.00 0.00 H new ATOM 0 HE1 TYR A 14 10.367 17.391 -8.617 1.00 0.00 H new ATOM 0 HE2 TYR A 14 7.263 19.564 -10.567 1.00 0.00 H new ATOM 0 HH TYR A 14 8.156 20.195 -8.649 1.00 0.00 H new ATOM 198 N ASP A 15 6.415 13.635 -12.851 1.00 0.00 N ATOM 199 CA ASP A 15 5.007 13.310 -12.649 1.00 0.00 C ATOM 200 C ASP A 15 4.850 12.142 -11.678 1.00 0.00 C ATOM 201 O ASP A 15 3.802 11.978 -11.057 1.00 0.00 O ATOM 202 CB ASP A 15 4.340 12.973 -13.983 1.00 0.00 C ATOM 203 CG ASP A 15 4.039 14.209 -14.807 1.00 0.00 C ATOM 204 OD1 ASP A 15 3.476 15.173 -14.248 1.00 0.00 O ATOM 205 OD2 ASP A 15 4.368 14.214 -16.013 1.00 0.00 O ATOM 0 H ASP A 15 6.716 13.622 -13.826 1.00 0.00 H new ATOM 0 HA ASP A 15 4.519 14.184 -12.219 1.00 0.00 H new ATOM 0 HB2 ASP A 15 4.989 12.309 -14.553 1.00 0.00 H new ATOM 0 HB3 ASP A 15 3.414 12.430 -13.796 1.00 0.00 H new ATOM 210 N CYS A 16 5.900 11.337 -11.549 1.00 0.00 N ATOM 211 CA CYS A 16 5.883 10.193 -10.655 1.00 0.00 C ATOM 212 C CYS A 16 6.485 10.561 -9.306 1.00 0.00 C ATOM 213 O CYS A 16 5.903 10.289 -8.256 1.00 0.00 O ATOM 214 CB CYS A 16 6.666 9.038 -11.272 1.00 0.00 C ATOM 215 SG CYS A 16 6.243 7.413 -10.602 1.00 0.00 S ATOM 0 H CYS A 16 6.776 11.460 -12.057 1.00 0.00 H new ATOM 0 HA CYS A 16 4.848 9.886 -10.504 1.00 0.00 H new ATOM 0 HB2 CYS A 16 6.493 9.031 -12.348 1.00 0.00 H new ATOM 0 HB3 CYS A 16 7.731 9.215 -11.121 1.00 0.00 H new ATOM 0 HG CYS A 16 6.003 6.590 -11.579 1.00 0.00 H new ATOM 221 N GLU A 17 7.657 11.183 -9.346 1.00 0.00 N ATOM 222 CA GLU A 17 8.350 11.595 -8.132 1.00 0.00 C ATOM 223 C GLU A 17 7.479 12.533 -7.304 1.00 0.00 C ATOM 224 O GLU A 17 7.361 12.378 -6.088 1.00 0.00 O ATOM 225 CB GLU A 17 9.664 12.288 -8.486 1.00 0.00 C ATOM 226 CG GLU A 17 10.769 12.053 -7.468 1.00 0.00 C ATOM 227 CD GLU A 17 12.013 12.871 -7.759 1.00 0.00 C ATOM 228 OE1 GLU A 17 11.885 13.940 -8.392 1.00 0.00 O ATOM 229 OE2 GLU A 17 13.113 12.443 -7.354 1.00 0.00 O ATOM 0 H GLU A 17 8.149 11.414 -10.209 1.00 0.00 H new ATOM 0 HA GLU A 17 8.561 10.704 -7.541 1.00 0.00 H new ATOM 0 HB2 GLU A 17 9.999 11.936 -9.462 1.00 0.00 H new ATOM 0 HB3 GLU A 17 9.487 13.360 -8.577 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.400 12.301 -6.473 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.029 10.994 -7.457 1.00 0.00 H new ATOM 236 N VAL A 18 6.874 13.507 -7.972 1.00 0.00 N ATOM 237 CA VAL A 18 6.013 14.474 -7.304 1.00 0.00 C ATOM 238 C VAL A 18 4.766 13.806 -6.735 1.00 0.00 C ATOM 239 O VAL A 18 4.375 14.067 -5.597 1.00 0.00 O ATOM 240 CB VAL A 18 5.582 15.602 -8.261 1.00 0.00 C ATOM 241 CG1 VAL A 18 4.829 16.687 -7.505 1.00 0.00 C ATOM 242 CG2 VAL A 18 6.787 16.187 -8.981 1.00 0.00 C ATOM 0 H VAL A 18 6.964 13.648 -8.978 1.00 0.00 H new ATOM 0 HA VAL A 18 6.598 14.901 -6.489 1.00 0.00 H new ATOM 0 HB VAL A 18 4.912 15.178 -9.009 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.533 17.475 -8.198 1.00 0.00 H new ATOM 0 HG12 VAL A 18 3.940 16.258 -7.042 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.474 17.107 -6.733 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.460 16.982 -9.652 1.00 0.00 H new ATOM 0 HG22 VAL A 18 7.486 16.594 -8.250 1.00 0.00 H new ATOM 0 HG23 VAL A 18 7.281 15.405 -9.558 1.00 0.00 H new ATOM 252 N ASN A 19 4.141 12.946 -7.534 1.00 0.00 N ATOM 253 CA ASN A 19 2.932 12.250 -7.108 1.00 0.00 C ATOM 254 C ASN A 19 3.252 11.122 -6.127 1.00 0.00 C ATOM 255 O ASN A 19 2.372 10.656 -5.403 1.00 0.00 O ATOM 256 CB ASN A 19 2.187 11.692 -8.321 1.00 0.00 C ATOM 257 CG ASN A 19 0.740 12.143 -8.370 1.00 0.00 C ATOM 258 OD1 ASN A 19 -0.178 11.345 -8.183 1.00 0.00 O ATOM 259 ND2 ASN A 19 0.532 13.430 -8.624 1.00 0.00 N ATOM 0 H ASN A 19 4.451 12.715 -8.478 1.00 0.00 H new ATOM 0 HA ASN A 19 2.296 12.972 -6.596 1.00 0.00 H new ATOM 0 HB2 ASN A 19 2.694 12.009 -9.232 1.00 0.00 H new ATOM 0 HB3 ASN A 19 2.224 10.603 -8.297 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -0.420 13.793 -8.670 1.00 0.00 H new ATOM 0 HD22 ASN A 19 1.324 14.055 -8.773 1.00 0.00 H new ATOM 266 N ALA A 20 4.507 10.681 -6.106 1.00 0.00 N ATOM 267 CA ALA A 20 4.913 9.606 -5.211 1.00 0.00 C ATOM 268 C ALA A 20 6.358 9.774 -4.749 1.00 0.00 C ATOM 269 O ALA A 20 7.266 9.114 -5.255 1.00 0.00 O ATOM 270 CB ALA A 20 4.723 8.255 -5.885 1.00 0.00 C ATOM 0 H ALA A 20 5.254 11.049 -6.695 1.00 0.00 H new ATOM 0 HA ALA A 20 4.277 9.652 -4.327 1.00 0.00 H new ATOM 0 HB1 ALA A 20 5.031 7.462 -5.204 1.00 0.00 H new ATOM 0 HB2 ALA A 20 3.673 8.123 -6.145 1.00 0.00 H new ATOM 0 HB3 ALA A 20 5.329 8.211 -6.790 1.00 0.00 H new ATOM 276 N PRO A 21 6.580 10.656 -3.764 1.00 0.00 N ATOM 277 CA PRO A 21 7.913 10.911 -3.208 1.00 0.00 C ATOM 278 C PRO A 21 8.470 9.687 -2.485 1.00 0.00 C ATOM 279 O PRO A 21 7.734 8.754 -2.172 1.00 0.00 O ATOM 280 CB PRO A 21 7.690 12.057 -2.210 1.00 0.00 C ATOM 281 CG PRO A 21 6.326 12.591 -2.496 1.00 0.00 C ATOM 282 CD PRO A 21 5.545 11.464 -3.110 1.00 0.00 C ATOM 0 HA PRO A 21 8.635 11.151 -3.988 1.00 0.00 H new ATOM 0 HB2 PRO A 21 7.762 11.699 -1.183 1.00 0.00 H new ATOM 0 HB3 PRO A 21 8.446 12.833 -2.331 1.00 0.00 H new ATOM 0 HG2 PRO A 21 5.847 12.941 -1.582 1.00 0.00 H new ATOM 0 HG3 PRO A 21 6.377 13.442 -3.175 1.00 0.00 H new ATOM 0 HD2 PRO A 21 5.004 10.892 -2.356 1.00 0.00 H new ATOM 0 HD3 PRO A 21 4.807 11.828 -3.825 1.00 0.00 H new ATOM 290 N ILE A 22 9.772 9.698 -2.217 1.00 0.00 N ATOM 291 CA ILE A 22 10.415 8.588 -1.524 1.00 0.00 C ATOM 292 C ILE A 22 10.870 8.996 -0.121 1.00 0.00 C ATOM 293 O ILE A 22 11.192 8.144 0.708 1.00 0.00 O ATOM 294 CB ILE A 22 11.619 8.049 -2.325 1.00 0.00 C ATOM 295 CG1 ILE A 22 11.185 7.714 -3.756 1.00 0.00 C ATOM 296 CG2 ILE A 22 12.214 6.825 -1.642 1.00 0.00 C ATOM 297 CD1 ILE A 22 12.237 6.977 -4.555 1.00 0.00 C ATOM 0 H ILE A 22 10.401 10.461 -2.468 1.00 0.00 H new ATOM 0 HA ILE A 22 9.672 7.796 -1.433 1.00 0.00 H new ATOM 0 HB ILE A 22 12.389 8.820 -2.364 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.279 7.108 -3.719 1.00 0.00 H new ATOM 0 HG13 ILE A 22 10.929 8.638 -4.274 1.00 0.00 H new ATOM 0 HG21 ILE A 22 13.061 6.460 -2.222 1.00 0.00 H new ATOM 0 HG22 ILE A 22 12.549 7.094 -0.640 1.00 0.00 H new ATOM 0 HG23 ILE A 22 11.458 6.043 -1.574 1.00 0.00 H new ATOM 0 HD11 ILE A 22 11.858 6.775 -5.557 1.00 0.00 H new ATOM 0 HD12 ILE A 22 13.136 7.589 -4.624 1.00 0.00 H new ATOM 0 HD13 ILE A 22 12.476 6.036 -4.061 1.00 0.00 H new ATOM 309 N GLN A 23 10.882 10.302 0.144 1.00 0.00 N ATOM 310 CA GLN A 23 11.286 10.819 1.451 1.00 0.00 C ATOM 311 C GLN A 23 12.794 10.704 1.646 1.00 0.00 C ATOM 312 O GLN A 23 13.266 10.298 2.708 1.00 0.00 O ATOM 313 CB GLN A 23 10.557 10.073 2.570 1.00 0.00 C ATOM 314 CG GLN A 23 10.030 10.983 3.667 1.00 0.00 C ATOM 315 CD GLN A 23 8.559 10.757 3.958 1.00 0.00 C ATOM 316 OE1 GLN A 23 7.689 11.292 3.271 1.00 0.00 O ATOM 317 NE2 GLN A 23 8.273 9.960 4.981 1.00 0.00 N ATOM 0 H GLN A 23 10.617 11.021 -0.529 1.00 0.00 H new ATOM 0 HA GLN A 23 11.014 11.874 1.491 1.00 0.00 H new ATOM 0 HB2 GLN A 23 9.724 9.516 2.141 1.00 0.00 H new ATOM 0 HB3 GLN A 23 11.236 9.343 3.010 1.00 0.00 H new ATOM 0 HG2 GLN A 23 10.606 10.819 4.578 1.00 0.00 H new ATOM 0 HG3 GLN A 23 10.183 12.022 3.376 1.00 0.00 H new ATOM 0 HE21 GLN A 23 9.026 9.537 5.524 1.00 0.00 H new ATOM 0 HE22 GLN A 23 7.301 9.771 5.224 1.00 0.00 H new ATOM 326 N GLY A 24 13.544 11.068 0.614 1.00 0.00 N ATOM 327 CA GLY A 24 14.988 11.003 0.688 1.00 0.00 C ATOM 328 C GLY A 24 15.639 11.031 -0.680 1.00 0.00 C ATOM 329 O GLY A 24 14.959 11.181 -1.695 1.00 0.00 O ATOM 0 H GLY A 24 13.176 11.408 -0.274 1.00 0.00 H new ATOM 0 HA2 GLY A 24 15.357 11.841 1.280 1.00 0.00 H new ATOM 0 HA3 GLY A 24 15.282 10.091 1.208 1.00 0.00 H new ATOM 333 N SER A 25 16.960 10.885 -0.708 1.00 0.00 N ATOM 334 CA SER A 25 17.702 10.892 -1.964 1.00 0.00 C ATOM 335 C SER A 25 17.169 9.821 -2.910 1.00 0.00 C ATOM 336 O SER A 25 16.651 10.127 -3.984 1.00 0.00 O ATOM 337 CB SER A 25 19.191 10.663 -1.701 1.00 0.00 C ATOM 338 OG SER A 25 19.873 11.893 -1.520 1.00 0.00 O ATOM 0 H SER A 25 17.538 10.761 0.123 1.00 0.00 H new ATOM 0 HA SER A 25 17.571 11.867 -2.434 1.00 0.00 H new ATOM 0 HB2 SER A 25 19.315 10.041 -0.815 1.00 0.00 H new ATOM 0 HB3 SER A 25 19.631 10.119 -2.537 1.00 0.00 H new ATOM 0 HG SER A 25 20.823 11.719 -1.352 1.00 0.00 H new ATOM 344 N ARG A 26 17.299 8.563 -2.502 1.00 0.00 N ATOM 345 CA ARG A 26 16.830 7.445 -3.306 1.00 0.00 C ATOM 346 C ARG A 26 16.111 6.421 -2.448 1.00 0.00 C ATOM 347 O ARG A 26 15.750 6.683 -1.300 1.00 0.00 O ATOM 348 CB ARG A 26 18.001 6.777 -4.027 1.00 0.00 C ATOM 349 CG ARG A 26 17.782 6.606 -5.521 1.00 0.00 C ATOM 350 CD ARG A 26 19.094 6.664 -6.286 1.00 0.00 C ATOM 351 NE ARG A 26 18.892 6.534 -7.727 1.00 0.00 N ATOM 352 CZ ARG A 26 19.878 6.572 -8.621 1.00 0.00 C ATOM 353 NH1 ARG A 26 21.135 6.736 -8.226 1.00 0.00 N ATOM 354 NH2 ARG A 26 19.606 6.445 -9.912 1.00 0.00 N ATOM 0 H ARG A 26 17.727 8.294 -1.616 1.00 0.00 H new ATOM 0 HA ARG A 26 16.129 7.837 -4.043 1.00 0.00 H new ATOM 0 HB2 ARG A 26 18.901 7.370 -3.866 1.00 0.00 H new ATOM 0 HB3 ARG A 26 18.180 5.799 -3.581 1.00 0.00 H new ATOM 0 HG2 ARG A 26 17.291 5.652 -5.711 1.00 0.00 H new ATOM 0 HG3 ARG A 26 17.113 7.387 -5.884 1.00 0.00 H new ATOM 0 HD2 ARG A 26 19.596 7.608 -6.074 1.00 0.00 H new ATOM 0 HD3 ARG A 26 19.752 5.868 -5.939 1.00 0.00 H new ATOM 0 HE ARG A 26 17.939 6.407 -8.068 1.00 0.00 H new ATOM 0 HH11 ARG A 26 21.349 6.834 -7.234 1.00 0.00 H new ATOM 0 HH12 ARG A 26 21.887 6.764 -8.915 1.00 0.00 H new ATOM 0 HH21 ARG A 26 18.642 6.318 -10.220 1.00 0.00 H new ATOM 0 HH22 ARG A 26 20.361 6.474 -10.597 1.00 0.00 H new ATOM 368 N ASN A 27 15.909 5.255 -3.030 1.00 0.00 N ATOM 369 CA ASN A 27 15.233 4.161 -2.358 1.00 0.00 C ATOM 370 C ASN A 27 16.127 2.925 -2.286 1.00 0.00 C ATOM 371 O ASN A 27 17.159 2.846 -2.952 1.00 0.00 O ATOM 372 CB ASN A 27 13.921 3.845 -3.081 1.00 0.00 C ATOM 373 CG ASN A 27 13.322 2.507 -2.691 1.00 0.00 C ATOM 374 OD1 ASN A 27 13.783 1.458 -3.136 1.00 0.00 O ATOM 375 ND2 ASN A 27 12.293 2.540 -1.853 1.00 0.00 N ATOM 0 H ASN A 27 16.208 5.039 -3.981 1.00 0.00 H new ATOM 0 HA ASN A 27 15.009 4.463 -1.335 1.00 0.00 H new ATOM 0 HB2 ASN A 27 13.199 4.633 -2.868 1.00 0.00 H new ATOM 0 HB3 ASN A 27 14.096 3.856 -4.157 1.00 0.00 H new ATOM 0 HD21 ASN A 27 11.852 1.671 -1.553 1.00 0.00 H new ATOM 0 HD22 ASN A 27 11.944 3.435 -1.509 1.00 0.00 H new ATOM 382 N LEU A 28 15.720 1.969 -1.461 1.00 0.00 N ATOM 383 CA LEU A 28 16.458 0.739 -1.268 1.00 0.00 C ATOM 384 C LEU A 28 16.491 -0.109 -2.542 1.00 0.00 C ATOM 385 O LEU A 28 17.458 -0.061 -3.303 1.00 0.00 O ATOM 386 CB LEU A 28 15.824 -0.040 -0.121 1.00 0.00 C ATOM 387 CG LEU A 28 16.599 0.001 1.193 1.00 0.00 C ATOM 388 CD1 LEU A 28 15.849 -0.753 2.280 1.00 0.00 C ATOM 389 CD2 LEU A 28 17.995 -0.572 1.008 1.00 0.00 C ATOM 0 H LEU A 28 14.865 2.030 -0.908 1.00 0.00 H new ATOM 0 HA LEU A 28 17.492 0.985 -1.024 1.00 0.00 H new ATOM 0 HB2 LEU A 28 14.822 0.351 0.054 1.00 0.00 H new ATOM 0 HB3 LEU A 28 15.712 -1.080 -0.427 1.00 0.00 H new ATOM 0 HG LEU A 28 16.695 1.042 1.503 1.00 0.00 H new ATOM 0 HD11 LEU A 28 16.417 -0.713 3.209 1.00 0.00 H new ATOM 0 HD12 LEU A 28 14.872 -0.295 2.432 1.00 0.00 H new ATOM 0 HD13 LEU A 28 15.720 -1.793 1.979 1.00 0.00 H new ATOM 0 HD21 LEU A 28 18.532 -0.534 1.956 1.00 0.00 H new ATOM 0 HD22 LEU A 28 17.922 -1.607 0.673 1.00 0.00 H new ATOM 0 HD23 LEU A 28 18.533 0.014 0.262 1.00 0.00 H new ATOM 401 N LEU A 29 15.437 -0.893 -2.765 1.00 0.00 N ATOM 402 CA LEU A 29 15.358 -1.754 -3.938 1.00 0.00 C ATOM 403 C LEU A 29 15.418 -0.927 -5.217 1.00 0.00 C ATOM 404 O LEU A 29 14.769 0.114 -5.329 1.00 0.00 O ATOM 405 CB LEU A 29 14.078 -2.606 -3.915 1.00 0.00 C ATOM 406 CG LEU A 29 13.128 -2.369 -2.731 1.00 0.00 C ATOM 407 CD1 LEU A 29 13.815 -2.657 -1.401 1.00 0.00 C ATOM 408 CD2 LEU A 29 12.560 -0.956 -2.772 1.00 0.00 C ATOM 0 H LEU A 29 14.627 -0.948 -2.147 1.00 0.00 H new ATOM 0 HA LEU A 29 16.216 -2.426 -3.916 1.00 0.00 H new ATOM 0 HB2 LEU A 29 13.528 -2.423 -4.838 1.00 0.00 H new ATOM 0 HB3 LEU A 29 14.366 -3.657 -3.919 1.00 0.00 H new ATOM 0 HG LEU A 29 12.296 -3.067 -2.821 1.00 0.00 H new ATOM 0 HD11 LEU A 29 13.115 -2.480 -0.584 1.00 0.00 H new ATOM 0 HD12 LEU A 29 14.143 -3.696 -1.378 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.678 -2.001 -1.288 1.00 0.00 H new ATOM 0 HD21 LEU A 29 11.890 -0.809 -1.925 1.00 0.00 H new ATOM 0 HD22 LEU A 29 13.375 -0.234 -2.719 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.008 -0.813 -3.701 1.00 0.00 H new ATOM 420 N GLN A 30 16.211 -1.392 -6.173 1.00 0.00 N ATOM 421 CA GLN A 30 16.374 -0.698 -7.439 1.00 0.00 C ATOM 422 C GLN A 30 16.427 -1.683 -8.607 1.00 0.00 C ATOM 423 O GLN A 30 15.408 -1.975 -9.230 1.00 0.00 O ATOM 424 CB GLN A 30 17.648 0.143 -7.401 1.00 0.00 C ATOM 425 CG GLN A 30 17.904 0.910 -8.683 1.00 0.00 C ATOM 426 CD GLN A 30 18.916 2.024 -8.504 1.00 0.00 C ATOM 427 OE1 GLN A 30 19.733 1.996 -7.583 1.00 0.00 O ATOM 428 NE2 GLN A 30 18.870 3.014 -9.389 1.00 0.00 N ATOM 0 H GLN A 30 16.753 -2.252 -6.093 1.00 0.00 H new ATOM 0 HA GLN A 30 15.512 -0.048 -7.590 