USER MOD reduce.3.24.130724 H: found=0, std=0, add=1037, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1041 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 121 ASN :FLIP amide:sc= -2.14 F(o=-7.2!,f=-1.9) USER MOD Set 1.2: A 149 CYS SG : rot -127:sc= 0.232 USER MOD Set 2.1: A 142 ASN : amide:sc= -7.22! C(o=-12!,f=-13!) USER MOD Set 2.2: A 144 ASN :FLIP amide:sc= -4.92! C(o=-13!,f=-12!) USER MOD Set 3.1: A 105 ASN : amide:sc= -1.01 K(o=-1,f=-4.9!) USER MOD Set 3.2: A 139 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 32 TYR OH : rot 179:sc= 1.29 USER MOD Set 4.2: A 96 HIS : no HD1:sc= -1.94 K(o=-0.64,f=-10!) USER MOD Set 5.1: A 38 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 47 ASN : amide:sc= -0.421 K(o=-0.42,f=-1.3) USER MOD Set 6.1: A 35 THR OG1 : rot 144:sc= 1.86 USER MOD Set 6.2: A 66 TYR OH : rot 60:sc= 0.048 USER MOD Set 7.1: A 9 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -86:sc= 1.53 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -130:sc= -0.835 (180deg=-4.07!) USER MOD Single : A 39 HIS : no HD1:sc= -2.63! C(o=-2.6!,f=-3.4!) USER MOD Single : A 45 CYS SG : rot 34:sc= 0.533 USER MOD Single : A 49 ASN : amide:sc= -1.81! C(o=-1.8!,f=-6!) USER MOD Single : A 50 THR OG1 : rot -129:sc= 1.11 USER MOD Single : A 51 GLN : amide:sc= -0.714 K(o=-0.71,f=-2!) USER MOD Single : A 55 CYS SG : rot 180:sc= -0.479 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.014 K(o=-0.014,f=-2.8!) USER MOD Single : A 61 ASN : amide:sc= -2.37 X(o=-2.4,f=-2.1) USER MOD Single : A 65 ASN : amide:sc= -0.593 K(o=-0.59,f=-1.1!) USER MOD Single : A 80 CYS SG : rot -120:sc= -0.0839 USER MOD Single : A 82 SER OG : rot 151:sc= -1.17! USER MOD Single : A 84 CYS SG : rot 4:sc= -0.0624 USER MOD Single : A 85 SER OG : rot 180:sc= -1.56! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 CYS SG : rot 180:sc= -0.171 USER MOD Single : A 103 ASN : amide:sc= -4.23! C(o=-4.2!,f=-10!) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot -45:sc= 1.03 USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.071 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -159:sc=-0.000805 (180deg=-0.414) USER MOD Single : A 118 MET CE :methyl -128:sc= 0 (180deg=-0.513) USER MOD Single : A 134 ASN : amide:sc= -3.6! C(o=-3.6!,f=-7.1!) USER MOD Single : A 141 SER OG : rot 8:sc= 0.9 USER MOD Single : A 145 LYS NZ :NH3+ -118:sc= -0.543! (180deg=-1.42) USER MOD Single : A 147 THR OG1 : rot -70:sc= 0.394 USER MOD Single : A 158 SER OG : rot -105:sc= 1.26 USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 9 -0.675 11.614 -7.723 1.00 0.00 N ATOM 81 CA SER A 9 -2.077 11.612 -7.323 1.00 0.00 C ATOM 82 C SER A 9 -2.561 10.192 -7.045 1.00 0.00 C ATOM 83 O SER A 9 -3.322 9.957 -6.107 1.00 0.00 O ATOM 84 CB SER A 9 -2.940 12.254 -8.411 1.00 0.00 C ATOM 85 OG SER A 9 -3.069 13.649 -8.202 1.00 0.00 O ATOM 0 HA SER A 9 -2.169 12.194 -6.406 1.00 0.00 H new ATOM 0 HB2 SER A 9 -2.495 12.069 -9.389 1.00 0.00 H new ATOM 0 HB3 SER A 9 -3.927 11.791 -8.417 1.00 0.00 H new ATOM 0 HG SER A 9 -3.623 14.036 -8.911 1.00 0.00 H new ATOM 91 N ALA A 10 -2.113 9.249 -7.868 1.00 0.00 N ATOM 92 CA ALA A 10 -2.498 7.852 -7.710 1.00 0.00 C ATOM 93 C ALA A 10 -1.278 6.972 -7.460 1.00 0.00 C ATOM 94 O ALA A 10 -0.279 7.059 -8.176 1.00 0.00 O ATOM 95 CB ALA A 10 -3.255 7.372 -8.940 1.00 0.00 C ATOM 0 H ALA A 10 -1.483 9.427 -8.650 1.00 0.00 H new ATOM 0 HA ALA A 10 -3.152 7.776 -6.841 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -3.537 6.327 -8.809 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -4.153 7.976 -9.073 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.619 7.469 -9.820 1.00 0.00 H new ATOM 101 N LEU A 11 -1.365 6.125 -6.441 1.00 0.00 N ATOM 102 CA LEU A 11 -0.268 5.228 -6.095 1.00 0.00 C ATOM 103 C LEU A 11 -0.444 3.869 -6.765 1.00 0.00 C ATOM 104 O LEU A 11 -1.542 3.312 -6.781 1.00 0.00 O ATOM 105 CB LEU A 11 -0.183 5.055 -4.578 1.00 0.00 C ATOM 106 CG LEU A 11 0.592 3.832 -4.084 1.00 0.00 C ATOM 107 CD1 LEU A 11 2.081 4.006 -4.340 1.00 0.00 C ATOM 108 CD2 LEU A 11 0.328 3.595 -2.604 1.00 0.00 C ATOM 0 H LEU A 11 -2.184 6.040 -5.839 1.00 0.00 H new ATOM 0 HA LEU A 11 0.660 5.673 -6.456 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.279 5.948 -4.156 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -1.197 5.002 -4.181 1.00 0.00 H new ATOM 0 HG LEU A 11 0.248 2.959 -4.638 1.00 0.00 H new ATOM 0 HD11 LEU A 11 2.617 3.127 -3.982 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.255 4.127 -5.409 1.00 0.00 H new ATOM 0 HD13 LEU A 11 2.440 4.889 -3.812 1.00 0.00 H new ATOM 0 HD21 LEU A 11 0.887 2.721 -2.270 1.00 0.00 H new ATOM 0 HD22 LEU A 11 0.644 4.468 -2.034 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.737 3.426 -2.447 1.00 0.00 H new ATOM 120 N ARG A 12 0.644 3.339 -7.314 1.00 0.00 N ATOM 121 CA ARG A 12 0.610 2.045 -7.983 1.00 0.00 C ATOM 122 C ARG A 12 1.890 1.259 -7.713 1.00 0.00 C ATOM 123 O ARG A 12 2.986 1.821 -7.711 1.00 0.00 O ATOM 124 CB ARG A 12 0.421 2.231 -9.490 1.00 0.00 C ATOM 125 CG ARG A 12 1.682 2.677 -10.211 1.00 0.00 C ATOM 126 CD ARG A 12 1.548 2.518 -11.718 1.00 0.00 C ATOM 127 NE ARG A 12 2.545 3.303 -12.442 1.00 0.00 N ATOM 128 CZ ARG A 12 2.886 3.072 -13.705 1.00 0.00 C ATOM 129 NH1 ARG A 12 2.312 2.085 -14.380 1.00 0.00 N ATOM 130 NH2 ARG A 12 3.801 3.829 -14.295 1.00 0.00 N ATOM 0 H ARG A 12 1.561 3.787 -7.308 1.00 0.00 H new ATOM 0 HA ARG A 12 -0.233 1.480 -7.585 1.00 0.00 H new ATOM 0 HB2 ARG A 12 0.078 1.292 -9.923 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -0.365 2.967 -9.661 1.00 0.00 H new ATOM 0 HG2 ARG A 12 1.890 3.720 -9.971 1.00 0.00 H new ATOM 0 HG3 ARG A 12 2.531 2.093 -9.856 1.00 0.00 H new ATOM 0 HD2 ARG A 12 1.653 1.466 -11.982 1.00 0.00 H new ATOM 0 HD3 ARG A 12 0.549 2.826 -12.028 1.00 0.00 H new ATOM 0 HE ARG A 12 3.004 4.070 -11.951 1.00 0.00 H new ATOM 0 HH11 ARG A 12 1.607 1.501 -13.929 1.00 0.00 H new ATOM 0 HH12 ARG A 12 2.575 1.910 -15.350 1.00 0.00 H new ATOM 0 HH21 ARG A 12 4.244 4.589 -13.779 1.00 0.00 H new ATOM 0 HH22 ARG A 12 4.062 3.651 -15.265 1.00 0.00 H new ATOM 144 N ILE A 13 1.742 -0.042 -7.486 1.00 0.00 N ATOM 145 CA ILE A 13 2.886 -0.904 -7.216 1.00 0.00 C ATOM 146 C ILE A 13 2.773 -2.222 -7.975 1.00 0.00 C ATOM 147 O ILE A 13 1.684 -2.780 -8.113 1.00 0.00 O ATOM 148 CB ILE A 13 3.024 -1.201 -5.711 1.00 0.00 C ATOM 149 CG1 ILE A 13 3.091 0.104 -4.915 1.00 0.00 C ATOM 150 CG2 ILE A 13 4.259 -2.051 -5.450 1.00 0.00 C ATOM 151 CD1 ILE A 13 2.966 -0.092 -3.421 1.00 0.00 C ATOM 0 H ILE A 13 0.842 -0.522 -7.484 1.00 0.00 H new ATOM 0 HA ILE A 13 3.772 -0.368 -7.555 1.00 0.00 H new ATOM 0 HB ILE A 13 2.147 -1.759 -5.384 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.036 0.603 -5.130 1.00 0.00 H new ATOM 0 HG13 ILE A 13 2.296 0.768 -5.254 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.343 -2.253 -4.382 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.173 -2.993 -5.991 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.147 -1.517 -5.789 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.022 0.875 -2.921 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.009 -0.563 -3.195 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.776 -0.730 -3.069 1.00 0.00 H new ATOM 163 N LYS A 14 3.905 -2.716 -8.463 1.00 0.00 N ATOM 164 CA LYS A 14 3.935 -3.971 -9.205 1.00 0.00 C ATOM 165 C LYS A 14 4.813 -5.000 -8.500 1.00 0.00 C ATOM 166 O LYS A 14 6.024 -4.814 -8.375 1.00 0.00 O ATOM 167 CB LYS A 14 4.451 -3.734 -10.627 1.00 0.00 C ATOM 168 CG LYS A 14 4.462 -4.986 -11.486 1.00 0.00 C ATOM 169 CD LYS A 14 5.387 -4.834 -12.682 1.00 0.00 C ATOM 170 CE LYS A 14 5.532 -6.142 -13.445 1.00 0.00 C ATOM 171 NZ LYS A 14 6.598 -6.064 -14.482 1.00 0.00 N ATOM 0 H LYS A 14 4.815 -2.266 -8.358 1.00 0.00 H new ATOM 0 HA LYS A 14 2.918 -4.360 -9.253 1.00 0.00 H new ATOM 0 HB2 LYS A 14 3.830 -2.978 -11.109 1.00 0.00 H new ATOM 0 HB3 LYS A 14 5.462 -3.330 -10.575 1.00 0.00 H new ATOM 0 HG2 LYS A 14 4.780 -5.838 -10.885 1.00 0.00 H new ATOM 0 HG3 LYS A 14 3.451 -5.200 -11.832 1.00 0.00 H new ATOM 0 HD2 LYS A 14 4.998 -4.064 -13.348 1.00 0.00 H new ATOM 0 HD3 LYS A 14 6.367 -4.498 -12.345 1.00 0.00 H new ATOM 0 HE2 LYS A 14 5.763 -6.946 -12.746 1.00 0.00 H new ATOM 0 HE3 LYS A 14 4.583 -6.394 -13.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 6.666 -6.975 -14.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 6.365 -5.314 -15.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 7.509 -5.849 -14.028 1.00 0.00 H new ATOM 185 N ILE A 15 4.196 -6.083 -8.042 1.00 0.00 N ATOM 186 CA ILE A 15 4.922 -7.142 -7.352 1.00 0.00 C ATOM 187 C ILE A 15 5.604 -8.077 -8.344 1.00 0.00 C ATOM 188 O ILE A 15 5.084 -8.335 -9.430 1.00 0.00 O ATOM 189 CB ILE A 15 3.989 -7.966 -6.445 1.00 0.00 C ATOM 190 CG1 ILE A 15 3.321 -7.061 -5.408 1.00 0.00 C ATOM 191 CG2 ILE A 15 4.765 -9.082 -5.761 1.00 0.00 C ATOM 192 CD1 ILE A 15 4.267 -6.571 -4.335 1.00 0.00 C ATOM 0 H ILE A 15 3.194 -6.251 -8.136 1.00 0.00 H new ATOM 0 HA ILE A 15 5.678 -6.656 -6.735 1.00 0.00 H new ATOM 0 HB ILE A 15 3.211 -8.416 -7.062 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.884 -6.201 -5.916 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.501 -7.604 -4.938 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.092 -9.655 -5.123 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.198 -9.739 -6.515 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.562 -8.652 -5.154 1.00 0.00 H new ATOM 0 HD11 ILE A 15 3.725 -5.935 -3.635 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.685 -7.424 -3.801 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.074 -6.000 -4.794 1.00 0.00 H new ATOM 204 N LEU A 16 6.772 -8.584 -7.964 1.00 0.00 N ATOM 205 CA LEU A 16 7.526 -9.494 -8.820 1.00 0.00 C ATOM 206 C LEU A 16 7.331 -10.942 -8.381 1.00 0.00 C ATOM 207 O LEU A 16 6.637 -11.714 -9.044 1.00 0.00 O ATOM 208 CB LEU A 16 9.013 -9.137 -8.791 1.00 0.00 C ATOM 209 CG LEU A 16 9.488 -8.156 -9.864 1.00 0.00 C ATOM 210 CD1 LEU A 16 9.333 -8.764 -11.249 1.00 0.00 C ATOM 211 CD2 LEU A 16 8.722 -6.845 -9.765 1.00 0.00 C ATOM 0 H LEU A 16 7.217 -8.381 -7.069 1.00 0.00 H new ATOM 0 HA LEU A 16 7.152 -9.389 -9.839 1.00 0.00 H new ATOM 0 HB2 LEU A 16 9.246 -8.716 -7.813 1.00 0.00 H new ATOM 0 HB3 LEU A 16 9.589 -10.057 -8.887 1.00 0.00 H new ATOM 0 HG LEU A 16 10.545 -7.949 -9.697 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.676 -8.052 -11.999 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.928 -9.675 -11.315 1.00 0.00 H new ATOM 0 HD13 LEU A 16 8.284 -9.002 -11.427 1.00 0.00 H new ATOM 0 HD21 LEU A 16 9.073 -6.159 -10.536 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.658 -7.034 -9.905 1.00 0.00 H new ATOM 0 HD23 LEU A 16 8.886 -6.401 -8.783 1.00 0.00 H new ATOM 223 N CYS A 17 7.944 -11.302 -7.259 1.00 0.00 N ATOM 224 CA CYS A 17 7.837 -12.658 -6.731 1.00 0.00 C ATOM 225 C CYS A 17 8.433 -12.744 -5.330 1.00 0.00 C ATOM 226 O CYS A 17 8.951 -11.759 -4.803 1.00 0.00 O ATOM 227 CB CYS A 17 8.542 -13.647 -7.660 1.00 0.00 C ATOM 228 SG CYS A 17 10.316 -13.352 -7.843 1.00 0.00 S ATOM 0 H CYS A 17 8.520 -10.675 -6.697 1.00 0.00 H new ATOM 0 HA CYS A 17 6.780 -12.916 -6.673 1.00 0.00 H new ATOM 0 HB2 CYS A 17 8.390 -14.657 -7.280 1.00 0.00 H new ATOM 0 HB3 CYS A 17 8.074 -13.602 -8.643 1.00 0.00 H new ATOM 0 HG CYS A 17 10.823 -14.240 -8.645 1.00 0.00 H new ATOM 234 N ALA A 18 8.355 -13.927 -4.731 1.00 0.00 N ATOM 235 CA ALA A 18 8.887 -14.142 -3.391 1.00 0.00 C ATOM 236 C ALA A 18 9.789 -15.371 -3.349 1.00 0.00 C ATOM 237 O ALA A 18 9.515 -16.378 -4.003 1.00 0.00 O ATOM 238 CB ALA A 18 7.752 -14.284 -2.388 1.00 0.00 C ATOM 0 H ALA A 18 7.928 -14.752 -5.153 1.00 0.00 H new ATOM 0 HA ALA A 18 9.488 -13.273 -3.122 1.00 0.00 H new ATOM 0 HB1 ALA A 18 8.165 -14.444 -1.392 1.00 0.00 H new ATOM 0 HB2 ALA A 18 7.149 -13.376 -2.390 1.00 0.00 H new ATOM 0 HB3 ALA A 18 7.128 -15.134 -2.663 1.00 0.00 H new ATOM 244 N THR A 19 10.866 -15.283 -2.575 1.00 0.00 N ATOM 245 CA THR A 19 11.809 -16.387 -2.449 1.00 0.00 C ATOM 246 C THR A 19 11.873 -16.895 -1.013 1.00 0.00 C ATOM 247 O THR A 19 11.765 -16.117 -0.064 1.00 0.00 O ATOM 248 CB THR A 19 13.223 -15.972 -2.898 1.00 0.00 C ATOM 249 OG1 THR A 19 14.155 -17.022 -2.616 1.00 0.00 O ATOM 250 CG2 THR A 19 13.661 -14.696 -2.196 1.00 0.00 C ATOM 0 H THR A 19 11.107 -14.458 -2.026 1.00 0.00 H new ATOM 0 HA THR A 19 11.449 -17.185 -3.098 1.00 0.00 H new ATOM 0 HB THR A 19 13.199 -15.787 -3.972 1.00 0.00 H new ATOM 0 HG1 THR A 19 14.474 -16.937 -1.693 1.00 0.00 H new ATOM 0 HG21 THR A 19 14.662 -14.423 -2.529 1.00 0.00 H new ATOM 0 HG22 THR A 19 12.966 -13.891 -2.437 1.00 0.00 H new ATOM 0 HG23 THR A 19 13.669 -14.858 -1.118 1.00 0.00 H new ATOM 258 N TYR A 20 12.050 -18.202 -0.860 1.00 0.00 N ATOM 259 CA TYR A 20 12.126 -18.814 0.461 1.00 0.00 C ATOM 260 C TYR A 20 10.784 -18.725 1.181 1.00 0.00 C ATOM 261 O TYR A 20 10.717 -18.341 2.349 1.00 0.00 O ATOM 262 CB TYR A 20 13.213 -18.136 1.298 1.00 0.00 C ATOM 263 CG TYR A 20 14.476 -17.837 0.522 1.00 0.00 C ATOM 264 CD1 TYR A 20 15.096 -18.820 -0.240 1.00 0.00 C ATOM 265 CD2 TYR A 20 15.049 -16.572 0.551 1.00 0.00 C ATOM 266 CE1 TYR A 20 16.250 -18.551 -0.949 1.00 0.00 C ATOM 267 CE2 TYR A 20 16.203 -16.294 -0.156 1.00 0.00 C ATOM 268 CZ TYR A 20 16.800 -17.287 -0.904 1.00 0.00 C ATOM 269 OH TYR A 20 17.949 -17.015 -1.611 1.00 0.00 O ATOM 0 H TYR A 20 12.144 -18.859 -1.635 1.00 0.00 H new ATOM 0 HA TYR A 20 12.379 -19.866 0.332 1.00 0.00 H new ATOM 0 HB2 TYR A 20 12.818 -17.205 1.706 1.00 0.00 H new ATOM 0 HB3 TYR A 20 13.460 -18.776 2.145 1.00 0.00 H new ATOM 0 HD1 TYR A 20 14.668 -19.811 -0.278 1.00 0.00 H new ATOM 0 HD2 TYR A 20 14.584 -15.792 1.136 1.00 0.00 H new ATOM 0 HE1 TYR A 20 16.720 -19.327 -1.536 1.00 0.00 H new ATOM 0 HE2 TYR A 20 16.635 -15.305 -0.123 1.00 0.00 H new ATOM 0 HH TYR A 20 18.204 -16.079 -1.473 1.00 0.00 H new ATOM 279 N VAL A 21 9.716 -19.083 0.475 1.00 0.00 N ATOM 280 CA VAL A 21 8.375 -19.046 1.046 1.00 0.00 C ATOM 281 C VAL A 21 8.166 -20.189 2.034 1.00 0.00 C ATOM 282 O VAL A 21 8.624 -21.308 1.809 1.00 0.00 O ATOM 283 CB VAL A 21 7.296 -19.126 -0.050 1.00 0.00 C ATOM 284 CG1 VAL A 21 5.915 -18.888 0.541 1.00 0.00 C ATOM 285 CG2 VAL A 21 7.590 -18.127 -1.160 1.00 0.00 C ATOM 0 H VAL A 21 9.754 -19.402 -0.493 1.00 0.00 H new ATOM 0 HA VAL A 21 8.281 -18.095 1.570 1.00 0.00 H new ATOM 0 HB VAL A 21 7.313 -20.128 -0.480 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.166 -18.948 -0.249 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.707 -19.645 1.297 1.00 0.00 H new ATOM 0 HG13 VAL A 21 5.881 -17.899 0.999 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.818 -18.197 -1.926 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.602 -17.118 -0.748 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.561 -18.350 -1.602 1.00 0.00 H new ATOM 394 N ILE A 28 -1.159 -27.303 -0.615 1.00 0.00 N ATOM 395 CA ILE A 28 -1.731 -26.003 -0.945 1.00 0.00 C ATOM 396 C ILE A 28 -2.071 -25.913 -2.429 1.00 0.00 C ATOM 397 O ILE A 28 -1.263 -26.277 -3.284 1.00 0.00 O ATOM 398 CB ILE A 28 -0.771 -24.856 -0.579 1.00 0.00 C ATOM 399 CG1 ILE A 28 -0.466 -24.875 0.920 1.00 0.00 C ATOM 400 CG2 ILE A 28 -1.367 -23.517 -0.987 1.00 0.00 C ATOM 401 CD1 ILE A 28 0.890 -24.303 1.268 1.00 0.00 C ATOM 0 HA ILE A 28 -2.644 -25.902 -0.359 1.00 0.00 H new ATOM 0 HB ILE A 28 0.164 -24.997 -1.122 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -1.235 -24.310 1.446 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.522 -25.902 1.281 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -0.677 -22.716 -0.722 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -1.538 -23.508 -2.064 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.314 -23.367 -0.468 1.00 0.00 H new ATOM 0 HD11 ILE A 28 1.038 -24.349 2.347 1.00 0.00 H new ATOM 0 HD12 ILE A 28 1.668 -24.882 0.770 1.00 0.00 H new ATOM 0 HD13 ILE A 28 0.943 -23.265 0.938 1.00 0.00 H new ATOM 413 N ASP A 29 -3.270 -25.425 -2.727 1.00 0.00 N ATOM 414 CA ASP A 29 -3.716 -25.284 -4.108 1.00 0.00 C ATOM 415 C ASP A 29 -3.042 -24.091 -4.778 1.00 0.00 C ATOM 416 O ASP A 29 -2.292 -24.247 -5.742 1.00 0.00 O ATOM 417 CB ASP A 29 -5.236 -25.123 -4.162 1.00 0.00 C ATOM 418 CG ASP A 29 -5.725 -24.698 -5.532 1.00 0.00 C ATOM 419 OD1 ASP A 29 -5.229 -25.249 -6.537 1.00 0.00 O ATOM 420 OD2 ASP A 29 -6.606 -23.815 -5.600 1.00 0.00 O ATOM 0 H ASP A 29 -3.950 -25.120 -2.031 1.00 0.00 H new ATOM 0 HA ASP A 29 -3.435 -26.188 -4.648 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -5.708 -26.066 -3.887 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -5.547 -24.384 -3.423 1.00 0.00 H new ATOM 425 N LYS A 30 -3.314 -22.897 -4.261 1.00 0.00 N ATOM 426 CA LYS A 30 -2.735 -21.676 -4.808 1.00 0.00 C ATOM 427 C LYS A 30 -2.442 -20.669 -3.700 1.00 0.00 C ATOM 428 O LYS A 30 -2.691 -20.937 -2.524 1.00 0.00 O ATOM 429 CB LYS A 30 -3.680 -21.055 -5.839 1.00 0.00 C ATOM 430 CG LYS A 30 -3.793 -21.859 -7.122 1.00 0.00 C ATOM 431 CD LYS A 30 -2.782 -21.398 -8.159 1.00 0.00 C ATOM 432 CE LYS A 30 -2.758 -22.326 -9.364 1.00 0.00 C ATOM 433 NZ LYS A 30 -2.017 -23.587 -9.079 1.00 0.00 N ATOM 0 H LYS A 30 -3.932 -22.749 -3.463 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.796 -21.937 -5.296 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -4.671 -20.952 -5.396 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.333 -20.050 -6.079 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.637 -22.916 -6.905 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.801 -21.762 -7.526 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -3.026 -20.386 -8.482 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -1.790 -21.358 -7.709 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.780 -22.564 -9.659 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.294 -21.815 -10.