USER MOD reduce.3.24.130724 H: found=0, std=0, add=831, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 829 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 19 TYR OH : rot 180:sc= -0.805 USER MOD Set 1.2: B 20 MET CE :methyl -116:sc= -0.78 (180deg=-2.67) USER MOD Set 2.1: A 19 TYR OH : rot 180:sc= -0.831 USER MOD Set 2.2: A 20 MET CE :methyl -118:sc= -0.857 (180deg=-2.9) USER MOD Single : A 1 MET CE :methyl 145:sc= -4.27 (180deg=-6.43!) USER MOD Single : A 1 MET N :NH3+ -157:sc=-0.00886 (180deg=-0.239) USER MOD Single : A 3 MET CE :methyl -118:sc= -3.1 (180deg=-7.57!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0308 USER MOD Single : A 6 SER OG : rot 180:sc=-0.00166 USER MOD Single : A 9 ASN : amide:sc= -0.679 K(o=-0.68,f=-2.9!) USER MOD Single : A 14 GLN : amide:sc= -0.476 X(o=-0.48,f=0) USER MOD Single : A 22 THR OG1 : rot -24:sc= 0.305 USER MOD Single : A 23 GLN : amide:sc= -0.091 X(o=-0.091,f=0) USER MOD Single : A 28 THR OG1 : rot 69:sc= 0.662 USER MOD Single : A 30 GLN : amide:sc= -0.118 X(o=-0.12,f=-0.56) USER MOD Single : A 31 GLN : amide:sc= -0.277 K(o=-0.28,f=-1.8!) USER MOD Single : A 35 SER OG : rot 16:sc= 0.778 USER MOD Single : A 43 SER OG : rot 180:sc= 0.0508 USER MOD Single : A 44 GLN : amide:sc= -0.622 K(o=-0.62,f=-1.2!) USER MOD Single : B 1 MET CE :methyl 148:sc= -4.41! (180deg=-6.72!) USER MOD Single : B 1 MET N :NH3+ -156:sc= -0.0119 (180deg=-0.195) USER MOD Single : B 3 MET CE :methyl -117:sc= -3.18 (180deg=-7.75!) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.137 USER MOD Single : B 6 SER OG : rot -18:sc= 0.41! USER MOD Single : B 9 ASN : amide:sc= -0.143 K(o=-0.14,f=-2.1!) USER MOD Single : B 14 GLN : amide:sc= -0.396 X(o=-0.4,f=0) USER MOD Single : B 22 THR OG1 : rot -23:sc= 0.306 USER MOD Single : B 23 GLN : amide:sc= -0.0883 X(o=-0.088,f=0) USER MOD Single : B 28 THR OG1 : rot 71:sc= 0.645 USER MOD Single : B 30 GLN : amide:sc= -0.145 K(o=-0.14,f=-0.66) USER MOD Single : B 31 GLN : amide:sc= -0.162 K(o=-0.16,f=-2!) USER MOD Single : B 35 SER OG : rot 26:sc= 0.412 USER MOD Single : B 43 SER OG : rot 180:sc= 0.072 USER MOD Single : B 44 GLN : amide:sc= -0.498 K(o=-0.5,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.305 -11.260 -4.357 1.00 0.00 N ATOM 2 CA MET A 1 -1.560 -10.400 -5.270 1.00 0.00 C ATOM 3 C MET A 1 -1.680 -10.899 -6.706 1.00 0.00 C ATOM 4 O MET A 1 -1.309 -12.032 -7.014 1.00 0.00 O ATOM 5 CB MET A 1 -0.087 -10.340 -4.859 1.00 0.00 C ATOM 6 CG MET A 1 0.135 -9.748 -3.477 1.00 0.00 C ATOM 7 SD MET A 1 1.178 -8.278 -3.510 1.00 0.00 S ATOM 8 CE MET A 1 0.276 -7.249 -4.666 1.00 0.00 C ATOM 0 H1 MET A 1 -2.542 -10.728 -3.495 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.180 -11.580 -4.818 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.724 -12.085 -4.106 1.00 0.00 H new ATOM 0 HA MET A 1 -1.986 -9.398 -5.216 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.330 -11.347 -4.885 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.462 -9.748 -5.591 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.829 -9.495 -3.035 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.593 -10.499 -2.834 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.361 -6.204 -4.366 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.692 -7.374 -5.666 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.774 -7.541 -4.670 1.00 0.00 H new ATOM 18 N LEU A 2 -2.199 -10.046 -7.582 1.00 0.00 N ATOM 19 CA LEU A 2 -2.368 -10.400 -8.987 1.00 0.00 C ATOM 20 C LEU A 2 -1.578 -9.454 -9.886 1.00 0.00 C ATOM 21 O LEU A 2 -1.800 -8.244 -9.878 1.00 0.00 O ATOM 22 CB LEU A 2 -3.849 -10.365 -9.368 1.00 0.00 C ATOM 23 CG LEU A 2 -4.340 -11.504 -10.262 1.00 0.00 C ATOM 24 CD1 LEU A 2 -5.812 -11.324 -10.597 1.00 0.00 C ATOM 25 CD2 LEU A 2 -3.507 -11.580 -11.534 1.00 0.00 C ATOM 0 H LEU A 2 -2.510 -9.104 -7.344 1.00 0.00 H new ATOM 0 HA LEU A 2 -1.986 -11.411 -9.129 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -4.439 -10.369 -8.452 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -4.051 -9.421 -9.873 1.00 0.00 H new ATOM 0 HG LEU A 2 -4.225 -12.442 -9.719 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -6.143 -12.144 -11.234 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -6.397 -11.320 -9.677 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -5.953 -10.378 -11.121 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -3.870 -12.396 -12.159 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -3.590 -10.640 -12.080 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -2.463 -11.758 -11.275 1.00 0.00 H new ATOM 37 N MET A 3 -0.655 -10.016 -10.661 1.00 0.00 N ATOM 38 CA MET A 3 0.166 -9.222 -11.568 1.00 0.00 C