1.00 0.00 H new ATOM 0 HB2 GLN A 30 17.584 0.848 -6.572 1.00 0.00 H new ATOM 0 HB3 GLN A 30 18.498 -0.509 -7.201 1.00 0.00 H new ATOM 0 HG2 GLN A 30 18.259 0.221 -9.449 1.00 0.00 H new ATOM 0 HG3 GLN A 30 16.966 1.331 -9.044 1.00 0.00 H new ATOM 0 HE21 GLN A 30 18.177 2.998 -10.137 1.00 0.00 H new ATOM 0 HE22 GLN A 30 19.528 3.790 -9.321 1.00 0.00 H new ATOM 437 N GLY A 31 17.621 -2.185 -8.905 1.00 0.00 N ATOM 438 CA GLY A 31 17.779 -3.118 -9.998 1.00 0.00 C ATOM 439 C GLY A 31 17.262 -4.504 -9.667 1.00 0.00 C ATOM 440 O GLY A 31 16.071 -4.781 -9.813 1.00 0.00 O ATOM 0 H GLY A 31 18.482 -1.960 -8.406 1.00 0.00 H new ATOM 0 HA2 GLY A 31 17.252 -2.738 -10.873 1.00 0.00 H new ATOM 0 HA3 GLY A 31 18.834 -3.183 -10.265 1.00 0.00 H new ATOM 444 N GLU A 32 18.160 -5.377 -9.223 1.00 0.00 N ATOM 445 CA GLU A 32 17.792 -6.744 -8.874 1.00 0.00 C ATOM 446 C GLU A 32 17.174 -6.816 -7.479 1.00 0.00 C ATOM 447 O GLU A 32 16.518 -7.799 -7.135 1.00 0.00 O ATOM 448 CB GLU A 32 19.015 -7.659 -8.951 1.00 0.00 C ATOM 449 CG GLU A 32 18.722 -9.016 -9.569 1.00 0.00 C ATOM 450 CD GLU A 32 17.904 -9.910 -8.657 1.00 0.00 C ATOM 451 OE1 GLU A 32 18.088 -9.827 -7.425 1.00 0.00 O ATOM 452 OE2 GLU A 32 17.080 -10.692 -9.175 1.00 0.00 O ATOM 0 H GLU A 32 19.149 -5.162 -9.096 1.00 0.00 H new ATOM 0 HA GLU A 32 17.045 -7.081 -9.593 1.00 0.00 H new ATOM 0 HB2 GLU A 32 19.792 -7.164 -9.533 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.413 -7.805 -7.947 1.00 0.00 H new ATOM 0 HG2 GLU A 32 18.187 -8.875 -10.508 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.662 -9.512 -9.809 1.00 0.00 H new ATOM 459 N GLU A 33 17.382 -5.773 -6.678 1.00 0.00 N ATOM 460 CA GLU A 33 16.835 -5.738 -5.330 1.00 0.00 C ATOM 461 C GLU A 33 15.342 -5.455 -5.364 1.00 0.00 C ATOM 462 O GLU A 33 14.611 -5.791 -4.433 1.00 0.00 O ATOM 463 CB GLU A 33 17.553 -4.685 -4.483 1.00 0.00 C ATOM 464 CG GLU A 33 19.058 -4.884 -4.414 1.00 0.00 C ATOM 465 CD GLU A 33 19.682 -4.217 -3.203 1.00 0.00 C ATOM 466 OE1 GLU A 33 18.981 -3.430 -2.531 1.00 0.00 O ATOM 467 OE2 GLU A 33 20.872 -4.478 -2.929 1.00 0.00 O ATOM 0 H GLU A 33 17.922 -4.948 -6.939 1.00 0.00 H new ATOM 0 HA GLU A 33 16.993 -6.716 -4.875 1.00 0.00 H new ATOM 0 HB2 GLU A 33 17.344 -3.697 -4.893 1.00 0.00 H new ATOM 0 HB3 GLU A 33 17.145 -4.704 -3.472 1.00 0.00 H new ATOM 0 HG2 GLU A 33 19.278 -5.951 -4.390 1.00 0.00 H new ATOM 0 HG3 GLU A 33 19.515 -4.485 -5.319 1.00 0.00 H new ATOM 474 N LEU A 34 14.897 -4.847 -6.451 1.00 0.00 N ATOM 475 CA LEU A 34 13.503 -4.525 -6.634 1.00 0.00 C ATOM 476 C LEU A 34 12.683 -5.797 -6.775 1.00 0.00 C ATOM 477 O LEU A 34 11.551 -5.874 -6.302 1.00 0.00 O ATOM 478 CB LEU A 34 13.351 -3.649 -7.872 1.00 0.00 C ATOM 479 CG LEU A 34 13.033 -2.182 -7.593 1.00 0.00 C ATOM 480 CD1 LEU A 34 12.784 -1.432 -8.893 1.00 0.00 C ATOM 481 CD2 LEU A 34 11.832 -2.056 -6.664 1.00 0.00 C ATOM 0 H LEU A 34 15.496 -4.566 -7.227 1.00 0.00 H new ATOM 0 HA LEU A 34 13.137 -3.982 -5.763 1.00 0.00 H new ATOM 0 HB2 LEU A 34 14.274 -3.701 -8.450 1.00 0.00 H new ATOM 0 HB3 LEU A 34 12.560 -4.064 -8.496 1.00 0.00 H new ATOM 0 HG LEU A 34 13.895 -1.736 -7.097 1.00 0.00 H new ATOM 0 HD11 LEU A 34 12.559 -0.388 -8.674 1.00 0.00 H new ATOM 0 HD12 LEU A 34 13.673 -1.487 -9.521 1.00 0.00 H new ATOM 0 HD13 LEU A 34 11.941 -1.882 -9.417 1.00 0.00 H new ATOM 0 HD21 LEU A 34 11.624 -1.002 -6.479 1.00 0.00 H new ATOM 0 HD22 LEU A 34 10.963 -2.522 -7.128 1.00 0.00 H new ATOM 0 HD23 LEU A 34 12.049 -2.554 -5.719 1.00 0.00 H new ATOM 493 N LEU A 35 13.269 -6.799 -7.422 1.00 0.00 N ATOM 494 CA LEU A 35 12.598 -8.074 -7.614 1.00 0.00 C ATOM 495 C LEU A 35 12.680 -8.906 -6.343 1.00 0.00 C ATOM 496 O LEU A 35 11.717 -9.571 -5.960 1.00 0.00 O ATOM 497 CB LEU A 35 13.214 -8.839 -8.788 1.00 0.00 C ATOM 498 CG LEU A 35 13.617 -7.979 -9.987 1.00 0.00 C ATOM 499 CD1 LEU A 35 14.237 -8.840 -11.077 1.00 0.00 C ATOM 500 CD2 LEU A 35 12.413 -7.219 -10.526 1.00 0.00 C ATOM 0 H LEU A 35 14.206 -6.750 -7.821 1.00 0.00 H new ATOM 0 HA LEU A 35 11.550 -7.881 -7.843 1.00 0.00 H new ATOM 0 HB2 LEU A 35 14.095 -9.372 -8.431 1.00 0.00 H new ATOM 0 HB3 LEU A 35 12.501 -9.592 -9.124 1.00 0.00 H new ATOM 0 HG LEU A 35 14.362 -7.255 -9.657 1.00 0.00 H new ATOM 0 HD11 LEU A 35 14.517 -8.211 -11.922 1.00 0.00 H new ATOM 0 HD12 LEU A 35 15.124 -9.339 -10.686 1.00 0.00 H new ATOM 0 HD13 LEU A 35 13.515 -9.588 -11.405 1.00 0.00 H new ATOM 0 HD21 LEU A 35 12.718 -6.612 -11.379 1.00 0.00 H new ATOM 0 HD22 LEU A 35 11.646 -7.927 -10.840 1.00 0.00 H new ATOM 0 HD23 LEU A 35 12.012 -6.572 -9.746 1.00 0.00 H new ATOM 512 N ARG A 36 13.831 -8.850 -5.681 1.00 0.00 N ATOM 513 CA ARG A 36 14.025 -9.584 -4.440 1.00 0.00 C ATOM 514 C ARG A 36 13.219 -8.929 -3.327 1.00 0.00 C ATOM 515 O ARG A 36 12.708 -9.601 -2.432 1.00 0.00 O ATOM 516 CB ARG A 36 15.508 -9.625 -4.066 1.00 0.00 C ATOM 517 CG ARG A 36 16.224 -10.873 -4.559 1.00 0.00 C ATOM 518 CD ARG A 36 17.243 -11.368 -3.546 1.00 0.00 C ATOM 519 NE ARG A 36 18.566 -10.792 -3.773 1.00 0.00 N ATOM 520 CZ ARG A 36 19.592 -10.940 -2.939 1.00 0.00 C ATOM 521 NH1 ARG A 36 19.453 -11.644 -1.823 1.00 0.00 N ATOM 522 NH2 ARG A 36 20.761 -10.381 -3.222 1.00 0.00 N ATOM 0 H ARG A 36 14.639 -8.306 -5.983 1.00 0.00 H new ATOM 0 HA ARG A 36 13.679 -10.608 -4.578 1.00 0.00 H new ATOM 0 HB2 ARG A 36 16.003 -8.745 -4.478 1.00 0.00 H new ATOM 0 HB3 ARG A 36 15.603 -9.566 -2.982 1.00 0.00 H new ATOM 0 HG2 ARG A 36 15.494 -11.658 -4.756 1.00 0.00 H new ATOM 0 HG3 ARG A 36 16.724 -10.658 -5.504 1.00 0.00 H new ATOM 0 HD2 ARG A 36 16.906 -11.116 -2.540 1.00 0.00 H new ATOM 0 HD3 ARG A 36 17.307 -12.455 -3.598 1.00 0.00 H new ATOM 0 HE ARG A 36 18.712 -10.244 -4.621 1.00 0.00 H new ATOM 0 HH11 ARG A 36 18.556 -12.075 -1.601 1.00 0.00 H new ATOM 0 HH12 ARG A 36 20.243 -11.754 -1.188 1.00 0.00 H new ATOM 0 HH21 ARG A 36 20.873 -9.838 -4.078 1.00 0.00 H new ATOM 0 HH22 ARG A 36 21.548 -10.494 -2.583 1.00 0.00 H new ATOM 536 N ALA A 37 13.104 -7.606 -3.403 1.00 0.00 N ATOM 537 CA ALA A 37 12.358 -6.845 -2.423 1.00 0.00 C ATOM 538 C ALA A 37 10.861 -6.938 -2.690 1.00 0.00 C ATOM 539 O ALA A 37 10.080 -7.259 -1.794 1.00 0.00 O ATOM 540 CB ALA A 37 12.806 -5.395 -2.426 1.00 0.00 C ATOM 0 H ALA A 37 13.524 -7.041 -4.141 1.00 0.00 H new ATOM 0 HA ALA A 37 12.556 -7.270 -1.439 1.00 0.00 H new ATOM 0 HB1 ALA A 37 12.236 -4.836 -1.684 1.00 0.00 H new ATOM 0 HB2 ALA A 37 13.867 -5.342 -2.183 1.00 0.00 H new ATOM 0 HB3 ALA A 37 12.637 -4.964 -3.413 1.00 0.00 H new ATOM 546 N LEU A 38 10.462 -6.662 -3.933 1.00 0.00 N ATOM 547 CA LEU A 38 9.050 -6.726 -4.311 1.00 0.00 C ATOM 548 C LEU A 38 8.425 -8.037 -3.840 1.00 0.00 C ATOM 549 O LEU A 38 7.222 -8.108 -3.587 1.00 0.00 O ATOM 550 CB LEU A 38 8.886 -6.599 -5.830 1.00 0.00 C ATOM 551 CG LEU A 38 8.736 -5.170 -6.361 1.00 0.00 C ATOM 552 CD1 LEU A 38 8.432 -5.186 -7.852 1.00 0.00 C ATOM 553 CD2 LEU A 38 7.644 -4.428 -5.602 1.00 0.00 C ATOM 0 H LEU A 38 11.092 -6.394 -4.689 1.00 0.00 H new ATOM 0 HA LEU A 38 8.539 -5.893 -3.828 1.00 0.00 H new ATOM 0 HB2 LEU A 38 9.750 -7.057 -6.311 1.00 0.00 H new ATOM 0 HB3 LEU A 38 8.011 -7.174 -6.133 1.00 0.00 H new ATOM 0 HG LEU A 38 9.679 -4.645 -6.206 1.00 0.00 H new ATOM 0 HD11 LEU A 38 8.328 -4.163 -8.213 1.00 0.00 H new ATOM 0 HD12 LEU A 38 9.246 -5.678 -8.384 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.503 -5.729 -8.028 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.553 -3.415 -5.994 1.00 0.00 H new ATOM 0 HD22 LEU A 38 6.696 -4.951 -5.725 1.00 0.00 H new ATOM 0 HD23 LEU A 38 7.901 -4.386 -4.544 1.00 0.00 H new ATOM 565 N ASP A 39 9.253 -9.070 -3.723 1.00 0.00 N ATOM 566 CA ASP A 39 8.792 -10.378 -3.281 1.00 0.00 C ATOM 567 C ASP A 39 8.986 -10.539 -1.780 1.00 0.00 C ATOM 568 O ASP A 39 9.456 -11.574 -1.306 1.00 0.00 O ATOM 569 CB ASP A 39 9.534 -11.487 -4.031 1.00 0.00 C ATOM 570 CG ASP A 39 8.608 -12.596 -4.490 1.00 0.00 C ATOM 571 OD1 ASP A 39 7.801 -12.354 -5.412 1.00 0.00 O ATOM 572 OD2 ASP A 39 8.690 -13.709 -3.926 1.00 0.00 O ATOM 0 H ASP A 39 10.251 -9.024 -3.930 1.00 0.00 H new ATOM 0 HA ASP A 39 7.727 -10.456 -3.502 1.00 0.00 H new ATOM 0 HB2 ASP A 39 10.041 -11.060 -4.896 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.305 -11.906 -3.384 1.00 0.00 H new ATOM 577 N GLN A 40 8.613 -9.506 -1.038 1.00 0.00 N ATOM 578 CA GLN A 40 8.733 -9.519 0.413 1.00 0.00 C ATOM 579 C GLN A 40 7.567 -8.778 1.050 1.00 0.00 C ATOM 580 O GLN A 40 7.750 -7.926 1.920 1.00 0.00 O ATOM 581 CB GLN A 40 10.059 -8.891 0.847 1.00 0.00 C ATOM 582 CG GLN A 40 10.520 -9.337 2.225 1.00 0.00 C ATOM 583 CD GLN A 40 11.885 -8.786 2.590 1.00 0.00 C ATOM 584 OE1 GLN A 40 12.746 -8.608 1.728 1.00 0.00 O ATOM 585 NE2 GLN A 40 12.090 -8.514 3.873 1.00 0.00 N ATOM 0 H GLN A 40 8.223 -8.644 -1.419 1.00 0.00 H new ATOM 0 HA GLN A 40 8.713 -10.556 0.749 1.00 0.00 H new ATOM 0 HB2 GLN A 40 10.828 -9.143 0.116 1.00 0.00 H new ATOM 0 HB3 GLN A 40 9.957 -7.806 0.840 1.00 0.00 H new ATOM 0 HG2 GLN A 40 9.792 -9.015 2.969 1.00 0.00 H new ATOM 0 HG3 GLN A 40 10.551 -10.426 2.259 1.00 0.00 H new ATOM 0 HE21 GLN A 40 11.348 -8.677 4.554 1.00 0.00 H new ATOM 0 HE22 GLN A 40 12.989 -8.142 4.178 1.00 0.00 H new ATOM 594 N VAL A 41 6.365 -9.115 0.605 1.00 0.00 N ATOM 595 CA VAL A 41 5.149 -8.492 1.118 1.00 0.00 C ATOM 596 C VAL A 41 5.077 -8.588 2.640 1.00 0.00 C ATOM 597 O VAL A 41 5.017 -9.682 3.201 1.00 0.00 O ATOM 598 CB VAL A 41 3.889 -9.143 0.517 1.00 0.00 C ATOM 599 CG1 VAL A 41 2.645 -8.358 0.903 1.00 0.00 C ATOM 600 CG2 VAL A 41 4.012 -9.252 -0.995 1.00 0.00 C ATOM 0 H VAL A 41 6.203 -9.820 -0.114 1.00 0.00 H new ATOM 0 HA VAL A 41 5.186 -7.443 0.825 1.00 0.00 H new ATOM 0 HB VAL A 41 3.795 -10.150 0.924 1.00 0.00 H new ATOM 0 HG11 VAL A 41 1.765 -8.834 0.469 1.00 0.00 H new ATOM 0 HG12 VAL A 41 2.549 -8.339 1.989 1.00 0.00 H new ATOM 0 HG13 VAL A 41 2.728 -7.338 0.528 1.00 0.00 H new ATOM 0 HG21 VAL A 41 3.112 -9.714 -1.401 1.00 0.00 H new ATOM 0 HG22 VAL A 41 4.133 -8.257 -1.423 1.00 0.00 H new ATOM 0 HG23 VAL A 41 4.879 -9.863 -1.246 1.00 0.00 H new ATOM 712 N ALA B 108 -0.065 18.591 -8.221 1.00 0.00 N ATOM 713 CA ALA B 108 -0.525 17.313 -7.692 1.00 0.00 C ATOM 714 C ALA B 108 -1.948 17.012 -8.146 1.00 0.00 C ATOM 715 O ALA B 108 -2.899 17.145 -7.374 1.00 0.00 O ATOM 716 CB ALA B 108 -0.442 17.306 -6.172 1.00 0.00 C ATOM 0 HA ALA B 108 0.128 16.532 -8.083 1.00 0.00 H new ATOM 0 HB1 ALA B 108 -0.789 16.345 -5.793 1.00 0.00 H new ATOM 0 HB2 ALA B 108 0.591 17.466 -5.863 1.00 0.00 H new ATOM 0 HB3 ALA B 108 -1.068 18.102 -5.770 1.00 0.00 H new ATOM 722 N ASP B 109 -2.090 16.606 -9.404 1.00 0.00 N ATOM 723 CA ASP B 109 -3.399 16.286 -9.962 1.00 0.00 C ATOM 724 C ASP B 109 -3.743 14.815 -9.735 1.00 0.00 C ATOM 725 O ASP B 109 -2.943 13.930 -10.039 1.00 0.00 O ATOM 726 CB ASP B 109 -3.429 16.603 -11.458 1.00 0.00 C ATOM 727 CG ASP B 109 -4.803 17.036 -11.930 1.00 0.00 C ATOM 728 OD1 ASP B 109 -5.654 16.151 -12.166 1.00 0.00 O ATOM 729 OD2 ASP B 109 -5.029 18.256 -12.063 1.00 0.00 O ATOM 0 H ASP B 109 -1.314 16.491 -10.056 1.00 0.00 H new ATOM 0 HA ASP B 109 -4.143 16.898 -9.452 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -2.708 17.392 -11.674 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -3.116 15.723 -12.019 1.00 0.00 H new ATOM 734 N PRO B 110 -4.943 14.529 -9.197 1.00 0.00 N ATOM 735 CA PRO B 110 -5.381 13.155 -8.938 1.00 0.00 C ATOM 736 C PRO B 110 -5.633 12.374 -10.224 1.00 0.00 C ATOM 737 O PRO B 110 -5.704 11.145 -10.210 1.00 0.00 O ATOM 738 CB PRO B 110 -6.685 13.334 -8.157 1.00 0.00 C ATOM 739 CG PRO B 110 -7.187 14.676 -8.559 1.00 0.00 C ATOM 740 CD PRO B 110 -5.966 15.518 -8.806 1.00 0.00 C ATOM 0 HA PRO B 110 -4.624 12.583 -8.401 1.00 0.00 H new ATOM 0 HB2 PRO B 110 -7.404 12.553 -8.403 1.00 0.00 H new ATOM 0 HB3 PRO B 110 -6.513 13.282 -7.082 1.00 0.00 H new ATOM 0 HG2 PRO B 110 -7.803 14.610 -9.456 1.00 0.00 H new ATOM 0 HG3 PRO B 110 -7.809 15.111 -7.776 1.00 0.00 H new ATOM 0 HD2 PRO B 110 -6.137 16.252 -9.593 1.00 0.00 H new ATOM 0 HD3 PRO B 110 -5.671 16.070 -7.914 1.00 0.00 H new ATOM 748 N GLU B 111 -5.772 13.094 -11.334 1.00 0.00 N ATOM 749 CA GLU B 111 -6.019 12.469 -12.625 1.00 0.00 C ATOM 750 C GLU B 111 -4.938 11.448 -12.966 1.00 0.00 C ATOM 751 O GLU B 111 -5.150 10.549 -13.780 1.00 0.00 O ATOM 752 CB GLU B 111 -6.103 13.529 -13.725 1.00 0.00 C ATOM 753 CG GLU B 111 -4.788 14.247 -13.980 1.00 0.00 C ATOM 754 CD GLU B 111 -4.957 15.492 -14.831 1.00 0.00 C ATOM 755 OE1 GLU B 111 -6.020 15.634 -15.471 1.00 0.00 O ATOM 756 OE2 GLU B 111 -4.026 16.324 -14.858 1.00 0.00 O ATOM 0 H GLU B 111 -5.717 14.112 -11.363 1.00 0.00 H new ATOM 0 HA GLU B 111 -6.972 11.945 -12.561 1.00 0.00 H new ATOM 0 HB2 GLU B 111 -6.434 13.056 -14.649 1.00 0.00 H new ATOM 0 HB3 GLU B 111 -6.861 14.263 -13.453 1.00 0.00 H new ATOM 0 HG2 GLU B 111 -4.338 14.522 -13.026 1.00 0.00 H new ATOM 0 HG3 GLU B 111 -4.096 13.565 -14.474 1.00 0.00 H new ATOM 763 N LYS B 112 -3.782 11.595 -12.337 1.00 0.00 N ATOM 764 CA LYS B 112 -2.662 10.690 -12.566 1.00 0.00 C ATOM 765 C LYS B 112 -2.650 9.563 -11.537 1.00 