USER MOD reduce.3.24.130724 H: found=0, std=0, add=978, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 972 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 32 HIS : no HD1:sc= -1.13 X(o=-1.1,f=-1.4) USER MOD Set 1.2: B 34 GLN : amide:sc= 0.0134 X(o=-1.1,f=-1.5) USER MOD Single : A 1 MET CE :methyl 145:sc= -4.2! (180deg=-6.32!) USER MOD Single : A 1 MET N :NH3+ -158:sc=-0.00618 (180deg=-0.219) USER MOD Single : A 3 MET CE :methyl -121:sc= -2.43 (180deg=-5.72!) USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.0877 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.875 K(o=-0.87,f=-4.3!) USER MOD Single : A 14 GLN : amide:sc= -0.0083 X(o=-0.0083,f=-0.36) USER MOD Single : A 19 TYR OH : rot -59:sc= 1.18 USER MOD Single : A 20 MET CE :methyl -161:sc= -4.37 (180deg=-5.56!) USER MOD Single : A 22 THR OG1 : rot -22:sc= 0.402 USER MOD Single : A 23 GLN : amide:sc= -0.601 K(o=-0.6,f=-4.8!) USER MOD Single : A 28 THR OG1 : rot 69:sc= 0.894 USER MOD Single : A 30 GLN : amide:sc= -0.189 K(o=-0.19,f=-0.83) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 33 ASN : amide:sc= -1.03 K(o=-1,f=-1.6) USER MOD Single : A 34 GLN : amide:sc= 0.057 X(o=0.057,f=-0.003) USER MOD Single : A 35 SER OG : rot -32:sc= 0.256 USER MOD Single : A 43 SER OG : rot 180:sc= 0.0515 USER MOD Single : A 44 GLN : amide:sc= -0.359 X(o=-0.36,f=-0.49) USER MOD Single : A 58 ASN : amide:sc= -0.425 X(o=-0.43,f=-0.78) USER MOD Single : B 1 MET CE :methyl 143:sc= -4.02 (180deg=-5.97!) USER MOD Single : B 1 MET N :NH3+ -159:sc= -0.0109 (180deg=-0.152) USER MOD Single : B 3 MET CE :methyl 140:sc= -4.62! (180deg=-12.4!) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.184 USER MOD Single : B 6 SER OG : rot 180:sc= 0 USER MOD Single : B 9 ASN : amide:sc= -0.483 K(o=-0.48,f=-4!) USER MOD Single : B 14 GLN : amide:sc=-0.00199 X(o=-0.002,f=-0.33) USER MOD Single : B 19 TYR OH : rot -57:sc= 1.21 USER MOD Single : B 20 MET CE :methyl -155:sc= -2.79 (180deg=-4.27!) USER MOD Single : B 22 THR OG1 : rot -28:sc= 0.338 USER MOD Single : B 23 GLN : amide:sc= -0.461 K(o=-0.46,f=-3!) USER MOD Single : B 28 THR OG1 : rot 69:sc= 0.917 USER MOD Single : B 30 GLN : amide:sc= -0.152 K(o=-0.15,f=-0.78) USER MOD Single : B 31 GLN : amide:sc= 0 X(o=0,f=-0.098) USER MOD Single : B 32 HIS : no HD1:sc= -1.44 K(o=-1.4,f=-2.1) USER MOD Single : B 33 ASN : amide:sc= -1.01 K(o=-1,f=-1.5) USER MOD Single : B 35 SER OG : rot -35:sc= 0.103 USER MOD Single : B 43 SER OG : rot 180:sc= 0.0507 USER MOD Single : B 44 GLN : amide:sc= -0.189 X(o=-0.19,f=-0.36) USER MOD Single : B 58 ASN : amide:sc= -0.329 K(o=-0.33,f=0.56) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.299 -11.200 -4.417 1.00 0.00 N ATOM 2 CA MET A 1 -1.538 -10.339 -5.316 1.00 0.00 C ATOM 3 C MET A 1 -1.658 -10.819 -6.759 1.00 0.00 C ATOM 4 O MET A 1 -1.307 -11.955 -7.078 1.00 0.00 O ATOM 5 CB MET A 1 -0.067 -10.305 -4.899 1.00 0.00 C ATOM 6 CG MET A 1 0.158 -9.723 -3.512 1.00 0.00 C ATOM 7 SD MET A 1 1.224 -8.269 -3.534 1.00 0.00 S ATOM 8 CE MET A 1 0.315 -7.200 -4.648 1.00 0.00 C ATOM 0 H1 MET A 1 -2.519 -10.681 -3.543 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.184 -11.489 -4.880 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.737 -12.044 -4.187 1.00 0.00 H new ATOM 0 HA MET A 1 -1.951 -9.332 -5.251 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.334 -11.318 -4.929 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.495 -9.718 -5.626 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.804 -9.457 -3.073 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.601 -10.484 -2.870 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.423 -6.164 -4.327 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.708 -7.309 -5.659 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.740 -7.475 -4.637 1.00 0.00 H new ATOM 18 N LEU A 2 -2.157 -9.946 -7.628 1.00 0.00 N ATOM 19 CA LEU A 2 -2.324 -10.280 -9.038 1.00 0.00 C ATOM 20 C LEU A 2 -1.521 -9.331 -9.921 1.00 0.00 C ATOM 21 O LEU A 2 -1.751 -8.122 -9.919 1.00 0.00 O ATOM 22 CB LEU A 2 -3.803 -10.226 -9.424 1.00 0.00 C ATOM 23 CG LEU A 2 -4.299 -11.343 -10.343 1.00 0.00 C ATOM 24 CD1 LEU A 2 -5.777 -11.163 -10.653 1.00 0.00 C ATOM 25 CD2 LEU A 2 -3.483 -11.379 -11.626 1.00 0.00 C ATOM 0 H LEU A 2 -2.453 -9.002 -7.381 1.00 0.00 H new ATOM 0 HA LEU A 2 -1.952 -11.293 -9.192 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -4.397 -10.244 -8.510 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -3.996 -9.270 -9.911 1.00 0.00 H new ATOM 0 HG LEU A 2 -4.171 -12.295 -9.828 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -6.112 -11.967 -11.308 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -6.349 -11.189 -9.726 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -5.931 -10.204 -11.148 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -3.850 -12.180 -12.268 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -3.579 -10.425 -12.145 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -2.435 -11.558 -11.386 1.00 0.00 H new ATOM 37 N MET A 3 -0.580 -9.887 -10.677 1.00 0.00 N ATOM 38 CA MET A 3 0.255 -9.090 -11.568 1.00 0.00 C ATOM 39 C MET A 3 -0.600 -8.320 -12.569 1.00 0.00 C ATOM 40 O MET A 3 -1.281 -8.915 -13.405 1.00 0.00 O ATOM 41 CB MET A 3 1.247 -9.987 -12.310 1.00 0.00 C ATOM 42 CG MET A 3 2.616 -9.353 -12.499 1.00 0.00 C ATOM 43 SD MET A 3 3.545 -10.096 -13.854 1.00 0.00 S ATOM 44 CE MET A 3 4.058 -8.635 -14.753 1.00 0.00 C ATOM 0 H MET A 3 -0.377 -10.886 -10.690 1.00 0.00 H new ATOM 0 HA MET A 3 0.809 -8.373 -10.962 1.00 0.00 H new ATOM 0 HB2 MET A 3 1.361 -10.921 -11.760 1.00 0.00 H new ATOM 0 HB3 MET A 3 0.835 -10.240 -13.287 1.00 0.00 H new ATOM 0 HG2 MET A 3 2.495 -8.286 -12.689 1.00 0.00 H new ATOM 0 HG3 MET A 3 3.187 -9.450 -11.576 1.00 0.00 H new ATOM 0 HE1 MET A 3 3.675 -8.682 -15.772 1.00 0.00 H new ATOM 0 HE2 MET A 3 3.665 -7.747 -14.258 1.00 0.00 H new ATOM 0 HE3 MET A 3 5.147 -8.586 -14.776 1.00 0.00 H new ATOM 54 N ILE A 4 -0.560 -6.995 -12.479 1.00 0.00 N ATOM 55 CA ILE A 4 -1.331 -6.145 -13.378 1.00 0.00 C ATOM 56 C ILE A 4 -0.731 -6.141 -14.780 1.00 0.00 C ATOM 57 O ILE A 4 -1.436 -6.334 -15.770 1.00 0.00 O ATOM 58 CB ILE A 4 -1.404 -4.697 -12.859 1.00 0.00 C ATOM 59 CG1 ILE A 4 -2.175 -4.644 -11.538 1.00 0.00 C ATOM 60 CG2 ILE A 4 -2.057 -3.795 -13.895 1.00 0.00 C ATOM 61 CD1 ILE A 4 -3.520 -5.333 -11.596 1.00 0.00 C ATOM 0 H ILE A 4 -0.002 -6.487 -11.793 1.00 0.00 H new ATOM 0 HA ILE A 4 -2.338 -6.559 -13.418 1.00 0.00 H new ATOM 0 HB ILE A 4 -0.390 -4.339 -12.681 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -1.572 -5.106 -10.756 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -2.321 -3.602 -11.254 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -2.101 -2.775 -13.513 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -1.471 -3.813 -14.814 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.067 -4.149 -14.101 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.010 -5.256 -10.626 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -4.141 -4.856 -12.355 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.380 -6.384 -11.850 1.00 0.00 H new ATOM 73 N THR A 5 0.578 -5.920 -14.857 1.00 0.00 N ATOM 74 CA THR A 5 1.274 -5.892 -16.137 1.00 0.00 C ATOM 75 C THR A 5 2.777 -5.726 -15.942 1.00 0.00 C ATOM 76 O THR A 5 3.256 -5.601 -14.815 1.00 0.00 O ATOM 77 CB THR A 5 0.756 -4.751 -17.033 1.00 0.00 C ATOM 78 OG1 THR A 5 1.252 -4.911 -18.366 1.00 0.00 O ATOM 79 CG2 THR A 5 1.182 -3.397 -16.487 1.00 0.00 C ATOM 0 H THR A 5 1.177 -5.758 -14.048 1.00 0.00 H new ATOM 0 HA THR A 5 1.076 -6.846 -16.625 1.00 0.00 H new ATOM 0 HB THR A 5 -0.333 -4.794 -17.044 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.917 -4.183 -18.929 1.00 0.00 H new ATOM 0 HG21 THR A 5 0.804 -2.608 -17.137 1.00 0.00 H new ATOM 0 HG22 THR A 5 0.777 -3.266 -15.483 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.270 -3.346 -16.449 1.00 0.00 H new ATOM 87 N SER A 6 3.516 -5.725 -17.046 1.00 0.00 N ATOM 88 CA SER A 6 4.966 -5.577 -16.996 1.00 0.00 C ATOM 89 C SER A 6 5.426 -4.429 -17.889 1.00 0.00 C ATOM 90 O SER A 6 4.879 -4.209 -18.970 1.00 0.00 O ATOM 91 CB SER A 6 5.647 -6.877 -17.426 1.00 0.00 C ATOM 92 OG SER A 6 5.891 -6.888 -18.822 1.00 0.00 O ATOM 0 H SER A 6 3.135 -5.825 -17.987 1.00 0.00 H new ATOM 0 HA SER A 6 5.248 -5.350 -15.968 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.588 -6.993 -16.888 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.019 -7.726 -17.157 1.00 0.00 H new ATOM 0 HG SER A 6 6.328 -7.729 -19.071 1.00 0.00 H new ATOM 98 N PHE A 7 6.437 -3.699 -17.429 1.00 0.00 N ATOM 99 CA PHE A 7 6.972 -2.572 -18.185 1.00 0.00 C ATOM 100 C PHE A 7 8.496 -2.624 -18.233 1.00 0.00 C ATOM 101 O PHE A 7 9.126 -3.369 -17.484 1.00 0.00 O ATOM 102 CB PHE A 7 6.515 -1.251 -17.562 1.00 0.00 C ATOM 103 CG PHE A 7 5.047 -0.982 -17.735 1.00 0.00 C ATOM 104 CD1 PHE A 7 4.428 -1.201 -18.955 1.00 0.00 C ATOM 105 CD2 PHE A 7 4.286 -0.513 -16.676 1.00 0.00 C ATOM 106 CE1 PHE A 7 3.078 -0.954 -19.116 1.00 0.00 C ATOM 107 CE2 PHE A 7 2.935 -0.264 -16.832 1.00 0.00 C ATOM 108 CZ PHE A 7 2.330 -0.486 -18.053 1.00 0.00 C ATOM 0 H PHE A 7 6.902 -3.867 -16.537 1.00 0.00 H new ATOM 0 HA PHE A 7 6.592 -2.636 -19.204 1.00 0.00 H new ATOM 0 HB2 PHE A 7 6.752 -1.259 -16.498 1.00 0.00 H new ATOM 0 HB3 PHE A 7 7.081 -0.433 -18.008 1.00 0.00 H new ATOM 0 HD1 PHE A 7 5.007 -1.569 -19.789 1.00 0.00 H new ATOM 0 HD2 PHE A 7 4.754 -0.340 -15.718 1.00 0.00 H new ATOM 0 HE1 PHE A 7 2.608 -1.127 -20.073 1.00 0.00 H new ATOM 0 HE2 PHE A 7 2.354 0.104 -16.000 1.00 0.00 H new ATOM 0 HZ PHE A 7 1.274 -0.294 -18.177 1.00 0.00 H new ATOM 118 N ALA A 8 9.081 -1.827 -19.121 1.00 0.00 N ATOM 119 CA ALA A 8 10.530 -1.781 -19.268 1.00 0.00 C ATOM 120 C ALA A 8 11.053 -0.357 -19.111 1.00 0.00 C ATOM 121 O ALA A 8 11.928 0.079 -19.857 1.00 0.00 O ATOM 122 CB ALA A 8 10.943 -2.350 -20.617 1.00 0.00 C ATOM 0 H ALA A 8 8.573 -1.204 -19.749 1.00 0.00 H new ATOM 0 HA ALA A 8 10.969 -2.391 -18.479 1.00 0.00 H new ATOM 0 HB1 ALA A 8 12.028 -2.309 -20.712 1.00 0.00 H new ATOM 0 HB2 ALA A 8 10.611 -3.385 -20.692 1.00 0.00 H new ATOM 0 HB3 ALA A 8 10.486 -1.764 -21.414 1.00 0.00 H new ATOM 128 N ASN A 9 10.509 0.364 -18.135 1.00 0.00 N ATOM 129 CA ASN A 9 10.920 1.740 -17.881 1.00 0.00 C ATOM 130 C ASN A 9 10.300 2.263 -16.589 1.00 0.00 C ATOM 131 O ASN A 9 9.148 1.975 -16.263 1.00 0.00 O ATOM 132 CB ASN A 9 10.520 2.638 -19.053 1.00 0.00 C ATOM 133 CG ASN A 9 11.688 2.948 -19.970 1.00 0.00 C ATOM 134 OD1 ASN A 9 12.808 3.176 -19.511 1.00 0.00 O ATOM 135 ND2 ASN A 9 11.431 2.957 -21.272 1.00 0.00 N ATOM 0 H ASN A 9 9.783 0.018 -17.508 1.00 0.00 H new ATOM 0 HA ASN A 9 12.005 1.756 -17.774 1.00 0.00 H new ATOM 0 HB2 ASN A 9 9.731 2.152 -19.626 1.00 0.00 H new ATOM 0 HB3 ASN A 9 10.107 3.570 -18.668 1.00 0.00 H new ATOM 0 HD21 ASN A 9 12.177 3.159 -21.938 1.00 0.00 H new ATOM 0 HD22 ASN A 9 10.487 2.762 -21.607 1.00 0.00 H new ATOM 142 N PRO A 10 11.080 3.053 -15.836 1.00 0.00 N ATOM 143 CA PRO A 10 10.628 3.634 -14.568 1.00 0.00 C ATOM 144 C PRO A 10 9.566 4.710 -14.770 1.00 0.00 C ATOM 145 O PRO A 10 8.568 4.754 -14.051 1.00 0.00 O ATOM 146 CB PRO A 10 11.904 4.245 -13.983 1.00 0.00 C ATOM 147 CG PRO A 10 12.768 4.521 -15.165 1.00 0.00 C ATOM 148 CD PRO A 10 12.463 3.438 -16.163 1.00 0.00 C ATOM 0 HA PRO A 10 10.160 2.891 -13.922 1.00 0.00 H new ATOM 0 HB2 PRO A 10 11.688 5.158 -13.429 1.00 0.00 H new ATOM 0 HB3 PRO A 10 12.390 3.559 -13.289 1.00 0.00 H new ATOM 0 HG2 PRO A 10 12.557 5.506 -15.581 1.00 0.00 H new ATOM 0 HG3 PRO A 10 13.822 4.511 -14.889 1.00 0.00 H new ATOM 0 HD2 PRO A 10 12.548 3.800 -17.188 1.00 0.00 H new ATOM 0 HD3 PRO A 10 13.148 2.596 -16.065 1.00 0.00 H new ATOM 156 N ARG A 11 9.788 5.576 -15.754 1.00 0.00 N ATOM 157 CA ARG A 11 8.850 6.653 -16.049 1.00 0.00 C ATOM 158 C ARG A 11 7.437 6.108 -16.233 1.00 0.00 C ATOM 159 O ARG A 11 6.484 6.609 -15.635 1.00 0.00 O ATOM 160 CB ARG A 11 9.285 7.406 -17.308 1.00 0.00 C ATOM 161 CG ARG A 11 9.282 8.917 -17.146 1.00 0.00 C ATOM 162 CD ARG A 11 7.930 9.422 -16.665 1.00 0.00 C ATOM 163 NE ARG A 11 7.978 9.878 -15.278 1.00 0.00 N ATOM 164 CZ ARG A 11 7.058 10.665 -14.731 1.00 0.00 C ATOM 165 NH1 ARG A 11 6.025 11.082 -15.450 1.00 0.00 N ATOM 166 NH2 ARG A 11 7.171 11.037 -13.463 1.00 0.00 N ATOM 0 H ARG A 11 10.608 5.553 -16.360 1.00 0.00 H new ATOM 0 HA ARG A 11 8.849 7.341 -15.204 1.00 0.00 H new ATOM 0 HB2 ARG A 11 10.287 7.081 -17.587 1.00 0.00 H new ATOM 0 HB3 ARG A 11 8.622 7.136 -18.130 1.00 0.00 H new ATOM 0 HG2 ARG A 11 10.055 9.210 -16.435 1.00 0.00 H new ATOM 0 HG3 ARG A 11 9.530 9.387 -18.098 1.00 0.00 H new ATOM 0 HD2 ARG A 11 7.600 10.241 -17.305 1.00 0.00 H new ATOM 0 HD3 ARG A 11 7.191 8.626 -16.760 1.00 0.00 H new ATOM 0 HE ARG A 11 8.761 9.576 -14.698 1.00 0.00 H new ATOM 0 HH11 ARG A 11 5.935 10.799 -16.426 1.00 0.00 H new ATOM 0 HH12 ARG A 11 5.320 11.686 -15.027 1.00 0.00 H new ATOM 0 HH21 ARG A 11 7.965 10.719 -12.907 1.00 0.00 H new ATOM 0 HH22 ARG A 11 6.464 11.641 -13.044 1.00 0.00 H new ATOM 180 N VAL A 12 7.308 5.078 -17.064 1.00 0.00 N ATOM 181 CA VAL A 12 6.012 4.464 -17.326 1.00 0.00 C ATOM 182 C VAL A 12 5.446 3.816 -16.067 1.00 0.00 C ATOM 183 O VAL A 12 4.351 4.155 -15.621 1.00 0.00 O ATOM 184 CB VAL A 12 6.108 3.403 -18.438 1.00 0.00 C ATOM 185 CG1 VAL A 12 4.765 2.720 -18.642 1.00 0.00 C ATOM 186 CG2 VAL A 12 6.599 4.031 -19.733 1.00 0.00 C ATOM 0 H VAL A 12 8.086 4.651 -17.567 1.00 0.00 H new ATOM 0 HA VAL A 12 5.344 5.261 -17.652 1.00 0.00 H new ATOM 0 HB VAL A 12 6.830 2.646 -18.132 1.00 0.00 H new ATOM 0 HG11 VAL A 12 4.853 1.974 -19.432 1.00 0.00 H new ATOM 0 HG12 VAL A 12 4.460 2.234 -17.715 1.00 0.00 H new ATOM 0 HG13 VAL A 12 4.019 3.462 -18.925 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.661 3.267 -20.508 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.904 4.810 -20.046 1.00 0.00 H new ATOM 0 HG23 VAL A 12 7.585 4.468 -19.575 1.00 0.00 H new ATOM 196 N ALA A 13 6.201 2.882 -15.499 1.00 0.00 N ATOM 197 CA ALA A 13 5.777 2.188 -14.289 1.00 0.00 C ATOM 198 C ALA A 13 5.279 3.173 -13.237 1.00 0.00 C ATOM 199 O ALA A 13 4.159 3.053 -12.743 1.00 0.00 O ATOM 200 CB ALA A 13 6.918 1.350 -13.733 1.00 0.00 C ATOM 0 H ALA A 13 7.110 2.588 -15.857 1.00 0.00 H new ATOM 0 HA ALA A 13 4.950 1.527 -14.550 1.00 0.00 H new ATOM 0 HB1 ALA A 13 6.587 0.838 -12.830 1.00 0.00 H new ATOM 0 HB2 ALA A 13 7.224 0.614 -14.476 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.762 1.997 -13.494 1.00 0.00 H new ATOM 206 N GLN A 14 6.121 4.145 -12.898 1.00 0.00 N ATOM 207 CA GLN A 14 5.766 5.149 -11.903 1.00 