ATOM 39 C MET A 3 -0.705 -8.436 -12.542 1.00 0.00 C ATOM 40 O MET A 3 -1.463 -9.017 -13.320 1.00 0.00 O ATOM 41 CB MET A 3 1.128 -10.126 -12.341 1.00 0.00 C ATOM 42 CG MET A 3 2.468 -9.473 -12.641 1.00 0.00 C ATOM 43 SD MET A 3 3.148 -9.980 -14.232 1.00 0.00 S ATOM 44 CE MET A 3 4.158 -8.557 -14.637 1.00 0.00 C ATOM 0 H MET A 3 -0.457 -11.017 -10.679 1.00 0.00 H new ATOM 0 HA MET A 3 0.743 -8.515 -10.972 1.00 0.00 H new ATOM 0 HB2 MET A 3 1.298 -11.037 -11.767 1.00 0.00 H new ATOM 0 HB3 MET A 3 0.660 -10.423 -13.279 1.00 0.00 H new ATOM 0 HG2 MET A 3 2.350 -8.389 -12.629 1.00 0.00 H new ATOM 0 HG3 MET A 3 3.175 -9.725 -11.851 1.00 0.00 H new ATOM 0 HE1 MET A 3 3.790 -8.099 -15.555 1.00 0.00 H new ATOM 0 HE2 MET A 3 4.108 -7.832 -13.824 1.00 0.00 H new ATOM 0 HE3 MET A 3 5.192 -8.873 -14.778 1.00 0.00 H new ATOM 54 N ILE A 4 -0.592 -7.113 -12.495 1.00 0.00 N ATOM 55 CA ILE A 4 -1.369 -6.248 -13.374 1.00 0.00 C ATOM 56 C ILE A 4 -0.767 -6.204 -14.775 1.00 0.00 C ATOM 57 O ILE A 4 -1.475 -6.342 -15.772 1.00 0.00 O ATOM 58 CB ILE A 4 -1.455 -4.814 -12.820 1.00 0.00 C ATOM 59 CG1 ILE A 4 -2.238 -4.798 -11.506 1.00 0.00 C ATOM 60 CG2 ILE A 4 -2.103 -3.890 -13.840 1.00 0.00 C ATOM 61 CD1 ILE A 4 -3.598 -5.454 -11.604 1.00 0.00 C ATOM 0 H ILE A 4 0.030 -6.617 -11.857 1.00 0.00 H new ATOM 0 HA ILE A 4 -2.373 -6.670 -13.425 1.00 0.00 H new ATOM 0 HB ILE A 4 -0.445 -4.455 -12.624 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -1.654 -5.305 -10.738 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -2.364 -3.765 -11.180 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -2.157 -2.880 -13.434 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -1.508 -3.882 -14.754 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.109 -4.245 -14.065 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.096 -5.406 -10.636 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -4.200 -4.933 -12.348 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.479 -6.497 -11.899 1.00 0.00 H new ATOM 73 N THR A 5 0.547 -6.013 -14.842 1.00 0.00 N ATOM 74 CA THR A 5 1.246 -5.952 -16.120 1.00 0.00 C ATOM 75 C THR A 5 2.751 -5.824 -15.918 1.00 0.00 C ATOM 76 O THR A 5 3.238 -5.823 -14.787 1.00 0.00 O ATOM 77 CB THR A 5 0.752 -4.769 -16.975 1.00 0.00 C ATOM 78 OG1 THR A 5 1.227 -4.904 -18.319 1.00 0.00 O ATOM 79 CG2 THR A 5 1.227 -3.446 -16.394 1.00 0.00 C ATOM 0 H THR A 5 1.148 -5.898 -14.026 1.00 0.00 H new ATOM 0 HA THR A 5 1.030 -6.884 -16.643 1.00 0.00 H new ATOM 0 HB THR A 5 -0.338 -4.778 -16.973 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.907 -4.149 -18.856 1.00 0.00 H new ATOM 0 HG21 THR A 5 0.866 -2.626 -17.014 1.00 0.00 H new ATOM 0 HG22 THR A 5 0.839 -3.333 -15.382 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.317 -3.430 -16.369 1.00 0.00 H new ATOM 87 N SER A 6 3.485 -5.715 -17.021 1.00 0.00 N ATOM 88 CA SER A 6 4.936 -5.590 -16.965 1.00 0.00 C ATOM 89 C SER A 6 5.422 -4.482 -17.894 1.00 0.00 C ATOM 90 O SER A 6 5.010 -4.402 -19.052 1.00 0.00 O ATOM 91 CB SER A 6 5.599 -6.916 -17.343 1.00 0.00 C ATOM 92 OG SER A 6 5.903 -6.958 -18.727 1.00 0.00 O ATOM 0 H SER A 6 3.098 -5.711 -17.965 1.00 0.00 H new ATOM 0 HA SER A 6 5.214 -5.332 -15.943 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.512 -7.048 -16.763 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.937 -7.743 -17.088 1.00 0.00 H new ATOM 0 HG SER A 6 6.327 -7.815 -18.943 1.00 0.00 H new ATOM 98 N PHE A 7 6.302 -3.629 -17.379 1.00 0.00 N ATOM 99 CA PHE A 7 6.844 -2.525 -18.161 1.00 0.00 C ATOM 100 C PHE A 7 8.366 -2.605 -18.233 1.00 0.00 C ATOM 101 O PHE A 7 8.995 -3.351 -17.483 1.00 0.00 O ATOM 102 CB PHE A 7 6.421 -1.186 -17.554 1.00 0.00 C ATOM 103 CG PHE A 7 4.938 -0.952 -17.591 1.00 0.00 C ATOM 104 CD1 PHE A 7 4.209 -1.223 -18.738 1.00 0.00 C ATOM 105 CD2 PHE A 7 4.272 -0.462 -16.479 1.00 0.00 C ATOM 106 CE1 PHE A 7 2.844 -1.010 -18.775 1.00 0.00 C ATOM 107 CE2 PHE A 7 2.908 -0.248 -16.510 1.00 0.00 C ATOM 108 CZ PHE A 7 2.193 -0.521 -17.660 1.00 0.00 C ATOM 0 H PHE A 7 6.655 -3.682 -16.423 1.00 0.00 H new ATOM 0 HA PHE A 7 6.445 -2.600 -19.173 1.00 0.00 H new ATOM 0 HB2 PHE A 7 6.762 -1.141 -16.520 1.00 0.00 H new ATOM 0 HB3 PHE A 7 6.921 -0.379 -18.090 1.00 0.00 H new ATOM 0 HD1 PHE A 7 4.713 -1.605 -19.613 1.00 0.00 H new ATOM 0 HD2 PHE A 7 4.826 -0.245 -15.578 1.00 0.00 H new ATOM 0 HE1 PHE A 7 2.287 -1.226 -19.675 1.00 0.00 H new ATOM 0 HE2 PHE A 7 2.401 0.133 -15.636 1.00 0.00 H new ATOM 0 HZ PHE A 7 1.127 -0.352 -17.687 1.00 0.00 H new ATOM 118 N ALA A 8 8.951 -1.832 -19.142 1.00 0.00 N ATOM 119 CA ALA A 8 10.399 -1.814 -19.312 1.00 0.00 C ATOM 120 C ALA A 8 10.951 -0.400 -19.170 1.00 0.00 C ATOM 121 