USER MOD reduce.3.24.130724 H: found=0, std=0, add=939, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 937 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 6 LYS NZ :NH3+ -167:sc= 1.58 (180deg=0.387) USER MOD Set 1.2: B 338 GLN : amide:sc= 2.24 K(o=3.8,f=-4.6) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 135:sc= 0.0244 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= -0.129 X(o=-0.13,f=-0.13) USER MOD Single : A 7 THR OG1 : rot -170:sc= 1.02 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -155:sc= 1.26 (180deg=1.05) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -82:sc= 1.22 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.3 USER MOD Single : A 25 ASN : amide:sc= -0.223 X(o=-0.22,f=0) USER MOD Single : A 27 LYS NZ :NH3+ -173:sc= 1.82 (180deg=1.39) USER MOD Single : A 28 SER OG : rot 84:sc= 0.821 USER MOD Single : A 29 LYS NZ :NH3+ 145:sc= 2.06 (180deg=0.832) USER MOD Single : A 31 GLN : amide:sc= -0.0131 X(o=-0.013,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -0.283 X(o=-0.28,f=-0.36) USER MOD Single : A 41 GLN : amide:sc= -1.18 K(o=-1.2,f=-3!) USER MOD Single : A 48 LYS NZ :NH3+ -170:sc= 1.12 (180deg=1.04) USER MOD Single : A 49 GLN : amide:sc= 0.597 K(o=0.6,f=-4.4!) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0.345 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 70:sc= 0.279 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 GLN : amide:sc= 0.813 K(o=0.81,f=-0.0076) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot -130:sc= 0.331 USER MOD Single : A 66 THR OG1 : rot 50:sc= 0.0493 USER MOD Single : A 68 HIS : no HD1:sc= -1.59 X(o=-1.6,f=-1.5) USER MOD Single : B 332 TYR OH : rot 30:sc= 0.652 USER MOD Single : B 334 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 335 GLN : amide:sc= 1.38 K(o=1.4,f=-4.8!) USER MOD Single : B 340 ASN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : B 342 MET CE :methyl 178:sc= -0.287 (180deg=-0.315) USER MOD Single : B 350 ASN : amide:sc= 0.991 K(o=0.99,f=-2.8!) USER MOD Single : B 357 SER OG : rot 155:sc= 0.0704 USER MOD Single : B 360 SER OG : rot 180:sc= 0.373 USER MOD Single : B 362 GLN :FLIP amide:sc= -0.407 F(o=-1.5,f=-0.41) USER MOD Single : B 367 SER OG : rot 180:sc= 0 USER MOD Single : B 370 ASN : amide:sc= 1.11 K(o=1.1,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.348 14.074 -15.407 1.00 0.00 N ATOM 2 CA MET A 1 -2.268 12.782 -14.675 1.00 0.00 C ATOM 3 C MET A 1 -2.629 12.980 -13.199 1.00 0.00 C ATOM 4 O MET A 1 -2.328 14.013 -12.601 1.00 0.00 O ATOM 5 CB MET A 1 -0.889 12.107 -14.889 1.00 0.00 C ATOM 6 CG MET A 1 -0.545 10.919 -13.968 1.00 0.00 C ATOM 7 SD MET A 1 0.951 10.027 -14.493 1.00 0.00 S ATOM 8 CE MET A 1 1.087 8.744 -13.214 1.00 0.00 C ATOM 0 H1 MET A 1 -1.512 14.180 -16.017 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.208 14.089 -15.992 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.380 14.858 -14.725 1.00 0.00 H new ATOM 0 HA MET A 1 -3.005 12.091 -15.084 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.836 11.762 -15.922 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.117 12.866 -14.767 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.406 11.283 -12.950 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.386 10.226 -13.947 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.961 8.124 -13.412 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.190 9.214 -12.236 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.192 8.123 -13.225 1.00 0.00 H new ATOM 20 N GLN A 2 -3.296 11.986 -12.609 1.00 0.00 N ATOM 21 CA GLN A 2 -3.571 11.873 -11.169 1.00 0.00 C ATOM 22 C GLN A 2 -3.308 10.445 -10.696 1.00 0.00 C ATOM 23 O GLN A 2 -3.256 9.525 -11.511 1.00 0.00 O ATOM 24 CB GLN A 2 -5.027 12.280 -10.858 1.00 0.00 C ATOM 25 CG GLN A 2 -6.064 11.261 -11.352 1.00 0.00 C ATOM 26 CD GLN A 2 -7.477 11.842 -11.318 1.00 0.00 C ATOM 27 OE1 GLN A 2 -7.981 12.377 -12.297 1.00 0.00 O ATOM 28 NE2 GLN A 2 -8.169 11.769 -10.201 1.00 0.00 N ATOM 0 H GLN A 2 -3.677 11.203 -13.141 1.00 0.00 H new ATOM 0 HA GLN A 2 -2.905 12.551 -10.635 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -5.139 12.408 -9.781 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -5.232 13.247 -11.317 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -5.819 10.955 -12.369 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -6.022 10.366 -10.731 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -7.762 11.326 -9.377 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -9.112 12.155 -10.159 1.00 0.00 H new ATOM 37 N ILE A 3 -3.231 10.258 -9.385 1.00 0.00 N ATOM 38 CA ILE A 3 -3.194 8.957 -8.698 1.00 0.00 C ATOM 39 C ILE A 3 -3.972 9.032 -7.378 1.00 0.00 C ATOM 40 O ILE A 3 -4.338 10.114 -6.921 1.00 0.00 O ATOM 41 CB ILE A 3 -1.740 8.465 -8.477 1.00 0.00 C ATOM 42 CG1 ILE A 3 -0.890 9.400 -7.584 1.00 0.00 C ATOM 43 CG2 ILE A 3 -1.022 8.253 -9.820 1.00 0.00 C ATOM 44 CD1 ILE A 3 -0.717 8.897 -6.150 1.00 0.00 C ATOM 0 H ILE A 3 -3.190 11.042 -8.733 1.00 0.00 H new ATOM 0 HA ILE A 3 -3.679 8.221 -9.339 1.00 0.00 H new ATOM 0 HB ILE A 3 -1.835 7.518 -7.946 1.00 0.00 H new ATOM 0 HG12 ILE A 3 0.094 9.523 -8.037 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -1.355 10.385 -7.560 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -0.004 7.908 -9.638 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.559 7.507 -10.406 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -0.993 9.194 -10.370 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -0.110 9.606 -5.587 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -1.695 8.801 -5.678 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -0.223 7.926 -6.162 1.00 0.00 H new ATOM 56 N PHE A 4 -4.222 7.886 -6.752 1.00 0.00 N ATOM 57 CA PHE A 4 -4.923 7.752 -5.477 1.00 0.00 C ATOM 58 C PHE A 4 -4.050 6.964 -4.489 1.00 0.00 C ATOM 59 O PHE A 4 -3.276 6.096 -4.904 1.00 0.00 O ATOM 60 CB PHE A 4 -6.286 7.065 -5.687 1.00 0.00 C ATOM 61 CG PHE A 4 -7.306 7.788 -6.557 1.00 0.00 C ATOM 62 CD1 PHE A 4 -7.100 7.916 -7.944 1.00 0.00 C ATOM 63 CD2 PHE A 4 -8.507 8.263 -5.997 1.00 0.00 C ATOM 64 CE1 PHE A 4 -8.064 8.535 -8.761 1.00 0.00 C ATOM 65 CE2 PHE A 4 -9.477 8.877 -6.811 1.00 0.00 C ATOM 66 CZ PHE A 4 -9.253 9.019 -8.192 1.00 0.00 C ATOM 0 H PHE A 4 -3.930 6.987 -7.135 1.00 0.00 H new ATOM 0 HA PHE A 4 -5.110 8.742 -5.060 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -6.105 6.083 -6.125 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -6.735 6.900 -4.708 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -6.191 7.535 -8.386 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -8.685 8.156 -4.937 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -7.890 8.637 -9.822 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -10.396 9.240 -6.374 1.00 0.00 H new ATOM 0 HZ PHE A 4 -9.994 9.499 -8.814 1.00 0.00 H new ATOM 76 N VAL A 5 -4.174 7.245 -3.188 1.00 0.00 N ATOM 77 CA VAL A 5 -3.373 6.608 -2.124 1.00 0.00 C ATOM 78 C VAL A 5 -4.262 6.213 -0.953 1.00 0.00 C ATOM 79 O VAL A 5 -4.991 7.043 -0.425 1.00 0.00 O ATOM 80 CB VAL A 5 -2.220 7.491 -1.609 1.00 0.00 C ATOM 81 CG1 VAL A 5 -1.055 6.584 -1.208 1.00 0.00 C ATOM 82 CG2 VAL A 5 -1.670 8.488 -2.623 1.00 0.00 C ATOM 0 H VAL A 5 -4.841 7.930 -2.834 1.00 0.00 H new ATOM 0 HA VAL A 5 -2.924 5.724 -2.578 1.00 0.00 H new ATOM 0 HB VAL A 5 -2.639 8.065 -0.783 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -0.229 7.193 -0.841 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -1.379 5.901 -0.423 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -0.725 6.011 -2.074 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -0.863 9.062 -2.168 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -1.288 7.951 -3.491 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -2.465 9.165 -2.936 1.00 0.00 H new ATOM 92 N LYS A 6 -4.207 4.954 -0.528 1.00 0.00 N ATOM 93 CA LYS A 6 -5.147 4.351 0.421 1.00 0.00 C ATOM 94 C LYS A 6 -4.479 3.886 1.725 1.00 0.00 C ATOM 95 O LYS A 6 -3.524 3.111 1.697 1.00 0.00 O ATOM 96 CB LYS A 6 -5.855 3.237 -0.362 1.00 0.00 C ATOM 97 CG LYS A 6 -7.303 3.009 0.049 1.00 0.00 C ATOM 98 CD LYS A 6 -7.465 2.361 1.420 1.00 0.00 C ATOM 99 CE LYS A 6 -8.874 1.762 1.466 1.00 0.00 C ATOM 100 NZ LYS A 6 -8.942 0.432 0.805 1.00 0.00 N ATOM 0 H LYS A 6 -3.487 4.303 -0.842 1.00 0.00 H new ATOM 0 HA LYS A 6 -5.872 5.079 0.786 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -5.824 3.479 -1.424 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -5.301 2.307 -0.231 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -7.825 3.966 0.047 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -7.787 2.380 -0.698 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -6.712 1.588 1.573 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -7.332 3.097 2.213 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.192 1.666 2.504 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -9.572 2.443 0.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -9.937 0.165 0.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -8.461 0.477 -0.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -8.475 -0.278 1.405 1.00 0.00 H new ATOM 114 N THR A 7 -4.914 4.406 2.873 1.00 0.00 N ATOM 115 CA THR A 7 -4.331 4.077 4.192 1.00 0.00 C ATOM 116 C THR A 7 -4.584 2.621 4.612 1.00 0.00 C ATOM 117 O THR A 7 -5.502 1.960 4.115 1.00 0.00 O ATOM 118 CB THR A 7 -4.834 5.013 5.311 1.00 0.00 C ATOM 119 OG1 THR A 7 -6.174 4.755 5.666 1.00 0.00 O ATOM 120 CG2 THR A 7 -4.780 6.494 4.955 1.00 0.00 C ATOM 0 H THR A 7 -5.685 5.072 2.924 1.00 0.00 H new ATOM 0 HA THR A 7 -3.258 4.221 4.063 1.00 0.00 H new ATOM 0 HB THR A 7 -4.150 4.801 6.133 1.00 0.00 H new ATOM 0 HG1 THR A 7 -6.498 5.465 6.259 1.00 0.00 H new ATOM 0 HG21 THR A 7 -5.150 7.084 5.794 1.00 0.00 H new ATOM 0 HG22 THR A 7 -3.750 6.779 4.738 1.00 0.00 H new ATOM 0 HG23 THR A 7 -5.401 6.680 4.078 1.00 0.00 H new ATOM 128 N LEU A 8 -3.815 2.124 5.590 1.00 0.00 N ATOM 129 CA LEU A 8 -4.065 0.832 6.254 1.00 0.00 C ATOM 130 C LEU A 8 -5.337 0.847 7.128 1.00 0.00 C ATOM 131 O LEU A 8 -5.919 -0.213 7.371 1.00 0.00 O ATOM 132 CB LEU A 8 -2.850 0.436 7.111 1.00 0.00 C ATOM 133 CG LEU A 8 -1.560 0.159 6.317 1.00 0.00 C ATOM 134 CD1 LEU A 8 -0.380 0.067 7.283 1.00 0.00 C ATOM 135 CD2 LEU A 8 -1.614 -1.152 5.527 1.00 0.00 C ATOM 0 H LEU A 8 -2.993 2.610 5.948 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.223 0.096 5.466 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.654 1.233 7.828 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.104 -0.455 7.686 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.448 0.982 5.611 1.00 0.00 H new ATOM 0 HD11 LEU A 8 0.534 -0.129 6.723 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -0.279 1.007 7.825 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.552 -0.743 7.992 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.677 -1.291 4.989 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.765 -1.985 6.214 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -2.439 -1.114 4.815 1.00 0.00 H new ATOM 147 N THR A 9 -5.800 2.027 7.555 1.00 0.00 N ATOM 148 CA THR A 9 -7.088 2.233 8.246 1.00 0.00 C ATOM 149 C THR A 9 -8.274 2.102 7.280 1.00 0.00 C ATOM 150 O THR A 9 -9.256 1.430 7.602 1.00 0.00 O ATOM 151 CB THR A 9 -7.127 3.614 8.928 1.00 0.00 C ATOM 152 OG1 THR A 9 -5.965 3.817 9.707 1.00 0.00 O ATOM 153 CG2 THR A 9 -8.331 3.784 9.855 1.00 0.00 C ATOM 0 H THR A 9 -5.277 2.894 7.428 1.00 0.00 H new ATOM 0 HA THR A 9 -7.175 1.455 9.005 1.00 0.00 H new ATOM 0 HB THR A 9 -7.195 4.341 8.118 1.00 0.00 H new ATOM 0 HG1 THR A 9 -6.006 4.699 10.131 1.00 0.00 H new ATOM 0 HG21 THR A 9 -8.305 4.776 10.307 1.00 0.00 H new ATOM 0 HG22 THR A 9 -9.251 3.671 9.281 1.00 0.00 H new ATOM 0 HG23 THR A 9 -8.297 3.027 10.639 1.00 0.00 H new ATOM 161 N GLY A 10 -8.181 2.708 6.088 1.00 0.00 N ATOM 162 CA GLY A 10 -9.124 2.533 4.978 1.00 0.00 C ATOM 163 C GLY A 10 -9.546 3.804 4.216 1.00 0.00 C ATOM 164 O GLY A 10 -10.449 3.732 3.380 1.00 0.00 O ATOM 0 H GLY A 10 -7.423 3.353 5.864 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -8.681 1.840 4.263 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.023 2.057 5.369 1.00 0.00 H new ATOM 168 N LYS A 11 -8.926 4.962 4.477 1.00 0.00 N ATOM 169 CA LYS A 11 -9.158 6.245 3.790 1.00 0.00 C ATOM 170 C LYS A 11 -8.465 6.270 2.425 1.00 0.00 C ATOM 171 O LYS A 11 -7.299 5.898 2.330 1.00 0.00 O ATOM 172 CB LYS A 11 -8.627 7.372 4.700 1.00 0.00 C ATOM 173 CG LYS A 11 -8.603 8.782 4.082 1.00 0.00 C ATOM 174 CD LYS A 11 -9.983 9.271 3.621 1.00 0.00 C ATOM 175 CE LYS A 11 -9.950 10.699 3.051 1.00 0.00 C ATOM 176 NZ LYS A 11 -9.734 11.733 4.096 1.00 0.00 N ATOM 0 H LYS A 11 -8.216 5.036 5.206 1.00 0.00 H new ATOM 0 HA LYS A 11 -10.223 6.383 3.606 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -9.238 7.402 5.602 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.614 7.115 5.010 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -8.203 9.484 4.814 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.922 8.786 3.231 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -10.369 8.591 2.862 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -10.675 9.236 4.462 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -9.156 10.770 2.307 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -10.889 10.901 2.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -10.127 12.640 3.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -10.209 11.443 4.