0.00 C ATOM 208 C GLN A 14 4.497 5.892 -12.308 1.00 0.00 C ATOM 209 O GLN A 14 3.555 6.004 -11.524 1.00 0.00 O ATOM 210 CB GLN A 14 6.915 6.141 -11.717 1.00 0.00 C ATOM 211 CG GLN A 14 6.548 7.344 -10.862 1.00 0.00 C ATOM 212 CD GLN A 14 6.093 6.953 -9.470 1.00 0.00 C ATOM 213 OE1 GLN A 14 6.617 6.011 -8.874 1.00 0.00 O ATOM 214 NE2 GLN A 14 5.112 7.676 -8.943 1.00 0.00 N ATOM 0 H GLN A 14 7.053 4.258 -13.298 1.00 0.00 H new ATOM 0 HA GLN A 14 5.580 4.638 -10.958 1.00 0.00 H new ATOM 0 HB2 GLN A 14 7.759 5.625 -11.260 1.00 0.00 H new ATOM 0 HB3 GLN A 14 7.246 6.489 -12.696 1.00 0.00 H new ATOM 0 HG2 GLN A 14 7.410 8.007 -10.786 1.00 0.00 H new ATOM 0 HG3 GLN A 14 5.755 7.907 -11.355 1.00 0.00 H new ATOM 0 HE21 GLN A 14 4.706 8.448 -9.472 1.00 0.00 H new ATOM 0 HE22 GLN A 14 4.764 7.459 -8.009 1.00 0.00 H new ATOM 223 N ALA A 15 4.480 6.399 -13.536 1.00 0.00 N ATOM 224 CA ALA A 15 3.327 7.130 -14.045 1.00 0.00 C ATOM 225 C ALA A 15 2.048 6.313 -13.893 1.00 0.00 C ATOM 226 O ALA A 15 1.036 6.812 -13.401 1.00 0.00 O ATOM 227 CB ALA A 15 3.543 7.508 -15.503 1.00 0.00 C ATOM 0 H ALA A 15 5.252 6.317 -14.197 1.00 0.00 H new ATOM 0 HA ALA A 15 3.218 8.041 -13.457 1.00 0.00 H new ATOM 0 HB1 ALA A 15 2.674 8.054 -15.870 1.00 0.00 H new ATOM 0 HB2 ALA A 15 4.429 8.137 -15.588 1.00 0.00 H new ATOM 0 HB3 ALA A 15 3.681 6.604 -16.097 1.00 0.00 H new ATOM 233 N PHE A 16 2.101 5.055 -14.318 1.00 0.00 N ATOM 234 CA PHE A 16 0.946 4.170 -14.230 1.00 0.00 C ATOM 235 C PHE A 16 0.430 4.090 -12.796 1.00 0.00 C ATOM 236 O PHE A 16 -0.728 4.409 -12.523 1.00 0.00 O ATOM 237 CB PHE A 16 1.310 2.771 -14.731 1.00 0.00 C ATOM 238 CG PHE A 16 0.943 2.535 -16.169 1.00 0.00 C ATOM 239 CD1 PHE A 16 -0.317 2.070 -16.508 1.00 0.00 C ATOM 240 CD2 PHE A 16 1.859 2.777 -17.180 1.00 0.00 C ATOM 241 CE1 PHE A 16 -0.659 1.852 -17.830 1.00 0.00 C ATOM 242 CE2 PHE A 16 1.523 2.561 -18.503 1.00 0.00 C ATOM 243 CZ PHE A 16 0.263 2.097 -18.828 1.00 0.00 C ATOM 0 H PHE A 16 2.931 4.626 -14.727 1.00 0.00 H new ATOM 0 HA PHE A 16 0.156 4.580 -14.859 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.382 2.617 -14.608 1.00 0.00 H new ATOM 0 HB3 PHE A 16 0.808 2.029 -14.110 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -1.041 1.875 -15.731 1.00 0.00 H new ATOM 0 HD2 PHE A 16 2.846 3.138 -16.932 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -1.645 1.491 -18.081 1.00 0.00 H new ATOM 0 HE2 PHE A 16 2.245 2.755 -19.282 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.000 1.926 -19.861 1.00 0.00 H new ATOM 253 N VAL A 17 1.296 3.661 -11.884 1.00 0.00 N ATOM 254 CA VAL A 17 0.930 3.539 -10.479 1.00 0.00 C ATOM 255 C VAL A 17 0.564 4.896 -9.886 1.00 0.00 C ATOM 256 O VAL A 17 -0.131 4.976 -8.874 1.00 0.00 O ATOM 257 CB VAL A 17 2.073 2.921 -9.652 1.00 0.00 C ATOM 258 CG1 VAL A 17 2.431 1.542 -10.183 1.00 0.00 C ATOM 259 CG2 VAL A 17 3.288 3.836 -9.657 1.00 0.00 C ATOM 0 H VAL A 17 2.257 3.392 -12.094 1.00 0.00 H new ATOM 0 HA VAL A 17 0.063 2.880 -10.435 1.00 0.00 H new ATOM 0 HB VAL A 17 1.735 2.810 -8.622 1.00 0.00 H new ATOM 0 HG11 VAL A 17 3.240 1.121 -9.586 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.559 0.891 -10.122 1.00 0.00 H new ATOM 0 HG13 VAL A 17 2.751 1.624 -11.222 1.00 0.00 H new ATOM 0 HG21 VAL A 17 4.086 3.384 -9.068 1.00 0.00 H new ATOM 0 HG22 VAL A 17 3.630 3.981 -10.682 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.019 4.800 -9.225 1.00 0.00 H new ATOM 269 N ASP A 18 1.038 5.960 -10.524 1.00 0.00 N ATOM 270 CA ASP A 18 0.760 7.315 -10.062 1.00 0.00 C ATOM 271 C ASP A 18 -0.714 7.661 -10.248 1.00 0.00 C ATOM 272 O ASP A 18 -1.419 7.956 -9.282 1.00 0.00 O ATOM 273 CB ASP A 18 1.632 8.322 -10.814 1.00 0.00 C ATOM 274 CG ASP A 18 1.628 9.691 -10.163 1.00 0.00 C ATOM 275 OD1 ASP A 18 1.475 9.759 -8.925 1.00 0.00 O ATOM 276 OD2 ASP A 18 1.779 10.694 -10.890 1.00 0.00 O ATOM 0 H ASP A 18 1.617 5.911 -11.363 1.00 0.00 H new ATOM 0 HA ASP A 18 0.995 7.365 -8.999 1.00 0.00 H new ATOM 0 HB2 ASP A 18 2.655 7.948 -10.861 1.00 0.00 H new ATOM 0 HB3 ASP A 18 1.277 8.410 -11.841 1.00 0.00 H new ATOM 281 N TYR A 19 -1.172 7.625 -11.494 1.00 0.00 N ATOM 282 CA TYR A 19 -2.561 7.938 -11.807 1.00 0.00 C ATOM 283 C TYR A 19 -3.506 6.928 -11.161 1.00 0.00 C ATOM 284 O TYR A 19 -4.637 7.259 -10.806 1.00 0.00 O ATOM 285 CB TYR A 19 -2.774 7.955 -13.321 1.00 0.00 C ATOM 286 CG TYR A 19 -3.088 6.596 -13.905 1.00 0.00 C ATOM 287 CD1 TYR A 19 -4.356 6.042 -13.781 1.00 0.00 C ATOM 288 CD2 TYR A 19 -2.117 5.866 -14.579 1.00 0.00 C ATOM 289 CE1 TYR A 19 -4.648 4.801 -14.312 1.00 0.00 C ATOM 290 CE2 TYR A 19 -2.400 4.624 -15.114 1.00 0.00 C ATOM 291 CZ TYR A 19 -3.667 4.096 -14.978 1.00 0.00 C ATOM 292 OH TYR A 19 -3.953 2.859 -15.508 1.00 0.00 O ATOM 0 H TYR A 19 -0.602 7.382 -12.304 1.00 0.00 H new ATOM 0 HA TYR A 19 -2.783 8.926 -11.405 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -3.589 8.639 -13.557 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -1.878 8.349 -13.801 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -5.127 6.591 -13.260 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -1.124 6.276 -14.687 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -5.639 4.385 -14.206 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -1.634 4.070 -15.636 1.00 0.00 H new ATOM 0 HH TYR A 19 -4.243 2.256 -14.792 1.00 0.00 H new ATOM 302 N MET A 20 -3.032 5.696 -11.013 1.00 0.00 N ATOM 303 CA MET A 20 -3.833 4.637 -10.409 1.00 0.00 C ATOM 304 C MET A 20 -3.939 4.830 -8.899 1.00 0.00 C ATOM 305 O MET A 20 -4.989 4.587 -8.305 1.00 0.00 O ATOM 306 CB MET A 20 -3.225 3.268 -10.718 1.00 0.00 C ATOM 307 CG MET A 20 -4.260 2.170 -10.900 1.00 0.00 C ATOM 308 SD MET A 20 -4.686 1.897 -12.631 1.00 0.00 S ATOM 309 CE MET A 20 -6.411 2.381 -12.635 1.00 0.00 C ATOM 0 H MET A 20 -2.098 5.406 -11.303 1.00 0.00 H new ATOM 0 HA MET A 20 -4.835 4.686 -10.836 1.00 0.00 H new ATOM 0 HB2 MET A 20 -2.624 3.343 -11.624 1.00 0.00 H new ATOM 0 HB3 MET A 20 -2.550 2.989 -9.909 1.00 0.00 H new ATOM 0 HG2 MET A 20 -3.879 1.242 -10.473 1.00 0.00 H new ATOM 0 HG3 MET A 20 -5.161 2.430 -10.345 1.00 0.00 H new ATOM 0 HE1 MET A 20 -6.904 1.964 -13.513 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.896 2.005 -11.734 1.00 0.00 H new ATOM 0 HE3 MET A 20 -6.484 3.468 -12.660 1.00 0.00 H new ATOM 319 N ALA A 21 -2.845 5.267 -8.285 1.00 0.00 N ATOM 320 CA ALA A 21 -2.816 5.494 -6.845 1.00 0.00 C ATOM 321 C ALA A 21 -3.722 6.657 -6.454 1.00 0.00 C ATOM 322 O ALA A 21 -4.444 6.588 -5.459 1.00 0.00 O ATOM 323 CB ALA A 21 -1.390 5.753 -6.380 1.00 0.00 C ATOM 0 H ALA A 21 -1.967 5.471 -8.762 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.189 4.596 -6.353 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.383 5.921 -5.303 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -0.768 4.890 -6.617 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -0.996 6.634 -6.887 1.00 0.00 H new ATOM 329 N THR A 22 -3.679 7.726 -7.243 1.00 0.00 N ATOM 330 CA THR A 22 -4.494 8.904 -6.979 1.00 0.00 C ATOM 331 C THR A 22 -5.967 8.628 -7.258 1.00 0.00 C ATOM 332 O THR A 22 -6.836 9.412 -6.879 1.00 0.00 O ATOM 333 CB THR A 22 -4.038 10.105 -7.829 1.00 0.00 C ATOM 334 OG1 THR A 22 -4.849 11.249 -7.537 1.00 0.00 O ATOM 335 CG2 THR A 22 -4.125 9.781 -9.313 1.00 0.00 C ATOM 0 H THR A 22 -3.088 7.800 -8.071 1.00 0.00 H new ATOM 0 HA THR A 22 -4.366 9.146 -5.924 1.00 0.00 H new ATOM 0 HB THR A 22 -2.999 10.324 -7.581 1.00 0.00 H new ATOM 0 HG1 THR A 22 -5.700 10.956 -7.149 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.798 10.644 -9.894 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.484 8.929 -9.537 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.155 9.538 -9.573 1.00 0.00 H new ATOM 343 N GLN A 23 -6.239 7.509 -7.921 1.00 0.00 N ATOM 344 CA GLN A 23 -7.608 7.131 -8.250 1.00 0.00 C ATOM 345 C GLN A 23 -8.204 6.245 -7.162 1.00 0.00 C ATOM 346 O GLN A 23 -9.362 5.838 -7.244 1.00 0.00 O ATOM 347 CB GLN A 23 -7.649 6.404 -9.596 1.00 0.00 C ATOM 348 CG GLN A 23 -7.675 7.341 -10.793 1.00 0.00 C ATOM 349 CD GLN A 23 -8.929 8.191 -10.842 1.00 0.00 C ATOM 350 OE1 GLN A 23 -9.953 7.777 -11.385 1.00 0.00 O ATOM 351 NE2 GLN A 23 -8.855 9.388 -10.272 1.00 0.00 N ATOM 0 H GLN A 23 -5.530 6.849 -8.241 1.00 0.00 H new ATOM 0 HA GLN A 23 -8.204 8.041 -8.318 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -6.779 5.752 -9.674 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -8.531 5.764 -9.627 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -6.801 7.991 -10.759 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -7.602 6.756 -11.709 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -7.986 9.691 -9.833 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -9.668 10.005 -10.273 1.00 0.00 H new ATOM 360 N GLY A 24 -7.404 5.949 -6.142 1.00 0.00 N ATOM 361 CA GLY A 24 -7.871 5.112 -5.052 1.00 0.00 C ATOM 362 C GLY A 24 -7.362 3.688 -5.155 1.00 0.00 C ATOM 363 O GLY A 24 -7.596 2.871 -4.264 1.00 0.00 O ATOM 0 H GLY A 24 -6.441 6.274 -6.051 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -7.548 5.542 -4.104 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -8.961 5.105 -5.044 1.00 0.00 H new ATOM 367 N VAL A 25 -6.665 3.388 -6.247 1.00 0.00 N ATOM 368 CA VAL A 25 -6.123 2.052 -6.464 1.00 0.00 C ATOM 369 C VAL A 25 -4.610 2.036 -6.276 1.00 0.00 C ATOM 370 O VAL A 25 -3.870 2.621 -7.068 1.00 0.00 O ATOM 371 CB VAL A 25 -6.459 1.532 -7.874 1.00 0.00 C ATOM 372 CG1 VAL A 25 -6.140 0.049 -7.987 1.00 0.00 C ATOM 373 CG2 VAL A 25 -7.920 1.799 -8.205 1.00 0.00 C ATOM 0 H VAL A 25 -6.463 4.052 -6.994 1.00 0.00 H new ATOM 0 HA VAL A 25 -6.586 1.399 -5.724 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.843 2.067 -8.597 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -6.384 -0.300 -8.990 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -5.079 -0.111 -7.795 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.728 -0.506 -7.256 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.141 1.425 -9.205 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.556 1.292 -7.479 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.111 2.871 -8.168 1.00 0.00 H new ATOM 383 N ILE A 26 -4.157 1.364 -5.224 1.00 0.00 N ATOM 384 CA ILE A 26 -2.732 1.271 -4.933 1.00 0.00 C ATOM 385 C ILE A 26 -2.066 0.194 -5.784 1.00 0.00 C ATOM 386 O ILE A 26 -2.576 -0.920 -5.905 1.00 0.00 O ATOM 387 CB ILE A 26 -2.480 0.962 -3.445 1.00 0.00 C ATOM 388 CG1 ILE A 26 -3.080 2.060 -2.565 1.00 0.00 C ATOM 389 CG2 ILE A 26 -0.989 0.819 -3.179 1.00 0.00 C ATOM 390 CD1 ILE A 26 -2.499 3.431 -2.829 1.00 0.00 C ATOM 0 H ILE A 26 -4.756 0.876 -4.559 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.297 2.241 -5.173 1.00 0.00 H new ATOM 0 HB ILE A 26 -2.966 0.018 -3.198 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.158 2.094 -2.725 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -2.921 1.802 -1.518 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.827 0.601 -2.123 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.588 0.005 -3.783 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -0.482 1.748 -3.439 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -2.971 4.159 -2.170 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -1.425 3.414 -2.641 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.681 3.710 -3.867 1.00 0.00 H new ATOM 402 N LEU A 27 -0.923 0.534 -6.370 1.00 0.00 N ATOM 403 CA LEU A 27 -0.185 -0.404 -7.208 1.00 0.00 C ATOM 404 C LEU A 27 1.260 -0.534 -6.738 1.00 0.00 C ATOM 405 O LEU A 27 1.767 0.319 -6.010 1.00 0.00 O ATOM 406 CB LEU A 27 -0.220 0.051 -8.668 1.00 0.00 C ATOM 407 CG LEU A 27 -1.523 -0.213 -9.423 1.00 0.00 C ATOM 408 CD1 LEU A 27 -1.377 0.164 -10.889 1.00 0.00 C ATOM 409 CD2 LEU A 27 -1.934 -1.671 -9.284 1.00 0.00 C ATOM 0 H LEU A 27 -0.488 1.452 -6.280 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.663 -1.380 -7.126 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -0.016 1.121 -8.699 1.00 0.00 H new ATOM 0 HB3 LEU A 27 0.592 -0.444 -9.201 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.305 0.408 -8.986 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -2.314 -0.031 -11.410 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.130 1.223 -10.970 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -0.581 -0.429 -11.340 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -2.863 -1.840 -9.828 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -1.152 -2.310 -9.694 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.081 -1.909 -8.230 1.00 0.00 H new ATOM 421 N THR A 28 1.920 -1.608 -7.161 1.00 0.00 N ATOM 422 CA THR A 28 3.307 -1.850 -6.785 1.00 0.00 C ATOM 423 C THR A 28 4.178 -2.082 -8.014 1.00 0.00 C ATOM 424 O THR A 28 3.728 -2.658 -9.005 1.00 0.00 O ATOM 425 CB THR A 28 3.431 -3.064 -5.845 1.00 0.00 C ATOM 426 OG1 THR A 28 2.131 -3.485 -5.415 1.00 0.00 O ATOM 427 CG2 THR A 28 4.287 -2.727 -4.634 1.00 0.00 C ATOM 0 H THR A 28 1.516 -2.324 -7.764 1.00 0.00 H new ATOM 0 HA THR A 28 3.652 -0.958 -6.262 1.00 0.00 H new ATOM 0 HB THR A 28 3.912 -3.873 -6.395 1.00 0.00 H new ATOM 0 HG1 THR A 28 1.641 -3.861 -6.176 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.360 -3.600 -3.985 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.284 -2.436 -4.963 1.00 0.00 H new ATOM 0 HG23 THR A 28 3.831 -1.903 -4.084 1.00 0.00 H new ATOM 435 N ILE A 29 5.426 -1.632 -7.943 1.00 0.00 N ATOM 436 CA ILE A 29 6.360 -1.793 -9.050 1.00 0.00 C ATOM 437 C ILE A 29 7.615 -2.537 -8.607 1.00 0.00 C ATOM 438 O ILE A 29 8.097 -2.350 -7.491 1.00 0.00 O ATOM 439 CB ILE A 29 6.767 -0.432 -9.646 1.00 0.00 C ATOM 440 CG1 ILE A 29 5.549 0.271 -10.249 1.00 0.00 C ATOM 441 CG2 ILE A 29 7.853 -0.616 -10.695 1.00 0.00 C ATOM 442 CD1 ILE A 29 4.930 -0.481 -11.407 1.00 0.00 C ATOM 0 H ILE A 29 5.814 -1.153 -7.130 1.00 0.00 H new ATOM 0 HA ILE A 29 5.846 -2.376 -9.814 1.00 0.00 H new ATOM 0 HB ILE A 29 7.164 0.193 -8.846 1.00 0.00 H new ATOM 0 HG12 ILE A 29 4.797 0.408 -9.472 1.00 0.00 H new ATOM 0 HG13 ILE A 29 5.843 1.265 -10.587 1.00 0.00 H new ATOM 0 HG21 ILE A 29 8.130 0.355 -11.107 1.00 0.00 H new ATOM 0 HG22 ILE A 29 8.727 -1.078 -10.236 1.00 0.00 H new ATOM 0 HG23 ILE A 29 7.482 -1.257 -11.495 1.00 0.00 H new ATOM 0 HD11 ILE A 29 4.072 0.075 -11.785 1.00 0.00 H new ATOM 0 HD12 ILE A 29 5.667 -0.596 -12.202 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.604 -1.465 -11.069 1.00 0.00 H new ATOM 454 N GLN A 30 8.139 -3.380 -9.491 1.00 0.00 N ATOM 455 CA GLN A 30 9.339 -4.152 -9.191 1.00 0.00 C ATOM 456 C GLN A 30 10.434 -3.876 -10.216 1.00 0.00 C ATOM 457 O GLN A 30 10.383 -4.371 -11.341 1.00 0.00 O ATOM 