0.00 C ATOM 766 O LYS B 112 -2.120 8.483 -11.793 1.00 0.00 O ATOM 767 CB LYS B 112 -1.341 11.460 -12.515 1.00 0.00 C ATOM 768 CG LYS B 112 -0.809 11.846 -13.886 1.00 0.00 C ATOM 769 CD LYS B 112 -0.089 13.184 -13.849 1.00 0.00 C ATOM 770 CE LYS B 112 -0.273 13.953 -15.146 1.00 0.00 C ATOM 771 NZ LYS B 112 0.167 15.369 -15.022 1.00 0.00 N ATOM 0 H LYS B 112 -3.593 12.335 -11.661 1.00 0.00 H new ATOM 0 HA LYS B 112 -2.780 10.249 -13.556 1.00 0.00 H new ATOM 0 HB2 LYS B 112 -1.479 12.363 -11.920 1.00 0.00 H new ATOM 0 HB3 LYS B 112 -0.595 10.852 -12.003 1.00 0.00 H new ATOM 0 HG2 LYS B 112 -0.127 11.074 -14.243 1.00 0.00 H new ATOM 0 HG3 LYS B 112 -1.634 11.895 -14.597 1.00 0.00 H new ATOM 0 HD2 LYS B 112 -0.466 13.778 -13.016 1.00 0.00 H new ATOM 0 HD3 LYS B 112 0.974 13.021 -13.669 1.00 0.00 H new ATOM 0 HE2 LYS B 112 0.293 13.466 -15.940 1.00 0.00 H new ATOM 0 HE3 LYS B 112 -1.322 13.924 -15.439 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 -0.007 15.866 -15.919 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 -0.367 15.833 -14.259 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 1.183 15.399 -14.801 1.00 0.00 H new ATOM 785 N ARG B 113 -3.237 9.822 -10.370 1.00 0.00 N ATOM 786 CA ARG B 113 -3.291 8.829 -9.301 1.00 0.00 C ATOM 787 C ARG B 113 -3.813 7.493 -9.813 1.00 0.00 C ATOM 788 O ARG B 113 -3.447 6.433 -9.306 1.00 0.00 O ATOM 789 CB ARG B 113 -4.169 9.332 -8.154 1.00 0.00 C ATOM 790 CG ARG B 113 -4.267 8.362 -6.987 1.00 0.00 C ATOM 791 CD ARG B 113 -5.696 8.236 -6.485 1.00 0.00 C ATOM 792 NE ARG B 113 -5.952 9.103 -5.336 1.00 0.00 N ATOM 793 CZ ARG B 113 -7.101 9.125 -4.664 1.00 0.00 C ATOM 794 NH1 ARG B 113 -8.104 8.334 -5.025 1.00 0.00 N ATOM 795 NH2 ARG B 113 -7.249 9.943 -3.631 1.00 0.00 N ATOM 0 H ARG B 113 -3.682 10.711 -10.142 1.00 0.00 H new ATOM 0 HA ARG B 113 -2.276 8.677 -8.934 1.00 0.00 H new ATOM 0 HB2 ARG B 113 -3.772 10.281 -7.794 1.00 0.00 H new ATOM 0 HB3 ARG B 113 -5.171 9.530 -8.535 1.00 0.00 H new ATOM 0 HG2 ARG B 113 -3.901 7.383 -7.295 1.00 0.00 H new ATOM 0 HG3 ARG B 113 -3.624 8.702 -6.175 1.00 0.00 H new ATOM 0 HD2 ARG B 113 -6.386 8.488 -7.290 1.00 0.00 H new ATOM 0 HD3 ARG B 113 -5.893 7.200 -6.208 1.00 0.00 H new ATOM 0 HE ARG B 113 -5.206 9.728 -5.031 1.00 0.00 H new ATOM 0 HH11 ARG B 113 -7.997 7.705 -5.821 1.00 0.00 H new ATOM 0 HH12 ARG B 113 -8.982 8.355 -4.506 1.00 0.00 H new ATOM 0 HH21 ARG B 113 -6.483 10.555 -3.351 1.00 0.00 H new ATOM 0 HH22 ARG B 113 -8.129 9.960 -3.116 1.00 0.00 H new ATOM 809 N LYS B 114 -4.660 7.554 -10.827 1.00 0.00 N ATOM 810 CA LYS B 114 -5.228 6.349 -11.420 1.00 0.00 C ATOM 811 C LYS B 114 -4.214 5.682 -12.342 1.00 0.00 C ATOM 812 O LYS B 114 -4.152 4.455 -12.431 1.00 0.00 O ATOM 813 CB LYS B 114 -6.511 6.670 -12.194 1.00 0.00 C ATOM 814 CG LYS B 114 -6.441 7.958 -13.002 1.00 0.00 C ATOM 815 CD LYS B 114 -7.264 9.064 -12.360 1.00 0.00 C ATOM 816 CE LYS B 114 -8.746 8.720 -12.348 1.00 0.00 C ATOM 817 NZ LYS B 114 -9.170 8.124 -11.050 1.00 0.00 N ATOM 0 H LYS B 114 -4.971 8.424 -11.259 1.00 0.00 H new ATOM 0 HA LYS B 114 -5.478 5.662 -10.612 1.00 0.00 H new ATOM 0 HB2 LYS B 114 -6.733 5.842 -12.868 1.00 0.00 H new ATOM 0 HB3 LYS B 114 -7.340 6.740 -11.490 1.00 0.00 H new ATOM 0 HG2 LYS B 114 -5.403 8.279 -13.088 1.00 0.00 H new ATOM 0 HG3 LYS B 114 -6.803 7.774 -14.014 1.00 0.00 H new ATOM 0 HD2 LYS B 114 -6.919 9.230 -11.339 1.00 0.00 H new ATOM 0 HD3 LYS B 114 -7.110 9.996 -12.904 1.00 0.00 H new ATOM 0 HE2 LYS B 114 -9.329 9.621 -12.541 1.00 0.00 H new ATOM 0 HE3 LYS B 114 -8.963 8.021 -13.156 1.00 0.00 H new ATOM 0 HZ1 LYS B 114 -9.308 7.100 -11.167 1.00 0.00 H new ATOM 0 HZ2 LYS B 114 -8.436 8.295 -10.333 1.00 0.00 H new ATOM 0 HZ3 LYS B 114 -10.062 8.561 -10.742 1.00 0.00 H new ATOM 831 N LEU B 115 -3.413 6.499 -13.018 1.00 0.00 N ATOM 832 CA LEU B 115 -2.392 5.989 -13.923 1.00 0.00 C ATOM 833 C LEU B 115 -1.191 5.481 -13.140 1.00 0.00 C ATOM 834 O LEU B 115 -0.507 4.548 -13.562 1.00 0.00 O ATOM 835 CB LEU B 115 -1.955 7.078 -14.906 1.00 0.00 C ATOM 836 CG LEU B 115 -2.834 7.223 -16.148 1.00 0.00 C ATOM 837 CD1 LEU B 115 -2.721 8.627 -16.720 1.00 0.00 C ATOM 838 CD2 LEU B 115 -2.450 6.186 -17.195 1.00 0.00 C ATOM 0 H LEU B 115 -3.452 7.516 -12.956 1.00 0.00 H new ATOM 0 HA LEU B 115 -2.819 5.159 -14.486 1.00 0.00 H new ATOM 0 HB2 LEU B 115 -1.935 8.033 -14.381 1.00 0.00 H new ATOM 0 HB3 LEU B 115 -0.934 6.869 -15.225 1.00 0.00 H new ATOM 0 HG LEU B 115 -3.871 7.053 -15.859 1.00 0.00 H new ATOM 0 HD11 LEU B 115 -3.353 8.712 -17.604 1.00 0.00 H new ATOM 0 HD12 LEU B 115 -3.043 9.352 -15.972 1.00 0.00 H new ATOM 0 HD13 LEU B 115 -1.685 8.826 -16.995 1.00 0.00 H new ATOM 0 HD21 LEU B 115 -3.085 6.303 -18.073 1.00 0.00 H new ATOM 0 HD22 LEU B 115 -1.407 6.326 -17.480 1.00 0.00 H new ATOM 0 HD23 LEU B 115 -2.582 5.186 -16.782 1.00 0.00 H new ATOM 850 N ILE B 116 -0.951 6.095 -11.991 1.00 0.00 N ATOM 851 CA ILE B 116 0.158 5.704 -11.132 1.00 0.00 C ATOM 852 C ILE B 116 -0.164 4.401 -10.411 1.00 0.00 C ATOM 853 O ILE B 116 0.724 3.592 -10.140 1.00 0.00 O ATOM 854 CB ILE B 116 0.478 6.797 -10.094 1.00 0.00 C ATOM 855 CG1 ILE B 116 0.762 8.126 -10.794 1.00 0.00 C ATOM 856 CG2 ILE B 116 1.662 6.383 -9.231 1.00 0.00 C ATOM 857 CD1 ILE B 116 0.585 9.332 -9.898 1.00 0.00 C ATOM 0 H ILE B 116 -1.511 6.868 -11.631 1.00 0.00 H new ATOM 0 HA ILE B 116 1.032 5.564 -11.768 1.00 0.00 H new ATOM 0 HB ILE B 116 -0.389 6.925 -9.446 1.00 0.00 H new ATOM 0 HG12 ILE B 116 1.783 8.115 -11.177 1.00 0.00 H new ATOM 0 HG13 ILE B 116 0.100 8.223 -11.654 1.00 0.00 H new ATOM 0 HG21 ILE B 116 1.874 7.167 -8.504 1.00 0.00 H new ATOM 0 HG22 ILE B 116 1.425 5.457 -8.708 1.00 0.00 H new ATOM 0 HG23 ILE B 116 2.537 6.229 -9.863 1.00 0.00 H new ATOM 0 HD11 ILE B 116 0.803 10.239 -10.462 1.00 0.00 H new ATOM 0 HD12 ILE B 116 -0.442 9.368 -9.535 1.00 0.00 H new ATOM 0 HD13 ILE B 116 1.266 9.259 -9.050 1.00 0.00 H new ATOM 869 N GLN B 117 -1.444 4.204 -10.109 1.00 0.00 N ATOM 870 CA GLN B 117 -1.888 2.997 -9.427 1.00 0.00 C ATOM 871 C GLN B 117 -1.837 1.800 -10.369 1.00 0.00 C ATOM 872 O GLN B 117 -1.456 0.703 -9.969 1.00 0.00 O ATOM 873 CB GLN B 117 -3.307 3.180 -8.883 1.00 0.00 C ATOM 874 CG GLN B 117 -3.359 3.375 -7.375 1.00 0.00 C ATOM 875 CD GLN B 117 -4.156 4.600 -6.971 1.00 0.00 C ATOM 876 OE1 GLN B 117 -4.959 5.116 -7.747 1.00 0.00 O ATOM 877 NE2 GLN B 117 -3.937 5.070 -5.749 1.00 0.00 N ATOM 0 H GLN B 117 -2.190 4.865 -10.326 1.00 0.00 H new ATOM 0 HA GLN B 117 -1.215 2.810 -8.590 1.00 0.00 H new ATOM 0 HB2 GLN B 117 -3.765 4.041 -9.369 1.00 0.00 H new ATOM 0 HB3 GLN B 117 -3.905 2.308 -9.149 1.00 0.00 H new ATOM 0 HG2 GLN B 117 -3.800 2.491 -6.913 1.00 0.00 H new ATOM 0 HG3 GLN B 117 -2.344 3.464 -6.989 1.00 0.00 H new ATOM 0 HE21 GLN B 117 -3.261 4.610 -5.139 1.00 0.00 H new ATOM 0 HE22 GLN B 117 -4.444 5.891 -5.420 1.00 0.00 H new ATOM 886 N GLN B 118 -2.221 2.017 -11.623 1.00 0.00 N ATOM 887 CA GLN B 118 -2.210 0.948 -12.617 1.00 0.00 C ATOM 888 C GLN B 118 -0.799 0.443 -12.845 1.00 0.00 C ATOM 889 O GLN B 118 -0.518 -0.743 -12.684 1.00 0.00 O ATOM 890 CB GLN B 118 -2.820 1.434 -13.934 1.00 0.00 C ATOM 891 CG GLN B 118 -4.250 0.965 -14.150 1.00 0.00 C ATOM 892 CD GLN B 118 -5.256 2.096 -14.061 1.00 0.00 C ATOM 893 OE1 GLN B 118 -6.098 2.125 -13.164 1.00 0.00 O ATOM 894 NE2 GLN B 118 -5.175 3.035 -14.998 1.00 0.00 N ATOM 0 H GLN B 118 -2.542 2.919 -11.974 1.00 0.00 H new ATOM 0 HA GLN B 118 -2.814 0.124 -12.237 1.00 0.00 H new ATOM 0 HB2 GLN B 118 -2.796 2.524 -13.956 1.00 0.00 H new ATOM 0 HB3 GLN B 118 -2.203 1.085 -14.762 1.00 0.00 H new ATOM 0 HG2 GLN B 118 -4.329 0.490 -15.128 1.00 0.00 H new ATOM 0 HG3 GLN B 118 -4.496 0.206 -13.407 1.00 0.00 H new ATOM 0 HE21 GLN B 118 -4.461 2.971 -15.723 1.00 0.00 H new ATOM 0 HE22 GLN B 118 -5.827 3.819 -14.992 1.00 0.00 H new ATOM 903 N GLN B 119 0.085 1.351 -13.207 1.00 0.00 N ATOM 904 CA GLN B 119 1.478 0.998 -13.446 1.00 0.00 C ATOM 905 C GLN B 119 2.099 0.422 -12.183 1.00 0.00 C ATOM 906 O GLN B 119 2.997 -0.417 -12.243 1.00 0.00 O ATOM 907 CB GLN B 119 2.270 2.218 -13.922 1.00 0.00 C ATOM 908 CG GLN B 119 3.192 1.926 -15.095 1.00 0.00 C ATOM 909 CD GLN B 119 4.607 2.423 -14.866 1.00 0.00 C ATOM 910 OE1 GLN B 119 4.883 3.618 -14.977 1.00 0.00 O ATOM 911 NE2 GLN B 119 5.512 1.506 -14.543 1.00 0.00 N ATOM 0 H GLN B 119 -0.132 2.338 -13.343 1.00 0.00 H new ATOM 0 HA GLN B 119 1.513 0.241 -14.229 1.00 0.00 H new ATOM 0 HB2 GLN B 119 1.572 3.005 -14.207 1.00 0.00 H new ATOM 0 HB3 GLN B 119 2.863 2.602 -13.092 1.00 0.00 H new ATOM 0 HG2 GLN B 119 3.214 0.851 -15.276 1.00 0.00 H new ATOM 0 HG3 GLN B 119 2.789 2.392 -15.994 1.00 0.00 H new ATOM 0 HE21 GLN B 119 5.239 0.527 -14.462 1.00 0.00 H new ATOM 0 HE22 GLN B 119 6.480 1.781 -14.376 1.00 0.00 H new ATOM 920 N LEU B 120 1.590 0.862 -11.042 1.00 0.00 N ATOM 921 CA LEU B 120 2.068 0.376 -9.758 1.00 0.00 C ATOM 922 C LEU B 120 1.499 -1.012 -9.500 1.00 0.00 C ATOM 923 O LEU B 120 2.216 -1.926 -9.097 1.00 0.00 O ATOM 924 CB LEU B 120 1.660 1.336 -8.637 1.00 0.00 C ATOM 925 CG LEU B 120 1.899 0.819 -7.216 1.00 0.00 C ATOM 926 CD1 LEU B 120 3.355 0.425 -7.025 1.00 0.00 C ATOM 927 CD2 LEU B 120 1.490 1.869 -6.193 1.00 0.00 C ATOM 0 H LEU B 120 0.845 1.556 -10.980 1.00 0.00 H new ATOM 0 HA LEU B 120 3.156 0.321 -9.779 1.00 0.00 H new ATOM 0 HB2 LEU B 120 2.207 2.270 -8.763 1.00 0.00 H new ATOM 0 HB3 LEU B 120 0.601 1.570 -8.748 1.00 0.00 H new ATOM 0 HG LEU B 120 1.284 -0.068 -7.065 1.00 0.00 H new ATOM 0 HD11 LEU B 120 3.503 0.060 -6.008 1.00 0.00 H new ATOM 0 HD12 LEU B 120 3.615 -0.361 -7.734 1.00 0.00 H new ATOM 0 HD13 LEU B 120 3.992 1.293 -7.196 1.00 0.00 H new ATOM 0 HD21 LEU B 120 1.666 1.486 -5.188 1.00 0.00 H new ATOM 0 HD22 LEU B 120 2.079 2.774 -6.345 1.00 0.00 H new ATOM 0 HD23 LEU B 120 0.432 2.101 -6.313 1.00 0.00 H new ATOM 939 N VAL B 121 0.202 -1.162 -9.759 1.00 0.00 N ATOM 940 CA VAL B 121 -0.471 -2.438 -9.577 1.00 0.00 C ATOM 941 C VAL B 121 0.030 -3.450 -10.599 1.00 0.00 C ATOM 942 O VAL B 121 0.203 -4.625 -10.276 1.00 0.00 O ATOM 943 CB VAL B 121 -2.004 -2.300 -9.696 1.00 0.00 C ATOM 944 CG1 VAL B 121 -2.680 -3.662 -9.605 1.00 0.00 C ATOM 945 CG2 VAL B 121 -2.541 -1.365 -8.622 1.00 0.00 C ATOM 0 H VAL B 121 -0.402 -0.412 -10.096 1.00 0.00 H new ATOM 0 HA VAL B 121 -0.239 -2.787 -8.571 1.00 0.00 H new ATOM 0 HB VAL B 121 -2.232 -1.872 -10.672 1.00 0.00 H new ATOM 0 HG11 VAL B 121 -3.760 -3.539 -9.691 1.00 0.00 H new ATOM 0 HG12 VAL B 121 -2.322 -4.301 -10.412 1.00 0.00 H new ATOM 0 HG13 VAL B 121 -2.443 -4.122 -8.646 1.00 0.00 H new ATOM 0 HG21 VAL B 121 -3.623 -1.280 -8.722 1.00 0.00 H new ATOM 0 HG22 VAL B 121 -2.297 -1.764 -7.637 1.00 0.00 H new ATOM 0 HG23 VAL B 121 -2.088 -0.380 -8.737 1.00 0.00 H new ATOM 955 N LEU B 122 0.283 -2.999 -11.829 1.00 0.00 N ATOM 956 CA LEU B 122 0.783 -3.886 -12.851 1.00 0.00 C ATOM 957 C LEU B 122 2.174 -4.370 -12.457 1.00 0.00 C ATOM 958 O LEU B 122 2.507 -5.542 -12.630 1.00 0.00 O ATOM 959 CB LEU B 122 0.795 -3.163 -14.199 1.00 0.00 C ATOM 960 CG LEU B 122 2.128 -3.173 -14.938 1.00 0.00 C ATOM 961 CD1 LEU B 122 2.539 -4.595 -15.299 1.00 0.00 C ATOM 962 CD2 LEU B 122 2.053 -2.309 -16.183 1.00 0.00 C ATOM 0 H LEU B 122 0.148 -2.033 -12.128 1.00 0.00 H new ATOM 0 HA LEU B 122 0.134 -4.757 -12.948 1.00 0.00 H new ATOM 0 HB2 LEU B 122 0.040 -3.616 -14.841 1.00 0.00 H new ATOM 0 HB3 LEU B 122 0.496 -2.127 -14.038 1.00 0.00 H new ATOM 0 HG LEU B 122 2.887 -2.759 -14.274 1.00 0.00 H new ATOM 0 HD11 LEU B 122 3.493 -4.575 -15.826 1.00 0.00 H new ATOM 0 HD12 LEU B 122 2.639 -5.187 -14.389 1.00 0.00 H new ATOM 0 HD13 LEU B 122 1.780 -5.041 -15.941 1.00 0.00 H new ATOM 0 HD21 LEU B 122 3.014 -2.328 -16.698 1.00 0.00 H new ATOM 0 HD22 LEU B 122 1.278 -2.693 -16.846 1.00 0.00 H new ATOM 0 HD23 LEU B 122 1.813 -1.284 -15.901 1.00 0.00 H new ATOM 974 N LEU B 123 2.972 -3.466 -11.892 1.00 0.00 N ATOM 975 CA LEU B 123 4.305 -3.821 -11.438 1.00 0.00 C ATOM 976 C LEU B 123 4.164 -4.793 -10.283 1.00 0.00 C ATOM 977 O LEU B 123 4.896 -5.777 -10.180 1.00 0.00 O ATOM 978 CB LEU B 123 5.084 -2.577 -11.000 1.00 0.00 C ATOM 979 CG LEU B 123 5.994 -1.972 -12.069 1.00 0.00 C ATOM 980 CD1 LEU B 123 6.518 -0.619 -11.616 1.00 0.00 C ATOM 981 CD2 LEU B 123 7.146 -2.915 -12.384 1.00 0.00 C ATOM 0 H LEU B 123 2.717 -2.490 -11.741 1.00 0.00 H new ATOM 0 HA LEU B 123 4.862 -4.282 -12.254 1.00 0.00 H new ATOM 0 HB2 LEU B 123 4.373 -1.817 -10.678 1.00 0.00 H new ATOM 0 HB3 LEU B 123 5.691 -2.834 -10.132 1.00 0.00 H new ATOM 0 HG LEU B 123 5.411 -1.828 -12.979 1.00 0.00 H new ATOM 0 HD11 LEU B 123 7.164 -0.202 -12.388 1.00 0.00 H new ATOM 0 HD12 LEU B 123 5.680 0.056 -11.441 1.00 0.00 H new ATOM 0 HD13 LEU B 123 7.086 -0.739 -10.694 1.00 0.00 H new ATOM 0 HD21 LEU B 123 7.784 -2.468 -13.147 1.00 0.00 H new ATOM 0 HD22 LEU B 123 7.730 -3.091 -11.480 1.00 0.00 H new ATOM 0 HD23 LEU B 123 6.751 -3.862 -12.751 1.00 0.00 H new ATOM 993 N LEU B 124 3.169 -4.523 -9.445 1.00 0.00 N ATOM 994 CA LEU B 124 2.856 -5.378 -8.317 1.00 0.00 C ATOM 995 C LEU B 124 2.462 -6.741 -8.856 1.00 