O ALA A 8 12.034 -0.093 -19.667 1.00 0.00 O ATOM 122 CB ALA A 8 10.779 -2.398 -20.665 1.00 0.00 C ATOM 0 H ALA A 8 8.445 -1.210 -19.772 1.00 0.00 H new ATOM 0 HA ALA A 8 10.840 -2.428 -18.527 1.00 0.00 H new ATOM 0 HB1 ALA A 8 11.863 -2.378 -20.778 1.00 0.00 H new ATOM 0 HB2 ALA A 8 10.426 -3.427 -20.729 1.00 0.00 H new ATOM 0 HB3 ALA A 8 10.320 -1.807 -21.458 1.00 0.00 H new ATOM 128 N ASN A 9 10.198 0.459 -18.490 1.00 0.00 N ATOM 129 CA ASN A 9 10.612 1.842 -18.284 1.00 0.00 C ATOM 130 C ASN A 9 10.164 2.346 -16.916 1.00 0.00 C ATOM 131 O ASN A 9 9.080 2.020 -16.431 1.00 0.00 O ATOM 132 CB ASN A 9 10.037 2.737 -19.384 1.00 0.00 C ATOM 133 CG ASN A 9 11.097 3.200 -20.365 1.00 0.00 C ATOM 134 OD1 ASN A 9 11.865 4.119 -20.079 1.00 0.00 O ATOM 135 ND2 ASN A 9 11.142 2.565 -21.530 1.00 0.00 N ATOM 0 H ASN A 9 9.298 0.222 -18.072 1.00 0.00 H new ATOM 0 HA ASN A 9 11.701 1.880 -18.326 1.00 0.00 H new ATOM 0 HB2 ASN A 9 9.260 2.193 -19.922 1.00 0.00 H new ATOM 0 HB3 ASN A 9 9.561 3.606 -18.930 1.00 0.00 H new ATOM 0 HD21 ASN A 9 11.833 2.833 -22.231 1.00 0.00 H new ATOM 0 HD22 ASN A 9 10.486 1.809 -21.724 1.00 0.00 H new ATOM 142 N PRO A 10 11.015 3.163 -16.278 1.00 0.00 N ATOM 143 CA PRO A 10 10.728 3.731 -14.957 1.00 0.00 C ATOM 144 C PRO A 10 9.613 4.770 -15.003 1.00 0.00 C ATOM 145 O PRO A 10 8.672 4.720 -14.211 1.00 0.00 O ATOM 146 CB PRO A 10 12.053 4.385 -14.557 1.00 0.00 C ATOM 147 CG PRO A 10 12.731 4.688 -15.848 1.00 0.00 C ATOM 148 CD PRO A 10 12.324 3.594 -16.797 1.00 0.00 C ATOM 0 HA PRO A 10 10.381 2.974 -14.254 1.00 0.00 H new ATOM 0 HB2 PRO A 10 11.887 5.291 -13.975 1.00 0.00 H new ATOM 0 HB3 PRO A 10 12.655 3.716 -13.941 1.00 0.00 H new ATOM 0 HG2 PRO A 10 12.430 5.665 -16.227 1.00 0.00 H new ATOM 0 HG3 PRO A 10 13.814 4.714 -15.724 1.00 0.00 H new ATOM 0 HD2 PRO A 10 12.250 3.958 -17.822 1.00 0.00 H new ATOM 0 HD3 PRO A 10 13.044 2.776 -16.800 1.00 0.00 H new ATOM 156 N ARG A 11 9.725 5.710 -15.936 1.00 0.00 N ATOM 157 CA ARG A 11 8.726 6.762 -16.084 1.00 0.00 C ATOM 158 C ARG A 11 7.325 6.169 -16.193 1.00 0.00 C ATOM 159 O ARG A 11 6.419 6.548 -15.450 1.00 0.00 O ATOM 160 CB ARG A 11 9.029 7.612 -17.319 1.00 0.00 C ATOM 161 CG ARG A 11 10.434 8.193 -17.329 1.00 0.00 C ATOM 162 CD ARG A 11 10.557 9.335 -18.325 1.00 0.00 C ATOM 163 NE ARG A 11 10.997 10.573 -17.687 1.00 0.00 N ATOM 164 CZ ARG A 11 11.387 11.649 -18.360 1.00 0.00 C ATOM 165 NH1 ARG A 11 11.391 11.640 -19.686 1.00 0.00 N ATOM 166 NH2 ARG A 11 11.773 12.738 -17.708 1.00 0.00 N ATOM 0 H ARG A 11 10.497 5.765 -16.600 1.00 0.00 H new ATOM 0 HA ARG A 11 8.766 7.394 -15.197 1.00 0.00 H new ATOM 0 HB2 ARG A 11 8.891 7.002 -18.212 1.00 0.00 H new ATOM 0 HB3 ARG A 11 8.307 8.427 -17.375 1.00 0.00 H new ATOM 0 HG2 ARG A 11 10.688 8.550 -16.331 1.00 0.00 H new ATOM 0 HG3 ARG A 11 11.151 7.411 -17.580 1.00 0.00 H new ATOM 0 HD2 ARG A 11 11.264 9.059 -19.107 1.00 0.00 H new ATOM 0 HD3 ARG A 11 9.594 9.499 -18.809 1.00 0.00 H new ATOM 0 HE ARG A 11 11.005 10.613 -16.668 1.00 0.00 H new ATOM 0 HH11 ARG A 11 11.094 10.805 -20.191 1.00 0.00 H new ATOM 0 HH12 ARG A 11 11.691 12.468 -20.201 1.00 0.00 H new ATOM 0 HH21 ARG A 11 11.770 12.750 -16.688 1.00 0.00 H new ATOM 0 HH22 ARG A 11 12.072 13.564 -18.227 1.00 0.00 H new ATOM 180 N VAL A 12 7.153 5.236 -17.125 1.00 0.00 N ATOM 181 CA VAL A 12 5.862 4.590 -17.331 1.00 0.00 C ATOM 182 C VAL A 12 5.379 3.908 -16.056 1.00 0.00 C ATOM 183 O VAL A 12 4.259 4.139 -15.602 1.00 0.00 O ATOM 184 CB VAL A 12 5.930 3.549 -18.463 1.00 0.00 C ATOM 185 CG1 VAL A 12 4.598 2.829 -18.609 1.00 0.00 C ATOM 186 CG2 VAL A 12 6.333 4.211 -19.772 1.00 0.00 C ATOM 0 H VAL A 12 7.892 4.911 -17.749 1.00 0.00 H new ATOM 0 HA VAL A 12 5.157 5.373 -17.610 1.00 0.00 H new ATOM 0 HB VAL A 12 6.689 2.810 -18.207 1.00 0.00 H new ATOM 0 HG11 VAL A 12 4.666 2.097 -19.414 1.00 0.00 H new ATOM 0 HG12 VAL A 12 4.355 2.320 -17.676 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.817 3.553 -18.842 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.376 3.460 -20.561 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.599 4.973 -20.035 1.00 0.00 H new ATOM 0 HG23 VAL A 12 7.313 4.675 -19.659 1.00 0.00 H new ATOM 196 N ALA A 13 6.233 3.065 -15.483 1.00 0.00 N ATOM 197 CA ALA A 13 5.895 2.351 -14.258 1.00 0.00 C ATOM 198 C ALA A 13 5.374 3.307 -13.190 1.00 0.00 C ATOM 199 O ALA A 13 4.224 3.207 -12.763 1.00 0.00 O ATOM 200 CB ALA A 13 7.105 1.587 -13.741 1.00 0.00 C ATOM 0 H ALA A 13 7.163 2.860 -15.848 1.00 0.00 H new ATOM 0 HA ALA A 13 5.102 1.640 -14.489 1.00 0.00 H new ATOM 0 HB1 ALA A 13 6.838 1.059 -12.826 1.00 0.00 H new ATOM 0 HB2 ALA A 13 7.430 0.868 -14.493 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.915 