458 CB GLN A 30 9.016 -5.647 -9.163 1.00 0.00 C ATOM 459 CG GLN A 30 8.843 -6.206 -7.760 1.00 0.00 C ATOM 460 CD GLN A 30 9.886 -7.252 -7.416 1.00 0.00 C ATOM 461 OE1 GLN A 30 10.311 -8.026 -8.274 1.00 0.00 O ATOM 462 NE2 GLN A 30 10.303 -7.280 -6.156 1.00 0.00 N ATOM 0 H GLN A 30 7.752 -3.546 -10.420 1.00 0.00 H new ATOM 0 HA GLN A 30 9.700 -3.847 -8.209 1.00 0.00 H new ATOM 0 HB2 GLN A 30 8.102 -5.823 -9.731 1.00 0.00 H new ATOM 0 HB3 GLN A 30 9.814 -6.192 -9.666 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.900 -5.391 -7.039 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.850 -6.645 -7.668 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.923 -6.619 -5.478 1.00 0.00 H new ATOM 0 HE22 GLN A 30 11.003 -7.962 -5.866 1.00 0.00 H new ATOM 471 N GLN A 31 11.424 -3.083 -9.818 1.00 0.00 N ATOM 472 CA GLN A 31 12.531 -2.740 -10.703 1.00 0.00 C ATOM 473 C GLN A 31 13.608 -3.819 -10.670 1.00 0.00 C ATOM 474 O GLN A 31 14.298 -3.992 -9.665 1.00 0.00 O ATOM 475 CB GLN A 31 13.132 -1.391 -10.304 1.00 0.00 C ATOM 476 CG GLN A 31 12.967 -0.314 -11.364 1.00 0.00 C ATOM 477 CD GLN A 31 13.688 0.971 -11.008 1.00 0.00 C ATOM 478 OE1 GLN A 31 14.870 0.958 -10.665 1.00 0.00 O ATOM 479 NE2 GLN A 31 12.978 2.090 -11.088 1.00 0.00 N ATOM 0 H GLN A 31 11.482 -2.666 -8.889 1.00 0.00 H new ATOM 0 HA GLN A 31 12.143 -2.670 -11.719 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.664 -1.054 -9.379 1.00 0.00 H new ATOM 0 HB3 GLN A 31 14.193 -1.523 -10.094 1.00 0.00 H new ATOM 0 HG2 GLN A 31 13.345 -0.686 -12.316 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.906 -0.105 -11.502 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.000 2.054 -11.377 1.00 0.00 H new ATOM 0 HE22 GLN A 31 13.410 2.986 -10.861 1.00 0.00 H new ATOM 488 N HIS A 32 13.746 -4.544 -11.776 1.00 0.00 N ATOM 489 CA HIS A 32 14.740 -5.607 -11.874 1.00 0.00 C ATOM 490 C HIS A 32 16.149 -5.052 -11.691 1.00 0.00 C ATOM 491 O HIS A 32 16.331 -3.856 -11.465 1.00 0.00 O ATOM 492 CB HIS A 32 14.629 -6.315 -13.224 1.00 0.00 C ATOM 493 CG HIS A 32 13.298 -6.961 -13.455 1.00 0.00 C ATOM 494 ND1 HIS A 32 13.036 -7.784 -14.530 1.00 0.00 N ATOM 495 CD2 HIS A 32 12.150 -6.903 -12.739 1.00 0.00 C ATOM 496 CE1 HIS A 32 11.785 -8.202 -14.467 1.00 0.00 C ATOM 497 NE2 HIS A 32 11.225 -7.683 -13.389 1.00 0.00 N ATOM 0 H HIS A 32 13.182 -4.415 -12.616 1.00 0.00 H new ATOM 0 HA HIS A 32 14.546 -6.326 -11.078 1.00 0.00 H new ATOM 0 HB2 HIS A 32 14.816 -5.594 -14.019 1.00 0.00 H new ATOM 0 HB3 HIS A 32 15.408 -7.074 -13.292 1.00 0.00 H new ATOM 0 HD2 HIS A 32 11.991 -6.347 -11.827 1.00 0.00 H new ATOM 0 HE1 HIS A 32 11.302 -8.857 -15.177 1.00 0.00 H new ATOM 0 HE2 HIS A 32 10.262 -7.836 -13.088 1.00 0.00 H new ATOM 505 N ASN A 33 17.143 -5.929 -11.790 1.00 0.00 N ATOM 506 CA ASN A 33 18.536 -5.526 -11.634 1.00 0.00 C ATOM 507 C ASN A 33 19.476 -6.687 -11.945 1.00 0.00 C ATOM 508 O ASN A 33 19.319 -7.785 -11.411 1.00 0.00 O ATOM 509 CB ASN A 33 18.787 -5.019 -10.212 1.00 0.00 C ATOM 510 CG ASN A 33 18.773 -3.505 -10.128 1.00 0.00 C ATOM 511 OD1 ASN A 33 17.871 -2.914 -9.534 1.00 0.00 O ATOM 512 ND2 ASN A 33 19.776 -2.871 -10.723 1.00 0.00 N ATOM 0 H ASN A 33 17.010 -6.923 -11.977 1.00 0.00 H new ATOM 0 HA ASN A 33 18.736 -4.720 -12.340 1.00 0.00 H new ATOM 0 HB2 ASN A 33 18.026 -5.424 -9.545 1.00 0.00 H new ATOM 0 HB3 ASN A 33 19.750 -5.391 -9.861 1.00 0.00 H new ATOM 0 HD21 ASN A 33 19.821 -1.852 -10.699 1.00 0.00 H new ATOM 0 HD22 ASN A 33 20.502 -3.403 -11.204 1.00 0.00 H new ATOM 519 N GLN A 34 20.452 -6.436 -12.811 1.00 0.00 N ATOM 520 CA GLN A 34 21.417 -7.460 -13.193 1.00 0.00 C ATOM 521 C GLN A 34 22.607 -6.843 -13.919 1.00 0.00 C ATOM 522 O GLN A 34 22.687 -5.625 -14.078 1.00 0.00 O ATOM 523 CB GLN A 34 20.751 -8.512 -14.081 1.00 0.00 C ATOM 524 CG GLN A 34 20.451 -9.816 -13.360 1.00 0.00 C ATOM 525 CD GLN A 34 20.537 -11.022 -14.275 1.00 0.00 C ATOM 526 OE1 GLN A 34 19.534 -11.458 -14.842 1.00 0.00 O ATOM 527 NE2 GLN A 34 21.738 -11.568 -14.424 1.00 0.00 N ATOM 0 H GLN A 34 20.596 -5.532 -13.262 1.00 0.00 H new ATOM 0 HA GLN A 34 21.779 -7.940 -12.284 1.00 0.00 H new ATOM 0 HB2 GLN A 34 19.822 -8.104 -14.478 1.00 0.00 H new ATOM 0 HB3 GLN A 34 21.398 -8.718 -14.933 1.00 0.00 H new ATOM 0 HG2 GLN A 34 21.152 -9.940 -12.535 1.00 0.00 H new ATOM 0 HG3 GLN A 34 19.453 -9.765 -12.925 1.00 0.00 H new ATOM 0 HE21 GLN A 34 22.542 -11.174 -13.935 1.00 0.00 H new ATOM 0 HE22 GLN A 34 21.857 -12.382 -15.028 1.00 0.00 H new ATOM 536 N SER A 35 23.531 -7.692 -14.359 1.00 0.00 N ATOM 537 CA SER A 35 24.720 -7.230 -15.066 1.00 0.00 C ATOM 538 C SER A 35 25.338 -8.359 -15.885 1.00 0.00 C ATOM 539 O SER A 35 26.014 -9.234 -15.345 1.00 0.00 O ATOM 540 CB SER A 35 25.748 -6.682 -14.074 1.00 0.00 C ATOM 541 OG SER A 35 25.131 -5.845 -13.111 1.00 0.00 O ATOM 0 H SER A 35 23.479 -8.703 -14.238 1.00 0.00 H new ATOM 0 HA SER A 35 24.421 -6.433 -15.746 1.00 0.00 H new ATOM 0 HB2 SER A 35 26.251 -7.509 -13.573 1.00 0.00 H new ATOM 0 HB3 SER A 35 26.513 -6.121 -14.611 1.00 0.00 H new ATOM 0 HG SER A 35 24.372 -5.380 -13.520 1.00 0.00 H new ATOM 547 N ASP A 36 25.101 -8.331 -17.192 1.00 0.00 N ATOM 548 CA ASP A 36 25.635 -9.350 -18.087 1.00 0.00 C ATOM 549 C ASP A 36 27.044 -8.987 -18.546 1.00 0.00 C ATOM 550 O ASP A 36 27.276 -7.900 -19.075 1.00 0.00 O ATOM 551 CB ASP A 36 24.720 -9.524 -19.301 1.00 0.00 C ATOM 552 CG ASP A 36 23.992 -10.854 -19.291 1.00 0.00 C ATOM 553 OD1 ASP A 36 23.561 -11.287 -18.202 1.00 0.00 O ATOM 554 OD2 ASP A 36 23.854 -11.461 -20.373 1.00 0.00 O ATOM 0 H ASP A 36 24.543 -7.614 -17.655 1.00 0.00 H new ATOM 0 HA ASP A 36 25.682 -10.291 -17.538 1.00 0.00 H new ATOM 0 HB2 ASP A 36 23.991 -8.714 -19.322 1.00 0.00 H new ATOM 0 HB3 ASP A 36 25.312 -9.444 -20.213 1.00 0.00 H new ATOM 559 N VAL A 37 27.984 -9.905 -18.337 1.00 0.00 N ATOM 560 CA VAL A 37 29.370 -9.682 -18.729 1.00 0.00 C ATOM 561 C VAL A 37 29.687 -10.375 -20.049 1.00 0.00 C ATOM 562 O VAL A 37 29.608 -11.599 -20.154 1.00 0.00 O ATOM 563 CB VAL A 37 30.346 -10.187 -17.649 1.00 0.00 C ATOM 564 CG1 VAL A 37 31.744 -9.638 -17.894 1.00 0.00 C ATOM 565 CG2 VAL A 37 29.850 -9.806 -16.263 1.00 0.00 C ATOM 0 H VAL A 37 27.810 -10.809 -17.899 1.00 0.00 H new ATOM 0 HA VAL A 37 29.496 -8.606 -18.848 1.00 0.00 H new ATOM 0 HB VAL A 37 30.393 -11.274 -17.706 1.00 0.00 H new ATOM 0 HG11 VAL A 37 32.420 -10.005 -17.121 1.00 0.00 H new ATOM 0 HG12 VAL A 37 32.098 -9.966 -18.871 1.00 0.00 H new ATOM 0 HG13 VAL A 37 31.717 -8.549 -17.865 1.00 0.00 H new ATOM 0 HG21 VAL A 37 30.551 -10.171 -15.513 1.00 0.00 H new ATOM 0 HG22 VAL A 37 29.772 -8.721 -16.190 1.00 0.00 H new ATOM 0 HG23 VAL A 37 28.871 -10.253 -16.092 1.00 0.00 H new ATOM 575 N TRP A 38 30.045 -9.584 -21.054 1.00 0.00 N ATOM 576 CA TRP A 38 30.375 -10.122 -22.369 1.00 0.00 C ATOM 577 C TRP A 38 31.743 -9.633 -22.831 1.00 0.00 C ATOM 578 O TRP A 38 32.121 -8.488 -22.579 1.00 0.00 O ATOM 579 CB TRP A 38 29.307 -9.723 -23.389 1.00 0.00 C ATOM 580 CG TRP A 38 28.565 -8.476 -23.014 1.00 0.00 C ATOM 581 CD1 TRP A 38 27.795 -8.283 -21.903 1.00 0.00 C ATOM 582 CD2 TRP A 38 28.521 -7.250 -23.753 1.00 0.00 C ATOM 583 NE1 TRP A 38 27.275 -7.011 -21.906 1.00 0.00 N ATOM 584 CE2 TRP A 38 27.707 -6.357 -23.030 1.00 0.00 C ATOM 585 CE3 TRP A 38 29.092 -6.820 -24.953 1.00 0.00 C ATOM 586 CZ2 TRP A 38 27.450 -5.061 -23.470 1.00 0.00 C ATOM 587 CZ3 TRP A 38 28.837 -5.534 -25.389 1.00 0.00 C ATOM 588 CH2 TRP A 38 28.022 -4.666 -24.649 1.00 0.00 C ATOM 0 H TRP A 38 30.114 -8.569 -20.984 1.00 0.00 H new ATOM 0 HA TRP A 38 30.406 -11.209 -22.291 1.00 0.00 H new ATOM 0 HB2 TRP A 38 29.779 -9.578 -24.361 1.00 0.00 H new ATOM 0 HB3 TRP A 38 28.596 -10.542 -23.499 1.00 0.00 H new ATOM 0 HD1 TRP A 38 27.620 -9.022 -21.135 1.00 0.00 H new ATOM 0 HE1 TRP A 38 26.666 -6.618 -21.188 1.00 0.00 H new ATOM 0 HE3 TRP A 38 29.722 -7.481 -25.530 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 26.822 -4.392 -22.901 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 29.273 -5.192 -26.316 1.00 0.00 H new ATOM 0 HH2 TRP A 38 27.842 -3.666 -25.016 1.00 0.00 H new ATOM 599 N LEU A 39 32.482 -10.506 -23.506 1.00 0.00 N ATOM 600 CA LEU A 39 33.810 -10.162 -24.003 1.00 0.00 C ATOM 601 C LEU A 39 33.854 -10.223 -25.527 1.00 0.00 C ATOM 602 O LEU A 39 33.101 -10.971 -26.150 1.00 0.00 O ATOM 603 CB LEU A 39 34.858 -11.107 -23.413 1.00 0.00 C ATOM 604 CG LEU A 39 36.241 -11.065 -24.063 1.00 0.00 C ATOM 605 CD1 LEU A 39 36.931 -9.743 -23.765 1.00 0.00 C ATOM 606 CD2 LEU A 39 37.091 -12.233 -23.584 1.00 0.00 C ATOM 0 H LEU A 39 32.184 -11.457 -23.722 1.00 0.00 H new ATOM 0 HA LEU A 39 34.034 -9.142 -23.692 1.00 0.00 H new ATOM 0 HB2 LEU A 39 34.970 -10.877 -22.353 1.00 0.00 H new ATOM 0 HB3 LEU A 39 34.478 -12.126 -23.480 1.00 0.00 H new ATOM 0 HG LEU A 39 36.117 -11.151 -25.143 1.00 0.00 H new ATOM 0 HD11 LEU A 39 37.914 -9.731 -24.236 1.00 0.00 H new ATOM 0 HD12 LEU A 39 36.331 -8.923 -24.158 1.00 0.00 H new ATOM 0 HD13 LEU A 39 37.044 -9.626 -22.687 1.00 0.00 H new ATOM 0 HD21 LEU A 39 38.072 -12.187 -24.057 1.00 0.00 H new ATOM 0 HD22 LEU A 39 37.207 -12.179 -22.502 1.00 0.00 H new ATOM 0 HD23 LEU A 39 36.604 -13.171 -23.850 1.00 0.00 H new ATOM 618 N ALA A 40 34.742 -9.432 -26.120 1.00 0.00 N ATOM 619 CA ALA A 40 34.887 -9.400 -27.570 1.00 0.00 C ATOM 620 C ALA A 40 36.086 -10.228 -28.021 1.00 0.00 C ATOM 621 O ALA A 40 36.097 -10.772 -29.125 1.00 0.00 O ATOM 622 CB ALA A 40 35.024 -7.964 -28.055 1.00 0.00 C ATOM 0 H ALA A 40 35.372 -8.805 -25.619 1.00 0.00 H new ATOM 0 HA ALA A 40 33.990 -9.837 -28.009 1.00 0.00 H new ATOM 0 HB1 ALA A 40 35.132 -7.955 -29.140 1.00 0.00 H new ATOM 0 HB2 ALA A 40 34.136 -7.399 -27.774 1.00 0.00 H new ATOM 0 HB3 ALA A 40 35.903 -7.508 -27.599 1.00 0.00 H new ATOM 628 N ASP A 41 37.093 -10.320 -27.159 1.00 0.00 N ATOM 629 CA ASP A 41 38.296 -11.083 -27.469 1.00 0.00 C ATOM 630 C ASP A 41 38.131 -12.545 -27.067 1.00 0.00 C ATOM 631 O ASP A 41 38.513 -12.943 -25.967 1.00 0.00 O ATOM 632 CB ASP A 41 39.507 -10.478 -26.755 1.00 0.00 C ATOM 633 CG ASP A 41 40.821 -10.916 -27.371 1.00 0.00 C ATOM 634 OD1 ASP A 41 40.981 -12.128 -27.629 1.00 0.00 O ATOM 635 OD2 ASP A 41 41.689 -10.048 -27.597 1.00 0.00 O ATOM 0 H ASP A 41 37.100 -9.876 -26.241 1.00 0.00 H new ATOM 0 HA ASP A 41 38.458 -11.037 -28.546 1.00 0.00 H new ATOM 0 HB2 ASP A 41 39.438 -9.391 -26.788 1.00 0.00 H new ATOM 0 HB3 ASP A 41 39.487 -10.767 -25.704 1.00 0.00 H new ATOM 640 N GLU A 42 37.559 -13.340 -27.966 1.00 0.00 N ATOM 641 CA GLU A 42 37.342 -14.758 -27.703 1.00 0.00 C ATOM 642 C GLU A 42 38.620 -15.418 -27.192 1.00 0.00 C ATOM 643 O GLU A 42 38.591 -16.190 -26.234 1.00 0.00 O ATOM 644 CB GLU A 42 36.861 -15.466 -28.971 1.00 0.00 C ATOM 645 CG GLU A 42 35.504 -14.986 -29.458 1.00 0.00 C ATOM 646 CD GLU A 42 35.336 -15.137 -30.958 1.00 0.00 C ATOM 647 OE1 GLU A 42 36.011 -16.007 -31.546 1.00 0.00 O ATOM 648 OE2 GLU A 42 34.528 -14.385 -31.542 1.00 0.00 O ATOM 0 H GLU A 42 37.238 -13.027 -28.882 1.00 0.00 H new ATOM 0 HA GLU A 42 36.575 -14.846 -26.933 1.00 0.00 H new ATOM 0 HB2 GLU A 42 37.596 -15.316 -29.762 1.00 0.00 H new ATOM 0 HB3 GLU A 42 36.811 -16.538 -28.782 1.00 0.00 H new ATOM 0 HG2 GLU A 42 34.720 -15.548 -28.950 1.00 0.00 H new ATOM 0 HG3 GLU A 42 35.374 -13.939 -29.185 1.00 0.00 H new ATOM 655 N SER A 43 39.738 -15.109 -27.840 1.00 0.00 N ATOM 656 CA SER A 43 41.026 -15.676 -27.455 1.00 0.00 C ATOM 657 C SER A 43 41.314 -15.416 -25.980 1.00 0.00 C ATOM 658 O SER A 43 41.951 -16.227 -25.309 1.00 0.00 O ATOM 659 CB SER A 43 42.144 -15.086 -28.317 1.00 0.00 C ATOM 660 OG SER A 43 41.687 -14.815 -29.630 1.00 0.00 O ATOM 0 H SER A 43 39.779 -14.470 -28.634 1.00 0.00 H new ATOM 0 HA SER A 43 40.984 -16.753 -27.614 1.00 0.00 H new ATOM 0 HB2 SER A 43 42.513 -14.168 -27.860 1.00 0.00 H new ATOM 0 HB3 SER A 43 42.982 -15.782 -28.357 1.00 0.00 H new ATOM 0 HG SER A 43 42.420 -14.437 -30.160 1.00 0.00 H new ATOM 666 N GLN A 44 40.841 -14.278 -25.482 1.00 0.00 N ATOM 667 CA GLN A 44 41.048 -13.910 -24.087 1.00 0.00 C ATOM 668 C GLN A 44 39.921 -14.444 -23.210 1.00 0.00 C ATOM 669 O GLN A 44 40.030 -14.460 -21.984 1.00 0.00 O ATOM 670 CB GLN A 44 41.142 -12.389 -23.947 1.00 0.00 C ATOM 671 CG GLN A 44 42.421 -11.918 -23.275 1.00 0.00 C ATOM 672 CD GLN A 44 43.667 -12.485 -23.927 1.00 0.00 C ATOM 673 OE1 GLN A 44 43.733 -12.623 -25.149 1.00 0.00 O ATOM 674 NE2 GLN A 44 44.662 -12.818 -23.114 1.00 0.00 N ATOM 0 H GLN A 44 40.312 -13.595 -26.024 1.00 0.00 H new ATOM 0 HA GLN A 44 41.985 -14.357 -23.755 1.00 0.00 H new ATOM 0 HB2 GLN A 44 41.073 -11.936 -24.936 1.00 0.00 H new ATOM 0 HB3 GLN A 44 40.287 -12.032 -23.373 1.00 0.00 H new ATOM 0 HG2 GLN A 44 42.463 -10.829 -23.306 1.00 0.00 H new ATOM 0 HG3 GLN A 44 42.402 -12.207 -22.224 1.00 0.00 H new ATOM 0 HE21 GLN A 44 44.564 -12.686 -22.107 1.00 0.00 H new ATOM 0 HE22 GLN A 44 45.525 -13.205 -23.496 1.00 0.00 H new ATOM 683 N ALA A 45 38.839 -14.881 -23.846 1.00 0.00 N ATOM 684 CA ALA A 45 37.693 -15.418 -23.123 1.00 0.00 C ATOM 685 C ALA A 45 38.125 -16.487 -22.125 1.00 0.00 C ATOM 686 O ALA A 45 37.549 -16.607 -21.044 1.00 0.00 O ATOM 687 CB ALA A 45 36.673 -15.986 -24.099 1.00 0.00 C ATOM 0 H ALA A 45 38.732 -14.874 -24.860 1.00 0.00 H new ATOM 0 HA ALA A 45 37.232 -14.603 -22.565 1.00 0.00 H new ATOM 0 HB1 ALA A 45 35.822 -16.384 -23.546 1.00 0.00 H new ATOM 0 HB2 ALA A 45 36.333 -15.197 -24.770 1.00 0.00 H new ATOM 0 HB3 ALA A 45 37.132 -16.785 -24.682 1.00 0.00 H new ATOM 693 N GLU A 46 39.141 -17.260 -22.495 1.00 0.00 N ATOM 694 CA GLU A 46 39.648 -18.320 -21.631 1.00 0.00 C ATOM 695 C GLU A 46 40.306 -17.736 -20.383 1.00 0.00 C ATOM 696 O GLU A 46 40.005 -18.144 -19.262 1.00 0.00 O ATOM 697 CB GLU A 46 40.650 -19.191 -22.390 1.00 0.00 C ATOM 698 CG GLU A 46 40.168 -19.616 -23.766 1.00 0.00 C ATOM 699 CD GLU A 46 41.051 -20.679 -24.392 1.00 0.00 C ATOM 700 OE1 GLU A 46 42.059 -20.311 -25.030 1.00 0.00 O ATOM 701 OE2 GLU A 46 40.733 -21.877 -24.243 1.00 0.00 O ATOM 0 H GLU A 46 39.629 -17.172 -23.386 1.00 0.00 H new ATOM 0 HA GLU A 46 38.804 -18.937 -21.321 1.00 0.00 H new ATOM 0 HB2 GLU A 46 41.587 -18.644 -22.496 1.00 0.00 H new ATOM 0 HB3 GLU A 46 40.865 -20.081 -21.799 1.00 0.00 H new ATOM 0 HG2 GLU A 46 39.149 -19.995 -23.689 1.00 0.00 H new ATOM 0 HG3 GLU A 46 40.135 -18.745 -24.420 1.00 0.00 H new ATOM 708 N ARG A 47 41.206 -16.780 -20.589 1.00 0.00 N ATOM 709 CA ARG A 47 41.908 -16.142 -19.482 1.00 0.00 C ATOM 710 C ARG A 47 40.921 -15.524 -18.496 1.00 0.00 C ATOM 711 O ARG A 47 40.958 -15.814 -17.300 1.00 0.00 O ATOM 712 CB ARG A 47 42.862 -15.067 -20.007 1.00 0.00 C ATOM 713 CG ARG A 47 43.640 -14.356 -18.913 1.00 0.00 C ATOM 714 CD ARG A 47 43.036 -12.997 -18.593 1.00 0.00 C ATOM 715 NE ARG A 47 43.664 -12.380 -17.428 1.00 0.00 N ATOM 716 CZ ARG A 47 44.861 -11.805 -17.456 1.00 0.00 C ATOM 717 NH1 ARG A 47 45.556 -11.768 -18.585 1.00 0.00 N ATOM 718 NH2 ARG A 47 45.366 -11.264 -16.355 1.00 0.00 N ATOM 0 H ARG A 47 41.466 -16.431 -21.511 1.00 0.00 H new ATOM 0 HA ARG A 47 42.484 -16.907 -18.961 1.00 0.00 H new ATOM 0 HB2 ARG A 47 43.566 -15.526 -20.702 1.00 0.00 H new ATOM 0 HB3 ARG A 47 42.290 -14.331 -20.572 1.00 0.00 H new ATOM 0 HG2 ARG A 47 43.650 -14.972 -18.014 1.00 0.00 H new ATOM 0 HG3 ARG A 47 44.677 -14.230 -19.225 1.00 0.00 H new ATOM 0 HD2 ARG A 47 43.146 -12.339 -19.455 1.00 0.00 H new ATOM 0 HD3 ARG A 47 41.967 -13.109 -18.412 1.00 0.00 H new ATOM 0 HE ARG A 47 43.155 -12.391 -16.544 1.00 0.00 H new ATOM 0 HH11 ARG A 47 45.171 -12.182 -19.434 1.00 0.00 H new ATOM 0 HH12 ARG A 47 46.475 -11.326 -18.604 1.00 0.00 H new ATOM 0 HH21 ARG A 47 44.835 -11.289 -15.485 1.00 0.00 H new ATOM 0 HH22 ARG A 47 46.285 -10.823 -16.379 1.00 0.00 H new ATOM 732 N VAL A 48 40.040 -14.669 -19.006 1.00 0.00 N ATOM 733 CA VAL A 48 39.043 -14.010 -18.171 1.00 0.00 C ATOM 734 C VAL A 48 38.202 -15.030 -17.411 1.00 0.00 C ATOM 735 O VAL A 48 37.906 -14.849 -16.230 1.00 0.00 O ATOM 736 CB VAL A 48 38.111 -13.115 -19.010 1.00 0.00 C ATOM 737 CG1 VAL A 48 38.882 -11.941 -19.594 1.00 0.00 C ATOM 738 CG2 VAL A 48 37.444 -13.926 -20.111 1.00 0.00 C ATOM 0 H VAL A 48 39.997 -14.417 -19.993 1.00 0.00 H new ATOM 0 HA VAL A 48 39.587 -13.389 -17.459 1.00 0.00 H new ATOM 0 HB VAL A 48 37.332 -12.719 -18.359 1.00 0.00 H new ATOM 0 HG11 VAL A 48 38.208 -11.320 -20.183 1.00 0.00 H new ATOM 0 HG12 VAL A 48 39.308 -11.347 -18.785 1.00 0.00 H new ATOM 0 HG13 VAL A 48 39.683 -12.313 -20.232 1.00 0.00 H new ATOM 0 HG21 VAL A 48 36.789 -13.278 -20.694 1.00 0.00 H new ATOM 0 HG22 VAL A 48 38.207 -14.352 -20.763 1.00 0.00 H new ATOM 0 HG23 VAL A 48 36.857 -14.730 -19.666 1.00 0.00 H new ATOM 748 N ARG A 49 37.820 -16.102 -18.097 1.00 0.00 N ATOM 749 CA ARG A 49 37.012 -17.151 -17.487 1.00 0.00 C ATOM 750 C ARG A 49 37.694 -17.708 -16.241 1.00 0.00 C ATOM 751 O ARG A 49 37.078 -17.822 -15.182 1.00 0.00 O ATOM 752 CB ARG A 49 36.759 -18.278 -18.490 1.00 0.00 C ATOM 753 CG ARG A 49 35.465 -18.120 -19.271 1.00 0.00 C ATOM 754 CD ARG A 49 35.584 -18.701 -20.671 1.00 0.00 C ATOM 755 NE ARG A 49 34.596 -19.748 -20.915 1.00 0.00 N ATOM 756 CZ ARG A 49 34.416 -20.327 -22.097 1.00 0.00 C ATOM 757 NH1 ARG A 49 35.153 -19.963 -23.137 1.00 0.00 N ATOM 758 NH2 ARG A 49 33.496 -21.273 -22.240 1.00 0.00 N ATOM 0 H ARG A 49 38.057 -16.267 -19.075 1.00 0.00 H new ATOM 0 HA ARG A 49 36.057 -16.714 -17.193 1.00 0.00 H new ATOM 0 HB2 ARG A 49 37.593 -18.323 -19.191 1.00 0.00 H new ATOM 0 HB3 ARG A 49 36.738 -19.229 -17.957 1.00 0.00 H new ATOM 0 HG2 ARG A 49 34.654 -18.616 -18.738 1.00 0.00 H new ATOM 0 HG3 ARG A 49 35.204 -17.064 -19.335 1.00 0.00 H new ATOM 0 HD2 ARG A 49 35.458 -17.906 -21.405 1.00 0.00 H new ATOM 0 HD3 ARG A 49 36.585 -19.108 -20.811 1.00 0.00 H new ATOM 0 HE ARG A 49 34.012 -20.051 -20.135 1.00 0.00 H new ATOM 0 HH11 ARG A 49 35.861 -19.236 -23.031 1.00 0.00 H new ATOM 0 HH12 ARG A 49 35.012 -20.410 -24.043 1.00 0.00 H new ATOM 0 HH21 ARG A 49 32.927 -21.556 -21.442 1.00 0.00 H new ATOM 0 HH22 ARG A 49 33.358 -21.717 -23.148 1.00 0.00 H new ATOM 772 N ALA A 50 38.970 -18.054 -16.376 1.00 0.00 N ATOM 773 CA ALA A 50 39.737 -18.597 -15.262 1.00 0.00 C ATOM 774 C ALA A 50 39.810 -17.602 -14.109 1.00 0.00 C ATOM 775 O ALA A 50 39.358 -17.889 -13.001 1.00 0.00 O ATOM 776 CB ALA A 50 41.136 -18.980 -15.721 1.00 0.00 C ATOM 0 H ALA A 50 39.495 -17.968 -17.247 1.00 0.00 H new ATOM 0 HA ALA A 50 39.227 -19.491 -14.904 1.00 0.00 H new ATOM 0 HB1 ALA A 50 41.697 -19.384 -14.879 1.00 0.00 H new ATOM 0 HB2 ALA A 50 41.068 -19.733 -16.506 1.00 0.00 H new ATOM 0 HB3 ALA A 50 41.646 -18.098 -16.107 1.00 0.00 H new ATOM 782 N GLU A 51 40.382 -16.433 -14.377 1.00 0.00 N ATOM 783 CA GLU A 51 40.514 -15.397 -13.360 1.00 0.00 C ATOM 784 C GLU A 51 39.163 -15.081 -12.726 1.00 0.00 C ATOM 785 O GLU A 51 39.029 -15.057 -11.501 1.00 0.00 O ATOM 786 CB GLU A 51 41.114 -14.127 -13.968 1.00 0.00 C ATOM 787 CG GLU A 51 42.416 -14.365 -14.713 1.00 0.00 C ATOM 788 CD GLU A 51 43.295 -15.399 -14.036 1.00 0.00 C ATOM 789 OE1 GLU A 51 43.583 -15.235 -12.832 1.00 0.00 O ATOM 790 OE2 GLU A 51 43.694 -16.372 -14.709 1.00 0.00 O ATOM 0 H GLU A 51 40.761 -16.180 -15.289 1.00 0.00 H new ATOM 0 HA GLU A 51 41.182 -15.770 -12.583 1.00 0.00 H new ATOM 0 HB2 GLU A 51 40.390 -13.685 -14.652 1.00 0.00 H new ATOM 0 HB3 GLU A 51 41.287 -13.401 -13.174 1.00 0.00 H new ATOM 0 HG2 GLU A 51 42.194 -14.691 -15.729 1.00 0.00 H new ATOM 0 HG3 GLU A 51 42.962 -13.425 -14.792 1.00 0.00 H new ATOM 797 N LEU A 52 38.164 -14.839 -13.567 1.00 0.00 N ATOM 798 CA LEU A 52 36.821 -14.524 -13.090 1.00 0.00 C ATOM 799 C LEU A 52 36.366 -15.532 -12.040 1.00 0.00 C ATOM 800 O LEU A 52 36.000 -15.161 -10.925 1.00 0.00 O ATOM 801 CB LEU A 52 35.835 -14.505 -14.258 1.00 0.00 C ATOM 802 CG LEU A 52 34.447 -13.939 -13.956 1.00 0.00 C ATOM 803 CD1 LEU A 52 33.774 -13.463 -15.235 1.00 0.00 C ATOM 804 CD2 LEU A 52 33.587 -14.981 -13.255 1.00 0.00 C ATOM 0 H LEU A 52 38.258 -14.855 -14.583 1.00 0.00 H new ATOM 0 HA LEU A 52 36.848 -13.536 -12.630 1.00 0.00 H new ATOM 0 HB2 LEU A 52 36.274 -13.923 -15.068 1.00 0.00 H new ATOM 0 HB3 LEU A 52 35.718 -15.525 -14.625 1.00 0.00 H new ATOM 0 HG LEU A 52 34.562 -13.084 -13.290 1.00 0.00 H new ATOM 0 HD11 LEU A 52 32.787 -13.064 -15.000 1.00 0.00 H new ATOM 0 HD12 LEU A 52 34.380 -12.684 -15.697 1.00 0.00 H new ATOM 0 HD13 LEU A 52 33.671 -14.300 -15.925 1.00 0.00 H new ATOM 0 HD21 LEU A 52 32.603 -14.561 -13.048 1.00 0.00 H new ATOM 0 HD22 LEU A 52 33.480 -15.856 -13.896 1.00 0.00 H new ATOM 0 HD23 LEU A 52 34.061 -15.274 -12.318 1.00 0.00 H new ATOM 816 N ALA A 53 36.392 -16.810 -12.405 1.00 0.00 N ATOM 817 CA ALA A 53 35.986 -17.873 -11.494 1.00 0.00 C ATOM 818 C ALA A 53 36.843 -17.873 -10.233 1.00 0.00 C ATOM 819 O ALA A 53 36.360 -18.178 -9.142 1.00 0.00 O ATOM 820 CB ALA A 53 36.066 -19.224 -12.189 1.00 0.00 C ATOM 0 H ALA A 53 36.690 -17.134 -13.325 1.00 0.00 H new ATOM 0 HA ALA A 53 34.953 -17.689 -11.199 1.00 0.00 H new ATOM 0 HB1 ALA A 53 35.760 -20.008 -11.496 1.00 0.00 H new ATOM 0 HB2 ALA A 53 35.405 -19.227 -13.056 1.00 0.00 H new ATOM 0 HB3 ALA A 53 37.091 -19.406 -12.513 1.00 0.00 H new ATOM 826 N ARG A 54 38.118 -17.530 -10.390 1.00 0.00 N ATOM 827 CA ARG A 54 39.043 -17.493 -9.264 1.00 0.00 C ATOM 828 C ARG A 54 38.732 -16.316 -8.344 1.00 0.00 C ATOM 829 O ARG A 54 39.067 -16.336 -7.159 1.00 0.00 O ATOM 830 CB ARG A 54 40.485 -17.396 -9.764 1.00 0.00 C ATOM 831 CG ARG A 54 41.038 -18.711 -10.290 1.00 0.00 C ATOM 832 CD ARG A 54 42.323 -18.501 -11.075 1.00 0.00 C ATOM 833 NE ARG A 54 43.093 -19.735 -11.204 1.00 0.00 N ATOM 834 CZ ARG A 54 44.386 -19.766 -11.508 1.00 0.00 C ATOM 835 NH1 ARG A 54 45.050 -18.637 -11.713 1.00 0.00 N ATOM 836 NH2 ARG A 54 45.017 -20.929 -11.608 1.00 0.00 N ATOM 0 H ARG A 54 38.533 -17.274 -11.286 1.00 0.00 H new ATOM 0 HA ARG A 54 38.924 -18.417 -8.697 1.00 0.00 H new ATOM 0 HB2 ARG A 54 40.537 -16.648 -10.555 1.00 0.00 H new ATOM 0 HB3 ARG A 54 41.120 -17.044 -8.951 1.00 0.00 H new ATOM 0 HG2 ARG A 54 41.226 -19.387 -9.456 1.00 0.00 H new ATOM 0 HG3 ARG A 54 40.295 -19.190 -10.928 1.00 0.00 H new ATOM 0 HD2 ARG A 54 42.083 -18.118 -12.067 1.00 0.00 H new ATOM 0 HD3 ARG A 54 42.931 -17.744 -10.579 1.00 0.00 H new ATOM 0 HE ARG A 54 42.612 -20.622 -11.052 1.00 0.00 H new ATOM 0 HH11 ARG A 54 44.568 -17.741 -11.637 1.00 0.00 H new ATOM 0 HH12 ARG A 54 46.043 -18.664 -11.946 1.00 0.00 H new ATOM 0 HH21 ARG A 54 44.509 -21.800 -11.451 1.00 0.00 H new ATOM 0 HH22 ARG A 54 46.010 -20.952 -11.841 1.00 0.00 H new ATOM 850 N PHE A 55 38.091 -15.292 -8.897 1.00 0.00 N ATOM 851 CA PHE A 55 37.736 -14.106 -8.127 1.00 0.00 C ATOM 852 C PHE A 55 36.371 -14.275 -7.466 1.00 0.00 C ATOM 853 O PHE A 55 36.167 -13.866 -6.322 1.00 0.00 O ATOM 854 CB PHE A 55 37.730 -12.870 -9.028 1.00 0.00 C ATOM 855 CG PHE A 55 37.938 -11.583 -8.282 1.00 0.00 C ATOM 856 CD1 PHE A 55 37.020 -11.160 -7.334 1.00 0.00 C ATOM 857 CD2 PHE A 55 39.052 -10.796 -8.527 1.00 0.00 C ATOM 858 CE1 PHE A 55 37.208 -9.976 -6.647 1.00 0.00 C ATOM 859 CE2 PHE A 55 39.246 -9.611 -7.843 1.00 0.00 C ATOM 860 CZ PHE A 55 38.323 -9.201 -6.901 1.00 0.00 C ATOM 0 H PHE A 55 37.807 -15.260 -9.876 1.00 0.00 H new ATOM 0 HA PHE A 55 38.484 -13.973 -7.346 1.00 0.00 H new ATOM 0 HB2 PHE A 55 38.512 -12.975 -9.780 1.00 0.00 H new ATOM 0 HB3 PHE A 55 36.780 -12.823 -9.560 1.00 0.00 H new ATOM 0 HD1 PHE A 55 36.147 -11.763 -7.130 1.00 0.00 H new ATOM 0 HD2 PHE A 55 39.778 -11.113 -9.262 1.00 0.00 H new ATOM 0 HE1 PHE A 55 36.484 -9.657 -5.912 1.00 0.00 H new ATOM 0 HE2 PHE A 55 40.118 -9.007 -8.045 1.00 0.00 H new ATOM 0 HZ PHE A 55 38.473 -8.276 -6.364 1.00 0.00 H new ATOM 870 N LEU A 56 35.438 -14.878 -8.195 1.00 0.00 N ATOM 871 CA LEU A 56 34.091 -15.100 -7.682 1.00 0.00 C ATOM 872 C LEU A 56 34.127 -15.915 -6.392 1.00 0.00 C ATOM 873 O LEU A 56 33.291 -15.731 -5.508 1.00 0.00 O ATOM 874 CB LEU A 56 33.238 -15.819 -8.728 1.00 0.00 C ATOM 875 CG LEU A 56 32.350 -14.928 -9.597 1.00 0.00 C ATOM 876 CD1 LEU A 56 31.743 -15.729 -10.739 1.00 0.00 C ATOM 877 CD2 LEU A 56 31.258 -14.282 -8.757 1.00 0.00 C ATOM 0 H LEU A 56 35.590 -15.222 -9.143 1.00 0.00 H new ATOM 0 HA LEU A 56 33.647 -14.129 -7.465 1.00 0.00 H new ATOM 0 HB2 LEU A 56 33.901 -16.385 -9.382 1.00 0.00 H new ATOM 0 HB3 LEU A 56 32.603 -16.542 -8.216 1.00 0.00 H new ATOM 0 HG LEU A 56 32.968 -14.138 -10.024 1.00 0.00 H new ATOM 0 HD11 LEU A 56 31.114 -15.078 -11.346 1.00 0.00 H new ATOM 0 HD12 LEU A 56 32.540 -16.143 -11.357 1.00 0.00 H new ATOM 0 HD13 LEU A 56 31.139 -16.541 -10.333 1.00 0.00 H new ATOM 0 HD21 LEU A 56 30.636 -13.651 -9.392 1.00 0.00 H new ATOM 0 HD22 LEU A 56 30.643 -15.058 -8.301 1.00 0.00 H new ATOM 0 HD23 LEU A 56 31.712 -13.673 -7.975 1.00 0.00 H new ATOM 889 N GLU A 57 35.103 -16.812 -6.293 1.00 0.00 N ATOM 890 CA GLU A 57 35.248 -17.653 -5.110 1.00 0.00 C ATOM 891 C GLU A 57 35.889 -16.875 -3.965 1.00 0.00 C ATOM 892 O GLU A 57 36.085 -17.406 -2.873 1.00 0.00 O ATOM 893 CB GLU A 57 36.090 -18.888 -5.436 1.00 0.00 C ATOM 894 CG GLU A 57 37.588 -18.633 -5.393 1.00 0.00 C ATOM 895 CD GLU A 57 38.399 -19.853 -5.785 1.00 0.00 C ATOM 896 OE1 GLU A 57 37.802 -20.820 -6.304 1.00 0.00 O ATOM 897 OE2 GLU A 57 39.629 -19.841 -5.573 1.00 0.00 O ATOM 0 H GLU A 57 35.804 -16.975 -7.016 1.00 0.00 H new ATOM 0 HA GLU A 57 34.254 -17.972 -4.798 1.00 0.00 H new ATOM 0 HB2 GLU A 57 35.845 -19.681 -4.730 1.00 0.00 H new ATOM 0 HB3 GLU A 57 35.820 -19.250 -6.428 1.00 0.00 H new ATOM 0 HG2 GLU A 57 37.832 -17.809 -6.063 1.00 0.00 H new ATOM 0 HG3 GLU A 57 37.871 -18.321 -4.388 1.00 0.00 H new ATOM 904 N ASN A 58 36.214 -15.612 -4.224 1.00 0.00 N ATOM 905 CA ASN A 58 36.835 -14.760 -3.216 1.00 0.00 C ATOM 906 C ASN A 58 35.890 -13.639 -2.795 1.00 0.00 C ATOM 907 O ASN A 58 36.065 -12.476 -3.160 1.00 0.00 O ATOM 908 CB ASN A 58 38.140 -14.168 -3.751 1.00 0.00 C ATOM 909 CG ASN A 58 39.271 -15.178 -3.761 1.00 0.00 C ATOM 910 OD1 ASN A 58 39.294 -16.094 -4.584 1.00 0.00 O ATOM 911 ND2 ASN A 58 40.218 -15.015 -2.843 1.00 0.00 N ATOM 0 H ASN A 58 36.058 -15.156 -5.123 1.00 0.00 H new ATOM 0 HA ASN A 58 37.054 -15.374 -2.343 1.00 0.00 H new ATOM 0 HB2 ASN A 58 37.979 -13.796 -4.763 1.00 0.00 H new ATOM 0 HB3 ASN A 58 38.426 -13.313 -3.139 1.00 0.00 H new ATOM 0 HD21 ASN A 58 41.004 -15.663 -2.801 1.00 0.00 H new ATOM 0 HD22 ASN A 58 40.159 -14.242 -2.181 1.00 0.00 H new ATOM 918 N PRO A 59 34.863 -13.994 -2.009 1.00 0.00 N ATOM 919 CA PRO A 59 33.870 -13.032 -1.521 1.00 0.00 C ATOM 920 C PRO A 59 34.452 -12.070 -0.491 1.00 0.00 C ATOM 921 O PRO A 59 34.412 -12.333 0.710 1.00 0.00 O ATOM 922 CB PRO A 59 32.802 -13.921 -0.878 1.00 0.00 C ATOM 923 CG PRO A 59 33.525 -15.166 -0.495 1.00 0.00 C ATOM 924 CD PRO A 59 34.592 -15.362 -1.536 1.00 0.00 C ATOM 0 HA PRO A 59 33.491 -12.396 -2.321 1.00 0.00 H new ATOM 0 HB2 PRO A 59 32.357 -13.438 -0.008 1.00 0.00 H new ATOM 0 HB3 PRO A 59 31.991 -14.133 -1.575 1.00 0.00 H new ATOM 0 HG2 PRO A 59 33.962 -15.073 0.499 1.00 0.00 H new ATOM 0 HG3 PRO A 59 32.846 -16.018 -0.467 1.00 0.00 H new ATOM 0 HD2 PRO A 59 35.484 -15.826 -1.115 1.00 0.00 H new ATOM 0 HD3 PRO A 59 34.250 -16.007 -2.346 1.00 0.00 H new ATOM 932 N ALA A 60 34.993 -10.954 -0.970 1.00 0.00 N ATOM 933 CA ALA A 60 35.581 -9.952 -0.091 1.00 0.00 C ATOM 934 C ALA A 60 35.683 -8.601 -0.789 1.00 0.00 C ATOM 935 O ALA A 60 34.960 -7.662 -0.455 1.00 0.00 O ATOM 936 CB ALA A 60 36.953 -10.407 0.385 1.00 0.00 C ATOM 0 H ALA A 60 35.036 -10.722 -1.962 1.00 0.00 H new ATOM 0 HA ALA A 60 34.928 -9.836 0.774 1.00 0.00 H new ATOM 0 HB1 ALA A 60 37.381 -9.649 1.041 1.00 0.00 H new ATOM 0 HB2 ALA A 60 36.856 -11.346 0.930 1.00 0.00 H new ATOM 0 HB3 ALA A 60 37.607 -10.553 -0.475 1.00 0.00 H new ATOM 942 N ASP A 61 36.586 -8.508 -1.760 1.00 0.00 N ATOM 943 CA ASP A 61 36.782 -7.271 -2.506 1.00 0.00 C ATOM 944 C ASP A 61 35.629 -7.032 -3.476 1.00 0.00 C ATOM 945 O ASP A 61 35.078 -5.933 -3.544 1.00 0.00 O ATOM 946 CB ASP A 61 38.106 -7.316 -3.270 1.00 0.00 C ATOM 947 CG ASP A 61 39.100 -6.286 -2.768 1.00 0.00 C ATOM 948 OD1 ASP A 61 39.685 -6.504 -1.687 1.00 0.00 O ATOM 949 OD2 ASP A 61 39.291 -5.261 -3.457 1.00 0.00 O ATOM 0 H ASP A 61 37.193 -9.275 -2.048 1.00 0.00 H new ATOM 0 HA ASP A 61 36.810 -6.447 -1.793 1.00 0.00 H new ATOM 0 HB2 ASP A 61 38.541 -8.311 -3.179 1.00 0.00 H new ATOM 0 HB3 ASP A 61 37.916 -7.147 -4.330 1.00 0.00 H new ATOM 954 N LEU A 62 35.269 -8.068 -4.225 1.00 0.00 N ATOM 955 CA LEU A 62 34.182 -7.972 -5.193 1.00 0.00 C ATOM 956 C LEU A 62 32.934 -7.374 -4.551 1.00 0.00 C ATOM 957 O LEU A 62 32.260 -6.534 -5.147 1.00 0.00 O ATOM 958 CB LEU A 62 33.862 -9.352 -5.769 1.00 0.00 C ATOM 959 CG LEU A 62 33.773 -10.497 -4.760 1.00 0.00 C ATOM 960 CD1 LEU A 62 32.340 -10.683 -4.288 1.00 0.00 C ATOM 961 CD2 LEU A 62 34.308 -11.786 -5.367 1.00 0.00 C ATOM 0 H LEU A 62 35.714 -8.985 -4.181 1.00 0.00 H new ATOM 0 HA LEU A 62 34.504 -7.315 -6.001 1.00 0.00 H new ATOM 0 HB2 LEU A 62 32.913 -9.290 -6.302 1.00 0.00 H new ATOM 0 HB3 LEU A 62 34.626 -9.602 -6.505 1.00 0.00 H new ATOM 0 HG LEU A 62 34.388 -10.243 -3.897 1.00 0.00 H new ATOM 0 HD11 LEU A 62 32.297 -11.502 -3.570 1.00 0.00 H new ATOM 0 HD12 LEU A 62 31.991 -9.766 -3.813 1.00 0.00 H new ATOM 0 HD13 LEU A 62 31.703 -10.914 -5.142 1.00 