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.715 11.841 4.273 1.00 0.00 H new ATOM 190 N THR A 12 -9.146 6.775 1.398 1.00 0.00 N ATOM 191 CA THR A 12 -8.609 6.997 0.043 1.00 0.00 C ATOM 192 C THR A 12 -8.348 8.487 -0.201 1.00 0.00 C ATOM 193 O THR A 12 -9.270 9.305 -0.198 1.00 0.00 O ATOM 194 CB THR A 12 -9.557 6.463 -1.044 1.00 0.00 C ATOM 195 OG1 THR A 12 -10.014 5.163 -0.727 1.00 0.00 O ATOM 196 CG2 THR A 12 -8.853 6.373 -2.399 1.00 0.00 C ATOM 0 H THR A 12 -10.124 7.053 1.483 1.00 0.00 H new ATOM 0 HA THR A 12 -7.670 6.447 -0.018 1.00 0.00 H new ATOM 0 HB THR A 12 -10.392 7.162 -1.094 1.00 0.00 H new ATOM 0 HG1 THR A 12 -10.616 4.847 -1.433 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.549 5.992 -3.146 1.00 0.00 H new ATOM 0 HG22 THR A 12 -8.508 7.363 -2.696 1.00 0.00 H new ATOM 0 HG23 THR A 12 -8.000 5.699 -2.322 1.00 0.00 H new ATOM 204 N ILE A 13 -7.081 8.840 -0.398 1.00 0.00 N ATOM 205 CA ILE A 13 -6.580 10.147 -0.851 1.00 0.00 C ATOM 206 C ILE A 13 -6.530 10.177 -2.388 1.00 0.00 C ATOM 207 O ILE A 13 -6.411 9.131 -3.028 1.00 0.00 O ATOM 208 CB ILE A 13 -5.162 10.413 -0.270 1.00 0.00 C ATOM 209 CG1 ILE A 13 -5.003 10.012 1.219 1.00 0.00 C ATOM 210 CG2 ILE A 13 -4.752 11.889 -0.438 1.00 0.00 C ATOM 211 CD1 ILE A 13 -5.932 10.763 2.177 1.00 0.00 C ATOM 0 H ILE A 13 -6.320 8.180 -0.236 1.00 0.00 H new ATOM 0 HA ILE A 13 -7.254 10.926 -0.496 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.501 9.770 -0.852 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -5.188 8.942 1.317 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -3.970 10.186 1.522 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -3.756 12.040 -0.021 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -4.745 12.146 -1.497 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -5.465 12.526 0.085 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -5.755 10.422 3.197 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -5.733 11.833 2.112 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.969 10.569 1.904 1.00 0.00 H new ATOM 223 N THR A 14 -6.530 11.370 -2.984 1.00 0.00 N ATOM 224 CA THR A 14 -6.315 11.614 -4.423 1.00 0.00 C ATOM 225 C THR A 14 -5.288 12.735 -4.602 1.00 0.00 C ATOM 226 O THR A 14 -5.353 13.745 -3.901 1.00 0.00 O ATOM 227 CB THR A 14 -7.621 12.022 -5.125 1.00 0.00 C ATOM 228 OG1 THR A 14 -8.714 11.227 -4.715 1.00 0.00 O ATOM 229 CG2 THR A 14 -7.501 11.870 -6.644 1.00 0.00 C ATOM 0 H THR A 14 -6.686 12.232 -2.462 1.00 0.00 H new ATOM 0 HA THR A 14 -5.954 10.688 -4.870 1.00 0.00 H new ATOM 0 HB THR A 14 -7.793 13.063 -4.850 1.00 0.00 H new ATOM 0 HG1 THR A 14 -8.716 10.388 -5.221 1.00 0.00 H new ATOM 0 HG21 THR A 14 -8.439 12.165 -7.114 1.00 0.00 H new ATOM 0 HG22 THR A 14 -6.695 12.506 -7.011 1.00 0.00 H new ATOM 0 HG23 THR A 14 -7.284 10.831 -6.890 1.00 0.00 H new ATOM 237 N LEU A 15 -4.340 12.569 -5.525 1.00 0.00 N ATOM 238 CA LEU A 15 -3.206 13.468 -5.767 1.00 0.00 C ATOM 239 C LEU A 15 -3.005 13.783 -7.261 1.00 0.00 C ATOM 240 O LEU A 15 -3.389 13.001 -8.129 1.00 0.00 O ATOM 241 CB LEU A 15 -1.934 12.775 -5.255 1.00 0.00 C ATOM 242 CG LEU A 15 -1.855 12.525 -3.742 1.00 0.00 C ATOM 243 CD1 LEU A 15 -0.559 11.759 -3.502 1.00 0.00 C ATOM 244 CD2 LEU A 15 -1.880 13.836 -2.953 1.00 0.00 C ATOM 0 H LEU A 15 -4.340 11.767 -6.155 1.00 0.00 H new ATOM 0 HA LEU A 15 -3.409 14.407 -5.251 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.838 11.817 -5.765 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -1.075 13.379 -5.547 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.718 11.955 -3.398 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -0.450 11.553 -2.437 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.585 10.819 -4.053 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.286 12.357 -3.844 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -1.822 13.620 -1.886 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -1.030 14.452 -3.245 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.806 14.371 -3.165 1.00 0.00 H new ATOM 256 N GLU A 16 -2.303 14.880 -7.559 1.00 0.00 N ATOM 257 CA GLU A 16 -1.937 15.323 -8.913 1.00 0.00 C ATOM 258 C GLU A 16 -0.411 15.238 -9.126 1.00 0.00 C ATOM 259 O GLU A 16 0.355 16.024 -8.562 1.00 0.00 O ATOM 260 CB GLU A 16 -2.491 16.738 -9.153 1.00 0.00 C ATOM 261 CG GLU A 16 -2.329 17.189 -10.611 1.00 0.00 C ATOM 262 CD GLU A 16 -2.901 18.604 -10.818 1.00 0.00 C ATOM 263 OE1 GLU A 16 -4.120 18.740 -11.089 1.00 0.00 O ATOM 264 OE2 GLU A 16 -2.137 19.596 -10.721 1.00 0.00 O ATOM 0 H GLU A 16 -1.959 15.512 -6.836 1.00 0.00 H new ATOM 0 HA GLU A 16 -2.385 14.658 -9.652 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.547 16.763 -8.883 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.978 17.442 -8.498 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.274 17.176 -10.884 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.838 16.487 -11.271 1.00 0.00 H new ATOM 271 N VAL A 17 0.031 14.255 -9.918 1.00 0.00 N ATOM 272 CA VAL A 17 1.444 13.953 -10.239 1.00 0.00 C ATOM 273 C VAL A 17 1.663 13.739 -11.745 1.00 0.00 C ATOM 274 O VAL A 17 0.718 13.710 -12.532 1.00 0.00 O ATOM 275 CB VAL A 17 1.906 12.685 -9.483 1.00 0.00 C ATOM 276 CG1 VAL A 17 2.051 12.912 -7.973 1.00 0.00 C ATOM 277 CG2 VAL A 17 0.954 11.516 -9.763 1.00 0.00 C ATOM 0 H VAL A 17 -0.613 13.612 -10.379 1.00 0.00 H new ATOM 0 HA VAL A 17 2.031 14.816 -9.925 1.00 0.00 H new ATOM 0 HB VAL A 17 2.899 12.438 -9.860 1.00 0.00 H new ATOM 0 HG11 VAL A 17 2.377 11.988 -7.496 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.788 13.694 -7.792 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.090 13.216 -7.557 1.00 0.00 H new ATOM 0 HG21 VAL A 17 1.294 10.632 -9.223 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.051 11.778 -9.433 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.941 11.305 -10.832 1.00 0.00 H new ATOM 287 N GLU A 18 2.914 13.545 -12.148 1.00 0.00 N ATOM 288 CA GLU A 18 3.360 13.102 -13.474 1.00 0.00 C ATOM 289 C GLU A 18 4.039 11.732 -13.346 1.00 0.00 C ATOM 290 O GLU A 18 4.536 11.379 -12.278 1.00 0.00 O ATOM 291 CB GLU A 18 4.372 14.104 -14.053 1.00 0.00 C ATOM 292 CG GLU A 18 3.702 15.404 -14.506 1.00 0.00 C ATOM 293 CD GLU A 18 4.718 16.352 -15.170 1.00 0.00 C ATOM 294 OE1 GLU A 18 4.936 16.248 -16.403 1.00 0.00 O ATOM 295 OE2 GLU A 18 5.302 17.218 -14.472 1.00 0.00 O ATOM 0 H GLU A 18 3.700 13.702 -11.518 1.00 0.00 H new ATOM 0 HA GLU A 18 2.496 13.036 -14.136 1.00 0.00 H new ATOM 0 HB2 GLU A 18 5.128 14.330 -13.301 1.00 0.00 H new ATOM 0 HB3 GLU A 18 4.888 13.649 -14.898 1.00 0.00 H new ATOM 0 HG2 GLU A 18 2.900 15.177 -15.208 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.245 15.899 -13.649 1.00 0.00 H new ATOM 302 N SER A 19 4.170 10.979 -14.441 1.00 0.00 N ATOM 303 CA SER A 19 4.893 9.693 -14.454 1.00 0.00 C ATOM 304 C SER A 19 6.379 9.806 -14.055 1.00 0.00 C ATOM 305 O SER A 19 7.004 8.799 -13.709 1.00 0.00 O ATOM 306 CB SER A 19 4.747 9.030 -15.829 1.00 0.00 C ATOM 307 OG SER A 19 5.226 9.884 -16.859 1.00 0.00 O ATOM 0 H SER A 19 3.780 11.239 -15.347 1.00 0.00 H new ATOM 0 HA SER A 19 4.433 9.069 -13.688 1.00 0.00 H new ATOM 0 HB2 SER A 19 5.299 8.090 -15.844 1.00 0.00 H new ATOM 0 HB3 SER A 19 3.700 8.787 -16.010 1.00 0.00 H new ATOM 0 HG SER A 19 5.124 9.439 -17.726 1.00 0.00 H new ATOM 313 N SER A 20 6.924 11.028 -14.038 1.00 0.00 N ATOM 314 CA SER A 20 8.296 11.380 -13.647 1.00 0.00 C ATOM 315 C SER A 20 8.435 11.776 -12.168 1.00 0.00 C ATOM 316 O SER A 20 9.561 11.931 -11.690 1.00 0.00 O ATOM 317 CB SER A 20 8.800 12.547 -14.510 1.00 0.00 C ATOM 318 OG SER A 20 8.744 12.239 -15.897 1.00 0.00 O ATOM 0 H SER A 20 6.386 11.849 -14.314 1.00 0.00 H new ATOM 0 HA SER A 20 8.892 10.481 -13.802 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.199 13.434 -14.310 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.826 12.788 -14.232 1.00 0.00 H new ATOM 0 HG SER A 20 9.070 13.004 -16.415 1.00 0.00 H new ATOM 324 N ASP A 21 7.333 11.931 -11.420 1.00 0.00 N ATOM 325 CA ASP A 21 7.385 12.096 -9.958 1.00 0.00 C ATOM 326 C ASP A 21 8.040 10.864 -9.312 1.00 0.00 C ATOM 327 O ASP A 21 7.748 9.724 -9.690 1.00 0.00 O ATOM 328 CB ASP A 21 5.989 12.297 -9.338 1.00 0.00 C ATOM 329 CG ASP A 21 5.504 13.754 -9.361 1.00 0.00 C ATOM 330 OD1 ASP A 21 5.082 14.242 -10.432 1.00 0.00 O ATOM 331 OD2 ASP A 21 5.501 14.404 -8.287 1.00 0.00 O ATOM 0 H ASP A 21 6.389 11.946 -11.805 1.00 0.00 H new ATOM 0 HA ASP A 21 7.975 12.992 -9.763 1.00 0.00 H new ATOM 0 HB2 ASP A 21 5.271 11.676 -9.874 1.00 0.00 H new ATOM 0 HB3 ASP A 21 6.006 11.946 -8.306 1.00 0.00 H new ATOM 336 N THR A 22 8.913 11.078 -8.324 1.00 0.00 N ATOM 337 CA THR A 22 9.454 9.996 -7.490 1.00 0.00 C ATOM 338 C THR A 22 8.465 9.532 -6.416 1.00 0.00 C ATOM 339 O THR A 22 7.520 10.239 -6.067 1.00 0.00 O ATOM 340 CB THR A 22 10.781 10.380 -6.822 1.00 0.00 C ATOM 341 OG1 THR A 22 10.585 11.497 -5.990 1.00 0.00 O ATOM 342 CG2 THR A 22 11.868 10.724 -7.838 1.00 0.00 C ATOM 0 H THR A 22 9.265 12.003 -8.078 1.00 0.00 H new ATOM 0 HA THR A 22 9.634 9.170 -8.177 1.00 0.00 H new ATOM 0 HB THR A 22 11.110 9.514 -6.249 1.00 0.00 H new ATOM 0 HG1 THR A 22 11.433 11.740 -5.563 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.786 10.988 -7.313 1.00 0.00 H new ATOM 0 HG22 THR A 22 12.052 9.862 -8.480 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.543 11.567 -8.447 1.00 0.00 H new ATOM 350 N ILE A 23 8.703 8.361 -5.825 1.00 0.00 N ATOM 351 CA ILE A 23 7.975 7.864 -4.649 1.00 0.00 C ATOM 352 C ILE A 23 8.074 8.864 -3.481 1.00 0.00 C ATOM 353 O ILE A 23 7.059 9.197 -2.870 1.00 0.00 O ATOM 354 CB ILE A 23 8.491 6.452 -4.297 1.00 0.00 C ATOM 355 CG1 ILE A 23 8.179 5.406 -5.393 1.00 0.00 C ATOM 356 CG2 ILE A 23 7.984 5.975 -2.929 1.00 0.00 C ATOM 357 CD1 ILE A 23 6.697 5.187 -5.711 1.00 0.00 C ATOM 0 H ILE A 23 9.421 7.716 -6.154 1.00 0.00 H new ATOM 0 HA ILE A 23 6.911 7.778 -4.870 1.00 0.00 H new ATOM 0 HB ILE A 23 9.576 6.543 -4.240 1.00 0.00 H new ATOM 0 HG12 ILE A 23 8.686 5.707 -6.310 1.00 0.00 H new ATOM 0 HG13 ILE A 23 8.610 4.452 -5.090 1.00 0.00 H new ATOM 0 HG21 ILE A 23 8.373 4.977 -2.725 1.00 0.00 H new ATOM 0 HG22 ILE A 23 8.324 6.663 -2.155 1.00 0.00 H new ATOM 0 HG23 ILE A 23 6.894 5.946 -2.935 1.00 0.00 H new ATOM 0 HD11 ILE A 23 6.600 4.433 -6.493 1.00 0.00 H new ATOM 0 HD12 ILE A 23 6.179 4.848 -4.814 1.00 0.00 H new ATOM 0 HD13 ILE A 23 6.256 6.123 -6.053 1.00 0.00 H new ATOM 369 N ASP A 24 9.263 9.415 -3.220 1.00 0.00 N ATOM 370 CA ASP A 24 9.479 10.538 -2.290 1.00 0.00 C ATOM 371 C ASP A 24 8.567 11.744 -2.590 1.00 0.00 C ATOM 372 O ASP A 24 7.913 12.287 -1.696 1.00 0.00 O ATOM 373 CB ASP A 24 10.950 10.960 -2.383 1.00 0.00 C ATOM 374 CG ASP A 24 11.245 12.263 -1.621 1.00 0.00 C ATOM 375 OD1 ASP A 24 11.539 12.206 -0.403 1.00 0.00 O ATOM 376 OD2 ASP A 24 11.198 13.346 -2.254 1.00 0.00 O ATOM 0 H ASP A 24 10.125 9.088 -3.657 1.00 0.00 H new ATOM 0 HA ASP A 24 9.228 10.202 -1.284 1.00 0.00 H new ATOM 0 HB2 ASP A 24 11.578 10.162 -1.986 1.00 0.00 H new ATOM 0 HB3 ASP A 24 11.221 11.088 -3.431 1.00 0.00 H new ATOM 381 N ASN A 25 8.509 12.154 -3.860 1.00 0.00 N ATOM 382 CA ASN A 25 7.708 13.286 -4.325 1.00 0.00 C ATOM 383 C ASN A 25 6.211 13.033 -4.157 1.00 0.00 C ATOM 384 O ASN A 25 5.468 13.980 -3.908 1.00 0.00 O ATOM 385 CB ASN A 25 8.012 13.567 -5.806 1.00 0.00 C ATOM 386 CG ASN A 25 9.272 14.384 -6.079 1.00 0.00 C ATOM 387 OD1 ASN A 25 9.421 14.963 -7.146 1.00 0.00 O ATOM 388 ND2 ASN A 25 10.212 14.486 -5.164 1.00 0.00 N ATOM 0 H ASN A 25 9.030 11.697 -4.609 1.00 0.00 H new ATOM 0 HA ASN A 25 7.976 14.149 -3.715 1.00 0.00 H new ATOM 0 HB2 ASN A 25 8.099 12.614 -6.327 1.00 0.00 H new ATOM 0 HB3 ASN A 25 7.160 14.091 -6.240 1.00 0.00 H new ATOM 0 HD21 ASN A 25 11.047 15.041 -5.351 1.00 0.00 H new ATOM 0 HD22 ASN A 25 10.105 14.010 -4.268 1.00 0.00 H new ATOM 395 N VAL A 26 5.762 11.785 -4.300 1.00 0.00 N ATOM 396 CA VAL A 26 4.368 11.375 -4.093 1.00 0.00 C ATOM 397 C VAL A 26 3.997 11.458 -2.620 1.00 0.00 C ATOM 398 O VAL A 26 3.031 12.146 -2.301 1.00 0.00 O ATOM 399 CB VAL A 26 4.090 9.968 -4.640 1.00 0.00 C ATOM 400 CG1 VAL A 26 2.631 9.562 -4.400 1.00 0.00 C ATOM 401 CG2 VAL A 26 4.372 9.899 -6.147 1.00 0.00 C ATOM 0 H VAL A 26 6.370 11.012 -4.569 1.00 0.00 H new ATOM 0 HA VAL A 26 3.743 12.069 -4.654 1.00 0.00 H new ATOM 0 HB VAL A 26 4.752 9.283 -4.111 1.00 0.00 H new ATOM 0 HG11 VAL A 26 2.462 8.561 -4.797 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.423 9.568 -3.330 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.970 10.268 -4.902 1.00 0.00 H new ATOM 0 HG21 VAL A 26 4.167 8.892 -6.510 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.732 10.610 -6.670 1.00 0.00 H new ATOM 0 HG23 VAL A 26 5.417 10.146 -6.333 1.00 0.00 H new ATOM 411 N LYS A 27 4.773 10.840 -1.711 1.00 0.00 N ATOM 412 CA LYS A 27 4.567 10.925 -0.248 1.00 0.00 C ATOM 413 C LYS A 27 4.383 12.366 0.222 1.00 0.00 C ATOM 414 O LYS A 27 3.489 12.680 1.006 1.00 0.00 O ATOM 415 CB LYS A 27 5.778 10.338 0.479 1.00 0.00 C ATOM 416 CG LYS A 27 5.948 8.832 0.292 1.00 0.00 C ATOM 417 CD LYS A 27 7.320 8.464 0.854 1.00 0.00 C ATOM 418 CE LYS A 27 7.547 6.969 0.713 1.00 0.00 C ATOM 419 NZ LYS A 27 8.722 6.556 1.519 1.00 0.00 N ATOM 0 H LYS A 27 5.571 10.260 -1.972 1.00 0.00 H new ATOM 0 HA LYS A 27 3.661 10.363 -0.018 1.00 0.00 H new ATOM 0 HB2 LYS A 27 6.679 10.841 0.127 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.688 10.553 1.544 1.00 0.00 H new ATOM 0 HG2 LYS A 27 5.160 8.287 0.812 1.00 0.00 H new ATOM 0 HG3 LYS A 27 5.879 8.564 -0.762 1.00 0.00 H new ATOM 0 HD2 LYS A 27 8.099 9.011 0.324 1.00 0.00 H new ATOM 0 HD3 LYS A 27 7.384 8.754 1.903 1.00 0.00 H new ATOM 0 HE2 LYS A 27 6.661 6.426 1.042 1.00 0.00 H new ATOM 0 HE3 LYS A 27 7.707 6.714 -0.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 8.943 5.558 1.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 9.540 7.147 1.