0.00 C ATOM 996 O LEU B 124 2.940 -7.784 -8.408 1.00 0.00 O ATOM 997 CB LEU B 124 1.704 -4.767 -7.518 1.00 0.00 C ATOM 998 CG LEU B 124 2.098 -3.640 -6.560 1.00 0.00 C ATOM 999 CD1 LEU B 124 0.897 -3.185 -5.748 1.00 0.00 C ATOM 1000 CD2 LEU B 124 3.225 -4.085 -5.644 1.00 0.00 C ATOM 0 H LEU B 124 2.562 -3.708 -9.532 1.00 0.00 H new ATOM 0 HA LEU B 124 3.718 -5.477 -7.657 1.00 0.00 H new ATOM 0 HB2 LEU B 124 0.961 -4.384 -8.218 1.00 0.00 H new ATOM 0 HB3 LEU B 124 1.222 -5.558 -6.944 1.00 0.00 H new ATOM 0 HG LEU B 124 2.452 -2.796 -7.152 1.00 0.00 H new ATOM 0 HD11 LEU B 124 1.197 -2.384 -5.073 1.00 0.00 H new ATOM 0 HD12 LEU B 124 0.120 -2.821 -6.420 1.00 0.00 H new ATOM 0 HD13 LEU B 124 0.512 -4.023 -5.168 1.00 0.00 H new ATOM 0 HD21 LEU B 124 3.490 -3.270 -4.971 1.00 0.00 H new ATOM 0 HD22 LEU B 124 2.901 -4.947 -5.060 1.00 0.00 H new ATOM 0 HD23 LEU B 124 4.094 -4.359 -6.243 1.00 0.00 H new ATOM 1012 N HIS B 125 1.610 -6.698 -9.869 1.00 0.00 N ATOM 1013 CA HIS B 125 1.156 -7.895 -10.555 1.00 0.00 C ATOM 1014 C HIS B 125 2.362 -8.638 -11.077 1.00 0.00 C ATOM 1015 O HIS B 125 2.755 -9.681 -10.560 1.00 0.00 O ATOM 1016 CB HIS B 125 0.254 -7.517 -11.734 1.00 0.00 C ATOM 1017 CG HIS B 125 0.114 -8.599 -12.767 1.00 0.00 C ATOM 1018 ND1 HIS B 125 -0.885 -9.546 -12.758 1.00 0.00 N ATOM 1019 CD2 HIS B 125 0.882 -8.876 -13.856 1.00 0.00 C ATOM 1020 CE1 HIS B 125 -0.699 -10.351 -13.814 1.00 0.00 C ATOM 1021 NE2 HIS B 125 0.360 -9.985 -14.511 1.00 0.00 N ATOM 0 H HIS B 125 1.215 -5.833 -10.237 1.00 0.00 H new ATOM 0 HA HIS B 125 0.592 -8.519 -9.861 1.00 0.00 H new ATOM 0 HB2 HIS B 125 -0.735 -7.261 -11.354 1.00 0.00 H new ATOM 0 HB3 HIS B 125 0.653 -6.622 -12.212 1.00 0.00 H new ATOM 0 HD1 HIS B 125 -1.634 -9.622 -12.070 1.00 0.00 H new ATOM 0 HD2 HIS B 125 1.757 -8.322 -14.162 1.00 0.00 H new ATOM 0 HE1 HIS B 125 -1.333 -11.189 -14.062 1.00 0.00 H new ATOM 1029 N ALA B 126 2.946 -8.057 -12.112 1.00 0.00 N ATOM 1030 CA ALA B 126 4.131 -8.613 -12.751 1.00 0.00 C ATOM 1031 C ALA B 126 5.133 -9.088 -11.702 1.00 0.00 C ATOM 1032 O ALA B 126 5.858 -10.060 -11.912 1.00 0.00 O ATOM 1033 CB ALA B 126 4.769 -7.582 -13.669 1.00 0.00 C ATOM 0 H ALA B 126 2.615 -7.189 -12.533 1.00 0.00 H new ATOM 0 HA ALA B 126 3.830 -9.472 -13.350 1.00 0.00 H new ATOM 0 HB1 ALA B 126 5.653 -8.012 -14.140 1.00 0.00 H new ATOM 0 HB2 ALA B 126 4.055 -7.289 -14.438 1.00 0.00 H new ATOM 0 HB3 ALA B 126 5.057 -6.706 -13.088 1.00 0.00 H new ATOM 1039 N HIS B 127 5.150 -8.399 -10.562 1.00 0.00 N ATOM 1040 CA HIS B 127 6.042 -8.749 -9.464 1.00 0.00 C ATOM 1041 C HIS B 127 5.797 -10.195 -9.034 1.00 0.00 C ATOM 1042 O HIS B 127 6.734 -10.973 -8.863 1.00 0.00 O ATOM 1043 CB HIS B 127 5.830 -7.778 -8.287 1.00 0.00 C ATOM 1044 CG HIS B 127 5.623 -8.442 -6.957 1.00 0.00 C ATOM 1045 ND1 HIS B 127 4.489 -8.260 -6.194 1.00 0.00 N ATOM 1046 CD2 HIS B 127 6.411 -9.294 -6.257 1.00 0.00 C ATOM 1047 CE1 HIS B 127 4.588 -8.970 -5.083 1.00 0.00 C ATOM 1048 NE2 HIS B 127 5.745 -9.607 -5.098 1.00 0.00 N ATOM 0 H HIS B 127 4.553 -7.593 -10.377 1.00 0.00 H new ATOM 0 HA HIS B 127 7.077 -8.663 -9.796 1.00 0.00 H new ATOM 0 HB2 HIS B 127 6.695 -7.118 -8.218 1.00 0.00 H new ATOM 0 HB3 HIS B 127 4.966 -7.150 -8.503 1.00 0.00 H new ATOM 0 HD1 HIS B 127 3.697 -7.669 -6.447 1.00 0.00 H new ATOM 0 HD2 HIS B 127 7.383 -9.659 -6.556 1.00 0.00 H new ATOM 0 HE1 HIS B 127 3.849 -9.020 -4.297 1.00 0.00 H new ATOM 1057 N LYS B 128 4.524 -10.541 -8.865 1.00 0.00 N ATOM 1058 CA LYS B 128 4.143 -11.889 -8.459 1.00 0.00 C ATOM 1059 C LYS B 128 3.758 -12.739 -9.670 1.00 0.00 C ATOM 1060 O LYS B 128 3.849 -13.967 -9.633 1.00 0.00 O ATOM 1061 CB LYS B 128 2.978 -11.834 -7.469 1.00 0.00 C ATOM 1062 CG LYS B 128 1.693 -11.288 -8.069 1.00 0.00 C ATOM 1063 CD LYS B 128 0.564 -11.269 -7.051 1.00 0.00 C ATOM 1064 CE LYS B 128 0.293 -9.862 -6.545 1.00 0.00 C ATOM 1065 NZ LYS B 128 -1.157 -9.630 -6.297 1.00 0.00 N ATOM 0 H LYS B 128 3.738 -9.905 -9.003 1.00 0.00 H new ATOM 0 HA LYS B 128 5.003 -12.351 -7.975 1.00 0.00 H new ATOM 0 HB2 LYS B 128 2.792 -12.837 -7.084 1.00 0.00 H new ATOM 0 HB3 LYS B 128 3.264 -11.214 -6.619 1.00 0.00 H new ATOM 0 HG2 LYS B 128 1.865 -10.278 -8.441 1.00 0.00 H new ATOM 0 HG3 LYS B 128 1.402 -11.898 -8.924 1.00 0.00 H new ATOM 0 HD2 LYS B 128 -0.341 -11.675 -7.503 1.00 0.00 H new ATOM 0 HD3 LYS B 128 0.819 -11.916 -6.211 1.00 0.00 H new ATOM 0 HE2 LYS B 128 0.850 -9.694 -5.623 1.00 0.00 H new ATOM 0 HE3 LYS B 128 0.657 -9.138 -7.274 1.00 0.00 H new ATOM 0 HZ1 LYS B 128 -1.299 -8.659 -5.953 1.00 0.00 H new ATOM 0 HZ2 LYS B 128 -1.686 -9.765 -7.182 1.00 0.00 H new ATOM 0 HZ3 LYS B 128 -1.499 -10.304 -5.583 1.00 0.00 H new ATOM 1079 N CYS B 129 3.322 -12.079 -10.741 1.00 0.00 N ATOM 1080 CA CYS B 129 2.920 -12.771 -11.962 1.00 0.00 C ATOM 1081 C CYS B 129 4.011 -13.725 -12.437 1.00 0.00 C ATOM 1082 O CYS B 129 3.743 -14.886 -12.746 1.00 0.00 O ATOM 1083 CB CYS B 129 2.595 -11.762 -13.065 1.00 0.00 C ATOM 1084 SG CYS B 129 1.600 -12.447 -14.429 1.00 0.00 S ATOM 0 H CYS B 129 3.238 -11.063 -10.787 1.00 0.00 H new ATOM 0 HA CYS B 129 2.027 -13.354 -11.737 1.00 0.00 H new ATOM 0 HB2 CYS B 129 2.060 -10.920 -12.626 1.00 0.00 H new ATOM 0 HB3 CYS B 129 3.528 -11.370 -13.471 1.00 0.00 H new ATOM 0 HG CYS B 129 0.967 -11.484 -15.030 1.00 0.00 H new ATOM 1089 N GLN B 130 5.242 -13.228 -12.491 1.00 0.00 N ATOM 1090 CA GLN B 130 6.374 -14.037 -12.928 1.00 0.00 C ATOM 1091 C GLN B 130 6.664 -15.163 -11.942 1.00 0.00 C ATOM 1092 O GLN B 130 7.303 -16.157 -12.285 1.00 0.00 O ATOM 1093 CB GLN B 130 7.617 -13.162 -13.105 1.00 0.00 C ATOM 1094 CG GLN B 130 8.366 -13.420 -14.402 1.00 0.00 C ATOM 1095 CD GLN B 130 9.761 -12.828 -14.397 1.00 0.00 C ATOM 1096 OE1 GLN B 130 10.439 -12.816 -13.369 1.00 0.00 O ATOM 1097 NE2 GLN B 130 10.198 -12.332 -15.549 1.00 0.00 N ATOM 0 H GLN B 130 5.481 -12.269 -12.238 1.00 0.00 H new ATOM 0 HA GLN B 130 6.113 -14.485 -13.887 1.00 0.00 H new ATOM 0 HB2 GLN B 130 7.321 -12.114 -13.069 1.00 0.00 H new ATOM 0 HB3 GLN B 130 8.292 -13.331 -12.266 1.00 0.00 H new ATOM 0 HG2 GLN B 130 8.432 -14.495 -14.572 1.00 0.00 H new ATOM 0 HG3 GLN B 130 7.800 -13.000 -15.234 1.00 0.00 H new ATOM 0 HE21 GLN B 130 9.602 -12.363 -16.376 1.00 0.00 H new ATOM 0 HE22 GLN B 130 11.129 -11.920 -15.606 1.00 0.00 H new ATOM 1106 N ARG B 131 6.189 -14.995 -10.718 1.00 0.00 N ATOM 1107 CA ARG B 131 6.392 -15.992 -9.672 1.00 0.00 C ATOM 1108 C ARG B 131 5.225 -16.971 -9.596 1.00 0.00 C ATOM 1109 O ARG B 131 5.283 -17.968 -8.876 1.00 0.00 O ATOM 1110 CB ARG B 131 6.596 -15.313 -8.317 1.00 0.00 C ATOM 1111 CG ARG B 131 7.784 -14.366 -8.283 1.00 0.00 C ATOM 1112 CD ARG B 131 9.098 -15.112 -8.458 1.00 0.00 C ATOM 1113 NE ARG B 131 10.245 -14.300 -8.060 1.00 0.00 N ATOM 1114 CZ ARG B 131 11.501 -14.569 -8.407 1.00 0.00 C ATOM 1115 NH1 ARG B 131 11.777 -15.629 -9.158 1.00 0.00 N ATOM 1116 NH2 ARG B 131 12.485 -13.778 -8.003 1.00 0.00 N ATOM 0 H ARG B 131 5.658 -14.176 -10.421 1.00 0.00 H new ATOM 0 HA ARG B 131 7.289 -16.557 -9.927 1.00 0.00 H new ATOM 0 HB2 ARG B 131 5.693 -14.759 -8.058 1.00 0.00 H new ATOM 0 HB3 ARG B 131 6.731 -16.079 -7.553 1.00 0.00 H new ATOM 0 HG2 ARG B 131 7.679 -13.621 -9.072 1.00 0.00 H new ATOM 0 HG3 ARG B 131 7.794 -13.827 -7.336 1.00 0.00 H new ATOM 0 HD2 ARG B 131 9.078 -16.026 -7.865 1.00 0.00 H new ATOM 0 HD3 ARG B 131 9.209 -15.411 -9.500 1.00 0.00 H new ATOM 0 HE ARG B 131 10.073 -13.478 -7.482 1.00 0.00 H new ATOM 0 HH11 ARG B 131 11.024 -16.242 -9.472 1.00 0.00 H new ATOM 0 HH12 ARG B 131 12.742 -15.830 -9.421 1.00 0.00 H new ATOM 0 HH21 ARG B 131 12.280 -12.963 -7.426 1.00 0.00 H new ATOM 0 HH22 ARG B 131 13.448 -13.985 -8.269 1.00 0.00 H new ATOM 1130 N ARG B 132 4.172 -16.679 -10.341 1.00 0.00 N ATOM 1131 CA ARG B 132 2.988 -17.530 -10.362 1.00 0.00 C ATOM 1132 C ARG B 132 3.309 -18.900 -10.951 1.00 0.00 C ATOM 1133 O ARG B 132 2.718 -19.908 -10.564 1.00 0.00 O ATOM 1134 CB ARG B 132 1.869 -16.865 -11.166 1.00 0.00 C ATOM 1135 CG ARG B 132 0.476 -17.327 -10.770 1.00 0.00 C ATOM 1136 CD ARG B 132 -0.513 -17.153 -11.911 1.00 0.00 C ATOM 1137 NE ARG B 132 -1.885 -17.001 -11.429 1.00 0.00 N ATOM 1138 CZ ARG B 132 -2.354 -15.890 -10.865 1.00 0.00 C ATOM 1139 NH1 ARG B 132 -1.567 -14.833 -10.708 1.00 0.00 N ATOM 1140 NH2 ARG B 132 -3.614 -15.836 -10.456 1.00 0.00 N ATOM 0 H ARG B 132 4.110 -15.857 -10.942 1.00 0.00 H new ATOM 0 HA ARG B 132 2.654 -17.668 -9.333 1.00 0.00 H new ATOM 0 HB2 ARG B 132 1.934 -15.785 -11.038 1.00 0.00 H new ATOM 0 HB3 ARG B 132 2.023 -17.070 -12.225 1.00 0.00 H new ATOM 0 HG2 ARG B 132 0.510 -18.375 -10.473 1.00 0.00 H new ATOM 0 HG3 ARG B 132 0.136 -16.761 -9.903 1.00 0.00 H new ATOM 0 HD2 ARG B 132 -0.237 -16.278 -12.500 1.00 0.00 H new ATOM 0 HD3 ARG B 132 -0.456 -18.015 -12.575 1.00 0.00 H new ATOM 0 HE ARG B 132 -2.520 -17.793 -11.531 1.00 0.00 H new ATOM 0 HH11 ARG B 132 -0.597 -14.869 -11.020 1.00 0.00 H new ATOM 0 HH12 ARG B 132 -1.933 -13.985 -10.275 1.00 0.00 H new ATOM 0 HH21 ARG B 132 -4.223 -16.645 -10.574 1.00 0.00 H new ATOM 0 HH22 ARG B 132 -3.974 -14.985 -10.024 1.00 0.00 H new ATOM 1154 N GLU B 133 4.248 -18.930 -11.892 1.00 0.00 N ATOM 1155 CA GLU B 133 4.646 -20.176 -12.536 1.00 0.00 C ATOM 1156 C GLU B 133 5.439 -21.059 -11.578 1.00 0.00 C ATOM 1157 O GLU B 133 5.399 -22.286 -11.674 1.00 0.00 O ATOM 1158 CB GLU B 133 5.482 -19.887 -13.785 1.00 0.00 C ATOM 1159 CG GLU B 133 4.834 -18.897 -14.737 1.00 0.00 C ATOM 1160 CD GLU B 133 5.426 -18.958 -16.131 1.00 0.00 C ATOM 1161 OE1 GLU B 133 5.093 -19.904 -16.877 1.00 0.00 O ATOM 1162 OE2 GLU B 133 6.224 -18.062 -16.477 1.00 0.00 O ATOM 0 H GLU B 133 4.747 -18.105 -12.225 1.00 0.00 H new ATOM 0 HA GLU B 133 3.739 -20.707 -12.826 1.00 0.00 H new ATOM 0 HB2 GLU B 133 6.454 -19.501 -13.479 1.00 0.00 H new ATOM 0 HB3 GLU B 133 5.663 -20.822 -14.315 1.00 0.00 H new ATOM 0 HG2 GLU B 133 3.764 -19.098 -14.791 1.00 0.00 H new ATOM 0 HG3 GLU B 133 4.950 -17.888 -14.341 1.00 0.00 H new ATOM 1169 N GLN B 134 6.159 -20.430 -10.655 1.00 0.00 N ATOM 1170 CA GLN B 134 6.962 -21.163 -9.682 1.00 0.00 C ATOM 1171 C GLN B 134 6.098 -22.124 -8.870 1.00 0.00 C ATOM 1172 O GLN B 134 6.578 -23.152 -8.391 1.00 0.00 O ATOM 1173 CB GLN B 134 7.680 -20.190 -8.745 1.00 0.00 C ATOM 1174 CG GLN B 134 8.606 -20.875 -7.753 1.00 0.00 C ATOM 1175 CD GLN B 134 9.790 -21.540 -8.426 1.00 0.00 C ATOM 1176 OE1 GLN B 134 9.939 -21.484 -9.646 1.00 0.00 O ATOM 1177 NE2 GLN B 134 10.641 -22.177 -7.629 1.00 0.00 N ATOM 0 H GLN B 134 6.203 -19.415 -10.560 1.00 0.00 H new ATOM 0 HA GLN B 134 7.703 -21.746 -10.229 1.00 0.00 H new ATOM 0 HB2 GLN B 134 8.258 -19.484 -9.341 1.00 0.00 H new ATOM 0 HB3 GLN B 134 6.937 -19.611 -8.196 1.00 0.00 H new ATOM 0 HG2 GLN B 134 8.967 -20.141 -7.032 1.00 0.00 H new ATOM 0 HG3 GLN B 134 8.044 -21.622 -7.193 1.00 0.00 H new ATOM 0 HE21 GLN B 134 10.479 -22.198 -6.622 1.00 0.00 H new ATOM 0 HE22 GLN B 134 11.457 -22.645 -8.024 1.00 0.00 H new ATOM 1186 N ALA B 135 4.822 -21.784 -8.718 1.00 0.00 N ATOM 1187 CA ALA B 135 3.894 -22.617 -7.964 1.00 0.00 C ATOM 1188 C ALA B 135 2.987 -23.416 -8.894 1.00 0.00 C ATOM 1189 O ALA B 135 2.677 -24.577 -8.627 1.00 0.00 O ATOM 1190 CB ALA B 135 3.063 -21.759 -7.022 1.00 0.00 C ATOM 0 H ALA B 135 4.408 -20.937 -9.107 1.00 0.00 H new ATOM 0 HA ALA B 135 4.478 -23.325 -7.376 1.00 0.00 H new ATOM 0 HB1 ALA B 135 2.374 -22.393 -6.465 1.00 0.00 H new ATOM 0 HB2 ALA B 135 3.722 -21.240 -6.326 1.00 0.00 H new ATOM 0 HB3 ALA B 135 2.497 -21.028 -7.599 1.00 0.00 H new ATOM 1196 N ASN B 136 2.562 -22.786 -9.985 1.00 0.00 N ATOM 1197 CA ASN B 136 1.688 -23.441 -10.952 1.00 0.00 C ATOM 1198 C ASN B 136 2.488 -24.023 -12.115 1.00 0.00 C ATOM 1199 O ASN B 136 1.954 -24.230 -13.204 1.00 0.00 O ATOM 1200 CB ASN B 136 0.649 -22.449 -11.482 1.00 0.00 C ATOM 1201 CG ASN B 136 -0.661 -22.525 -10.725 1.00 0.00 C ATOM 1202 OD1 ASN B 136 -0.756 -22.085 -9.579 1.00 0.00 O ATOM 1203 ND2 ASN B 136 -1.683 -23.084 -11.364 1.00 0.00 N ATOM 0 H ASN B 136 2.808 -21.825 -10.221 1.00 0.00 H new ATOM 0 HA ASN B 136 1.179 -24.260 -10.443 1.00 0.00 H new ATOM 0 HB2 ASN B 136 1.048 -21.437 -11.412 1.00 0.00 H new ATOM 0 HB3 ASN B 136 0.467 -22.647 -12.538 1.00 0.00 H new ATOM 0 HD21 ASN B 136 -2.591 -23.161 -10.905 1.00 0.00 H new ATOM 0 HD22 ASN B 136 -1.560 -23.436 -12.314 1.00 0.00 H new ATOM 1210 N GLY B 137 3.772 -24.285 -11.879 1.00 0.00 N ATOM 1211 CA GLY B 137 4.619 -24.841 -12.920 1.00 0.00 C ATOM 1212 C GLY B 137 4.524 -24.070 -14.223 1.00 0.00 C ATOM 1213 O GLY B 137 4.443 -22.842 -14.220 1.00 0.00 O ATOM 0 H GLY B 137 4.239 -24.122 -10.987 1.00 0.00 H new ATOM 0 HA2 GLY B 137 5.654 -24.844 -12.578 1.00 0.00 H new ATOM 0 HA3 GLY B 137 4.339 -25.880 -13.095 1.00 0.00 H new ATOM 1217 N GLU B 138 4.531 -24.792 -15.339 1.00 0.00 N ATOM 1218 CA GLU B 138 4.442 -24.168 -16.652 1.00 0.00 C ATOM 1219 C GLU B 138 3.059 -23.562 -16.871 1.00 0.00 C ATOM 1220 O GLU B 138 2.080 -24.281 -17.071 1.00 0.00 O ATOM 1221 CB GLU B 138 4.743 -25.191 -17.748 1.00 0.00 C ATOM 1222 CG GLU B 138 4.703 -24.609 -19.152 1.00 