0.00 H new ATOM 0 HD21 LEU A 62 34.237 -12.590 -4.635 1.00 0.00 H new ATOM 0 HD22 LEU A 62 33.720 -12.045 -6.248 1.00 0.00 H new ATOM 0 HD23 LEU A 62 35.350 -11.648 -5.654 1.00 0.00 H new ATOM 973 N GLU A 63 32.633 -7.812 -3.333 1.00 0.00 N ATOM 974 CA GLU A 63 31.467 -7.319 -2.610 1.00 0.00 C ATOM 975 C GLU A 63 31.801 -6.043 -1.843 1.00 0.00 C ATOM 976 O GLU A 63 31.059 -5.673 -0.934 1.00 0.00 O ATOM 977 CB GLU A 63 30.948 -8.386 -1.644 1.00 0.00 C ATOM 978 CG GLU A 63 31.984 -8.846 -0.632 1.00 0.00 C ATOM 979 CD GLU A 63 31.371 -9.210 0.706 1.00 0.00 C ATOM 980 OE1 GLU A 63 30.442 -10.045 0.725 1.00 0.00 O ATOM 981 OE2 GLU A 63 31.818 -8.660 1.734 1.00 0.00 O ATOM 0 H GLU A 63 33.181 -8.507 -2.826 1.00 0.00 H new ATOM 0 HA GLU A 63 30.690 -7.091 -3.340 1.00 0.00 H new ATOM 0 HB2 GLU A 63 30.082 -7.992 -1.112 1.00 0.00 H new ATOM 0 HB3 GLU A 63 30.605 -9.247 -2.217 1.00 0.00 H new ATOM 0 HG2 GLU A 63 32.517 -9.709 -1.030 1.00 0.00 H new ATOM 0 HG3 GLU A 63 32.721 -8.056 -0.487 1.00 0.00 H new TER 988 GLU A 63 ATOM 989 N MET B 1 31.727 -11.809 -30.193 1.00 0.00 N ATOM 990 CA MET B 1 31.372 -11.498 -28.813 1.00 0.00 C ATOM 991 C MET B 1 30.909 -12.750 -28.075 1.00 0.00 C ATOM 992 O MET B 1 29.936 -13.393 -28.473 1.00 0.00 O ATOM 993 CB MET B 1 30.274 -10.433 -28.774 1.00 0.00 C ATOM 994 CG MET B 1 30.702 -9.097 -29.358 1.00 0.00 C ATOM 995 SD MET B 1 30.592 -7.750 -28.163 1.00 0.00 S ATOM 996 CE MET B 1 31.669 -8.358 -26.868 1.00 0.00 C ATOM 0 H1 MET B 1 32.355 -11.068 -30.565 1.00 0.00 H new ATOM 0 H2 MET B 1 32.216 -12.726 -30.227 1.00 0.00 H new ATOM 0 H3 MET B 1 30.864 -11.855 -30.772 1.00 0.00 H new ATOM 0 HA MET B 1 32.261 -11.112 -28.314 1.00 0.00 H new ATOM 0 HB2 MET B 1 29.405 -10.798 -29.322 1.00 0.00 H new ATOM 0 HB3 MET B 1 29.960 -10.285 -27.741 1.00 0.00 H new ATOM 0 HG2 MET B 1 31.727 -9.174 -29.719 1.00 0.00 H new ATOM 0 HG3 MET B 1 30.077 -8.865 -30.220 1.00 0.00 H new ATOM 0 HE1 MET B 1 32.224 -7.525 -26.435 1.00 0.00 H new ATOM 0 HE2 MET B 1 31.071 -8.838 -26.093 1.00 0.00 H new ATOM 0 HE3 MET B 1 32.369 -9.081 -27.286 1.00 0.00 H new ATOM 1006 N LEU B 2 31.611 -13.092 -27.001 1.00 0.00 N ATOM 1007 CA LEU B 2 31.272 -14.269 -26.208 1.00 0.00 C ATOM 1008 C LEU B 2 30.952 -13.881 -24.768 1.00 0.00 C ATOM 1009 O LEU B 2 31.795 -13.327 -24.062 1.00 0.00 O ATOM 1010 CB LEU B 2 32.424 -15.275 -26.234 1.00 0.00 C ATOM 1011 CG LEU B 2 32.026 -16.750 -26.292 1.00 0.00 C ATOM 1012 CD1 LEU B 2 33.258 -17.639 -26.229 1.00 0.00 C ATOM 1013 CD2 LEU B 2 31.064 -17.088 -25.162 1.00 0.00 C ATOM 0 H LEU B 2 32.419 -12.571 -26.659 1.00 0.00 H new ATOM 0 HA LEU B 2 30.386 -14.730 -26.646 1.00 0.00 H new ATOM 0 HB2 LEU B 2 33.053 -15.055 -27.097 1.00 0.00 H new ATOM 0 HB3 LEU B 2 33.036 -15.119 -25.346 1.00 0.00 H new ATOM 0 HG LEU B 2 31.520 -16.932 -27.240 1.00 0.00 H new ATOM 0 HD11 LEU B 2 32.954 -18.685 -26.272 1.00 0.00 H new ATOM 0 HD12 LEU B 2 33.911 -17.416 -27.073 1.00 0.00 H new ATOM 0 HD13 LEU B 2 33.793 -17.454 -25.297 1.00 0.00 H new ATOM 0 HD21 LEU B 2 30.792 -18.142 -25.219 1.00 0.00 H new ATOM 0 HD22 LEU B 2 31.544 -16.889 -24.204 1.00 0.00 H new ATOM 0 HD23 LEU B 2 30.167 -16.476 -25.253 1.00 0.00 H new ATOM 1025 N MET B 3 29.730 -14.177 -24.338 1.00 0.00 N ATOM 1026 CA MET B 3 29.301 -13.862 -22.980 1.00 0.00 C ATOM 1027 C MET B 3 30.213 -14.527 -21.954 1.00 0.00 C ATOM 1028 O MET B 3 30.243 -15.753 -21.839 1.00 0.00 O ATOM 1029 CB MET B 3 27.855 -14.312 -22.763 1.00 0.00 C ATOM 1030 CG MET B 3 27.079 -13.421 -21.807 1.00 0.00 C ATOM 1031 SD MET B 3 25.808 -14.320 -20.896 1.00 0.00 S ATOM 1032 CE MET B 3 25.769 -13.391 -19.365 1.00 0.00 C ATOM 0 H MET B 3 29.020 -14.634 -24.910 1.00 0.00 H new ATOM 0 HA MET B 3 29.362 -12.782 -22.847 1.00 0.00 H new ATOM 0 HB2 MET B 3 27.342 -14.334 -23.724 1.00 0.00 H new ATOM 0 HB3 MET B 3 27.854 -15.332 -22.378 1.00 0.00 H new ATOM 0 HG2 MET B 3 27.771 -12.963 -21.101 1.00 0.00 H new ATOM 0 HG3 MET B 3 26.614 -12.611 -22.368 1.00 0.00 H new ATOM 0 HE1 MET B 3 24.737 -13.282 -19.031 1.00 0.00 H new ATOM 0 HE2 MET B 3 26.343 -13.920 -18.604 1.00 0.00 H new ATOM 0 HE3 MET B 3 26.204 -12.405 -19.527 1.00 0.00 H new ATOM 1042 N ILE B 4 30.953 -13.712 -21.211 1.00 0.00 N ATOM 1043 CA ILE B 4 31.864 -14.222 -20.194 1.00 0.00 C ATOM 1044 C ILE B 4 31.098 -14.819 -19.018 1.00 0.00 C ATOM 1045 O ILE B 4 31.380 -15.935 -18.580 1.00 0.00 O ATOM 1046 CB ILE B 4 32.803 -13.118 -19.673 1.00 0.00 C ATOM 1047 CG1 ILE B 4 33.741 -12.649 -20.787 1.00 0.00 C ATOM 1048 CG2 ILE B 4 33.599 -13.619 -18.478 1.00 0.00 C ATOM 1049 CD1 ILE B 4 34.525 -13.772 -21.429 1.00 0.00 C ATOM 0 H ILE B 4 30.940 -12.695 -21.294 1.00 0.00 H new ATOM 0 HA ILE B 4 32.461 -15.001 -20.669 1.00 0.00 H new ATOM 0 HB ILE B 4 32.199 -12.270 -19.351 1.00 0.00 H new ATOM 0 HG12 ILE B 4 33.156 -12.141 -21.553 1.00 0.00 H new ATOM 0 HG13 ILE B 4 34.438 -11.917 -20.380 1.00 0.00 H new ATOM 0 HG21 ILE B 4 34.258 -12.827 -18.122 1.00 0.00 H new ATOM 0 HG22 ILE B 4 32.915 -13.908 -17.680 1.00 0.00 H new ATOM 0 HG23 ILE B 4 34.196 -14.482 -18.774 1.00 0.00 H new ATOM 0 HD11 ILE B 4 35.169 -13.366 -22.210 1.00 0.00 H new ATOM 0 HD12 ILE B 4 35.137 -14.266 -20.674 1.00 0.00 H new ATOM 0 HD13 ILE B 4 33.835 -14.494 -21.866 1.00 0.00 H new ATOM 1061 N THR B 5 30.125 -14.068 -18.511 1.00 0.00 N ATOM 1062 CA THR B 5 29.316 -14.522 -17.387 1.00 0.00 C ATOM 1063 C THR B 5 28.214 -13.520 -17.063 1.00 0.00 C ATOM 1064 O THR B 5 28.017 -12.544 -17.785 1.00 0.00 O ATOM 1065 CB THR B 5 30.177 -14.745 -16.130 1.00 0.00 C ATOM 1066 OG1 THR B 5 29.446 -15.510 -15.164 1.00 0.00 O ATOM 1067 CG2 THR B 5 30.598 -13.417 -15.519 1.00 0.00 C ATOM 0 H THR B 5 29.878 -13.142 -18.861 1.00 0.00 H new ATOM 0 HA THR B 5 28.866 -15.470 -17.683 1.00 0.00 H new ATOM 0 HB THR B 5 31.073 -15.292 -16.423 1.00 0.00 H new ATOM 0 HG1 THR B 5 30.001 -15.649 -14.369 1.00 0.00 H new ATOM 0 HG21 THR B 5 31.205 -13.601 -14.633 1.00 0.00 H new ATOM 0 HG22 THR B 5 31.179 -12.850 -16.246 1.00 0.00 H new ATOM 0 HG23 THR B 5 29.711 -12.848 -15.240 1.00 0.00 H new ATOM 1075 N SER B 6 27.497 -13.769 -15.971 1.00 0.00 N ATOM 1076 CA SER B 6 26.412 -12.890 -15.553 1.00 0.00 C ATOM 1077 C SER B 6 26.496 -12.596 -14.058 1.00 0.00 C ATOM 1078 O SER B 6 26.957 -13.428 -13.275 1.00 0.00 O ATOM 1079 CB SER B 6 25.058 -13.522 -15.885 1.00 0.00 C ATOM 1080 OG SER B 6 24.587 -14.313 -14.808 1.00 0.00 O ATOM 0 H SER B 6 27.648 -14.572 -15.361 1.00 0.00 H new ATOM 0 HA SER B 6 26.509 -11.950 -16.096 1.00 0.00 H new ATOM 0 HB2 SER B 6 24.333 -12.740 -16.110 1.00 0.00 H new ATOM 0 HB3 SER B 6 25.150 -14.138 -16.780 1.00 0.00 H new ATOM 0 HG SER B 6 23.720 -14.704 -15.044 1.00 0.00 H new ATOM 1086 N PHE B 7 26.047 -11.408 -13.669 1.00 0.00 N ATOM 1087 CA PHE B 7 26.072 -11.003 -12.268 1.00 0.00 C ATOM 1088 C PHE B 7 24.787 -10.271 -11.891 1.00 0.00 C ATOM 1089 O PHE B 7 23.996 -9.896 -12.756 1.00 0.00 O ATOM 1090 CB PHE B 7 27.281 -10.106 -11.996 1.00 0.00 C ATOM 1091 CG PHE B 7 28.598 -10.794 -12.215 1.00 0.00 C ATOM 1092 CD1 PHE B 7 28.876 -12.002 -11.596 1.00 0.00 C ATOM 1093 CD2 PHE B 7 29.559 -10.233 -13.041 1.00 0.00 C ATOM 1094 CE1 PHE B 7 30.087 -12.636 -11.795 1.00 0.00 C ATOM 1095 CE2 PHE B 7 30.772 -10.863 -13.245 1.00 0.00 C ATOM 1096 CZ PHE B 7 31.036 -12.067 -12.622 1.00 0.00 C ATOM 0 H PHE B 7 25.661 -10.709 -14.304 1.00 0.00 H new ATOM 0 HA PHE B 7 26.150 -11.902 -11.657 1.00 0.00 H new ATOM 0 HB2 PHE B 7 27.226 -9.230 -12.642 1.00 0.00 H new ATOM 0 HB3 PHE B 7 27.234 -9.748 -10.968 1.00 0.00 H new ATOM 0 HD1 PHE B 7 28.137 -12.453 -10.950 1.00 0.00 H new ATOM 0 HD2 PHE B 7 29.358 -9.292 -13.531 1.00 0.00 H new ATOM 0 HE1 PHE B 7 30.292 -13.576 -11.304 1.00 0.00 H new ATOM 0 HE2 PHE B 7 31.512 -10.414 -13.891 1.00 0.00 H new ATOM 0 HZ PHE B 7 31.982 -12.563 -12.781 1.00 0.00 H new ATOM 1106 N ALA B 8 24.586 -10.071 -10.592 1.00 0.00 N ATOM 1107 CA ALA B 8 23.399 -9.383 -10.100 1.00 0.00 C ATOM 1108 C ALA B 8 23.777 -8.231 -9.175 1.00 0.00 C ATOM 1109 O ALA B 8 23.112 -7.988 -8.168 1.00 0.00 O ATOM 1110 CB ALA B 8 22.482 -10.361 -9.381 1.00 0.00 C ATOM 0 H ALA B 8 25.230 -10.376 -9.862 1.00 0.00 H new ATOM 0 HA ALA B 8 22.868 -8.968 -10.957 1.00 0.00 H new ATOM 0 HB1 ALA B 8 21.600 -9.833 -9.019 1.00 0.00 H new ATOM 0 HB2 ALA B 8 22.177 -11.148 -10.071 1.00 0.00 H new ATOM 0 HB3 ALA B 8 23.012 -10.804 -8.537 1.00 0.00 H new ATOM 1116 N ASN B 9 24.848 -7.526 -9.522 1.00 0.00 N ATOM 1117 CA ASN B 9 25.315 -6.400 -8.721 1.00 0.00 C ATOM 1118 C ASN B 9 26.324 -5.560 -9.499 1.00 0.00 C ATOM 1119 O ASN B 9 27.197 -6.080 -10.194 1.00 0.00 O ATOM 1120 CB ASN B 9 25.945 -6.899 -7.420 1.00 0.00 C ATOM 1121 CG ASN B 9 25.020 -6.736 -6.229 1.00 0.00 C ATOM 1122 OD1 ASN B 9 24.312 -5.736 -6.111 1.00 0.00 O ATOM 1123 ND2 ASN B 9 25.023 -7.722 -5.339 1.00 0.00 N ATOM 0 H ASN B 9 25.409 -7.714 -10.353 1.00 0.00 H new ATOM 0 HA ASN B 9 24.455 -5.774 -8.483 1.00 0.00 H new ATOM 0 HB2 ASN B 9 26.211 -7.950 -7.528 1.00 0.00 H new ATOM 0 HB3 ASN B 9 26.870 -6.353 -7.235 1.00 0.00 H new ATOM 0 HD21 ASN B 9 24.422 -7.669 -4.517 1.00 0.00 H new ATOM 0 HD22 ASN B 9 25.627 -8.532 -5.478 1.00 0.00 H new ATOM 1130 N PRO B 10 26.203 -4.229 -9.380 1.00 0.00 N ATOM 1131 CA PRO B 10 27.096 -3.289 -10.063 1.00 0.00 C ATOM 1132 C PRO B 10 28.509 -3.311 -9.490 1.00 0.00 C ATOM 1133 O PRO B 10 29.490 -3.243 -10.230 1.00 0.00 O ATOM 1134 CB PRO B 10 26.438 -1.930 -9.813 1.00 0.00 C ATOM 1135 CG PRO B 10 25.656 -2.112 -8.559 1.00 0.00 C ATOM 1136 CD PRO B 10 25.185 -3.540 -8.568 1.00 0.00 C ATOM 0 HA PRO B 10 27.214 -3.533 -11.119 1.00 0.00 H new ATOM 0 HB2 PRO B 10 27.184 -1.143 -9.703 1.00 0.00 H new ATOM 0 HB3 PRO B 10 25.793 -1.644 -10.644 1.00 0.00 H new ATOM 0 HG2 PRO B 10 26.272 -1.910 -7.682 1.00 0.00 H new ATOM 0 HG3 PRO B 10 24.812 -1.423 -8.522 1.00 0.00 H new ATOM 0 HD2 PRO B 10 25.129 -3.951 -7.560 1.00 0.00 H new ATOM 0 HD3 PRO B 10 24.191 -3.633 -9.006 1.00 0.00 H new ATOM 1144 N ARG B 11 28.604 -3.405 -8.167 1.00 0.00 N ATOM 1145 CA ARG B 11 29.898 -3.435 -7.495 1.00 0.00 C ATOM 1146 C ARG B 11 30.745 -4.600 -7.998 1.00 0.00 C ATOM 1147 O ARG B 11 31.918 -4.430 -8.331 1.00 0.00 O ATOM 1148 CB ARG B 11 29.707 -3.545 -5.981 1.00 0.00 C ATOM 1149 CG ARG B 11 30.537 -2.548 -5.189 1.00 0.00 C ATOM 1150 CD ARG B 11 32.025 -2.742 -5.436 1.00 0.00 C ATOM 1151 NE ARG B 11 32.653 -1.534 -5.964 1.00 0.00 N ATOM 1152 CZ ARG B 11 33.963 -1.314 -5.936 1.00 0.00 C ATOM 1153 NH1 ARG B 11 34.779 -2.216 -5.407 1.00 0.00 N ATOM 1154 NH2 ARG B 11 34.460 -0.190 -6.437 1.00 0.00 N ATOM 0 H ARG B 11 27.801 -3.462 -7.540 1.00 0.00 H new ATOM 0 HA ARG B 11 30.419 -2.505 -7.722 1.00 0.00 H new ATOM 0 HB2 ARG B 11 28.653 -3.397 -5.744 1.00 0.00 H new ATOM 0 HB3 ARG B 11 29.966 -4.555 -5.663 1.00 0.00 H new ATOM 0 HG2 ARG B 11 30.250 -1.533 -5.465 1.00 0.00 H new ATOM 0 HG3 ARG B 11 30.326 -2.660 -4.126 1.00 0.00 H new ATOM 0 HD2 ARG B 11 32.513 -3.027 -4.504 1.00 0.00 H new ATOM 0 HD3 ARG B 11 32.172 -3.563 -6.137 1.00 0.00 H new ATOM 0 HE ARG B 11 32.053 -0.820 -6.377 1.00 0.00 H new ATOM 0 HH11 ARG B 11 34.401 -3.081 -5.020 1.00 0.00 H new ATOM 0 HH12 ARG B 11 35.784 -2.045 -5.387 1.00 0.00 H new ATOM 0 HH21 ARG B 11 33.836 0.507 -6.844 1.00 0.00 H new ATOM 0 HH22 ARG B 11 35.466 -0.023 -6.415 1.00 0.00 H new ATOM 1168 N VAL B 12 30.143 -5.784 -8.049 1.00 0.00 N ATOM 1169 CA VAL B 12 30.842 -6.978 -8.512 1.00 0.00 C ATOM 1170 C VAL B 12 31.157 -6.888 -10.000 1.00 0.00 C ATOM 1171 O VAL B 12 32.298 -7.087 -10.417 1.00 0.00 O ATOM 1172 CB VAL B 12 30.014 -8.250 -8.249 1.00 0.00 C ATOM 1173 CG1 VAL B 12 30.794 -9.489 -8.661 1.00 0.00 C ATOM 1174 CG2 VAL B 12 29.607 -8.327 -6.786 1.00 0.00 C ATOM 0 H VAL B 12 29.173 -5.942 -7.776 1.00 0.00 H new ATOM 0 HA VAL B 12 31.774 -7.037 -7.950 1.00 0.00 H new ATOM 0 HB VAL B 12 29.107 -8.204 -8.852 1.00 0.00 H new ATOM 0 HG11 VAL B 12 30.193 -10.378 -8.468 1.00 0.00 H new ATOM 0 HG12 VAL B 12 31.030 -9.434 -9.724 1.00 0.00 H new ATOM 0 HG13 VAL B 12 31.719 -9.544 -8.087 1.00 0.00 H new ATOM 0 HG21 VAL B 12 29.023 -9.232 -6.618 1.00 0.00 H new ATOM 0 HG22 VAL B 12 30.500 -8.350 -6.161 1.00 0.00 H new ATOM 0 HG23 VAL B 12 29.006 -7.454 -6.529 1.00 0.00 H new ATOM 1184 N ALA B 13 30.138 -6.585 -10.798 1.00 0.00 N ATOM 1185 CA ALA B 13 30.307 -6.466 -12.241 1.00 0.00 C ATOM 1186 C ALA B 13 31.393 -5.452 -12.585 1.00 0.00 C ATOM 1187 O ALA B 13 32.359 -5.775 -13.275 1.00 0.00 O ATOM 1188 CB ALA B 13 28.990 -6.075 -12.896 1.00 0.00 C ATOM 0 H ALA B 13 29.187 -6.418 -10.469 1.00 0.00 H new ATOM 0 HA ALA B 13 30.618 -7.437 -12.627 1.00 0.00 H new ATOM 0 HB1 ALA B 13 29.131 -5.990 -13.973 1.00 0.00 H new ATOM 0 HB2 ALA B 13 28.239 -6.837 -12.687 1.00 0.00 H new ATOM 0 HB3 ALA B 13 28.655 -5.118 -12.497 1.00 0.00 H new ATOM 1194 N GLN B 14 31.227 -4.226 -12.099 1.00 0.00 N ATOM 1195 CA GLN B 14 32.193 -3.166 -12.357 1.00 0.00 C ATOM 1196 C GLN B 14 33.584 -3.568 -11.878 1.00 0.00 C ATOM 1197 O GLN B 14 34.552 -3.513 -12.635 1.00 0.00 O ATOM 1198 CB GLN B 14 31.758 -1.871 -11.669 1.00 0.00 C ATOM 1199 CG GLN B 14 32.821 -0.785 -11.686 1.00 0.00 C ATOM 1200 CD GLN B 14 33.228 -0.390 -13.092 1.00 0.00 C ATOM 1201 OE1 GLN B 14 32.400 -0.350 -14.003 1.00 0.00 O ATOM 1202 NE2 GLN B 14 34.510 -0.094 -13.276 1.00 0.00 N ATOM 0 H GLN B 14 30.433 -3.943 -11.525 1.00 0.00 H new ATOM 0 HA GLN B 14 32.233 -3.001 -13.434 1.00 0.00 H new ATOM 0 HB2 GLN B 14 30.859 -1.495 -12.157 1.00 0.00 H new ATOM 0 HB3 GLN B 14 31.492 -2.091 -10.635 1.00 0.00 H new ATOM 0 HG2 GLN B 14 32.447 0.093 -11.160 1.00 0.00 H new ATOM 0 HG3 GLN B 14 33.699 -1.133 -11.142 1.00 0.00 H new ATOM 0 HE21 GLN B 14 35.162 -0.140 -12.493 1.00 0.00 H new ATOM 0 HE22 GLN B 14 34.843 0.180 -14.201 1.00 0.00 H new ATOM 1211 N ALA B 15 33.675 -3.971 -10.615 1.00 0.00 N ATOM 1212 CA ALA B 15 34.947 -4.384 -10.034 1.00 0.00 C ATOM 1213 C ALA B 15 35.645 -5.412 -10.918 1.00 0.00 C ATOM 1214 O ALA B 15 36.837 -5.291 -11.205 1.00 0.00 O ATOM 1215 CB ALA B 15 34.732 -4.945 -8.636 1.00 0.00 C ATOM 0 H ALA B 15 32.883 -4.020 -9.974 1.00 0.00 H new ATOM 0 HA ALA B 15 35.589 -3.506 -9.965 1.00 0.00 H new ATOM 0 HB1 ALA B 15 35.690 -5.249 -8.215 1.00 0.00 H new ATOM 0 HB2 ALA B 15 34.283 -4.180 -8.002 1.00 0.00 H new ATOM 0 HB3 ALA B 15 34.068 -5.808 -8.688 1.00 0.00 H new ATOM 1221 N PHE B 16 34.897 -6.423 -11.345 1.00 0.00 N ATOM 1222 CA PHE B 16 35.445 -7.474 -12.195 1.00 0.00 C ATOM 1223 C PHE B 16 36.033 -6.887 -13.475 1.00 0.00 C ATOM 1224 O PHE B 16 37.229 -7.015 -13.738 1.00 0.00 O ATOM 1225 CB PHE B 16 34.362 -8.497 -12.541 1.00 0.00 C ATOM 1226 CG PHE B 16 34.296 -9.649 -11.579 1.00 0.00 C ATOM 