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 8.508 6.673 2.530 1.00 0.00 H new ATOM 433 N SER A 28 5.222 13.243 -0.318 1.00 0.00 N ATOM 434 CA SER A 28 5.271 14.680 -0.046 1.00 0.00 C ATOM 435 C SER A 28 3.995 15.428 -0.455 1.00 0.00 C ATOM 436 O SER A 28 3.760 16.531 0.041 1.00 0.00 O ATOM 437 CB SER A 28 6.483 15.286 -0.763 1.00 0.00 C ATOM 438 OG SER A 28 7.693 14.752 -0.252 1.00 0.00 O ATOM 0 H SER A 28 5.928 12.956 -0.996 1.00 0.00 H new ATOM 0 HA SER A 28 5.358 14.797 1.034 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.415 15.086 -1.832 1.00 0.00 H new ATOM 0 HB3 SER A 28 6.479 16.369 -0.641 1.00 0.00 H new ATOM 0 HG SER A 28 7.884 13.897 -0.691 1.00 0.00 H new ATOM 444 N LYS A 29 3.132 14.842 -1.303 1.00 0.00 N ATOM 445 CA LYS A 29 1.830 15.419 -1.653 1.00 0.00 C ATOM 446 C LYS A 29 0.759 15.121 -0.603 1.00 0.00 C ATOM 447 O LYS A 29 -0.054 15.990 -0.312 1.00 0.00 O ATOM 448 CB LYS A 29 1.312 14.893 -2.986 1.00 0.00 C ATOM 449 CG LYS A 29 2.250 14.924 -4.177 1.00 0.00 C ATOM 450 CD LYS A 29 2.688 16.349 -4.527 1.00 0.00 C ATOM 451 CE LYS A 29 3.225 16.332 -5.952 1.00 0.00 C ATOM 452 NZ LYS A 29 4.597 15.764 -6.025 1.00 0.00 N ATOM 0 H LYS A 29 3.322 13.952 -1.764 1.00 0.00 H new ATOM 0 HA LYS A 29 2.005 16.493 -1.711 1.00 0.00 H new ATOM 0 HB2 LYS A 29 0.995 13.861 -2.837 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.422 15.465 -3.247 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.130 14.317 -3.961 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.756 14.475 -5.039 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.848 17.039 -4.443 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.455 16.695 -3.834 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.557 15.747 -6.584 1.00 0.00 H new ATOM 0 HE3 LYS A 29 3.232 17.347 -6.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 4.706 15.233 -6.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.294 16.535 -5.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 4.752 15.126 -5.218 1.00 0.00 H new ATOM 466 N ILE A 30 0.748 13.918 -0.010 1.00 0.00 N ATOM 467 CA ILE A 30 -0.212 13.520 1.045 1.00 0.00 C ATOM 468 C ILE A 30 -0.167 14.485 2.245 1.00 0.00 C ATOM 469 O ILE A 30 -1.180 14.738 2.900 1.00 0.00 O ATOM 470 CB ILE A 30 0.024 12.061 1.506 1.00 0.00 C ATOM 471 CG1 ILE A 30 -0.309 11.032 0.400 1.00 0.00 C ATOM 472 CG2 ILE A 30 -0.842 11.718 2.728 1.00 0.00 C ATOM 473 CD1 ILE A 30 0.971 10.556 -0.280 1.00 0.00 C ATOM 0 H ILE A 30 1.411 13.181 -0.249 1.00 0.00 H new ATOM 0 HA ILE A 30 -1.209 13.577 0.607 1.00 0.00 H new ATOM 0 HB ILE A 30 1.084 12.000 1.753 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -0.838 10.182 0.831 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -0.975 11.482 -0.336 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.655 10.687 3.029 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -0.591 12.387 3.551 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.895 11.836 2.472 1.00 0.00 H new ATOM 0 HD11 ILE A 30 0.723 9.832 -1.056 1.00 0.00 H new ATOM 0 HD12 ILE A 30 1.483 11.407 -0.728 1.00 0.00 H new ATOM 0 HD13 ILE A 30 1.623 10.088 0.458 1.00 0.00 H new ATOM 485 N GLN A 31 0.993 15.091 2.499 1.00 0.00 N ATOM 486 CA GLN A 31 1.177 16.113 3.539 1.00 0.00 C ATOM 487 C GLN A 31 0.323 17.383 3.299 1.00 0.00 C ATOM 488 O GLN A 31 0.079 18.156 4.223 1.00 0.00 O ATOM 489 CB GLN A 31 2.679 16.414 3.663 1.00 0.00 C ATOM 490 CG GLN A 31 3.036 17.327 4.843 1.00 0.00 C ATOM 491 CD GLN A 31 4.544 17.408 5.063 1.00 0.00 C ATOM 492 OE1 GLN A 31 5.320 17.796 4.198 1.00 0.00 O ATOM 493 NE2 GLN A 31 5.012 17.050 6.238 1.00 0.00 N ATOM 0 H GLN A 31 1.847 14.885 1.981 1.00 0.00 H new ATOM 0 HA GLN A 31 0.811 15.724 4.489 1.00 0.00 H new ATOM 0 HB2 GLN A 31 3.220 15.474 3.767 1.00 0.00 H new ATOM 0 HB3 GLN A 31 3.024 16.879 2.739 1.00 0.00 H new ATOM 0 HG2 GLN A 31 2.641 18.327 4.661 1.00 0.00 H new ATOM 0 HG3 GLN A 31 2.556 16.955 5.748 1.00 0.00 H new ATOM 0 HE21 GLN A 31 4.373 16.726 6.964 1.00 0.00 H new ATOM 0 HE22 GLN A 31 6.014 17.097 6.424 1.00 0.00 H new ATOM 502 N ASP A 32 -0.206 17.573 2.088 1.00 0.00 N ATOM 503 CA ASP A 32 -1.174 18.628 1.743 1.00 0.00 C ATOM 504 C ASP A 32 -2.638 18.233 2.043 1.00 0.00 C ATOM 505 O ASP A 32 -3.503 19.099 2.198 1.00 0.00 O ATOM 506 CB ASP A 32 -1.019 18.952 0.250 1.00 0.00 C ATOM 507 CG ASP A 32 -1.738 20.253 -0.148 1.00 0.00 C ATOM 508 OD1 ASP A 32 -1.319 21.342 0.313 1.00 0.00 O ATOM 509 OD2 ASP A 32 -2.703 20.194 -0.948 1.00 0.00 O ATOM 0 H ASP A 32 0.032 16.981 1.293 1.00 0.00 H new ATOM 0 HA ASP A 32 -0.958 19.497 2.364 1.00 0.00 H new ATOM 0 HB2 ASP A 32 0.040 19.037 0.008 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -1.415 18.126 -0.341 1.00 0.00 H new ATOM 514 N LYS A 33 -2.916 16.924 2.126 1.00 0.00 N ATOM 515 CA LYS A 33 -4.258 16.311 2.195 1.00 0.00 C ATOM 516 C LYS A 33 -4.630 15.843 3.609 1.00 0.00 C ATOM 517 O LYS A 33 -5.782 15.973 4.021 1.00 0.00 O ATOM 518 CB LYS A 33 -4.356 15.130 1.201 1.00 0.00 C ATOM 519 CG LYS A 33 -3.615 15.299 -0.139 1.00 0.00 C ATOM 520 CD LYS A 33 -4.029 16.515 -0.974 1.00 0.00 C ATOM 521 CE LYS A 33 -5.244 16.226 -1.859 1.00 0.00 C ATOM 522 NZ LYS A 33 -5.760 17.465 -2.498 1.00 0.00 N ATOM 0 H LYS A 33 -2.174 16.224 2.148 1.00 0.00 H new ATOM 0 HA LYS A 33 -4.973 17.086 1.920 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.972 14.236 1.693 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.410 14.949 0.988 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -2.546 15.366 0.063 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.771 14.400 -0.736 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.256 17.349 -0.310 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -3.192 16.825 -1.600 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -4.971 15.505 -2.629 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -6.032 15.769 -1.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -6.583 17.233 -3.090 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -6.043 18.143 -1.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -5.016 17.887 -3.089 1.00 0.00 H new ATOM 536 N GLU A 34 -3.654 15.318 4.353 1.00 0.00 N ATOM 537 CA GLU A 34 -3.789 14.794 5.726 1.00 0.00 C ATOM 538 C GLU A 34 -2.720 15.336 6.690 1.00 0.00 C ATOM 539 O GLU A 34 -2.938 15.368 7.903 1.00 0.00 O ATOM 540 CB GLU A 34 -3.678 13.259 5.707 1.00 0.00 C ATOM 541 CG GLU A 34 -4.832 12.542 4.996 1.00 0.00 C ATOM 542 CD GLU A 34 -6.199 12.643 5.709 1.00 0.00 C ATOM 543 OE1 GLU A 34 -6.273 13.022 6.903 1.00 0.00 O ATOM 544 OE2 GLU A 34 -7.226 12.304 5.072 1.00 0.00 O ATOM 0 H GLU A 34 -2.699 15.240 4.003 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.764 15.123 6.085 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -2.742 12.982 5.222 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -3.623 12.900 6.735 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.932 12.953 3.991 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -4.573 11.489 4.886 1.00 0.00 H new ATOM 551 N GLY A 35 -1.563 15.760 6.166 1.00 0.00 N ATOM 552 CA GLY A 35 -0.435 16.274 6.960 1.00 0.00 C ATOM 553 C GLY A 35 0.631 15.227 7.316 1.00 0.00 C ATOM 554 O GLY A 35 1.552 15.522 8.078 1.00 0.00 O ATOM 0 H GLY A 35 -1.379 15.756 5.163 1.00 0.00 H new ATOM 0 HA2 GLY A 35 0.041 17.084 6.407 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -0.824 16.704 7.883 1.00 0.00 H new ATOM 558 N ILE A 36 0.516 14.008 6.776 1.00 0.00 N ATOM 559 CA ILE A 36 1.378 12.854 7.084 1.00 0.00 C ATOM 560 C ILE A 36 2.812 13.110 6.579 1.00 0.00 C ATOM 561 O ILE A 36 3.005 13.294 5.373 1.00 0.00 O ATOM 562 CB ILE A 36 0.790 11.557 6.487 1.00 0.00 C ATOM 563 CG1 ILE A 36 -0.593 11.249 7.116 1.00 0.00 C ATOM 564 CG2 ILE A 36 1.747 10.373 6.735 1.00 0.00 C ATOM 565 CD1 ILE A 36 -1.443 10.286 6.282 1.00 0.00 C ATOM 0 H ILE A 36 -0.204 13.787 6.088 1.00 0.00 H new ATOM 0 HA ILE A 36 1.420 12.726 8.166 1.00 0.00 H new ATOM 0 HB ILE A 36 0.667 11.699 5.413 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -0.445 10.824 8.109 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -1.140 12.183 7.247 1.00 0.00 H new ATOM 0 HG21 ILE A 36 1.320 9.465 6.309 1.00 0.00 H new ATOM 0 HG22 ILE A 36 2.709 10.578 6.264 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.889 10.239 7.807 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -2.396 10.116 6.782 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.622 10.718 5.297 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.917 9.338 6.172 1.00 0.00 H new ATOM 577 N PRO A 37 3.827 13.119 7.465 1.00 0.00 N ATOM 578 CA PRO A 37 5.199 13.462 7.099 1.00 0.00 C ATOM 579 C PRO A 37 5.831 12.412 6.166 1.00 0.00 C ATOM 580 O PRO A 37 5.819 11.223 6.502 1.00 0.00 O ATOM 581 CB PRO A 37 5.969 13.596 8.416 1.00 0.00 C ATOM 582 CG PRO A 37 5.118 12.875 9.458 1.00 0.00 C ATOM 583 CD PRO A 37 3.720 12.782 8.876 1.00 0.00 C ATOM 0 HA PRO A 37 5.228 14.393 6.532 1.00 0.00 H new ATOM 0 HB2 PRO A 37 6.960 13.148 8.339 1.00 0.00 H new ATOM 0 HB3 PRO A 37 6.113 14.643 8.682 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.518 11.883 9.668 1.00 0.00 H new ATOM 0 HG3 PRO A 37 5.111 13.422 10.401 1.00 0.00 H new ATOM 0 HD2 PRO A 37 3.314 11.778 9.004 1.00 0.00 H new ATOM 0 HD3 PRO A 37 3.043 13.467 9.386 1.00 0.00 H new ATOM 591 N PRO A 38 6.422 12.809 5.020 1.00 0.00 N ATOM 592 CA PRO A 38 6.971 11.883 4.022 1.00 0.00 C ATOM 593 C PRO A 38 8.174 11.030 4.476 1.00 0.00 C ATOM 594 O PRO A 38 8.599 10.157 3.719 1.00 0.00 O ATOM 595 CB PRO A 38 7.302 12.742 2.793 1.00 0.00 C ATOM 596 CG PRO A 38 7.464 14.152 3.345 1.00 0.00 C ATOM 597 CD PRO A 38 6.476 14.174 4.507 1.00 0.00 C ATOM 0 HA PRO A 38 6.224 11.117 3.813 1.00 0.00 H new ATOM 0 HB2 PRO A 38 8.214 12.400 2.304 1.00 0.00 H new ATOM 0 HB3 PRO A 38 6.506 12.696 2.050 1.00 0.00 H new ATOM 0 HG2 PRO A 38 8.484 14.342 3.678 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.227 14.909 2.598 1.00 0.00 H new ATOM 0 HD2 PRO A 38 6.801 14.869 5.282 1.00 0.00 H new ATOM 0 HD3 PRO A 38 5.492 14.505 4.175 1.00 0.00 H new ATOM 605 N ASP A 39 8.708 11.215 5.691 1.00 0.00 N ATOM 606 CA ASP A 39 9.747 10.339 6.258 1.00 0.00 C ATOM 607 C ASP A 39 9.150 9.220 7.137 1.00 0.00 C ATOM 608 O ASP A 39 9.807 8.205 7.393 1.00 0.00 O ATOM 609 CB ASP A 39 10.756 11.197 7.039 1.00 0.00 C ATOM 610 CG ASP A 39 12.005 10.402 7.468 1.00 0.00 C ATOM 611 OD1 ASP A 39 12.682 9.812 6.591 1.00 0.00 O ATOM 612 OD2 ASP A 39 12.350 10.404 8.674 1.00 0.00 O ATOM 0 H ASP A 39 8.432 11.977 6.311 1.00 0.00 H new ATOM 0 HA ASP A 39 10.262 9.834 5.441 1.00 0.00 H new ATOM 0 HB2 ASP A 39 11.062 12.042 6.423 1.00 0.00 H new ATOM 0 HB3 ASP A 39 10.270 11.607 7.924 1.00 0.00 H new ATOM 617 N GLN A 40 7.888 9.369 7.568 1.00 0.00 N ATOM 618 CA GLN A 40 7.170 8.359 8.346 1.00 0.00 C ATOM 619 C GLN A 40 6.461 7.321 7.468 1.00 0.00 C ATOM 620 O GLN A 40 6.386 6.148 7.826 1.00 0.00 O ATOM 621 CB GLN A 40 6.171 9.033 9.287 1.00 0.00 C ATOM 622 CG GLN A 40 6.815 9.402 10.633 1.00 0.00 C ATOM 623 CD GLN A 40 7.858 10.521 10.614 1.00 0.00 C ATOM 624 OE1 GLN A 40 8.976 10.385 10.141 1.00 0.00 O ATOM 625 NE2 GLN A 40 7.545 11.656 11.196 1.00 0.00 N ATOM 0 H GLN A 40 7.335 10.205 7.382 1.00 0.00 H new ATOM 0 HA GLN A 40 7.915 7.818 8.929 1.00 0.00 H new ATOM 0 HB2 GLN A 40 5.776 9.932 8.814 1.00 0.00 H new ATOM 0 HB3 GLN A 40 5.326 8.366 9.459 1.00 0.00 H new ATOM 0 HG2 GLN A 40 6.021 9.689 11.322 1.00 0.00 H new ATOM 0 HG3 GLN A 40 7.284 8.507 11.042 1.00 0.00 H new ATOM 0 HE21 GLN A 40 6.615 11.785 11.596 1.00 0.00 H new ATOM 0 HE22 GLN A 40 8.231 12.409 11.248 1.00 0.00 H new ATOM 634 N GLN A 41 5.920 7.747 6.331 1.00 0.00 N ATOM 635 CA GLN A 41 5.188 6.888 5.397 1.00 0.00 C ATOM 636 C GLN A 41 6.089 6.195 4.346 1.00 0.00 C ATOM 637 O GLN A 41 7.166 6.673 3.977 1.00 0.00 O ATOM 638 CB GLN A 41 4.039 7.676 4.746 1.00 0.00 C ATOM 639 CG GLN A 41 4.507 8.941 4.019 1.00 0.00 C ATOM 640 CD GLN A 41 3.421 9.533 3.135 1.00 0.00 C ATOM 641 OE1 GLN A 41 2.894 8.887 2.245 1.00 0.00 O ATOM 642 NE2 GLN A 41 3.080 10.791 3.296 1.00 0.00 N ATOM 0 H GLN A 41 5.977 8.718 6.024 1.00 0.00 H new ATOM 0 HA GLN A 41 4.767 6.069 5.981 1.00 0.00 H new ATOM 0 HB2 GLN A 41 3.520 7.030 4.038 1.00 0.00 H new ATOM 0 HB3 GLN A 41 3.317 7.953 5.514 1.00 0.00 H new ATOM 0 HG2 GLN A 41 4.821 9.684 4.752 1.00 0.00 H new ATOM 0 HG3 GLN A 41 5.380 8.706 3.410 1.00 0.00 H new ATOM 0 HE21 GLN A 41 3.511 11.346 4.036 1.00 0.00 H new ATOM 0 HE22 GLN A 41 2.384 11.213 2.681 1.00 0.00 H new ATOM 651 N ARG A 42 5.583 5.083 3.809 1.00 0.00 N ATOM 652 CA ARG A 42 6.057 4.243 2.690 1.00 0.00 C ATOM 653 C ARG A 42 4.880 4.000 1.737 1.00 0.00 C ATOM 654 O ARG A 42 3.740 4.179 2.158 1.00 0.00 O ATOM 655 CB ARG A 42 6.566 2.893 3.231 1.00 0.00 C ATOM 656 CG ARG A 42 7.709 2.975 4.253 1.00 0.00 C ATOM 657 CD ARG A 42 7.959 1.567 4.806 1.00 0.00 C ATOM 658 NE ARG A 42 9.119 1.528 5.716 1.00 0.00 N ATOM 659 CZ ARG A 42 9.658 0.452 6.264 1.00 0.00 C ATOM 660 NH1 ARG A 42 9.244 -0.753 5.991 1.00 0.00 N ATOM 661 NH2 ARG A 42 10.641 0.568 7.111 1.00 0.00 N ATOM 0 H ARG A 42 4.721 4.695 4.193 1.00 0.00 H new ATOM 0 HA ARG A 42 6.871 4.744 2.166 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.729 2.368 3.691 1.00 0.00 H new ATOM 0 HB3 ARG A 42 6.899 2.287 2.389 1.00 0.00 H new ATOM 0 HG2 ARG A 42 8.612 3.365 3.783 1.00 0.00 H new ATOM 0 HG3 ARG A 42 7.449 3.660 5.060 1.00 0.00 H new ATOM 0 HD2 ARG A 42 7.071 1.223 5.336 1.00 0.00 H new ATOM 0 HD3 ARG A 42 8.124 0.877 3.979 1.00 0.00 H new ATOM 0 HE ARG A 42 9.550 2.423 5.946 1.00 0.00 H new ATOM 0 HH11 ARG A 42 8.477 -0.892 5.333 1.00 0.00 H new ATOM 0 HH12 ARG A 42 9.687 -1.557 6.435 