0.00 C ATOM 1223 CD GLU B 138 5.302 -25.540 -20.186 1.00 0.00 C ATOM 1224 OE1 GLU B 138 4.849 -26.700 -20.274 1.00 0.00 O ATOM 1225 OE2 GLU B 138 6.226 -25.109 -20.908 1.00 0.00 O ATOM 0 H GLU B 138 4.597 -25.810 -15.359 1.00 0.00 H new ATOM 0 HA GLU B 138 5.182 -23.369 -16.699 1.00 0.00 H new ATOM 0 HB2 GLU B 138 5.728 -25.622 -17.570 1.00 0.00 H new ATOM 0 HB3 GLU B 138 4.022 -26.006 -17.681 1.00 0.00 H new ATOM 0 HG2 GLU B 138 3.670 -24.390 -19.421 1.00 0.00 H new ATOM 0 HG3 GLU B 138 5.243 -23.662 -19.164 1.00 0.00 H new ATOM 1232 N VAL B 139 2.986 -22.236 -16.828 1.00 0.00 N ATOM 1233 CA VAL B 139 1.724 -21.532 -17.018 1.00 0.00 C ATOM 1234 C VAL B 139 1.630 -20.937 -18.417 1.00 0.00 C ATOM 1235 O VAL B 139 2.644 -20.719 -19.081 1.00 0.00 O ATOM 1236 CB VAL B 139 1.539 -20.404 -15.987 1.00 0.00 C ATOM 1237 CG1 VAL B 139 0.091 -19.940 -15.959 1.00 0.00 C ATOM 1238 CG2 VAL B 139 1.989 -20.856 -14.605 1.00 0.00 C ATOM 0 H VAL B 139 3.787 -21.627 -16.663 1.00 0.00 H new ATOM 0 HA VAL B 139 0.935 -22.271 -16.881 1.00 0.00 H new ATOM 0 HB VAL B 139 2.163 -19.561 -16.285 1.00 0.00 H new ATOM 0 HG11 VAL B 139 -0.021 -19.142 -15.225 1.00 0.00 H new ATOM 0 HG12 VAL B 139 -0.191 -19.569 -16.944 1.00 0.00 H new ATOM 0 HG13 VAL B 139 -0.554 -20.776 -15.688 1.00 0.00 H new ATOM 0 HG21 VAL B 139 1.849 -20.043 -13.893 1.00 0.00 H new ATOM 0 HG22 VAL B 139 1.398 -21.717 -14.293 1.00 0.00 H new ATOM 0 HG23 VAL B 139 3.043 -21.132 -14.638 1.00 0.00 H new ATOM 1248 N ARG B 140 0.406 -20.677 -18.855 1.00 0.00 N ATOM 1249 CA ARG B 140 0.167 -20.106 -20.177 1.00 0.00 C ATOM 1250 C ARG B 140 0.919 -18.790 -20.349 1.00 0.00 C ATOM 1251 O ARG B 140 1.346 -18.174 -19.372 1.00 0.00 O ATOM 1252 CB ARG B 140 -1.331 -19.881 -20.392 1.00 0.00 C ATOM 1253 CG ARG B 140 -1.685 -19.442 -21.804 1.00 0.00 C ATOM 1254 CD ARG B 140 -3.113 -19.821 -22.163 1.00 0.00 C ATOM 1255 NE ARG B 140 -3.441 -19.475 -23.544 1.00 0.00 N ATOM 1256 CZ ARG B 140 -4.667 -19.555 -24.056 1.00 0.00 C ATOM 1257 NH1 ARG B 140 -5.682 -19.967 -23.306 1.00 0.00 N ATOM 1258 NH2 ARG B 140 -4.879 -19.223 -25.322 1.00 0.00 N ATOM 0 H ARG B 140 -0.441 -20.852 -18.314 1.00 0.00 H new ATOM 0 HA ARG B 140 0.535 -20.812 -20.922 1.00 0.00 H new ATOM 0 HB2 ARG B 140 -1.865 -20.803 -20.163 1.00 0.00 H new ATOM 0 HB3 ARG B 140 -1.681 -19.127 -19.688 1.00 0.00 H new ATOM 0 HG2 ARG B 140 -1.560 -18.363 -21.893 1.00 0.00 H new ATOM 0 HG3 ARG B 140 -0.996 -19.902 -22.513 1.00 0.00 H new ATOM 0 HD2 ARG B 140 -3.252 -20.892 -22.015 1.00 0.00 H new ATOM 0 HD3 ARG B 140 -3.803 -19.314 -21.489 1.00 0.00 H new ATOM 0 HE ARG B 140 -2.687 -19.154 -24.151 1.00 0.00 H new ATOM 0 HH11 ARG B 140 -5.525 -20.224 -22.332 1.00 0.00 H new ATOM 0 HH12 ARG B 140 -6.619 -20.026 -23.704 1.00 0.00 H new ATOM 0 HH21 ARG B 140 -4.103 -18.906 -25.903 1.00 0.00 H new ATOM 0 HH22 ARG B 140 -5.818 -19.284 -25.715 1.00 0.00 H new ATOM 1272 N GLN B 141 1.076 -18.363 -21.598 1.00 0.00 N ATOM 1273 CA GLN B 141 1.776 -17.120 -21.899 1.00 0.00 C ATOM 1274 C GLN B 141 0.937 -15.913 -21.498 1.00 0.00 C ATOM 1275 O GLN B 141 -0.219 -15.787 -21.904 1.00 0.00 O ATOM 1276 CB GLN B 141 2.113 -17.048 -23.391 1.00 0.00 C ATOM 1277 CG GLN B 141 2.679 -18.343 -23.951 1.00 0.00 C ATOM 1278 CD GLN B 141 3.866 -18.852 -23.157 1.00 0.00 C ATOM 1279 OE1 GLN B 141 3.936 -20.031 -22.808 1.00 0.00 O ATOM 1280 NE2 GLN B 141 4.808 -17.963 -22.865 1.00 0.00 N ATOM 0 H GLN B 141 0.728 -18.860 -22.418 1.00 0.00 H new ATOM 0 HA GLN B 141 2.701 -17.105 -21.323 1.00 0.00 H new ATOM 0 HB2 GLN B 141 1.212 -16.785 -23.946 1.00 0.00 H new ATOM 0 HB3 GLN B 141 2.833 -16.246 -23.554 1.00 0.00 H new ATOM 0 HG2 GLN B 141 1.898 -19.103 -23.958 1.00 0.00 H new ATOM 0 HG3 GLN B 141 2.980 -18.186 -24.987 1.00 0.00 H new ATOM 0 HE21 GLN B 141 4.710 -16.996 -23.174 1.00 0.00 H new ATOM 0 HE22 GLN B 141 5.630 -18.247 -22.332 1.00 0.00 H new ATOM 1289 N CYS B 142 1.526 -15.032 -20.689 1.00 0.00 N ATOM 1290 CA CYS B 142 0.851 -13.835 -20.212 1.00 0.00 C ATOM 1291 C CYS B 142 -0.024 -13.204 -21.295 1.00 0.00 C ATOM 1292 O CYS B 142 0.456 -12.878 -22.381 1.00 0.00 O ATOM 1293 CB CYS B 142 1.877 -12.816 -19.714 1.00 0.00 C ATOM 1294 SG CYS B 142 1.291 -11.788 -18.328 1.00 0.00 S ATOM 0 H CYS B 142 2.483 -15.132 -20.349 1.00 0.00 H new ATOM 0 HA CYS B 142 0.200 -14.131 -19.389 1.00 0.00 H new ATOM 0 HB2 CYS B 142 2.778 -13.345 -19.404 1.00 0.00 H new ATOM 0 HB3 CYS B 142 2.158 -12.165 -20.542 1.00 0.00 H new ATOM 0 HG CYS B 142 2.311 -11.279 -17.704 1.00 0.00 H new ATOM 1299 N ASN B 143 -1.307 -13.038 -20.992 1.00 0.00 N ATOM 1300 CA ASN B 143 -2.245 -12.447 -21.939 1.00 0.00 C ATOM 1301 C ASN B 143 -2.236 -10.925 -21.842 1.00 0.00 C ATOM 1302 O ASN B 143 -2.374 -10.228 -22.847 1.00 0.00 O ATOM 1303 CB ASN B 143 -3.659 -12.976 -21.686 1.00 0.00 C ATOM 1304 CG ASN B 143 -3.888 -14.337 -22.313 1.00 0.00 C ATOM 1305 OD1 ASN B 143 -4.464 -14.446 -23.396 1.00 0.00 O ATOM 1306 ND2 ASN B 143 -3.439 -15.386 -21.633 1.00 0.00 N ATOM 0 H ASN B 143 -1.721 -13.304 -20.099 1.00 0.00 H new ATOM 0 HA ASN B 143 -1.931 -12.730 -22.944 1.00 0.00 H new ATOM 0 HB2 ASN B 143 -3.833 -13.040 -20.612 1.00 0.00 H new ATOM 0 HB3 ASN B 143 -4.386 -12.268 -22.085 1.00 0.00 H new ATOM 0 HD21 ASN B 143 -3.566 -16.327 -22.005 1.00 0.00 H new ATOM 0 HD22 ASN B 143 -2.967 -15.250 -20.739 1.00 0.00 H new ATOM 1313 N LEU B 144 -2.072 -10.415 -20.625 1.00 0.00 N ATOM 1314 CA LEU B 144 -2.046 -8.975 -20.398 1.00 0.00 C ATOM 1315 C LEU B 144 -0.769 -8.356 -20.964 1.00 0.00 C ATOM 1316 O LEU B 144 0.330 -8.856 -20.722 1.00 0.00 O ATOM 1317 CB LEU B 144 -2.149 -8.671 -18.902 1.00 0.00 C ATOM 1318 CG LEU B 144 -3.510 -8.972 -18.271 1.00 0.00 C ATOM 1319 CD1 LEU B 144 -3.474 -10.303 -17.536 1.00 0.00 C ATOM 1320 CD2 LEU B 144 -3.921 -7.851 -17.326 1.00 0.00 C ATOM 0 H LEU B 144 -1.955 -10.977 -19.782 1.00 0.00 H new ATOM 0 HA LEU B 144 -2.902 -8.538 -20.913 1.00 0.00 H new ATOM 0 HB2 LEU B 144 -1.387 -9.247 -18.377 1.00 0.00 H new ATOM 0 HB3 LEU B 144 -1.918 -7.618 -18.744 1.00 0.00 H new ATOM 0 HG LEU B 144 -4.251 -9.039 -19.068 1.00 0.00 H new ATOM 0 HD11 LEU B 144 -4.450 -10.501 -17.093 1.00 0.00 H new ATOM 0 HD12 LEU B 144 -3.225 -11.099 -18.237 1.00 0.00 H new ATOM 0 HD13 LEU B 144 -2.720 -10.264 -16.749 1.00 0.00 H new ATOM 0 HD21 LEU B 144 -4.891 -8.083 -16.887 1.00 0.00 H new ATOM 0 HD22 LEU B 144 -3.179 -7.752 -16.534 1.00 0.00 H new ATOM 0 HD23 LEU B 144 -3.988 -6.914 -17.880 1.00 0.00 H new ATOM 1332 N PRO B 145 -0.893 -7.254 -21.726 1.00 0.00 N ATOM 1333 CA PRO B 145 0.262 -6.573 -22.319 1.00 0.00 C ATOM 1334 C PRO B 145 1.053 -5.777 -21.287 1.00 0.00 C ATOM 1335 O PRO B 145 2.259 -5.578 -21.433 1.00 0.00 O ATOM 1336 CB PRO B 145 -0.374 -5.637 -23.345 1.00 0.00 C ATOM 1337 CG PRO B 145 -1.725 -5.339 -22.792 1.00 0.00 C ATOM 1338 CD PRO B 145 -2.163 -6.583 -22.068 1.00 0.00 C ATOM 0 HA PRO B 145 0.979 -7.274 -22.747 1.00 0.00 H new ATOM 0 HB2 PRO B 145 0.213 -4.727 -23.470 1.00 0.00 H new ATOM 0 HB3 PRO B 145 -0.442 -6.110 -24.325 1.00 0.00 H new ATOM 0 HG2 PRO B 145 -1.689 -4.486 -22.114 1.00 0.00 H new ATOM 0 HG3 PRO B 145 -2.425 -5.085 -23.588 1.00 0.00 H new ATOM 0 HD2 PRO B 145 -2.743 -6.344 -21.176 1.00 0.00 H new ATOM 0 HD3 PRO B 145 -2.792 -7.213 -22.698 1.00 0.00 H new ATOM 1346 N HIS B 146 0.364 -5.324 -20.245 1.00 0.00 N ATOM 1347 CA HIS B 146 0.999 -4.548 -19.184 1.00 0.00 C ATOM 1348 C HIS B 146 2.132 -5.339 -18.536 1.00 0.00 C ATOM 1349 O HIS B 146 3.290 -4.925 -18.567 1.00 0.00 O ATOM 1350 CB HIS B 146 -0.035 -4.154 -18.129 1.00 0.00 C ATOM 1351 CG HIS B 146 -0.850 -2.958 -18.511 1.00 0.00 C ATOM 1352 ND1 HIS B 146 -2.133 -3.050 -19.011 1.00 0.00 N ATOM 1353 CD2 HIS B 146 -0.560 -1.636 -18.467 1.00 0.00 C ATOM 1354 CE1 HIS B 146 -2.595 -1.838 -19.259 1.00 0.00 C ATOM 1355 NE2 HIS B 146 -1.661 -0.962 -18.937 1.00 0.00 N ATOM 0 H HIS B 146 -0.635 -5.481 -20.112 1.00 0.00 H new ATOM 0 HA HIS B 146 1.420 -3.645 -19.626 1.00 0.00 H new ATOM 0 HB2 HIS B 146 -0.702 -4.998 -17.953 1.00 0.00 H new ATOM 0 HB3 HIS B 146 0.477 -3.950 -17.188 1.00 0.00 H new ATOM 0 HD1 HIS B 146 -2.645 -3.919 -19.165 1.00 0.00 H new ATOM 0 HD2 HIS B 146 0.364 -1.194 -18.126 1.00 0.00 H new ATOM 0 HE1 HIS B 146 -3.571 -1.603 -19.657 1.00 0.00 H new ATOM 1364 N CYS B 147 1.787 -6.483 -17.952 1.00 0.00 N ATOM 1365 CA CYS B 147 2.771 -7.342 -17.298 1.00 0.00 C ATOM 1366 C CYS B 147 3.937 -7.641 -18.228 1.00 0.00 C ATOM 1367 O CYS B 147 5.082 -7.291 -17.944 1.00 0.00 O ATOM 1368 CB CYS B 147 2.119 -8.654 -16.869 1.00 0.00 C ATOM 1369 SG CYS B 147 3.202 -9.742 -15.890 1.00 0.00 S ATOM 0 H CYS B 147 0.831 -6.838 -17.918 1.00 0.00 H new ATOM 0 HA CYS B 147 3.147 -6.815 -16.421 1.00 0.00 H new ATOM 0 HB2 CYS B 147 1.226 -8.429 -16.286 1.00 0.00 H new ATOM 0 HB3 CYS B 147 1.791 -9.192 -17.759 1.00 0.00 H new ATOM 0 HG CYS B 147 2.479 -10.615 -15.253 1.00 0.00 H new ATOM 1374 N ARG B 148 3.626 -8.298 -19.339 1.00 0.00 N ATOM 1375 CA ARG B 148 4.635 -8.664 -20.334 1.00 0.00 C ATOM 1376 C ARG B 148 5.602 -7.509 -20.583 1.00 0.00 C ATOM 1377 O ARG B 148 6.819 -7.699 -20.612 1.00 0.00 O ATOM 1378 CB ARG B 148 3.964 -9.074 -21.647 1.00 0.00 C ATOM 1379 CG ARG B 148 4.847 -9.933 -22.538 1.00 0.00 C ATOM 1380 CD ARG B 148 4.923 -9.380 -23.953 1.00 0.00 C ATOM 1381 NE ARG B 148 5.903 -8.303 -24.068 1.00 0.00 N ATOM 1382 CZ ARG B 148 7.220 -8.493 -24.051 1.00 0.00 C ATOM 1383 NH1 ARG B 148 7.720 -9.717 -23.925 1.00 0.00 N ATOM 1384 NH2 ARG B 148 8.042 -7.458 -24.161 1.00 0.00 N ATOM 0 H ARG B 148 2.678 -8.591 -19.577 1.00 0.00 H new ATOM 0 HA ARG B 148 5.201 -9.510 -19.943 1.00 0.00 H new ATOM 0 HB2 ARG B 148 3.048 -9.620 -21.422 1.00 0.00 H new ATOM 0 HB3 ARG B 148 3.674 -8.176 -22.193 1.00 0.00 H new ATOM 0 HG2 ARG B 148 5.850 -9.987 -22.114 1.00 0.00 H new ATOM 0 HG3 ARG B 148 4.457 -10.950 -22.565 1.00 0.00 H new ATOM 0 HD2 ARG B 148 5.184 -10.183 -24.642 1.00 0.00 H new ATOM 0 HD3 ARG B 148 3.942 -9.011 -24.251 1.00 0.00 H new ATOM 0 HE ARG B 148 5.557 -7.349 -24.167 1.00 0.00 H new ATOM 0 HH11 ARG B 148 7.094 -10.518 -23.841 1.00 0.00 H new ATOM 0 HH12 ARG B 148 8.730 -9.856 -23.913 1.00 0.00 H new ATOM 0 HH21 ARG B 148 7.665 -6.515 -24.259 1.00 0.00 H new ATOM 0 HH22 ARG B 148 9.051 -7.605 -24.148 1.00 0.00 H new ATOM 1398 N THR B 149 5.054 -6.312 -20.750 1.00 0.00 N ATOM 1399 CA THR B 149 5.870 -5.126 -20.982 1.00 0.00 C ATOM 1400 C THR B 149 6.732 -4.836 -19.761 1.00 0.00 C ATOM 1401 O THR B 149 7.928 -4.572 -19.884 1.00 0.00 O ATOM 1402 CB THR B 149 4.985 -3.921 -21.303 1.00 0.00 C ATOM 1403 OG1 THR B 149 4.136 -4.200 -22.401 1.00 0.00 O ATOM 1404 CG2 THR B 149 5.773 -2.673 -21.638 1.00 0.00 C ATOM 0 H THR B 149 4.049 -6.136 -20.729 1.00 0.00 H new ATOM 0 HA THR B 149 6.521 -5.314 -21.836 1.00 0.00 H new ATOM 0 HB THR B 149 4.409 -3.736 -20.396 1.00 0.00 H new ATOM 0 HG1 THR B 149 3.234 -4.401 -22.074 1.00 0.00 H new ATOM 0 HG21 THR B 149 5.085 -1.856 -21.856 1.00 0.00 H new ATOM 0 HG22 THR B 149 6.402 -2.402 -20.790 1.00 0.00 H new ATOM 0 HG23 THR B 149 6.400 -2.861 -22.510 1.00 0.00 H new ATOM 1412 N MET B 150 6.123 -4.901 -18.580 1.00 0.00 N ATOM 1413 CA MET B 150 6.853 -4.659 -17.343 1.00 0.00 C ATOM 1414 C MET B 150 7.936 -5.709 -17.174 1.00 0.00 C ATOM 1415 O MET B 150 9.026 -5.415 -16.687 1.00 0.00 O ATOM 1416 CB MET B 150 5.909 -4.664 -16.139 1.00 0.00 C ATOM 1417 CG MET B 150 5.283 -3.309 -15.846 1.00 0.00 C ATOM 1418 SD MET B 150 6.510 -2.018 -15.562 1.00 0.00 S ATOM 1419 CE MET B 150 6.072 -0.847 -16.844 1.00 0.00 C ATOM 0 H MET B 150 5.134 -5.117 -18.455 1.00 0.00 H new ATOM 0 HA MET B 150 7.316 -3.674 -17.399 1.00 0.00 H new ATOM 0 HB2 MET B 150 5.115 -5.391 -16.314 1.00 0.00 H new ATOM 0 HB3 MET B 150 6.459 -4.998 -15.259 1.00 0.00 H new ATOM 0 HG2 MET B 150 4.645 -3.020 -16.682 1.00 0.00 H new ATOM 0 HG3 MET B 150 4.641 -3.393 -14.969 1.00 0.00 H new ATOM 0 HE1 MET B 150 6.732 0.019 -16.787 1.00 0.00 H new ATOM 0 HE2 MET B 150 6.178 -1.320 -17.820 1.00 0.00 H new ATOM 0 HE3 MET B 150 5.040 -0.526 -16.706 1.00 0.00 H new ATOM 1429 N LYS B 151 7.646 -6.930 -17.612 1.00 0.00 N ATOM 1430 CA LYS B 151 8.624 -8.004 -17.541 1.00 0.00 C ATOM 1431 C LYS B 151 9.860 -7.583 -18.324 1.00 0.00 C ATOM 1432 O LYS B 151 10.995 -7.851 -17.929 1.00 0.00 O ATOM 1433 CB LYS B 151 8.045 -9.297 -18.120 1.00 0.00 C ATOM 1434 CG LYS B 151 7.472 -10.235 -17.070 1.00 0.00 C ATOM 1435 CD LYS B 151 6.171 -10.869 -17.539 1.00 0.00 C ATOM 1436 CE LYS B 151 5.739 -12.002 -16.623 1.00 0.00 C ATOM 1437 NZ LYS B 151 6.083 -13.336 -17.190 1.00 0.00 N ATOM 0 H LYS B 151 6.748 -7.197 -18.016 1.00 0.00 H new ATOM 0 HA LYS B 151 8.888 -8.192 -16.500 1.00 0.00 H new ATOM 0 HB2 LYS B 151 7.262 -9.045 -18.835 1.00 0.00 H new ATOM 0 HB3 LYS B 151 8.826 -9.819 -18.673 1.00 0.00 H new ATOM 0 HG2 LYS B 151 8.198 -11.016 -16.844 1.00 0.00 H new ATOM 0 HG3 LYS B 151 7.297 -9.685 -16.146 1.00 0.00 H new ATOM 0 HD2 LYS B 151 5.389 -10.111 -17.575 1.00 0.00 H new ATOM 0 HD3 LYS B 151 6.295 -11.248 -18.554 1.00 0.00 H new ATOM 0 HE2 LYS B 151 6.218 -11.886 -15.651 1.00 0.00 H new ATOM 