1227 CD1 PHE B 16 34.586 -9.466 -10.237 1.00 0.00 C ATOM 1228 CD2 PHE B 16 33.945 -10.916 -12.018 1.00 0.00 C ATOM 1229 CE1 PHE B 16 34.526 -10.524 -9.349 1.00 0.00 C ATOM 1230 CE2 PHE B 16 33.884 -11.977 -11.135 1.00 0.00 C ATOM 1231 CZ PHE B 16 34.175 -11.781 -9.800 1.00 0.00 C ATOM 0 H PHE B 16 33.909 -6.537 -11.117 1.00 0.00 H new ATOM 0 HA PHE B 16 36.243 -7.972 -11.644 1.00 0.00 H new ATOM 0 HB2 PHE B 16 33.394 -7.996 -12.563 1.00 0.00 H new ATOM 0 HB3 PHE B 16 34.544 -8.882 -13.544 1.00 0.00 H new ATOM 0 HD1 PHE B 16 34.862 -8.485 -9.880 1.00 0.00 H new ATOM 0 HD2 PHE B 16 33.717 -11.076 -13.061 1.00 0.00 H new ATOM 0 HE1 PHE B 16 34.753 -10.368 -8.305 1.00 0.00 H new ATOM 0 HE2 PHE B 16 33.609 -12.959 -11.489 1.00 0.00 H new ATOM 0 HZ PHE B 16 34.128 -12.610 -9.109 1.00 0.00 H new ATOM 1241 N VAL B 17 35.184 -6.243 -14.268 1.00 0.00 N ATOM 1242 CA VAL B 17 35.618 -5.635 -15.521 1.00 0.00 C ATOM 1243 C VAL B 17 36.726 -4.616 -15.282 1.00 0.00 C ATOM 1244 O VAL B 17 37.486 -4.285 -16.192 1.00 0.00 O ATOM 1245 CB VAL B 17 34.447 -4.944 -16.245 1.00 0.00 C ATOM 1246 CG1 VAL B 17 33.342 -5.944 -16.548 1.00 0.00 C ATOM 1247 CG2 VAL B 17 33.916 -3.786 -15.413 1.00 0.00 C ATOM 0 H VAL B 17 34.191 -6.128 -14.066 1.00 0.00 H new ATOM 0 HA VAL B 17 35.998 -6.441 -16.149 1.00 0.00 H new ATOM 0 HB VAL B 17 34.812 -4.545 -17.191 1.00 0.00 H new ATOM 0 HG11 VAL B 17 32.523 -5.438 -17.059 1.00 0.00 H new ATOM 0 HG12 VAL B 17 33.733 -6.737 -17.186 1.00 0.00 H new ATOM 0 HG13 VAL B 17 32.976 -6.375 -15.616 1.00 0.00 H new ATOM 0 HG21 VAL B 17 33.089 -3.309 -15.939 1.00 0.00 H new ATOM 0 HG22 VAL B 17 33.566 -4.160 -14.451 1.00 0.00 H new ATOM 0 HG23 VAL B 17 34.712 -3.059 -15.252 1.00 0.00 H new ATOM 1257 N ASP B 18 36.813 -4.122 -14.052 1.00 0.00 N ATOM 1258 CA ASP B 18 37.830 -3.141 -13.692 1.00 0.00 C ATOM 1259 C ASP B 18 39.215 -3.781 -13.662 1.00 0.00 C ATOM 1260 O ASP B 18 40.111 -3.379 -14.404 1.00 0.00 O ATOM 1261 CB ASP B 18 37.512 -2.521 -12.331 1.00 0.00 C ATOM 1262 CG ASP B 18 38.288 -1.243 -12.081 1.00 0.00 C ATOM 1263 OD1 ASP B 18 38.590 -0.531 -13.061 1.00 0.00 O ATOM 1264 OD2 ASP B 18 38.594 -0.955 -10.905 1.00 0.00 O ATOM 0 H ASP B 18 36.191 -4.385 -13.287 1.00 0.00 H new ATOM 0 HA ASP B 18 37.828 -2.357 -14.449 1.00 0.00 H new ATOM 0 HB2 ASP B 18 36.444 -2.312 -12.271 1.00 0.00 H new ATOM 0 HB3 ASP B 18 37.740 -3.241 -11.545 1.00 0.00 H new ATOM 1269 N TYR B 19 39.383 -4.776 -12.799 1.00 0.00 N ATOM 1270 CA TYR B 19 40.659 -5.469 -12.669 1.00 0.00 C ATOM 1271 C TYR B 19 41.054 -6.134 -13.985 1.00 0.00 C ATOM 1272 O TYR B 19 42.237 -6.264 -14.296 1.00 0.00 O ATOM 1273 CB TYR B 19 40.584 -6.517 -11.558 1.00 0.00 C ATOM 1274 CG TYR B 19 40.058 -7.856 -12.022 1.00 0.00 C ATOM 1275 CD1 TYR B 19 40.853 -8.716 -12.768 1.00 0.00 C ATOM 1276 CD2 TYR B 19 38.764 -8.260 -11.715 1.00 0.00 C ATOM 1277 CE1 TYR B 19 40.376 -9.941 -13.195 1.00 0.00 C ATOM 1278 CE2 TYR B 19 38.279 -9.482 -12.136 1.00 0.00 C ATOM 1279 CZ TYR B 19 39.088 -10.319 -12.876 1.00 0.00 C ATOM 1280 OH TYR B 19 38.608 -11.538 -13.299 1.00 0.00 O ATOM 0 H TYR B 19 38.651 -5.121 -12.178 1.00 0.00 H new ATOM 0 HA TYR B 19 41.419 -4.731 -12.412 1.00 0.00 H new ATOM 0 HB2 TYR B 19 41.578 -6.654 -11.132 1.00 0.00 H new ATOM 0 HB3 TYR B 19 39.944 -6.142 -10.759 1.00 0.00 H new ATOM 0 HD1 TYR B 19 41.862 -8.423 -13.019 1.00 0.00 H new ATOM 0 HD2 TYR B 19 38.127 -7.607 -11.137 1.00 0.00 H new ATOM 0 HE1 TYR B 19 41.007 -10.598 -13.775 1.00 0.00 H new ATOM 0 HE2 TYR B 19 37.271 -9.781 -11.887 1.00 0.00 H new ATOM 0 HH TYR B 19 38.676 -11.595 -14.275 1.00 0.00 H new ATOM 1290 N MET B 20 40.053 -6.552 -14.752 1.00 0.00 N ATOM 1291 CA MET B 20 40.295 -7.202 -16.035 1.00 0.00 C ATOM 1292 C MET B 20 40.716 -6.184 -17.090 1.00 0.00 C ATOM 1293 O MET B 20 41.580 -6.460 -17.922 1.00 0.00 O ATOM 1294 CB MET B 20 39.040 -7.945 -16.499 1.00 0.00 C ATOM 1295 CG MET B 20 39.339 -9.222 -17.268 1.00 0.00 C ATOM 1296 SD MET B 20 39.188 -10.699 -16.246 1.00 0.00 S ATOM 1297 CE MET B 20 40.830 -11.394 -16.410 1.00 0.00 C ATOM 0 H MET B 20 39.068 -6.453 -14.508 1.00 0.00 H new ATOM 0 HA MET B 20 41.106 -7.919 -15.904 1.00 0.00 H new ATOM 0 HB2 MET B 20 38.430 -8.189 -15.629 1.00 0.00 H new ATOM 0 HB3 MET B 20 38.447 -7.282 -17.129 1.00 0.00 H new ATOM 0 HG2 MET B 20 38.657 -9.300 -18.115 1.00 0.00 H new ATOM 0 HG3 MET B 20 40.349 -9.168 -17.675 1.00 0.00 H new ATOM 0 HE1 MET B 20 40.789 -12.469 -16.236 1.00 0.00 H new ATOM 0 HE2 MET B 20 41.207 -11.203 -17.415 1.00 0.00 H new ATOM 0 HE3 MET B 20 41.495 -10.933 -15.679 1.00 0.00 H new ATOM 1307 N ALA B 21 40.101 -5.007 -17.049 1.00 0.00 N ATOM 1308 CA ALA B 21 40.414 -3.948 -17.999 1.00 0.00 C ATOM 1309 C ALA B 21 41.847 -3.456 -17.822 1.00 0.00 C ATOM 1310 O ALA B 21 42.546 -3.181 -18.797 1.00 0.00 O ATOM 1311 CB ALA B 21 39.435 -2.793 -17.845 1.00 0.00 C ATOM 0 H ALA B 21 39.383 -4.763 -16.367 1.00 0.00 H new ATOM 0 HA ALA B 21 40.320 -4.358 -19.005 1.00 0.00 H new ATOM 0 HB1 ALA B 21 39.681 -2.009 -18.561 1.00 0.00 H new ATOM 0 HB2 ALA B 21 38.421 -3.148 -18.030 1.00 0.00 H new ATOM 0 HB3 ALA B 21 39.500 -2.393 -16.833 1.00 0.00 H new ATOM 1317 N THR B 22 42.279 -3.347 -16.569 1.00 0.00 N ATOM 1318 CA THR B 22 43.628 -2.887 -16.263 1.00 0.00 C ATOM 1319 C THR B 22 44.653 -3.987 -16.510 1.00 0.00 C ATOM 1320 O THR B 22 45.857 -3.732 -16.532 1.00 0.00 O ATOM 1321 CB THR B 22 43.741 -2.412 -14.802 1.00 0.00 C ATOM 1322 OG1 THR B 22 45.070 -1.945 -14.541 1.00 0.00 O ATOM 1323 CG2 THR B 22 43.396 -3.538 -13.839 1.00 0.00 C ATOM 0 H THR B 22 41.714 -3.571 -15.750 1.00 0.00 H new ATOM 0 HA THR B 22 43.835 -2.047 -16.927 1.00 0.00 H new ATOM 0 HB THR B 22 43.033 -1.597 -14.652 1.00 0.00 H new ATOM 0 HG1 THR B 22 45.701 -2.410 -15.129 1.00 0.00 H new ATOM 0 HG21 THR B 22 43.483 -3.179 -12.813 1.00 0.00 H new ATOM 0 HG22 THR B 22 42.375 -3.872 -14.021 1.00 0.00 H new ATOM 0 HG23 THR B 22 44.083 -4.370 -13.991 1.00 0.00 H new ATOM 1331 N GLN B 23 44.169 -5.211 -16.694 1.00 0.00 N ATOM 1332 CA GLN B 23 45.045 -6.350 -16.939 1.00 0.00 C ATOM 1333 C GLN B 23 45.305 -6.526 -18.432 1.00 0.00 C ATOM 1334 O GLN B 23 46.030 -7.431 -18.843 1.00 0.00 O ATOM 1335 CB GLN B 23 44.430 -7.627 -16.363 1.00 0.00 C ATOM 1336 CG GLN B 23 44.692 -7.812 -14.877 1.00 0.00 C ATOM 1337 CD GLN B 23 46.135 -8.169 -14.579 1.00 0.00 C ATOM 1338 OE1 GLN B 23 46.509 -9.343 -14.583 1.00 0.00 O ATOM 1339 NE2 GLN B 23 46.955 -7.158 -14.319 1.00 0.00 N ATOM 0 H GLN B 23 43.175 -5.439 -16.678 1.00 0.00 H new ATOM 0 HA GLN B 23 45.996 -6.157 -16.443 1.00 0.00 H new ATOM 0 HB2 GLN B 23 43.354 -7.611 -16.534 1.00 0.00 H new ATOM 0 HB3 GLN B 23 44.826 -8.487 -16.903 1.00 0.00 H new ATOM 0 HG2 GLN B 23 44.432 -6.894 -14.349 1.00 0.00 H new ATOM 0 HG3 GLN B 23 44.041 -8.597 -14.492 1.00 0.00 H new ATOM 0 HE21 GLN B 23 46.603 -6.201 -14.326 1.00 0.00 H new ATOM 0 HE22 GLN B 23 47.937 -7.338 -14.112 1.00 0.00 H new ATOM 1348 N GLY B 24 44.708 -5.654 -19.238 1.00 0.00 N ATOM 1349 CA GLY B 24 44.887 -5.730 -20.676 1.00 0.00 C ATOM 1350 C GLY B 24 43.702 -6.366 -21.376 1.00 0.00 C ATOM 1351 O GLY B 24 43.658 -6.431 -22.604 1.00 0.00 O ATOM 0 H GLY B 24 44.103 -4.896 -18.921 1.00 0.00 H new ATOM 0 HA2 GLY B 24 45.044 -4.727 -21.073 1.00 0.00 H new ATOM 0 HA3 GLY B 24 45.787 -6.304 -20.897 1.00 0.00 H new ATOM 1355 N VAL B 25 42.737 -6.837 -20.592 1.00 0.00 N ATOM 1356 CA VAL B 25 41.545 -7.471 -21.143 1.00 0.00 C ATOM 1357 C VAL B 25 40.318 -6.584 -20.964 1.00 0.00 C ATOM 1358 O VAL B 25 39.861 -6.360 -19.843 1.00 0.00 O ATOM 1359 CB VAL B 25 41.280 -8.836 -20.482 1.00 0.00 C ATOM 1360 CG1 VAL B 25 40.204 -9.597 -21.241 1.00 0.00 C ATOM 1361 CG2 VAL B 25 42.563 -9.649 -20.402 1.00 0.00 C ATOM 0 H VAL B 25 42.758 -6.791 -19.573 1.00 0.00 H new ATOM 0 HA VAL B 25 41.729 -7.621 -22.207 1.00 0.00 H new ATOM 0 HB VAL B 25 40.923 -8.664 -19.467 1.00 0.00 H new ATOM 0 HG11 VAL B 25 40.030 -10.559 -20.759 1.00 0.00 H new ATOM 0 HG12 VAL B 25 39.280 -9.019 -21.240 1.00 0.00 H new ATOM 0 HG13 VAL B 25 40.529 -9.759 -22.269 1.00 0.00 H new ATOM 0 HG21 VAL B 25 42.356 -10.610 -19.932 1.00 0.00 H new ATOM 0 HG22 VAL B 25 42.953 -9.813 -21.407 1.00 0.00 H new ATOM 0 HG23 VAL B 25 43.301 -9.107 -19.810 1.00 0.00 H new ATOM 1371 N ILE B 26 39.790 -6.083 -22.075 1.00 0.00 N ATOM 1372 CA ILE B 26 38.615 -5.222 -22.041 1.00 0.00 C ATOM 1373 C ILE B 26 37.335 -6.043 -21.923 1.00 0.00 C ATOM 1374 O ILE B 26 37.118 -6.987 -22.683 1.00 0.00 O ATOM 1375 CB ILE B 26 38.529 -4.336 -23.298 1.00 0.00 C ATOM 1376 CG1 ILE B 26 39.780 -3.464 -23.420 1.00 0.00 C ATOM 1377 CG2 ILE B 26 37.277 -3.473 -23.253 1.00 0.00 C ATOM 1378 CD1 ILE B 26 39.998 -2.550 -22.234 1.00 0.00 C ATOM 0 H ILE B 26 40.157 -6.259 -23.010 1.00 0.00 H new ATOM 0 HA ILE B 26 38.717 -4.584 -21.163 1.00 0.00 H new ATOM 0 HB ILE B 26 38.471 -4.980 -24.176 1.00 0.00 H new ATOM 0 HG12 ILE B 26 40.652 -4.108 -23.537 1.00 0.00 H new ATOM 0 HG13 ILE B 26 39.705 -2.860 -24.325 1.00 0.00 H new ATOM 0 HG21 ILE B 26 37.230 -2.853 -24.148 1.00 0.00 H new ATOM 0 HG22 ILE B 26 36.396 -4.113 -23.209 1.00 0.00 H new ATOM 0 HG23 ILE B 26 37.307 -2.835 -22.370 1.00 0.00 H new ATOM 0 HD11 ILE B 26 40.903 -1.962 -22.389 1.00 0.00 H new ATOM 0 HD12 ILE B 26 39.144 -1.881 -22.128 1.00 0.00 H new ATOM 0 HD13 ILE B 26 40.105 -3.148 -21.329 1.00 0.00 H new ATOM 1390 N LEU B 27 36.490 -5.676 -20.966 1.00 0.00 N ATOM 1391 CA LEU B 27 35.229 -6.377 -20.749 1.00 0.00 C ATOM 1392 C LEU B 27 34.048 -5.418 -20.852 1.00 0.00 C ATOM 1393 O LEU B 27 34.209 -4.202 -20.746 1.00 0.00 O ATOM 1394 CB LEU B 27 35.230 -7.057 -19.378 1.00 0.00 C ATOM 1395 CG LEU B 27 35.726 -8.503 -19.346 1.00 0.00 C ATOM 1396 CD1 LEU B 27 34.588 -9.464 -19.650 1.00 0.00 C ATOM 1397 CD2 LEU B 27 36.868 -8.697 -20.333 1.00 0.00 C ATOM 0 H LEU B 27 36.655 -4.897 -20.328 1.00 0.00 H new ATOM 0 HA LEU B 27 35.126 -7.136 -21.525 1.00 0.00 H new ATOM 0 HB2 LEU B 27 35.849 -6.467 -18.702 1.00 0.00 H new ATOM 0 HB3 LEU B 27 34.215 -7.033 -18.982 1.00 0.00 H new ATOM 0 HG LEU B 27 36.098 -8.717 -18.344 1.00 0.00 H new ATOM 0 HD11 LEU B 27 34.960 -10.488 -19.623 1.00 0.00 H new ATOM 0 HD12 LEU B 27 33.801 -9.344 -18.905 1.00 0.00 H new ATOM 0 HD13 LEU B 27 34.186 -9.250 -20.640 1.00 0.00 H new ATOM 0 HD21 LEU B 27 37.208 -9.732 -20.297 1.00 0.00 H new ATOM 0 HD22 LEU B 27 36.522 -8.464 -21.340 1.00 0.00 H new ATOM 0 HD23 LEU B 27 37.693 -8.034 -20.070 1.00 0.00 H new ATOM 1409 N THR B 28 32.857 -5.973 -21.058 1.00 0.00 N ATOM 1410 CA THR B 28 31.648 -5.168 -21.175 1.00 0.00 C ATOM 1411 C THR B 28 30.570 -5.652 -20.213 1.00 0.00 C ATOM 1412 O THR B 28 30.457 -6.849 -19.943 1.00 0.00 O ATOM 1413 CB THR B 28 31.090 -5.198 -22.610 1.00 0.00 C ATOM 1414 OG1 THR B 28 32.041 -5.802 -23.494 1.00 0.00 O ATOM 1415 CG2 THR B 28 30.764 -3.793 -23.093 1.00 0.00 C ATOM 0 H THR B 28 32.705 -6.978 -21.147 1.00 0.00 H new ATOM 0 HA THR B 28 31.924 -4.144 -20.922 1.00 0.00 H new ATOM 0 HB THR B 28 30.173 -5.787 -22.607 1.00 0.00 H new ATOM 0 HG1 THR B 28 32.113 -6.758 -23.293 1.00 0.00 H new ATOM 0 HG21 THR B 28 30.371 -3.839 -24.109 1.00 0.00 H new ATOM 0 HG22 THR B 28 30.018 -3.346 -22.436 1.00 0.00 H new ATOM 0 HG23 THR B 28 31.669 -3.185 -23.081 1.00 0.00 H new ATOM 1423 N ILE B 29 29.780 -4.717 -19.697 1.00 0.00 N ATOM 1424 CA ILE B 29 28.709 -5.050 -18.766 1.00 0.00 C ATOM 1425 C ILE B 29 27.370 -4.505 -19.250 1.00 0.00 C ATOM 1426 O ILE B 29 27.302 -3.417 -19.822 1.00 0.00 O ATOM 1427 CB ILE B 29 28.996 -4.497 -17.357 1.00 0.00 C ATOM 1428 CG1 ILE B 29 30.245 -5.159 -16.771 1.00 0.00 C ATOM 1429 CG2 ILE B 29 27.797 -4.716 -16.448 1.00 0.00 C ATOM 1430 CD1 ILE B 29 30.083 -6.643 -16.526 1.00 0.00 C ATOM 0 H ILE B 29 29.861 -3.722 -19.908 1.00 0.00 H new ATOM 0 HA ILE B 29 28.660 -6.138 -18.718 1.00 0.00 H new ATOM 0 HB ILE B 29 29.178 -3.425 -17.433 1.00 0.00 H new ATOM 0 HG12 ILE B 29 31.083 -5.000 -17.450 1.00 0.00 H new ATOM 0 HG13 ILE B 29 30.499 -4.669 -15.831 1.00 0.00 H new ATOM 0 HG21 ILE B 29 28.015 -4.320 -15.456 1.00 0.00 H new ATOM 0 HG22 ILE B 29 26.929 -4.202 -16.861 1.00 0.00 H new ATOM 0 HG23 ILE B 29 27.586 -5.783 -16.374 1.00 0.00 H new ATOM 0 HD11 ILE B 29 31.007 -7.046 -16.110 1.00 0.00 H new ATOM 0 HD12 ILE B 29 29.266 -6.809 -15.824 1.00 0.00 H new ATOM 0 HD13 ILE B 29 29.859 -7.145 -17.467 1.00 0.00 H new ATOM 1442 N GLN B 30 26.307 -5.268 -19.016 1.00 0.00 N ATOM 1443 CA GLN B 30 24.969 -4.860 -19.427 1.00 0.00 C ATOM 1444 C GLN B 30 24.016 -4.839 -18.237 1.00 0.00 C ATOM 1445 O GLN B 30 23.558 -5.885 -17.779 1.00 0.00 O ATOM 1446 CB GLN B 30 24.435 -5.804 -20.506 1.00 0.00 C ATOM 1447 CG GLN B 30 24.593 -5.264 -21.919 1.00 0.00 C ATOM 1448 CD GLN B 30 23.262 -5.034 -22.608 1.00 0.00 C ATOM 1449 OE1 GLN B 30 22.308 -5.786 -22.407 1.00 0.00 O ATOM 1450 NE2 GLN B 30 23.192 -3.991 -23.427 1.00 0.00 N ATOM 0 H GLN B 30 26.346 -6.171 -18.544 1.00 0.00 H new ATOM 0 HA GLN B 30 25.033 -3.851 -19.835 1.00 0.00 H new ATOM 0 HB2 GLN B 30 24.954 -6.759 -20.431 1.00 0.00 H new ATOM 0 HB3 GLN B 30 23.380 -5.999 -20.316 1.00 0.00 H new ATOM 0 HG2 GLN B 30 25.147 -4.326 -21.886 1.00 0.00 H new ATOM 0 HG3 GLN B 30 25.186 -5.964 -22.507 1.00 0.00 H new ATOM 0 HE21 GLN B 30 24.008 -3.394 -23.564 1.00 0.00 H new ATOM 0 HE22 GLN B 30 22.322 -3.787 -23.919 1.00 0.00 H new ATOM 1459 N GLN B 31 23.722 -3.641 -17.741 1.00 0.00 N ATOM 1460 CA GLN B 31 22.824 -3.485 -16.603 1.00 0.00 C ATOM 1461 C GLN B 31 21.367 -3.587 -17.041 1.00 0.00 C ATOM 1462 O GLN B 31 20.839 -2.684 -17.691 1.00 0.00 O ATOM 1463 CB GLN B 31 23.069 -2.142 -15.914 1.00 0.00 C ATOM 1464 CG GLN B 31 23.606 -2.273 -14.498 1.00 0.00 C ATOM 1465 CD GLN B 31 23.704 -0.939 -13.785 1.00 0.00 C ATOM 1466 OE1 GLN B 31 22.743 -0.171 -13.746 1.00 0.00 O ATOM 1467 NE2 GLN B 31 24.870 -0.656 -13.214 1.00 0.00 N ATOM 0 H GLN B 31 24.093 -2.765 -18.109 1.00 0.00 H new ATOM 0 HA GLN B 31 23.029 -4.290 -15.897 1.00 0.00 H new ATOM 0 HB2 GLN B 31 23.774 -1.561 -16.509 1.00 0.00 H new ATOM 0 HB3 GLN B 31 22.135 -1.580 -15.889 1.00 0.00 H new ATOM 0 HG2 GLN B 31 22.958 -2.939 -13.928 1.00 0.00 H new ATOM 0 HG3 GLN B 31 24.592 -2.737 -14.529 1.00 0.00 H new ATOM 0 HE21 GLN B 31 25.641 -1.322 -13.271 1.00 0.00 H new ATOM 0 HE22 GLN B 31 24.994 0.227 -12.719 1.00 0.00 H new ATOM 1476 N HIS B 32 20.722 -4.693 -16.682 1.00 0.00 N ATOM 1477 CA HIS B 32 19.325 -4.912 -17.039 1.00 0.00 C ATOM 1478 C HIS B 32 18.445 -3.783 -16.510 1.00 0.00 C ATOM 1479 O HIS B 32 18.925 -2.877 -15.831 1.00 0.00 O ATOM 1480 CB HIS B 32 18.841 -6.253 -16.486 1.00 0.00 C ATOM 1481 CG HIS B 32 19.597 -7.430 -17.021 1.00 0.00 C ATOM 1482 ND1 HIS B 32 19.206 -8.735 -16.811 1.00 0.00 N ATOM 1483 CD2 HIS B 32 20.727 -7.493 -17.764 1.00 0.00 C ATOM 1484 CE1 HIS B 32 20.063 -9.550 -17.399 1.00 0.00 C ATOM 1485 NE2 HIS B 32 20.996 -8.821 -17.985 1.00 0.00 N ATOM 0 H HIS B 32 21.144 -5.450 -16.145 1.00 0.00 H new ATOM 0 HA HIS B 32 19.251 -4.927 -18.126 1.00 0.00 H new ATOM 0 HB2 HIS B 32 18.926 -6.240 -15.399 1.00 0.00 H new ATOM 0 HB3 HIS B 32 17.784 -6.373 -16.722 1.00 0.00 H new ATOM 0 HD2 HIS B 32 21.309 -6.654 -18.117 1.00 0.00 H new ATOM 0 HE1 HIS B 32 20.010 -10.629 -17.401 1.00 0.00 H new ATOM 0 HE2 HIS B 32 21.787 -9.185 -18.515 1.00 0.00 H new ATOM 1493 N ASN B 33 17.156 -3.846 -16.827 1.00 0.00 N ATOM 1494 CA ASN B 33 16.210 -2.828 -16.385 1.00 0.00 C ATOM 1495 C ASN B 33 14.780 -3.222 -16.743 1.00 0.00 C ATOM 1496 O ASN B 33 14.496 -3.594 -17.881 1.00 0.00 O ATOM 1497 CB ASN B 33 16.552 -1.477 -17.015 1.00 0.00 C ATOM 1498 CG ASN B 33 17.326 -0.578 -16.070 1.00 0.00 C ATOM 1499 OD1 ASN B 33 18.506 -0.300 -16.287 1.00 0.00 O ATOM 1500 ND2 ASN B 33 16.664 -0.118 -15.015 1.00 0.00 N ATOM 0 H ASN B 33 16.743 -4.591 -17.388 1.00 0.00 H new ATOM 0 HA ASN B 33 16.284 -2.745 -15.301 1.00 0.00 H new ATOM 0 HB2 ASN B 33 17.138 -1.639 -17.920 1.00 0.00 H new ATOM 0 HB3 ASN B 33 15.632 -0.976 -17.317 1.00 0.00 H new ATOM 0 HD21 ASN B 33 17.133 0.492 -14.345 1.00 0.00 H new ATOM 0 HD22 ASN B 33 15.687 -0.374 -14.875 1.00 0.00 H new ATOM 1507 N GLN B 34 13.886 -3.137 -15.764 1.00 0.00 N ATOM 1508 CA GLN B 34 12.486 -3.485 -15.977 1.00 0.00 C ATOM 1509 C GLN B 34 11.610 -2.925 -14.860 1.00 0.00 C ATOM 1510 O GLN B 34 12.098 -2.249 -13.955 1.00 0.00 O ATOM 1511 CB GLN B 34 12.322 -5.003 -16.057 1.00 0.00 C ATOM 1512 CG GLN B 34 12.117 -5.519 -17.473 1.00 0.00 C ATOM 1513 CD GLN B 34 11.249 -6.761 -17.521 1.00 0.00 C ATOM 1514 OE1 GLN B 34 11.752 -7.885 -17.503 1.00 0.00 O ATOM 1515 NE2 GLN B 34 9.938 -6.565 -17.585 1.00 0.00 N ATOM 0 H GLN B 34 14.105 -2.831 -14.816 1.00 0.00 H new ATOM 0 HA GLN B 34 12.167 -3.042 -16.921 1.00 0.00 H new ATOM 0 HB2 GLN B 34 13.205 -5.479 -15.630 1.00 0.00 H new ATOM 0 HB3 GLN B 34 11.472 -5.301 -15.444 1.00 0.00 H new ATOM 0 HG2 GLN B 34 11.659 -4.737 -18.078 1.00 0.00 H new ATOM 0 HG3 GLN B 34 13.087 -5.740 -17.919 1.00 0.00 H new ATOM 0 HE21 GLN B 34 9.564 -5.616 -17.598 1.00 0.00 H new ATOM 0 HE22 GLN B 34 9.304 -7.363 -17.622 1.00 0.00 H new ATOM 1524 N SER B 35 10.314 -3.212 -14.931 1.00 0.00 N ATOM 1525 CA SER B 35 9.370 -2.734 -13.929 1.00 0.00 C ATOM 1526 C SER B 35 8.082 -3.551 -13.962 1.00 0.00 C ATOM 1527 O SER B 35 7.209 -3.322 -14.800 1.00 0.00 O ATOM 1528 CB SER B 35 9.054 -1.255 -14.159 1.00 0.00 C ATOM 1529 OG SER B 35 10.227 -0.527 -14.478 1.00 0.00 O ATOM 0 H SER B 35 9.894 -3.773 -15.672 1.00 0.00 H new ATOM 0 HA SER B 35 9.830 -2.852 -12.948 1.00 0.00 H new ATOM 0 HB2 SER B 35 8.330 -1.156 -14.967 1.00 0.00 H new ATOM 0 HB3 SER B 35 8.593 -0.835 -13.265 1.00 0.00 H new ATOM 0 HG SER B 35 10.987 -0.898 -13.982 1.00 0.00 H new ATOM 1535 N ASP B 36 7.971 -4.506 -13.045 1.00 0.00 N ATOM 1536 CA ASP B 36 6.790 -5.358 -12.968 1.00 0.00 C ATOM 1537 C ASP B 36 5.706 -4.708 -12.113 1.00 0.00 C ATOM 1538 O ASP B 36 5.950 -4.320 -10.971 1.00 0.00 O ATOM 1539 CB ASP B 36 7.159 -6.726 -12.391 1.00 0.00 C ATOM 1540 CG ASP B 36 5.977 -7.419 -11.743 1.00 0.00 C ATOM 1541 OD1 ASP B 36 4.865 -7.352 -12.309 1.00 0.00 O ATOM 1542 OD2 ASP B 36 6.163 -8.029 -10.669 1.00 0.00 O ATOM 0 H ASP B 36 8.684 -4.709 -12.345 1.00 0.00 H new ATOM 0 HA ASP B 36 6.401 -5.490 -13.978 1.00 0.00 H new ATOM 0 HB2 ASP B 36 7.555 -7.357 -13.186 1.00 0.00 H new ATOM 0 HB3 ASP B 36 7.953 -6.604 -11.655 1.00 0.00 H new ATOM 1547 N VAL B 37 4.507 -4.591 -12.676 1.00 0.00 N ATOM 1548 CA VAL B 37 3.385 -3.988 -11.966 1.00 0.00 C ATOM 1549 C VAL B 37 2.462 -5.056 -11.390 1.00 0.00 C ATOM 1550 O VAL B 37 1.884 -5.854 -12.128 1.00 0.00 O ATOM 1551 CB VAL B 37 2.570 -3.063 -12.889 1.00 0.00 C ATOM 1552 CG1 VAL B 37 1.594 -2.225 -12.077 1.00 0.00 C ATOM 1553 CG2 VAL B 37 3.497 -2.174 -13.705 1.00 0.00 C ATOM 0 H VAL B 37 4.288 -4.906 -13.621 1.00 0.00 H new ATOM 0 HA VAL B 37 3.805 -3.398 -11.152 1.00 0.00 H new ATOM 0 HB VAL B 37 1.996 -3.681 -13.579 1.00 0.00 H new ATOM 0 HG11 VAL B 37 1.027 -1.577 -12.746 1.00 0.00 H new ATOM 0 HG12 VAL B 37 0.909 -2.882 -11.541 1.00 0.00 H new ATOM 0 HG13 VAL B 37 2.146 -1.614 -11.362 1.00 0.00 H new ATOM 0 HG21 VAL B 37 2.904 -1.527 -14.352 1.00 0.00 H new ATOM 0 HG22 VAL B 37 4.099 -1.562 -13.033 1.00 0.00 H new ATOM 0 HG23 VAL B 37 4.152 -2.795 -14.316 1.00 0.00 H new ATOM 1563 N TRP B 38 2.327 -5.063 -10.069 1.00 0.00 N ATOM 1564 CA TRP B 38 1.472 -6.033 -9.394 1.00 0.00 C ATOM 1565 C TRP B 38 0.489 -5.335 -8.460 1.00 0.00 C ATOM 1566 O TRP B 38 0.836 -4.358 -7.795 1.00 0.00 O ATOM 1567 CB TRP B 38 2.322 -7.031 -8.605 1.00 0.00 C ATOM 1568 CG TRP B 38 3.669 -6.494 -8.225 1.00 0.00 C ATOM 1569 CD1 TRP B 38 4.651 -6.069 -9.073 1.00 0.00 C ATOM 1570 CD2 TRP B 38 4.181 -6.327 -6.899 1.00 0.00 C ATOM 1571 NE1 TRP B 38 5.743 -5.648 -8.354 1.00 0.00 N ATOM 1572 CE2 TRP B 38 5.480 -5.795 -7.018 1.00 0.00 C ATOM 1573 CE3 TRP B 38 3.668 -6.572 -5.622 1.00 0.00 C ATOM 1574 CZ2 TRP B 38 6.271 -5.507 -5.909 1.00 0.00 C ATOM 1575 CZ3 TRP B 38 4.455 -6.286 -4.522 1.00 0.00 C ATOM 1576 CH2 TRP B 38 5.744 -5.757 -4.671 1.00 0.00 C ATOM 0 H TRP B 38 2.798 -4.409 -9.444 1.00 0.00 H new ATOM 0 HA TRP B 38 0.904 -6.570 -10.154 1.00 0.00 H new ATOM 0 HB2 TRP B 38 1.786 -7.319 -7.701 1.00 0.00 H new ATOM 0 HB3 TRP B 38 2.454 -7.935 -9.200 1.00 0.00 H new ATOM 0 HD1 TRP B 38 4.580 -6.064 -10.151 1.00 0.00 H new ATOM 0 HE1 TRP B 38 6.610 -5.285 -8.751 1.00 0.00 H new ATOM 0 HE3 TRP B 38 2.675 -6.977 -5.497 1.00 0.00 H new ATOM 0 HZ2 TRP B 38 7.265 -5.101 -6.022 1.00 0.00 H new ATOM 0 HZ3 TRP B 38 4.070 -6.474 -3.531 1.00 0.00 H new ATOM 0 HH2 TRP B 38 6.333 -5.542 -3.792 1.00 0.00 H new ATOM 1587 N LEU B 39 -0.738 -5.842 -8.415 1.00 0.00 N ATOM 1588 CA LEU B 39 -1.772 -5.266 -7.562 1.00 0.00 C ATOM 1589 C LEU B 39 -2.147 -6.226 -6.438 1.00 0.00 C ATOM 1590 O LEU B 39 -2.011 -7.442 -6.575 1.00 0.00 O ATOM 1591 CB LEU B 39 -3.012 -4.924 -8.390 1.00 0.00 C ATOM 1592 CG LEU B 39 -4.262 -4.539 -7.599 1.00 0.00 C ATOM 1593 CD1 LEU B 39 -4.044 -3.226 -6.862 1.00 0.00 C ATOM 1594 CD2 LEU B 39 -5.468 -4.440 -8.521 1.00 0.00 C ATOM 0 H LEU B 39 -1.041 -6.650 -8.959 1.00 0.00 H new ATOM 0 HA LEU B 39 -1.375 -4.353 -7.118 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -2.762 -4.101 -9.059 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -3.253 -5.782 -9.017 1.00 0.00 H new ATOM 0 HG LEU B 39 -4.456 -5.319 -6.862 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -4.944 -2.968 -6.304 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -3.207 -3.331 -6.171 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -3.824 -2.437 -7.581 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -6.348 -4.165 -7.940 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -5.283 -3.681 -9.281 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -5.638 -5.403 -9.003 1.00 0.00 H new ATOM 1606 N ALA B 40 -2.621 -5.672 -5.327 1.00 0.00 N ATOM 1607 CA ALA B 40 -3.019 -6.479 -4.180 1.00 0.00 C ATOM 1608 C ALA B 40 -4.537 -6.591 -4.088 1.00 0.00 C ATOM 1609 O ALA B 40 -5.067 -7.570 -3.562 1.00 0.00 O ATOM 1610 CB ALA B 40 -2.453 -5.889 -2.897 1.00 0.00 C ATOM 0 H ALA B 40 -2.739 -4.667 -5.197 1.00 0.00 H new ATOM 0 HA ALA B 40 -2.614 -7.482 -4.315 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -2.758 -6.502 -2.049 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -1.365 -5.867 -2.956 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -2.830 -4.875 -2.766 1.00 0.00 H new ATOM 1616 N ASP B 41 -5.232 -5.582 -4.602 1.00 0.00 N ATOM 1617 CA ASP B 41 -6.690 -5.567 -4.578 1.00 0.00 C ATOM 1618 C ASP B 41 -7.261 -6.227 -5.829 1.00 0.00 C ATOM 1619 O ASP B 41 -7.518 -5.561 -6.831 1.00 0.00 O ATOM 1620 CB ASP B 41 -7.205 -4.131 -4.464 1.00 0.00 C ATOM 1621 CG ASP B 41 -8.643 -4.068 -3.988 1.00 0.00 C ATOM 1622 OD1 ASP B 41 -9.480 -4.824 -4.524 1.00 0.00 O ATOM 1623 OD2 ASP B 41 -8.931 -3.262 -3.079 1.00 0.00 O ATOM 0 H ASP B 41 -4.809 -4.764 -5.040 1.00 0.00 H new ATOM 0 HA ASP B 41 -7.020 -6.133 -3.707 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -6.572 -3.575 -3.773 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -7.125 -3.641 -5.434 1.00 0.00 H new ATOM 1628 N GLU B 42 -7.455 -7.541 -5.762 1.00 0.00 N ATOM 1629 CA GLU B 42 -7.993 -8.291 -6.891 1.00 0.00 C ATOM 1630 C GLU B 42 -9.255 -7.626 -7.434 1.00 0.00 C ATOM 1631 O GLU B 42 -9.427 -7.494 -8.646 1.00 0.00 O ATOM 1632 CB GLU B 42 -8.302 -9.731 -6.474 1.00 0.00 C ATOM 1633 CG GLU B 42 -7.093 -10.484 -5.945 1.00 0.00 C ATOM 1634 CD GLU B 42 -7.469 -11.568 -4.954 1.00 0.00 C ATOM 1635 OE1 GLU B 42 -8.605 -12.079 -5.035 1.00 0.00 O ATOM 1636 OE2 GLU B 42 -6.626 -11.905 -4.096 1.00 0.00 O ATOM 0 H GLU B 42 -7.248 -8.107 -4.939 1.00 0.00 H new ATOM 0 HA GLU B 42 -7.240 -8.302 -7.679 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -9.077 -9.720 -5.707 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -8.709 -10.269 -7.330 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -6.554 -10.931 -6.780 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -6.412 -9.780 -5.467 1.00 0.00 H new ATOM 1643 N SER B 43 -10.133 -7.208 -6.529 1.00 0.00 N ATOM 1644 CA SER B 43 -11.381 -6.561 -6.916 1.00 0.00 C ATOM 1645 C SER B 43 -11.112 -5.357 -7.815 1.00 0.00 C ATOM 1646 O SER B 43 -11.898 -5.051 -8.711 1.00 0.00 O ATOM 1647 CB SER B 43 -12.159 -6.121 -5.675 1.00 0.00 C ATOM 1648 OG SER B 43 -11.977 -7.036 -4.608 1.00 0.00 O ATOM 0 H SER B 43 -10.003 -7.306 -5.522 1.00 0.00 H new ATOM 0 HA SER B 43 -11.978 -7.283 -7.473 1.00 0.00 H new ATOM 0 HB2 SER B 43 -11.829 -5.129 -5.368 1.00 0.00 H new ATOM 0 HB3 SER B 43 -13.219 -6.044 -5.915 1.00 0.00 H new ATOM 0 HG SER B 43 -12.483 -6.731 -3.826 1.00 0.00 H new ATOM 1654 N GLN B 44 -9.996 -4.679 -7.567 1.00 0.00 N ATOM 1655 CA GLN B 44 -9.623 -3.509 -8.353 1.00 0.00 C ATOM 1656 C GLN B 44 -8.814 -3.913 -9.581 1.00 0.00 C ATOM 1657 O GLN B 44 -8.620 -3.116 -10.498 1.00 0.00 O ATOM 1658 CB GLN B 44 -8.819 -2.529 -7.497 1.00 0.00 C ATOM 1659 CG GLN B 44 -9.461 -1.156 -7.379 1.00 0.00 C ATOM 1660 CD GLN B 44 -10.874 -1.217 -6.833 1.00 0.00 C ATOM 1661 OE1 GLN B 44 -11.165 -1.986 -5.917 1.00 0.00 O ATOM 1662 NE2 GLN B 44 -11.761 -0.404 -7.395 1.00 0.00 N ATOM 0 H GLN B 44 -9.335 -4.920 -6.829 1.00 0.00 H new ATOM 0 HA GLN B 44 -10.538 -3.021 -8.689 1.00 0.00 H new ATOM 0 HB2 GLN B 44 -8.694 -2.949 -6.499 1.00 0.00 H new ATOM 0 HB3 GLN B 44 -7.822 -2.419 -7.924 1.00 0.00 H new ATOM 0 HG2 GLN B 44 -8.851 -0.529 -6.729 1.00 0.00 H new ATOM 0 HG3 GLN B 44 -9.475 -0.680 -8.360 1.00 0.00 H new ATOM 0 HE21 GLN B 44 -11.476 0.217 -8.152 1.00 0.00 H new ATOM 0 HE22 GLN B 44 -12.728 -0.401 -7.070 1.00 0.00 H new ATOM 1671 N ALA B 45 -8.343 -5.156 -9.590 1.00 0.00 N ATOM 1672 CA ALA B 45 -7.556 -5.665 -10.706 1.00 0.00 C ATOM 1673 C ALA B 45 -8.264 -5.422 -12.034 1.00 0.00 C ATOM 1674 O ALA B 45 -7.627 -5.107 -13.039 1.00 0.00 O ATOM 1675 CB ALA B 45 -7.275 -7.149 -10.520 1.00 0.00 C ATOM 0 H ALA B 45 -8.493 -5.828 -8.838 1.00 0.00 H new ATOM 0 HA ALA B 45 -6.609 -5.126 -10.725 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -6.686 -7.516 -11.361 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -6.720 -7.301 -9.594 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -8.217 -7.694 -10.471 1.00 0.00 H new ATOM 1681 N GLU B 46 -9.585 -5.571 -12.031 1.00 0.00 N ATOM 1682 CA GLU B 46 -10.379 -5.368 -13.238 1.00 0.00 C ATOM 1683 C GLU B 46 -10.325 -3.910 -13.686 1.00 0.00 C ATOM 1684 O GLU B 46 -10.100 -3.619 -14.860 1.00 0.00 O ATOM 1685 CB GLU B 46 -11.831 -5.785 -12.996 1.00 0.00 C ATOM 1686 CG GLU B 46 -11.970 -7.138 -12.317 1.00 0.00 C ATOM 1687 CD GLU B 46 -13.399 -7.645 -12.316 1.00 0.00 C ATOM 1688 OE1 GLU B 46 -14.159 -7.276 -11.397 1.00 0.00 O ATOM 1689 OE2 GLU B 46 -13.758 -8.412 -13.234 1.00 0.00 O ATOM 0 H GLU B 46 -10.128 -5.831 -11.207 1.00 0.00 H new ATOM 0 HA GLU B 46 -9.957 -5.989 -14.028 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -12.320 -5.028 -12.383 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -12.357 -5.811 -13.950 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -11.332 -7.862 -12.824 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -11.614 -7.063 -11.289 1.00 0.00 H new ATOM 1696 N ARG B 47 -10.534 -2.999 -12.741 1.00 0.00 N ATOM 1697 CA ARG B 47 -10.512 -1.572 -13.038 1.00 0.00 C ATOM 1698 C ARG B 47 -9.164 -1.159 -13.622 1.00 0.00 C ATOM 1699 O ARG B 47 -9.097 -0.576 -14.704 1.00 0.00 O ATOM 1700 CB ARG B 47 -10.800 -0.761 -11.773 1.00 0.00 C ATOM 1701 CG ARG B 47 -10.780 0.742 -11.995 1.00 0.00 C ATOM 1702 CD ARG B 47 -9.419 1.335 -11.668 1.00 0.00 C ATOM 1703 NE ARG B 47 -9.358 2.764 -11.965 1.00 0.00 N ATOM 1704 CZ ARG B 47 -9.961 3.693 -11.231 1.00 0.00 C ATOM 1705 NH1 ARG B 47 -10.665 3.345 -10.162 1.00 0.00 N ATOM 1706 NH2 ARG B 47 -9.860 4.973 -11.565 1.00 0.00 N ATOM 0 H ARG B 47 -10.720 -3.224 -11.764 1.00 0.00 H new ATOM 0 HA ARG B 47 -11.287 -1.369 -13.777 1.00 0.00 H new ATOM 0 HB2 ARG B 47 -11.776 -1.049 -11.381 1.00 0.00 H new ATOM 0 HB3 ARG B 47 -10.063 -1.017 -11.012 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -11.034 0.961 -13.032 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -11.542 1.213 -11.374 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -9.198 1.174 -10.613 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -8.650 0.813 -12.238 1.00 0.00 H new ATOM 0 HE ARG B 47 -8.824 3.065 -12.780 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -10.745 2.362 -9.902 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -11.127 4.060 -9.600 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -9.319 5.245 -12.386 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -10.323 5.685 -11.001 1.00 0.00 H new ATOM 1720 N VAL B 48 -8.092 -1.466 -12.899 1.00 0.00 N ATOM 1721 CA VAL B 48 -6.746 -1.128 -13.345 1.00 0.00 C ATOM 1722 C VAL B 48 -6.451 -1.737 -14.711 1.00 0.00 C ATOM 1723 O VAL B 48 -5.809 -1.112 -15.555 1.00 0.00 O ATOM 1724 CB VAL B 48 -5.683 -1.610 -12.340 1.00 0.00 C ATOM 1725 CG1 VAL B 48 -5.818 -0.864 -11.021 1.00 0.00 C ATOM 1726 CG2 VAL B 48 -5.796 -3.112 -12.126 1.00 0.00 C ATOM 0 H VAL B 48 -8.130 -1.949 -12.001 1.00 0.00 H new ATOM 0 HA VAL B 48 -6.700 -0.041 -13.417 1.00 0.00 H new ATOM 0 HB VAL B 48 -4.696 -1.397 -12.751 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -5.059 -1.218 -10.323 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -5.684 