2.286 -13.533 1.00 0.00 H new ATOM 206 N GLN A 14 6.228 4.232 -12.764 1.00 0.00 N ATOM 207 CA GLN A 14 5.853 5.204 -11.744 1.00 0.00 C ATOM 208 C GLN A 14 4.612 5.985 -12.166 1.00 0.00 C ATOM 209 O GLN A 14 3.675 6.147 -11.387 1.00 0.00 O ATOM 210 CB GLN A 14 7.011 6.168 -11.479 1.00 0.00 C ATOM 211 CG GLN A 14 6.640 7.329 -10.570 1.00 0.00 C ATOM 212 CD GLN A 14 6.278 6.880 -9.168 1.00 0.00 C ATOM 213 OE1 GLN A 14 7.102 6.305 -8.456 1.00 0.00 O ATOM 214 NE2 GLN A 14 5.041 7.140 -8.763 1.00 0.00 N ATOM 0 H GLN A 14 7.183 4.329 -13.109 1.00 0.00 H new ATOM 0 HA GLN A 14 5.624 4.661 -10.827 1.00 0.00 H new ATOM 0 HB2 GLN A 14 7.837 5.616 -11.031 1.00 0.00 H new ATOM 0 HB3 GLN A 14 7.370 6.562 -12.430 1.00 0.00 H new ATOM 0 HG2 GLN A 14 7.476 8.027 -10.519 1.00 0.00 H new ATOM 0 HG3 GLN A 14 5.798 7.870 -11.003 1.00 0.00 H new ATOM 0 HE21 GLN A 14 4.390 7.619 -9.386 1.00 0.00 H new ATOM 0 HE22 GLN A 14 4.741 6.861 -7.829 1.00 0.00 H new ATOM 223 N ALA A 15 4.615 6.466 -13.405 1.00 0.00 N ATOM 224 CA ALA A 15 3.490 7.227 -13.932 1.00 0.00 C ATOM 225 C ALA A 15 2.182 6.462 -13.763 1.00 0.00 C ATOM 226 O ALA A 15 1.176 7.020 -13.323 1.00 0.00 O ATOM 227 CB ALA A 15 3.720 7.566 -15.397 1.00 0.00 C ATOM 0 H ALA A 15 5.385 6.342 -14.062 1.00 0.00 H new ATOM 0 HA ALA A 15 3.414 8.154 -13.364 1.00 0.00 H new ATOM 0 HB1 ALA A 15 2.871 8.135 -15.777 1.00 0.00 H new ATOM 0 HB2 ALA A 15 4.628 8.161 -15.495 1.00 0.00 H new ATOM 0 HB3 ALA A 15 3.826 6.646 -15.971 1.00 0.00 H new ATOM 233 N PHE A 16 2.202 5.181 -14.116 1.00 0.00 N ATOM 234 CA PHE A 16 1.016 4.339 -14.005 1.00 0.00 C ATOM 235 C PHE A 16 0.538 4.260 -12.558 1.00 0.00 C ATOM 236 O PHE A 16 -0.587 4.647 -12.242 1.00 0.00 O ATOM 237 CB PHE A 16 1.312 2.933 -14.533 1.00 0.00 C ATOM 238 CG PHE A 16 0.858 2.717 -15.949 1.00 0.00 C ATOM 239 CD1 PHE A 16 -0.485 2.535 -16.239 1.00 0.00 C ATOM 240 CD2 PHE A 16 1.773 2.696 -16.988 1.00 0.00 C ATOM 241 CE1 PHE A 16 -0.906 2.336 -17.541 1.00 0.00 C ATOM 242 CE2 PHE A 16 1.358 2.498 -18.292 1.00 0.00 C ATOM 243 CZ PHE A 16 0.017 2.317 -18.568 1.00 0.00 C ATOM 0 H PHE A 16 3.026 4.703 -14.481 1.00 0.00 H new ATOM 0 HA PHE A 16 0.225 4.787 -14.606 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.385 2.749 -14.472 1.00 0.00 H new ATOM 0 HB3 PHE A 16 0.825 2.201 -13.888 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -1.211 2.549 -15.439 1.00 0.00 H new ATOM 0 HD2 PHE A 16 2.823 2.836 -16.777 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -1.955 2.196 -17.754 1.00 0.00 H new ATOM 0 HE2 PHE A 16 2.082 2.485 -19.094 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.309 2.161 -19.586 1.00 0.00 H new ATOM 253 N VAL A 17 1.402 3.756 -11.682 1.00 0.00 N ATOM 254 CA VAL A 17 1.070 3.626 -10.269 1.00 0.00 C ATOM 255 C VAL A 17 0.711 4.978 -9.662 1.00 0.00 C ATOM 256 O VAL A 17 0.034 5.050 -8.636 1.00 0.00 O ATOM 257 CB VAL A 17 2.236 3.012 -9.472 1.00 0.00 C ATOM 258 CG1 VAL A 17 2.495 1.582 -9.921 1.00 0.00 C ATOM 259 CG2 VAL A 17 3.489 3.862 -9.622 1.00 0.00 C ATOM 0 H VAL A 17 2.337 3.431 -11.927 1.00 0.00 H new ATOM 0 HA VAL A 17 0.208 2.962 -10.207 1.00 0.00 H new ATOM 0 HB VAL A 17 1.962 2.992 -8.417 1.00 0.00 H new ATOM 0 HG11 VAL A 17 3.322 1.165 -9.347 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.600 0.982 -9.757 1.00 0.00 H new ATOM 0 HG13 VAL A 17 2.749 1.574 -10.981 1.00 0.00 H new ATOM 0 HG21 VAL A 17 4.303 3.414 -9.052 1.00 0.00 H new ATOM 0 HG22 VAL A 17 3.769 3.915 -10.674 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.294 4.867 -9.247 1.00 0.00 H new ATOM 269 N ASP A 18 1.167 6.048 -10.304 1.00 0.00 N ATOM 270 CA ASP A 18 0.893 7.399 -9.829 1.00 0.00 C ATOM 271 C ASP A 18 -0.565 7.776 -10.075 1.00 0.00 C ATOM 272 O ASP A 18 -1.306 8.073 -9.138 1.00 0.00 O ATOM 273 CB ASP A 18 1.816 8.403 -10.521 1.00 0.00 C ATOM 274 CG ASP A 18 1.707 9.794 -9.928 1.00 0.00 C ATOM 275 OD1 ASP A 18 1.448 9.901 -8.712 1.00 0.00 O ATOM 276 OD2 ASP A 18 1.880 10.775 -10.681 1.00 0.00 O ATOM 0 H ASP A 18 1.728 6.006 -11.155 1.00 0.00 H new ATOM 0 HA ASP A 18 1.080 7.425 -8.756 1.00 0.00 H new ATOM 0 HB2 ASP A 18 2.847 8.058 -10.443 1.00 0.00 H new ATOM 0 HB3 ASP A 18 1.573 8.444 -11.583 1.00 0.00 H new ATOM 281 N TYR A 19 -0.968 7.763 -11.341 1.00 0.00 N ATOM 282 CA TYR A 19 -2.336 8.107 -11.710 1.00 0.00 C ATOM 283 C TYR A 19 -3.326 7.098 -11.135 1.00 0.00 C ATOM 284 O TYR A 19 -4.502 7.406 -10.942 1.00 0.00 O ATOM 285 CB TYR A 19 -2.476 8.164 -13.232 1.00 0.00 C ATOM 286 CG TYR A 19 -3.178 6.962 -13.822 1.00 0.00 C ATOM 287 CD1 TYR A 19 -4.565 6.874 -13.825 1.00 0.00 C ATOM 288 CD2 TYR A 19 -2.454 5.914 -14.377 1.00 0.00 C ATOM 289 CE1 TYR