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.322 -23.760 -9.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -1.524 -23.501 -8.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -2.687 -24.381 -9.037 1.00 0.00 H new ATOM 447 N ILE A 31 -1.914 -19.512 -4.083 1.00 0.00 N ATOM 448 CA ILE A 31 -1.591 -18.465 -3.121 1.00 0.00 C ATOM 449 C ILE A 31 -2.003 -17.093 -3.643 1.00 0.00 C ATOM 450 O ILE A 31 -2.515 -16.968 -4.756 1.00 0.00 O ATOM 451 CB ILE A 31 -0.086 -18.446 -2.794 1.00 0.00 C ATOM 452 CG1 ILE A 31 0.738 -18.387 -4.082 1.00 0.00 C ATOM 453 CG2 ILE A 31 0.292 -19.670 -1.973 1.00 0.00 C ATOM 454 CD1 ILE A 31 2.142 -17.864 -3.878 1.00 0.00 C ATOM 0 H ILE A 31 -1.701 -19.275 -5.052 1.00 0.00 H new ATOM 0 HA ILE A 31 -2.150 -18.688 -2.212 1.00 0.00 H new ATOM 0 HB ILE A 31 0.132 -17.555 -2.205 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.791 -19.385 -4.516 1.00 0.00 H new ATOM 0 HG13 ILE A 31 0.224 -17.752 -4.804 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.358 -19.643 -1.749 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.274 -19.672 -1.042 1.00 0.00 H new ATOM 0 HG23 ILE A 31 0.063 -20.573 -2.539 1.00 0.00 H new ATOM 0 HD11 ILE A 31 2.667 -17.850 -4.833 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.098 -16.853 -3.473 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.674 -18.512 -3.181 1.00 0.00 H new ATOM 466 N TYR A 32 -1.775 -16.065 -2.833 1.00 0.00 N ATOM 467 CA TYR A 32 -2.123 -14.701 -3.213 1.00 0.00 C ATOM 468 C TYR A 32 -1.617 -13.701 -2.177 1.00 0.00 C ATOM 469 O TYR A 32 -1.708 -13.938 -0.972 1.00 0.00 O ATOM 470 CB TYR A 32 -3.638 -14.564 -3.372 1.00 0.00 C ATOM 471 CG TYR A 32 -4.373 -14.404 -2.060 1.00 0.00 C ATOM 472 CD1 TYR A 32 -4.436 -13.172 -1.422 1.00 0.00 C ATOM 473 CD2 TYR A 32 -5.006 -15.486 -1.460 1.00 0.00 C ATOM 474 CE1 TYR A 32 -5.105 -13.022 -0.223 1.00 0.00 C ATOM 475 CE2 TYR A 32 -5.679 -15.345 -0.261 1.00 0.00 C ATOM 476 CZ TYR A 32 -5.725 -14.111 0.353 1.00 0.00 C ATOM 477 OH TYR A 32 -6.394 -13.965 1.547 1.00 0.00 O ATOM 0 H TYR A 32 -1.351 -16.150 -1.909 1.00 0.00 H new ATOM 0 HA TYR A 32 -1.643 -14.483 -4.167 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -3.852 -13.703 -4.006 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -4.022 -15.444 -3.889 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -3.954 -12.316 -1.871 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -4.971 -16.453 -1.939 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -5.142 -12.057 0.261 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -6.166 -16.196 0.192 1.00 0.00 H new ATOM 0 HH TYR A 32 -6.789 -14.823 1.808 1.00 0.00 H new ATOM 487 N VAL A 33 -1.084 -12.582 -2.656 1.00 0.00 N ATOM 488 CA VAL A 33 -0.565 -11.544 -1.773 1.00 0.00 C ATOM 489 C VAL A 33 -1.648 -10.532 -1.418 1.00 0.00 C ATOM 490 O VAL A 33 -2.520 -10.229 -2.232 1.00 0.00 O ATOM 491 CB VAL A 33 0.623 -10.803 -2.416 1.00 0.00 C ATOM 492 CG1 VAL A 33 1.313 -9.912 -1.394 1.00 0.00 C ATOM 493 CG2 VAL A 33 1.605 -11.796 -3.020 1.00 0.00 C ATOM 0 H VAL A 33 -1.000 -12.371 -3.650 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.225 -12.042 -0.865 1.00 0.00 H new ATOM 0 HB VAL A 33 0.243 -10.169 -3.217 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.149 -9.397 -1.866 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.603 -9.178 -1.013 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.682 -10.522 -0.569 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.438 -11.256 -3.470 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.981 -12.457 -2.239 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.101 -12.387 -3.784 1.00 0.00 H new ATOM 503 N ARG A 34 -1.586 -10.012 -0.196 1.00 0.00 N ATOM 504 CA ARG A 34 -2.563 -9.034 0.268 1.00 0.00 C ATOM 505 C ARG A 34 -1.869 -7.792 0.819 1.00 0.00 C ATOM 506 O ARG A 34 -1.080 -7.874 1.761 1.00 0.00 O ATOM 507 CB ARG A 34 -3.461 -9.648 1.343 1.00 0.00 C ATOM 508 CG ARG A 34 -4.402 -8.649 1.995 1.00 0.00 C ATOM 509 CD ARG A 34 -5.461 -9.346 2.835 1.00 0.00 C ATOM 510 NE ARG A 34 -6.711 -8.593 2.874 1.00 0.00 N ATOM 511 CZ ARG A 34 -7.631 -8.744 3.821 1.00 0.00 C ATOM 512 NH1 ARG A 34 -7.440 -9.616 4.802 1.00 0.00 N ATOM 513 NH2 ARG A 34 -8.743 -8.022 3.788 1.00 0.00 N ATOM 0 H ARG A 34 -0.870 -10.252 0.490 1.00 0.00 H new ATOM 0 HA ARG A 34 -3.177 -8.739 -0.583 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -4.049 -10.451 0.898 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -2.835 -10.100 2.112 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -3.830 -7.965 2.623 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -4.885 -8.047 1.225 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -5.649 -10.340 2.429 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -5.087 -9.481 3.850 1.00 0.00 H new ATOM 0 HE ARG A 34 -6.888 -7.914 2.134 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -6.586 -10.172 4.831 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -8.148 -9.730 5.528 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -8.893 -7.350 3.035 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -9.449 -8.139 4.515 1.00 0.00 H new ATOM 527 N THR A 35 -2.167 -6.640 0.225 1.00 0.00 N ATOM 528 CA THR A 35 -1.571 -5.382 0.655 1.00 0.00 C ATOM 529 C THR A 35 -2.633 -4.419 1.173 1.00 0.00 C ATOM 530 O THR A 35 -3.822 -4.736 1.181 1.00 0.00 O ATOM 531 CB THR A 35 -0.797 -4.706 -0.493 1.00 0.00 C ATOM 532 OG1 THR A 35 -1.702 -4.321 -1.534 1.00 0.00 O ATOM 533 CG2 THR A 35 0.263 -5.641 -1.055 1.00 0.00 C ATOM 0 H THR A 35 -2.818 -6.553 -0.555 1.00 0.00 H new ATOM 0 HA THR A 35 -0.877 -5.620 1.461 1.00 0.00 H new ATOM 0 HB THR A 35 -0.303 -3.819 -0.096 1.00 0.00 H new ATOM 0 HG1 THR A 35 -1.403 -3.477 -1.932 1.00 0.00 H new ATOM 0 HG21 THR A 35 0.796 -5.142 -1.864 1.00 0.00 H new ATOM 0 HG22 THR A 35 0.967 -5.908 -0.267 1.00 0.00 H new ATOM 0 HG23 THR A 35 -0.214 -6.544 -1.437 1.00 0.00 H new ATOM 541 N GLY A 36 -2.197 -3.239 1.604 1.00 0.00 N ATOM 542 CA GLY A 36 -3.124 -2.248 2.117 1.00 0.00 C ATOM 543 C GLY A 36 -2.462 -1.276 3.074 1.00 0.00 C ATOM 544 O GLY A 36 -1.646 -1.673 3.907 1.00 0.00 O ATOM 0 H GLY A 36 -1.218 -2.952 1.607 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.557 -1.695 1.284 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.945 -2.752 2.626 1.00 0.00 H new ATOM 548 N ILE A 37 -2.813 0.000 2.956 1.00 0.00 N ATOM 549 CA ILE A 37 -2.246 1.030 3.817 1.00 0.00 C ATOM 550 C ILE A 37 -3.043 1.165 5.110 1.00 0.00 C ATOM 551 O ILE A 37 -4.248 0.909 5.139 1.00 0.00 O ATOM 552 CB ILE A 37 -2.206 2.397 3.109 1.00 0.00 C ATOM 553 CG1 ILE A 37 -1.101 2.414 2.050 1.00 0.00 C ATOM 554 CG2 ILE A 37 -1.993 3.513 4.121 1.00 0.00 C ATOM 555 CD1 ILE A 37 -1.554 1.913 0.696 1.00 0.00 C ATOM 0 H ILE A 37 -3.487 0.345 2.273 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.227 0.720 4.050 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.163 2.561 2.613 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.725 3.432 1.945 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -0.268 1.801 2.395 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.967 4.472 3.604 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.810 3.511 4.842 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.049 3.356 4.642 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.720 1.953 -0.005 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.903 0.884 0.787 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.366 2.540 0.329 1.00 0.00 H new ATOM 567 N TYR A 38 -2.364 1.569 6.178 1.00 0.00 N ATOM 568 CA TYR A 38 -3.009 1.737 7.475 1.00 0.00 C ATOM 569 C TYR A 38 -2.475 2.973 8.192 1.00 0.00 C ATOM 570 O TYR A 38 -1.337 3.390 7.973 1.00 0.00 O ATOM 571 CB TYR A 38 -2.789 0.496 8.342 1.00 0.00 C ATOM 572 CG TYR A 38 -3.771 -0.619 8.063 1.00 0.00 C ATOM 573 CD1 TYR A 38 -3.658 -1.400 6.919 1.00 0.00 C ATOM 574 CD2 TYR A 38 -4.812 -0.891 8.941 1.00 0.00 C ATOM 575 CE1 TYR A 38 -4.553 -2.420 6.659 1.00 0.00 C ATOM 576 CE2 TYR A 38 -5.711 -1.910 8.690 1.00 0.00 C ATOM 577 CZ TYR A 38 -5.578 -2.671 7.548 1.00 0.00 C ATOM 578 OH TYR A 38 -6.472 -3.686 7.294 1.00 0.00 O ATOM 0 H TYR A 38 -1.367 1.786 6.171 1.00 0.00 H new ATOM 0 HA TYR A 38 -4.078 1.870 7.307 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -1.776 0.126 8.181 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -2.862 0.779 9.392 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -2.857 -1.206 6.221 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -4.921 -0.296 9.836 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -4.451 -3.017 5.765 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -6.514 -2.109 9.385 1.00 0.00 H new ATOM 0 HH TYR A 38 -7.131 -3.731 8.018 1.00 0.00 H new ATOM 588 N HIS A 39 -3.305 3.555 9.052 1.00 0.00 N ATOM 589 CA HIS A 39 -2.918 4.743 9.804 1.00 0.00 C ATOM 590 C HIS A 39 -3.142 4.538 11.299 1.00 0.00 C ATOM 591 O HIS A 39 -4.274 4.580 11.779 1.00 0.00 O ATOM 592 CB HIS A 39 -3.709 5.959 9.320 1.00 0.00 C ATOM 593 CG HIS A 39 -3.285 7.244 9.964 1.00 0.00 C ATOM 594 ND1 HIS A 39 -3.754 8.477 9.562 1.00 0.00 N ATOM 595 CD2 HIS A 39 -2.432 7.482 10.987 1.00 0.00 C ATOM 596 CE1 HIS A 39 -3.206 9.419 10.310 1.00 0.00 C ATOM 597 NE2 HIS A 39 -2.400 8.841 11.183 1.00 0.00 N ATOM 0 H HIS A 39 -4.250 3.223 9.245 1.00 0.00 H new ATOM 0 HA HIS A 39 -1.856 4.919 9.635 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -3.596 6.049 8.240 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -4.768 5.795 9.517 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -1.879 6.741 11.546 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -3.386 10.480 10.223 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -1.844 9.325 11.888 1.00 0.00 H new ATOM 606 N GLY A 40 -2.055 4.313 12.031 1.00 0.00 N ATOM 607 CA GLY A 40 -2.155 4.103 13.463 1.00 0.00 C ATOM 608 C GLY A 40 -2.953 2.862 13.813 1.00 0.00 C ATOM 609 O GLY A 40 -3.881 2.918 14.618 1.00 0.00 O ATOM 0 H GLY A 40 -1.107 4.272 11.657 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -1.154 4.018 13.885 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.623 4.974 13.923 1.00 0.00 H new ATOM 613 N GLY A 41 -2.591 1.737 13.203 1.00 0.00 N ATOM 614 CA GLY A 41 -3.292 0.493 13.466 1.00 0.00 C ATOM 615 C GLY A 41 -4.756 0.560 13.083 1.00 0.00 C ATOM 616 O GLY A 41 -5.605 -0.040 13.742 1.00 0.00 O ATOM 0 H GLY A 41 -1.826 1.665 12.532 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.812 -0.315 12.914 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.208 0.249 14.525 1.00 0.00 H new ATOM 620 N GLU A 42 -5.054 1.293 12.014 1.00 0.00 N ATOM 621 CA GLU A 42 -6.428 1.438 11.546 1.00 0.00 C ATOM 622 C GLU A 42 -6.483 1.462 10.022 1.00 0.00 C ATOM 623 O GLU A 42 -5.614 2.021 9.352 1.00 0.00 O ATOM 624 CB GLU A 42 -7.050 2.717 12.111 1.00 0.00 C ATOM 625 CG GLU A 42 -7.153 2.726 13.627 1.00 0.00 C ATOM 626 CD GLU A 42 -8.459 2.138 14.126 1.00 0.00 C ATOM 627 OE1 GLU A 42 -9.528 2.672 13.764 1.00 0.00 O ATOM 628 OE2 GLU A 42 -8.411 1.142 14.878 1.00 0.00 O ATOM 0 H GLU A 42 -4.363 1.795 11.456 1.00 0.00 H new ATOM 0 HA GLU A 42 -6.998 0.579 11.899 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.455 3.572 11.791 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.046 2.845 11.687 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.321 2.162 14.047 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.058 3.750 13.988 1.00 0.00 H new ATOM 635 N PRO A 43 -7.530 0.841 9.458 1.00 0.00 N ATOM 636 CA PRO A 43 -7.725 0.777 8.007 1.00 0.00 C ATOM 637 C PRO A 43 -8.084 2.134 7.410 1.00 0.00 C ATOM 638 O PRO A 43 -8.707 2.968 8.068 1.00 0.00 O ATOM 639 CB PRO A 43 -8.891 -0.202 7.849 1.00 0.00 C ATOM 640 CG PRO A 43 -9.637 -0.114 9.135 1.00 0.00 C ATOM 641 CD PRO A 43 -8.604 0.154 10.195 1.00 0.00 C ATOM 0 HA PRO A 43 -6.818 0.469 7.487 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -9.524 0.070 7.005 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -8.535 -1.216 7.667 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -10.379 0.684 9.102 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -10.174 -1.040 9.339 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -9.003 0.776 10.997 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -8.250 -0.769 10.654 1.00 0.00 H new ATOM 649 N LEU A 44 -7.687 2.348 6.160 1.00 0.00 N ATOM 650 CA LEU A 44 -7.967 3.604 5.473 1.00 0.00 C ATOM 651 C LEU A 44 -8.921 3.384 4.303 1.00 0.00 C ATOM 652 O LEU A 44 -9.785 4.217 4.029 1.00 0.00 O ATOM 653 CB LEU A 44 -6.667 4.237 4.975 1.00 0.00 C ATOM 654 CG LEU A 44 -5.900 5.084 5.990 1.00 0.00 C ATOM 655 CD1 LEU A 44 -5.212 4.196 7.016 1.00 0.00 C ATOM 656 CD2 LEU A 44 -4.885 5.973 5.286 1.00 0.00 C ATOM 0 H LEU A 44 -7.170 1.668 5.602 1.00 0.00 H new ATOM 0 HA LEU A 44 -8.443 4.280 6.183 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -6.009 3.441 4.626 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -6.898 4.861 4.112 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.612 5.723 6.512 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -4.671 4.817 7.730 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -5.959 3.603 7.544 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -4.512 3.531 6.510 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.349 6.569 6.025 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -4.177 5.352 4.737 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.401 