0.204 -11.192 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -6.808 -1.043 -10.601 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -5.038 -3.436 -11.413 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -6.786 -3.351 -11.737 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -5.646 -3.627 -13.075 1.00 0.00 H new ATOM 1736 N ARG B 49 -6.924 -2.961 -14.922 1.00 0.00 N ATOM 1737 CA ARG B 49 -6.710 -3.656 -16.186 1.00 0.00 C ATOM 1738 C ARG B 49 -7.278 -2.850 -17.351 1.00 0.00 C ATOM 1739 O ARG B 49 -6.593 -2.613 -18.346 1.00 0.00 O ATOM 1740 CB ARG B 49 -7.358 -5.041 -16.146 1.00 0.00 C ATOM 1741 CG ARG B 49 -6.403 -6.147 -15.726 1.00 0.00 C ATOM 1742 CD ARG B 49 -7.122 -7.235 -14.943 1.00 0.00 C ATOM 1743 NE ARG B 49 -7.065 -8.527 -15.622 1.00 0.00 N ATOM 1744 CZ ARG B 49 -7.522 -9.656 -15.093 1.00 0.00 C ATOM 1745 NH1 ARG B 49 -8.067 -9.652 -13.884 1.00 0.00 N ATOM 1746 NH2 ARG B 49 -7.435 -10.792 -15.773 1.00 0.00 N ATOM 0 H ARG B 49 -7.458 -3.492 -14.234 1.00 0.00 H new ATOM 0 HA ARG B 49 -5.636 -3.769 -16.334 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -8.201 -5.019 -15.456 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -7.759 -5.274 -17.132 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -5.936 -6.581 -16.610 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -5.603 -5.727 -15.117 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -6.674 -7.326 -13.953 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -8.163 -6.948 -14.797 1.00 0.00 H new ATOM 0 HE ARG B 49 -6.651 -8.564 -16.554 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -8.136 -8.781 -13.358 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -8.417 -10.520 -13.480 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -7.017 -10.799 -16.703 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -7.786 -11.659 -15.365 1.00 0.00 H new ATOM 1760 N ALA B 50 -8.533 -2.433 -17.220 1.00 0.00 N ATOM 1761 CA ALA B 50 -9.191 -1.654 -18.261 1.00 0.00 C ATOM 1762 C ALA B 50 -8.476 -0.327 -18.489 1.00 0.00 C ATOM 1763 O ALA B 50 -8.025 -0.036 -19.596 1.00 0.00 O ATOM 1764 CB ALA B 50 -10.649 -1.415 -17.899 1.00 0.00 C ATOM 0 H ALA B 50 -9.114 -2.622 -16.403 1.00 0.00 H new ATOM 0 HA ALA B 50 -9.147 -2.224 -19.189 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.128 -0.832 -18.685 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -11.160 -2.372 -17.795 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -10.705 -0.869 -16.957 1.00 0.00 H new ATOM 1770 N GLU B 51 -8.376 0.475 -17.433 1.00 0.00 N ATOM 1771 CA GLU B 51 -7.716 1.773 -17.520 1.00 0.00 C ATOM 1772 C GLU B 51 -6.312 1.631 -18.100 1.00 0.00 C ATOM 1773 O GLU B 51 -5.951 2.319 -19.057 1.00 0.00 O ATOM 1774 CB GLU B 51 -7.646 2.427 -16.139 1.00 0.00 C ATOM 1775 CG GLU B 51 -9.003 2.610 -15.481 1.00 0.00 C ATOM 1776 CD GLU B 51 -10.090 2.966 -16.477 1.00 0.00 C ATOM 1777 OE1 GLU B 51 -9.904 3.942 -17.234 1.00 0.00 O ATOM 1778 OE2 GLU B 51 -11.127 2.270 -16.499 1.00 0.00 O ATOM 0 H GLU B 51 -8.743 0.249 -16.509 1.00 0.00 H new ATOM 0 HA GLU B 51 -8.302 2.407 -18.185 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -7.016 1.818 -15.490 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.163 3.400 -16.231 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -9.278 1.692 -14.961 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -8.935 3.395 -14.727 1.00 0.00 H new ATOM 1785 N LEU B 52 -5.524 0.736 -17.515 1.00 0.00 N ATOM 1786 CA LEU B 52 -4.158 0.504 -17.973 1.00 0.00 C ATOM 1787 C LEU B 52 -4.122 0.265 -19.479 1.00 0.00 C ATOM 1788 O LEU B 52 -3.377 0.924 -20.204 1.00 0.00 O ATOM 1789 CB LEU B 52 -3.551 -0.693 -17.240 1.00 0.00 C ATOM 1790 CG LEU B 52 -2.155 -1.121 -17.695 1.00 0.00 C ATOM 1791 CD1 LEU B 52 -1.166 -1.028 -16.544 1.00 0.00 C ATOM 1792 CD2 LEU B 52 -2.188 -2.534 -18.260 1.00 0.00 C ATOM 0 H LEU B 52 -5.807 0.159 -16.723 1.00 0.00 H new ATOM 0 HA LEU B 52 -3.570 1.395 -17.751 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -3.509 -0.459 -16.176 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -4.225 -1.543 -17.353 1.00 0.00 H new ATOM 0 HG LEU B 52 -1.827 -0.443 -18.483 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -0.178 -1.336 -16.887 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -1.121 0.000 -16.185 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -1.489 -1.681 -15.733 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -1.186 -2.822 -18.579 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -2.537 -3.225 -17.492 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -2.864 -2.569 -19.114 1.00 0.00 H new ATOM 1804 N ALA B 53 -4.933 -0.680 -19.942 1.00 0.00 N ATOM 1805 CA ALA B 53 -4.997 -1.003 -21.362 1.00 0.00 C ATOM 1806 C ALA B 53 -5.329 0.232 -22.192 1.00 0.00 C ATOM 1807 O ALA B 53 -4.801 0.415 -23.289 1.00 0.00 O ATOM 1808 CB ALA B 53 -6.024 -2.099 -21.609 1.00 0.00 C ATOM 0 H ALA B 53 -5.555 -1.235 -19.355 1.00 0.00 H new ATOM 0 HA ALA B 53 -4.016 -1.363 -21.671 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -6.061 -2.330 -22.674 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -5.742 -2.993 -21.053 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -7.005 -1.760 -21.277 1.00 0.00 H new ATOM 1814 N ARG B 54 -6.207 1.077 -21.661 1.00 0.00 N ATOM 1815 CA ARG B 54 -6.611 2.295 -22.354 1.00 0.00 C ATOM 1816 C ARG B 54 -5.500 3.339 -22.310 1.00 0.00 C ATOM 1817 O ARG B 54 -5.441 4.234 -23.154 1.00 0.00 O ATOM 1818 CB ARG B 54 -7.886 2.864 -21.729 1.00 0.00 C ATOM 1819 CG ARG B 54 -9.146 2.110 -22.121 1.00 0.00 C ATOM 1820 CD ARG B 54 -10.313 2.464 -21.213 1.00 0.00 C ATOM 1821 NE ARG B 54 -11.598 2.107 -21.808 1.00 0.00 N ATOM 1822 CZ ARG B 54 -12.759 2.613 -21.408 1.00 0.00 C ATOM 1823 NH1 ARG B 54 -12.796 3.493 -20.416 1.00 0.00 N ATOM 1824 NH2 ARG B 54 -13.886 2.239 -22.000 1.00 0.00 N ATOM 0 H ARG B 54 -6.652 0.941 -20.753 1.00 0.00 H new ATOM 0 HA ARG B 54 -6.807 2.042 -23.396 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -7.787 2.849 -20.644 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -7.991 3.908 -22.025 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.404 2.343 -23.154 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.959 1.037 -22.073 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.200 1.948 -20.259 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.296 3.533 -21.001 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.604 1.432 -22.573 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -11.932 3.783 -19.959 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -13.689 3.880 -20.111 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -13.861 1.562 -22.763 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -14.777 2.628 -21.692 1.00 0.00 H new ATOM 1838 N PHE B 55 -4.621 3.220 -21.320 1.00 0.00 N ATOM 1839 CA PHE B 55 -3.513 4.154 -21.165 1.00 0.00 C ATOM 1840 C PHE B 55 -2.319 3.728 -22.015 1.00 0.00 C ATOM 1841 O PHE B 55 -1.603 4.566 -22.565 1.00 0.00 O ATOM 1842 CB PHE B 55 -3.099 4.248 -19.695 1.00 0.00 C ATOM 1843 CG PHE B 55 -2.372 5.518 -19.356 1.00 0.00 C ATOM 1844 CD1 PHE B 55 -2.937 6.751 -19.638 1.00 0.00 C ATOM 1845 CD2 PHE B 55 -1.124 5.479 -18.757 1.00 0.00 C ATOM 1846 CE1 PHE B 55 -2.271 7.922 -19.328 1.00 0.00 C ATOM 1847 CE2 PHE B 55 -0.453 6.646 -18.443 1.00 0.00 C ATOM 1848 CZ PHE B 55 -1.027 7.869 -18.731 1.00 0.00 C ATOM 0 H PHE B 55 -4.655 2.485 -20.613 1.00 0.00 H new ATOM 0 HA PHE B 55 -3.847 5.134 -21.505 1.00 0.00 H new ATOM 0 HB2 PHE B 55 -3.988 4.170 -19.070 1.00 0.00 H new ATOM 0 HB3 PHE B 55 -2.462 3.398 -19.450 1.00 0.00 H new ATOM 0 HD1 PHE B 55 -3.909 6.798 -20.106 1.00 0.00 H new ATOM 0 HD2 PHE B 55 -0.670 4.525 -18.532 1.00 0.00 H new ATOM 0 HE1 PHE B 55 -2.723 8.877 -19.552 1.00 0.00 H new ATOM 0 HE2 PHE B 55 0.518 6.602 -17.973 1.00 0.00 H new ATOM 0 HZ PHE B 55 -0.504 8.782 -18.490 1.00 0.00 H new ATOM 1858 N LEU B 56 -2.110 2.420 -22.117 1.00 0.00 N ATOM 1859 CA LEU B 56 -1.003 1.881 -22.899 1.00 0.00 C ATOM 1860 C LEU B 56 -1.069 2.367 -24.344 1.00 0.00 C ATOM 1861 O LEU B 56 -0.044 2.657 -24.958 1.00 0.00 O ATOM 1862 CB LEU B 56 -1.023 0.352 -22.862 1.00 0.00 C ATOM 1863 CG LEU B 56 -0.165 -0.304 -21.780 1.00 0.00 C ATOM 1864 CD1 LEU B 56 -0.347 -1.814 -21.796 1.00 0.00 C ATOM 1865 CD2 LEU B 56 1.301 0.060 -21.967 1.00 0.00 C ATOM 0 H LEU B 56 -2.693 1.713 -21.668 1.00 0.00 H new ATOM 0 HA LEU B 56 -0.072 2.237 -22.458 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -2.054 0.025 -22.728 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -0.695 -0.019 -23.833 1.00 0.00 H new ATOM 0 HG LEU B 56 -0.491 0.070 -20.810 1.00 0.00 H new ATOM 0 HD11 LEU B 56 0.272 -2.263 -21.019 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -1.394 -2.056 -21.612 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -0.049 -2.206 -22.769 1.00 0.00 H new ATOM 0 HD21 LEU B 56 1.896 -0.416 -21.188 1.00 0.00 H new ATOM 0 HD22 LEU B 56 1.640 -0.285 -22.944 1.00 0.00 H new ATOM 0 HD23 LEU B 56 1.418 1.142 -21.903 1.00 0.00 H new ATOM 1877 N GLU B 57 -2.283 2.454 -24.878 1.00 0.00 N ATOM 1878 CA GLU B 57 -2.483 2.906 -26.250 1.00 0.00 C ATOM 1879 C GLU B 57 -2.381 4.426 -26.342 1.00 0.00 C ATOM 1880 O GLU B 57 -2.477 5.000 -27.426 1.00 0.00 O ATOM 1881 CB GLU B 57 -3.845 2.443 -26.771 1.00 0.00 C ATOM 1882 CG GLU B 57 -5.012 3.243 -26.218 1.00 0.00 C ATOM 1883 CD GLU B 57 -6.355 2.713 -26.684 1.00 0.00 C ATOM 1884 OE1 GLU B 57 -6.390 1.597 -27.241 1.00 0.00 O ATOM 1885 OE2 GLU B 57 -7.369 3.415 -26.491 1.00 0.00 O ATOM 0 H GLU B 57 -3.142 2.218 -24.382 1.00 0.00 H new ATOM 0 HA GLU B 57 -1.699 2.468 -26.867 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -3.851 2.512 -27.859 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -3.983 1.392 -26.518 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -4.976 3.225 -25.129 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -4.911 4.285 -26.523 1.00 0.00 H new ATOM 1892 N ASN B 58 -2.188 5.071 -25.196 1.00 0.00 N ATOM 1893 CA ASN B 58 -2.074 6.524 -25.146 1.00 0.00 C ATOM 1894 C ASN B 58 -0.669 6.946 -24.729 1.00 0.00 C ATOM 1895 O ASN B 58 -0.437 7.402 -23.609 1.00 0.00 O ATOM 1896 CB ASN B 58 -3.103 7.104 -24.173 1.00 0.00 C ATOM 1897 CG ASN B 58 -4.487 7.201 -24.785 1.00 0.00 C ATOM 1898 OD1 ASN B 58 -5.218 6.213 -24.855 1.00 0.00 O ATOM 1899 ND2 ASN B 58 -4.853 8.397 -25.233 1.00 0.00 N ATOM 0 H ASN B 58 -2.107 4.610 -24.290 1.00 0.00 H new ATOM 0 HA ASN B 58 -2.269 6.913 -26.145 1.00 0.00 H new ATOM 0 HB2 ASN B 58 -3.146 6.480 -23.280 1.00 0.00 H new ATOM 0 HB3 ASN B 58 -2.779 8.095 -23.854 1.00 0.00 H new ATOM 0 HD21 ASN B 58 -5.773 8.524 -25.656 1.00 0.00 H new ATOM 0 HD22 ASN B 58 -4.214 9.188 -25.154 1.00 0.00 H new ATOM 1906 N PRO B 59 0.293 6.793 -25.651 1.00 0.00 N ATOM 1907 CA PRO B 59 1.692 7.153 -25.403 1.00 0.00 C ATOM 1908 C PRO B 59 1.893 8.661 -25.303 1.00 0.00 C ATOM 1909 O PRO B 59 2.099 9.338 -26.310 1.00 0.00 O ATOM 1910 CB PRO B 59 2.424 6.596 -26.627 1.00 0.00 C ATOM 1911 CG PRO B 59 1.391 6.552 -27.699 1.00 0.00 C ATOM 1912 CD PRO B 59 0.089 6.256 -27.007 1.00 0.00 C ATOM 0 HA PRO B 59 2.054 6.754 -24.455 1.00 0.00 H new ATOM 0 HB2 PRO B 59 3.262 7.233 -26.911 1.00 0.00 H new ATOM 0 HB3 PRO B 59 2.830 5.604 -26.428 1.00 0.00 H new ATOM 0 HG2 PRO B 59 1.342 7.501 -28.233 1.00 0.00 H new ATOM 0 HG3 PRO B 59 1.625 5.783 -28.435 1.00 0.00 H new ATOM 0 HD2 PRO B 59 -0.751 6.738 -27.508 1.00 0.00 H new ATOM 0 HD3 PRO B 59 -0.122 5.187 -26.988 1.00 0.00 H new ATOM 1920 N ALA B 60 1.833 9.181 -24.081 1.00 0.00 N ATOM 1921 CA ALA B 60 2.011 10.609 -23.850 1.00 0.00 C ATOM 1922 C ALA B 60 2.579 10.874 -22.459 1.00 0.00 C ATOM 1923 O ALA B 60 3.673 11.421 -22.319 1.00 0.00 O ATOM 1924 CB ALA B 60 0.690 11.342 -24.030 1.00 0.00 C ATOM 0 H ALA B 60 1.663 8.635 -23.237 1.00 0.00 H new ATOM 0 HA ALA B 60 2.725 10.984 -24.583 1.00 0.00 H new ATOM 0 HB1 ALA B 60 0.838 12.407 -23.854 1.00 0.00 H new ATOM 0 HB2 ALA B 60 0.324 11.189 -25.045 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -0.040 10.955 -23.319 1.00 0.00 H new ATOM 1930 N ASP B 61 1.829 10.482 -21.435 1.00 0.00 N ATOM 1931 CA ASP B 61 2.259 10.676 -20.055 1.00 0.00 C ATOM 1932 C ASP B 61 3.176 9.543 -19.607 1.00 0.00 C ATOM 1933 O ASP B 61 4.311 9.776 -19.189 1.00 0.00 O ATOM 1934 CB ASP B 61 1.045 10.764 -19.129 1.00 0.00 C ATOM 1935 CG ASP B 61 0.959 12.097 -18.412 1.00 0.00 C ATOM 1936 OD1 ASP B 61 0.615 13.101 -19.068 1.00 0.00 O ATOM 1937 OD2 ASP B 61 1.236 12.135 -17.194 1.00 0.00 O ATOM 0 H ASP B 61 0.921 10.028 -21.534 1.00 0.00 H new ATOM 0 HA ASP B 61 2.816 11.611 -20.001 1.00 0.00 H new ATOM 0 HB2 ASP B 61 0.136 10.608 -19.710 1.00 0.00 H new ATOM 0 HB3 ASP B 61 1.094 9.961 -18.393 1.00 0.00 H new ATOM 1942 N LEU B 62 2.677 8.315 -19.695 1.00 0.00 N ATOM 1943 CA LEU B 62 3.451 7.144 -19.297 1.00 0.00 C ATOM 1944 C LEU B 62 4.846 7.179 -19.912 1.00 0.00 C ATOM 1945 O LEU B 62 5.824 6.782 -19.279 1.00 0.00 O ATOM 1946 CB LEU B 62 2.728 5.863 -19.718 1.00 0.00 C ATOM 1947 CG LEU B 62 2.138 5.858 -21.128 1.00 0.00 C ATOM 1948 CD1 LEU B 62 3.175 5.394 -22.139 1.00 0.00 C ATOM 1949 CD2 LEU B 62 0.901 4.973 -21.186 1.00 0.00 C ATOM 0 H LEU B 62 1.740 8.104 -20.038 1.00 0.00 H new ATOM 0 HA LEU B 62 3.552 7.157 -18.212 1.00 0.00 H new ATOM 0 HB2 LEU B 62 3.427 5.031 -19.635 1.00 0.00 H new ATOM 0 HB3 LEU B 62 1.923 5.674 -19.008 1.00 0.00 H new ATOM 0 HG LEU B 62 1.844 6.877 -21.381 1.00 0.00 H new ATOM 0 HD11 LEU B 62 2.737 5.397 -23.137 1.00 0.00 H new ATOM 0 HD12 LEU B 62 4.032 6.068 -22.117 1.00 0.00 H new ATOM 0 HD13 LEU B 62 3.501 4.384 -21.889 1.00 0.00 H new ATOM 0 HD21 LEU B 62 0.495 4.982 -22.197 1.00 0.00 H new ATOM 0 HD22 LEU B 62 1.170 3.953 -20.912 1.00 0.00 H new ATOM 0 HD23 LEU B 62 0.151 5.350 -20.490 1.00 0.00 H new ATOM 1961 N GLU B 63 4.930 7.659 -21.149 1.00 0.00 N ATOM 1962 CA GLU B 63 6.207 7.748 -21.848 1.00 0.00 C ATOM 1963 C GLU B 63 6.970 9.002 -21.432 1.00 0.00 C ATOM 1964 O GLU B 63 7.897 9.432 -22.117 1.00 0.00 O ATOM 1965 CB GLU B 63 5.985 7.751 -23.362 1.00 0.00 C ATOM 1966 CG GLU B 63 4.921 8.734 -23.819 1.00 0.00 C ATOM 1967 CD GLU B 63 5.399 9.632 -24.943 1.00 0.00 C ATOM 1968 OE1 GLU B 63 5.885 9.097 -25.963 1.00 0.00 O ATOM 1969 OE2 GLU B 63 5.289 10.868 -24.805 1.00 0.00 O ATOM 0 H GLU B 63 4.130 7.992 -21.687 1.00 0.00 H new ATOM 0 HA GLU B 63 6.802 6.876 -21.577 1.00 0.00 H new ATOM 0 HB2 GLU B 63 6.926 7.990 -23.858 1.00 0.00 H new ATOM 0 HB3 GLU B 63 5.702 6.748 -23.681 1.00 0.00 H new ATOM 0 HG2 GLU B 63 4.041 8.183 -24.149 1.00 0.00 H new ATOM 0 HG3 GLU B 63 4.613 9.349 -22.974 1.00 0.00 H new TER 1976 GLU B 63