1.00 0.00 H new ATOM 0 HH21 ARG A 42 10.998 1.492 7.354 1.00 0.00 H new ATOM 0 HH22 ARG A 42 11.053 -0.265 7.531 1.00 0.00 H new ATOM 675 N LEU A 43 5.118 3.558 0.499 1.00 0.00 N ATOM 676 CA LEU A 43 4.056 3.246 -0.478 1.00 0.00 C ATOM 677 C LEU A 43 4.097 1.773 -0.935 1.00 0.00 C ATOM 678 O LEU A 43 5.159 1.146 -0.945 1.00 0.00 O ATOM 679 CB LEU A 43 4.105 4.223 -1.675 1.00 0.00 C ATOM 680 CG LEU A 43 3.957 5.727 -1.355 1.00 0.00 C ATOM 681 CD1 LEU A 43 3.903 6.535 -2.653 1.00 0.00 C ATOM 682 CD2 LEU A 43 2.685 6.080 -0.584 1.00 0.00 C ATOM 0 H LEU A 43 6.059 3.403 0.138 1.00 0.00 H new ATOM 0 HA LEU A 43 3.099 3.383 0.025 1.00 0.00 H new ATOM 0 HB2 LEU A 43 5.053 4.078 -2.193 1.00 0.00 H new ATOM 0 HB3 LEU A 43 3.315 3.945 -2.373 1.00 0.00 H new ATOM 0 HG LEU A 43 4.822 5.968 -0.737 1.00 0.00 H new ATOM 0 HD11 LEU A 43 3.799 7.594 -2.418 1.00 0.00 H new ATOM 0 HD12 LEU A 43 4.822 6.377 -3.218 1.00 0.00 H new ATOM 0 HD13 LEU A 43 3.050 6.210 -3.249 1.00 0.00 H new ATOM 0 HD21 LEU A 43 2.658 7.154 -0.399 1.00 0.00 H new ATOM 0 HD22 LEU A 43 1.812 5.790 -1.169 1.00 0.00 H new ATOM 0 HD23 LEU A 43 2.677 5.548 0.367 1.00 0.00 H new ATOM 694 N ILE A 44 2.940 1.230 -1.330 1.00 0.00 N ATOM 695 CA ILE A 44 2.736 -0.154 -1.803 1.00 0.00 C ATOM 696 C ILE A 44 1.977 -0.164 -3.148 1.00 0.00 C ATOM 697 O ILE A 44 0.946 0.505 -3.278 1.00 0.00 O ATOM 698 CB ILE A 44 1.942 -0.993 -0.759 1.00 0.00 C ATOM 699 CG1 ILE A 44 2.474 -0.988 0.690 1.00 0.00 C ATOM 700 CG2 ILE A 44 1.744 -2.440 -1.253 1.00 0.00 C ATOM 701 CD1 ILE A 44 3.771 -1.754 0.938 1.00 0.00 C ATOM 0 H ILE A 44 2.073 1.767 -1.330 1.00 0.00 H new ATOM 0 HA ILE A 44 3.721 -0.601 -1.940 1.00 0.00 H new ATOM 0 HB ILE A 44 0.987 -0.472 -0.690 1.00 0.00 H new ATOM 0 HG12 ILE A 44 2.625 0.047 0.995 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.703 -1.403 1.339 1.00 0.00 H new ATOM 0 HG21 ILE A 44 1.187 -3.006 -0.507 1.00 0.00 H new ATOM 0 HG22 ILE A 44 1.189 -2.431 -2.191 1.00 0.00 H new ATOM 0 HG23 ILE A 44 2.716 -2.907 -1.411 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.043 -1.678 1.991 1.00 0.00 H new ATOM 0 HD12 ILE A 44 3.630 -2.802 0.675 1.00 0.00 H new ATOM 0 HD13 ILE A 44 4.567 -1.330 0.326 1.00 0.00 H new ATOM 713 N PHE A 45 2.452 -0.944 -4.130 1.00 0.00 N ATOM 714 CA PHE A 45 1.735 -1.254 -5.383 1.00 0.00 C ATOM 715 C PHE A 45 1.967 -2.718 -5.798 1.00 0.00 C ATOM 716 O PHE A 45 3.081 -3.227 -5.675 1.00 0.00 O ATOM 717 CB PHE A 45 2.120 -0.285 -6.521 1.00 0.00 C ATOM 718 CG PHE A 45 1.328 -0.418 -7.822 1.00 0.00 C ATOM 719 CD1 PHE A 45 -0.038 -0.785 -7.835 1.00 0.00 C ATOM 720 CD2 PHE A 45 1.943 -0.066 -9.039 1.00 0.00 C ATOM 721 CE1 PHE A 45 -0.763 -0.808 -9.039 1.00 0.00 C ATOM 722 CE2 PHE A 45 1.211 -0.063 -10.240 1.00 0.00 C ATOM 723 CZ PHE A 45 -0.141 -0.439 -10.243 1.00 0.00 C ATOM 0 H PHE A 45 3.368 -1.390 -4.077 1.00 0.00 H new ATOM 0 HA PHE A 45 0.670 -1.118 -5.193 1.00 0.00 H new ATOM 0 HB2 PHE A 45 2.007 0.735 -6.154 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.177 -0.427 -6.748 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.529 -1.050 -6.910 1.00 0.00 H new ATOM 0 HD2 PHE A 45 2.988 0.205 -9.050 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.800 -1.110 -9.038 1.00 0.00 H new ATOM 0 HE2 PHE A 45 1.691 0.229 -11.162 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.701 -0.445 -11.167 1.00 0.00 H new ATOM 733 N ALA A 46 0.919 -3.409 -6.266 1.00 0.00 N ATOM 734 CA ALA A 46 0.905 -4.849 -6.571 1.00 0.00 C ATOM 735 C ALA A 46 1.478 -5.723 -5.424 1.00 0.00 C ATOM 736 O ALA A 46 2.145 -6.736 -5.649 1.00 0.00 O ATOM 737 CB ALA A 46 1.569 -5.069 -7.939 1.00 0.00 C ATOM 0 H ALA A 46 0.020 -2.963 -6.451 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.126 -5.195 -6.642 1.00 0.00 H new ATOM 0 HB1 ALA A 46 1.566 -6.132 -8.178 1.00 0.00 H new ATOM 0 HB2 ALA A 46 1.016 -4.523 -8.704 1.00 0.00 H new ATOM 0 HB3 ALA A 46 2.597 -4.708 -7.907 1.00 0.00 H new ATOM 743 N GLY A 47 1.249 -5.289 -4.180 1.00 0.00 N ATOM 744 CA GLY A 47 1.753 -5.875 -2.936 1.00 0.00 C ATOM 745 C GLY A 47 3.221 -5.566 -2.604 1.00 0.00 C ATOM 746 O GLY A 47 3.659 -5.833 -1.484 1.00 0.00 O ATOM 0 H GLY A 47 0.670 -4.467 -4.006 1.00 0.00 H new ATOM 0 HA2 GLY A 47 1.131 -5.524 -2.112 1.00 0.00 H new ATOM 0 HA3 GLY A 47 1.631 -6.957 -2.989 1.00 0.00 H new ATOM 750 N LYS A 48 3.987 -4.994 -3.543 1.00 0.00 N ATOM 751 CA LYS A 48 5.423 -4.701 -3.422 1.00 0.00 C ATOM 752 C LYS A 48 5.659 -3.333 -2.772 1.00 0.00 C ATOM 753 O LYS A 48 5.065 -2.331 -3.174 1.00 0.00 O ATOM 754 CB LYS A 48 6.061 -4.833 -4.820 1.00 0.00 C ATOM 755 CG LYS A 48 7.601 -4.853 -4.812 1.00 0.00 C ATOM 756 CD LYS A 48 8.220 -3.475 -5.091 1.00 0.00 C ATOM 757 CE LYS A 48 9.756 -3.516 -5.105 1.00 0.00 C ATOM 758 NZ LYS A 48 10.335 -3.696 -3.747 1.00 0.00 N ATOM 0 H LYS A 48 3.607 -4.711 -4.446 1.00 0.00 H new ATOM 0 HA LYS A 48 5.905 -5.417 -2.756 1.00 0.00 H new ATOM 0 HB2 LYS A 48 5.699 -5.749 -5.287 1.00 0.00 H new ATOM 0 HB3 LYS A 48 5.723 -4.004 -5.441 1.00 0.00 H new ATOM 0 HG2 LYS A 48 7.949 -5.212 -3.844 1.00 0.00 H new ATOM 0 HG3 LYS A 48 7.954 -5.562 -5.561 1.00 0.00 H new ATOM 0 HD2 LYS A 48 7.860 -3.106 -6.051 1.00 0.00 H new ATOM 0 HD3 LYS A 48 7.885 -2.768 -4.332 1.00 0.00 H new ATOM 0 HE2 LYS A 48 10.088 -4.330 -5.749 1.00 0.00 H new ATOM 0 HE3 LYS A 48 10.137 -2.591 -5.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 11.364 -3.548 -3.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 9.911 -3.006 -3.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 10.136 -4.659 -3.410 1.00 0.00 H new ATOM 772 N GLN A 49 6.531 -3.297 -1.763 1.00 0.00 N ATOM 773 CA GLN A 49 6.949 -2.083 -1.050 1.00 0.00 C ATOM 774 C GLN A 49 7.917 -1.243 -1.900 1.00 0.00 C ATOM 775 O GLN A 49 9.023 -1.689 -2.220 1.00 0.00 O ATOM 776 CB GLN A 49 7.532 -2.484 0.317 1.00 0.00 C ATOM 777 CG GLN A 49 7.696 -1.278 1.258 1.00 0.00 C ATOM 778 CD GLN A 49 8.390 -1.650 2.567 1.00 0.00 C ATOM 779 OE1 GLN A 49 7.821 -1.588 3.650 1.00 0.00 O ATOM 780 NE2 GLN A 49 9.652 -2.021 2.535 1.00 0.00 N ATOM 0 H GLN A 49 6.982 -4.139 -1.406 1.00 0.00 H new ATOM 0 HA GLN A 49 6.088 -1.439 -0.871 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.880 -3.221 0.785 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.501 -2.962 0.170 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.271 -0.502 0.753 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.715 -0.856 1.477 1.00 0.00 H new ATOM 0 HE21 GLN A 49 10.144 -2.079 1.643 1.00 0.00 H new ATOM 0 HE22 GLN A 49 10.138 -2.251 3.402 1.00 0.00 H new ATOM 789 N LEU A 50 7.471 -0.059 -2.322 1.00 0.00 N ATOM 790 CA LEU A 50 8.138 0.798 -3.310 1.00 0.00 C ATOM 791 C LEU A 50 9.333 1.572 -2.715 1.00 0.00 C ATOM 792 O LEU A 50 9.319 1.963 -1.546 1.00 0.00 O ATOM 793 CB LEU A 50 7.094 1.754 -3.929 1.00 0.00 C ATOM 794 CG LEU A 50 5.783 1.082 -4.397 1.00 0.00 C ATOM 795 CD1 LEU A 50 4.842 2.114 -5.015 1.00 0.00 C ATOM 796 CD2 LEU A 50 6.008 -0.027 -5.422 1.00 0.00 C ATOM 0 H LEU A 50 6.603 0.347 -1.973 1.00 0.00 H new ATOM 0 HA LEU A 50 8.559 0.163 -4.089 1.00 0.00 H new ATOM 0 HB2 LEU A 50 6.848 2.522 -3.196 1.00 0.00 H new ATOM 0 HB3 LEU A 50 7.548 2.260 -4.781 1.00 0.00 H new ATOM 0 HG LEU A 50 5.345 0.638 -3.503 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.925 1.622 -5.339 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.603 2.878 -4.275 1.00 0.00 H new ATOM 0 HD13 LEU A 50 5.326 2.580 -5.873 1.00 0.00 H new ATOM 0 HD21 LEU A 50 5.049 -0.457 -5.709 1.00 0.00 H new ATOM 0 HD22 LEU A 50 6.499 0.386 -6.303 1.00 0.00 H new ATOM 0 HD23 LEU A 50 6.638 -0.803 -4.986 1.00 0.00 H new ATOM 808 N GLU A 51 10.367 1.807 -3.527 1.00 0.00 N ATOM 809 CA GLU A 51 11.615 2.482 -3.133 1.00 0.00 C ATOM 810 C GLU A 51 11.561 3.996 -3.403 1.00 0.00 C ATOM 811 O GLU A 51 11.137 4.445 -4.466 1.00 0.00 O ATOM 812 CB GLU A 51 12.767 1.844 -3.916 1.00 0.00 C ATOM 813 CG GLU A 51 14.168 2.380 -3.599 1.00 0.00 C ATOM 814 CD GLU A 51 15.222 1.684 -4.485 1.00 0.00 C ATOM 815 OE1 GLU A 51 15.297 1.991 -5.701 1.00 0.00 O ATOM 816 OE2 GLU A 51 15.985 0.829 -3.970 1.00 0.00 O ATOM 0 H GLU A 51 10.363 1.526 -4.507 1.00 0.00 H new ATOM 0 HA GLU A 51 11.762 2.359 -2.060 1.00 0.00 H new ATOM 0 HB2 GLU A 51 12.758 0.770 -3.728 1.00 0.00 H new ATOM 0 HB3 GLU A 51 12.578 1.982 -4.981 1.00 0.00 H new ATOM 0 HG2 GLU A 51 14.198 3.457 -3.764 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.399 2.212 -2.547 1.00 0.00 H new ATOM 823 N ASP A 52 12.049 4.791 -2.453 1.00 0.00 N ATOM 824 CA ASP A 52 11.921 6.261 -2.410 1.00 0.00 C ATOM 825 C ASP A 52 12.487 6.988 -3.641 1.00 0.00 C ATOM 826 O ASP A 52 11.890 7.958 -4.117 1.00 0.00 O ATOM 827 CB ASP A 52 12.595 6.802 -1.139 1.00 0.00 C ATOM 828 CG ASP A 52 11.681 6.663 0.081 1.00 0.00 C ATOM 829 OD1 ASP A 52 11.589 5.559 0.665 1.00 0.00 O ATOM 830 OD2 ASP A 52 11.005 7.654 0.443 1.00 0.00 O ATOM 0 H ASP A 52 12.567 4.421 -1.656 1.00 0.00 H new ATOM 0 HA ASP A 52 10.850 6.466 -2.407 1.00 0.00 H new ATOM 0 HB2 ASP A 52 13.526 6.263 -0.961 1.00 0.00 H new ATOM 0 HB3 ASP A 52 12.856 7.851 -1.282 1.00 0.00 H new ATOM 835 N GLY A 53 13.620 6.510 -4.164 1.00 0.00 N ATOM 836 CA GLY A 53 14.316 7.088 -5.317 1.00 0.00 C ATOM 837 C GLY A 53 13.767 6.662 -6.686 1.00 0.00 C ATOM 838 O GLY A 53 14.264 7.144 -7.708 1.00 0.00 O ATOM 0 H GLY A 53 14.091 5.688 -3.787 1.00 0.00 H new ATOM 0 HA2 GLY A 53 14.267 8.175 -5.245 1.00 0.00 H new ATOM 0 HA3 GLY A 53 15.369 6.812 -5.263 1.00 0.00 H new ATOM 842 N ARG A 54 12.768 5.768 -6.736 1.00 0.00 N ATOM 843 CA ARG A 54 12.105 5.351 -7.986 1.00 0.00 C ATOM 844 C ARG A 54 11.025 6.330 -8.401 1.00 0.00 C ATOM 845 O ARG A 54 10.530 7.097 -7.580 1.00 0.00 O ATOM 846 CB ARG A 54 11.473 3.960 -7.825 1.00 0.00 C ATOM 847 CG ARG A 54 12.475 2.827 -7.588 1.00 0.00 C ATOM 848 CD ARG A 54 13.212 2.334 -8.840 1.00 0.00 C ATOM 849 NE ARG A 54 14.049 3.353 -9.492 1.00 0.00 N ATOM 850 CZ ARG A 54 15.238 3.802 -9.137 1.00 0.00 C ATOM 851 NH1 ARG A 54 15.865 3.415 -8.061 1.00 0.00 N ATOM 852 NH2 ARG A 54 15.829 4.687 -9.888 1.00 0.00 N ATOM 0 H ARG A 54 12.393 5.309 -5.906 1.00 0.00 H new ATOM 0 HA ARG A 54 12.873 5.325 -8.759 1.00 0.00 H new ATOM 0 HB2 ARG A 54 10.773 3.988 -6.990 1.00 0.00 H new ATOM 0 HB3 ARG A 54 10.893 3.733 -8.720 1.00 0.00 H new ATOM 0 HG2 ARG A 54 13.213 3.163 -6.860 1.00 0.00 H new ATOM 0 HG3 ARG A 54 11.947 1.984 -7.141 1.00 0.00 H new ATOM 0 HD2 ARG A 54 13.840 1.486 -8.567 1.00 0.00 H new ATOM 0 HD3 ARG A 54 12.478 1.969 -9.559 1.00 0.00 H new ATOM 0 HE ARG A 54 13.656 3.770 -10.336 1.00 0.00 H new ATOM 0 HH11 ARG A 54 15.437 2.728 -7.440 1.00 0.00 H new ATOM 0 HH12 ARG A 54 16.784 3.799 -7.840 1.00 0.00 H new ATOM 0 HH21 ARG A 54 15.373 5.023 -10.736 1.00 0.00 H new ATOM 0 HH22 ARG A 54 16.748 5.044 -9.628 1.00 0.00 H new ATOM 866 N THR A 55 10.631 6.260 -9.666 1.00 0.00 N ATOM 867 CA THR A 55 9.512 7.017 -10.244 1.00 0.00 C ATOM 868 C THR A 55 8.204 6.227 -10.243 1.00 0.00 C ATOM 869 O THR A 55 8.148 5.055 -9.867 1.00 0.00 O ATOM 870 CB THR A 55 9.832 7.483 -11.674 1.00 0.00 C ATOM 871 OG1 THR A 55 10.086 6.382 -12.516 1.00 0.00 O ATOM 872 CG2 THR A 55 11.041 8.413 -11.712 1.00 0.00 C ATOM 0 H THR A 55 11.093 5.656 -10.346 1.00 0.00 H new ATOM 0 HA THR A 55 9.376 7.888 -9.603 1.00 0.00 H new ATOM 0 HB THR A 55 8.956 8.027 -12.026 1.00 0.00 H new ATOM 0 HG1 THR A 55 10.286 6.701 -13.421 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.233 8.719 -12.741 1.00 0.00 H new ATOM 0 HG22 THR A 55 10.841 9.294 -11.103 1.00 0.00 H new ATOM 0 HG23 THR A 55 11.914 7.891 -11.320 1.00 0.00 H new ATOM 880 N LEU A 56 7.121 6.873 -10.668 1.00 0.00 N ATOM 881 CA LEU A 56 5.848 6.214 -10.950 1.00 0.00 C ATOM 882 C LEU A 56 5.976 5.340 -12.218 1.00 0.00 C ATOM 883 O LEU A 56 5.558 4.180 -12.227 1.00 0.00 O ATOM 884 CB LEU A 56 4.770 7.309 -11.041 1.00 0.00 C ATOM 885 CG LEU A 56 4.530 8.042 -9.706 1.00 0.00 C ATOM 886 CD1 LEU A 56 3.443 9.089 -9.889 1.00 0.00 C ATOM 887 CD2 LEU A 56 4.082 7.114 -8.575 1.00 0.00 C ATOM 0 H LEU A 56 7.102 7.880 -10.828 1.00 0.00 H new ATOM 0 HA LEU A 56 5.555 5.525 -10.158 1.00 0.00 H new ATOM 0 HB2 LEU A 56 5.063 8.036 -11.799 1.00 0.00 H new ATOM 0 HB3 LEU A 56 3.834 6.861 -11.375 1.00 0.00 H new ATOM 0 HG LEU A 56 5.487 8.484 -9.429 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.274 9.607 -8.945 1.00 0.00 H new ATOM 0 HD12 LEU A 56 3.754 9.808 -10.647 1.00 0.00 H new ATOM 0 HD13 LEU A 56 2.520 8.604 -10.207 1.00 0.00 H new ATOM 0 HD21 LEU A 56 3.931 7.695 -7.665 1.00 0.00 H new ATOM 0 HD22 LEU A 56 3.148 6.627 -8.853 1.00 0.00 H new ATOM 0 HD23 LEU A 56 4.847 6.358 -8.400 1.00 0.00 H new ATOM 899 N SER A 57 6.650 5.847 -13.255 1.00 0.00 N ATOM 900 CA SER A 57 7.016 5.095 -14.468 1.00 0.00 C ATOM 901 C SER A 57 7.819 3.813 -14.178 1.00 0.00 C ATOM 902 O SER A 57 7.569 2.779 -14.800 1.00 0.00 O ATOM 903 CB SER A 57 7.805 6.011 -15.413 1.00 0.00 C ATOM 904 OG SER A 57 8.046 5.392 -16.667 1.00 0.00 O ATOM 0 H SER A 57 6.966 6.817 -13.278 1.00 0.00 H new ATOM 0 HA SER A 57 6.086 4.770 -14.935 1.00 0.00 H new ATOM 0 HB2 SER A 57 7.253 6.938 -15.565 1.00 0.00 H new ATOM 0 HB3 SER A 57 8.755 6.278 -14.951 1.00 0.00 H new ATOM 0 HG SER A 57 8.549 6.005 -17.243 1.00 0.00 H new ATOM 910 N ASP A 58 8.717 3.830 -13.185 1.00 0.00 N ATOM 911 CA ASP A 58 9.499 2.665 -12.735 1.00 0.00 C ATOM 912 C ASP A 58 8.638 1.467 -12.291 1.00 0.00 C ATOM 913 O ASP A 58 9.086 0.323 -12.411 1.00 0.00 O ATOM 914 CB ASP A 58 10.423 3.063 -11.571 1.00 0.00 C ATOM 915 CG ASP A 58 11.801 3.584 -12.001 1.00 0.00 C ATOM 916 OD1 ASP A 58 12.456 2.969 -12.874 1.00 0.00 O ATOM 917 OD2 ASP A 58 12.266 4.581 -11.396 1.00 0.00 O ATOM 0 H ASP A 58 8.928 4.676 -12.656 1.00 0.00 H