6.636 4.592 1.00 0.00 H new ATOM 668 N CYS A 45 -8.758 2.257 3.619 1.00 0.00 N ATOM 669 CA CYS A 45 -9.606 1.927 2.478 1.00 0.00 C ATOM 670 C CYS A 45 -9.552 0.432 2.177 1.00 0.00 C ATOM 671 O CYS A 45 -8.729 -0.294 2.733 1.00 0.00 O ATOM 672 CB CYS A 45 -9.173 2.723 1.247 1.00 0.00 C ATOM 673 SG CYS A 45 -9.987 4.330 1.083 1.00 0.00 S ATOM 0 H CYS A 45 -8.048 1.557 3.834 1.00 0.00 H new ATOM 0 HA CYS A 45 -10.633 2.193 2.730 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -8.095 2.876 1.288 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -9.377 2.131 0.355 1.00 0.00 H new ATOM 0 HG CYS A 45 -10.205 4.828 2.264 1.00 0.00 H new ATOM 679 N ASP A 46 -10.437 -0.019 1.294 1.00 0.00 N ATOM 680 CA ASP A 46 -10.491 -1.427 0.919 1.00 0.00 C ATOM 681 C ASP A 46 -9.108 -1.940 0.530 1.00 0.00 C ATOM 682 O ASP A 46 -8.401 -1.310 -0.255 1.00 0.00 O ATOM 683 CB ASP A 46 -11.469 -1.631 -0.239 1.00 0.00 C ATOM 684 CG ASP A 46 -12.698 -0.751 -0.121 1.00 0.00 C ATOM 685 OD1 ASP A 46 -13.194 -0.575 1.010 1.00 0.00 O ATOM 686 OD2 ASP A 46 -13.163 -0.239 -1.161 1.00 0.00 O ATOM 0 H ASP A 46 -11.126 0.570 0.825 1.00 0.00 H new ATOM 0 HA ASP A 46 -10.839 -1.994 1.782 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.962 -1.418 -1.180 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -11.776 -2.676 -0.272 1.00 0.00 H new ATOM 691 N ASN A 47 -8.730 -3.087 1.085 1.00 0.00 N ATOM 692 CA ASN A 47 -7.431 -3.683 0.797 1.00 0.00 C ATOM 693 C ASN A 47 -7.350 -4.135 -0.658 1.00 0.00 C ATOM 694 O ASN A 47 -8.370 -4.290 -1.329 1.00 0.00 O ATOM 695 CB ASN A 47 -7.174 -4.871 1.727 1.00 0.00 C ATOM 696 CG ASN A 47 -7.282 -4.493 3.191 1.00 0.00 C ATOM 697 OD1 ASN A 47 -8.082 -5.062 3.934 1.00 0.00 O ATOM 698 ND2 ASN A 47 -6.474 -3.528 3.614 1.00 0.00 N ATOM 0 H ASN A 47 -9.305 -3.622 1.736 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.666 -2.925 0.966 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -7.889 -5.664 1.506 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -6.180 -5.274 1.531 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -6.501 -3.231 4.589 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -5.826 -3.084 2.963 1.00 0.00 H new ATOM 705 N VAL A 48 -6.129 -4.345 -1.139 1.00 0.00 N ATOM 706 CA VAL A 48 -5.914 -4.781 -2.514 1.00 0.00 C ATOM 707 C VAL A 48 -5.141 -6.094 -2.560 1.00 0.00 C ATOM 708 O VAL A 48 -4.193 -6.295 -1.801 1.00 0.00 O ATOM 709 CB VAL A 48 -5.149 -3.719 -3.327 1.00 0.00 C ATOM 710 CG1 VAL A 48 -4.985 -4.167 -4.771 1.00 0.00 C ATOM 711 CG2 VAL A 48 -5.864 -2.378 -3.254 1.00 0.00 C ATOM 0 H VAL A 48 -5.274 -4.220 -0.597 1.00 0.00 H new ATOM 0 HA VAL A 48 -6.899 -4.927 -2.957 1.00 0.00 H new ATOM 0 HB VAL A 48 -4.156 -3.600 -2.894 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.442 -3.404 -5.329 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.428 -5.103 -4.800 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -5.967 -4.315 -5.220 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.311 -1.639 -3.833 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.870 -2.479 -3.661 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.924 -2.054 -2.215 1.00 0.00 H new ATOM 721 N ASN A 49 -5.551 -6.985 -3.456 1.00 0.00 N ATOM 722 CA ASN A 49 -4.897 -8.280 -3.602 1.00 0.00 C ATOM 723 C ASN A 49 -4.479 -8.519 -5.050 1.00 0.00 C ATOM 724 O ASN A 49 -5.044 -7.935 -5.975 1.00 0.00 O ATOM 725 CB ASN A 49 -5.828 -9.401 -3.136 1.00 0.00 C ATOM 726 CG ASN A 49 -6.439 -9.118 -1.777 1.00 0.00 C ATOM 727 OD1 ASN A 49 -6.053 -8.168 -1.096 1.00 0.00 O ATOM 728 ND2 ASN A 49 -7.399 -9.943 -1.377 1.00 0.00 N ATOM 0 H ASN A 49 -6.334 -6.834 -4.092 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.002 -8.279 -2.980 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -6.624 -9.536 -3.868 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -5.272 -10.337 -3.093 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -7.848 -9.802 -0.472 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -7.687 -10.718 -1.974 1.00 0.00 H new ATOM 735 N THR A 50 -3.486 -9.383 -5.239 1.00 0.00 N ATOM 736 CA THR A 50 -2.993 -9.700 -6.573 1.00 0.00 C ATOM 737 C THR A 50 -3.690 -10.932 -7.139 1.00 0.00 C ATOM 738 O THR A 50 -4.545 -11.527 -6.485 1.00 0.00 O ATOM 739 CB THR A 50 -1.471 -9.943 -6.566 1.00 0.00 C ATOM 740 OG1 THR A 50 -1.015 -10.231 -7.892 1.00 0.00 O ATOM 741 CG2 THR A 50 -1.111 -11.094 -5.639 1.00 0.00 C ATOM 0 H THR A 50 -3.008 -9.875 -4.485 1.00 0.00 H new ATOM 0 HA THR A 50 -3.214 -8.839 -7.204 1.00 0.00 H new ATOM 0 HB THR A 50 -0.983 -9.039 -6.203 1.00 0.00 H new ATOM 0 HG1 THR A 50 -0.483 -11.054 -7.883 1.00 0.00 H new ATOM 0 HG21 THR A 50 -0.032 -11.247 -5.651 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.433 -10.859 -4.625 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.610 -12.003 -5.976 1.00 0.00 H new ATOM 749 N GLN A 51 -3.317 -11.309 -8.358 1.00 0.00 N ATOM 750 CA GLN A 51 -3.908 -12.471 -9.012 1.00 0.00 C ATOM 751 C GLN A 51 -3.528 -13.756 -8.284 1.00 0.00 C ATOM 752 O GLN A 51 -2.597 -13.773 -7.479 1.00 0.00 O ATOM 753 CB GLN A 51 -3.457 -12.545 -10.472 1.00 0.00 C ATOM 754 CG GLN A 51 -1.957 -12.732 -10.636 1.00 0.00 C ATOM 755 CD GLN A 51 -1.479 -12.404 -12.037 1.00 0.00 C ATOM 756 OE1 GLN A 51 -0.509 -11.667 -12.218 1.00 0.00 O ATOM 757 NE2 GLN A 51 -2.158 -12.952 -13.038 1.00 0.00 N ATOM 0 H GLN A 51 -2.609 -10.827 -8.912 1.00 0.00 H new ATOM 0 HA GLN A 51 -4.992 -12.363 -8.979 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -3.973 -13.370 -10.962 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -3.759 -11.631 -10.984 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.435 -12.097 -9.920 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -1.695 -13.763 -10.399 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.956 -13.557 -12.842 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -1.882 -12.768 -14.003 1.00 0.00 H new ATOM 766 N ARG A 52 -4.256 -14.830 -8.572 1.00 0.00 N ATOM 767 CA ARG A 52 -3.997 -16.120 -7.943 1.00 0.00 C ATOM 768 C ARG A 52 -2.859 -16.850 -8.650 1.00 0.00 C ATOM 769 O ARG A 52 -2.889 -17.039 -9.866 1.00 0.00 O ATOM 770 CB ARG A 52 -5.260 -16.983 -7.960 1.00 0.00 C ATOM 771 CG ARG A 52 -5.407 -17.872 -6.736 1.00 0.00 C ATOM 772 CD ARG A 52 -6.217 -19.120 -7.048 1.00 0.00 C ATOM 773 NE ARG A 52 -6.978 -19.582 -5.890 1.00 0.00 N ATOM 774 CZ ARG A 52 -8.055 -20.355 -5.979 1.00 0.00 C ATOM 775 NH1 ARG A 52 -8.495 -20.751 -7.165 1.00 0.00 N ATOM 776 NH2 ARG A 52 -8.693 -20.735 -4.879 1.00 0.00 N ATOM 0 H ARG A 52 -5.030 -14.833 -9.237 1.00 0.00 H new ATOM 0 HA ARG A 52 -3.703 -15.940 -6.909 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.132 -16.334 -8.034 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -5.251 -17.608 -8.853 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -4.420 -18.159 -6.373 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -5.891 -17.313 -5.935 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.900 -18.912 -7.871 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -5.547 -19.913 -7.382 1.00 0.00 H new ATOM 0 HE ARG A 52 -6.666 -19.296 -4.962 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -8.006 -20.462 -8.013 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -9.322 -21.344 -7.230 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -8.357 -20.434 -3.964 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.520 -21.328 -4.948 1.00 0.00 H new ATOM 790 N VAL A 53 -1.855 -17.258 -7.880 1.00 0.00 N ATOM 791 CA VAL A 53 -0.707 -17.968 -8.432 1.00 0.00 C ATOM 792 C VAL A 53 -0.301 -19.134 -7.538 1.00 0.00 C ATOM 793 O VAL A 53 -0.512 -19.122 -6.325 1.00 0.00 O ATOM 794 CB VAL A 53 0.500 -17.029 -8.612 1.00 0.00 C ATOM 795 CG1 VAL A 53 0.042 -15.651 -9.067 1.00 0.00 C ATOM 796 CG2 VAL A 53 1.299 -16.935 -7.321 1.00 0.00 C ATOM 0 H VAL A 53 -1.813 -17.109 -6.872 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.009 -18.349 -9.407 1.00 0.00 H new ATOM 0 HB VAL A 53 1.148 -17.443 -9.384 1.00 0.00 H new ATOM 0 HG11 VAL A 53 0.909 -15.001 -9.189 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.483 -15.738 -10.018 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.628 -15.225 -8.320 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.148 -16.267 -7.466 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.663 -16.545 -6.527 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.660 -17.925 -7.043 1.00 0.00 H new ATOM 806 N PRO A 54 0.297 -20.168 -8.149 1.00 0.00 N ATOM 807 CA PRO A 54 0.747 -21.362 -7.428 1.00 0.00 C ATOM 808 C PRO A 54 1.943 -21.077 -6.525 1.00 0.00 C ATOM 809 O PRO A 54 2.864 -20.355 -6.909 1.00 0.00 O ATOM 810 CB PRO A 54 1.141 -22.326 -8.549 1.00 0.00 C ATOM 811 CG PRO A 54 1.483 -21.447 -9.702 1.00 0.00 C ATOM 812 CD PRO A 54 0.580 -20.250 -9.592 1.00 0.00 C ATOM 0 HA PRO A 54 -0.024 -21.752 -6.764 1.00 0.00 H new ATOM 0 HB2 PRO A 54 1.989 -22.946 -8.258 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.322 -23.002 -8.796 1.00 0.00 H new ATOM 0 HG2 PRO A 54 2.531 -21.150 -9.669 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.329 -21.966 -10.648 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.065 -19.345 -9.958 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -0.333 -20.380 -10.174 1.00 0.00 H new ATOM 820 N CYS A 55 1.922 -21.648 -5.326 1.00 0.00 N ATOM 821 CA CYS A 55 3.005 -21.455 -4.368 1.00 0.00 C ATOM 822 C CYS A 55 4.359 -21.718 -5.018 1.00 0.00 C ATOM 823 O CYS A 55 5.301 -20.944 -4.849 1.00 0.00 O ATOM 824 CB CYS A 55 2.817 -22.376 -3.162 1.00 0.00 C ATOM 825 SG CYS A 55 2.687 -24.129 -3.585 1.00 0.00 S ATOM 0 H CYS A 55 1.167 -22.248 -4.994 1.00 0.00 H new ATOM 0 HA CYS A 55 2.979 -20.418 -4.032 1.00 0.00 H new ATOM 0 HB2 CYS A 55 3.656 -22.239 -2.480 1.00 0.00 H new ATOM 0 HB3 CYS A 55 1.917 -22.075 -2.625 1.00 0.00 H new ATOM 0 HG CYS A 55 2.532 -24.827 -2.499 1.00 0.00 H new ATOM 831 N SER A 56 4.449 -22.816 -5.762 1.00 0.00 N ATOM 832 CA SER A 56 5.690 -23.185 -6.434 1.00 0.00 C ATOM 833 C SER A 56 6.235 -22.015 -7.248 1.00 0.00 C ATOM 834 O SER A 56 7.446 -21.823 -7.344 1.00 0.00 O ATOM 835 CB SER A 56 5.462 -24.393 -7.345 1.00 0.00 C ATOM 836 OG SER A 56 6.676 -25.079 -7.594 1.00 0.00 O ATOM 0 H SER A 56 3.678 -23.466 -5.915 1.00 0.00 H new ATOM 0 HA SER A 56 6.423 -23.448 -5.672 1.00 0.00 H new ATOM 0 HB2 SER A 56 4.745 -25.072 -6.882 1.00 0.00 H new ATOM 0 HB3 SER A 56 5.026 -24.064 -8.288 1.00 0.00 H new ATOM 0 HG SER A 56 6.504 -25.848 -8.177 1.00 0.00 H new ATOM 842 N ASN A 57 5.330 -21.237 -7.833 1.00 0.00 N ATOM 843 CA ASN A 57 5.719 -20.086 -8.640 1.00 0.00 C ATOM 844 C ASN A 57 4.943 -18.841 -8.222 1.00 0.00 C ATOM 845 O ASN A 57 3.914 -18.497 -8.803 1.00 0.00 O ATOM 846 CB ASN A 57 5.482 -20.374 -10.124 1.00 0.00 C ATOM 847 CG ASN A 57 6.632 -21.134 -10.756 1.00 0.00 C ATOM 848 OD1 ASN A 57 7.164 -22.077 -10.171 1.00 0.00 O ATOM 849 ND2 ASN A 57 7.021 -20.725 -11.958 1.00 0.00 N ATOM 0 H ASN A 57 4.323 -21.382 -7.763 1.00 0.00 H new ATOM 0 HA ASN A 57 6.781 -19.902 -8.477 1.00 0.00 H new ATOM 0 HB2 ASN A 57 4.564 -20.950 -10.237 1.00 0.00 H new ATOM 0 HB3 ASN A 57 5.336 -19.433 -10.655 1.00 0.00 H new ATOM 0 HD21 ASN A 57 7.790 -21.198 -12.433 1.00 0.00 H new ATOM 0 HD22 ASN A 57 6.551 -19.938 -12.406 1.00 0.00 H new ATOM 856 N PRO A 58 5.446 -18.149 -7.189 1.00 0.00 N ATOM 857 CA PRO A 58 4.817 -16.931 -6.671 1.00 0.00 C ATOM 858 C PRO A 58 4.935 -15.760 -7.640 1.00 0.00 C ATOM 859 O PRO A 58 4.521 -14.642 -7.331 1.00 0.00 O ATOM 860 CB PRO A 58 5.602 -16.644 -5.388 1.00 0.00 C ATOM 861 CG PRO A 58 6.930 -17.284 -5.606 1.00 0.00 C ATOM 862 CD PRO A 58 6.669 -18.502 -6.449 1.00 0.00 C ATOM 0 HA PRO A 58 3.747 -17.062 -6.512 1.00 0.00 H new ATOM 0 HB2 PRO A 58 5.702 -15.572 -5.216 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.100 -17.061 -4.515 1.00 0.00 H new ATOM 0 HG2 PRO A 58 7.615 -16.601 -6.109 1.00 0.00 H new ATOM 0 HG3 PRO A 58 7.392 -17.558 -4.657 1.00 0.00 H new ATOM 0 HD2 PRO A 58 7.500 -18.710 -7.123 1.00 0.00 H new ATOM 0 HD3 PRO A 58 6.525 -19.392 -5.836 1.00 0.00 H new ATOM 870 N ARG A 59 5.501 -16.023 -8.813 1.00 0.00 N ATOM 871 CA ARG A 59 5.673 -14.990 -9.828 1.00 0.00 C ATOM 872 C ARG A 59 4.352 -14.282 -10.113 1.00 0.00 C ATOM 873 O ARG A 59 3.443 -14.859 -10.710 1.00 0.00 O ATOM 874 CB ARG A 59 6.226 -15.599 -11.118 1.00 0.00 C ATOM 875 CG ARG A 59 7.745 -15.627 -11.176 1.00 0.00 C ATOM 876 CD ARG A 59 8.249 -15.533 -12.607 1.00 0.00 C ATOM 877 NE ARG A 59 9.636 -15.078 -12.670 1.00 0.00 N ATOM 878 CZ ARG A 59 10.299 -14.899 -13.806 1.00 0.00 C ATOM 879 NH1 ARG A 59 9.707 -15.135 -14.969 1.00 0.00 N ATOM 880 NH2 ARG A 59 11.559 -14.482 -13.782 1.00 0.00 N ATOM 0 H ARG A 59 5.848 -16.943 -9.084 1.00 0.00 H new ATOM 0 HA ARG A 59 6.384 -14.257 -9.447 1.00 0.00 H new ATOM 0 HB2 ARG A 59 5.848 -16.616 -11.221 1.00 0.00 H new ATOM 0 HB3 ARG A 59 5.849 -15.031 -11.969 1.00 0.00 H new ATOM 0 HG2 ARG A 59 8.148 -14.799 -10.592 1.00 0.00 H new ATOM 0 HG3 ARG A 59 8.111 -16.547 -10.720 1.00 0.00 H new ATOM 0 HD2 ARG A 59 8.165 -16.509 -13.086 1.00 0.00 H new ATOM 0 HD3 ARG A 59 7.616 -14.847 -13.170 1.00 0.00 H new ATOM 0 HE ARG A 59 10.121 -14.888 -11.793 1.00 0.00 H new ATOM 0 HH11 ARG A 59 8.739 -15.455 -14.993 1.00 0.00 H new ATOM 0 HH12 ARG A 59 10.220 -14.996 -15.840 1.00 0.00 H new ATOM 0 HH21 ARG A 59 12.019 -14.299 -12.890 1.00 0.00 H new ATOM 0 HH22 ARG A 59 12.068 -14.345 -14.655 1.00 0.00 H new ATOM 894 N TRP A 60 4.253 -13.030 -9.681 1.00 0.00 N ATOM 895 CA TRP A 60 3.042 -12.244 -9.889 1.00 0.00 C ATOM 896 C TRP A 60 3.235 -11.236 -11.017 1.00 0.00 C ATOM 897 O TRP A 60 2.387 -11.109 -11.899 1.00 0.00 O ATOM 898 CB TRP A 60 2.654 -11.517 -8.601 1.00 0.00 C ATOM 899 CG TRP A 60 1.918 -12.387 -7.626 1.00 0.00 C ATOM 900 CD1 TRP A 60 0.630 -12.827 -7.731 1.00 0.00 C ATOM 901 CD2 TRP A 60 2.428 -12.920 -6.399 1.00 0.00 C ATOM 902 NE1 TRP A 60 0.308 -13.601 -6.643 1.00 0.00 N ATOM 903 CE2 TRP A 60 1.395 -13.675 -5.812 1.00 0.00 C ATOM 904 CE3 TRP A 60 3.658 -12.835 -5.741 1.00 0.00 C ATOM 905 CZ2 TRP A 60 1.555 -14.338 -4.598 1.00 0.00 C ATOM 906 CZ3 TRP A 60 3.816 -13.493 -4.536 1.00 0.00 C ATOM 907 CH2 TRP A 60 2.769 -14.237 -3.975 1.00 0.00 C ATOM 0 H TRP A 60 4.996 -12.538 -9.185 1.00 0.00 H new ATOM 0 HA TRP A 60 2.239 -12.926 -10.169 1.00 0.00 H new ATOM 0 HB2 TRP A 60 3.555 -11.131 -8.124 1.00 0.00 H new ATOM 0 HB3 TRP A 60 2.032 -10.657 -8.851 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -0.037 -12.600 -8.549 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -0.594 -14.048 -6.480 1.00 0.00 H new ATOM 0 HE3 TRP A 60 4.471 -12.265 -6.167 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 0.750 -14.912 -4.164 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 4.762 -13.433 -4.018 1.00 0.00 H new ATOM 0 HH2 TRP A 60 2.924 -14.741 -3.032 1.00 0.00 H new ATOM 918 N ASN A 61 4.356 -10.523 -10.983 1.00 0.00 N ATOM 919 CA ASN A 61 4.659 -9.526 -12.003 1.00 0.00 C ATOM 920 C ASN A 61 3.389 -8.821 -12.470 1.00 0.00 C ATOM 921 O ASN A 61 3.180 -8.625 -13.666 1.00 0.00 O ATOM 922 CB ASN A 61 5.358 -10.183 -13.195 1.00 0.00 C ATOM 923 CG ASN A 61 4.446 -11.130 -13.951 1.00 0.00 C ATOM 924 OD1 ASN A 61 3.813 -10.747 -14.935 1.00 0.00 O ATOM 925 ND2 ASN A 61 4.374 -12.374 -13.492 1.00 0.00 N ATOM 0 H ASN A 61 5.069 -10.617 -10.260 1.00 0.00 H new ATOM 0 HA ASN A 61 5.324 -8.783 -11.563 1.00 0.00 H new ATOM 0 HB2 ASN A 61 5.717 -9.409 -13.874 1.00 0.00 H new ATOM 0 HB3 ASN A 61 6.233 -10.729 -12.843 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.776 -13.056 -13.959 1.00 0.00 H new ATOM 0 HD22 ASN A 61 4.917 -12.648 -12.673 1.00 0.00 H new ATOM 932 N GLU A 62 2.544 -8.443 -11.515 1.00 0.00 N ATOM 933 CA GLU A 62 1.294 -7.760 -11.829 1.00 0.00 C ATOM 934 C GLU A 62 1.310 -6.328 -11.302 1.00 0.00 C ATOM 935 O GLU A 62 1.922 -6.040 -10.274 1.00 0.00 O ATOM 936 CB GLU A 62 0.108 -8.521 -11.234 1.00 0.00 C ATOM 937 CG GLU A 62 -1.232 -7.848 -11.478 1.00 0.00 C ATOM 938 CD GLU A 62 -1.499 -7.595 -12.949 1.00 0.00 C ATOM 939 OE1 GLU A 62 -1.335 -8.539 -13.752 1.00 0.00 O ATOM 940 OE2 GLU A 62 -1.870 -6.455 -13.299 1.00 0.00 O ATOM 0 H GLU A 62 2.702 -8.598 -10.519 1.00 0.00 H new ATOM 0 HA GLU A 62 1.189 -7.729 -12.913 1.00 0.00 H new ATOM 0 HB2 GLU A 62 0.083 -9.525 -11.657 1.00 0.00 H new ATOM 0 HB3 GLU A 62 0.260 -8.631 -10.160 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -2.027 -8.472 -11.070 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -1.262 -6.901 -10.939 1.00 0.00 H new ATOM 947 N TRP A 63 0.632 -5.435 -12.015 1.00 0.00 N ATOM 948 CA TRP A 63 0.568 -4.032 -11.620 1.00 0.00 C ATOM 949 C TRP A 63 -0.608 -3.784 -10.682 1.00 0.00 C ATOM 950 O TRP A 63 -1.742 -3.604 -11.127 1.00 0.00 O ATOM 951 CB TRP A 63 0.449 -3.138 -12.855 1.00 0.00 C ATOM 952 CG TRP A 63 1.753 -2.923 -13.561 1.00 0.00 C ATOM 953 CD1 TRP A 63 2.270 -3.678 -14.576 1.00 0.00 C ATOM 954 CD2 TRP A 63 2.706 -1.886 -13.304 1.00 0.00 C ATOM 955 NE1 TRP A 63 3.487 -3.172 -14.964 1.00 0.00 N ATOM 956 CE2 TRP A 63 3.777 -2.073 -14.200 1.00 0.00 C ATOM 957 CE3 TRP A 63 2.759 -0.818 -12.405 1.00 0.00 C ATOM 958 CZ2 TRP A 63 4.885 -1.230 -14.221 1.00 0.00 C ATOM 959 CZ3 TRP A 63 3.860 0.018 -12.427 1.00 0.00 C ATOM 960 CH2 TRP A 63 4.910 -0.192 -13.330 1.00 0.00 C ATOM 0 H TRP A 63 0.119 -5.657 -12.868 1.00 0.00 H new ATOM 0 HA TRP A 63 1.489 -3.787 -11.091 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -0.263 -3.584 -13.550 1.00 0.00 H new ATOM 0 HB3 TRP A 63 0.042 -2.172 -12.557 1.00 0.00 H new ATOM 0 HD1 TRP A 63 1.792 -4.544 -15.009 1.00 0.00 H new ATOM 0 HE1 TRP A 63 4.079 -3.553 -15.702 1.00 0.00 H new ATOM 0 HE3 TRP A 63 1.954 -0.648 -11.705 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 5.696 -1.390 -14.916 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 3.911 0.847 -11.736 1.00 0.00 H new ATOM 0 HH2 TRP A 63 5.756 0.479 -13.323 1.00 0.00 H new ATOM 971 N LEU A 64 -0.331 -3.775 -9.383 1.00 0.00 N ATOM 972 CA LEU A 64 -1.367 -3.548 -8.381 1.00 0.00 C ATOM 973 C LEU A 64 -1.599 -2.056 -8.166 1.00 0.00 C ATOM 974 O LEU A 64 -0.739 -1.355 -7.634 1.00 0.00 O ATOM 975 CB LEU A 64 -0.980 -4.212 -7.059 1.00 0.00 C ATOM 976 CG LEU A 64 -2.136 -4.574 -6.126 1.00 0.00 C ATOM 977 CD1 LEU A 64 -2.982 -5.684 -6.729 1.00 0.00 C ATOM 978 CD2 LEU A 64 -1.609 -4.986 -4.758 1.00 0.00 C ATOM 0 H LEU A 64 0.602 -3.922 -8.999 1.00 0.00 H new ATOM 0 HA LEU A 64 -2.294 -3.992 -8.745 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.421 -5.121 -7.282 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.304 -3.545 -6.525 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.765 -3.693 -6.001 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -3.800 -5.928 -6.051 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.390 -5.353 -7.684 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.364 -6.568 -6.885 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.446 -5.240 -4.107 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -0.957 -5.853 -4.865 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.047 -4.161 -4.321 1.00 0.00 H new ATOM 990 N ASN A 65 -2.767 -1.578 -8.581 1.00 0.00 N ATOM 991 CA ASN A 65 -3.113 -0.169 -8.431 1.00 0.00 C ATOM 992 C ASN A 65 -3.837 0.077 -7.111 1.00 0.00 C ATOM 993 O ASN A 65 -4.764 -0.651 -6.755 1.00 0.00 O ATOM 994 CB ASN A 65 -3.989 0.290 -9.599 1.00 0.00 C ATOM 995 CG ASN A 65 -5.081 -0.709 -9.930 1.00 0.00 C ATOM 996 OD1 ASN A 65 -5.484 -1.508 -9.084 1.00 0.00 O ATOM 997 ND2 ASN A 65 -5.565 -0.669 -11.166 1.00 0.00 N ATOM 0 H ASN A 65 -3.490 -2.145 -9.024 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.188 0.408 -8.430 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -4.441 1.251 -9.355 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.364 0.446 -10.479 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -6.301 -1.317 -11.447 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -5.201 0.010 -11.834 1.00 0.00 H new ATOM 1004 N TYR A 66 -3.408 1.106 -6.390 1.00 0.00 N ATOM 1005 CA TYR A 66 -4.013 1.447 -5.108 1.00 0.00 C ATOM 1006 C TYR A 66 -5.007 2.595 -5.263 1.00 0.00 C ATOM 1007 O TYR A 66 -4.741 3.570 -5.966 1.00 0.00 O ATOM 1008 CB TYR A 66 -2.933 1.826 -4.094 1.00 0.00 C ATOM 1009 CG TYR A 66 -2.134 0.646 -3.590 1.00 0.00 C ATOM 1010 CD1 TYR A 66 -1.122 0.087 -4.360 1.00 0.00 C ATOM 1011 CD2 TYR A 66 -2.392 0.090 -2.343 1.00 0.00 C ATOM 1012 CE1 TYR A 66 -0.391 -0.993 -3.904 1.00 0.00 C ATOM 1013 CE2 TYR A 66 -1.664 -0.989 -1.878 1.00 0.00 C ATOM 1014 CZ TYR A 66 -0.665 -1.527 -2.662 1.00 0.00 C ATOM 1015 OH TYR A 66 0.062 -2.601 -2.203 1.00 0.00 O ATOM 0 H TYR A 66 -2.643 1.719 -6.671 1.00 0.00 H new ATOM 0 HA TYR A 66 -4.550 0.571 -4.745 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -2.254 2.545 -4.551 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.402 2.325 -3.246 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -0.903 0.504 -5.332 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -3.174 0.508 -1.727 1.00 0.00 H new ATOM 0 HE1 TYR A 66 0.391 -1.417 -4.517 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -1.876 -1.409 -0.906 1.00 0.00 H new ATOM 0 HH TYR A 66 1.010 -2.357 -2.154 1.00 0.00 H new ATOM 1025 N ASP A 67 -6.151 2.471 -4.600 1.00 0.00 N ATOM 1026 CA ASP A 67 -7.185 3.498 -4.662 1.00 0.00 C ATOM 1027 C ASP A 67 -6.963 4.558 -3.587 1.00 0.00 C ATOM 1028 O ASP A 67 -7.903 4.976 -2.911 1.00 0.00 O ATOM 1029 CB ASP A 67 -8.569 2.869 -4.497 1.00 0.00 C ATOM 1030 CG ASP A 67 -9.671 3.732 -5.079 1.00 0.00 C ATOM 1031 OD1 ASP A 67 -9.454 4.323 -6.158 1.00 0.00 O ATOM 1032 OD2 ASP A 67 -10.750 3.817 -4.456 1.00 0.00 O ATOM 0 H ASP A 67 -6.386 1.670 -4.014 1.00 0.00 H new ATOM 0 HA ASP A 67 -7.127 3.979 -5.639 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.581 1.893 -4.982 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -8.764 2.701 -3.438 1.00 0.00 H new ATOM 1037 N ILE A 68 -5.714 4.987 -3.436 1.00 0.00 N ATOM 1038 CA ILE A 68 -5.369 5.997 -2.444 1.00 0.00 C ATOM 1039 C ILE A 68 -4.935 7.298 -3.112 1.00 0.00 C ATOM 1040 O ILE A 68 -4.747 7.351 -4.327 1.00 0.00 O ATOM 1041 CB ILE A 68 -4.243 5.511 -1.513 1.00 0.00 C ATOM 1042 CG1 ILE A 68 -2.928 5.392 -2.286 1.00 0.00 C ATOM 1043 CG2 ILE A 68 -4.616 4.177 -0.882 1.00 0.00 C ATOM 1044 CD1 ILE A 68 -2.082 6.645 -2.237 1.00 0.00 C ATOM 0 H ILE A 68 -4.925 4.651 -3.988 1.00 0.00 H new ATOM 0 HA ILE A 68 -6.266 6.177 -1.852 1.00 0.00 H new ATOM 0 HB ILE A 68 -4.109 6.243 -0.716 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -2.353 4.559 -1.882 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -3.148 5.152 -3.326 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.810 3.847 -0.227 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -5.531 4.292 -0.302 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.774 3.436 -1.665 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.166 6.488 -2.806 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -2.639 7.477 -2.668 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -1.831 6.874 -1.201 1.00 0.00 H new ATOM 1056 N TYR A 69 -4.777 8.344 -2.309 1.00 0.00 N ATOM 1057 CA TYR A 69 -4.365 9.645 -2.822 1.00 0.00 C ATOM 1058 C TYR A 69 -3.029 10.071 -2.220 1.00 0.00 C ATOM 1059 O TYR A 69 -2.920 10.283 -1.012 1.00 0.00 O ATOM 1060 CB TYR A 69 -5.433 10.698 -2.518 1.00 0.00 C ATOM 1061 CG TYR A 69 -5.748 11.597 -3.692 1.00 0.00 C ATOM 1062 CD1 TYR A 69 -5.859 11.081 -4.977 1.00 0.00 C ATOM 1063 CD2 TYR A 69 -5.934 12.963 -3.516 1.00 0.00 C ATOM 1064 CE1 TYR A 69 -6.146 11.899 -6.053 1.00 0.00 C ATOM 1065 CE2 TYR A 69 -6.223 13.788 -4.586 1.00 0.00 C ATOM 1066 CZ TYR A 69 -6.328 13.251 -5.852 1.00 0.00 C ATOM 1067 OH TYR A 69 -6.614 14.070 -6.920 1.00 0.00 O ATOM 0 H TYR A 69 -4.928 8.317 -1.301 1.00 0.00 H new ATOM 0 HA TYR A 69 -4.245 9.559 -3.902 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -6.347 10.196 -2.200 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -5.099 11.311 -1.681 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -5.719 10.022 -5.138 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -5.851 13.387 -2.526 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -6.227 11.482 -7.046 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -6.366 14.847 -4.432 1.00 0.00 H new ATOM 0 HH TYR A 69 -6.713 14.993 -6.607 1.00 0.00 H new ATOM 1077 N ILE A 70 -2.017 10.194 -3.071 1.00 0.00 N ATOM 1078 CA ILE A 70 -0.689 10.596 -2.624 1.00 0.00 C ATOM 1079 C ILE A 70 -0.746 11.894 -1.826 1.00 0.00 C ATOM 1080 O ILE A 70 -0.221 11.994 -0.717 1.00 0.00 O ATOM 1081 CB ILE A 70 0.274 10.780 -3.813 1.00 0.00 C ATOM 1082 CG1 ILE A 70 0.803 9.423 -4.283 1.00 0.00 C ATOM 1083 CG2 ILE A 70 1.423 11.699 -3.427 1.00 0.00 C ATOM 1084 CD1 ILE A 70 -0.124 8.712 -5.243 1.00 0.00 C ATOM 0 H ILE A 70 -2.091 10.021 -4.074 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.316 9.796 -1.985 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.272 11.241 -4.636 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.771 9.566 -4.764 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.970 8.787 -3.414 1.00 0.00 H new ATOM 0 HG21 ILE A 70 2.094 11.819 -4.277 1.00 0.00 H new ATOM 0 HG22 ILE A 70 1.028 12.672 -3.136 1.00 0.00 H new ATOM 0 HG23 ILE A 70 1.971 11.265 -2.591 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.315 7.758 -5.534 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.085 8.537 -4.759 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -0.272 9.328 -6.130 1.00 0.00 H new ATOM 1096 N PRO A 71 -1.402 12.913 -2.401 1.00 0.00 N ATOM 1097 CA PRO A 71 -1.547 14.223 -1.759 1.00 0.00 C ATOM 1098 C PRO A 71 -2.476 14.178 -0.552 1.00 0.00 C ATOM 1099 O PRO A 71 -2.739 15.202 0.080 1.00 0.00 O ATOM 1100 CB PRO A 71 -2.148 15.095 -2.865 1.00 0.00 C ATOM 1101 CG PRO A 71 -2.854 14.137 -3.761 1.00 0.00 C ATOM 1102 CD PRO A 71 -2.053 12.865 -3.721 1.00 0.00 C ATOM 0 HA PRO A 71 -0.598 14.595 -1.372 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -2.836 15.835 -2.456 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -1.374 15.642 -3.402 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -3.876 13.966 -3.422 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -2.917 14.527 -4.777 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -2.689 11.986 -3.823 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -1.322 12.825 -4.528 1.00 0.00 H new ATOM 1110 N ASP A 72 -2.970 12.986 -0.235 1.00 0.00 N ATOM 1111 CA ASP A 72 -3.869 12.807 0.898 1.00 0.00 C ATOM 1112 C ASP A 72 -3.316 11.773 1.873 1.00 0.00 C ATOM 1113 O ASP A 72 -3.817 11.625 2.989 1.00 0.00 O ATOM 1114 CB ASP A 72 -5.256 12.379 0.414 1.00 0.00 C ATOM 1115 CG ASP A 72 -6.349 12.736 1.402 1.00 0.00 C ATOM 1116 OD1 ASP A 72 -6.382 12.133 2.494 1.00 0.00 O ATOM 1117 OD2 ASP A 72 -7.174 13.618 1.082 1.00 0.00 O ATOM 0 H ASP A 72 -2.762 12.129 -0.748 1.00 0.00 H new ATOM 0 HA ASP A 72 -3.952 13.762 1.418 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -5.466 12.855 -0.544 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -5.262 11.302 0.243 1.00 0.00 H new ATOM 1122 N LEU A 73 -2.280 11.059 1.446 1.00 0.00 N ATOM 1123 CA LEU A 73 -1.658 10.037 2.281 1.00 0.00 C ATOM 1124 C LEU A 73 -0.869 10.672 3.421 1.00 0.00 C ATOM 1125 O LEU A 73 0.138 11.348 3.211 1.00 0.00 O ATOM 1126 CB LEU A 73 -0.737 9.154 1.438 1.00 0.00 C ATOM 1127 CG LEU A 73 -0.496 7.739 1.967 1.00 0.00 C ATOM 1128 CD1 LEU A 73 0.063 7.786 3.380 1.00 0.00 C ATOM 1129 CD2 LEU A 73 -1.783 6.928 1.926 1.00 0.00 C ATOM 0 H LEU A 73 -1.853 11.169 0.526 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.449 9.422 2.710 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -1.157 9.079 0.435 1.00 0.00 H new ATOM 0 HB3 LEU A 73 0.227 9.654 1.344 1.00 0.00 H new ATOM 0 HG LEU A 73 0.237 7.251 1.325 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.228 6.770 3.740 1.00 0.00 H new ATOM 0 HD12 LEU A 73 1.008 8.329 3.380 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -0.646 8.292 4.035 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -1.593 5.924 2.306 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -2.538 7.413 2.544 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.141 6.865 0.898 1.00 0.00 H new ATOM 1141 N PRO A 74 -1.335 10.449 4.659 1.00 0.00 N ATOM 1142 CA PRO A 74 -0.686 10.988 5.858 1.00 0.00 C ATOM 1143 C PRO A 74 0.658 10.324 6.138 1.00 0.00 C ATOM 1144 O PRO A 74 0.840 9.135 5.878 1.00 0.00 O ATOM 1145 CB PRO A 74 -1.683 10.668 6.975 1.00 0.00 C ATOM 1146 CG PRO A 74 -2.446 9.490 6.476 1.00 0.00 C ATOM 1147 CD PRO A 74 -2.530 9.652 4.984 1.00 0.00 C ATOM 0 HA PRO A 74 -0.463 12.050 5.758 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -1.171 10.441 7.910 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -2.343 11.513 7.171 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -1.943 8.559 6.740 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -3.440 9.452 6.921 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.521 8.689 4.474 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.446 10.162 4.686 1.00 0.00 H new ATOM 1155 N ARG A 75 1.596 11.100 6.671 1.00 0.00 N ATOM 1156 CA ARG A 75 2.924 10.587 6.986 1.00 0.00 C ATOM 1157 C ARG A 75 2.834 9.380 7.915 1.00 0.00 C ATOM 1158 O ARG A 75 3.549 8.394 7.738 1.00 0.00 O ATOM 1159 CB ARG A 75 3.776 11.680 7.632 1.00 0.00 C ATOM 1160 CG ARG A 75 4.588 12.490 6.635 1.00 0.00 C ATOM 1161 CD ARG A 75 3.698 13.400 5.801 1.00 0.00 C ATOM 1162 NE ARG A 75 3.105 14.468 6.601 1.00 0.00 N ATOM 1163 CZ ARG A 75 2.504 15.531 6.078 1.00 0.00 C ATOM 1164 NH1 ARG A 75 2.417 15.666 4.762 1.00 0.00 N ATOM 1165 NH2 ARG A 75 1.989 16.461 6.871 1.00 0.00 N ATOM 0 H ARG A 75 1.461 12.086 6.894 1.00 0.00 H new ATOM 0 HA ARG A 75 3.395 10.272 6.055 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.125 12.354 8.190 1.00 0.00 H new ATOM 0 HB3 ARG A 75 4.454 11.222 8.352 1.00 0.00 H new ATOM 0 HG2 ARG A 75 5.327 13.090 7.167 1.00 0.00 H new ATOM 0 HG3 ARG A 75 5.138 11.816 5.979 1.00 0.00 H new ATOM 0 HD2 ARG A 75 4.283 13.836 4.991 1.00 0.00 H new ATOM 0 HD3 ARG A 75 2.906 12.810 5.340 1.00 0.00 H new ATOM 0 HE ARG A 75 3.155 14.394 7.617 1.00 0.00 H new ATOM 0 HH11 ARG A 75 2.812 14.953 4.149 1.00 0.00 H new ATOM 0 HH12 ARG A 75 1.955 16.483 4.363 1.00 0.00 H new ATOM 0 HH21 ARG A 75 2.054 16.361 7.884 1.00 0.00 H new ATOM 0 HH22 ARG A 75 1.528 17.277 6.468 1.00 0.00 H new ATOM 1179 N ALA A 76 1.952 9.467 8.905 1.00 0.00 N ATOM 1180 CA ALA A 76 1.768 8.382 9.861 1.00 0.00 C ATOM 1181 C ALA A 76 1.425 7.077 9.151 1.00 0.00 C ATOM 1182 O ALA A 76 1.876 6.004 9.552 1.00 0.00 O ATOM 1183 CB ALA A 76 0.681 8.741 10.864 1.00 0.00 C ATOM 0 H ALA A 76 1.354 10.277 9.066 1.00 0.00 H new ATOM 0 HA ALA A 76 2.707 8.238 10.395 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.554 7.922 11.572 1.00 0.00 H new ATOM 0 HB2 ALA A 76 0.967 9.645 11.402 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -0.257 8.914 10.337 1.00 0.00 H new ATOM 1189 N ALA A 77 0.625 7.175 8.095 1.00 0.00 N ATOM 1190 CA ALA A 77 0.223 6.002 7.329 1.00 0.00 C ATOM 1191 C ALA A 77 1.436 5.285 6.747 1.00 0.00 C ATOM 1192 O ALA A 77 2.534 5.840 6.700 1.00 0.00 O ATOM 1193 CB ALA A 77 -0.739 6.401 6.219 1.00 0.00 C ATOM 0 H ALA A 77 