0 HE3 LYS B 151 4.663 -11.945 -16.457 1.00 0.00 H new ATOM 0 HZ1 LYS B 151 5.772 -14.082 -16.536 1.00 0.00 H new ATOM 0 HZ2 LYS B 151 5.605 -13.458 -18.106 1.00 0.00 H new ATOM 0 HZ3 LYS B 151 7.112 -13.401 -17.325 1.00 0.00 H new ATOM 1451 N ASN B 152 9.609 -6.891 -19.432 1.00 0.00 N ATOM 1452 CA ASN B 152 10.666 -6.384 -20.287 1.00 0.00 C ATOM 1453 C ASN B 152 11.325 -5.171 -19.640 1.00 0.00 C ATOM 1454 O ASN B 152 12.554 -5.073 -19.583 1.00 0.00 O ATOM 1455 CB ASN B 152 10.094 -6.004 -21.656 1.00 0.00 C ATOM 1456 CG ASN B 152 11.045 -6.327 -22.792 1.00 0.00 C ATOM 1457 OD1 ASN B 152 10.631 -6.821 -23.841 1.00 0.00 O ATOM 1458 ND2 ASN B 152 12.328 -6.050 -22.589 1.00 0.00 N ATOM 0 H ASN B 152 8.668 -6.669 -19.758 1.00 0.00 H new ATOM 0 HA ASN B 152 11.417 -7.163 -20.421 1.00 0.00 H new ATOM 0 HB2 ASN B 152 9.153 -6.532 -21.813 1.00 0.00 H new ATOM 0 HB3 ASN B 152 9.867 -4.938 -21.668 1.00 0.00 H new ATOM 0 HD21 ASN B 152 13.014 -6.247 -23.318 1.00 0.00 H new ATOM 0 HD22 ASN B 152 12.628 -5.641 -21.704 1.00 0.00 H new ATOM 1465 N VAL B 153 10.501 -4.253 -19.140 1.00 0.00 N ATOM 1466 CA VAL B 153 11.007 -3.055 -18.485 1.00 0.00 C ATOM 1467 C VAL B 153 11.763 -3.425 -17.219 1.00 0.00 C ATOM 1468 O VAL B 153 12.708 -2.745 -16.822 1.00 0.00 O ATOM 1469 CB VAL B 153 9.871 -2.076 -18.135 1.00 0.00 C ATOM 1470 CG1 VAL B 153 10.436 -0.778 -17.578 1.00 0.00 C ATOM 1471 CG2 VAL B 153 9.002 -1.807 -19.355 1.00 0.00 C ATOM 0 H VAL B 153 9.484 -4.318 -19.177 1.00 0.00 H new ATOM 0 HA VAL B 153 11.681 -2.561 -19.185 1.00 0.00 H new ATOM 0 HB VAL B 153 9.247 -2.533 -17.367 1.00 0.00 H new ATOM 0 HG11 VAL B 153 9.618 -0.099 -17.337 1.00 0.00 H new ATOM 0 HG12 VAL B 153 11.011 -0.989 -16.676 1.00 0.00 H new ATOM 0 HG13 VAL B 153 11.085 -0.315 -18.322 1.00 0.00 H new ATOM 0 HG21 VAL B 153 8.205 -1.113 -19.088 1.00 0.00 H new ATOM 0 HG22 VAL B 153 9.612 -1.372 -20.147 1.00 0.00 H new ATOM 0 HG23 VAL B 153 8.566 -2.743 -19.705 1.00 0.00 H new ATOM 1481 N LEU B 154 11.345 -4.518 -16.591 1.00 0.00 N ATOM 1482 CA LEU B 154 11.977 -4.993 -15.388 1.00 0.00 C ATOM 1483 C LEU B 154 13.405 -5.418 -15.682 1.00 0.00 C ATOM 1484 O LEU B 154 14.344 -4.997 -15.007 1.00 0.00 O ATOM 1485 CB LEU B 154 11.169 -6.160 -14.837 1.00 0.00 C ATOM 1486 CG LEU B 154 10.173 -5.792 -13.740 1.00 0.00 C ATOM 1487 CD1 LEU B 154 9.444 -7.032 -13.244 1.00 0.00 C ATOM 1488 CD2 LEU B 154 10.879 -5.088 -12.593 1.00 0.00 C ATOM 0 H LEU B 154 10.562 -5.090 -16.907 1.00 0.00 H new ATOM 0 HA LEU B 154 12.010 -4.196 -14.645 1.00 0.00 H new ATOM 0 HB2 LEU B 154 10.626 -6.627 -15.659 1.00 0.00 H new ATOM 0 HB3 LEU B 154 11.859 -6.908 -14.445 1.00 0.00 H new ATOM 0 HG LEU B 154 9.436 -5.107 -14.159 1.00 0.00 H new ATOM 0 HD11 LEU B 154 8.738 -6.751 -12.462 1.00 0.00 H new ATOM 0 HD12 LEU B 154 8.904 -7.492 -14.072 1.00 0.00 H new ATOM 0 HD13 LEU B 154 10.166 -7.742 -12.842 1.00 0.00 H new ATOM 0 HD21 LEU B 154 10.153 -4.833 -11.821 1.00 0.00 H new ATOM 0 HD22 LEU B 154 11.639 -5.748 -12.174 1.00 0.00 H new ATOM 0 HD23 LEU B 154 11.352 -4.177 -12.961 1.00 0.00 H new ATOM 1500 N ASN B 155 13.562 -6.239 -16.713 1.00 0.00 N ATOM 1501 CA ASN B 155 14.881 -6.705 -17.120 1.00 0.00 C ATOM 1502 C ASN B 155 15.794 -5.509 -17.366 1.00 0.00 C ATOM 1503 O ASN B 155 16.989 -5.550 -17.075 1.00 0.00 O ATOM 1504 CB ASN B 155 14.781 -7.561 -18.384 1.00 0.00 C ATOM 1505 CG ASN B 155 15.734 -8.740 -18.360 1.00 0.00 C ATOM 1506 OD1 ASN B 155 16.917 -8.591 -18.054 1.00 0.00 O ATOM 1507 ND2 ASN B 155 15.222 -9.921 -18.684 1.00 0.00 N ATOM 0 H ASN B 155 12.794 -6.595 -17.281 1.00 0.00 H new ATOM 0 HA ASN B 155 15.300 -7.319 -16.322 1.00 0.00 H new ATOM 0 HB2 ASN B 155 13.759 -7.925 -18.493 1.00 0.00 H new ATOM 0 HB3 ASN B 155 14.994 -6.943 -19.256 1.00 0.00 H new ATOM 0 HD21 ASN B 155 15.815 -10.751 -18.686 1.00 0.00 H new ATOM 0 HD22 ASN B 155 14.235 -9.999 -18.931 1.00 0.00 H new ATOM 1514 N HIS B 156 15.203 -4.436 -17.883 1.00 0.00 N ATOM 1515 CA HIS B 156 15.934 -3.206 -18.152 1.00 0.00 C ATOM 1516 C HIS B 156 16.393 -2.581 -16.847 1.00 0.00 C ATOM 1517 O HIS B 156 17.587 -2.500 -16.558 1.00 0.00 O ATOM 1518 CB HIS B 156 15.028 -2.222 -18.890 1.00 0.00 C ATOM 1519 CG HIS B 156 15.616 -0.855 -19.067 1.00 0.00 C ATOM 1520 ND1 HIS B 156 16.921 -0.529 -18.770 1.00 0.00 N ATOM 1521 CD2 HIS B 156 15.035 0.290 -19.504 1.00 0.00 C ATOM 1522 CE1 HIS B 156 17.085 0.777 -19.026 1.00 0.00 C ATOM 1523 NE2 HIS B 156 15.972 1.317 -19.475 1.00 0.00 N ATOM 0 H HIS B 156 14.213 -4.396 -18.125 1.00 0.00 H new ATOM 0 HA HIS B 156 16.803 -3.437 -18.768 1.00 0.00 H new ATOM 0 HB2 HIS B 156 14.790 -2.632 -19.871 1.00 0.00 H new ATOM 0 HB3 HIS B 156 14.088 -2.133 -18.345 1.00 0.00 H new ATOM 0 HD1 HIS B 156 17.635 -1.167 -18.418 1.00 0.00 H new ATOM 0 HD2 HIS B 156 14.008 0.388 -19.824 1.00 0.00 H new ATOM 0 HE1 HIS B 156 18.010 1.316 -18.882 1.00 0.00 H new ATOM 1531 N MET B 157 15.417 -2.136 -16.070 1.00 0.00 N ATOM 1532 CA MET B 157 15.675 -1.501 -14.779 1.00 0.00 C ATOM 1533 C MET B 157 16.691 -2.291 -13.959 1.00 0.00 C ATOM 1534 O MET B 157 17.579 -1.714 -13.331 1.00 0.00 O ATOM 1535 CB MET B 157 14.370 -1.367 -13.994 1.00 0.00 C ATOM 1536 CG MET B 157 14.382 -0.240 -12.973 1.00 0.00 C ATOM 1537 SD MET B 157 12.780 -0.005 -12.177 1.00 0.00 S ATOM 1538 CE MET B 157 12.254 -1.703 -11.956 1.00 0.00 C ATOM 0 H MET B 157 14.428 -2.202 -16.311 1.00 0.00 H new ATOM 0 HA MET B 157 16.092 -0.512 -14.971 1.00 0.00 H new ATOM 0 HB2 MET B 157 13.551 -1.202 -14.694 1.00 0.00 H new ATOM 0 HB3 MET B 157 14.167 -2.307 -13.481 1.00 0.00 H new ATOM 0 HG2 MET B 157 15.133 -0.452 -12.212 1.00 0.00 H new ATOM 0 HG3 MET B 157 14.679 0.687 -13.464 1.00 0.00 H new ATOM 0 HE1 MET B 157 11.358 -1.729 -11.335 1.00 0.00 H new ATOM 0 HE2 MET B 157 12.035 -2.145 -12.928 1.00 0.00 H new ATOM 0 HE3 MET B 157 13.048 -2.270 -11.470 1.00 0.00 H new ATOM 1548 N THR B 158 16.556 -3.614 -13.967 1.00 0.00 N ATOM 1549 CA THR B 158 17.464 -4.479 -13.221 1.00 0.00 C ATOM 1550 C THR B 158 18.906 -4.318 -13.700 1.00 0.00 C ATOM 1551 O THR B 158 19.846 -4.705 -13.005 1.00 0.00 O ATOM 1552 CB THR B 158 17.032 -5.941 -13.348 1.00 0.00 C ATOM 1553 OG1 THR B 158 15.627 -6.062 -13.215 1.00 0.00 O ATOM 1554 CG2 THR B 158 17.666 -6.844 -12.313 1.00 0.00 C ATOM 0 H THR B 158 15.828 -4.110 -14.481 1.00 0.00 H new ATOM 0 HA THR B 158 17.419 -4.182 -12.173 1.00 0.00 H new ATOM 0 HB THR B 158 17.366 -6.255 -14.337 1.00 0.00 H new ATOM 0 HG1 THR B 158 15.215 -6.084 -14.104 1.00 0.00 H new ATOM 0 HG21 THR B 158 17.317 -7.866 -12.459 1.00 0.00 H new ATOM 0 HG22 THR B 158 18.750 -6.812 -12.418 1.00 0.00 H new ATOM 0 HG23 THR B 158 17.388 -6.505 -11.315 1.00 0.00 H new ATOM 1562 N HIS B 159 19.079 -3.739 -14.886 1.00 0.00 N ATOM 1563 CA HIS B 159 20.404 -3.522 -15.446 1.00 0.00 C ATOM 1564 C HIS B 159 20.594 -2.062 -15.847 1.00 0.00 C ATOM 1565 O HIS B 159 21.494 -1.731 -16.618 1.00 0.00 O ATOM 1566 CB HIS B 159 20.628 -4.432 -16.656 1.00 0.00 C ATOM 1567 CG HIS B 159 22.057 -4.842 -16.839 1.00 0.00 C ATOM 1568 ND1 HIS B 159 22.565 -5.283 -18.043 1.00 0.00 N ATOM 1569 CD2 HIS B 159 23.089 -4.875 -15.962 1.00 0.00 C ATOM 1570 CE1 HIS B 159 23.846 -5.571 -17.899 1.00 0.00 C ATOM 1571 NE2 HIS B 159 24.189 -5.332 -16.647 1.00 0.00 N ATOM 0 H HIS B 159 18.314 -3.412 -15.476 1.00 0.00 H new ATOM 0 HA HIS B 159 21.139 -3.767 -14.679 1.00 0.00 H new ATOM 0 HB2 HIS B 159 20.013 -5.325 -16.547 1.00 0.00 H new ATOM 0 HB3 HIS B 159 20.288 -3.918 -17.555 1.00 0.00 H new ATOM 0 HD2 HIS B 159 23.054 -4.595 -14.920 1.00 0.00 H new ATOM 0 HE1 HIS B 159 24.502 -5.940 -18.674 1.00 0.00 H new ATOM 0 HE2 HIS B 159 25.120 -5.465 -16.252 1.00 0.00 H new ATOM 1580 N CYS B 160 19.737 -1.194 -15.317 1.00 0.00 N ATOM 1581 CA CYS B 160 19.804 0.231 -15.614 1.00 0.00 C ATOM 1582 C CYS B 160 20.537 0.977 -14.503 1.00 0.00 C ATOM 1583 O CYS B 160 20.067 1.037 -13.367 1.00 0.00 O ATOM 1584 CB CYS B 160 18.391 0.791 -15.785 1.00 0.00 C ATOM 1585 SG CYS B 160 18.336 2.562 -16.206 1.00 0.00 S ATOM 0 H CYS B 160 18.986 -1.455 -14.678 1.00 0.00 H new ATOM 0 HA CYS B 160 20.358 0.370 -16.542 1.00 0.00 H new ATOM 0 HB2 CYS B 160 17.881 0.227 -16.566 1.00 0.00 H new ATOM 0 HB3 CYS B 160 17.835 0.631 -14.861 1.00 0.00 H new ATOM 0 HG CYS B 160 18.361 2.702 -17.498 1.00 0.00 H new ATOM 1590 N GLN B 161 21.698 1.534 -14.835 1.00 0.00 N ATOM 1591 CA GLN B 161 22.502 2.266 -13.861 1.00 0.00 C ATOM 1592 C GLN B 161 22.190 3.762 -13.877 1.00 0.00 C ATOM 1593 O GLN B 161 22.641 4.503 -13.003 1.00 0.00 O ATOM 1594 CB GLN B 161 23.991 2.044 -14.137 1.00 0.00 C ATOM 1595 CG GLN B 161 24.669 1.135 -13.124 1.00 0.00 C ATOM 1596 CD GLN B 161 25.177 -0.153 -13.742 1.00 0.00 C ATOM 1597 OE1 GLN B 161 24.394 -0.996 -14.179 1.00 0.00 O ATOM 1598 NE2 GLN B 161 26.495 -0.312 -13.781 1.00 0.00 N ATOM 0 H GLN B 161 22.103 1.493 -15.770 1.00 0.00 H new ATOM 0 HA GLN B 161 22.251 1.883 -12.872 1.00 0.00 H new ATOM 0 HB2 GLN B 161 24.107 1.615 -15.132 1.00 0.00 H new ATOM 0 HB3 GLN B 161 24.498 3.009 -14.144 1.00 0.00 H new ATOM 0 HG2 GLN B 161 25.503 1.667 -12.665 1.00 0.00 H new ATOM 0 HG3 GLN B 161 23.965 0.898 -12.326 1.00 0.00 H new ATOM 0 HE21 GLN B 161 27.107 0.413 -13.407 1.00 0.00 H new ATOM 0 HE22 GLN B 161 26.895 -1.159 -14.185 1.00 0.00 H new ATOM 1607 N SER B 162 21.423 4.205 -14.868 1.00 0.00 N ATOM 1608 CA SER B 162 21.067 5.615 -14.976 1.00 0.00 C ATOM 1609 C SER B 162 20.091 6.013 -13.875 1.00 0.00 C ATOM 1610 O SER B 162 20.438 6.769 -12.967 1.00 0.00 O ATOM 1611 CB SER B 162 20.457 5.907 -16.348 1.00 0.00 C ATOM 1612 OG SER B 162 21.031 7.068 -16.926 1.00 0.00 O ATOM 0 H SER B 162 21.038 3.612 -15.603 1.00 0.00 H new ATOM 0 HA SER B 162 21.977 6.204 -14.861 1.00 0.00 H new ATOM 0 HB2 SER B 162 20.613 5.054 -17.008 1.00 0.00 H new ATOM 0 HB3 SER B 162 19.380 6.041 -16.249 1.00 0.00 H new ATOM 0 HG SER B 162 20.625 7.232 -17.803 1.00 0.00 H new ATOM 1618 N GLY B 163 18.869 5.501 -13.963 1.00 0.00 N ATOM 1619 CA GLY B 163 17.861 5.814 -12.973 1.00 0.00 C ATOM 1620 C GLY B 163 17.493 7.278 -12.974 1.00 0.00 C ATOM 1621 O GLY B 163 18.348 8.148 -12.818 1.00 0.00 O ATOM 0 H GLY B 163 18.560 4.873 -14.705 1.00 0.00 H new ATOM 0 HA2 GLY B 163 16.969 5.217 -13.164 1.00 0.00 H new ATOM 0 HA3 GLY B 163 18.226 5.534 -11.985 1.00 0.00 H new ATOM 1625 N LYS B 164 16.211 7.540 -13.157 1.00 0.00 N ATOM 1626 CA LYS B 164 15.693 8.903 -13.191 1.00 0.00 C ATOM 1627 C LYS B 164 16.100 9.597 -14.483 1.00 0.00 C ATOM 1628 O LYS B 164 17.192 10.156 -14.585 1.00 0.00 O ATOM 1629 CB LYS B 164 16.191 9.703 -11.987 1.00 0.00 C ATOM 1630 CG LYS B 164 15.425 10.996 -11.759 1.00 0.00 C ATOM 1631 CD LYS B 164 15.707 11.576 -10.382 1.00 0.00 C ATOM 1632 CE LYS B 164 17.131 12.097 -10.277 1.00 0.00 C ATOM 1633 NZ LYS B 164 17.576 12.217 -8.861 1.00 0.00 N ATOM 0 H LYS B 164 15.500 6.820 -13.286 1.00 0.00 H new ATOM 0 HA LYS B 164 14.605 8.852 -13.147 1.00 0.00 H new ATOM 0 HB2 LYS B 164 16.116 9.083 -11.093 1.00 0.00 H new ATOM 0 HB3 LYS B 164 17.247 9.935 -12.127 1.00 0.00 H new ATOM 0 HG2 LYS B 164 15.700 11.722 -12.524 1.00 0.00 H new ATOM 0 HG3 LYS B 164 14.356 10.810 -11.865 1.00 0.00 H new ATOM 0 HD2 LYS B 164 15.006 12.385 -10.177 1.00 0.00 H new ATOM 0 HD3 LYS B 164 15.542 10.811 -9.623 1.00 0.00 H new ATOM 0 HE2 LYS B 164 17.803 11.427 -10.813 1.00 0.00 H new ATOM 0 HE3 LYS B 164 17.198 13.071 -10.762 1.00 0.00 H new ATOM 0 HZ1 LYS B 164 18.552 12.575 -8.833 1.00 0.00 H new ATOM 0 HZ2 LYS B 164 16.950 12.876 -8.355 1.00 0.00 H new ATOM 0 HZ3 LYS B 164 17.537 11.283 -8.405 1.00 0.00 H new ATOM 1647 N SER B 165 15.210 9.541 -15.469 1.00 0.00 N ATOM 1648 CA SER B 165 15.455 10.149 -16.776 1.00 0.00 C ATOM 1649 C SER B 165 16.323 9.240 -17.640 1.00 0.00 C ATOM 1650 O SER B 165 16.989 9.698 -18.570 1.00 0.00 O ATOM 1651 CB SER B 165 16.120 11.523 -16.628 1.00 0.00 C ATOM 1652 OG SER B 165 15.889 12.327 -17.772 1.00 0.00 O ATOM 0 H SER B 165 14.305 9.077 -15.388 1.00 0.00 H new ATOM 0 HA SER B 165 14.490 10.283 -17.266 1.00 0.00 H new ATOM 0 HB2 SER B 165 15.731 12.025 -15.742 1.00 0.00 H new ATOM 0 HB3 SER B 165 17.192 11.397 -16.478 1.00 0.00 H new ATOM 0 HG SER B 165 16.147 11.832 -18.577 1.00 0.00 H new ATOM 1658 N CYS B 166 16.303 7.946 -17.331 1.00 0.00 N ATOM 1659 CA CYS B 166 17.078 6.964 -18.079 1.00 0.00 C ATOM 1660 C CYS B 166 16.652 6.950 -19.543 1.00 0.00 C ATOM 1661 O CYS B 166 15.622 7.520 -19.903 1.00 0.00 O ATOM 1662 CB CYS B 166 16.887 5.574 -17.464 1.00 0.00 C ATOM 1663 SG CYS B 166 18.177 4.366 -17.910 1.00 0.00 S ATOM 0 H CYS B 166 15.756 7.554 -16.565 1.00 0.00 H new ATOM 0 HA CYS B 166 18.132 7.237 -18.028 1.00 0.00 H new ATOM 0 HB2 CYS B 166 16.858 5.672 -16.379 1.00 0.00 H new ATOM 0 HB3 CYS B 166 15.918 5.183 -17.775 1.00 0.00 H new ATOM 0 HG CYS B 166 18.699 3.869 -16.828 1.00 0.00 H new ATOM 1668 N GLN B 167 17.443 6.289 -20.385 1.00 0.00 N ATOM 1669 CA GLN B 167 17.134 6.197 -21.808 1.00 0.00 C ATOM 1670 C GLN B 167 15.724 5.647 -22.031 1.00 0.00 C ATOM 1671 O GLN B 167 15.148 5.806 -23.107 1.00 0.00 O ATOM 1672 CB GLN B 167 18.162 5.313 -22.518 1.00 0.00 C ATOM 1673 CG GLN B 167 18.975 6.051 -23.569 1.00 0.00 C ATOM 1674 CD GLN B 167 19.822 7.160 -22.976 1.00 0.00 C ATOM 1675 OE1 GLN B 167 20.549 6.951 -22.004 1.00 0.00 O ATOM 1676 NE2 GLN B 167 19.733 8.350 -23.560 1.00 0.00 N ATOM 0 H GLN B 167 18.300 5.811 -20.107 1.00 0.00 H new ATOM 0 HA GLN B 167 17.178 7.202 -22.228 1.00 0.00 H new ATOM 0 HB2 GLN B 167 18.840 4.891 -21.776 1.00 0.00 H new ATOM 0 HB3 GLN B 167 17.646 4.477 -22.990 1.00 0.00 H new ATOM 0 HG2 GLN B 167 19.621 5.342 -24.087 1.00 0.00 H new ATOM 0 HG3 GLN B 167 18.301 6.472 -24.315 1.00 0.00 H new ATOM 0 HE21 GLN B 167 19.118 8.479 -24.363 1.00 0.00 H new ATOM 0 HE22 GLN B 167 20.280 9.134 -23.205 1.00 0.00 H new ATOM 1685 N VAL B 168 15.173 5.005 -21.003 1.00 0.00 N ATOM 1686 CA VAL B 168 13.846 4.443 -21.071 1.00 0.00 C ATOM 1687 C VAL B 168 12.936 5.133 -20.067 1.00 0.00 C ATOM 1688 O VAL B 168 13.300 5.341 -18.911 1.00 0.00 O ATOM 1689 CB VAL B 168 13.870 2.937 -20.783 1.00 0.00 C ATOM 1690 CG1 VAL B 168 12.460 2.360 -20.750 1.00 0.00 C ATOM 1691 CG2 VAL B 168 14.728 2.213 -21.810 1.00 0.00 C ATOM 0 H VAL B 168 15.640 4.865 -20.107 1.00 0.00 H new ATOM 0 HA VAL B 168 13.466 4.599 -22.081 1.00 0.00 H new ATOM 0 HB VAL B 168 14.312 2.788 -19.798 1.00 0.00 H new ATOM 0 HG11 VAL B 168 12.509 1.291 -20.544 1.00 0.00 H new ATOM 0 HG12 VAL B 168 11.883 2.854 -19.968 1.00 0.00 H new ATOM 0 HG13 VAL B 168 11.978 2.522 -21.714 1.00 0.00 H new ATOM 0 HG21 VAL B 168 14.734 1.145 -21.591 1.00 0.00 H new ATOM 0 HG22 VAL B 168 14.318 2.377 -22.807 1.00 0.00 H new ATOM 0 HG23 VAL B 168 15.747 2.598 -21.769 1.00 0.00 H new ATOM 1701 N ALA B 169 11.761 5.486 -20.532 1.00 0.00 N ATOM 1702 CA ALA B 169 10.771 6.165 -19.706 1.00 0.00 C ATOM 1703 C ALA B 169 10.217 5.238 -18.631 1.00 0.00 C ATOM 1704 O ALA B 169 10.209 5.575 -17.447 1.00 0.00 O ATOM 1705 CB ALA B 169 9.640 6.694 -20.575 1.00 0.00 C ATOM 0 H ALA B 169 11.458 5.314 -21.491 1.00 0.00 H new ATOM 0 HA ALA B 169 11.263 7.001 -19.208 1.00 0.00 H new ATOM 0 HB1 ALA B 169 8.905 7.200 -19.948 1.00 0.00 H new ATOM 0 HB2 ALA B 169 10.040 7.398 -21.305 1.00 0.00 H new ATOM 0 HB3 ALA B 169 9.163 5.864 -21.096 1.00 0.00 H new ATOM 1711 N HIS B 170 9.746 4.071 -19.055 1.00 0.00 N ATOM 1712 CA HIS B 170 9.179 3.097 -18.140 1.00 0.00 C ATOM 1713 C HIS B 170 10.223 2.570 -17.159 1.00 0.00 C ATOM 1714 O HIS B 170 9.878 1.971 -16.140 1.00 0.00 O ATOM 1715 CB HIS B 170 8.560 1.940 -18.924 1.00 0.00 C ATOM 1716 CG HIS B 170 7.504 2.382 -19.888 1.00 0.00 C ATOM 1717 ND1 HIS B 170 7.455 2.319 -21.241 1.00 0.00 N flip ATOM 1718 CD2 HIS B 170 6.325 2.979 -19.494 1.00 0.00 C flip ATOM 1719 CE1 HIS B 170 6.261 2.874 -21.632 1.00 0.00 C flip ATOM 1720 NE2 HIS B 170 5.598 3.263 -20.559 1.00 0.00 N flip ATOM 0 H HIS B 170 9.747 3.779 -20.032 1.00 0.00 H new ATOM 0 HA HIS B 170 8.403 3.597 -17.560 1.00 0.00 H new ATOM 0 HB2 HIS B 170 9.346 1.417 -19.470 1.00 0.00 H new ATOM 0 HB3 HIS B 170 8.128 1.225 -18.224 1.00 0.00 H new ATOM 0 HD2 HIS B 170 6.040 3.183 -18.472 1.00 0.00 H new ATOM 0 HE1 HIS B 170 5.920 2.976 -22.652 1.00 0.00 H new ATOM 0 HE2 HIS B 170 4.680 3.708 -20.553 1.00 0.00 H new ATOM 1729 N CYS B 171 11.500 2.793 -17.463 1.00 0.00 N ATOM 1730 CA CYS B 171 12.576 2.334 -16.594 1.00 0.00 C ATOM 1731 C CYS B 171 12.659 3.187 -15.342 1.00 0.00 C ATOM 1732 O CYS B 171 12.342 2.737 -14.240 1.00 0.00 O ATOM 1733 CB CYS B 171 13.906 2.393 -17.339 1.00 0.00 C ATOM 1734 SG CYS B 171 15.245 1.441 -16.553 1.00 0.00 S ATOM 0 H CYS B 171 11.811 3.286 -18.300 1.00 0.00 H new ATOM 0 HA CYS B 171 12.365 1.305 -16.303 1.00 0.00 H new ATOM 0 HB2 CYS B 171 13.758 2.022 -18.353 1.00 0.00 H new ATOM 0 HB3 CYS B 171 14.217 3.434 -17.423 1.00 0.00 H new ATOM 0 HG CYS B 171 16.299 2.193 -16.432 1.00 0.00 H new ATOM 1739 N ALA B 172 13.089 4.422 -15.527 1.00 0.00 N ATOM 1740 CA ALA B 172 13.221 5.362 -14.418 1.00 0.00 C ATOM 1741 C ALA B 172 11.885 5.570 -13.714 1.00 0.00 C ATOM 1742 O ALA B 172 11.823 5.640 -12.486 1.00 0.00 O ATOM 1743 CB ALA B 172 13.776 6.691 -14.910 1.00 0.00 C ATOM 0 H ALA B 172 13.354 4.802 -16.435 1.00 0.00 H new ATOM 0 HA ALA B 172 13.920 4.938 -13.697 1.00 0.00 H new ATOM 0 HB1 ALA B 172 13.868 7.380 -14.070 1.00 0.00 H new ATOM 0 HB2 ALA B 172 14.757 6.532 -15.358 1.00 0.00 H new ATOM 0 HB3 ALA B 172 13.101 7.114 -15.654 1.00 0.00 H new ATOM 1749 N SER B 173 10.816 5.666 -14.498 1.00 0.00 N ATOM 1750 CA SER B 173 9.480 5.865 -13.949 1.00 0.00 C ATOM 1751 C SER B 173 9.103 4.727 -13.005 1.00 0.00 C ATOM 1752 O SER B 173 8.767 4.957 -11.843 1.00 0.00 O ATOM 1753 CB SER B 173 8.452 5.971 -15.077 1.00 0.00 C ATOM 1754 OG SER B 173 8.468 7.260 -15.663 1.00 0.00 O ATOM 0 H SER B 173 10.849 5.609 -15.516 1.00 0.00 H new ATOM 0 HA SER B 173 9.483 6.796 -13.382 1.00 0.00 H new ATOM 0 HB2 SER B 173 8.664 5.220 -15.838 1.00 0.00 H new ATOM 0 HB3 SER B 173 7.457 5.758 -14.687 1.00 0.00 H new ATOM 0 HG SER B 173 7.676 7.372 -16.230 1.00 0.00 H new ATOM 1760 N SER B 174 9.164 3.498 -13.511 1.00 0.00 N ATOM 1761 CA SER B 174 8.829 2.323 -12.711 1.00 0.00 C ATOM 1762 C SER B 174 9.683 2.267 -11.448 1.00 0.00 C ATOM 1763 O SER B 174 9.228 1.808 -10.399 1.00 0.00 O ATOM 1764 CB SER B 174 9.027 1.048 -13.532 1.00 0.00 C ATOM 1765 OG SER B 174 9.003 -0.101 -12.703 1.00 0.00 O ATOM 0 H SER B 174 9.442 3.290 -14.470 1.00 0.00 H new ATOM 0 HA SER B 174 7.782 2.398 -12.418 1.00 0.00 H new ATOM 0 HB2 SER B 174 8.244 0.972 -14.287 1.00 0.00 H new ATOM 0 HB3 SER B 174 9.978 1.097 -14.063 1.00 0.00 H new ATOM 0 HG SER B 174 9.287 -0.884 -13.220 1.00 0.00 H new ATOM 1771 N ARG B 175 10.919 2.741 -11.556 1.00 0.00 N ATOM 1772 CA ARG B 175 11.834 2.748 -10.421 1.00 0.00 C ATOM 1773 C ARG B 175 11.283 3.612 -9.293 1.00 0.00 C ATOM 1774 O ARG B 175 11.396 3.262 -8.118 1.00 0.00 O ATOM 1775 CB ARG B 175 13.209 3.265 -10.850 1.00 0.00 C ATOM 1776 CG ARG B 175 14.280 3.099 -9.785 1.00 0.00 C ATOM 1777 CD ARG B 175 15.401 4.110 -9.959 1.00 0.00 C ATOM 1778 NE ARG B 175 15.076 5.400 -9.355 1.00 0.00 N ATOM 1779 CZ ARG B 175 15.109 5.634 -8.044 1.00 0.00 C ATOM 1780 NH1 ARG B 175 15.451 4.670 -7.199 1.00 0.00 N ATOM 1781 NH2 ARG B 175 14.799 6.837 -7.578 1.00 0.00 N ATOM 0 H ARG B 175 11.310 3.125 -12.416 1.00 0.00 H new ATOM 0 HA ARG B 175 11.937 1.725 -10.059 1.00 0.00 H new ATOM 0 HB2 ARG B 175 13.521 2.739 -11.752 1.00 0.00 H new ATOM 0 HB3 ARG B 175 13.127 4.321 -11.109 1.00 0.00 H new ATOM 0 HG2 ARG B 175 13.834 3.216 -8.797 1.00 0.00 H new ATOM 0 HG3 ARG B 175 14.689 2.090 -9.833 1.00 0.00 H new ATOM 0 HD2 ARG B 175 16.314 3.719 -9.509 1.00 0.00 H new ATOM 0 HD3 ARG B 175 15.603 4.248 -11.021 1.00 0.00 H new ATOM 0 HE ARG B 175 14.808 6.166 -9.973 1.00 0.00 H new ATOM 0 HH11 ARG B 175 15.691 3.744 -7.552 1.00 0.00 H new ATOM 0 HH12 ARG B 175 15.474 4.855 -6.196 1.00 0.00 H new ATOM 0 HH21 ARG B 175 14.536 7.582 -8.223 1.00 0.00 H new ATOM 0 HH22 ARG B 175 14.824 7.017 -6.574 1.00 0.00 H new ATOM 1795 N GLN B 176 10.688 4.743 -9.658 1.00 0.00 N ATOM 1796 CA GLN B 176 10.121 5.663 -8.677 1.00 0.00 C ATOM 1797 C GLN B 176 8.842 5.096 -8.065 1.00 0.00 C ATOM 1798 O GLN B 176 8.583 5.273 -6.875 1.00 0.00 O ATOM 1799 CB GLN B 176 9.831 7.017 -9.329 1.00 0.00 C ATOM 1800 CG GLN B 176 10.121 8.202 -8.423 1.00 0.00 C ATOM 1801 CD GLN B 176 11.539 8.717 -8.573 1.00 0.00 C ATOM 1802 OE1 GLN B 176 12.303 8.668 -7.488 1.00 0.00 O flip ATOM 1803 NE2 GLN B 176 11.943 9.153 -9.651 1.00 0.00 N flip ATOM 0 H GLN B 176 10.586 5.045 -10.627 1.00 0.00 H new ATOM 0 HA GLN B 176 10.852 5.797 -7.879 1.00 0.00 H new ATOM 0 HB2 GLN B 176 10.428 7.109 -10.236 1.00 0.00 H new ATOM 0 HB3 GLN B 176 8.784 7.049 -9.631 1.00 0.00 H new ATOM 0 HG2 GLN B 176 9.421 9.006 -8.648 1.00 0.00 H new ATOM 0 HG3 GLN B 176 9.951 7.912 -7.386 1.00 0.00 H new ATOM 0 HE21 GLN B 176 11.321 9.172 -10.459 1.00 0.00 H new ATOM 0 HE22 GLN B 176 12.900 9.495 -9.736 1.00 0.00 H new ATOM 1812 N ILE B 177 8.043 4.420 -8.886 1.00 0.00 N ATOM 1813 CA ILE B 177 6.790 3.833 -8.423 1.00 0.00 C ATOM 1814 C ILE B 177 7.025 2.869 -7.264 1.00 0.00 C ATOM 1815 O ILE B 177 6.621 3.133 -6.130 1.00 0.00 O ATOM 1816 CB ILE B 177 6.064 3.088 -9.563 1.00 0.00 C ATOM 1817 CG1 ILE B 177 5.799 4.038 -10.733 1.00 0.00 C ATOM 1818 CG2 ILE B 177 4.760 2.478 -9.062 1.00 0.00 C ATOM 1819 CD1 ILE B 177 5.086 3.383 -11.897 1.00 0.00 C ATOM 0 H ILE B 177 8.241 4.265 -9.875 1.00 0.00 H new ATOM 0 HA ILE B 177 6.163 4.656 -8.080 1.00 0.00 H new ATOM 0 HB ILE B 177 6.706 2.279 -9.911 1.00 0.00 H new ATOM 0 HG12 ILE B 177 5.202 4.879 -10.379 1.00 0.00 H new ATOM 0 HG13 ILE B 177 6.748 4.445 -11.082 1.00 0.00 H new ATOM 0 HG21 ILE B 177 4.264 1.957 -9.881 1.00 0.00 H new ATOM 0 HG22 ILE B 177 4.973 1.772 -8.259 1.00 0.00 H new ATOM 0 HG23 ILE B 177 4.109 3.268 -8.687 1.00 0.00 H new ATOM 0 HD11 ILE B 177 4.932 4.116 -12.689 1.00 0.00 H new ATOM 0 HD12 ILE B 177 5.691 2.560 -12.277 1.00 0.00 H new ATOM 0 HD13 ILE B 177 4.121 3.001 -11.564 1.00 0.00 H new ATOM 1831 N ILE B 178 7.673 1.748 -7.556 1.00 0.00 N ATOM 1832 CA ILE B 178 7.955 0.740 -6.539 1.00 0.00 C ATOM 1833 C ILE B 178 8.788 1.318 -5.399 1.00 0.00 C ATOM 1834 O ILE B 178 8.526 1.047 -4.227 1.00 0.00 O ATOM 1835 CB ILE B 178 8.690 -0.476 -7.136 1.00 0.00 C ATOM 1836 CG1 ILE B 178 7.961 -0.986 -8.381 1.00 0.00 C ATOM 1837 CG2 ILE B 178 8.809 -1.581 -6.096 1.00 0.00 C ATOM 1838 CD1 ILE B 178 8.612 -2.199 -9.009 1.00 0.00 C ATOM 0 H ILE B 178 8.014 1.513 -8.488 1.00 0.00 H new ATOM 0 HA ILE B 178 6.991 0.414 -6.148 1.00 0.00 H new ATOM 0 HB ILE B 178 9.693 -0.166 -7.430 1.00 0.00 H new ATOM 0 HG12 ILE B 178 6.933 -1.233 -8.115 1.00 0.00 H new ATOM 0 HG13 ILE B 178 7.916 -0.185 -9.119 1.00 0.00 H new ATOM 0 HG21 ILE B 178 9.330 -2.434 -6.530 1.00 0.00 H new ATOM 0 HG22 ILE B 178 9.369 -1.213 -5.236 1.00 0.00 H new ATOM 0 HG23 ILE B 178 7.813 -1.888 -5.776 1.00 0.00 H new ATOM 0 HD11 ILE B 178 8.042 -2.505 -9.886 1.00 0.00 H new ATOM 0 HD12 ILE B 178 9.631 -1.952 -9.307 1.00 0.00 H new ATOM 0 HD13 ILE B 178 8.633 -3.015 -8.287 1.00 0.00 H new ATOM 1850 N SER B 179 9.796 2.114 -5.748 1.00 0.00 N ATOM 1851 CA SER B 179 10.667 2.726 -4.749 1.00 0.00 C ATOM 1852 C SER B 179 9.854 3.473 -3.697 1.00 0.00 C ATOM 1853 O SER B 179 9.887 3.130 -2.514 1.00 0.00 O ATOM 1854 CB SER B 179 11.654 3.685 -5.419 1.00 0.00 C ATOM 1855 OG SER B 179 12.713 2.976 -6.040 1.00 0.00 O ATOM 0 H SER B 179 10.029 2.350 -6.713 1.00 0.00 H new ATOM 0 HA SER B 179 11.222 1.929 -4.255 1.00 0.00 H new ATOM 0 HB2 SER B 179 11.132 4.289 -6.161 1.00 0.00 H new ATOM 0 HB3 SER B 179 12.059 4.373 -4.676 1.00 0.00 H new ATOM 0 HG SER B 179 12.651 3.081 -7.012 1.00 0.00 H new ATOM 1861 N HIS B 180 9.123 4.494 -4.134 1.00 0.00 N ATOM 1862 CA HIS B 180 8.297 5.293 -3.235 1.00 0.00 C ATOM 1863 C HIS B 180 7.494 4.397 -2.289 1.00 0.00 C ATOM 1864 O HIS B 180 7.478 4.610 -1.079 1.00 0.00 O ATOM 1865 CB HIS B 180 7.354 6.187 -4.051 1.00 0.00 C ATOM 1866 CG HIS B 180 5.996 6.382 -3.436 1.00 0.00 C ATOM 1867 ND1 HIS B 180 5.582 7.553 -2.841 1.00 0.00 N ATOM 1868 CD2 HIS B 180 4.950 5.519 -3.335 1.00 0.00 C ATOM 1869 CE1 HIS B 180 4.328 7.372 -2.408 1.00 0.00 C ATOM 1870 NE2 HIS B 180 3.897 6.155 -2.683 1.00 0.00 N ATOM 0 H HIS B 180 9.086 4.788 -5.110 1.00 0.00 H new ATOM 0 HA HIS B 180 8.951 5.921 -2.630 1.00 0.00 H new ATOM 0 HB2 HIS B 180 7.822 7.162 -4.184 1.00 0.00 H new ATOM 0 HB3 HIS B 180 7.231 5.754 -5.044 1.00 0.00 H new ATOM 0 HD1 HIS B 180 6.133 8.406 -2.747 1.00 0.00 H new ATOM 0 HD2 HIS B 180 4.938 4.503 -3.702 1.00 0.00 H new ATOM 0 HE1 HIS B 180 3.744 8.125 -1.899 1.00 0.00 H new ATOM 1878 N TRP B 181 6.823 3.403 -2.863 1.00 0.00 N ATOM 1879 CA TRP B 181 6.003 2.468 -2.094 1.00 0.00 C ATOM 1880 C TRP B 181 6.715 1.989 -0.832 1.00 0.00 C ATOM 1881 O TRP B 181 6.271 2.253 0.286 1.00 0.00 O ATOM 1882 CB TRP B 181 5.651 1.261 -2.960 1.00 0.00 C ATOM 1883 CG TRP B 181 4.733 0.289 -2.284 1.00 0.00 C ATOM 1884 CD1 TRP B 181 5.088 -0.723 -1.438 1.00 0.00 C ATOM 1885 CD2 TRP B 181 3.309 0.236 -2.398 1.00 0.00 C ATOM 1886 NE1 TRP B 181 3.969 -1.402 -1.021 1.00 0.00 N ATOM 1887 CE2 TRP B 181 2.864 -0.832 -1.597 1.00 0.00 C ATOM 1888 CE3 TRP B 181 2.367 0.989 -3.102 1.00 0.00 C ATOM 1889 CZ2 TRP B 181 1.516 -1.164 -1.481 1.00 0.00 C ATOM 1890 CZ3 TRP B 181 1.031 0.658 -2.986 1.00 0.00 C ATOM 1891 CH2 TRP B 181 0.615 -0.409 -2.181 1.00 0.00 C ATOM 0 H TRP B 181 6.831 3.222 -3.867 1.00 0.00 H new ATOM 0 HA TRP B 181 5.099 2.996 -1.792 1.00 0.00 H new ATOM 0 HB2 TRP B 181 5.185 1.609 -3.882 1.00 0.00 H new ATOM 0 HB3 TRP B 181 6.569 0.746 -3.242 1.00 0.00 H new ATOM 0 HD1 TRP B 181 6.100 -0.955 -1.141 1.00 0.00 H new ATOM 0 HE1 TRP B 181 3.962 -2.200 -0.386 1.00 0.00 H new ATOM 0 HE3 TRP B 181 2.677 1.815 -3.725 1.00 0.00 H new ATOM 0 HZ2 TRP B 181 1.194 -1.988 -0.861 1.00 0.00 H new ATOM 0 HZ3 TRP B 181 0.294 1.233 -3.526 1.00 0.00 H new ATOM 0 HH2 TRP B 181 -0.438 -0.641 -2.111 1.00 0.00 H new ATOM 1902 N LYS B 182 7.808 1.266 -1.028 1.00 0.00 N ATOM 1903 CA LYS B 182 8.580 0.719 0.086 1.00 0.00 C ATOM 1904 C LYS B 182 9.107 