A 19 -5.210 5.777 -14.362 1.00 0.00 C ATOM 290 CE2 TYR A 19 -3.091 4.813 -14.918 1.00 0.00 C ATOM 291 CZ TYR A 19 -4.469 4.749 -14.907 1.00 0.00 C ATOM 292 OH TYR A 19 -5.108 3.655 -15.444 1.00 0.00 O ATOM 0 H TYR A 19 -0.367 7.518 -12.128 1.00 0.00 H new ATOM 0 HA TYR A 19 -2.562 9.088 -11.293 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -3.026 9.065 -13.504 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -1.484 8.249 -13.677 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -5.149 7.677 -13.400 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -1.375 5.960 -14.386 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -6.289 5.724 -14.355 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -2.513 4.008 -15.347 1.00 0.00 H new ATOM 0 HH TYR A 19 -4.442 3.023 -15.787 1.00 0.00 H new ATOM 302 N MET A 20 -2.840 5.891 -10.863 1.00 0.00 N ATOM 303 CA MET A 20 -3.681 4.837 -10.308 1.00 0.00 C ATOM 304 C MET A 20 -3.848 5.011 -8.802 1.00 0.00 C ATOM 305 O MET A 20 -4.939 4.825 -8.264 1.00 0.00 O ATOM 306 CB MET A 20 -3.079 3.463 -10.611 1.00 0.00 C ATOM 307 CG MET A 20 -3.414 2.945 -12.000 1.00 0.00 C ATOM 308 SD MET A 20 -4.795 1.785 -11.994 1.00 0.00 S ATOM 309 CE MET A 20 -6.177 2.902 -12.219 1.00 0.00 C ATOM 0 H MET A 20 -1.869 5.619 -11.018 1.00 0.00 H new ATOM 0 HA MET A 20 -4.664 4.907 -10.775 1.00 0.00 H new ATOM 0 HB2 MET A 20 -1.996 3.519 -10.505 1.00 0.00 H new ATOM 0 HB3 MET A 20 -3.436 2.748 -9.870 1.00 0.00 H new ATOM 0 HG2 MET A 20 -3.654 3.787 -12.649 1.00 0.00 H new ATOM 0 HG3 MET A 20 -2.536 2.457 -12.423 1.00 0.00 H new ATOM 0 HE1 MET A 20 -6.835 2.846 -11.352 1.00 0.00 H new ATOM 0 HE2 MET A 20 -5.807 3.921 -12.329 1.00 0.00 H new ATOM 0 HE3 MET A 20 -6.732 2.619 -13.114 1.00 0.00 H new ATOM 319 N ALA A 21 -2.760 5.368 -8.128 1.00 0.00 N ATOM 320 CA ALA A 21 -2.788 5.569 -6.684 1.00 0.00 C ATOM 321 C ALA A 21 -3.681 6.747 -6.311 1.00 0.00 C ATOM 322 O ALA A 21 -4.444 6.681 -5.346 1.00 0.00 O ATOM 323 CB ALA A 21 -1.378 5.785 -6.154 1.00 0.00 C ATOM 0 H ALA A 21 -1.848 5.524 -8.558 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.204 4.672 -6.225 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.414 5.934 -5.075 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -0.767 4.911 -6.380 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -0.942 6.665 -6.627 1.00 0.00 H new ATOM 329 N THR A 22 -3.581 7.827 -7.080 1.00 0.00 N ATOM 330 CA THR A 22 -4.379 9.021 -6.829 1.00 0.00 C ATOM 331 C THR A 22 -5.842 8.791 -7.192 1.00 0.00 C ATOM 332 O THR A 22 -6.710 9.587 -6.837 1.00 0.00 O ATOM 333 CB THR A 22 -3.848 10.229 -7.624 1.00 0.00 C ATOM 334 OG1 THR A 22 -4.555 11.414 -7.244 1.00 0.00 O ATOM 335 CG2 THR A 22 -3.998 10.000 -9.120 1.00 0.00 C ATOM 0 H THR A 22 -2.955 7.899 -7.882 1.00 0.00 H new ATOM 0 HA THR A 22 -4.301 9.235 -5.763 1.00 0.00 H new ATOM 0 HB THR A 22 -2.789 10.350 -7.396 1.00 0.00 H new ATOM 0 HG1 THR A 22 -5.430 11.169 -6.876 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.616 10.866 -9.661 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.434 9.114 -9.411 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.051 9.856 -9.362 1.00 0.00 H new ATOM 343 N GLN A 23 -6.106 7.699 -7.901 1.00 0.00 N ATOM 344 CA GLN A 23 -7.465 7.366 -8.312 1.00 0.00 C ATOM 345 C GLN A 23 -8.138 6.461 -7.285 1.00 0.00 C ATOM 346 O GLN A 23 -9.302 6.094 -7.435 1.00 0.00 O ATOM 347 CB GLN A 23 -7.453 6.683 -9.681 1.00 0.00 C ATOM 348 CG GLN A 23 -7.435 7.658 -10.847 1.00 0.00 C ATOM 349 CD GLN A 23 -8.816 8.179 -11.194 1.00 0.00 C ATOM 350 OE1 GLN A 23 -9.506 7.621 -12.048 1.00 0.00 O ATOM 351 NE2 GLN A 23 -9.227 9.254 -10.532 1.00 0.00 N ATOM 0 H GLN A 23 -5.398 7.030 -8.203 1.00 0.00 H new ATOM 0 HA GLN A 23 -8.034 8.293 -8.381 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -6.579 6.035 -9.747 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -8.332 6.043 -9.766 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -6.785 8.498 -10.603 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -7.006 7.166 -11.720 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -8.622 9.684 -9.832 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -10.148 9.650 -10.723 1.00 0.00 H new ATOM 360 N GLY A 24 -7.396 6.105 -6.241 1.00 0.00 N ATOM 361 CA GLY A 24 -7.938 5.246 -5.204 1.00 0.00 C ATOM 362 C GLY A 24 -7.463 3.812 -5.332 1.00 0.00 C ATOM 363 O GLY A 24 -7.781 2.968 -4.495 1.00 0.00 O ATOM 0 H GLY A 24 -6.429 6.396 -6.095 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -7.650 5.635 -4.227 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -9.027 5.270 -5.249 1.00 0.00 H new ATOM 367 N VAL A 25 -6.699 3.535 -6.385 1.00 0.00 N ATOM 