0.242 8.055 7.750 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.284 5.313 8.005 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.031 5.515 5.655 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.625 6.863 6.654 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.250 7.111 5.552 1.00 0.00 H new ATOM 1199 N ARG A 78 1.231 4.048 6.307 1.00 0.00 N ATOM 1200 CA ARG A 78 2.309 3.253 5.730 1.00 0.00 C ATOM 1201 C ARG A 78 1.751 2.097 4.905 1.00 0.00 C ATOM 1202 O ARG A 78 0.542 1.862 4.883 1.00 0.00 O ATOM 1203 CB ARG A 78 3.220 2.713 6.834 1.00 0.00 C ATOM 1204 CG ARG A 78 4.049 3.786 7.520 1.00 0.00 C ATOM 1205 CD ARG A 78 5.296 3.200 8.164 1.00 0.00 C ATOM 1206 NE ARG A 78 6.229 4.238 8.594 1.00 0.00 N ATOM 1207 CZ ARG A 78 6.059 4.971 9.689 1.00 0.00 C ATOM 1208 NH1 ARG A 78 4.998 4.780 10.461 1.00 0.00 N ATOM 1209 NH2 ARG A 78 6.953 5.897 10.014 1.00 0.00 N ATOM 0 H ARG A 78 0.328 3.574 6.339 1.00 0.00 H new ATOM 0 HA ARG A 78 2.890 3.899 5.072 1.00 0.00 H new ATOM 0 HB2 ARG A 78 2.610 2.205 7.581 1.00 0.00 H new ATOM 0 HB3 ARG A 78 3.890 1.966 6.408 1.00 0.00 H new ATOM 0 HG2 ARG A 78 4.336 4.546 6.793 1.00 0.00 H new ATOM 0 HG3 ARG A 78 3.446 4.284 8.279 1.00 0.00 H new ATOM 0 HD2 ARG A 78 5.009 2.592 9.022 1.00 0.00 H new ATOM 0 HD3 ARG A 78 5.793 2.537 7.455 1.00 0.00 H new ATOM 0 HE ARG A 78 7.056 4.410 8.023 1.00 0.00 H new ATOM 0 HH11 ARG A 78 4.310 4.069 10.215 1.00 0.00 H new ATOM 0 HH12 ARG A 78 4.870 5.344 11.301 1.00 0.00 H new ATOM 0 HH21 ARG A 78 7.771 6.046 9.423 1.00 0.00 H new ATOM 0 HH22 ARG A 78 6.822 6.459 10.855 1.00 0.00 H new ATOM 1223 N LEU A 79 2.639 1.379 4.227 1.00 0.00 N ATOM 1224 CA LEU A 79 2.236 0.247 3.399 1.00 0.00 C ATOM 1225 C LEU A 79 2.430 -1.069 4.145 1.00 0.00 C ATOM 1226 O LEU A 79 3.487 -1.314 4.728 1.00 0.00 O ATOM 1227 CB LEU A 79 3.039 0.232 2.097 1.00 0.00 C ATOM 1228 CG LEU A 79 2.677 -0.869 1.099 1.00 0.00 C ATOM 1229 CD1 LEU A 79 1.256 -0.682 0.589 1.00 0.00 C ATOM 1230 CD2 LEU A 79 3.663 -0.884 -0.060 1.00 0.00 C ATOM 0 H LEU A 79 3.643 1.560 4.234 1.00 0.00 H new ATOM 0 HA LEU A 79 1.177 0.358 3.165 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.914 1.197 1.605 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.096 0.136 2.346 1.00 0.00 H new ATOM 0 HG LEU A 79 2.734 -1.829 1.611 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.017 -1.475 -0.120 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.560 -0.722 1.427 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.172 0.285 0.094 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.390 -1.674 -0.760 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.638 0.078 -0.571 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.668 -1.068 0.320 1.00 0.00 H new ATOM 1242 N CYS A 80 1.405 -1.913 4.120 1.00 0.00 N ATOM 1243 CA CYS A 80 1.462 -3.206 4.793 1.00 0.00 C ATOM 1244 C CYS A 80 1.084 -4.333 3.838 1.00 0.00 C ATOM 1245 O CYS A 80 0.120 -4.222 3.080 1.00 0.00 O ATOM 1246 CB CYS A 80 0.531 -3.215 6.006 1.00 0.00 C ATOM 1247 SG CYS A 80 0.634 -1.727 7.027 1.00 0.00 S ATOM 0 H CYS A 80 0.524 -1.725 3.641 1.00 0.00 H new ATOM 0 HA CYS A 80 2.486 -3.368 5.130 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -0.496 -3.336 5.661 1.00 0.00 H new ATOM 0 HB3 CYS A 80 0.764 -4.083 6.623 1.00 0.00 H new ATOM 0 HG CYS A 80 0.996 -2.052 8.233 1.00 0.00 H new ATOM 1253 N LEU A 81 1.851 -5.418 3.878 1.00 0.00 N ATOM 1254 CA LEU A 81 1.598 -6.566 3.015 1.00 0.00 C ATOM 1255 C LEU A 81 1.882 -7.873 3.749 1.00 0.00 C ATOM 1256 O LEU A 81 2.663 -7.905 4.700 1.00 0.00 O ATOM 1257 CB LEU A 81 2.457 -6.480 1.752 1.00 0.00 C ATOM 1258 CG LEU A 81 3.919 -6.082 1.962 1.00 0.00 C ATOM 1259 CD1 LEU A 81 4.742 -7.283 2.400 1.00 0.00 C ATOM 1260 CD2 LEU A 81 4.494 -5.474 0.691 1.00 0.00 C ATOM 0 H LEU A 81 2.653 -5.526 4.499 1.00 0.00 H new ATOM 0 HA LEU A 81 0.545 -6.551 2.732 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.433 -7.449 1.253 1.00 0.00 H new ATOM 0 HB3 LEU A 81 1.999 -5.761 1.073 1.00 0.00 H new ATOM 0 HG LEU A 81 3.961 -5.332 2.751 1.00 0.00 H new ATOM 0 HD11 LEU A 81 5.779 -6.980 2.544 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.345 -7.674 3.336 1.00 0.00 H new ATOM 0 HD13 LEU A 81 4.693 -8.057 1.634 1.00 0.00 H new ATOM 0 HD21 LEU A 81 5.535 -5.197 0.859 1.00 0.00 H new ATOM 0 HD22 LEU A 81 4.438 -6.202 -0.118 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.921 -4.587 0.421 1.00 0.00 H new ATOM 1272 N SER A 82 1.244 -8.949 3.299 1.00 0.00 N ATOM 1273 CA SER A 82 1.427 -10.258 3.915 1.00 0.00 C ATOM 1274 C SER A 82 1.003 -11.371 2.961 1.00 0.00 C ATOM 1275 O SER A 82 -0.049 -11.290 2.325 1.00 0.00 O ATOM 1276 CB SER A 82 0.625 -10.351 5.214 1.00 0.00 C ATOM 1277 OG SER A 82 -0.769 -10.353 4.954 1.00 0.00 O ATOM 0 H SER A 82 0.597 -8.940 2.511 1.00 0.00 H new ATOM 0 HA SER A 82 2.486 -10.381 4.141 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.899 -11.259 5.750 1.00 0.00 H new ATOM 0 HB3 SER A 82 0.876 -9.511 5.861 1.00 0.00 H new ATOM 0 HG SER A 82 -1.232 -10.854 5.657 1.00 0.00 H new ATOM 1283 N ILE A 83 1.828 -12.407 2.866 1.00 0.00 N ATOM 1284 CA ILE A 83 1.539 -13.537 1.991 1.00 0.00 C ATOM 1285 C ILE A 83 0.572 -14.512 2.654 1.00 0.00 C ATOM 1286 O ILE A 83 0.655 -14.763 3.857 1.00 0.00 O ATOM 1287 CB ILE A 83 2.824 -14.291 1.602 1.00 0.00 C ATOM 1288 CG1 ILE A 83 3.836 -13.329 0.975 1.00 0.00 C ATOM 1289 CG2 ILE A 83 2.502 -15.427 0.643 1.00 0.00 C ATOM 1290 CD1 ILE A 83 5.236 -13.896 0.889 1.00 0.00 C ATOM 0 H ILE A 83 2.703 -12.488 3.384 1.00 0.00 H new ATOM 0 HA ILE A 83 1.080 -13.129 1.090 1.00 0.00 H new ATOM 0 HB ILE A 83 3.265 -14.716 2.504 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.499 -13.062 -0.027 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.861 -12.409 1.559 1.00 0.00 H new ATOM 0 HG21 ILE A 83 3.421 -15.950 0.377 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.813 -16.123 1.122 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.041 -15.023 -0.258 1.00 0.00 H new ATOM 0 HD11 ILE A 83 5.899 -13.160 0.435 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.593 -14.137 1.890 1.00 0.00 H new ATOM 0 HD13 ILE A 83 5.226 -14.800 0.280 1.00 0.00 H new ATOM 1302 N CYS A 84 -0.343 -15.059 1.862 1.00 0.00 N ATOM 1303 CA CYS A 84 -1.326 -16.008 2.371 1.00 0.00 C ATOM 1304 C CYS A 84 -1.494 -17.183 1.414 1.00 0.00 C ATOM 1305 O CYS A 84 -1.285 -17.050 0.208 1.00 0.00 O ATOM 1306 CB CYS A 84 -2.672 -15.314 2.586 1.00 0.00 C ATOM 1307 SG CYS A 84 -2.650 -14.043 3.872 1.00 0.00 S ATOM 0 H CYS A 84 -0.425 -14.862 0.865 1.00 0.00 H new ATOM 0 HA CYS A 84 -0.965 -16.389 3.326 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -2.989 -14.860 1.647 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -3.419 -16.065 2.845 1.00 0.00 H new ATOM 0 HG CYS A 84 -1.441 -13.910 4.330 1.00 0.00 H new ATOM 1313 N SER A 85 -1.871 -18.335 1.959 1.00 0.00 N ATOM 1314 CA SER A 85 -2.061 -19.536 1.154 1.00 0.00 C ATOM 1315 C SER A 85 -3.536 -19.919 1.090 1.00 0.00 C ATOM 1316 O SER A 85 -4.209 -20.018 2.116 1.00 0.00 O ATOM 1317 CB SER A 85 -1.246 -20.696 1.730 1.00 0.00 C ATOM 1318 OG SER A 85 0.104 -20.319 1.935 1.00 0.00 O ATOM 0 H SER A 85 -2.051 -18.462 2.955 1.00 0.00 H new ATOM 0 HA SER A 85 -1.714 -19.324 0.143 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.684 -21.018 2.675 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.290 -21.548 1.051 1.00 0.00 H new ATOM 0 HG SER A 85 0.603 -21.077 2.305 1.00 0.00 H new ATOM 1324 N VAL A 86 -4.033 -20.134 -0.124 1.00 0.00 N ATOM 1325 CA VAL A 86 -5.428 -20.506 -0.325 1.00 0.00 C ATOM 1326 C VAL A 86 -5.547 -21.939 -0.833 1.00 0.00 C ATOM 1327 O VAL A 86 -4.879 -22.327 -1.792 1.00 0.00 O ATOM 1328 CB VAL A 86 -6.125 -19.561 -1.321 1.00 0.00 C ATOM 1329 CG1 VAL A 86 -5.440 -19.617 -2.678 1.00 0.00 C ATOM 1330 CG2 VAL A 86 -7.600 -19.910 -1.444 1.00 0.00 C ATOM 0 H VAL A 86 -3.489 -20.057 -0.984 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.919 -20.425 0.645 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.047 -18.542 -0.943 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -5.946 -18.943 -3.369 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.398 -19.314 -2.573 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -5.484 -20.635 -3.066 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.077 -19.232 -2.152 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.703 -20.936 -1.798 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -8.079 -19.813 -0.470 1.00 0.00 H new ATOM 1340 N LYS A 87 -6.402 -22.722 -0.185 1.00 0.00 N ATOM 1341 CA LYS A 87 -6.611 -24.112 -0.571 1.00 0.00 C ATOM 1342 C LYS A 87 -8.091 -24.477 -0.511 1.00 0.00 C ATOM 1343 O LYS A 87 -8.797 -24.096 0.421 1.00 0.00 O ATOM 1344 CB LYS A 87 -5.808 -25.043 0.341 1.00 0.00 C ATOM 1345 CG LYS A 87 -6.221 -26.501 0.238 1.00 0.00 C ATOM 1346 CD LYS A 87 -5.649 -27.156 -1.008 1.00 0.00 C ATOM 1347 CE LYS A 87 -6.417 -28.414 -1.380 1.00 0.00 C ATOM 1348 NZ LYS A 87 -6.176 -29.518 -0.410 1.00 0.00 N ATOM 0 H LYS A 87 -6.962 -22.417 0.611 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.266 -24.233 -1.598 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -4.750 -24.956 0.094 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.923 -24.714 1.374 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -5.881 -27.040 1.122 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -7.309 -26.572 0.221 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -5.681 -26.450 -1.838 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -4.601 -27.405 -0.841 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -7.483 -28.191 -1.418 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.123 -28.737 -2.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -6.717 -30.358 -0.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -5.162 -29.749 -0.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -6.480 -29.219 0.539 1.00 0.00 H new ATOM 1454 N GLU A 94 -12.607 -22.215 0.339 1.00 0.00 N ATOM 1455 CA GLU A 94 -11.156 -22.301 0.459 1.00 0.00 C ATOM 1456 C GLU A 94 -10.697 -21.843 1.841 1.00 0.00 C ATOM 1457 O GLU A 94 -11.467 -21.252 2.597 1.00 0.00 O ATOM 1458 CB GLU A 94 -10.481 -21.454 -0.621 1.00 0.00 C ATOM 1459 CG GLU A 94 -10.948 -21.779 -2.030 1.00 0.00 C ATOM 1460 CD GLU A 94 -12.289 -21.152 -2.360 1.00 0.00 C ATOM 1461 OE1 GLU A 94 -12.471 -19.951 -2.069 1.00 0.00 O ATOM 1462 OE2 GLU A 94 -13.157 -21.863 -2.909 1.00 0.00 O ATOM 0 HA GLU A 94 -10.867 -23.344 0.325 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -10.673 -20.401 -0.418 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.402 -21.598 -0.563 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -10.203 -21.431 -2.745 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -11.019 -22.861 -2.145 1.00 0.00 H new ATOM 1469 N GLU A 95 -9.438 -22.122 2.162 1.00 0.00 N ATOM 1470 CA GLU A 95 -8.877 -21.740 3.452 1.00 0.00 C ATOM 1471 C GLU A 95 -7.668 -20.826 3.271 1.00 0.00 C ATOM 1472 O GLU A 95 -6.737 -21.148 2.532 1.00 0.00 O ATOM 1473 CB GLU A 95 -8.475 -22.984 4.247 1.00 0.00 C ATOM 1474 CG GLU A 95 -7.844 -22.669 5.593 1.00 0.00 C ATOM 1475 CD GLU A 95 -8.519 -21.507 6.296 1.00 0.00 C ATOM 1476 OE1 GLU A 95 -9.761 -21.401 6.207 1.00 0.00 O ATOM 1477 OE2 GLU A 95 -7.807 -20.704 6.934 1.00 0.00 O ATOM 0 H GLU A 95 -8.788 -22.611 1.547 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.643 -21.196 4.005 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.357 -23.604 4.405 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.774 -23.572 3.655 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.894 -23.553 6.229 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -6.788 -22.439 5.450 1.00 0.00 H new ATOM 1484 N HIS A 96 -7.690 -19.684 3.951 1.00 0.00 N ATOM 1485 CA HIS A 96 -6.596 -18.723 3.866 1.00 0.00 C ATOM 1486 C HIS A 96 -5.790 -18.700 5.161 1.00 0.00 C ATOM 1487 O HIS A 96 -6.356 -18.684 6.255 1.00 0.00 O ATOM 1488 CB HIS A 96 -7.139 -17.325 3.565 1.00 0.00 C ATOM 1489 CG HIS A 96 -7.936 -17.253 2.299 1.00 0.00 C ATOM 1490 ND1 HIS A 96 -8.058 -16.101 1.551 1.00 0.00 N ATOM 1491 CD2 HIS A 96 -8.654 -18.199 1.649 1.00 0.00 C ATOM 1492 CE1 HIS A 96 -8.817 -16.341 0.497 1.00 0.00 C ATOM 1493 NE2 HIS A 96 -9.191 -17.607 0.532 1.00 0.00 N ATOM 0 H HIS A 96 -8.453 -19.402 4.567 1.00 0.00 H new ATOM 0 HA HIS A 96 -5.937 -19.032 3.054 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -7.763 -17.000 4.397 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -6.305 -16.626 3.500 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -8.781 -19.228 1.952 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -9.086 -15.624 -0.264 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -9.782 -18.070 -0.158 1.00 0.00 H new ATOM 1502 N CYS A 97 -4.469 -18.699 5.030 1.00 0.00 N ATOM 1503 CA CYS A 97 -3.585 -18.680 6.191 1.00 0.00 C ATOM 1504 C CYS A 97 -2.353 -17.822 5.922 1.00 0.00 C ATOM 1505 O CYS A 97 -1.650 -17.996 4.926 1.00 0.00 O ATOM 1506 CB CYS A 97 -3.161 -20.102 6.558 1.00 0.00 C ATOM 1507 SG CYS A 97 -2.811 -20.337 8.316 1.00 0.00 S ATOM 0 H CYS A 97 -3.985 -18.711 4.132 1.00 0.00 H new ATOM 0 HA CYS A 97 -4.133 -18.245 7.027 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -3.949 -20.793 6.260 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.273 -20.365 5.983 1.00 0.00 H new ATOM 0 HG CYS A 97 -2.463 -21.571 8.528 1.00 0.00 H new ATOM 1513 N PRO A 98 -2.084 -16.872 6.830 1.00 0.00 N ATOM 1514 CA PRO A 98 -0.936 -15.967 6.712 1.00 0.00 C ATOM 1515 C PRO A 98 0.392 -16.685 6.925 1.00 0.00 C ATOM 1516 O PRO A 98 0.481 -17.629 7.711 1.00 0.00 O ATOM 1517 CB PRO A 98 -1.176 -14.944 7.825 1.00 0.00 C ATOM 1518 CG PRO A 98 -2.012 -15.663 8.827 1.00 0.00 C ATOM 1519 CD PRO A 98 -2.878 -16.608 8.041 1.00 0.00 C ATOM 0 HA PRO A 98 -0.864 -15.526 5.718 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.236 -14.607 8.262 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -1.686 -14.059 7.446 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.389 -16.205 9.539 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -2.619 -14.964 9.402 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -3.080 -17.524 8.596 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -3.843 -16.162 7.799 1.00 0.00 H new ATOM 1527 N LEU A 99 1.423 -16.231 6.220 1.00 0.00 N ATOM 1528 CA LEU A 99 2.749 -16.830 6.333 1.00 0.00 C ATOM 1529 C LEU A 99 3.770 -15.806 6.816 1.00 0.00 C ATOM 1530 O LEU A 99 4.598 -16.099 7.678 1.00 0.00 O ATOM 1531 CB LEU A 99 3.186 -17.406 4.984 1.00 0.00 C ATOM 1532 CG LEU A 99 2.139 -18.232 4.236 1.00 0.00 C ATOM 1533 CD1 LEU A 99 2.685 -18.696 2.895 1.00 0.00 C ATOM 1534 CD2 LEU A 99 1.699 -19.422 5.076 1.00 0.00 C ATOM 0 H LEU A 99 1.367 -15.451 5.565 1.00 0.00 H new ATOM 0 HA LEU A 99 2.696 -17.635 7.066 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.495 -16.581 4.342 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.065 -18.030 5.146 1.00 0.00 H new ATOM 0 HG LEU A 99 1.269 -17.601 4.052 1.00 0.00 H new ATOM 0 HD11 LEU A 99 1.926 -19.282 2.377 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.949 -17.829 2.290 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.571 -19.310 3.056 1.00 0.00 H new ATOM 0 HD21 LEU A 99 0.954 -19.999 4.528 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.561 -20.054 5.291 1.00 0.00 H new ATOM 0 HD23 LEU A 99 1.267 -19.067 6.012 1.00 0.00 H new ATOM 1546 N ALA A 100 3.704 -14.602 6.256 1.00 0.00 N ATOM 1547 CA ALA A 100 4.620 -13.533 6.634 1.00 0.00 C ATOM 1548 C ALA A 100 3.980 -12.164 6.427 1.00 0.00 C ATOM 1549 O ALA A 100 2.991 -12.033 