new ATOM 0 HA ASP A 58 10.074 2.346 -13.604 1.00 0.00 H new ATOM 0 HB2 ASP A 58 9.928 3.831 -10.977 1.00 0.00 H new ATOM 0 HB3 ASP A 58 10.562 2.198 -10.922 1.00 0.00 H new ATOM 922 N TYR A 59 7.405 1.704 -11.824 1.00 0.00 N ATOM 923 CA TYR A 59 6.450 0.654 -11.448 1.00 0.00 C ATOM 924 C TYR A 59 5.267 0.547 -12.428 1.00 0.00 C ATOM 925 O TYR A 59 4.268 -0.110 -12.129 1.00 0.00 O ATOM 926 CB TYR A 59 6.029 0.850 -9.984 1.00 0.00 C ATOM 927 CG TYR A 59 7.176 0.703 -8.999 1.00 0.00 C ATOM 928 CD1 TYR A 59 7.716 -0.570 -8.727 1.00 0.00 C ATOM 929 CD2 TYR A 59 7.706 1.838 -8.358 1.00 0.00 C ATOM 930 CE1 TYR A 59 8.770 -0.709 -7.802 1.00 0.00 C ATOM 931 CE2 TYR A 59 8.764 1.704 -7.439 1.00 0.00 C ATOM 932 CZ TYR A 59 9.284 0.428 -7.141 1.00 0.00 C ATOM 933 OH TYR A 59 10.270 0.300 -6.211 1.00 0.00 O ATOM 0 H TYR A 59 7.037 2.647 -11.695 1.00 0.00 H new ATOM 0 HA TYR A 59 6.942 -0.316 -11.524 1.00 0.00 H new ATOM 0 HB2 TYR A 59 5.588 1.840 -9.871 1.00 0.00 H new ATOM 0 HB3 TYR A 59 5.253 0.125 -9.737 1.00 0.00 H new ATOM 0 HD1 TYR A 59 7.321 -1.441 -9.229 1.00 0.00 H new ATOM 0 HD2 TYR A 59 7.300 2.816 -8.572 1.00 0.00 H new ATOM 0 HE1 TYR A 59 9.185 -1.685 -7.599 1.00 0.00 H new ATOM 0 HE2 TYR A 59 9.178 2.580 -6.962 1.00 0.00 H new ATOM 0 HH TYR A 59 11.107 0.047 -6.654 1.00 0.00 H new ATOM 943 N ASN A 60 5.378 1.167 -13.613 1.00 0.00 N ATOM 944 CA ASN A 60 4.353 1.229 -14.664 1.00 0.00 C ATOM 945 C ASN A 60 2.998 1.774 -14.161 1.00 0.00 C ATOM 946 O ASN A 60 1.935 1.413 -14.675 1.00 0.00 O ATOM 947 CB ASN A 60 4.265 -0.127 -15.396 1.00 0.00 C ATOM 948 CG ASN A 60 5.553 -0.475 -16.124 1.00 0.00 C ATOM 949 OD1 ASN A 60 5.862 0.065 -17.178 1.00 0.00 O ATOM 950 ND2 ASN A 60 6.340 -1.392 -15.605 1.00 0.00 N ATOM 0 H ASN A 60 6.229 1.664 -13.877 1.00 0.00 H new ATOM 0 HA ASN A 60 4.661 1.969 -15.402 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.034 -0.912 -14.676 1.00 0.00 H new ATOM 0 HB3 ASN A 60 3.443 -0.099 -16.111 1.00 0.00 H new ATOM 0 HD21 ASN A 60 7.204 -1.651 -16.081 1.00 0.00 H new ATOM 0 HD22 ASN A 60 6.086 -1.844 -14.727 1.00 0.00 H new ATOM 957 N ILE A 61 3.039 2.668 -13.166 1.00 0.00 N ATOM 958 CA ILE A 61 1.891 3.401 -12.619 1.00 0.00 C ATOM 959 C ILE A 61 1.163 4.132 -13.763 1.00 0.00 C ATOM 960 O ILE A 61 1.806 4.730 -14.632 1.00 0.00 O ATOM 961 CB ILE A 61 2.392 4.407 -11.565 1.00 0.00 C ATOM 962 CG1 ILE A 61 3.070 3.722 -10.355 1.00 0.00 C ATOM 963 CG2 ILE A 61 1.280 5.379 -11.118 1.00 0.00 C ATOM 964 CD1 ILE A 61 2.126 3.237 -9.263 1.00 0.00 C ATOM 0 H ILE A 61 3.913 2.911 -12.699 1.00 0.00 H new ATOM 0 HA ILE A 61 1.193 2.711 -12.145 1.00 0.00 H new ATOM 0 HB ILE A 61 3.164 4.999 -12.058 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.646 2.871 -10.717 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.779 4.422 -9.914 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.678 6.070 -10.375 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.920 5.941 -11.980 1.00 0.00 H new ATOM 0 HG23 ILE A 61 0.456 4.814 -10.683 1.00 0.00 H new ATOM 0 HD11 ILE A 61 2.703 2.773 -8.463 1.00 0.00 H new ATOM 0 HD12 ILE A 61 1.567 4.083 -8.863 1.00 0.00 H new ATOM 0 HD13 ILE A 61 1.432 2.507 -9.680 1.00 0.00 H new ATOM 976 N GLN A 62 -0.169 4.111 -13.756 1.00 0.00 N ATOM 977 CA GLN A 62 -1.026 4.785 -14.739 1.00 0.00 C ATOM 978 C GLN A 62 -1.792 5.953 -14.099 1.00 0.00 C ATOM 979 O GLN A 62 -1.746 6.158 -12.881 1.00 0.00 O ATOM 980 CB GLN A 62 -2.014 3.765 -15.346 1.00 0.00 C ATOM 981 CG GLN A 62 -1.355 2.543 -16.008 1.00 0.00 C ATOM 982 CD GLN A 62 -0.426 2.920 -17.160 1.00 0.00 C ATOM 983 OE1 GLN A 62 -0.819 3.555 -18.131 1.00 0.00 O ATOM 984 NE2 GLN A 62 0.833 2.541 -17.108 1.00 0.00 N ATOM 0 H GLN A 62 -0.701 3.610 -13.045 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.395 5.194 -15.528 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -2.684 3.417 -14.560 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -2.630 4.274 -16.087 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -0.789 1.991 -15.258 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -2.132 1.874 -16.378 1.00 0.00 H new ATOM 0 HE21 GLN A 62 1.174 2.012 -16.305 1.00 0.00 H new ATOM 0 HE22 GLN A 62 1.468 2.777 -17.870 1.00 0.00 H new ATOM 993 N LYS A 63 -2.516 6.737 -14.911 1.00 0.00 N ATOM 994 CA LYS A 63 -3.456 7.725 -14.362 1.00 0.00 C ATOM 995 C LYS A 63 -4.578 7.008 -13.597 1.00 0.00 C ATOM 996 O LYS A 63 -4.996 5.905 -13.948 1.00 0.00 O ATOM 997 CB LYS A 63 -3.961 8.722 -15.428 1.00 0.00 C ATOM 998 CG LYS A 63 -5.257 8.354 -16.176 1.00 0.00 C ATOM 999 CD LYS A 63 -5.197 7.077 -17.017 1.00 0.00 C ATOM 1000 CE LYS A 63 -4.334 7.317 -18.255 1.00 0.00 C ATOM 1001 NZ LYS A 63 -4.312 6.136 -19.159 1.00 0.00 N ATOM 0 H LYS A 63 -2.471 6.709 -15.930 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.925 8.351 -13.645 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -4.112 9.687 -14.944 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -3.171 8.856 -16.167 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -6.059 8.249 -15.446 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -5.527 9.185 -16.828 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -4.783 6.260 -16.426 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.202 6.778 -17.315 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -4.713 8.182 -18.799 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -3.316 7.556 -17.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -3.715 6.342 -19.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -3.926 5.316 -18.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -5.280 5.923 -19.475 1.00 0.00 H new ATOM 1015 N GLU A 64 -5.067 7.652 -12.548 1.00 0.00 N ATOM 1016 CA GLU A 64 -6.076 7.148 -11.611 1.00 0.00 C ATOM 1017 C GLU A 64 -5.722 5.804 -10.931 1.00 0.00 C ATOM 1018 O GLU A 64 -6.606 5.131 -10.394 1.00 0.00 O ATOM 1019 CB GLU A 64 -7.481 7.133 -12.254 1.00 0.00 C ATOM 1020 CG GLU A 64 -7.895 8.446 -12.931 1.00 0.00 C ATOM 1021 CD GLU A 64 -9.319 8.337 -13.511 1.00 0.00 C ATOM 1022 OE1 GLU A 64 -10.302 8.590 -12.773 1.00 0.00 O ATOM 1023 OE2 GLU A 64 -9.467 8.000 -14.711 1.00 0.00 O ATOM 0 H GLU A 64 -4.757 8.594 -12.309 1.00 0.00 H new ATOM 0 HA GLU A 64 -6.086 7.863 -10.788 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -7.518 6.333 -12.993 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -8.214 6.891 -11.485 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.853 9.262 -12.209 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -7.191 8.688 -13.727 1.00 0.00 H new ATOM 1030 N SER A 65 -4.441 5.404 -10.917 1.00 0.00 N ATOM 1031 CA SER A 65 -3.983 4.204 -10.194 1.00 0.00 C ATOM 1032 C SER A 65 -4.265 4.318 -8.690 1.00 0.00 C ATOM 1033 O SER A 65 -4.208 5.407 -8.116 1.00 0.00 O ATOM 1034 CB SER A 65 -2.485 3.946 -10.413 1.00 0.00 C ATOM 1035 OG SER A 65 -2.242 3.356 -11.681 1.00 0.00 O ATOM 0 H SER A 65 -3.695 5.900 -11.404 1.00 0.00 H new ATOM 0 HA SER A 65 -4.545 3.362 -10.599 1.00 0.00 H new ATOM 0 HB2 SER A 65 -1.937 4.885 -10.336 1.00 0.00 H new ATOM 0 HB3 SER A 65 -2.108 3.292 -9.627 1.00 0.00 H new ATOM 0 HG SER A 65 -1.671 2.567 -11.571 1.00 0.00 H new ATOM 1041 N THR A 66 -4.540 3.184 -8.042 1.00 0.00 N ATOM 1042 CA THR A 66 -5.039 3.083 -6.656 1.00 0.00 C ATOM 1043 C THR A 66 -4.011 2.419 -5.739 1.00 0.00 C ATOM 1044 O THR A 66 -4.062 1.217 -5.463 1.00 0.00 O ATOM 1045 CB THR A 66 -6.405 2.370 -6.598 1.00 0.00 C ATOM 1046 OG1 THR A 66 -6.384 1.145 -7.309 1.00 0.00 O ATOM 1047 CG2 THR A 66 -7.517 3.225 -7.211 1.00 0.00 C ATOM 0 H THR A 66 -4.419 2.271 -8.480 1.00 0.00 H new ATOM 0 HA THR A 66 -5.191 4.097 -6.287 1.00 0.00 H new ATOM 0 HB THR A 66 -6.601 2.194 -5.540 1.00 0.00 H new ATOM 0 HG1 THR A 66 -5.610 0.615 -7.025 1.00 0.00 H new ATOM 0 HG21 THR A 66 -8.464 2.688 -7.151 1.00 0.00 H new ATOM 0 HG22 THR A 66 -7.597 4.164 -6.664 1.00 0.00 H new ATOM 0 HG23 THR A 66 -7.283 3.432 -8.255 1.00 0.00 H new ATOM 1055 N LEU A 67 -3.032 3.209 -5.297 1.00 0.00 N ATOM 1056 CA LEU A 67 -1.910 2.768 -4.467 1.00 0.00 C ATOM 1057 C LEU A 67 -2.276 2.809 -2.977 1.00 0.00 C ATOM 1058 O LEU A 67 -3.352 3.280 -2.611 1.00 0.00 O ATOM 1059 CB LEU A 67 -0.664 3.624 -4.798 1.00 0.00 C ATOM 1060 CG LEU A 67 -0.175 3.594 -6.267 1.00 0.00 C ATOM 1061 CD1 LEU A 67 -0.453 2.259 -6.952 1.00 0.00 C ATOM 1062 CD2 LEU A 67 -0.768 4.701 -7.140 1.00 0.00 C ATOM 0 H LEU A 67 -2.997 4.205 -5.514 1.00 0.00 H new ATOM 0 HA LEU A 67 -1.674 1.728 -4.691 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.880 4.659 -4.532 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.155 3.295 -4.159 1.00 0.00 H new ATOM 0 HG LEU A 67 0.900 3.754 -6.181 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.090 2.294 -7.979 1.00 0.00 H new ATOM 0 HD12 LEU A 67 0.058 1.461 -6.414 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.526 2.067 -6.953 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.378 4.613 -8.154 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.854 4.607 -7.160 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.496 5.673 -6.729 1.00 0.00 H new ATOM 1074 N HIS A 68 -1.393 2.324 -2.104 1.00 0.00 N ATOM 1075 CA HIS A 68 -1.567 2.379 -0.646 1.00 0.00 C ATOM 1076 C HIS A 68 -0.365 3.026 0.047 1.00 0.00 C ATOM 1077 O HIS A 68 0.744 2.998 -0.493 1.00 0.00 O ATOM 1078 CB HIS A 68 -1.821 0.972 -0.091 1.00 0.00 C ATOM 1079 CG HIS A 68 -3.211 0.440 -0.338 1.00 0.00 C ATOM 1080 ND1 HIS A 68 -3.779 0.175 -1.565 1.00 0.00 N ATOM 1081 CD2 HIS A 68 -4.104 0.054 0.626 1.00 0.00 C ATOM 1082 CE1 HIS A 68 -4.998 -0.342 -1.348 1.00 0.00 C ATOM 1083 NE2 HIS A 68 -5.240 -0.441 -0.028 1.00 0.00 N ATOM 0 H HIS A 68 -0.523 1.875 -2.390 1.00 0.00 H new ATOM 0 HA HIS A 68 -2.435 3.005 -0.437 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -1.100 0.285 -0.534 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -1.635 0.980 0.983 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -3.959 0.119 1.694 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -5.688 -0.637 -2.124 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -6.086 -0.805 0.411 1.00 0.00 H new ATOM 1091 N LEU A 69 -0.573 3.566 1.256 1.00 0.00 N ATOM 1092 CA LEU A 69 0.479 4.106 2.114 1.00 0.00 C ATOM 1093 C LEU A 69 0.556 3.394 3.479 1.00 0.00 C ATOM 1094 O LEU A 69 -0.448 2.938 4.029 1.00 0.00 O ATOM 1095 CB LEU A 69 0.353 5.636 2.239 1.00 0.00 C ATOM 1096 CG LEU A 69 -0.865 6.139 3.041 1.00 0.00 C ATOM 1097 CD1 LEU A 69 -0.476 7.416 3.771 1.00 0.00 C ATOM 1098 CD2 LEU A 69 -2.071 6.438 2.148 1.00 0.00 C ATOM 0 H LEU A 69 -1.502 3.639 1.670 1.00 0.00 H new ATOM 0 HA LEU A 69 1.435 3.900 1.632 1.00 0.00 H new ATOM 0 HB2 LEU A 69 1.259 6.020 2.708 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.307 6.062 1.237 1.00 0.00 H new ATOM 0 HG LEU A 69 -1.151 5.350 3.736 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.329 7.783 4.342 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.353 7.210 4.448 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.173 8.172 3.046 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -2.900 6.789 2.762 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -1.805 7.208 1.423 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.368 5.531 1.621 1.00 0.00 H new ATOM 1110 N VAL A 70 1.776 3.298 4.004 1.00 0.00 N ATOM 1111 CA VAL A 70 2.192 2.523 5.183 1.00 0.00 C ATOM 1112 C VAL A 70 3.043 3.383 6.105 1.00 0.00 C ATOM 1113 O VAL A 70 4.162 3.742 5.754 1.00 0.00 O ATOM 1114 CB VAL A 70 2.990 1.286 4.728 1.00 0.00 C ATOM 1115 CG1 VAL A 70 3.632 0.543 5.906 1.00 0.00 C ATOM 1116 CG2 VAL A 70 2.135 0.303 3.928 1.00 0.00 C ATOM 0 H VAL A 70 2.563 3.796 3.588 1.00 0.00 H new ATOM 0 HA VAL A 70 1.306 2.200 5.730 1.00 0.00 H new ATOM 0 HB VAL A 70 3.778 1.674 4.082 1.00 0.00 H new ATOM 0 HG11 VAL A 70 4.183 -0.321 5.534 1.00 0.00 H new ATOM 0 HG12 VAL A 70 4.315 1.212 6.429 1.00 0.00 H new ATOM 0 HG13 VAL A 70 2.854 0.209 6.593 1.00 0.00 H new ATOM 0 HG21 VAL A 70 2.744 -0.551 3.631 1.00 0.00 H new ATOM 0 HG22 VAL A 70 1.304 -0.041 4.544 1.00 0.00 H new ATOM 0 HG23 VAL A 70 1.747 0.799 3.038 1.00 0.00 H new ATOM 1126 N LEU A 71 2.538 3.720 7.287 1.00 0.00 N ATOM 1127 CA LEU A 71 3.307 4.445 8.298 1.00 0.00 C ATOM 1128 C LEU A 71 4.203 3.502 9.121 1.00 0.00 C ATOM 1129 O LEU A 71 3.729 2.509 9.676 1.00 0.00 O ATOM 1130 CB LEU A 71 2.334 5.213 9.203 1.00 0.00 C ATOM 1131 CG LEU A 71 1.956 6.603 8.652 1.00 0.00 C ATOM 1132 CD1 LEU A 71 0.892 6.517 7.557 1.00 0.00 C ATOM 1133 CD2 LEU A 71 1.425 7.482 9.781 1.00 0.00 C ATOM 0 H LEU A 71 1.584 3.499 7.573 1.00 0.00 H new ATOM 0 HA LEU A 71 3.974 5.147 7.798 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.427 4.623 9.333 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.782 5.331 10.190 1.00 0.00 H new ATOM 0 HG LEU A 71 2.859 7.035 8.221 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.657 7.519 7.199 1.00 0.00 H new ATOM 0 HD12 LEU A 71 1.269 5.915 6.730 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.009 6.055 7.961 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.160 8.462 9.385 1.00 0.00 H new ATOM 0 HD22 LEU A 71 0.542 7.017 10.220 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.193 7.595 10.546 1.00 0.00 H new ATOM 1145 N ARG A 72 5.482 3.869 9.285 1.00 0.00 N ATOM 1146 CA ARG A 72 6.492 3.183 10.124 1.00 0.00 C ATOM 1147 C ARG A 72 6.172 3.130 11.630 1.00 0.00 C ATOM 1148 O ARG A 72 6.805 2.380 12.372 1.00 0.00 O ATOM 1149 CB ARG A 72 7.882 3.790 9.843 1.00 0.00 C ATOM 1150 CG ARG A 72 8.097 5.207 10.407 1.00 0.00 C ATOM 1151 CD ARG A 72 9.311 5.897 9.769 1.00 0.00 C ATOM 1152 NE ARG A 72 10.596 5.221 10.018 1.00 0.00 N ATOM 1153 CZ ARG A 72 11.747 5.529 9.441 1.00 0.00 C ATOM 1154 NH1 ARG