368 CA VAL A 25 -6.180 2.194 -6.620 1.00 0.00 C ATOM 369 C VAL A 25 -4.675 2.138 -6.385 1.00 0.00 C ATOM 370 O VAL A 25 -3.898 2.742 -7.124 1.00 0.00 O ATOM 371 CB VAL A 25 -6.482 1.719 -8.054 1.00 0.00 C ATOM 372 CG1 VAL A 25 -6.271 0.217 -8.175 1.00 0.00 C ATOM 373 CG2 VAL A 25 -7.899 2.100 -8.454 1.00 0.00 C ATOM 0 H VAL A 25 -6.427 4.222 -7.088 1.00 0.00 H new ATOM 0 HA VAL A 25 -6.680 1.533 -5.913 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.791 2.215 -8.735 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -6.489 -0.100 -9.195 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -5.236 -0.026 -7.933 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.936 -0.301 -7.484 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.095 1.757 -9.470 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.608 1.633 -7.770 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.011 3.183 -8.409 1.00 0.00 H new ATOM 383 N ILE A 26 -4.270 1.409 -5.350 1.00 0.00 N ATOM 384 CA ILE A 26 -2.857 1.272 -5.018 1.00 0.00 C ATOM 385 C ILE A 26 -2.187 0.215 -5.888 1.00 0.00 C ATOM 386 O ILE A 26 -2.718 -0.882 -6.070 1.00 0.00 O ATOM 387 CB ILE A 26 -2.661 0.902 -3.536 1.00 0.00 C ATOM 388 CG1 ILE A 26 -3.286 1.968 -2.634 1.00 0.00 C ATOM 389 CG2 ILE A 26 -1.181 0.737 -3.223 1.00 0.00 C ATOM 390 CD1 ILE A 26 -2.723 3.354 -2.856 1.00 0.00 C ATOM 0 H ILE A 26 -4.900 0.904 -4.727 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.393 2.240 -5.207 1.00 0.00 H new ATOM 0 HB ILE A 26 -3.161 -0.047 -3.345 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.362 1.991 -2.804 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.134 1.686 -1.592 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -1.058 0.476 -2.172 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.764 -0.055 -3.845 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -0.659 1.672 -3.428 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -3.212 4.058 -2.183 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -1.651 3.347 -2.658 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.899 3.657 -3.888 1.00 0.00 H new ATOM 402 N LEU A 27 -1.018 0.550 -6.423 1.00 0.00 N ATOM 403 CA LEU A 27 -0.273 -0.372 -7.273 1.00 0.00 C ATOM 404 C LEU A 27 1.170 -0.507 -6.797 1.00 0.00 C ATOM 405 O LEU A 27 1.675 0.343 -6.063 1.00 0.00 O ATOM 406 CB LEU A 27 -0.300 0.108 -8.725 1.00 0.00 C ATOM 407 CG LEU A 27 -1.492 -0.355 -9.563 1.00 0.00 C ATOM 408 CD1 LEU A 27 -1.463 -1.865 -9.745 1.00 0.00 C ATOM 409 CD2 LEU A 27 -2.800 0.080 -8.918 1.00 0.00 C ATOM 0 H LEU A 27 -0.566 1.453 -6.283 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.749 -1.350 -7.211 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -0.282 1.198 -8.727 1.00 0.00 H new ATOM 0 HB3 LEU A 27 0.615 -0.227 -9.214 1.00 0.00 H new ATOM 0 HG LEU A 27 -1.422 0.111 -10.546 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -2.319 -2.176 -10.344 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.542 -2.153 -10.252 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -1.507 -2.350 -8.770 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -3.637 -0.258 -9.529 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -2.877 -0.356 -7.922 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.824 1.167 -8.841 1.00 0.00 H new ATOM 421 N THR A 28 1.829 -1.580 -7.221 1.00 0.00 N ATOM 422 CA THR A 28 3.214 -1.826 -6.839 1.00 0.00 C ATOM 423 C THR A 28 4.089 -2.061 -8.065 1.00 0.00 C ATOM 424 O THR A 28 3.633 -2.609 -9.069 1.00 0.00 O ATOM 425 CB THR A 28 3.330 -3.041 -5.900 1.00 0.00 C ATOM 426 OG1 THR A 28 2.034 -3.418 -5.423 1.00 0.00 O ATOM 427 CG2 THR A 28 4.239 -2.729 -4.721 1.00 0.00 C ATOM 0 H THR A 28 1.426 -2.293 -7.829 1.00 0.00 H new ATOM 0 HA THR A 28 3.560 -0.936 -6.314 1.00 0.00 H new ATOM 0 HB THR A 28 3.763 -3.867 -6.464 1.00 0.00 H new ATOM 0 HG1 THR A 28 1.510 -3.792 -6.162 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.305 -3.602 -4.072 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.233 -2.472 -5.086 1.00 0.00 H new ATOM 0 HG23 THR A 28 3.831 -1.889 -4.159 1.00 0.00 H new ATOM 435 N ILE A 29 5.348 -1.644 -7.977 1.00 0.00 N ATOM 436 CA ILE A 29 6.287 -1.811 -9.079 1.00 0.00 C ATOM 437 C ILE A 29 7.542 -2.547 -8.625 1.00 0.00 C ATOM 438 O ILE A 29 8.007 -2.366 -7.500 1.00 0.00 O ATOM 439 CB ILE A 29 6.692 -0.454 -9.684 1.00 0.00 C ATOM 440 CG1 ILE A 29 5.466 0.259 -10.260 1.00 0.00 C ATOM 441 CG2 ILE A 29 7.752 -0.648 -10.758 1.00 0.00 C ATOM 442 CD1 ILE A 29 4.860 -0.449 -11.451 1.00 0.00 C ATOM 0 H ILE A 29 5.741 -1.188 -7.154 1.00 0.00 H new ATOM 0 HA ILE A 29 5.778 -2.402 -9.840 1.00 0.00 H new ATOM 0 HB ILE A 29 7.113 0.168 -8.894 1.00 0.00 