5.706 1.00 0.00 O ATOM 1550 CB ALA A 100 5.912 -13.639 5.838 1.00 0.00 C ATOM 0 H ALA A 100 3.026 -14.343 5.539 1.00 0.00 H new ATOM 0 HA ALA A 100 4.849 -13.642 7.694 1.00 0.00 H new ATOM 0 HB1 ALA A 100 6.587 -12.834 6.131 1.00 0.00 H new ATOM 0 HB2 ALA A 100 6.385 -14.600 6.039 1.00 0.00 H new ATOM 0 HB3 ALA A 100 5.691 -13.558 4.774 1.00 0.00 H new ATOM 1556 N TRP A 101 4.551 -11.147 7.063 1.00 0.00 N ATOM 1557 CA TRP A 101 4.035 -9.788 6.949 1.00 0.00 C ATOM 1558 C TRP A 101 5.173 -8.774 6.927 1.00 0.00 C ATOM 1559 O TRP A 101 6.115 -8.867 7.712 1.00 0.00 O ATOM 1560 CB TRP A 101 3.085 -9.482 8.109 1.00 0.00 C ATOM 1561 CG TRP A 101 3.709 -9.685 9.456 1.00 0.00 C ATOM 1562 CD1 TRP A 101 3.636 -10.806 10.232 1.00 0.00 C ATOM 1563 CD2 TRP A 101 4.498 -8.740 10.187 1.00 0.00 C ATOM 1564 NE1 TRP A 101 4.332 -10.615 11.402 1.00 0.00 N ATOM 1565 CE2 TRP A 101 4.871 -9.356 11.398 1.00 0.00 C ATOM 1566 CE3 TRP A 101 4.927 -7.434 9.936 1.00 0.00 C ATOM 1567 CZ2 TRP A 101 5.651 -8.709 12.352 1.00 0.00 C ATOM 1568 CZ3 TRP A 101 5.701 -6.793 10.884 1.00 0.00 C ATOM 1569 CH2 TRP A 101 6.058 -7.431 12.080 1.00 0.00 C ATOM 0 H TRP A 101 5.371 -11.238 7.663 1.00 0.00 H new ATOM 0 HA TRP A 101 3.487 -9.712 6.010 1.00 0.00 H new ATOM 0 HB2 TRP A 101 2.743 -8.450 8.027 1.00 0.00 H new ATOM 0 HB3 TRP A 101 2.204 -10.118 8.025 1.00 0.00 H new ATOM 0 HD1 TRP A 101 3.109 -11.710 9.966 1.00 0.00 H new ATOM 0 HE1 TRP A 101 4.431 -11.300 12.151 1.00 0.00 H new ATOM 0 HE3 TRP A 101 4.658 -6.934 9.017 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 5.926 -9.198 13.275 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 6.037 -5.783 10.700 1.00 0.00 H new ATOM 0 HH2 TRP A 101 6.666 -6.904 12.801 1.00 0.00 H new ATOM 1580 N GLY A 102 5.080 -7.805 6.021 1.00 0.00 N ATOM 1581 CA GLY A 102 6.109 -6.787 5.914 1.00 0.00 C ATOM 1582 C GLY A 102 5.534 -5.404 5.683 1.00 0.00 C ATOM 1583 O GLY A 102 4.666 -5.220 4.832 1.00 0.00 O ATOM 0 H GLY A 102 4.310 -7.707 5.359 1.00 0.00 H new ATOM 0 HA2 GLY A 102 6.706 -6.781 6.826 1.00 0.00 H new ATOM 0 HA3 GLY A 102 6.781 -7.039 5.094 1.00 0.00 H new ATOM 1587 N ASN A 103 6.020 -4.428 6.444 1.00 0.00 N ATOM 1588 CA ASN A 103 5.547 -3.054 6.319 1.00 0.00 C ATOM 1589 C ASN A 103 6.635 -2.155 5.739 1.00 0.00 C ATOM 1590 O ASN A 103 7.805 -2.262 6.109 1.00 0.00 O ATOM 1591 CB ASN A 103 5.102 -2.520 7.682 1.00 0.00 C ATOM 1592 CG ASN A 103 4.201 -3.493 8.418 1.00 0.00 C ATOM 1593 OD1 ASN A 103 4.203 -4.692 8.137 1.00 0.00 O ATOM 1594 ND2 ASN A 103 3.425 -2.980 9.365 1.00 0.00 N ATOM 0 H ASN A 103 6.741 -4.563 7.153 1.00 0.00 H new ATOM 0 HA ASN A 103 4.695 -3.050 5.639 1.00 0.00 H new ATOM 0 HB2 ASN A 103 5.981 -2.311 8.292 1.00 0.00 H new ATOM 0 HB3 ASN A 103 4.577 -1.575 7.545 1.00 0.00 H new ATOM 0 HD21 ASN A 103 2.797 -3.586 9.894 1.00 0.00 H new ATOM 0 HD22 ASN A 103 3.456 -1.980 9.564 1.00 0.00 H new ATOM 1601 N ILE A 104 6.241 -1.270 4.829 1.00 0.00 N ATOM 1602 CA ILE A 104 7.182 -0.352 4.200 1.00 0.00 C ATOM 1603 C ILE A 104 6.791 1.099 4.459 1.00 0.00 C ATOM 1604 O ILE A 104 5.625 1.470 4.332 1.00 0.00 O ATOM 1605 CB ILE A 104 7.265 -0.586 2.680 1.00 0.00 C ATOM 1606 CG1 ILE A 104 7.954 -1.920 2.384 1.00 0.00 C ATOM 1607 CG2 ILE A 104 8.006 0.560 2.008 1.00 0.00 C ATOM 1608 CD1 ILE A 104 7.777 -2.388 0.956 1.00 0.00 C ATOM 0 H ILE A 104 5.277 -1.170 4.511 1.00 0.00 H new ATOM 0 HA ILE A 104 8.158 -0.547 4.644 1.00 0.00 H new ATOM 0 HB ILE A 104 6.253 -0.624 2.277 1.00 0.00 H new ATOM 0 HG12 ILE A 104 9.019 -1.825 2.597 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.560 -2.680 3.058 1.00 0.00 H new ATOM 0 HG21 ILE A 104 8.057 0.380 0.934 1.00 0.00 H new ATOM 0 HG22 ILE A 104 7.477 1.495 2.195 1.00 0.00 H new ATOM 0 HG23 ILE A 104 9.016 0.627 2.413 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.291 -3.339 0.818 1.00 0.00 H new ATOM 0 HD12 ILE A 104 6.715 -2.516 0.744 1.00 0.00 H new ATOM 0 HD13 ILE A 104 8.196 -1.647 0.276 1.00 0.00 H new ATOM 1620 N ASN A 105 7.775 1.915 4.822 1.00 0.00 N ATOM 1621 CA ASN A 105 7.535 3.327 5.098 1.00 0.00 C ATOM 1622 C ASN A 105 7.283 4.098 3.807 1.00 0.00 C ATOM 1623 O ASN A 105 8.210 4.641 3.204 1.00 0.00 O ATOM 1624 CB ASN A 105 8.726 3.932 5.844 1.00 0.00 C ATOM 1625 CG ASN A 105 9.184 3.067 7.001 1.00 0.00 C ATOM 1626 OD1 ASN A 105 9.565 1.911 6.814 1.00 0.00 O ATOM 1627 ND2 ASN A 105 9.150 3.624 8.206 1.00 0.00 N ATOM 0 H ASN A 105 8.746 1.623 4.932 1.00 0.00 H new ATOM 0 HA ASN A 105 6.646 3.404 5.725 1.00 0.00 H new ATOM 0 HB2 ASN A 105 9.554 4.072 5.149 1.00 0.00 H new ATOM 0 HB3 ASN A 105 8.454 4.919 6.218 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.447 3.090 9.023 1.00 0.00 H new ATOM 0 HD22 ASN A 105 8.827 4.585 8.315 1.00 0.00 H new ATOM 1634 N LEU A 106 6.023 4.144 3.387 1.00 0.00 N ATOM 1635 CA LEU A 106 5.648 4.850 2.167 1.00 0.00 C ATOM 1636 C LEU A 106 6.483 6.115 1.991 1.00 0.00 C ATOM 1637 O LEU A 106 6.803 6.509 0.869 1.00 0.00 O ATOM 1638 CB LEU A 106 4.161 5.207 2.197 1.00 0.00 C ATOM 1639 CG LEU A 106 3.202 4.129 1.692 1.00 0.00 C ATOM 1640 CD1 LEU A 106 1.788 4.400 2.182 1.00 0.00 C ATOM 1641 CD2 LEU A 106 3.236 4.053 0.173 1.00 0.00 C ATOM 0 H LEU A 106 5.244 3.701 3.874 1.00 0.00 H new ATOM 0 HA LEU A 106 5.840 4.190 1.321 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.888 5.456 3.222 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.012 6.107 1.600 1.00 0.00 H new ATOM 0 HG LEU A 106 3.525 3.168 2.091 1.00 0.00 H new ATOM 0 HD11 LEU A 106 1.120 3.622 1.813 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.775 4.402 3.272 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.455 5.370 1.813 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.547 3.280 -0.168 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.939 5.014 -0.246 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.246 3.810 -0.157 1.00 0.00 H new ATOM 1653 N PHE A 107 6.834 6.745 3.107 1.00 0.00 N ATOM 1654 CA PHE A 107 7.633 7.965 3.076 1.00 0.00 C ATOM 1655 C PHE A 107 9.032 7.713 3.632 1.00 0.00 C ATOM 1656 O PHE A 107 9.194 7.378 4.806 1.00 0.00 O ATOM 1657 CB PHE A 107 6.945 9.071 3.878 1.00 0.00 C ATOM 1658 CG PHE A 107 5.678 9.571 3.245 1.00 0.00 C ATOM 1659 CD1 PHE A 107 5.706 10.200 2.011 1.00 0.00 C ATOM 1660 CD2 PHE A 107 4.459 9.411 3.884 1.00 0.00 C ATOM 1661 CE1 PHE A 107 4.542 10.661 1.425 1.00 0.00 C ATOM 1662 CE2 PHE A 107 3.291 9.870 3.303 1.00 0.00 C ATOM 1663 CZ PHE A 107 3.333 10.496 2.073 1.00 0.00 C ATOM 0 H PHE A 107 6.578 6.432 4.043 1.00 0.00 H new ATOM 0 HA PHE A 107 7.725 8.283 2.037 1.00 0.00 H new ATOM 0 HB2 PHE A 107 6.720 8.698 4.877 1.00 0.00 H new ATOM 0 HB3 PHE A 107 7.636 9.906 3.998 1.00 0.00 H new ATOM 0 HD1 PHE A 107 6.649 10.332 1.501 1.00 0.00 H new ATOM 0 HD2 PHE A 107 4.421 8.922 4.846 1.00 0.00 H new ATOM 0 HE1 PHE A 107 4.578 11.149 0.462 1.00 0.00 H new ATOM 0 HE2 PHE A 107 2.347 9.739 3.811 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.422 10.856 1.618 1.00 0.00 H new ATOM 1673 N ASP A 108 10.038 7.875 2.781 1.00 0.00 N ATOM 1674 CA ASP A 108 11.424 7.666 3.186 1.00 0.00 C ATOM 1675 C ASP A 108 11.741 8.444 4.460 1.00 0.00 C ATOM 1676 O ASP A 108 10.871 9.104 5.029 1.00 0.00 O ATOM 1677 CB ASP A 108 12.375 8.089 2.065 1.00 0.00 C ATOM 1678 CG ASP A 108 13.731 7.420 2.174 1.00 0.00 C ATOM 1679 OD1 ASP A 108 13.823 6.369 2.842 1.00 0.00 O ATOM 1680 OD2 ASP A 108 14.700 7.947 1.589 1.00 0.00 O ATOM 0 H ASP A 108 9.921 8.150 1.806 1.00 0.00 H new ATOM 0 HA ASP A 108 11.562 6.604 3.387 1.00 0.00 H new ATOM 0 HB2 ASP A 108 11.928 7.844 1.101 1.00 0.00 H new ATOM 0 HB3 ASP A 108 12.504 9.171 2.090 1.00 0.00 H new ATOM 1685 N TYR A 109 12.990 8.361 4.902 1.00 0.00 N ATOM 1686 CA TYR A 109 13.422 9.054 6.110 1.00 0.00 C ATOM 1687 C TYR A 109 13.329 10.567 5.933 1.00 0.00 C ATOM 1688 O TYR A 109 13.049 11.300 6.881 1.00 0.00 O ATOM 1689 CB TYR A 109 14.855 8.658 6.467 1.00 0.00 C ATOM 1690 CG TYR A 109 15.769 8.546 5.267 1.00 0.00 C ATOM 1691 CD1 TYR A 109 16.288 9.680 4.656 1.00 0.00 C ATOM 1692 CD2 TYR A 109 16.113 7.305 4.745 1.00 0.00 C ATOM 1693 CE1 TYR A 109 17.123 9.582 3.559 1.00 0.00 C ATOM 1694 CE2 TYR A 109 16.948 7.197 3.650 1.00 0.00 C ATOM 1695 CZ TYR A 109 17.449 8.338 3.060 1.00 0.00 C ATOM 1696 OH TYR A 109 18.281 8.237 1.969 1.00 0.00 O ATOM 0 H TYR A 109 13.722 7.820 4.442 1.00 0.00 H new ATOM 0 HA TYR A 109 12.759 8.760 6.923 1.00 0.00 H new ATOM 0 HB2 TYR A 109 15.265 9.394 7.158 1.00 0.00 H new ATOM 0 HB3 TYR A 109 14.839 7.703 6.992 1.00 0.00 H new ATOM 0 HD1 TYR A 109 16.035 10.655 5.045 1.00 0.00 H new ATOM 0 HD2 TYR A 109 15.721 6.409 5.203 1.00 0.00 H new ATOM 0 HE1 TYR A 109 17.518 10.474 3.095 1.00 0.00 H new ATOM 0 HE2 TYR A 109 17.207 6.224 3.258 1.00 0.00 H new ATOM 0 HH TYR A 109 18.412 7.292 1.744 1.00 0.00 H new ATOM 1706 N THR A 110 13.567 11.028 4.709 1.00 0.00 N ATOM 1707 CA THR A 110 13.512 12.452 4.405 1.00 0.00 C ATOM 1708 C THR A 110 12.118 12.863 3.947 1.00 0.00 C ATOM 1709 O THR A 110 11.962 13.794 3.156 1.00 0.00 O ATOM 1710 CB THR A 110 14.531 12.834 3.314 1.00 0.00 C ATOM 1711 OG1 THR A 110 14.530 14.252 3.117 1.00 0.00 O ATOM 1712 CG2 THR A 110 14.208 12.134 2.003 1.00 0.00 C ATOM 0 H THR A 110 13.800 10.435 3.912 1.00 0.00 H new ATOM 0 HA THR A 110 13.760 12.981 5.325 1.00 0.00 H new ATOM 0 HB THR A 110 15.520 12.515 3.644 1.00 0.00 H new ATOM 0 HG1 THR A 110 13.606 14.576 3.078 1.00 0.00 H new ATOM 0 HG21 THR A 110 14.941 12.419 1.248 1.00 0.00 H new ATOM 0 HG22 THR A 110 14.239 11.054 2.150 1.00 0.00 H new ATOM 0 HG23 THR A 110 13.212 12.426 1.670 1.00 0.00 H new ATOM 1720 N ASP A 111 11.105 12.165 4.450 1.00 0.00 N ATOM 1721 CA ASP A 111 9.722 12.459 4.094 1.00 0.00 C ATOM 1722 C ASP A 111 9.559 12.555 2.580 1.00 0.00 C ATOM 1723 O ASP A 111 8.978 13.512 2.066 1.00 0.00 O ATOM 1724 CB ASP A 111 9.270 13.764 4.752 1.00 0.00 C ATOM 1725 CG ASP A 111 7.762 13.916 4.759 1.00 0.00 C ATOM 1726 OD1 ASP A 111 7.135 13.664 3.709 1.00 0.00 O ATOM 1727 OD2 ASP A 111 7.208 14.289 5.815 1.00 0.00 O ATOM 0 H ASP A 111 11.216 11.392 5.106 1.00 0.00 H new ATOM 0 HA ASP A 111 9.098 11.643 4.457 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.641 13.798 5.776 1.00 0.00 H new ATOM 0 HB3 ASP A 111 9.715 14.607 4.224 1.00 0.00 H new ATOM 1732 N THR A 112 10.077 11.558 1.870 1.00 0.00 N ATOM 1733 CA THR A 112 9.992 11.531 0.415 1.00 0.00 C ATOM 1734 C THR A 112 9.620 10.141 -0.088 1.00 0.00 C ATOM 1735 O THR A 112 10.398 9.194 0.040 1.00 0.00 O ATOM 1736 CB THR A 112 11.321 11.961 -0.234 1.00 0.00 C ATOM 1737 OG1 THR A 112 11.580 13.341 0.048 1.00 0.00 O ATOM 1738 CG2 THR A 112 11.283 11.744 -1.739 1.00 0.00 C ATOM 0 H THR A 112 10.560 10.758 2.279 1.00 0.00 H new ATOM 0 HA THR A 112 9.213 12.238 0.131 1.00 0.00 H new ATOM 0 HB THR A 112 12.120 11.349 0.185 1.00 0.00 H new ATOM 0 HG1 THR A 112 12.427 13.606 -0.367 1.00 0.00 H new ATOM 0 HG21 THR A 112 12.232 12.055 -2.175 1.00 0.00 H new ATOM 0 HG22 THR A 112 11.115 10.688 -1.950 1.00 0.00 H new ATOM 0 HG23 THR A 112 10.475 12.334 -2.171 1.00 0.00 H new ATOM 1746 N LEU A 113 8.427 10.023 -0.660 1.00 0.00 N ATOM 1747 CA LEU A 113 7.952 8.747 -1.184 1.00 0.00 C ATOM 1748 C LEU A 113 9.095 7.957 -1.812 1.00 0.00 C ATOM 1749 O LEU A 113 10.033 8.533 -2.363 1.00 0.00 O ATOM 1750 CB LEU A 113 6.848 8.977 -2.217 1.00 0.00 C ATOM 1751 CG LEU A 113 5.457 9.278 -1.658 1.00 0.00 C ATOM 1752 CD1 LEU A 113 4.558 9.853 -2.742 1.00 0.00 C ATOM 1753 CD2 LEU A 113 4.839 8.023 -1.060 1.00 0.00 C ATOM 0 H LEU A 113 7.771 10.796 -0.773 1.00 0.00 H new ATOM 0 HA LEU A 113 7.549 8.168 -0.353 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.146 9.805 -2.860 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.780 8.092 -2.849 1.00 0.00 H new ATOM 0 HG LEU A 113 5.558 10.021 -0.867 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.573 10.061 -2.325 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.993 10.777 -3.123 1.00 0.00 H new ATOM 0 HD13 LEU A 113 4.463 9.134 -3.556 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.849 8.256 -0.667 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.752 7.257 -1.831 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.472 7.655 -0.253 1.00 0.00 H new ATOM 1765 N VAL A 114 9.009 6.633 -1.727 1.00 0.00 N ATOM 1766 CA VAL A 114 10.035 5.763 -2.290 1.00 0.00 C ATOM 1767 C VAL A 114 9.918 5.686 -3.808 1.00 0.00 C ATOM 1768 O VAL A 114 9.043 6.313 -4.406 1.00 0.00 O ATOM 1769 CB VAL A 114 9.945 4.340 -1.707 1.00 0.00 C ATOM 1770 CG1 VAL A 114 10.328 4.340 -0.235 1.00 0.00 C ATOM 1771 CG2 VAL A 114 8.547 3.771 -1.902 1.00 0.00 C ATOM 0 H VAL A 114 8.240 6.140 -1.274 1.00 0.00 H new ATOM 0 HA VAL A 114 10.999 6.197 -2.024 1.00 0.00 H new ATOM 0 HB VAL A 114 10.650 3.703 -2.241 1.00 0.00 H new ATOM 0 HG11 VAL A 114 10.258 3.326 0.159 1.00 0.00 H new ATOM 0 HG12 VAL A 114 11.350 4.703 -0.125 1.00 0.00 H new ATOM 0 HG13 VAL A 114 9.651 4.991 0.317 1.00 0.00 H new ATOM 0 HG21 VAL A 114 8.502 2.765 -1.484 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.821 4.407 -1.395 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.315 3.732 -2.966 1.00 0.00 H new ATOM 1781 N SER A 115 10.806 4.914 -4.426 1.00 0.00 N ATOM 1782 CA SER A 115 10.805 4.758 -5.876 1.00 0.00 C ATOM 1783 C SER A 115 11.817 3.702 -6.309 1.00 0.00 C ATOM 1784 O SER A 115 12.785 3.426 -5.601 1.00 0.00 O ATOM 1785 CB SER A 115 11.121 6.092 -6.554 1.00 0.00 C ATOM 1786 OG SER A 115 12.368 6.604 -6.117 1.00 0.00 O ATOM 0 H SER A 115 11.535 4.387 -3.946 1.00 0.00 H new ATOM 0 HA SER A 115 9.811 4.430 -6.181 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.138 5.959 -7.636 1.00 0.00 H new ATOM 0 HB3 SER A 115 10.332 6.811 -6.334 1.00 0.00 H new ATOM 0 HG SER A 115 12.547 7.456 -6.566 1.00 0.00 H new ATOM 1792 N GLY A 116 11.586 3.114 -7.479 1.00 0.00 N ATOM 1793 CA GLY A 116 12.486 2.095 -7.988 1.00 0.00 C ATOM 1794 C GLY A 116 12.268 0.748 -7.328 1.00 0.00 C ATOM 1795 O GLY A 116 11.815 0.673 -6.186 1.00 0.00 O ATOM 0 H GLY A 116 10.792 3.325 -8.083 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.346 1.996 -9.064 1.00 0.00 H new ATOM 0 HA3 GLY A 116 13.517 2.412 -7.828 1.00 0.00 H new ATOM 1799 N LYS A 117 12.588 -0.321 -8.050 1.00 0.00 N ATOM 1800 CA LYS A 117 12.425 -1.673 -7.529 1.00 0.00 C ATOM 1801 C LYS A 117 13.185 -1.847 -6.218 1.00 0.00 C ATOM 1802 O LYS A 117 14.237 -1.242 -6.015 1.00 0.00 O ATOM 1803 CB LYS A 117 12.914 -2.699 -8.554 1.00 0.00 C ATOM 1804 CG LYS A 117 12.301 -4.077 -8.375 1.00 0.00 C ATOM 1805 CD LYS A 117 13.007 -5.117 -9.230 1.00 0.00 C ATOM 1806 CE LYS A 117 14.136 -5.793 -8.467 1.00 0.00 C ATOM 1807 NZ LYS A 117 15.445 -5.123 -8.704 1.00 0.00 N ATOM 0 H LYS A 117 12.962 -0.277 -8.998 1.00 0.00 H new ATOM 0 HA LYS A 117 11.364 -1.836 -7.338 1.00 0.00 H new ATOM 0 HB2 LYS A 117 12.685 -2.336 -9.556 1.00 0.00 H new ATOM 0 HB3 LYS A 117 13.999 -2.781 -8.484 1.00 0.00 H new ATOM 0 HG2 LYS A 117 12.357 -4.368 -7.326 1.00 0.00 H new ATOM 0 HG3 LYS A 117 11.244 -4.043 -8.640 1.00 0.00 H new ATOM 0 HD2 LYS A 117 12.288 -5.868 -9.559 1.00 0.00 H new ATOM 0 HD3 LYS A 117 13.406 -4.643 -10.127 1.00 0.00 H new ATOM 0 HE2 LYS A 117 13.911 -5.783 -7.401 1.00 0.00 H new ATOM 0 HE3 LYS A 117 14.203 -6.838 -8.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 16.218 -5.782 -8.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 15.512 -4.836 -9.