A 72 11.846 6.470 8.543 1.00 0.00 N ATOM 1155 NH2 ARG A 72 12.835 4.888 9.759 1.00 0.00 N ATOM 0 H ARG A 72 5.865 4.690 8.817 1.00 0.00 H new ATOM 0 HA ARG A 72 6.477 2.133 9.831 1.00 0.00 H new ATOM 0 HB2 ARG A 72 8.642 3.129 10.260 1.00 0.00 H new ATOM 0 HB3 ARG A 72 8.040 3.816 8.765 1.00 0.00 H new ATOM 0 HG2 ARG A 72 7.204 5.807 10.232 1.00 0.00 H new ATOM 0 HG3 ARG A 72 8.237 5.151 11.487 1.00 0.00 H new ATOM 0 HD2 ARG A 72 9.152 5.963 8.693 1.00 0.00 H new ATOM 0 HD3 ARG A 72 9.373 6.918 10.145 1.00 0.00 H new ATOM 0 HE ARG A 72 10.599 4.453 10.690 1.00 0.00 H new ATOM 0 HH11 ARG A 72 11.019 6.997 8.263 1.00 0.00 H new ATOM 0 HH12 ARG A 72 12.751 6.679 8.121 1.00 0.00 H new ATOM 0 HH21 ARG A 72 12.803 4.144 10.456 1.00 0.00 H new ATOM 0 HH22 ARG A 72 13.719 5.130 9.311 1.00 0.00 H new ATOM 1366 N PRO B 328 -11.067 -16.694 10.744 1.00 0.00 N ATOM 1367 CA PRO B 328 -10.284 -15.562 10.228 1.00 0.00 C ATOM 1368 C PRO B 328 -10.945 -14.829 9.053 1.00 0.00 C ATOM 1369 O PRO B 328 -10.781 -13.618 8.912 1.00 0.00 O ATOM 1370 CB PRO B 328 -8.915 -16.138 9.854 1.00 0.00 C ATOM 1371 CG PRO B 328 -9.199 -17.619 9.618 1.00 0.00 C ATOM 1372 CD PRO B 328 -10.294 -17.922 10.635 1.00 0.00 C ATOM 0 HA PRO B 328 -10.203 -14.788 10.991 1.00 0.00 H new ATOM 0 HB2 PRO B 328 -8.510 -15.661 8.962 1.00 0.00 H new ATOM 0 HB3 PRO B 328 -8.187 -15.992 10.652 1.00 0.00 H new ATOM 0 HG2 PRO B 328 -9.532 -17.809 8.598 1.00 0.00 H new ATOM 0 HG3 PRO B 328 -8.313 -18.232 9.784 1.00 0.00 H new ATOM 0 HD2 PRO B 328 -10.919 -18.752 10.305 1.00 0.00 H new ATOM 0 HD3 PRO B 328 -9.869 -18.206 11.598 1.00 0.00 H new ATOM 1380 N GLU B 329 -11.750 -15.538 8.258 1.00 0.00 N ATOM 1381 CA GLU B 329 -12.558 -14.994 7.155 1.00 0.00 C ATOM 1382 C GLU B 329 -13.568 -13.904 7.571 1.00 0.00 C ATOM 1383 O GLU B 329 -14.011 -13.128 6.723 1.00 0.00 O ATOM 1384 CB GLU B 329 -13.265 -16.142 6.417 1.00 0.00 C ATOM 1385 CG GLU B 329 -14.309 -16.887 7.262 1.00 0.00 C ATOM 1386 CD GLU B 329 -14.939 -18.040 6.457 1.00 0.00 C ATOM 1387 OE1 GLU B 329 -14.400 -19.174 6.486 1.00 0.00 O ATOM 1388 OE2 GLU B 329 -15.977 -17.823 5.783 1.00 0.00 O ATOM 0 H GLU B 329 -11.864 -16.546 8.366 1.00 0.00 H new ATOM 0 HA GLU B 329 -11.860 -14.487 6.489 1.00 0.00 H new ATOM 0 HB2 GLU B 329 -13.753 -15.741 5.528 1.00 0.00 H new ATOM 0 HB3 GLU B 329 -12.515 -16.855 6.075 1.00 0.00 H new ATOM 0 HG2 GLU B 329 -13.840 -17.280 8.164 1.00 0.00 H new ATOM 0 HG3 GLU B 329 -15.086 -16.194 7.583 1.00 0.00 H new ATOM 1395 N GLU B 330 -13.903 -13.807 8.864 1.00 0.00 N ATOM 1396 CA GLU B 330 -14.720 -12.727 9.442 1.00 0.00 C ATOM 1397 C GLU B 330 -14.075 -12.017 10.649 1.00 0.00 C ATOM 1398 O GLU B 330 -14.348 -10.835 10.870 1.00 0.00 O ATOM 1399 CB GLU B 330 -16.151 -13.212 9.718 1.00 0.00 C ATOM 1400 CG GLU B 330 -16.277 -14.358 10.729 1.00 0.00 C ATOM 1401 CD GLU B 330 -17.759 -14.767 10.845 1.00 0.00 C ATOM 1402 OE1 GLU B 330 -18.488 -14.181 11.682 1.00 0.00 O ATOM 1403 OE2 GLU B 330 -18.221 -15.638 10.067 1.00 0.00 O ATOM 0 H GLU B 330 -13.607 -14.494 9.557 1.00 0.00 H new ATOM 0 HA GLU B 330 -14.775 -11.945 8.685 1.00 0.00 H new ATOM 0 HB2 GLU B 330 -16.739 -12.368 10.077 1.00 0.00 H new ATOM 0 HB3 GLU B 330 -16.596 -13.532 8.776 1.00 0.00 H new ATOM 0 HG2 GLU B 330 -15.676 -15.209 10.409 1.00 0.00 H new ATOM 0 HG3 GLU B 330 -15.896 -14.046 11.701 1.00 0.00 H new ATOM 1410 N ARG B 331 -13.146 -12.665 11.371 1.00 0.00 N ATOM 1411 CA ARG B 331 -12.300 -12.040 12.408 1.00 0.00 C ATOM 1412 C ARG B 331 -11.399 -10.929 11.846 1.00 0.00 C ATOM 1413 O ARG B 331 -11.117 -9.957 12.548 1.00 0.00 O ATOM 1414 CB ARG B 331 -11.470 -13.123 13.115 1.00 0.00 C ATOM 1415 CG ARG B 331 -10.896 -12.619 14.445 1.00 0.00 C ATOM 1416 CD ARG B 331 -10.273 -13.744 15.274 1.00 0.00 C ATOM 1417 NE ARG B 331 -8.957 -14.184 14.760 1.00 0.00 N ATOM 1418 CZ ARG B 331 -8.527 -15.415 14.540 1.00 0.00 C ATOM 1419 NH1 ARG B 331 -9.308 -16.454 14.537 1.00 0.00 N ATOM 1420 NH2 ARG B 331 -7.263 -15.634 14.319 1.00 0.00 N ATOM 0 H ARG B 331 -12.956 -13.660 11.249 1.00 0.00 H new ATOM 0 HA ARG B 331 -12.958 -11.558 13.131 1.00 0.00 H new ATOM 0 HB2 ARG B 331 -12.093 -13.999 13.296 1.00 0.00 H new ATOM 0 HB3 ARG B 331 -10.655 -13.440 12.464 1.00 0.00 H new ATOM 0 HG2 ARG B 331 -10.142 -11.857 14.247 1.00 0.00 H new ATOM 0 HG3 ARG B 331 -11.688 -12.142 15.022 1.00 0.00 H new ATOM 0 HD2 ARG B 331 -10.160 -13.408 16.305 1.00 0.00 H new ATOM 0 HD3 ARG B 331 -10.953 -14.595 15.289 1.00 0.00 H new ATOM 0 HE ARG B 331 -8.294 -13.439 14.547 1.00 0.00 H new ATOM 0 HH11 ARG B 331 -10.307 -16.342 14.710 1.00 0.00 H new ATOM 0 HH12 ARG B 331 -8.922 -17.382 14.361 1.00 0.00 H new ATOM 0 HH21 ARG B 331 -6.604 -14.856 14.315 1.00 0.00 H new ATOM 0 HH22 ARG B 331 -6.932 -16.584 14.149 1.00 0.00 H new ATOM 1434 N TYR B 332 -10.985 -11.055 10.581 1.00 0.00 N ATOM 1435 CA TYR B 332 -10.039 -10.163 9.897 1.00 0.00 C ATOM 1436 C TYR B 332 -10.550 -9.630 8.543 1.00 0.00 C ATOM 1437 O TYR B 332 -9.743 -9.244 7.696 1.00 0.00 O ATOM 1438 CB TYR B 332 -8.693 -10.884 9.707 1.00 0.00 C ATOM 1439 CG TYR B 332 -8.021 -11.484 10.928 1.00 0.00 C ATOM 1440 CD1 TYR B 332 -7.868 -10.732 12.109 1.00 0.00 C ATOM 1441 CD2 TYR B 332 -7.458 -12.772 10.841 1.00 0.00 C ATOM 1442 CE1 TYR B 332 -7.156 -11.263 13.201 1.00 0.00 C ATOM 1443 CE2 TYR B 332 -6.729 -13.300 11.922 1.00 0.00 C ATOM 1444 CZ TYR B 332 -6.570 -12.543 13.102 1.00 0.00 C ATOM 1445 OH TYR B 332 -5.894 -13.071 14.159 1.00 0.00 O ATOM 0 H TYR B 332 -11.312 -11.811 9.980 1.00 0.00 H new ATOM 0 HA TYR B 332 -9.919 -9.290 10.538 1.00 0.00 H new ATOM 0 HB2 TYR B 332 -8.844 -11.685 8.983 1.00 0.00 H new ATOM 0 HB3 TYR B 332 -7.997 -10.176 9.258 1.00 0.00 H new ATOM 0 HD1 TYR B 332 -8.299 -9.744 12.177 1.00 0.00 H new ATOM 0 HD2 TYR B 332 -7.586 -13.356 9.942 1.00 0.00 H new ATOM 0 HE1 TYR B 332 -7.058 -10.692 14.113 1.00 0.00 H new ATOM 0 HE2 TYR B 332 -6.291 -14.285 11.849 1.00 0.00 H new ATOM 0 HH TYR B 332 -6.275 -12.729 14.995 1.00 0.00 H new ATOM 1455 N GLU B 333 -11.864 -9.625 8.278 1.00 0.00 N ATOM 1456 CA GLU B 333 -12.393 -9.305 6.937 1.00 0.00 C ATOM 1457 C GLU B 333 -11.966 -7.929 6.385 1.00 0.00 C ATOM 1458 O GLU B 333 -11.801 -7.773 5.175 1.00 0.00 O ATOM 1459 CB GLU B 333 -13.918 -9.501 6.866 1.00 0.00 C ATOM 1460 CG GLU B 333 -14.777 -8.430 7.558 1.00 0.00 C ATOM 1461 CD GLU B 333 -16.234 -8.505 7.064 1.00 0.00 C ATOM 1462 OE1 GLU B 333 -16.502 -8.012 5.938 1.00 0.00 O ATOM 1463 OE2 GLU B 333 -17.108 -9.048 7.782 1.00 0.00 O ATOM 0 H GLU B 333 -12.582 -9.838 8.971 1.00 0.00 H new ATOM 0 HA GLU B 333 -11.923 -10.029 6.271 1.00 0.00 H new ATOM 0 HB2 GLU B 333 -14.208 -9.546 5.816 1.00 0.00 H new ATOM 0 HB3 GLU B 333 -14.159 -10.469 7.305 1.00 0.00 H new ATOM 0 HG2 GLU B 333 -14.745 -8.572 8.638 1.00 0.00 H new ATOM 0 HG3 GLU B 333 -14.368 -7.440 7.355 1.00 0.00 H new ATOM 1470 N HIS B 334 -11.733 -6.938 7.249 1.00 0.00 N ATOM 1471 CA HIS B 334 -11.151 -5.648 6.872 1.00 0.00 C ATOM 1472 C HIS B 334 -9.723 -5.808 6.338 1.00 0.00 C ATOM 1473 O HIS B 334 -9.414 -5.389 5.223 1.00 0.00 O ATOM 1474 CB HIS B 334 -11.171 -4.710 8.087 1.00 0.00 C ATOM 1475 CG HIS B 334 -12.538 -4.138 8.372 1.00 0.00 C ATOM 1476 ND1 HIS B 334 -13.361 -4.481 9.423 1.00 0.00 N ATOM 1477 CD2 HIS B 334 -13.188 -3.191 7.626 1.00 0.00 C ATOM 1478 CE1 HIS B 334 -14.490 -3.757 9.316 1.00 0.00 C ATOM 1479 NE2 HIS B 334 -14.429 -2.957 8.235 1.00 0.00 N ATOM 0 H HIS B 334 -11.946 -7.010 8.244 1.00 0.00 H new ATOM 0 HA HIS B 334 -11.749 -5.219 6.068 1.00 0.00 H new ATOM 0 HB2 HIS B 334 -10.822 -5.254 8.964 1.00 0.00 H new ATOM 0 HB3 HIS B 334 -10.470 -3.893 7.919 1.00 0.00 H new ATOM 0 HD2 HIS B 334 -12.814 -2.713 6.733 1.00 0.00 H new ATOM 0 HE1 HIS B 334 -15.325 -3.810 9.999 1.00 0.00 H new ATOM 0 HE2 HIS B 334 -15.148 -2.306 7.920 1.00 0.00 H new ATOM 1487 N GLN B 335 -8.846 -6.434 7.122 1.00 0.00 N ATOM 1488 CA GLN B 335 -7.448 -6.680 6.773 1.00 0.00 C ATOM 1489 C GLN B 335 -7.297 -7.562 5.525 1.00 0.00 C ATOM 1490 O GLN B 335 -6.455 -7.273 4.676 1.00 0.00 O ATOM 1491 CB GLN B 335 -6.732 -7.313 7.971 1.00 0.00 C ATOM 1492 CG GLN B 335 -6.704 -6.408 9.214 1.00 0.00 C ATOM 1493 CD GLN B 335 -7.749 -6.796 10.260 1.00 0.00 C ATOM 1494 OE1 GLN B 335 -8.946 -6.838 10.005 1.00 0.00 O ATOM 1495 NE2 GLN B 335 -7.342 -7.087 11.475 1.00 0.00 N ATOM 0 H GLN B 335 -9.096 -6.794 8.043 1.00 0.00 H new ATOM 0 HA GLN B 335 -6.990 -5.721 6.530 1.00 0.00 H new ATOM 0 HB2 GLN B 335 -7.225 -8.251 8.225 1.00 0.00 H new ATOM 0 HB3 GLN B 335 -5.709 -7.557 7.686 1.00 0.00 H new ATOM 0 HG2 GLN B 335 -5.713 -6.451 9.666 1.00 0.00 H new ATOM 0 HG3 GLN B 335 -6.870 -5.375 8.908 1.00 0.00 H new ATOM 0 HE21 GLN B 335 -6.348 -7.056 11.701 1.00 0.00 H new ATOM 0 HE22 GLN B 335 -8.020 -7.344 12.192 1.00 0.00 H new ATOM 1504 N LEU B 336 -8.140 -8.590 5.368 1.00 0.00 N ATOM 1505 CA LEU B 336 -8.218 -9.417 4.158 1.00 0.00 C ATOM 1506 C LEU B 336 -8.499 -8.562 2.910 1.00 0.00 C ATOM 1507 O LEU B 336 -7.752 -8.646 1.933 1.00 0.00 O ATOM 1508 CB LEU B 336 -9.275 -10.525 4.345 1.00 0.00 C ATOM 1509 CG LEU B 336 -8.862 -11.640 5.328 1.00 0.00 C ATOM 1510 CD1 LEU B 336 -10.048 -12.556 5.627 1.00 0.00 C ATOM 1511 CD2 LEU B 336 -7.748 -12.518 4.754 1.00 0.00 C ATOM 0 H LEU B 336 -8.799 -8.875 6.092 1.00 0.00 H new ATOM 0 HA LEU B 336 -7.251 -9.893 3.998 1.00 0.00 H new ATOM 0 HB2 LEU B 336 -10.201 -10.071 4.698 1.00 0.00 H new ATOM 0 HB3 LEU B 336 -9.489 -10.974 3.375 1.00 0.00 H new ATOM 0 HG LEU B 336 -8.512 -11.141 6.232 1.00 0.00 H new ATOM 0 HD11 LEU B 336 -9.739 -13.337 6.322 1.00 0.00 H new ATOM 0 HD12 LEU B 336 -10.855 -11.973 6.072 1.00 0.00 H new ATOM 0 HD13 LEU B 336 -10.398 -13.012 4.701 1.00 0.00 H new ATOM 0 HD21 LEU B 336 -7.485 -13.291 5.476 1.00 0.00 H new ATOM 0 HD22 LEU B 336 -8.092 -12.985 3.831 1.00 0.00 H new ATOM 0 HD23 LEU B 336 -6.872 -11.904 4.545 1.00 0.00 H new ATOM 1523 N ARG B 337 -9.515 -7.687 2.960 1.00 0.00 N ATOM 1524 CA ARG B 337 -9.803 -6.700 1.900 1.00 0.00 C ATOM 1525 C ARG B 337 -8.616 -5.768 1.636 1.00 0.00 C ATOM 1526 O ARG B 337 -8.278 -5.557 0.477 1.00 0.00 O ATOM 1527 CB ARG B 337 -11.075 -5.892 2.231 1.00 0.00 C ATOM 1528 CG ARG B 337 -12.370 -6.446 1.612 1.00 0.00 C ATOM 1529 CD ARG B 337 -12.645 -7.923 1.933 1.00 0.00 C ATOM 1530 NE ARG B 337 -14.091 -8.217 2.013 1.00 0.00 N ATOM 1531 CZ ARG B 337 -14.875 -8.006 3.058 1.00 0.00 C ATOM 1532 NH1 ARG B 337 -14.451 -7.448 4.149 1.00 0.00 N ATOM 1533 NH2 ARG B 337 -16.124 -8.362 3.070 1.00 0.00 N ATOM 0 H ARG B 337 -10.167 -7.642 3.743 1.00 0.00 H new ATOM 0 HA ARG B 337 -9.979 -7.260 0.982 1.00 0.00 H new ATOM 0 HB2 ARG B 337 -11.193 -5.855 3.314 1.00 0.00 H new ATOM 0 HB3 ARG B 337 -10.936 -4.866 1.890 1.00 0.00 H new ATOM 0 HG2 ARG B 337 -13.211 -5.848 1.963 1.00 0.00 H new ATOM 0 HG3 ARG B 337 -12.322 -6.325 0.530 1.00 0.00 H new ATOM 0 HD2 ARG B 337 -12.190 -8.550 1.166 1.00 0.00 H new ATOM 0 HD3 ARG B 337 -12.170 -8.182 2.880 1.00 0.00 H new ATOM 0 HE ARG B 337 -14.526 -8.621 1.184 1.00 0.00 H new ATOM 0 HH11 ARG B 337 -13.478 -7.152 4.226 1.00 0.00 H new ATOM 0 HH12 ARG B 337 -15.091 -7.305 4.930 1.00 0.00 H new ATOM 0 HH21 ARG B 337 -16.531 -8.821 2.255 1.00 0.00 H new ATOM 0 HH22 ARG B 337 -16.698 -8.183 3.894 1.00 0.00 H new ATOM 1547 N GLN B 338 -7.963 -5.231 2.670 1.00 0.00 N ATOM 1548 CA GLN B 338 -6.811 -4.325 2.515 1.00 0.00 C ATOM 1549 C GLN B 338 -5.611 -5.012 1.835 1.00 0.00 C ATOM 1550 O GLN B 338 -4.987 -4.428 0.949 1.00 0.00 O ATOM 1551 CB GLN B 338 -6.418 -3.695 3.864 1.00 0.00 C ATOM 1552 CG GLN B 338 -7.541 -2.834 4.461 1.00 0.00 C ATOM 1553 CD GLN B 338 -7.399 -1.427 3.934 1.00 0.00 C ATOM 1554 OE1 GLN B 338 -7.824 -1.083 2.842 1.00 0.00 O ATOM 1555 NE2 GLN B 338 -6.709 -0.594 4.665 1.00 0.00 N ATOM 0 H GLN B 338 -8.215 -5.410 3.642 1.00 0.00 H new ATOM 0 HA GLN B 338 -7.122 -3.521 1.848 1.00 0.00 H new ATOM 0 HB2 GLN B 338 -6.157 -4.485 4.568 1.00 0.00 H new ATOM 0 HB3 GLN B 338 -5.527 -3.082 3.729 1.00 0.00 H new ATOM 0 HG2 GLN B 338 -8.515 -3.243 4.192 1.00 0.00 H new ATOM 0 HG3 GLN B 338 -7.483 -2.838 5.549 1.00 0.00 H new ATOM 0 HE21 GLN B 338 -6.356 -0.887 5.576 1.00 0.00 H new ATOM 0 HE22 GLN B 338 -6.523 0.349 4.325 1.00 0.00 H new ATOM 1564 N LEU B 339 -5.320 -6.273 2.180 1.00 0.00 N ATOM 1565 CA LEU B 339 -4.334 -7.111 1.484 1.00 0.00 C ATOM 1566 C LEU B 339 -4.708 -7.334 0.011 1.00 0.00 C ATOM 1567 O LEU B 339 -3.882 -7.096 -0.873 1.00 0.00 O ATOM 1568 CB LEU B 339 -4.173 -8.454 2.221 1.00 0.00 C ATOM 1569 CG LEU B 339 -3.448 -8.351 3.574 1.00 0.00 C ATOM 1570 CD1 LEU B 339 -3.561 -9.686 4.305 1.00 0.00 C ATOM 1571 CD2 LEU B 339 -1.967 -8.015 3.403 1.00 0.00 C ATOM 0 H LEU B 339 -5.770 -6.747 2.963 1.00 0.00 H new ATOM 0 HA LEU B 339 -3.380 -6.585 1.492 1.00 0.00 H new ATOM 0 HB2 LEU B 339 -5.160 -8.887 2.383 1.00 0.00 H new ATOM 0 HB3 LEU B 339 -3.624 -9.144 1.580 1.00 0.00 H new ATOM 0 HG LEU B 339 -3.919 -7.549 4.143 1.00 0.00 H new ATOM 0 HD11 LEU B 339 -3.049 -9.620 5.265 1.00 0.00 H new ATOM 0 HD12 LEU B 339 -4.612 -9.923 4.470 1.00 0.00 H new ATOM 0 HD13 LEU B 339 -3.103 -10.470 3.703 1.00 0.00 H new ATOM 0 HD21 LEU B 339 -1.493 -7.952 4.382 1.00 0.00 H new ATOM 0 HD22 LEU B 339 -1.483 -8.795 2.815 1.00 0.00 H new ATOM 0 HD23 LEU B 339 -1.868 -7.059 2.889 1.00 0.00 H new ATOM 1583 N ASN B 340 -5.950 -7.742 -0.274 1.00 0.00 N ATOM 1584 CA ASN B 340 -6.447 -7.874 -1.650 1.00 0.00 C ATOM 1585 C ASN B 340 -6.267 -6.568 -2.453 1.00 0.00 C ATOM 1586 O ASN B 340 -5.722 -6.587 -3.554 1.00 0.00 O ATOM 1587 CB ASN B 340 -7.936 -8.260 -1.681 1.00 0.00 C ATOM 1588 CG ASN B 340 -8.365 -9.540 -0.986 1.00 0.00 C ATOM 1589 OD1 ASN B 340 -9.485 -9.655 -0.507 1.00 0.00 O ATOM 1590 ND2 ASN B 340 -7.554 -10.569 -0.959 