1.817 1.010 1.00 0.00 C ATOM 1905 O LYS B 182 9.440 1.553 2.165 1.00 0.00 O ATOM 1906 CB LYS B 182 9.744 -0.122 -0.443 1.00 0.00 C ATOM 1907 CG LYS B 182 9.536 -1.618 -0.278 1.00 0.00 C ATOM 1908 CD LYS B 182 10.855 -2.345 -0.076 1.00 0.00 C ATOM 1909 CE LYS B 182 10.645 -3.723 0.529 1.00 0.00 C ATOM 1910 NZ LYS B 182 10.862 -3.722 2.003 1.00 0.00 N ATOM 0 H LYS B 182 8.184 1.042 -1.950 1.00 0.00 H new ATOM 0 HA LYS B 182 7.910 0.089 0.671 1.00 0.00 H new ATOM 0 HB2 LYS B 182 9.893 0.102 -1.499 1.00 0.00 H new ATOM 0 HB3 LYS B 182 10.657 0.169 0.076 1.00 0.00 H new ATOM 0 HG2 LYS B 182 8.883 -1.804 0.575 1.00 0.00 H new ATOM 0 HG3 LYS B 182 9.031 -2.016 -1.159 1.00 0.00 H new ATOM 0 HD2 LYS B 182 11.369 -2.441 -1.032 1.00 0.00 H new ATOM 0 HD3 LYS B 182 11.501 -1.755 0.575 1.00 0.00 H new ATOM 0 HE2 LYS B 182 9.633 -4.065 0.311 1.00 0.00 H new ATOM 0 HE3 LYS B 182 11.328 -4.432 0.062 1.00 0.00 H new ATOM 0 HZ1 LYS B 182 10.709 -4.680 2.377 1.00 0.00 H new ATOM 0 HZ2 LYS B 182 11.836 -3.421 2.210 1.00 0.00 H new ATOM 0 HZ3 LYS B 182 10.193 -3.064 2.452 1.00 0.00 H new ATOM 1924 N ASN B 183 9.188 3.042 0.504 1.00 0.00 N ATOM 1925 CA ASN B 183 9.682 4.161 1.302 1.00 0.00 C ATOM 1926 C ASN B 183 8.534 4.972 1.903 1.00 0.00 C ATOM 1927 O ASN B 183 8.748 5.805 2.784 1.00 0.00 O ATOM 1928 CB ASN B 183 10.568 5.069 0.451 1.00 0.00 C ATOM 1929 CG ASN B 183 11.852 5.456 1.162 1.00 0.00 C ATOM 1930 OD1 ASN B 183 12.987 5.116 0.561 1.00 0.00 O flip ATOM 1931 ND2 ASN B 183 11.823 6.052 2.239 1.00 0.00 N flip ATOM 0 H ASN B 183 8.920 3.286 -0.449 1.00 0.00 H new ATOM 0 HA ASN B 183 10.270 3.747 2.122 1.00 0.00 H new ATOM 0 HB2 ASN B 183 10.812 4.563 -0.483 1.00 0.00 H new ATOM 0 HB3 ASN B 183 10.015 5.971 0.190 1.00 0.00 H new ATOM 0 HD21 ASN B 183 10.928 6.293 2.664 1.00 0.00 H new ATOM 0 HD22 ASN B 183 12.694 6.304 2.706 1.00 0.00 H new ATOM 1938 N CYS B 184 7.320 4.734 1.419 1.00 0.00 N ATOM 1939 CA CYS B 184 6.149 5.450 1.907 1.00 0.00 C ATOM 1940 C CYS B 184 5.569 4.774 3.146 1.00 0.00 C ATOM 1941 O CYS B 184 5.432 3.552 3.193 1.00 0.00 O ATOM 1942 CB CYS B 184 5.086 5.529 0.810 1.00 0.00 C ATOM 1943 SG CYS B 184 3.828 6.819 1.082 1.00 0.00 S ATOM 0 H CYS B 184 7.122 4.050 0.689 1.00 0.00 H new ATOM 0 HA CYS B 184 6.459 6.458 2.181 1.00 0.00 H new ATOM 0 HB2 CYS B 184 5.578 5.713 -0.145 1.00 0.00 H new ATOM 0 HB3 CYS B 184 4.588 4.562 0.731 1.00 0.00 H new ATOM 1948 N THR B 185 5.230 5.580 4.147 1.00 0.00 N ATOM 1949 CA THR B 185 4.663 5.064 5.389 1.00 0.00 C ATOM 1950 C THR B 185 4.341 6.200 6.352 1.00 0.00 C ATOM 1951 O THR B 185 4.972 7.257 6.316 1.00 0.00 O ATOM 1952 CB THR B 185 5.632 4.080 6.049 1.00 0.00 C ATOM 1953 OG1 THR B 185 5.139 3.661 7.308 1.00 0.00 O ATOM 1954 CG2 THR B 185 7.015 4.656 6.265 1.00 0.00 C ATOM 0 H THR B 185 5.338 6.594 4.123 1.00 0.00 H new ATOM 0 HA THR B 185 3.737 4.543 5.146 1.00 0.00 H new ATOM 0 HB THR B 185 5.710 3.242 5.357 1.00 0.00 H new ATOM 0 HG1 THR B 185 5.771 3.031 7.714 1.00 0.00 H new ATOM 0 HG21 THR B 185 7.652 3.907 6.736 1.00 0.00 H new ATOM 0 HG22 THR B 185 7.443 4.944 5.305 1.00 0.00 H new ATOM 0 HG23 THR B 185 6.948 5.532 6.910 1.00 0.00 H new ATOM 1962 N ARG B 186 3.355 5.976 7.216 1.00 0.00 N ATOM 1963 CA ARG B 186 2.949 6.982 8.190 1.00 0.00 C ATOM 1964 C ARG B 186 2.435 8.239 7.495 1.00 0.00 C ATOM 1965 O ARG B 186 3.154 9.230 7.370 1.00 0.00 O ATOM 1966 CB ARG B 186 4.120 7.336 9.108 1.00 0.00 C ATOM 1967 CG ARG B 186 4.816 6.123 9.702 1.00 0.00 C ATOM 1968 CD ARG B 186 4.134 5.662 10.979 1.00 0.00 C ATOM 1969 NE ARG B 186 4.483 6.505 12.120 1.00 0.00 N ATOM 1970 CZ ARG B 186 4.235 6.178 13.387 1.00 0.00 C ATOM 1971 NH1 ARG B 186 3.637 5.030 13.678 1.00 0.00 N ATOM 1972 NH2 ARG B 186 4.587 7.001 14.364 1.00 0.00 N ATOM 0 H ARG B 186 2.823 5.107 7.261 1.00 0.00 H new ATOM 0 HA ARG B 186 2.140 6.564 8.789 1.00 0.00 H new ATOM 0 HB2 ARG B 186 4.847 7.922 8.546 1.00 0.00 H new ATOM 0 HB3 ARG B 186 3.757 7.969 9.918 1.00 0.00 H new ATOM 0 HG2 ARG B 186 4.818 5.311 8.975 1.00 0.00 H new ATOM 0 HG3 ARG B 186 5.858 6.366 9.911 1.00 0.00 H new ATOM 0 HD2 ARG B 186 3.053 5.673 10.837 1.00 0.00 H new ATOM 0 HD3 ARG B 186 4.418 4.631 11.190 1.00 0.00 H new ATOM 0 HE ARG B 186 4.944 7.396 11.935 1.00 0.00 H new ATOM 0 HH11 ARG B 186 3.365 4.393 12.930 1.00 0.00 H new ATOM 0 HH12 ARG B 186 3.450 4.785 14.650 1.00 0.00 H new ATOM 0 HH21 ARG B 186 5.048 7.884 14.146 1.00 0.00 H new ATOM 0 HH22 ARG B 186 4.397 6.751 15.335 1.00 0.00 H new ATOM 1986 N HIS B 187 1.186 8.190 7.043 1.00 0.00 N ATOM 1987 CA HIS B 187 0.576 9.325 6.361 1.00 0.00 C ATOM 1988 C HIS B 187 1.361 9.690 5.104 1.00 0.00 C ATOM 1989 O HIS B 187 2.363 9.054 4.780 1.00 0.00 O ATOM 1990 CB HIS B 187 0.502 10.530 7.299 1.00 0.00 C ATOM 1991 CG HIS B 187 -0.161 10.230 8.607 1.00 0.00 C ATOM 1992 ND1 HIS B 187 -0.858 9.065 8.847 1.00 0.00 N ATOM 1993 CD2 HIS B 187 -0.232 10.950 9.752 1.00 0.00 C ATOM 1994 CE1 HIS B 187 -1.329 9.081 10.081 1.00 0.00 C ATOM 1995 NE2 HIS B 187 -0.962 10.213 10.652 1.00 0.00 N ATOM 0 H HIS B 187 0.577 7.377 7.137 1.00 0.00 H new ATOM 0 HA HIS B 187 -0.434 9.041 6.067 1.00 0.00 H new ATOM 0 HB2 HIS B 187 1.511 10.896 7.488 1.00 0.00 H new ATOM 0 HB3 HIS B 187 -0.040 11.334 6.802 1.00 0.00 H new ATOM 0 HD2 HIS B 187 0.204 11.923 9.925 1.00 0.00 H new ATOM 0 HE1 HIS B 187 -1.915 8.301 10.544 1.00 0.00 H new ATOM 0 HE2 HIS B 187 -1.184 10.495 11.607 1.00 0.00 H new ATOM 2004 N ASP B 188 0.897 10.717 4.401 1.00 0.00 N ATOM 2005 CA ASP B 188 1.555 11.167 3.180 1.00 0.00 C ATOM 2006 C ASP B 188 1.603 10.047 2.144 1.00 0.00 C ATOM 2007 O ASP B 188 2.568 9.928 1.388 1.00 0.00 O ATOM 2008 CB ASP B 188 2.972 11.652 3.489 1.00 0.00 C ATOM 2009 CG ASP B 188 2.999 13.090 3.970 1.00 0.00 C ATOM 2010 OD1 ASP B 188 1.956 13.569 4.465 1.00 0.00 O ATOM 2011 OD2 ASP B 188 4.061 13.736 3.854 1.00 0.00 O ATOM 0 H ASP B 188 0.068 11.254 4.656 1.00 0.00 H new ATOM 0 HA ASP B 188 0.977 11.994 2.769 1.00 0.00 H new ATOM 0 HB2 ASP B 188 3.415 11.009 4.249 1.00 0.00 H new ATOM 0 HB3 ASP B 188 3.588 11.559 2.595 1.00 0.00 H new ATOM 2016 N CYS B 189 0.557 9.229 2.116 1.00 0.00 N ATOM 2017 CA CYS B 189 0.480 8.118 1.175 1.00 0.00 C ATOM 2018 C CYS B 189 -0.859 8.123 0.438 1.00 0.00 C ATOM 2019 O CYS B 189 -1.812 7.471 0.863 1.00 0.00 O ATOM 2020 CB CYS B 189 0.672 6.788 1.907 1.00 0.00 C ATOM 2021 SG CYS B 189 1.964 5.726 1.188 1.00 0.00 S ATOM 0 H CYS B 189 -0.250 9.314 2.734 1.00 0.00 H new ATOM 0 HA CYS B 189 1.278 8.237 0.442 1.00 0.00 H new ATOM 0 HB2 CYS B 189 0.921 6.991 2.949 1.00 0.00 H new ATOM 0 HB3 CYS B 189 -0.273 6.245 1.905 1.00 0.00 H new ATOM 2026 N PRO B 190 -0.947 8.866 -0.677 1.00 0.00 N ATOM 2027 CA PRO B 190 -2.173 8.961 -1.469 1.00 0.00 C ATOM 2028 C PRO B 190 -2.341 7.798 -2.444 1.00 0.00 C ATOM 2029 O PRO B 190 -3.431 7.571 -2.966 1.00 0.00 O ATOM 2030 CB PRO B 190 -1.975 10.268 -2.230 1.00 0.00 C ATOM 2031 CG PRO B 190 -0.502 10.359 -2.437 1.00 0.00 C ATOM 2032 CD PRO B 190 0.141 9.683 -1.250 1.00 0.00 C ATOM 0 HA PRO B 190 -3.068 8.929 -0.847 1.00 0.00 H new ATOM 0 HB2 PRO B 190 -2.510 10.259 -3.180 1.00 0.00 H new ATOM 0 HB3 PRO B 190 -2.349 11.119 -1.661 1.00 0.00 H new ATOM 0 HG2 PRO B 190 -0.210 9.870 -3.367 1.00 0.00 H new ATOM 0 HG3 PRO B 190 -0.184 11.399 -2.510 1.00 0.00 H new ATOM 0 HD2 PRO B 190 0.988 9.066 -1.551 1.00 0.00 H new ATOM 0 HD3 PRO B 190 0.516 10.411 -0.530 1.00 0.00 H new ATOM 2040 N VAL B 191 -1.257 7.069 -2.694 1.00 0.00 N ATOM 2041 CA VAL B 191 -1.294 5.938 -3.614 1.00 0.00 C ATOM 2042 C VAL B 191 -1.473 4.616 -2.874 1.00 0.00 C ATOM 2043 O VAL B 191 -2.383 3.842 -3.174 1.00 0.00 O ATOM 2044 CB VAL B 191 -0.009 5.868 -4.463 1.00 0.00 C ATOM 2045 CG1 VAL B 191 -0.123 4.783 -5.523 1.00 0.00 C ATOM 2046 CG2 VAL B 191 0.282 7.218 -5.101 1.00 0.00 C ATOM 0 H VAL B 191 -0.344 7.241 -2.273 1.00 0.00 H new ATOM 0 HA VAL B 191 -2.152 6.096 -4.268 1.00 0.00 H new ATOM 0 HB VAL B 191 0.823 5.613 -3.807 1.00 0.00 H new ATOM 0 HG11 VAL B 191 0.794 4.751 -6.111 1.00 0.00 H new ATOM 0 HG12 VAL B 191 -0.279 3.818 -5.041 1.00 0.00 H new ATOM 0 HG13 VAL B 191 -0.966 5.002 -6.178 1.00 0.00 H new ATOM 0 HG21 VAL B 191 1.192 7.150 -5.697 1.00 0.00 H new ATOM 0 HG22 VAL B 191 -0.551 7.504 -5.743 1.00 0.00 H new ATOM 0 HG23 VAL B 191 0.414 7.968 -4.321 1.00 0.00 H new ATOM 2056 N CYS B 192 -0.593 4.357 -1.912 1.00 0.00 N ATOM 2057 CA CYS B 192 -0.651 3.122 -1.138 1.00 0.00 C ATOM 2058 C CYS B 192 -1.985 2.984 -0.409 1.00 0.00 C ATOM 2059 O CYS B 192 -2.491 1.876 -0.231 1.00 0.00 O ATOM 2060 CB CYS B 192 0.498 3.069 -0.130 1.00 0.00 C ATOM 2061 SG CYS B 192 2.119 3.538 -0.817 1.00 0.00 S ATOM 0 H CYS B 192 0.167 4.984 -1.650 1.00 0.00 H new ATOM 0 HA CYS B 192 -0.555 2.291 -1.836 1.00 0.00 H new ATOM 0 HB2 CYS B 192 0.265 3.730 0.704 1.00 0.00 H new ATOM 0 HB3 CYS B 192 0.566 2.059 0.273 1.00 0.00 H new ATOM 0 HG CYS B 192 2.552 4.606 -0.216 1.00 0.00 H new ATOM 2066 N LEU B 193 -2.549 4.110 0.017 1.00 0.00 N ATOM 2067 CA LEU B 193 -3.821 4.094 0.731 1.00 0.00 C ATOM 2068 C LEU B 193 -4.928 3.492 -0.137 1.00 0.00 C ATOM 2069 O LEU B 193 -5.456 2.427 0.181 1.00 0.00 O ATOM 2070 CB LEU B 193 -4.200 5.505 1.192 1.00 0.00 C ATOM 2071 CG LEU B 193 -3.961 5.786 2.676 1.00 0.00 C ATOM 2072 CD1 LEU B 193 -2.484 5.656 3.012 1.00 0.00 C ATOM 2073 CD2 LEU B 193 -4.473 7.171 3.043 1.00 0.00 C ATOM 0 H LEU B 193 -2.149 5.038 -0.118 1.00 0.00 H new ATOM 0 HA LEU B 193 -3.706 3.465 1.614 1.00 0.00 H new ATOM 0 HB2 LEU B 193 -3.633 6.227 0.605 1.00 0.00 H new ATOM 0 HB3 LEU B 193 -5.254 5.672 0.971 1.00 0.00 H new ATOM 0 HG LEU B 193 -4.512 5.049 3.260 1.00 0.00 H new ATOM 0 HD11 LEU B 193 -2.333 5.859 4.072 1.00 0.00 H new ATOM 0 HD12 LEU B 193 -2.147 4.645 2.785 1.00 0.00 H new ATOM 0 HD13 LEU B 193 -1.912 6.371 2.420 1.00 0.00 H new ATOM 0 HD21 LEU B 193 -4.295 7.356 4.102 1.00 0.00 H new ATOM 0 HD22 LEU B 193 -3.949 7.921 2.451 1.00 0.00 H new ATOM 0 HD23 LEU B 193 -5.542 7.230 2.839 1.00 0.00 H new ATOM 2085 N PRO B 194 -5.297 4.151 -1.253 1.00 0.00 N ATOM 2086 CA PRO B 194 -6.343 3.640 -2.145 1.00 0.00 C ATOM 2087 C PRO B 194 -6.074 2.203 -2.581 1.00 0.00 C ATOM 2088 O PRO B 194 -7.001 1.447 -2.870 1.00 0.00 O ATOM 2089 CB PRO B 194 -6.281 4.576 -3.353 1.00 0.00 C ATOM 2090 CG PRO B 194 -5.677 5.834 -2.836 1.00 0.00 C ATOM 2091 CD PRO B 194 -4.732 5.426 -1.738 1.00 0.00 C ATOM 0 HA PRO B 194 -7.317 3.621 -1.656 1.00 0.00 H new ATOM 0 HB2 PRO B 194 -5.677 4.148 -4.153 1.00 0.00 H new ATOM 0 HB3 PRO B 194 -7.274 4.755 -3.765 1.00 0.00 H new ATOM 0 HG2 PRO B 194 -5.148 6.366 -3.627 1.00 0.00 H new ATOM 0 HG3 PRO B 194 -6.446 6.508 -2.458 1.00 0.00 H new ATOM 0 HD2 PRO B 194 -3.715 5.299 -2.110 1.00 0.00 H new ATOM 0 HD3 PRO B 194 -4.690 6.174 -0.946 1.00 0.00 H new ATOM 2099 N LEU B 195 -4.796 1.836 -2.634 1.00 0.00 N ATOM 2100 CA LEU B 195 -4.400 0.499 -3.042 1.00 0.00 C ATOM 2101 C LEU B 195 -4.548 -0.500 -1.896 1.00 0.00 C ATOM 2102 O LEU B 195 -4.934 -1.650 -2.111 1.00 0.00 O ATOM 2103 CB LEU B 195 -2.955 0.521 -3.542 1.00 0.00 C ATOM 2104 CG LEU B 195 -2.786 0.300 -5.046 1.00 0.00 C ATOM 2105 CD1 LEU B 195 -1.312 0.288 -5.422 1.00 0.00 C ATOM 2106 CD2 LEU B 195 -3.462 -0.994 -5.477 1.00 0.00 C ATOM 0 H LEU B 195 -4.018 2.451 -2.398 1.00 0.00 H new ATOM 0 HA LEU B 195 -5.059 0.178 -3.848 1.00 0.00 H new ATOM 0 HB2 LEU B 195 -2.510 1.481 -3.279 1.00 0.00 H new ATOM 0 HB3 LEU B 195 -2.392 -0.247 -3.012 1.00 0.00 H new ATOM 0 HG LEU B 195 -3.266 1.126 -5.571 1.00 0.00 H new ATOM 0 HD11 LEU B 195 -1.212 0.130 -6.496 1.00 0.00 H new ATOM 0 HD12 LEU B 195 -0.860 1.242 -5.152 1.00 0.00 H new ATOM 0 HD13 LEU B 195 -0.807 -0.517 -4.888 1.00 0.00 H new ATOM 0 HD21 LEU B 195 -3.331 -1.133 -6.550 1.00 0.00 H new ATOM 0 HD22 LEU B 195 -3.014 -1.833 -4.945 1.00 0.00 H new ATOM 0 HD23 LEU B 195 -4.526 -0.943 -5.245 1.00 0.00 H new ATOM 2118 N LYS B 196 -4.234 -0.061 -0.680 1.00 0.00 N ATOM 2119 CA LYS B 196 -4.331 -0.928 0.490 1.00 0.00 C ATOM 2120 C LYS B 196 -4.960 -0.195 1.674 1.00 0.00 C ATOM 2121 O LYS B 196 -4.409 -0.186 2.775 1.00 0.00 O ATOM 2122 CB LYS B 196 -2.945 -1.452 0.875 1.00 0.00 C ATOM 2123 CG LYS B 196 -2.574 -2.755 0.187 1.00 0.00 C ATOM 2124 CD LYS B 196 -1.348 -3.391 0.824 1.00 0.00 C ATOM 2125 CE LYS B 196 -1.691 -4.065 2.143 1.00 0.00 C ATOM 2126 NZ LYS B 196 -0.715 -3.720 3.214 1.00 0.00 N ATOM 0 H LYS B 196 -3.912 0.886 -0.480 1.00 0.00 H new ATOM 0 HA LYS B 196 -4.975 -1.769 0.232 1.00 0.00 H new ATOM 0 HB2 LYS B 196 -2.199 -0.696 0.629 1.00 0.00 H new ATOM 0 HB3 LYS B 196 -2.908 -1.598 1.955 1.00 0.00 H new ATOM 0 HG2 LYS B 196 -3.414 -3.448 0.240 1.00 0.00 H new ATOM 0 HG3 LYS B 196 -2.381 -2.568 -0.869 1.00 0.00 H new ATOM 0 HD2 LYS B 196 -0.920 -4.124 0.140 1.00 0.00 H new ATOM 0 HD3 LYS B 196 -0.587 -2.629 0.991 1.00 0.00 H new ATOM 0 HE2 LYS B 196 -2.692 -3.766 2.454 1.00 0.00 H new ATOM 0 HE3 LYS B 196 -1.710 -5.146 2.004 1.00 0.00 H new ATOM 0 HZ1 LYS B 196 -0.984 -4.199 4.097 1.00 0.00 H new ATOM 0 HZ2 LYS B 196 0.236 -4.028 2.929 1.00 0.00 H new ATOM 0 HZ3 LYS B 196 -0.715 -2.691 3.365 1.00 0.00 H new