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 15.520 -4.283 -8.096 1.00 0.00 H new ATOM 1821 N MET A 118 12.646 -2.678 -5.332 1.00 0.00 N ATOM 1822 CA MET A 118 13.275 -2.933 -4.042 1.00 0.00 C ATOM 1823 C MET A 118 12.823 -4.274 -3.471 1.00 0.00 C ATOM 1824 O MET A 118 11.730 -4.750 -3.774 1.00 0.00 O ATOM 1825 CB MET A 118 12.945 -1.809 -3.058 1.00 0.00 C ATOM 1826 CG MET A 118 13.465 -2.060 -1.652 1.00 0.00 C ATOM 1827 SD MET A 118 13.631 -0.542 -0.692 1.00 0.00 S ATOM 1828 CE MET A 118 11.925 -0.243 -0.236 1.00 0.00 C ATOM 0 H MET A 118 11.775 -3.186 -5.484 1.00 0.00 H new ATOM 0 HA MET A 118 14.354 -2.968 -4.193 1.00 0.00 H new ATOM 0 HB2 MET A 118 13.366 -0.875 -3.431 1.00 0.00 H new ATOM 0 HB3 MET A 118 11.864 -1.678 -3.019 1.00 0.00 H new ATOM 0 HG2 MET A 118 12.789 -2.740 -1.135 1.00 0.00 H new ATOM 0 HG3 MET A 118 14.434 -2.556 -1.710 1.00 0.00 H new ATOM 0 HE1 MET A 118 11.650 0.777 -0.505 1.00 0.00 H new ATOM 0 HE2 MET A 118 11.279 -0.944 -0.764 1.00 0.00 H new ATOM 0 HE3 MET A 118 11.806 -0.379 0.839 1.00 0.00 H new ATOM 1838 N ALA A 119 13.672 -4.877 -2.645 1.00 0.00 N ATOM 1839 CA ALA A 119 13.358 -6.161 -2.032 1.00 0.00 C ATOM 1840 C ALA A 119 13.712 -6.162 -0.549 1.00 0.00 C ATOM 1841 O ALA A 119 14.807 -5.752 -0.161 1.00 0.00 O ATOM 1842 CB ALA A 119 14.091 -7.283 -2.752 1.00 0.00 C ATOM 0 H ALA A 119 14.582 -4.497 -2.385 1.00 0.00 H new ATOM 0 HA ALA A 119 12.284 -6.326 -2.123 1.00 0.00 H new ATOM 0 HB1 ALA A 119 13.847 -8.236 -2.283 1.00 0.00 H new ATOM 0 HB2 ALA A 119 13.786 -7.304 -3.798 1.00 0.00 H new ATOM 0 HB3 ALA A 119 15.166 -7.113 -2.691 1.00 0.00 H new ATOM 1848 N LEU A 120 12.780 -6.625 0.277 1.00 0.00 N ATOM 1849 CA LEU A 120 12.994 -6.679 1.719 1.00 0.00 C ATOM 1850 C LEU A 120 12.449 -7.979 2.302 1.00 0.00 C ATOM 1851 O LEU A 120 11.541 -8.590 1.740 1.00 0.00 O ATOM 1852 CB LEU A 120 12.325 -5.482 2.398 1.00 0.00 C ATOM 1853 CG LEU A 120 10.836 -5.291 2.108 1.00 0.00 C ATOM 1854 CD1 LEU A 120 10.007 -6.301 2.884 1.00 0.00 C ATOM 1855 CD2 LEU A 120 10.405 -3.871 2.446 1.00 0.00 C ATOM 0 H LEU A 120 11.869 -6.968 -0.027 1.00 0.00 H new ATOM 0 HA LEU A 120 14.067 -6.641 1.904 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.455 -5.582 3.476 1.00 0.00 H new ATOM 0 HB3 LEU A 120 12.852 -4.577 2.096 1.00 0.00 H new ATOM 0 HG LEU A 120 10.668 -5.457 1.044 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.950 -6.149 2.665 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.297 -7.310 2.592 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.179 -6.169 3.952 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.342 -3.753 2.233 1.00 0.00 H new ATOM 0 HD22 LEU A 120 10.587 -3.677 3.503 1.00 0.00 H new ATOM 0 HD23 LEU A 120 10.976 -3.164 1.844 1.00 0.00 H new ATOM 1867 N ASN A 121 13.009 -8.394 3.433 1.00 0.00 N ATOM 1868 CA ASN A 121 12.578 -9.621 4.094 1.00 0.00 C ATOM 1869 C ASN A 121 11.268 -9.403 4.845 1.00 0.00 C ATOM 1870 O ASN A 121 10.927 -8.277 5.208 1.00 0.00 O ATOM 1871 CB ASN A 121 13.658 -10.111 5.061 1.00 0.00 C ATOM 1872 CG ASN A 121 15.034 -10.141 4.424 1.00 0.00 C ATOM 1873 OD1 ASN A 121 15.495 -11.335 4.070 1.00 0.00 O flip ATOM 1874 ND2 ASN A 121 15.674 -9.104 4.252 1.00 0.00 N flip ATOM 0 H ASN A 121 13.762 -7.899 3.911 1.00 0.00 H new ATOM 0 HA ASN A 121 12.415 -10.379 3.328 1.00 0.00 H new ATOM 0 HB2 ASN A 121 13.680 -9.462 5.936 1.00 0.00 H new ATOM 0 HB3 ASN A 121 13.401 -11.110 5.412 1.00 0.00 H new ATOM 0 HD21 ASN A 121 15.280 -8.208 4.540 1.00 0.00 H new ATOM 0 HD22 ASN A 121 16.598 -9.140 3.822 1.00 0.00 H new ATOM 1881 N LEU A 122 10.537 -10.489 5.075 1.00 0.00 N ATOM 1882 CA LEU A 122 9.264 -10.418 5.784 1.00 0.00 C ATOM 1883 C LEU A 122 9.348 -11.136 7.127 1.00 0.00 C ATOM 1884 O LEU A 122 10.147 -12.055 7.301 1.00 0.00 O ATOM 1885 CB LEU A 122 8.150 -11.030 4.934 1.00 0.00 C ATOM 1886 CG LEU A 122 8.188 -10.702 3.440 1.00 0.00 C ATOM 1887 CD1 LEU A 122 7.371 -11.713 2.651 1.00 0.00 C ATOM 1888 CD2 LEU A 122 7.677 -9.290 3.191 1.00 0.00 C ATOM 0 H LEU A 122 10.804 -11.428 4.781 1.00 0.00 H new ATOM 0 HA LEU A 122 9.037 -9.368 5.968 1.00 0.00 H new ATOM 0 HB2 LEU A 122 8.186 -12.113 5.049 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.192 -10.699 5.334 1.00 0.00 H new ATOM 0 HG LEU A 122 9.223 -10.758 3.101 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.410 -11.464 1.591 1.00 0.00 H new ATOM 0 HD12 LEU A 122 7.781 -12.711 2.804 1.00 0.00 H new ATOM 0 HD13 LEU A 122 6.336 -11.690 2.992 1.00 0.00 H new ATOM 0 HD21 LEU A 122 7.711 -9.074 2.123 1.00 0.00 H new ATOM 0 HD22 LEU A 122 6.650 -9.207 3.545 1.00 0.00 H new ATOM 0 HD23 LEU A 122 8.304 -8.577 3.726 1.00 0.00 H new ATOM 1900 N TRP A 123 8.516 -10.712 8.071 1.00 0.00 N ATOM 1901 CA TRP A 123 8.494 -11.317 9.398 1.00 0.00 C ATOM 1902 C TRP A 123 7.515 -12.484 9.448 1.00 0.00 C ATOM 1903 O TRP A 123 6.497 -12.502 8.756 1.00 0.00 O ATOM 1904 CB TRP A 123 8.117 -10.273 10.451 1.00 0.00 C ATOM 1905 CG TRP A 123 8.946 -9.027 10.376 1.00 0.00 C ATOM 1906 CD1 TRP A 123 8.919 -8.082 9.390 1.00 0.00 C ATOM 1907 CD2 TRP A 123 9.927 -8.593 11.324 1.00 0.00 C ATOM 1908 NE1 TRP A 123 9.824 -7.086 9.668 1.00 0.00 N ATOM 1909 CE2 TRP A 123 10.455 -7.375 10.849 1.00 0.00 C ATOM 1910 CE3 TRP A 123 10.411 -9.112 12.528 1.00 0.00 C ATOM 1911 CZ2 TRP A 123 11.440 -6.673 11.537 1.00 0.00 C ATOM 1912 CZ3 TRP A 123 11.389 -8.414 13.209 1.00 0.00 C ATOM 1913 CH2 TRP A 123 11.895 -7.205 12.713 1.00 0.00 C ATOM 0 H TRP A 123 7.848 -9.952 7.943 1.00 0.00 H new ATOM 0 HA TRP A 123 9.493 -11.696 9.614 1.00 0.00 H new ATOM 0 HB2 TRP A 123 7.066 -10.009 10.331 1.00 0.00 H new ATOM 0 HB3 TRP A 123 8.224 -10.713 11.443 1.00 0.00 H new ATOM 0 HD1 TRP A 123 8.280 -8.113 8.520 1.00 0.00 H new ATOM 0 HE1 TRP A 123 9.998 -6.265 9.089 1.00 0.00 H new ATOM 0 HE3 TRP A 123 10.027 -10.043 12.919 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 11.832 -5.741 11.156 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 11.770 -8.807 14.140 1.00 0.00 H new ATOM 0 HH2 TRP A 123 12.659 -6.683 13.270 1.00 0.00 H new ATOM 1924 N PRO A 124 7.826 -13.484 10.287 1.00 0.00 N ATOM 1925 CA PRO A 124 6.985 -14.674 10.447 1.00 0.00 C ATOM 1926 C PRO A 124 5.669 -14.363 11.152 1.00 0.00 C ATOM 1927 O PRO A 124 5.522 -13.313 11.779 1.00 0.00 O ATOM 1928 CB PRO A 124 7.846 -15.603 11.308 1.00 0.00 C ATOM 1929 CG PRO A 124 8.753 -14.691 12.059 1.00 0.00 C ATOM 1930 CD PRO A 124 9.024 -13.529 11.143 1.00 0.00 C ATOM 0 HA PRO A 124 6.699 -15.103 9.487 1.00 0.00 H new ATOM 0 HB2 PRO A 124 7.232 -16.197 11.985 1.00 0.00 H new ATOM 0 HB3 PRO A 124 8.410 -16.303 10.692 1.00 0.00 H new ATOM 0 HG2 PRO A 124 8.289 -14.356 12.987 1.00 0.00 H new ATOM 0 HG3 PRO A 124 9.679 -15.198 12.330 1.00 0.00 H new ATOM 0 HD2 PRO A 124 9.156 -12.601 11.699 1.00 0.00 H new ATOM 0 HD3 PRO A 124 9.931 -13.681 10.558 1.00 0.00 H new ATOM 1938 N VAL A 125 4.714 -15.281 11.045 1.00 0.00 N ATOM 1939 CA VAL A 125 3.410 -15.105 11.673 1.00 0.00 C ATOM 1940 C VAL A 125 3.332 -15.857 12.997 1.00 0.00 C ATOM 1941 O VAL A 125 3.501 -17.076 13.058 1.00 0.00 O ATOM 1942 CB VAL A 125 2.274 -15.588 10.753 1.00 0.00 C ATOM 1943 CG1 VAL A 125 0.965 -15.677 11.522 1.00 0.00 C ATOM 1944 CG2 VAL A 125 2.134 -14.667 9.550 1.00 0.00 C ATOM 0 H VAL A 125 4.819 -16.155 10.529 1.00 0.00 H new ATOM 0 HA VAL A 125 3.289 -14.038 11.857 1.00 0.00 H new ATOM 0 HB VAL A 125 2.523 -16.585 10.391 1.00 0.00 H new ATOM 0 HG11 VAL A 125 0.174 -16.020 10.855 1.00 0.00 H new ATOM 0 HG12 VAL A 125 1.075 -16.381 12.347 1.00 0.00 H new ATOM 0 HG13 VAL A 125 0.707 -14.694 11.916 1.00 0.00 H new ATOM 0 HG21 VAL A 125 1.326 -15.024 8.911 1.00 0.00 H new ATOM 0 HG22 VAL A 125 1.908 -13.656 9.890 1.00 0.00 H new ATOM 0 HG23 VAL A 125 3.067 -14.660 8.986 1.00 0.00 H new ATOM 2039 N LEU A 132 -5.251 -11.925 8.647 1.00 0.00 N ATOM 2040 CA LEU A 132 -4.395 -12.204 7.499 1.00 0.00 C ATOM 2041 C LEU A 132 -3.294 -11.155 7.372 1.00 0.00 C ATOM 2042 O LEU A 132 -2.109 -11.486 7.323 1.00 0.00 O ATOM 2043 CB LEU A 132 -5.227 -12.244 6.216 1.00 0.00 C ATOM 2044 CG LEU A 132 -6.433 -13.184 6.227 1.00 0.00 C ATOM 2045 CD1 LEU A 132 -7.351 -12.889 5.052 1.00 0.00 C ATOM 2046 CD2 LEU A 132 -5.978 -14.636 6.198 1.00 0.00 C ATOM 0 HA LEU A 132 -3.928 -13.177 7.653 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -5.580 -11.235 6.004 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -4.574 -12.533 5.392 1.00 0.00 H new ATOM 0 HG LEU A 132 -6.991 -13.017 7.148 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -8.203 -13.568 5.077 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -7.705 -11.860 5.116 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -6.804 -13.027 4.119 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -6.849 -15.291 6.206 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -5.397 -14.817 5.294 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -5.361 -14.842 7.073 1.00 0.00 H new ATOM 2058 N LEU A 133 -3.694 -9.889 7.321 1.00 0.00 N ATOM 2059 CA LEU A 133 -2.742 -8.790 7.202 1.00 0.00 C ATOM 2060 C LEU A 133 -2.452 -8.172 8.566 1.00 0.00 C ATOM 2061 O LEU A 133 -3.363 -7.939 9.359 1.00 0.00 O ATOM 2062 CB LEU A 133 -3.281 -7.723 6.249 1.00 0.00 C ATOM 2063 CG LEU A 133 -2.253 -6.737 5.694 1.00 0.00 C ATOM 2064 CD1 LEU A 133 -1.588 -7.304 4.449 1.00 0.00 C ATOM 2065 CD2 LEU A 133 -2.908 -5.398 5.388 1.00 0.00 C ATOM 0 H LEU A 133 -4.671 -9.598 7.360 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.811 -9.189 6.799 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -3.764 -8.224 5.410 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -4.054 -7.157 6.769 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.485 -6.578 6.451 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -0.859 -6.589 4.068 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -1.084 -8.237 4.699 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -2.344 -7.493 3.687 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -2.161 -4.709 4.994 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -3.697 -5.539 4.649 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.336 -4.985 6.301 1.00 0.00 H new ATOM 2077 N ASN A 134 -1.177 -7.906 8.830 1.00 0.00 N ATOM 2078 CA ASN A 134 -0.766 -7.312 10.097 1.00 0.00 C ATOM 2079 C ASN A 134 -0.403 -5.841 9.917 1.00 0.00 C ATOM 2080 O ASN A 134 0.728 -5.492 9.578 1.00 0.00 O ATOM 2081 CB ASN A 134 0.425 -8.075 10.680 1.00 0.00 C ATOM 2082 CG ASN A 134 0.874 -7.513 12.015 1.00 0.00 C ATOM 2083 OD1 ASN A 134 2.056 -7.239 12.220 1.00 0.00 O ATOM 2084 ND2 ASN A 134 -0.071 -7.339 12.932 1.00 0.00 N ATOM 0 H ASN A 134 -0.410 -8.092 8.183 1.00 0.00 H new ATOM 0 HA ASN A 134 -1.605 -7.378 10.789 1.00 0.00 H new ATOM 0 HB2 ASN A 134 0.156 -9.124 10.802 1.00 0.00 H new ATOM 0 HB3 ASN A 134 1.256 -8.039 9.976 1.00 0.00 H new ATOM 0 HD21 ASN A 134 0.171 -6.965 13.849 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -1.039 -7.580 12.719 1.00 0.00 H new ATOM 2091 N PRO A 135 -1.385 -4.956 10.148 1.00 0.00 N ATOM 2092 CA PRO A 135 -1.192 -3.509 10.018 1.00 0.00 C ATOM 2093 C PRO A 135 -0.292 -2.943 11.111 1.00 0.00 C ATOM 2094 O PRO A 135 0.425 -1.966 10.893 1.00 0.00 O ATOM 2095 CB PRO A 135 -2.611 -2.949 10.152 1.00 0.00 C ATOM 2096 CG PRO A 135 -3.350 -3.974 10.941 1.00 0.00 C ATOM 2097 CD PRO A 135 -2.757 -5.301 10.555 1.00 0.00 C ATOM 0 HA PRO A 135 -0.701 -3.246 9.081 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.610 -1.984 10.659 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -3.070 -2.795 9.175 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -3.243 -3.795 12.011 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -4.417 -3.944 10.718 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.764 -6.002 11.389 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -3.312 -5.768 9.741 1.00 0.00 H new ATOM 2105 N ILE A 136 -0.333 -3.564 12.285 1.00 0.00 N ATOM 2106 CA ILE A 136 0.482 -3.123 13.411 1.00 0.00 C ATOM 2107 C ILE A 136 1.941 -3.525 13.225 1.00 0.00 C ATOM 2108 O ILE A 136 2.845 -2.886 13.762 1.00 0.00 O ATOM 2109 CB ILE A 136 -0.034 -3.705 14.740 1.00 0.00 C ATOM 2110 CG1 ILE A 136 -1.553 -3.555 14.833 1.00 0.00 C ATOM 2111 CG2 ILE A 136 0.644 -3.018 15.917 1.00 0.00 C ATOM 2112 CD1 ILE A 136 -2.011 -2.122 14.994 1.00 0.00 C ATOM 0 H ILE A 136 -0.921 -4.374 12.481 1.00 0.00 H new ATOM 0 HA ILE A 136 0.410 -2.036 13.447 1.00 0.00 H new ATOM 0 HB ILE A 136 0.210 -4.767 14.773 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -2.007 -3.974 13.935 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -1.917 -4.141 15.677 1.00 0.00 H new ATOM 0 HG21 ILE A 136 0.269 -3.440 16.850 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.721 -3.171 15.856 1.00 0.00 H new ATOM 0 HG23 ILE A 136 0.427 -1.950 15.889 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -3.099 -2.092 15.053 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -1.586 -1.705 15.907 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -1.678 -1.535 14.138 1.00 0.00 H new ATOM 2124 N GLY A 137 2.164 -4.587 12.457 1.00 0.00 N ATOM 2125 CA GLY A 137 3.515 -5.055 12.211 1.00 0.00 C ATOM 2126 C GLY A 137 4.516 -3.919 12.129 1.00 0.00 C ATOM 2127 O GLY A 137 4.181 -2.818 11.693 1.00 0.00 O ATOM 0 H GLY A 137 1.432 -5.132 12.001 1.00 0.00 H new ATOM 0 HA2 GLY A 137 3.810 -5.739 13.007 1.00 0.00 H new ATOM 0 HA3 GLY A 137 3.536 -5.622 11.280 1.00 0.00 H new ATOM 2131 N VAL A 138 5.748 -4.187 12.549 1.00 0.00 N ATOM 2132 CA VAL A 138 6.801 -3.178 12.522 1.00 0.00 C ATOM 2133 C VAL A 138 7.131 -2.768 11.091 1.00 0.00 C ATOM 2134 O VAL A 138 6.620 -3.348 10.132 1.00 0.00 O ATOM 2135 CB VAL A 138 8.083 -3.686 13.207 1.00 0.00 C ATOM 2136 CG1 VAL A 138 7.760 -4.284 14.568 1.00 0.00 C ATOM 2137 CG2 VAL A 138 8.792 -4.703 12.324 1.00 0.00 C ATOM 0 H VAL A 138 6.042 -5.094 12.912 1.00 0.00 H new ATOM 0 HA VAL A 138 6.425 -2.313 13.068 1.00 0.00 H new ATOM 0 HB VAL A 138 8.753 -2.840 13.358 1.00 0.00 H new ATOM 0 HG11 VAL A 138 8.678 -4.638 15.037 1.00 0.00 H new ATOM 0 HG12 VAL A 138 7.299 -3.524 15.199 1.00 0.00 H new ATOM 0 HG13 VAL A 138 7.071 -5.119 14.444 1.00 0.00 H new ATOM 0 HG21 VAL A 138 9.696 -5.051 12.824 1.00 0.00 H new ATOM 0 HG22 VAL A 138 8.130 -5.549 12.140 1.00 0.00 H new ATOM 0 HG23 VAL A 138 9.059 -4.238 11.375 1.00 0.00 H new ATOM 2147 N THR A 139 7.990 -1.762 10.953 1.00 0.00 N ATOM 2148 CA THR A 139 8.388 -1.273 9.639 1.00 0.00 C ATOM 2149 C THR A 139 9.886 -1.448 9.418 1.00 0.00 C ATOM 2150 O THR A 139 10.678 -1.341 10.353 1.00 0.00 O ATOM 2151 CB THR A 139 8.025 0.213 9.459 1.00 0.00 C ATOM 2152 OG1 THR A 139 8.538 0.979 10.555 1.00 0.00 O ATOM 2153 CG2 THR A 139 6.517 0.395 9.368 1.00 0.00 C ATOM 0 H THR A 139 8.423 -1.271 11.735 1.00 0.00 H new ATOM 0 HA THR A 139 7.843 -1.865 8.903 1.00 0.00 H new ATOM 0 HB THR A 139 8.474 0.564 8.530 1.00 0.00 H new ATOM 0 HG1 THR A 139 8.304 1.923 10.432 1.00 0.00 H new ATOM 0 HG21 THR A 139 6.285 1.452 9.241 1.00 0.00 H new ATOM 0 HG22 THR A 139 6.134 -0.165 8.515 1.00 0.00 H new ATOM 0 HG23 THR A 139 6.050 0.028 10.282 1.00 0.00 H new ATOM 2161 N GLY A 140 10.269 -1.718 8.174 1.00 0.00 N ATOM 2162 CA GLY A 140 11.672 -1.904 7.853 1.00 0.00 C ATOM 2163 C GLY A 140 11.966 -3.292 7.318 1.00 0.00 C ATOM 2164 O GLY A 140 11.159 -4.208 7.475 1.00 0.00 O ATOM 0 H GLY A 140 9.632 -1.811 7.382 1.00 0.00 H new ATOM 0 HA2 GLY A 140 11.974 -1.162 7.114 1.00 0.00 H new ATOM 0 HA3 GLY A 140 12.272 -1.727 8.746 1.00 0.00 H new ATOM 2168 N SER A 141 13.123 -3.447 6.683 1.00 0.00 N ATOM 2169 CA SER A 141 13.519 -4.732 6.119 1.00 0.00 C ATOM 2170 C SER A 141 14.171 -5.614 7.180 1.00 0.00 C ATOM 2171 O SER A 141 15.210 -5.266 7.739 1.00 0.00 O ATOM 2172 CB SER A 141 14.484 -4.523 4.950 1.00 0.00 C ATOM 2173 OG SER A 141 15.776 -4.171 5.412 1.00 0.00 O ATOM 0 H SER A 141 13.803 -2.699 6.546 1.00 0.00 H new ATOM 0 HA SER A 141 12.622 -5.234 5.756 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.543 -5.435 4.356 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.103 -3.740 4.295 1.00 0.00 H new ATOM 0 HG SER A 141 15.811 -4.263 6.387 1.00 0.00 H new ATOM 2179 N ASN A 142 13.551 -6.758 7.451 1.00 0.00 N ATOM 2180 CA ASN A 142 14.069 -7.690 8.445 1.00 0.00 C ATOM 2181 C ASN A 142 15.461 -8.181 8.058 1.00 0.00 C ATOM 2182 O ASN A 142 15.698 -8.631 6.937 1.00 0.00 O ATOM 2183 CB ASN A 142 13.122 -8.882 8.600 1.00 0.00 C ATOM 2184 CG ASN A 142 13.168 -9.480 9.993 1.00 0.00 C ATOM 2185 OD1 ASN A 142 13.165 -8.759 10.991 1.00 0.00 O ATOM 2186 ND2 ASN A 142 13.211 -10.805 10.066 1.00 0.00 N ATOM 0 H ASN A 142 12.690 -7.061 6.996 1.00 0.00 H new ATOM 0 HA ASN A 142 14.140 -7.164 9.397 1.00 0.00 H new ATOM 0 HB2 ASN A 142 12.103 -8.564 8.377 1.00 0.00 H new ATOM 0 HB3 ASN A 142 13.384 -9.648 7.870 1.00 0.00 H new ATOM 0 HD21 ASN A 142 13.243 -11.265 10.976 1.00 0.00 H new ATOM 0 HD22 ASN A 142 13.212 -11.363 9.212 1.00 0.00 H new ATOM 2193 N PRO A 143 16.405 -8.092 9.007 1.00 0.00 N ATOM 2194 CA PRO A 143 17.789 -8.523 8.789 1.00 0.00 C ATOM 2195 C PRO A 143 17.913 -10.038 8.669 1.00 0.00 C ATOM 2196 O PRO A 143 19.012 -10.571 8.520 1.00 0.00 O ATOM 2197 CB PRO A 143 18.517 -8.025 10.040 1.00 0.00 C ATOM 2198 CG PRO A 143 17.459 -7.941 11.085 1.00 0.00 C ATOM 2199 CD PRO A 143 16.193 -7.566 10.365 1.00 0.00 C ATOM 0 HA PRO A 143 18.196 -8.130 7.857 1.00 0.00 H new ATOM 0 HB2 PRO A 143 19.311 -8.710 10.335 1.00 0.00 H new ATOM 0 HB3 PRO A 143 18.981 -7.054 9.868 1.00 0.00 H new ATOM 0 HG2 PRO A 143 17.346 -8.893 11.603 1.00 0.00 H new ATOM 0 HG3 PRO A 143 17.714 -7.197 11.839 1.00 0.00 H new ATOM 0 HD2 PRO A 143 15.316 -8.010 10.836 1.00 0.00 H new ATOM 0 HD3 PRO A 143 16.039 -6.487 10.359 1.00 0.00 H new ATOM 2207 N ASN A 144 16.778 -10.727 8.734 1.00 0.00 N ATOM 2208 CA ASN A 144 16.760 -12.182 8.633 1.00 0.00 C ATOM 2209 C ASN A 144 16.617 -12.624 7.180 1.00 0.00 C ATOM 2210 O ASN A 144 15.610 -12.343 6.529 1.00 0.00 O ATOM 2211 CB ASN A 144 15.614 -12.758 9.468 1.00 0.00 C ATOM 2212 CG ASN A 144 15.523 -12.121 10.841 1.00 0.00 C ATOM 2213 OD1 ASN A 144 14.444 -12.413 11.558 1.00 0.00 O flip ATOM 2214 ND2 ASN A 144 16.413 -11.376 11.253 1.00 0.00 N flip ATOM 0 H ASN A 144 15.859 -10.301 8.856 1.00 0.00 H new ATOM 0 HA ASN A 144 17.707 -12.560 9.018 1.00 0.00 H new ATOM 0 HB2 ASN A 144 14.673 -12.610 8.939 1.00 0.00 H new ATOM 0 HB3 ASN A 144 15.753 -13.834 9.578 1.00 0.00 H new ATOM 0 HD21 ASN A 144 17.225 -11.179 10.668 1.00 0.00 H new ATOM 0 HD22 ASN A 144 16.338 -10.956 12.179 1.00 0.00 H new ATOM 2221 N LYS A 145 17.632 -13.318 6.676 1.00 0.00 N ATOM 2222 CA LYS A 145 17.620 -13.802 5.301 1.00 0.00 C ATOM 2223 C LYS A 145 16.729 -15.033 5.164 1.00 0.00 C ATOM 2224 O LYS A 145 15.921 -15.125 4.241 1.00 0.00 O ATOM 2225 CB LYS A 145 19.042 -14.136 4.844 1.00 0.00 C ATOM 2226 CG LYS A 145 20.057 -13.057 5.178 1.00 0.00 C ATOM 2227 CD LYS A 145 19.820 -11.796 4.364 1.00 0.00 C ATOM 2228 CE LYS A 145 20.207 -10.548 5.143 1.00 0.00 C ATOM 2229 NZ LYS A 145 19.084 -10.049 5.984 1.00 0.00 N ATOM 0 H LYS A 145 18.474 -13.558 7.200 1.00 0.00 H new ATOM 0 HA LYS A 145 17.217 -13.011 4.668 1.00 0.00 H new ATOM 0 HB2 LYS A 145 19.353 -15.072 5.308 1.00 0.00 H new ATOM 0 HB3 LYS A 145 19.039 -14.300 3.766 1.00 0.00 H new ATOM 0 HG2 LYS A 145 20.002 -12.821 6.241 1.00 0.00 H new ATOM 0 HG3 LYS A 145 21.063 -13.431 4.987 1.00 0.00 H new ATOM 0 HD2 LYS A 145 20.398 -11.844 3.441 1.00 0.00 H new ATOM 0 HD3 LYS A 145 18.769 -11.737 4.080 1.00 0.00 H new ATOM 0 HE2 LYS A 145 21.066 -10.767 5.777 1.00 0.00 H new ATOM 0 HE3 LYS A 145 20.515 -9.767 4.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 18.815 -9.094 5.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 18.268 -10.687 5.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 19.383 -10.018 6.980 1.00 0.00 H new ATOM 2243 N GLU A 146 16.883 -15.975 6.090 1.00 0.00 N ATOM 2244 CA GLU A 146 16.091 -17.199 6.072 1.00 0.00 C ATOM 2245 C GLU A 146 14.626 -16.895 5.770 1.00 0.00 C ATOM 2246 O GLU A 146 13.960 -17.641 5.050 1.00 0.00 O ATOM 2247 CB GLU A 146 16.206 -17.927 7.413 1.00 0.00 C ATOM 2248 CG GLU A 146 15.556 -17.183 8.567 1.00 0.00 C ATOM 2249 CD GLU A 146 15.513 -18.005 9.841 1.00 0.00 C ATOM 2250 OE1 GLU A 146 15.023 -19.152 9.791 1.00 0.00 O ATOM 2251 OE2 GLU A 146 15.970 -17.500 10.888 1.00 0.00 O ATOM 0 H GLU A 146 17.548 -15.914 6.861 1.00 0.00 H new ATOM 0 HA GLU A 146 16.481 -17.842 5.283 1.00 0.00 H new ATOM 0 HB2 GLU A 146 15.748 -18.912 7.323 1.00 0.00 H new ATOM 0 HB3 GLU A 146 17.260 -18.086 7.642 1.00 0.00 H new ATOM 0 HG2 GLU A 146 16.104 -16.259 8.753 1.00 0.00 H new ATOM 0 HG3 GLU A 146 14.541 -16.901 8.287 1.00 0.00 H new ATOM 2258 N THR A 147 14.129 -15.794 6.325 1.00 0.00 N ATOM 2259 CA THR A 147 12.744 -15.391 6.118 1.00 0.00 C ATOM 2260 C THR A 147 12.482 -15.058 4.654 1.00 0.00 C ATOM 2261 O THR A 147 13.376 -14.642 3.917 1.00 0.00 O ATOM 2262 CB THR A 147 12.378 -14.171 6.984 1.00 0.00 C ATOM 2263 OG1 THR A 147 13.145 -13.033 6.575 1.00 0.00 O ATOM 2264 CG2 THR A 147 12.631 -14.457 8.456 1.00 0.00 C ATOM 0 H THR A 147 14.666 -15.165 6.922 1.00 0.00 H new ATOM 0 HA THR A 147 12.121 -16.236 6.413 1.00 0.00 H new ATOM 0 HB THR A 147 11.317 -13.962 6.848 1.00 0.00 H new ATOM 0 HG1 THR A 147 14.082 -13.161 6.831 1.00 0.00 H new ATOM 0 HG21 THR A 147 12.365 -13.581 9.048 1.00 0.00 H new ATOM 0 HG22 THR A 147 12.024 -15.306 8.771 1.00 0.00 H new ATOM 0 HG23 THR A 147 13.685 -14.690 8.605 1.00 0.00 H new ATOM 2272 N PRO A 148 11.226 -15.244 4.219 1.00 0.00 N ATOM 2273 CA PRO A 148 10.817 -14.967 2.839 1.00 0.00 C ATOM 2274 C PRO A 148 10.810 -13.475 2.524 1.00 0.00 C ATOM 2275 O PRO A 148 10.269 -12.673 3.286 1.00 0.00 O ATOM 2276 CB PRO A 148 9.397 -15.535 2.769 1.00 0.00 C ATOM 2277 CG PRO A 148 8.905 -15.497 4.175 1.00 0.00 C ATOM 2278 CD PRO A 148 10.109 -15.737 5.043 1.00 0.00 C ATOM 0 HA PRO A 148 11.503 -15.407 2.115 1.00 0.00 H new ATOM 0 HB2 PRO A 148 8.764 -14.939 2.112 1.00 0.00 H new ATOM 0 HB3 PRO A 148 9.396 -16.552 2.376 1.00 0.00 H new ATOM 0 HG2 PRO A 148 8.446 -14.535 4.402 1.00 0.00 H new ATOM 0 HG3 PRO A 148 8.145 -16.260 4.343 1.00 0.00 H new ATOM 0 HD2 PRO A 148 10.038 -15.198 5.988 1.00 0.00 H new ATOM 0 HD3 PRO A 148 10.225 -16.793 5.287 1.00 0.00 H new ATOM 2286 N CYS A 149 11.412 -13.110 1.398 1.00 0.00 N ATOM 2287 CA CYS A 149 11.475 -11.714 0.982 1.00 0.00 C ATOM 2288 C CYS A 149 10.652 -11.484 -0.281 1.00 0.00 C ATOM 2289 O CYS A 149 10.695 -12.285 -1.216 1.00 0.00 O ATOM 2290 CB CYS A 149 12.927 -11.296 0.743 1.00 0.00 C ATOM 2291 SG CYS A 149 14.131 -12.212 1.733 1.00 0.00 S ATOM 0 H CYS A 149 11.864 -13.762 0.756 1.00 0.00 H new ATOM 0 HA CYS A 149 11.056 -11.104 1.782 1.00 0.00 H new ATOM 0 HB2 CYS A 149 13.163 -11.430 -0.313 1.00 0.00 H new ATOM 0 HB3 CYS A 149 13.028 -10.233 0.960 1.00 0.00 H new ATOM 0 HG CYS A 149 14.891 -11.375 2.375 1.00 0.00 H new ATOM 2297 N LEU A 150 9.903 -10.388 -0.302 1.00 0.00 N ATOM 2298 CA LEU A 150 9.068 -10.053 -1.450 1.00 0.00 C ATOM 2299 C LEU A 150 9.638 -8.859 -2.209 1.00 0.00 C ATOM 2300 O LEU A 150 10.078 -7.881 -1.604 1.00 0.00 O ATOM 2301 CB LEU A 150 7.639 -9.749 -0.996 1.00 0.00 C ATOM 2302 CG LEU A 150 6.655 -10.918 -1.046 1.00 0.00 C ATOM 2303 CD1 LEU A 150 5.360 -10.557 -0.335 1.00 0.00 C ATOM 2304 CD2 LEU A 150 6.380 -11.322 -2.487 1.00 0.00 C ATOM 0 H LEU A 150 9.857 -9.715 0.463 1.00 0.00 H new ATOM 0 HA LEU A 150 9.054 -10.912 -2.120 1.00 0.00 H new ATOM 0 HB2 LEU A 150 7.676 -9.375 0.027 1.00 0.00 H new ATOM 0 HB3 LEU A 150 7.246 -8.943 -1.616 1.00 0.00 H new ATOM 0 HG LEU A 150 7.103 -11.767 -0.531 1.00 0.00 H new ATOM 0 HD11 LEU A 150 4.672 -11.401 -0.381 1.00 0.00 H new ATOM 0 HD12 LEU A 150 5.572 -10.318 0.707 1.00 0.00 H new ATOM 0 HD13 LEU A 150 4.907 -9.693 -0.821 1.00 0.00 H new ATOM 0 HD21 LEU A 150 5.678 -12.155 -2.504 1.00 0.00 H new ATOM 0 HD22 LEU A 150 5.953 -10.477 -3.027 1.00 0.00 H new ATOM 0 HD23 LEU A 150 7.312 -11.624 -2.965 1.00 0.00 H new ATOM 2316 N GLU A 151 9.624 -8.945 -3.535 1.00 0.00 N ATOM 2317 CA GLU A 151 10.138 -7.870 -4.375 1.00 0.00 C ATOM 2318 C GLU A 151 8.997 -7.089 -5.019 1.00 0.00 C ATOM 2319 O GLU A 151 8.079 -7.672 -5.598 1.00 0.00 O ATOM 2320 CB GLU A 151 11.059 -8.436 -5.459 1.00 0.00 C ATOM 2321 CG GLU A 151 12.002 -7.405 -6.055 1.00 0.00 C ATOM 2322 CD GLU A 151 13.240 -8.031 -6.667 1.00 0.00 C ATOM 2323 OE1 GLU A 151 13.118 -8.657 -7.742 1.00 0.00 O ATOM 2324 OE2 GLU A 151 14.330 -7.897 -6.073 1.00 0.00 O ATOM 0 H GLU A 151 9.263 -9.747 -4.051 1.00 0.00 H new ATOM 0 HA GLU A 151 10.708 -7.190 -3.742 1.00 0.00 H new ATOM 0 HB2 GLU A 151 11.646 -9.251 -5.036 1.00 0.00 H new ATOM 0 HB3 GLU A 151 10.449 -8.862 -6.256 1.00 0.00 H new ATOM 0 HG2 GLU A 151 11.474 -6.833 -6.818 1.00 0.00 H new ATOM 0 HG3 GLU A 151 12.301 -6.701 -5.279 1.00 0.00 H new ATOM 2331 N LEU A 152 9.059 -5.766 -4.913 1.00 0.00 N ATOM 2332 CA LEU A 152 8.031 -4.903 -5.484 1.00 0.00 C ATOM 2333 C LEU A 152 8.657 -3.723 -6.220 1.00 0.00 C ATOM 2334 O LEU A 152 9.823 -3.394 -6.005 1.00 0.00 O ATOM 2335 CB LEU A 152 7.096 -4.395 -4.385 1.00 0.00 C ATOM 2336 CG LEU A 152 7.695 -3.380 -3.411 1.00 0.00 C ATOM 2337 CD1 LEU A 152 9.030 -3.875 -2.877 1.00 0.00 C ATOM 2338 CD2 LEU A 152 7.858 -2.025 -4.085 1.00 0.00 C ATOM 0 H LEU A 152 9.811 -5.268 -4.437 1.00 0.00 H new ATOM 0 HA LEU A 152 7.456 -5.490 -6.200 1.00 0.00 H new ATOM 0 HB2 LEU A 152 6.224 -3.944 -4.858 1.00 0.00 H new ATOM 0 HB3 LEU A 152 6.741 -5.252 -3.813 1.00 0.00 H new ATOM 0 HG LEU A 152 7.011 -3.266 -2.570 1.00 0.00 H new ATOM 0 HD11 LEU A 152 9.441 -3.139 -2.186 1.00 0.00 H new ATOM 0 HD12 LEU A 152 8.885 -4.821 -2.356 1.00 0.00 H new ATOM 0 HD13 LEU A 152 9.722 -4.020 -3.706 1.00 0.00 H new ATOM 0 HD21 LEU A 152 8.286 -1.315 -3.377 1.00 0.00 H new ATOM 0 HD22 LEU A 152 8.521 -2.124 -4.945 1.00 0.00 H new ATOM 0 HD23 LEU A 152 6.884 -1.664 -4.417 1.00 0.00 H new ATOM 2350 N GLU A 153 7.874 -3.090 -7.087 1.00 0.00 N ATOM 2351 CA GLU A 153 8.352 -1.946 -7.854 1.00 0.00 C ATOM 2352 C GLU A 153 7.567 -0.686 -7.500 1.00 0.00 C ATOM 2353 O GLU A 153 6.339 -0.664 -7.580 1.00 0.00 O ATOM 2354 CB GLU A 153 8.239 -2.225 -9.354 1.00 0.00 C ATOM 2355 CG GLU A 153 9.447 -2.942 -9.933 1.00 0.00 C ATOM 2356 CD GLU A 153 9.424 -2.994 -11.448 1.00 0.00 C ATOM 2357 OE1 GLU A 153 8.644 -3.795 -12.003 1.00 0.00 O ATOM 2358 OE2 GLU A 153 10.188 -2.233 -12.079 1.00 0.00 O ATOM 0 H GLU A 153 6.906 -3.350 -7.276 1.00 0.00 H new ATOM 0 HA GLU A 153 9.400 -1.784 -7.600 1.00 0.00 H new ATOM 0 HB2 GLU A 153 7.348 -2.826 -9.537 1.00 0.00 H new ATOM 0 HB3 GLU A 153 8.100 -1.281 -9.881 1.00 0.00 H new ATOM 0 HG2 GLU A 153 10.356 -2.438 -9.604 1.00 0.00 H new ATOM 0 HG3 GLU A 153 9.485 -3.958 -9.539 1.00 0.00 H new ATOM 2365 N PHE A 154 8.285 0.360 -7.106 1.00 0.00 N ATOM 2366 CA PHE A 154 7.656 1.623 -6.737 1.00 0.00 C ATOM 2367 C PHE A 154 7.594 2.570 -7.933 1.00 0.00 C ATOM 2368 O PHE A 154 8.613 3.109 -8.364 1.00 0.00 O ATOM 2369 CB PHE A 154 8.423 2.283 -5.589 1.00 0.00 C ATOM 2370 CG PHE A 154 8.130 1.678 -4.246 1.00 0.00 C ATOM 2371 CD1 PHE A 154 6.903 1.879 -3.635 1.00 0.00 C ATOM 2372 CD2 PHE A 154 9.081 0.910 -3.595 1.00 0.00 C ATOM 2373 CE1 PHE A 154 6.629 1.324 -2.399 1.00 0.00 C ATOM 2374 CE2 PHE A 154 8.812 0.351 -2.359 1.00 0.00 C ATOM 2375 CZ PHE A 154 7.585 0.560 -1.760 1.00 0.00 C ATOM 0 H PHE A 154 9.302 0.358 -7.034 1.00 0.00 H new ATOM 0 HA PHE A 154 6.638 1.411 -6.410 1.00 0.00 H new ATOM 0 HB2 PHE A 154 9.492 2.208 -5.787 1.00 0.00 H new ATOM 0 HB3 PHE A 154 8.177 3.345 -5.562 1.00 0.00 H new ATOM 0 HD1 PHE A 154 6.152 2.476 -4.130 1.00 0.00 H new ATOM 0 HD2 PHE A 154 10.043 0.746 -4.058 1.00 0.00 H new ATOM 0 HE1 PHE A 154 5.668 1.488 -1.934 1.00 0.00 H new ATOM 0 HE2 PHE A 154 9.561 -0.248 -1.862 1.00 0.00 H new ATOM 0 HZ PHE A 154 7.374 0.127 -0.794 1.00 0.00 H new ATOM 2385 N ASP A 155 6.392 2.765 -8.463 1.00 0.00 N ATOM 2386 CA ASP A 155 6.196 3.646 -9.608 1.00 0.00 C ATOM 2387 C ASP A 155 4.972 4.534 -9.407 1.00 0.00 C ATOM 2388 O ASP A 155 4.061 4.191 -8.653 1.00 0.00 O ATOM 2389 CB ASP A 155 6.041 2.825 -10.890 1.00 0.00 C ATOM 2390 CG ASP A 155 7.362 2.267 -11.382 1.00 0.00 C ATOM 2391 OD1 ASP A 155 8.098 1.675 -10.564 1.00 0.00 O ATOM 2392 OD2 ASP A 155 7.659 2.419 -12.585 1.00 0.00 O ATOM 0 H ASP A 155 5.539 2.325 -8.118 1.00 0.00 H new ATOM 0 HA ASP A 155 7.075 4.284 -9.699 1.00 0.00 H new ATOM 0 HB2 ASP A 155 5.347 2.004 -10.711 1.00 0.00 H new ATOM 0 HB3 ASP A 155 5.601 3.450 -11.667 1.00 0.00 H new ATOM 2397 N TRP A 156 4.958 5.676 -10.086 1.00 0.00 N ATOM 2398 CA TRP A 156 3.846 6.613 -9.981 1.00 0.00 C ATOM 2399 C TRP A 156 3.452 7.147 -11.354 1.00 0.00 C ATOM 2400 O TRP A 156 4.148 7.984 -11.928 1.00 0.00 O ATOM 2401 CB TRP A 156 4.216 7.774 -9.056 1.00 0.00 C ATOM 2402 CG TRP A 156 4.955 7.341 -7.826 1.00 0.00 C ATOM 2403 CD1 TRP A 156 6.286 7.048 -7.730 1.00 0.00 C ATOM 2404 CD2 TRP A 156 4.405 7.150 -6.518 1.00 0.00 C ATOM 2405 NE1 TRP A 156 6.596 6.687 -6.441 1.00 0.00 N ATOM 2406 CE2 TRP A 156 5.460 6.742 -5.678 1.00 0.00 C ATOM 2407 CE3 TRP A 156 3.125 7.286 -5.974 1.00 0.00 C ATOM 2408 CZ2 TRP A 156 5.271 6.468 -4.326 1.00 0.00 C ATOM 2409 CZ3 TRP A 156 2.939 7.014 -4.632 1.00 0.00 C ATOM 2410 CH2 TRP A 156 4.007 6.610 -3.820 1.00 0.00 C ATOM 0 H TRP A 156 5.704 5.975 -10.715 1.00 0.00 H new ATOM 0 HA TRP A 156 2.993 6.080 -9.561 1.00 0.00 H new ATOM 0 HB2 TRP A 156 4.829 8.487 -9.607 1.00 0.00 H new ATOM 0 HB3 TRP A 156 3.307 8.297 -8.760 1.00 0.00 H new ATOM 0 HD1 TRP A 156 6.991 7.093 -8.547 1.00 0.00 H new ATOM 0 HE1 TRP A 156 7.522 6.421 -6.107 1.00 0.00 H new ATOM 0 HE3 TRP A 156 2.296 7.598 -6.592 1.00 0.00 H new ATOM 0 HZ2 TRP A 156 6.092 6.155 -3.699 1.00 0.00 H new ATOM 0 HZ3 TRP A 156 1.954 7.115 -4.202 1.00 0.00 H new ATOM 0 HH2 TRP A 156 3.829 6.407 -2.774 1.00 0.00 H new ATOM 2421 N PHE A 157 2.332 6.658 -11.875 1.00 0.00 N ATOM 2422 CA PHE A 157 1.846 7.086 -13.182 1.00 0.00 C ATOM 2423 C PHE A 157 1.017 8.361 -13.063 1.00 0.00 C ATOM 2424 O PHE A 157 1.179 9.295 -13.848 1.00 0.00 O ATOM 2425 CB PHE A 157 1.009 5.978 -13.826 1.00 0.00 C ATOM 2426 CG PHE A 157 -0.413 5.944 -13.344 1.00 0.00 C ATOM 2427 CD1 PHE A 157 -0.731 5.376 -12.121 1.00 0.00 C ATOM 2428 CD2 PHE A 157 -1.432 6.480 -14.115 1.00 0.00 C ATOM 2429 CE1 PHE A 157 -2.038 5.344 -11.675 1.00 0.00 C ATOM 2430 CE2 PHE A 157 -2.742 6.451 -13.673 1.00 0.00 C ATOM 2431 CZ PHE A 157 -3.045 5.881 -12.452 1.00 0.00 C ATOM 0 H PHE A 157 1.744 5.965 -11.412 1.00 0.00 H new ATOM 0 HA PHE A 157 2.710 7.293 -13.813 1.00 0.00 H new ATOM 0 HB2 PHE A 157 1.014 6.112 -14.908 1.00 0.00 H new ATOM 0 HB3 PHE A 157 1.477 5.015 -13.622 1.00 0.00 H new ATOM 0 HD1 PHE A 157 0.052 4.953 -11.509 1.00 0.00 H new ATOM 0 HD2 PHE A 157 -1.201 6.925 -15.071 1.00 0.00 H new ATOM 0 HE1 PHE A 157 -2.272 4.899 -10.719 1.00 0.00 H new ATOM 0 HE2 PHE A 157 -3.527 6.874 -14.282 1.00 0.00 H new ATOM 0 HZ PHE A 157 -4.068 5.855 -12.106 1.00 0.00 H new ATOM 2441 N SER A 158 0.128 8.392 -12.075 1.00 0.00 N ATOM 2442 CA SER A 158 -0.730 9.551 -11.855 1.00 0.00 C ATOM 2443 C SER A 158 -1.522 9.887 -13.115 1.00 0.00 C ATOM 2444 O SER A 158 -1.830 11.049 -13.375 1.00 0.00 O ATOM 2445 CB SER A 158 0.107 10.758 -11.428 1.00 0.00 C ATOM 2446 OG SER A 158 0.405 10.707 -10.044 1.00 0.00 O ATOM 0 H SER A 158 -0.017 7.628 -11.415 1.00 0.00 H new ATOM 0 HA SER A 158 -1.433 9.306 -11.059 1.00 0.00 H new ATOM 0 HB2 SER A 158 1.033 10.784 -12.002 1.00 0.00 H new ATOM 0 HB3 SER A 158 -0.433 11.677 -11.653 1.00 0.00 H new ATOM 0 HG SER A 158 -0.155 11.353 -9.565 1.00 0.00 H new