1.00 0.00 N ATOM 0 H ASN B 340 -6.637 -7.989 0.439 1.00 0.00 H new ATOM 0 HA ASN B 340 -5.854 -8.666 -2.108 1.00 0.00 H new ATOM 0 HB2 ASN B 340 -8.501 -7.438 -1.241 1.00 0.00 H new ATOM 0 HB3 ASN B 340 -8.239 -8.332 -2.726 1.00 0.00 H new ATOM 0 HD21 ASN B 340 -7.860 -11.449 -0.543 1.00 0.00 H new ATOM 0 HD22 ASN B 340 -6.617 -10.490 -1.354 1.00 0.00 H new ATOM 1597 N ASP B 341 -6.715 -5.436 -1.898 1.00 0.00 N ATOM 1598 CA ASP B 341 -6.705 -4.106 -2.523 1.00 0.00 C ATOM 1599 C ASP B 341 -5.275 -3.577 -2.776 1.00 0.00 C ATOM 1600 O ASP B 341 -5.048 -2.848 -3.744 1.00 0.00 O ATOM 1601 CB ASP B 341 -7.542 -3.149 -1.648 1.00 0.00 C ATOM 1602 CG ASP B 341 -8.006 -1.856 -2.349 1.00 0.00 C ATOM 1603 OD1 ASP B 341 -8.189 -1.849 -3.589 1.00 0.00 O ATOM 1604 OD2 ASP B 341 -8.262 -0.851 -1.639 1.00 0.00 O ATOM 0 H ASP B 341 -7.112 -5.420 -0.959 1.00 0.00 H new ATOM 0 HA ASP B 341 -7.155 -4.175 -3.514 1.00 0.00 H new ATOM 0 HB2 ASP B 341 -8.421 -3.685 -1.290 1.00 0.00 H new ATOM 0 HB3 ASP B 341 -6.955 -2.877 -0.771 1.00 0.00 H new ATOM 1609 N MET B 342 -4.290 -3.983 -1.960 1.00 0.00 N ATOM 1610 CA MET B 342 -2.862 -3.740 -2.218 1.00 0.00 C ATOM 1611 C MET B 342 -2.293 -4.642 -3.324 1.00 0.00 C ATOM 1612 O MET B 342 -1.375 -4.218 -4.029 1.00 0.00 O ATOM 1613 CB MET B 342 -2.034 -3.903 -0.930 1.00 0.00 C ATOM 1614 CG MET B 342 -2.174 -2.641 -0.079 1.00 0.00 C ATOM 1615 SD MET B 342 -1.032 -2.446 1.313 1.00 0.00 S ATOM 1616 CE MET B 342 -1.665 -3.708 2.436 1.00 0.00 C ATOM 0 H MET B 342 -4.464 -4.494 -1.094 1.00 0.00 H new ATOM 0 HA MET B 342 -2.787 -2.711 -2.568 1.00 0.00 H new ATOM 0 HB2 MET B 342 -2.377 -4.773 -0.371 1.00 0.00 H new ATOM 0 HB3 MET B 342 -0.986 -4.075 -1.176 1.00 0.00 H new ATOM 0 HG2 MET B 342 -2.057 -1.778 -0.734 1.00 0.00 H new ATOM 0 HG3 MET B 342 -3.191 -2.609 0.312 1.00 0.00 H new ATOM 0 HE1 MET B 342 -1.045 -3.741 3.332 1.00 0.00 H new ATOM 0 HE2 MET B 342 -2.691 -3.467 2.713 1.00 0.00 H new ATOM 0 HE3 MET B 342 -1.641 -4.679 1.942 1.00 0.00 H new ATOM 1626 N GLY B 343 -2.840 -5.850 -3.507 1.00 0.00 N ATOM 1627 CA GLY B 343 -2.513 -6.759 -4.614 1.00 0.00 C ATOM 1628 C GLY B 343 -2.511 -8.265 -4.302 1.00 0.00 C ATOM 1629 O GLY B 343 -2.086 -9.040 -5.162 1.00 0.00 O ATOM 0 H GLY B 343 -3.541 -6.233 -2.873 1.00 0.00 H new ATOM 0 HA2 GLY B 343 -3.224 -6.581 -5.420 1.00 0.00 H new ATOM 0 HA3 GLY B 343 -1.527 -6.490 -4.993 1.00 0.00 H new ATOM 1633 N PHE B 344 -2.941 -8.711 -3.113 1.00 0.00 N ATOM 1634 CA PHE B 344 -2.800 -10.108 -2.670 1.00 0.00 C ATOM 1635 C PHE B 344 -4.143 -10.835 -2.702 1.00 0.00 C ATOM 1636 O PHE B 344 -4.858 -10.889 -1.701 1.00 0.00 O ATOM 1637 CB PHE B 344 -2.169 -10.185 -1.273 1.00 0.00 C ATOM 1638 CG PHE B 344 -0.750 -9.674 -1.179 1.00 0.00 C ATOM 1639 CD1 PHE B 344 0.328 -10.502 -1.550 1.00 0.00 C ATOM 1640 CD2 PHE B 344 -0.506 -8.381 -0.688 1.00 0.00 C ATOM 1641 CE1 PHE B 344 1.650 -10.041 -1.420 1.00 0.00 C ATOM 1642 CE2 PHE B 344 0.817 -7.930 -0.545 1.00 0.00 C ATOM 1643 CZ PHE B 344 1.896 -8.758 -0.901 1.00 0.00 C ATOM 0 H PHE B 344 -3.399 -8.111 -2.427 1.00 0.00 H new ATOM 0 HA PHE B 344 -2.131 -10.610 -3.369 1.00 0.00 H new ATOM 0 HB2 PHE B 344 -2.789 -9.617 -0.580 1.00 0.00 H new ATOM 0 HB3 PHE B 344 -2.187 -11.223 -0.940 1.00 0.00 H new ATOM 0 HD1 PHE B 344 0.138 -11.493 -1.935 1.00 0.00 H new ATOM 0 HD2 PHE B 344 -1.331 -7.737 -0.422 1.00 0.00 H new ATOM 0 HE1 PHE B 344 2.475 -10.671 -1.718 1.00 0.00 H new ATOM 0 HE2 PHE B 344 1.007 -6.939 -0.159 1.00 0.00 H new ATOM 0 HZ PHE B 344 2.911 -8.409 -0.776 1.00 0.00 H new ATOM 1653 N PHE B 345 -4.510 -11.393 -3.854 1.00 0.00 N ATOM 1654 CA PHE B 345 -5.765 -12.138 -4.030 1.00 0.00 C ATOM 1655 C PHE B 345 -5.713 -13.589 -3.498 1.00 0.00 C ATOM 1656 O PHE B 345 -6.736 -14.274 -3.460 1.00 0.00 O ATOM 1657 CB PHE B 345 -6.173 -12.066 -5.509 1.00 0.00 C ATOM 1658 CG PHE B 345 -6.387 -10.637 -5.980 1.00 0.00 C ATOM 1659 CD1 PHE B 345 -7.554 -9.944 -5.605 1.00 0.00 C ATOM 1660 CD2 PHE B 345 -5.396 -9.977 -6.734 1.00 0.00 C ATOM 1661 CE1 PHE B 345 -7.730 -8.599 -5.979 1.00 0.00 C ATOM 1662 CE2 PHE B 345 -5.571 -8.631 -7.106 1.00 0.00 C ATOM 1663 CZ PHE B 345 -6.737 -7.942 -6.728 1.00 0.00 C ATOM 0 H PHE B 345 -3.944 -11.343 -4.701 1.00 0.00 H new ATOM 0 HA PHE B 345 -6.531 -11.664 -3.415 1.00 0.00 H new ATOM 0 HB2 PHE B 345 -5.402 -12.536 -6.120 1.00 0.00 H new ATOM 0 HB3 PHE B 345 -7.090 -12.637 -5.659 1.00 0.00 H new ATOM 0 HD1 PHE B 345 -8.317 -10.446 -5.028 1.00 0.00 H new ATOM 0 HD2 PHE B 345 -4.501 -10.505 -7.027 1.00 0.00 H new ATOM 0 HE1 PHE B 345 -8.627 -8.071 -5.691 1.00 0.00 H new ATOM 0 HE2 PHE B 345 -4.809 -8.127 -7.682 1.00 0.00 H new ATOM 0 HZ PHE B 345 -6.870 -6.909 -7.013 1.00 0.00 H new ATOM 1673 N ASP B 346 -4.544 -14.059 -3.047 1.00 0.00 N ATOM 1674 CA ASP B 346 -4.337 -15.358 -2.389 1.00 0.00 C ATOM 1675 C ASP B 346 -4.901 -15.374 -0.952 1.00 0.00 C ATOM 1676 O ASP B 346 -4.171 -15.261 0.035 1.00 0.00 O ATOM 1677 CB ASP B 346 -2.844 -15.726 -2.406 1.00 0.00 C ATOM 1678 CG ASP B 346 -2.292 -15.912 -3.827 1.00 0.00 C ATOM 1679 OD1 ASP B 346 -2.737 -16.847 -4.536 1.00 0.00 O ATOM 1680 OD2 ASP B 346 -1.388 -15.139 -4.226 1.00 0.00 O ATOM 0 H ASP B 346 -3.680 -13.524 -3.133 1.00 0.00 H new ATOM 0 HA ASP B 346 -4.890 -16.111 -2.951 1.00 0.00 H new ATOM 0 HB2 ASP B 346 -2.276 -14.945 -1.900 1.00 0.00 H new ATOM 0 HB3 ASP B 346 -2.695 -16.646 -1.840 1.00 0.00 H new ATOM 1685 N PHE B 347 -6.221 -15.537 -0.833 1.00 0.00 N ATOM 1686 CA PHE B 347 -6.973 -15.588 0.428 1.00 0.00 C ATOM 1687 C PHE B 347 -6.357 -16.532 1.474 1.00 0.00 C ATOM 1688 O PHE B 347 -6.148 -16.141 2.620 1.00 0.00 O ATOM 1689 CB PHE B 347 -8.438 -15.951 0.136 1.00 0.00 C ATOM 1690 CG PHE B 347 -8.672 -17.240 -0.640 1.00 0.00 C ATOM 1691 CD1 PHE B 347 -8.663 -17.233 -2.049 1.00 0.00 C ATOM 1692 CD2 PHE B 347 -8.906 -18.449 0.046 1.00 0.00 C ATOM 1693 CE1 PHE B 347 -8.862 -18.427 -2.765 1.00 0.00 C ATOM 1694 CE2 PHE B 347 -9.103 -19.643 -0.670 1.00 0.00 C ATOM 1695 CZ PHE B 347 -9.079 -19.633 -2.076 1.00 0.00 C ATOM 0 H PHE B 347 -6.824 -15.642 -1.649 1.00 0.00 H new ATOM 0 HA PHE B 347 -6.924 -14.596 0.876 1.00 0.00 H new ATOM 0 HB2 PHE B 347 -8.969 -16.022 1.085 1.00 0.00 H new ATOM 0 HB3 PHE B 347 -8.890 -15.130 -0.421 1.00 0.00 H new ATOM 0 HD1 PHE B 347 -8.503 -16.307 -2.581 1.00 0.00 H new ATOM 0 HD2 PHE B 347 -8.934 -18.458 1.126 1.00 0.00 H new ATOM 0 HE1 PHE B 347 -8.848 -18.417 -3.845 1.00 0.00 H new ATOM 0 HE2 PHE B 347 -9.273 -20.568 -0.140 1.00 0.00 H new ATOM 0 HZ PHE B 347 -9.227 -20.551 -2.626 1.00 0.00 H new ATOM 1705 N ASP B 348 -6.025 -17.760 1.077 1.00 0.00 N ATOM 1706 CA ASP B 348 -5.398 -18.777 1.932 1.00 0.00 C ATOM 1707 C ASP B 348 -4.053 -18.319 2.534 1.00 0.00 C ATOM 1708 O ASP B 348 -3.819 -18.494 3.733 1.00 0.00 O ATOM 1709 CB ASP B 348 -5.234 -20.070 1.121 1.00 0.00 C ATOM 1710 CG ASP B 348 -4.689 -21.221 1.983 1.00 0.00 C ATOM 1711 OD1 ASP B 348 -5.464 -21.795 2.786 1.00 0.00 O ATOM 1712 OD2 ASP B 348 -3.491 -21.566 1.848 1.00 0.00 O ATOM 0 H ASP B 348 -6.188 -18.088 0.125 1.00 0.00 H new ATOM 0 HA ASP B 348 -6.052 -18.951 2.786 1.00 0.00 H new ATOM 0 HB2 ASP B 348 -6.196 -20.358 0.697 1.00 0.00 H new ATOM 0 HB3 ASP B 348 -4.558 -19.891 0.285 1.00 0.00 H new ATOM 1717 N ARG B 349 -3.191 -17.677 1.730 1.00 0.00 N ATOM 1718 CA ARG B 349 -1.924 -17.082 2.196 1.00 0.00 C ATOM 1719 C ARG B 349 -2.175 -15.926 3.161 1.00 0.00 C ATOM 1720 O ARG B 349 -1.547 -15.867 4.216 1.00 0.00 O ATOM 1721 CB ARG B 349 -1.049 -16.601 1.034 1.00 0.00 C ATOM 1722 CG ARG B 349 -0.555 -17.751 0.153 1.00 0.00 C ATOM 1723 CD ARG B 349 0.351 -17.223 -0.966 1.00 0.00 C ATOM 1724 NE ARG B 349 1.673 -16.786 -0.475 1.00 0.00 N ATOM 1725 CZ ARG B 349 2.366 -15.705 -0.781 1.00 0.00 C ATOM 1726 NH1 ARG B 349 1.943 -14.790 -1.607 1.00 0.00 N ATOM 1727 NH2 ARG B 349 3.527 -15.540 -0.225 1.00 0.00 N ATOM 0 H ARG B 349 -3.353 -17.554 0.730 1.00 0.00 H new ATOM 0 HA ARG B 349 -1.388 -17.873 2.720 1.00 0.00 H new ATOM 0 HB2 ARG B 349 -1.616 -15.899 0.423 1.00 0.00 H new ATOM 0 HB3 ARG B 349 -0.191 -16.058 1.431 1.00 0.00 H new ATOM 0 HG2 ARG B 349 -0.009 -18.473 0.760 1.00 0.00 H new ATOM 0 HG3 ARG B 349 -1.406 -18.277 -0.279 1.00 0.00 H new ATOM 0 HD2 ARG B 349 0.487 -18.003 -1.715 1.00 0.00 H new ATOM 0 HD3 ARG B 349 -0.142 -16.387 -1.462 1.00 0.00 H new ATOM 0 HE ARG B 349 2.115 -17.411 0.199 1.00 0.00 H new ATOM 0 HH11 ARG B 349 1.032 -14.889 -2.055 1.00 0.00 H new ATOM 0 HH12 ARG B 349 2.523 -13.975 -1.806 1.00 0.00 H new ATOM 0 HH21 ARG B 349 3.882 -16.236 0.430 1.00 0.00 H new ATOM 0 HH22 ARG B 349 4.084 -14.714 -0.443 1.00 0.00 H new ATOM 1741 N ASN B 350 -3.108 -15.033 2.825 1.00 0.00 N ATOM 1742 CA ASN B 350 -3.486 -13.892 3.664 1.00 0.00 C ATOM 1743 C ASN B 350 -3.977 -14.356 5.044 1.00 0.00 C ATOM 1744 O ASN B 350 -3.525 -13.843 6.064 1.00 0.00 O ATOM 1745 CB ASN B 350 -4.568 -13.048 2.970 1.00 0.00 C ATOM 1746 CG ASN B 350 -4.155 -12.409 1.657 1.00 0.00 C ATOM 1747 OD1 ASN B 350 -3.004 -12.387 1.254 1.00 0.00 O ATOM 1748 ND2 ASN B 350 -5.105 -11.830 0.963 1.00 0.00 N ATOM 0 H ASN B 350 -3.630 -15.082 1.950 1.00 0.00 H new ATOM 0 HA ASN B 350 -2.599 -13.276 3.810 1.00 0.00 H new ATOM 0 HB2 ASN B 350 -5.437 -13.681 2.789 1.00 0.00 H new ATOM 0 HB3 ASN B 350 -4.884 -12.260 3.654 1.00 0.00 H new ATOM 0 HD21 ASN B 350 -4.882 -11.361 0.085 1.00 0.00 H new ATOM 0 HD22 ASN B 350 -6.067 -11.849 1.301 1.00 0.00 H new ATOM 1755 N VAL B 351 -4.859 -15.360 5.082 1.00 0.00 N ATOM 1756 CA VAL B 351 -5.332 -16.013 6.312 1.00 0.00 C ATOM 1757 C VAL B 351 -4.162 -16.578 7.117 1.00 0.00 C ATOM 1758 O VAL B 351 -4.031 -16.257 8.299 1.00 0.00 O ATOM 1759 CB VAL B 351 -6.382 -17.096 5.983 1.00 0.00 C ATOM 1760 CG1 VAL B 351 -6.638 -18.059 7.149 1.00 0.00 C ATOM 1761 CG2 VAL B 351 -7.717 -16.432 5.628 1.00 0.00 C ATOM 0 H VAL B 351 -5.276 -15.753 4.238 1.00 0.00 H new ATOM 0 HA VAL B 351 -5.818 -15.264 6.937 1.00 0.00 H new ATOM 0 HB VAL B 351 -5.979 -17.667 5.147 1.00 0.00 H new ATOM 0 HG11 VAL B 351 -7.385 -18.796 6.855 1.00 0.00 H new ATOM 0 HG12 VAL B 351 -5.710 -18.568 7.411 1.00 0.00 H new ATOM 0 HG13 VAL B 351 -7.001 -17.499 8.011 1.00 0.00 H new ATOM 0 HG21 VAL B 351 -8.455 -17.200 5.396 1.00 0.00 H new ATOM 0 HG22 VAL B 351 -8.064 -15.838 6.474 1.00 0.00 H new ATOM 0 HG23 VAL B 351 -7.582 -15.785 4.761 1.00 0.00 H new ATOM 1771 N ALA B 352 -3.288 -17.382 6.501 1.00 0.00 N ATOM 1772 CA ALA B 352 -2.150 -17.985 7.191 1.00 0.00 C ATOM 1773 C ALA B 352 -1.167 -16.937 7.752 1.00 0.00 C ATOM 1774 O ALA B 352 -0.560 -17.160 8.801 1.00 0.00 O ATOM 1775 CB ALA B 352 -1.469 -18.963 6.227 1.00 0.00 C ATOM 0 H ALA B 352 -3.352 -17.630 5.514 1.00 0.00 H new ATOM 0 HA ALA B 352 -2.510 -18.525 8.067 1.00 0.00 H new ATOM 0 HB1 ALA B 352 -0.615 -19.426 6.721 1.00 0.00 H new ATOM 0 HB2 ALA B 352 -2.179 -19.735 5.930 1.00 0.00 H new ATOM 0 HB3 ALA B 352 -1.128 -18.424 5.343 1.00 0.00 H new ATOM 1781 N ALA B 353 -1.038 -15.787 7.084 1.00 0.00 N ATOM 1782 CA ALA B 353 -0.210 -14.655 7.488 1.00 0.00 C ATOM 1783 C ALA B 353 -0.835 -13.842 8.639 1.00 0.00 C ATOM 1784 O ALA B 353 -0.156 -13.538 9.620 1.00 0.00 O ATOM 1785 CB ALA B 353 0.036 -13.791 6.249 1.00 0.00 C ATOM 0 H ALA B 353 -1.532 -15.616 6.208 1.00 0.00 H new ATOM 0 HA ALA B 353 0.736 -15.024 7.884 1.00 0.00 H new ATOM 0 HB1 ALA B 353 0.654 -12.935 6.519 1.00 0.00 H new ATOM 0 HB2 ALA B 353 0.548 -14.382 5.489 1.00 0.00 H new ATOM 0 HB3 ALA B 353 -0.918 -13.440 5.855 1.00 0.00 H new ATOM 1791 N LEU B 354 -2.132 -13.526 8.572 1.00 0.00 N ATOM 1792 CA LEU B 354 -2.857 -12.820 9.638 1.00 0.00 C ATOM 1793 C LEU B 354 -2.913 -13.643 10.937 1.00 0.00 C ATOM 1794 O LEU B 354 -2.758 -13.092 12.029 1.00 0.00 O ATOM 1795 CB LEU B 354 -4.263 -12.442 9.140 1.00 0.00 C ATOM 1796 CG LEU B 354 -4.257 -11.335 8.067 1.00 0.00 C ATOM 1797 CD1 LEU B 354 -5.599 -11.315 7.342 1.00 0.00 C ATOM 1798 CD2 LEU B 354 -4.026 -9.949 8.671 1.00 0.00 C ATOM 0 H LEU B 354 -2.716 -13.755 7.768 1.00 0.00 H new ATOM 0 HA LEU B 354 -2.315 -11.906 9.881 1.00 0.00 H new ATOM 0 HB2 LEU B 354 -4.747 -13.330 8.732 1.00 0.00 H new ATOM 0 HB3 LEU B 354 -4.864 -12.113 9.988 1.00 0.00 H new ATOM 0 HG LEU B 354 -3.440 -11.559 7.381 1.00 0.00 H new ATOM 0 HD11 LEU B 354 -5.592 -10.531 6.584 1.00 0.00 H new ATOM 0 HD12 LEU B 354 -5.769 -12.280 6.865 1.00 0.00 H new ATOM 0 HD13 LEU B 354 -6.397 -11.119 8.058 1.00 0.00 H new ATOM 0 HD21 LEU B 354 -4.030 -9.201 7.878 1.00 0.00 H new ATOM 0 HD22 LEU B 354 -4.820 -9.726 9.384 1.00 0.00 H new ATOM 0 HD23 LEU B 354 -3.064 -9.931 9.182 1.00 0.00 H new ATOM 1810 N ARG B 355 -3.033 -14.974 10.819 1.00 0.00 N ATOM 1811 CA ARG B 355 -2.962 -15.944 11.929 1.00 0.00 C ATOM 1812 C ARG B 355 -1.666 -15.887 12.754 1.00 0.00 C ATOM 1813 O ARG B 355 -1.699 -16.264 13.927 1.00 0.00 O ATOM 1814 CB ARG B 355 -3.140 -17.370 11.377 1.00 0.00 C ATOM 1815 CG ARG B 355 -4.608 -17.773 11.162 1.00 0.00 C ATOM 1816 CD ARG B 355 -4.664 -19.137 10.461 1.00 0.00 C ATOM 1817 NE ARG B 355 -6.023 -19.715 10.467 1.00 0.00 N ATOM 1818 CZ ARG B 355 -6.456 -20.735 9.744 1.00 0.00 C ATOM 1819 NH1 ARG B 355 -5.697 -21.343 8.876 1.00 0.00 N ATOM 1820 NH2 ARG B 355 -7.674 -21.175 9.881 1.00 0.00 N ATOM 0 H ARG B 355 -3.188 -15.423 9.917 1.00 0.00 H new ATOM 0 HA ARG B 355 -3.768 -15.669 12.610 1.00 0.00 H new ATOM 0 HB2 ARG B 355 -2.608 -17.452 10.429 1.00 0.00 H new ATOM 0 HB3 ARG B 355 -2.676 -18.077 12.065 1.00 0.00 H new ATOM 0 HG2 ARG B 355 -5.127 -17.822 12.119 1.00 0.00 H new ATOM 0 HG3 ARG B 355 -5.119 -17.021 10.560 1.00 0.00 H new ATOM 0 HD2 ARG B 355 -4.322 -19.028 9.432 1.00 0.00 H new ATOM 0 HD3 ARG B 355 -3.977 -19.825 10.954 1.00 0.00 H new ATOM 0 HE ARG B 355 -6.700 -19.282 11.095 1.00 0.00 H new ATOM 0 HH11 ARG B 355 -4.734 -21.036 8.736 1.00 0.00 H new ATOM 0 HH12 ARG B 355 -6.066 -22.126 8.336 1.00 0.00 H new ATOM 0 HH21 ARG B 355 -8.304 -20.733 10.550 1.00 0.00 H new ATOM 0 HH22 ARG B 355 -7.998 -21.962 9.319 1.00 0.00 H new ATOM 1834 N ARG B 356 -0.543 -15.425 12.181 1.00 0.00 N ATOM 1835 CA ARG B 356 0.779 -15.369 12.844 1.00 0.00 C ATOM 1836 C ARG B 356 1.243 -13.945 13.143 1.00 0.00 C ATOM 1837 O ARG B 356 1.917 -13.712 14.146 1.00 0.00 O ATOM 1838 CB ARG B 356 1.809 -16.166 12.029 1.00 0.00 C ATOM 1839 CG ARG B 356 2.044 -15.637 10.607 1.00 0.00 C ATOM 1840 CD ARG B 356 2.913 -16.571 9.766 1.00 0.00 C ATOM 1841 NE ARG B 356 2.166 -17.775 9.363 1.00 0.00 N ATOM 1842 CZ ARG B 356 2.626 -18.824 8.709 1.00 0.00 C ATOM 1843 NH1 ARG B 356 3.855 -18.902 8.300 1.00 0.00 N ATOM 1844 NH2 ARG B 356 1.837 -19.825 8.443 1.00 0.00 N ATOM 0 H ARG B 356 -0.524 -15.072 11.224 1.00 0.00 H new ATOM 0 HA ARG B 356 0.678 -15.839 13.822 1.00 0.00 H new ATOM 0 HB2 ARG B 356 2.758 -16.164 12.565 1.00 0.00 H new ATOM 0 HB3 ARG B 356 1.480 -17.203 11.967 1.00 0.00 H new ATOM 0 HG2 ARG B 356 1.083 -15.498 10.112 1.00 0.00 H new ATOM 0 HG3 ARG B 356 2.519 -14.657 10.662 1.00 0.00 H new ATOM 0 HD2 ARG B 356 3.265 -16.044 8.879 1.00 0.00 H new ATOM 0 HD3 ARG B 356 3.796 -16.861 10.335 1.00 0.00 H new ATOM 0 HE ARG B 356 1.179 -17.800 9.619 1.00 0.00 H new ATOM 0 HH11 ARG B 356 4.503 -18.135 8.481 1.00 0.00 H new ATOM 0 HH12 ARG B 356 4.174 -19.730 7.797 1.00 0.00 H new ATOM 0 HH21 ARG B 356 0.862 -19.799 8.740 1.00 0.00 H new ATOM 0 HH22 ARG B 356 2.194 -20.635 7.937 1.00 0.00 H new ATOM 1858 N SER B 357 0.823 -12.991 12.316 1.00 0.00 N ATOM 1859 CA SER B 357 1.003 -11.553 12.533 1.00 0.00 C ATOM 1860 C SER B 357 0.203 -10.995 13.722 1.00 0.00 C ATOM 1861 O SER B 357 0.558 -9.947 14.267 1.00 0.00 O ATOM 1862 CB SER B 357 0.631 -10.799 11.255 1.00 0.00 C ATOM 1863 OG SER B 357 -0.756 -10.518 11.164 1.00 0.00 O ATOM 0 H SER B 357 0.332 -13.202 11.447 1.00 0.00 H new ATOM 0 HA SER B 357 2.054 -11.404 12.782 1.00 0.00 H new ATOM 0 HB2 SER B 357 1.189 -9.864 11.215 1.00 0.00 H new ATOM 0 HB3 SER B 357 0.935 -11.388 10.390 1.00 0.00 H new ATOM 0 HG SER B 357 -0.894 -9.737 10.589 1.00 0.00 H new ATOM 1869 N GLY B 358 -0.872 -11.683 14.130 1.00 0.00 N ATOM 1870 CA GLY B 358 -1.815 -11.232 15.159 1.00 0.00 C ATOM 1871 C GLY B 358 -2.958 -10.375 14.600 1.00 0.00 C ATOM 1872 O GLY B 358 -3.641 -9.689 15.364 1.00 0.00 O ATOM 0 H GLY B 358 -1.115 -12.594 13.741 1.00 0.00 H new ATOM 0 HA2 GLY B 358 -2.235 -12.102 15.663 1.00 0.00 H new ATOM 0 HA3 GLY B 358 -1.274 -10.658 15.911 1.00 0.00 H new ATOM 1876 N GLY B 359 -3.155 -10.381 13.276 1.00 0.00 N ATOM 1877 CA GLY B 359 -4.166 -9.587 12.574 1.00 0.00 C ATOM 1878 C GLY B 359 -3.662 -8.238 12.046 1.00 0.00 C ATOM 1879 O GLY B 359 -4.475 -7.394 11.666 1.00 0.00 O ATOM 0 H GLY B 359 -2.597 -10.957 12.646 1.00 0.00 H new ATOM 0 HA2 GLY B 359 -4.550 -10.170 11.737 1.00 0.00 H new ATOM 0 HA3 GLY B 359 -5.003 -9.409 13.249 1.00 0.00 H new ATOM 1883 N SER B 360 -2.345 -8.007 12.030 1.00 0.00 N ATOM 1884 CA SER B 360 -1.711 -6.842 11.397 1.00 0.00 C ATOM 1885 C SER B 360 -1.684 -6.991 9.872 1.00 0.00 C ATOM 1886 O SER B 360 -1.172 -7.989 9.359 1.00 0.00 O ATOM 1887 CB SER B 360 -0.274 -6.686 11.907 1.00 0.00 C ATOM 1888 OG SER B 360 0.354 -5.580 11.274 1.00 0.00 O ATOM 0 H SER B 360 -1.673 -8.639 12.466 1.00 0.00 H new ATOM 0 HA SER B 360 -2.297 -5.960 11.656 1.00 0.00 H new ATOM 0 HB2 SER B 360 -0.277 -6.542 12.987 1.00 0.00 H new ATOM 0 HB3 SER B 360 0.291 -7.597 11.709 1.00 0.00 H new ATOM 0 HG SER B 360 1.271 -5.489 11.609 1.00 0.00 H new ATOM 1894 N VAL B 361 -2.189 -5.986 9.143 1.00 0.00 N ATOM 1895 CA VAL B 361 -2.139 -5.914 7.669 1.00 0.00 C ATOM 1896 C VAL B 361 -0.689 -5.978 7.174 1.00 0.00 C ATOM 1897 O VAL B 361 -0.324 -6.884 6.432 1.00 0.00 O ATOM 1898 CB VAL B 361 -2.817 -4.635 7.125 1.00 0.00 C ATOM 1899 CG1 VAL B 361 -2.898 -4.666 5.593 1.00 0.00 C ATOM 1900 CG2 VAL B 361 -4.241 -4.419 7.637 1.00 0.00 C ATOM 0 H VAL B 361 -2.654 -5.183 9.566 1.00 0.00 H new ATOM 0 HA VAL B 361 -2.692 -6.774 7.291 1.00 0.00 H new ATOM 0 HB VAL B 361 -2.187 -3.821 7.484 1.00 0.00 H new ATOM 0 HG11 VAL B 361 -3.379 -3.755 5.236 1.00 0.00 H new ATOM 0 HG12 VAL B 361 -1.893 -4.733 5.177 1.00 0.00 H new ATOM 0 HG13 VAL B 361 -3.480 -5.532 5.277 1.00 0.00 H new ATOM 0 HG21 VAL B 361 -4.646 -3.502 7.210 1.00 0.00 H new ATOM 0 HG22 VAL B 361 -4.865 -5.263 7.343 1.00 0.00 H new ATOM 0 HG23 VAL B 361 -4.228 -4.338 8.724 1.00 0.00 H new ATOM 1910 N GLN B 362 0.154 -5.030 7.592 1.00 0.00 N ATOM 1911 CA GLN B 362 1.575 -4.969 7.225 1.00 0.00 C ATOM 1912 C GLN B 362 2.388 -6.143 7.798 1.00 0.00 C ATOM 1913 O GLN B 362 3.315 -6.622 7.145 1.00 0.00 O ATOM 1914 CB GLN B 362 2.163 -3.652 7.735 1.00 0.00 C ATOM 1915 CG GLN B 362 1.897 -2.536 6.731 1.00 0.00 C ATOM 1916 CD GLN B 362 2.621 -2.776 5.406 1.00 0.00 C ATOM 1917 OE1 GLN B 362 1.916 -2.803 4.298 1.00 0.00 O flip ATOM 1918 NE2 GLN B 362 3.826 -2.967 5.338 1.00 0.00 N flip ATOM 0 H GLN B 362 -0.135 -4.269 8.206 1.00 0.00 H new ATOM 0 HA GLN B 362 1.637 -5.033 6.139 1.00 0.00 H new ATOM 0 HB2 GLN B 362 1.723 -3.397 8.699 1.00 0.00 H new ATOM 0 HB3 GLN B 362 3.236 -3.761 7.894 1.00 0.00 H new ATOM 0 HG2 GLN B 362 0.825 -2.459 6.550 1.00 0.00 H new ATOM 0 HG3 GLN B 362 2.219 -1.584 7.153 1.00 0.00 H new ATOM 0 HE21 GLN B 362 4.394 -2.951 6.185 1.00 0.00 H new ATOM 0 HE22 GLN B 362 4.264 -3.143 4.434 1.00 0.00 H new ATOM 1927 N GLY B 363 2.041 -6.641 8.990 1.00 0.00 N ATOM 1928 CA GLY B 363 2.654 -7.844 9.563 1.00 0.00 C ATOM 1929 C GLY B 363 2.412 -9.083 8.695 1.00 0.00 C ATOM 1930 O GLY B 363 3.336 -9.860 8.449 1.00 0.00 O ATOM 0 H GLY B 363 1.327 -6.221 9.585 1.00 0.00 H new ATOM 0 HA2 GLY B 363 3.726 -7.685 9.676 1.00 0.00 H new ATOM 0 HA3 GLY B 363 2.250 -8.016 10.561 1.00 0.00 H new ATOM 1934 N ALA B 364 1.190 -9.246 8.177 1.00 0.00 N ATOM 1935 CA ALA B 364 0.872 -10.251 7.168 1.00 0.00 C ATOM 1936 C ALA B 364 1.595 -9.983 5.830 1.00 0.00 C ATOM 1937 O ALA B 364 2.150 -10.906 5.234 1.00 0.00 O ATOM 1938 CB ALA B 364 -0.651 -10.314 6.996 1.00 0.00 C ATOM 0 H ALA B 364 0.389 -8.677 8.452 1.00 0.00 H new ATOM 0 HA ALA B 364 1.234 -11.221 7.507 1.00 0.00 H new ATOM 0 HB1 ALA B 364 -0.902 -11.062 6.244 1.00 0.00 H new ATOM 0 HB2 ALA B 364 -1.113 -10.585 7.945 1.00 0.00 H new ATOM 0 HB3 ALA B 364 -1.022 -9.340 6.677 1.00 0.00 H new ATOM 1944 N LEU B 365 1.630 -8.727 5.369 1.00 0.00 N ATOM 1945 CA LEU B 365 2.297 -8.281 4.150 1.00 0.00 C ATOM 1946 C LEU B 365 3.796 -8.623 4.117 1.00 0.00 C ATOM 1947 O LEU B 365 4.297 -9.102 3.101 1.00 0.00 O ATOM 1948 CB LEU B 365 2.028 -6.772 4.002 1.00 0.00 C ATOM 1949 CG LEU B 365 2.279 -6.277 2.577 1.00 0.00 C ATOM 1950 CD1 LEU B 365 1.114 -5.448 2.053 1.00 0.00 C ATOM 1951 CD2 LEU B 365 3.544 -5.440 2.452 1.00 0.00 C ATOM 0 H LEU B 365 1.171 -7.961 5.863 1.00 0.00 H new ATOM 0 HA LEU B 365 1.888 -8.819 3.295 1.00 0.00 H new ATOM 0 HB2 LEU B 365 0.996 -6.560 4.282 1.00 0.00 H new ATOM 0 HB3 LEU B 365 2.666 -6.222 4.694 1.00 0.00 H new ATOM 0 HG LEU B 365 2.394 -7.183 1.982 1.00 0.00 H new ATOM 0 HD11 LEU B 365 1.332 -5.115 1.038 1.00 0.00 H new ATOM 0 HD12 LEU B 365 0.208 -6.054 2.050 1.00 0.00 H new ATOM 0 HD13 LEU B 365 0.967 -4.580 2.696 1.00 0.00 H new ATOM 0 HD21 LEU B 365 3.667 -5.119 1.418 1.00 0.00 H new ATOM 0 HD22 LEU B 365 3.466 -4.565 3.097 1.00 0.00 H new ATOM 0 HD23 LEU B 365 4.406 -6.036 2.751 1.00 0.00 H new ATOM 1963 N ASP B 366 4.506 -8.445 5.232 1.00 0.00 N ATOM 1964 CA ASP B 366 5.901 -8.864 5.393 1.00 0.00 C ATOM 1965 C ASP B 366 6.085 -10.379 5.173 1.00 0.00 C ATOM 1966 O ASP B 366 6.983 -10.791 4.436 1.00 0.00 O ATOM 1967 CB ASP B 366 6.398 -8.432 6.779 1.00 0.00 C ATOM 1968 CG ASP B 366 7.887 -8.758 6.978 1.00 0.00 C ATOM 1969 OD1 ASP B 366 8.741 -8.072 6.367 1.00 0.00 O ATOM 1970 OD2 ASP B 366 8.207 -9.693 7.749 1.00 0.00 O ATOM 0 H ASP B 366 4.122 -7.998 6.064 1.00 0.00 H new ATOM 0 HA ASP B 366 6.501 -8.375 4.626 1.00 0.00 H new ATOM 0 HB2 ASP B 366 6.240 -7.361 6.904 1.00 0.00 H new ATOM 0 HB3 ASP B 366 5.810 -8.933 7.548 1.00 0.00 H new ATOM 1975 N SER B 367 5.215 -11.213 5.751 1.00 0.00 N ATOM 1976 CA SER B 367 5.224 -12.676 5.572 1.00 0.00 C ATOM 1977 C SER B 367 4.919 -13.091 4.127 1.00 0.00 C ATOM 1978 O SER B 367 5.589 -13.971 3.579 1.00 0.00 O ATOM 1979 CB SER B 367 4.216 -13.338 6.522 1.00 0.00 C ATOM 1980 OG SER B 367 4.592 -13.100 7.869 1.00 0.00 O ATOM 0 H SER B 367 4.470 -10.889 6.368 1.00 0.00 H new ATOM 0 HA SER B 367 6.232 -13.016 5.808 1.00 0.00 H new ATOM 0 HB2 SER B 367 3.217 -12.942 6.339 1.00 0.00 H new ATOM 0 HB3 SER B 367 4.174 -14.410 6.331 1.00 0.00 H new ATOM 0 HG SER B 367 3.944 -13.524 8.469 1.00 0.00 H new ATOM 1986 N LEU B 368 3.943 -12.435 3.490 1.00 0.00 N ATOM 1987 CA LEU B 368 3.576 -12.613 2.081 1.00 0.00 C ATOM 1988 C LEU B 368 4.734 -12.277 1.123 1.00 0.00 C ATOM 1989 O LEU B 368 4.963 -13.024 0.168 1.00 0.00 O ATOM 1990 CB LEU B 368 2.339 -11.749 1.769 1.00 0.00 C ATOM 1991 CG LEU B 368 1.024 -12.303 2.350 1.00 0.00 C ATOM 1992 CD1 LEU B 368 -0.026 -11.202 2.475 1.00 0.00 C ATOM 1993 CD2 LEU B 368 0.448 -13.392 1.445 1.00 0.00 C ATOM 0 H LEU B 368 3.365 -11.739 3.960 1.00 0.00 H new ATOM 0 HA LEU B 368 3.343 -13.666 1.922 1.00 0.00 H new ATOM 0 HB2 LEU B 368 2.502 -10.745 2.160 1.00 0.00 H new ATOM 0 HB3 LEU B 368 2.236 -11.657 0.688 1.00 0.00 H new ATOM 0 HG LEU B 368 1.258 -12.711 3.333 1.00 0.00 H new ATOM 0 HD11 LEU B 368 -0.944 -11.620 2.888 1.00 0.00 H new ATOM 0 HD12 LEU B 368 0.345 -10.419 3.136 1.00 0.00 H new ATOM 0 HD13 LEU B 368 -0.230 -10.780 1.491 1.00 0.00 H new ATOM 0 HD21 LEU B 368 -0.480 -13.769 1.875 1.00 0.00 H new ATOM 0 HD22 LEU B 368 0.248 -12.976 0.457 1.00 0.00 H new ATOM 0 HD23 LEU B 368 1.165 -14.208 1.357 1.00 0.00 H new ATOM 2005 N LEU B 369 5.478 -11.194 1.386 1.00 0.00 N ATOM 2006 CA LEU B 369 6.668 -10.780 0.628 1.00 0.00 C ATOM 2007 C LEU B 369 7.834 -11.768 0.793 1.00 0.00 C ATOM 2008 O LEU B 369 8.452 -12.171 -0.194 1.00 0.00 O ATOM 2009 CB LEU B 369 7.116 -9.373 1.077 1.00 0.00 C ATOM 2010 CG LEU B 369 6.269 -8.212 0.526 1.00 0.00 C ATOM 2011 CD1 LEU B 369 6.673 -6.914 1.227 1.00 0.00 C ATOM 2012 CD2 LEU B 369 6.496 -8.006 -0.973 1.00 0.00 C ATOM 0 H LEU B 369 5.262 -10.562 2.156 1.00 0.00 H new ATOM 0 HA LEU B 369 6.392 -10.765 -0.426 1.00 0.00 H new ATOM 0 HB2 LEU B 369 7.096 -9.332 2.166 1.00 0.00 H new ATOM 0 HB3 LEU B 369 8.152 -9.224 0.772 1.00 0.00 H new ATOM 0 HG LEU B 369 5.223 -8.461 0.704 1.00 0.00 H new ATOM 0 HD11 LEU B 369 6.075 -6.090 0.839 1.00 0.00 H new ATOM 0 HD12 LEU B 369 6.504 -7.012 2.299 1.00 0.00 H new ATOM 0 HD13 LEU B 369 7.729 -6.714 1.043 1.00 0.00 H new ATOM 0 HD21 LEU B 369 5.880 -7.178 -1.324 1.00 0.00 H new ATOM 0 HD22 LEU B 369 7.547 -7.779 -1.154 1.00 0.00 H new ATOM 0 HD23 LEU B 369 6.223 -8.914 -1.511 1.00 0.00 H new ATOM 2024 N ASN B 370 8.139 -12.157 2.035 1.00 0.00 N ATOM 2025 CA ASN B 370 9.230 -13.082 2.368 1.00 0.00 C ATOM 2026 C ASN B 370 8.968 -14.544 1.943 1.00 0.00 C ATOM 2027 O ASN B 370 9.899 -15.354 1.938 1.00 0.00 O ATOM 2028 CB ASN B 370 9.512 -12.988 3.878 1.00 0.00 C ATOM 2029 CG ASN B 370 10.391 -11.795 4.219 1.00 0.00 C ATOM 2030 OD1 ASN B 370 11.612 -11.863 4.187 1.00 0.00 O ATOM 2031 ND2 ASN B 370 9.807 -10.670 4.552 1.00 0.00 N ATOM 0 H ASN B 370 7.625 -11.832 2.854 1.00 0.00 H new ATOM 0 HA ASN B 370 10.104 -12.776 1.793 1.00 0.00 H new ATOM 0 HB2 ASN B 370 8.569 -12.910 4.419 1.00 0.00 H new ATOM 0 HB3 ASN B 370 9.998 -13.904 4.214 1.00 0.00 H new ATOM 0 HD21 ASN B 370 10.370 -9.852 4.784 1.00 0.00 H new ATOM 0 HD22 ASN B 370 8.789 -10.612 4.579 1.00 0.00 H new ATOM 2038 N GLY B 371 7.728 -14.897 1.584 1.00 0.00 N ATOM 2039 CA GLY B 371 7.338 -16.264 1.219 1.00 0.00 C ATOM 2040 C GLY B 371 7.192 -17.209 2.421 1.00 0.00 C ATOM 2041 O GLY B 371 7.283 -18.428 2.268 1.00 0.00 O ATOM 0 H GLY B 371 6.956 -14.232 1.538 1.00 0.00 H new ATOM 0 HA2 GLY B 371 6.392 -16.230 0.679 1.00 0.00 H new ATOM 0 HA3 GLY B 371 8.081 -16.674 0.535 1.00 0.00 H new ATOM 2045 N ASP B 372 6.985 -16.657 3.621 1.00 0.00 N ATOM 2046 CA ASP B 372 6.722 -17.406 4.862 1.00 0.00 C ATOM 2047 C ASP B 372 5.361 -18.144 4.841 1.00 0.00 C ATOM 2048 O ASP B 372 5.156 -19.112 5.582 1.00 0.00 O ATOM 2049 CB ASP B 372 6.814 -16.426 6.039 1.00 0.00 C ATOM 2050 CG ASP B 372 6.759 -17.133 7.402 1.00 0.00 C ATOM 2051 OD1 ASP B 372 7.711 -17.878 7.738 1.00 0.00 O ATOM 2052 OD2 ASP B 372 5.774 -16.929 8.151 1.00 0.00 O ATOM 0 H ASP B 372 6.995 -15.647 3.764 1.00 0.00 H new ATOM 0 HA ASP B 372 7.471 -18.191 4.966 1.00 0.00 H new ATOM 0 HB2 ASP B 372 7.743 -15.860 5.964 1.00 0.00 H new ATOM 0 HB3 ASP B 372 5.997 -15.707 5.973 1.00 0.00 H new ATOM 2057 N VAL B 373 4.462 -17.723 3.940 1.00 0.00 N ATOM 2058 CA VAL B 373 3.185 -18.344 3.548 1.00 0.00 C ATOM 2059 C VAL B 373 3.163 -18.680 2.058 1.00 0.00 C ATOM 2060 O VAL B 373 2.629 -19.752 1.701 1.00 0.00 O ATOM 2061 CB VAL B 373 1.985 -17.455 3.910 1.00 0.00 C ATOM 2062 CG1 VAL B 373 1.724 -17.496 5.416 1.00 0.00 C ATOM 2063 CG2 VAL B 373 2.136 -15.990 3.480 1.00 0.00 C ATOM 2064 OXT VAL B 373 3.660 -17.863 1.248 1.00 0.00 O ATOM 0 H VAL B 373 4.623 -16.861 3.419 1.00 0.00 H new ATOM 0 HA VAL B 373 3.100 -19.273 4.112 1.00 0.00 H new ATOM 0 HB VAL B 373 1.144 -17.870 3.354 1.00 0.00 H new ATOM 0 HG11 VAL B 373 0.871 -16.861 5.655 1.00 0.00 H new ATOM 0 HG12 VAL B 373 1.510 -18.521 5.720 1.00 0.00 H new ATOM 0 HG13 VAL B 373 2.605 -17.136 5.948 1.00 0.00 H new ATOM 0 HG21 VAL B 373 1.247 -15.431 3.773 1.00 0.00 H new ATOM 0 HG22 VAL B 373 3.012 -15.557 3.964 1.00 0.00 H new ATOM 0 HG23 VAL B 373 2.257 -15.939 2.398 1.00 0.00 H new