H new ATOM 0 HG12 ILE A 29 4.710 0.353 -9.480 1.00 0.00 H new ATOM 0 HG13 ILE A 29 5.748 1.270 -10.553 1.00 0.00 H new ATOM 0 HG21 ILE A 29 8.028 0.320 -11.176 1.00 0.00 H new ATOM 0 HG22 ILE A 29 8.632 -1.118 -10.320 1.00 0.00 H new ATOM 0 HG23 ILE A 29 7.356 -1.285 -11.549 1.00 0.00 H new ATOM 0 HD11 ILE A 29 3.996 0.112 -11.807 1.00 0.00 H new ATOM 0 HD12 ILE A 29 5.600 -0.519 -12.248 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.546 -1.451 -11.158 1.00 0.00 H new ATOM 454 N GLN A 30 8.087 -3.377 -9.509 1.00 0.00 N ATOM 455 CA GLN A 30 9.290 -4.141 -9.198 1.00 0.00 C ATOM 456 C GLN A 30 10.377 -3.890 -10.238 1.00 0.00 C ATOM 457 O GLN A 30 10.320 -4.419 -11.348 1.00 0.00 O ATOM 458 CB GLN A 30 8.968 -5.635 -9.130 1.00 0.00 C ATOM 459 CG GLN A 30 8.784 -6.153 -7.713 1.00 0.00 C ATOM 460 CD GLN A 30 9.818 -7.194 -7.333 1.00 0.00 C ATOM 461 OE1 GLN A 30 10.204 -8.030 -8.151 1.00 0.00 O ATOM 462 NE2 GLN A 30 10.275 -7.149 -6.087 1.00 0.00 N ATOM 0 H GLN A 30 7.715 -3.537 -10.445 1.00 0.00 H new ATOM 0 HA GLN A 30 9.658 -3.812 -8.226 1.00 0.00 H new ATOM 0 HB2 GLN A 30 8.059 -5.829 -9.700 1.00 0.00 H new ATOM 0 HB3 GLN A 30 9.771 -6.194 -9.611 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.841 -5.318 -7.015 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.787 -6.583 -7.614 1.00 0.00 H new ATOM 0 HE21 GLN A 30 9.928 -6.439 -5.442 1.00 0.00 H new ATOM 0 HE22 GLN A 30 10.973 -7.824 -5.775 1.00 0.00 H new ATOM 471 N GLN A 31 11.365 -3.080 -9.871 1.00 0.00 N ATOM 472 CA GLN A 31 12.464 -2.759 -10.773 1.00 0.00 C ATOM 473 C GLN A 31 13.529 -3.850 -10.744 1.00 0.00 C ATOM 474 O GLN A 31 14.303 -3.951 -9.791 1.00 0.00 O ATOM 475 CB GLN A 31 13.085 -1.413 -10.395 1.00 0.00 C ATOM 476 CG GLN A 31 12.694 -0.278 -11.328 1.00 0.00 C ATOM 477 CD GLN A 31 11.810 0.753 -10.655 1.00 0.00 C ATOM 478 OE1 GLN A 31 11.204 0.485 -9.617 1.00 0.00 O ATOM 479 NE2 GLN A 31 11.731 1.940 -11.243 1.00 0.00 N ATOM 0 H GLN A 31 11.427 -2.634 -8.956 1.00 0.00 H new ATOM 0 HA GLN A 31 12.063 -2.695 -11.785 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.785 -1.157 -9.379 1.00 0.00 H new ATOM 0 HB3 GLN A 31 14.171 -1.511 -10.391 1.00 0.00 H new ATOM 0 HG2 GLN A 31 13.596 0.209 -11.699 1.00 0.00 H new ATOM 0 HG3 GLN A 31 12.174 -0.687 -12.194 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.250 2.119 -12.102 1.00 0.00 H new ATOM 0 HE22 GLN A 31 11.151 2.673 -10.835 1.00 0.00 H new ATOM 536 N SER A 35 22.714 -8.174 -14.821 1.00 0.00 N ATOM 537 CA SER A 35 23.954 -7.722 -15.442 1.00 0.00 C ATOM 538 C SER A 35 24.494 -8.775 -16.405 1.00 0.00 C ATOM 539 O SER A 35 25.085 -9.771 -15.986 1.00 0.00 O ATOM 540 CB SER A 35 25.000 -7.409 -14.371 1.00 0.00 C ATOM 541 OG SER A 35 24.392 -7.203 -13.108 1.00 0.00 O ATOM 0 HA SER A 35 23.740 -6.815 -16.007 1.00 0.00 H new ATOM 0 HB2 SER A 35 25.714 -8.230 -14.305 1.00 0.00 H new ATOM 0 HB3 SER A 35 25.562 -6.520 -14.657 1.00 0.00 H new ATOM 0 HG SER A 35 23.475 -7.547 -13.126 1.00 0.00 H new ATOM 547 N ASP A 36 24.288 -8.547 -17.697 1.00 0.00 N ATOM 548 CA ASP A 36 24.755 -9.474 -18.722 1.00 0.00 C ATOM 549 C ASP A 36 26.207 -9.188 -19.092 1.00 0.00 C ATOM 550 O ASP A 36 26.564 -8.056 -19.419 1.00 0.00 O ATOM 551 CB ASP A 36 23.870 -9.380 -19.966 1.00 0.00 C ATOM 552 CG ASP A 36 22.494 -9.975 -19.744 1.00 0.00 C ATOM 553 OD1 ASP A 36 22.218 -10.426 -18.612 1.00 0.00 O ATOM 554 OD2 ASP A 36 21.693 -9.990 -20.701 1.00 0.00 O ATOM 0 H ASP A 36 23.800 -7.728 -18.060 1.00 0.00 H new ATOM 0 HA ASP A 36 24.694 -10.485 -18.318 1.00 0.00 H new ATOM 0 HB2 ASP A 36 23.768 -8.335 -20.257 1.00 0.00 H new ATOM 0 HB3 ASP A 36 24.356 -9.896 -20.794 1.00 0.00 H new ATOM 559 N VAL A 37 27.041 -10.222 -19.037 1.00 0.00 N ATOM 560 CA VAL A 37 28.454 -10.082 -19.366 1.00 0.00 C ATOM 561 C VAL A 37 28.738 -10.564 -20.784 1.00 0.00 C ATOM 562 O VAL A 37 28.494 -11.724 -21.117 1.00 0.00 O ATOM 563 CB VAL A 37 29.340 -10.868 -18.382 1.00 0.00 C ATOM 564 CG1 VAL A 37 30.806 -10.512 -18.581 1.00 0.00 C ATOM 565 CG2 VAL A 37 28.908 -10.602 -16.948 1.00 0.00 C ATOM 0 H VAL A 37 26.762 -11.165 -18.768 1.00 0.00 H new ATOM 0 HA VAL A 37 28.693 -9.021 -19.291 1.00 0.00 H new ATOM 0 HB VAL A 37 29.220 -11.933 -18.582 1.00 0.00 H new ATOM 0 HG11 VAL A 37 31.417 -11.077 -17.877 1.00 0.00 H new ATOM 0 HG12 VAL A 37 31.105 -10.758 -19.600 1.00 0.00 H new ATOM 0 HG13 VAL A 37 30.948 -9.445 -18.409 1.00 0.00 H new ATOM 0 HG21 VAL A 37 29.545 -11.165 -16.266 1.00 0.00 H new ATOM 0 HG22 VAL A 37 28.998 -9.537 -16.732 1.00 0.00 H new ATOM 0 HG23 VAL A 37 27.871 -10.913 -16.817 1.00 0.00 H new ATOM 575 N TRP A 38 29.255 -9.667 -21.616 1.00 0.00 N ATOM 576 CA TRP A 38 29.573 -10.001 -22.999 1.00 0.00 C ATOM 577 C TRP A 38 31.005 -9.603 -23.340 1.00 0.00 C ATOM 578 O TRP A 38 31.510 -8.589 -22.856 1.00 0.00 O ATOM 579 CB TRP A 38 28.597 -9.306 -23.950 1.00 0.00 C ATOM 580 CG TRP A 38 27.986 -8.066 -23.372 1.00 0.00 C ATOM 581 CD1 TRP A 38 27.221 -7.978 -22.245 1.00 0.00 C ATOM 582 CD2 TRP A 38 28.086 -6.737 -23.896 1.00 0.00 C ATOM 583 NE1 TRP A 38 26.840 -6.675 -22.035 1.00 0.00 N ATOM 584 CE2 TRP A 38 27.359 -5.894 -23.033 1.00 0.00 C ATOM 585 CE3 TRP A 38 28.722 -6.177 -25.007 1.00 0.00 C ATOM 586 CZ2 TRP A 38 27.250 -4.523 -23.250 1.00 0.00 C ATOM 587 CZ3 TRP A 38 28.613 -4.816 -25.221 1.00 0.00 C ATOM 588 CH2 TRP A 38 27.882 -4.001 -24.346 1.00 0.00 C ATOM 0 H TRP A 38 29.463 -8.703 -21.357 1.00 0.00 H new ATOM 0 HA TRP A 38 29.478 -11.080 -23.117 1.00 0.00 H new ATOM 0 HB2 TRP A 38 29.119 -9.049 -24.872 1.00 0.00 H new ATOM 0 HB3 TRP A 38 27.803 -10.003 -24.217 1.00 0.00 H new ATOM 0 HD1 TRP A 38 26.954 -8.811 -21.611 1.00 0.00 H new ATOM 0 HE1 TRP A 38 26.264 -6.343 -21.261 1.00 0.00 H new ATOM 0 HE3 TRP A 38 29.289 -6.797 -25.686 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 26.687 -3.894 -22.577 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 29.100 -4.373 -26.077 1.00 0.00 H new ATOM 0 HH2 TRP A 38 27.816 -2.941 -24.540 1.00 0.00 H new ATOM 599 N LEU A 39 31.655 -10.405 -24.176 1.00 0.00 N ATOM 600 CA LEU A 39 33.030 -10.136 -24.582 1.00 0.00 C ATOM 601 C LEU A 39 33.117 -9.902 -26.087 1.00 0.00 C ATOM 602 O LEU A 39 32.298 -10.409 -26.852 1.00 0.00 O ATOM 603 CB LEU A 39 33.938 -11.299 -24.182 1.00 0.00 C ATOM 604 CG LEU A 39 35.350 -11.281 -24.767 1.00 0.00 C ATOM 605 CD1 LEU A 39 36.154 -10.129 -24.185 1.00 0.00 C ATOM 606 CD2 LEU A 39 36.052 -12.607 -24.511 1.00 0.00 C ATOM 0 H LEU A 39 31.252 -11.247 -24.586 1.00 0.00 H new ATOM 0 HA LEU A 39 33.363 -9.232 -24.072 1.00 0.00 H new ATOM 0 HB2 LEU A 39 34.017 -11.314 -23.095 1.00 0.00 H new ATOM 0 HB3 LEU A 39 33.455 -12.230 -24.480 1.00 0.00 H new ATOM 0 HG LEU A 39 35.274 -11.136 -25.845 1.00 0.00 H new ATOM 0 HD11 LEU A 39 37.156 -10.132 -24.613 1.00 0.00 H new ATOM 0 HD12 LEU A 39 35.662 -9.186 -24.421 1.00 0.00 H new ATOM 0 HD13 LEU A 39 36.221 -10.242 -23.103 1.00 0.00 H new ATOM 0 HD21 LEU A 39 37.056 -12.575 -24.935 1.00 0.00 H new ATOM 0 HD22 LEU A 39 36.117 -12.783 -23.437 1.00 0.00 H new ATOM 0 HD23 LEU A 39 35.487 -13.414 -24.977 1.00 0.00 H new ATOM 618 N ALA A 40 34.117 -9.131 -26.504 1.00 0.00 N ATOM 619 CA ALA A 40 34.314 -8.834 -27.917 1.00 0.00 C ATOM 620 C ALA A 40 35.465 -9.650 -28.494 1.00 0.00 C ATOM 621 O ALA A 40 35.493 -9.943 -29.689 1.00 0.00 O ATOM 622 CB ALA A 40 34.568 -7.347 -28.113 1.00 0.00 C ATOM 0 H ALA A 40 34.803 -8.701 -25.883 1.00 0.00 H new ATOM 0 HA ALA A 40 33.405 -9.109 -28.451 1.00 0.00 H new ATOM 0 HB1 ALA A 40 34.713 -7.139 -29.173 1.00 0.00 H new ATOM 0 HB2 ALA A 40 33.712 -6.780 -27.746 1.00 0.00 H new ATOM 0 HB3 ALA A 40 35.461 -7.054 -27.560 1.00 0.00 H new ATOM 628 N ASP A 41 36.414 -10.012 -27.638 1.00 0.00 N ATOM 629 CA ASP A 41 37.569 -10.795 -28.064 1.00 0.00 C ATOM 630 C ASP A 41 37.282 -12.290 -27.956 1.00 0.00 C ATOM 631 O ASP A 41 37.546 -12.909 -26.927 1.00 0.00 O ATOM 632 CB ASP A 41 38.794 -10.437 -27.221 1.00 0.00 C ATOM 633 CG ASP A 41 40.078 -10.997 -27.798 1.00 0.00 C ATOM 634 OD1 ASP A 41 40.092 -12.190 -28.170 1.00 0.00 O ATOM 635 OD2 ASP A 41 41.070 -10.243 -27.879 1.00 0.00 O ATOM 0 H ASP A 41 36.407 -9.776 -26.646 1.00 0.00 H new ATOM 0 HA ASP A 41 37.773 -10.556 -29.108 1.00 0.00 H new ATOM 0 HB2 ASP A 41 38.875 -9.353 -27.146 1.00 0.00 H new ATOM 0 HB3 ASP A 41 38.658 -10.817 -26.208 1.00 0.00 H new ATOM 640 N GLU A 42 36.738 -12.861 -29.027 1.00 0.00 N ATOM 641 CA GLU A 42 36.414 -14.282 -29.051 1.00 0.00 C ATOM 642 C GLU A 42 37.598 -15.119 -28.577 1.00 0.00 C ATOM 643 O GLU A 42 37.436 -16.058 -27.798 1.00 0.00 O ATOM 644 CB GLU A 42 36.005 -14.711 -30.462 1.00 0.00 C ATOM 645 CG GLU A 42 34.826 -13.930 -31.017 1.00 0.00 C ATOM 646 CD GLU A 42 34.510 -14.294 -32.455 1.00 0.00 C ATOM 647 OE1 GLU A 42 34.610 -15.490 -32.799 1.00 0.00 O ATOM 648 OE2 GLU A 42 34.164 -13.383 -33.236 1.00 0.00 O ATOM 0 H GLU A 42 36.513 -12.362 -29.888 1.00 0.00 H new ATOM 0 HA GLU A 42 35.578 -14.449 -28.371 1.00 0.00 H new ATOM 0 HB2 GLU A 42 36.857 -14.590 -31.131 1.00 0.00 H new ATOM 0 HB3 GLU A 42 35.755 -15.772 -30.452 1.00 0.00 H new ATOM 0 HG2 GLU A 42 33.948 -14.116 -30.398 1.00 0.00 H new ATOM 0 HG3 GLU A 42 35.040 -12.863 -30.955 1.00 0.00 H new ATOM 655 N SER A 43 38.789 -14.771 -29.053 1.00 0.00 N ATOM 656 CA SER A 43 40.001 -15.492 -28.682 1.00 0.00 C ATOM 657 C SER A 43 40.149 -15.563 -27.165 1.00 0.00 C ATOM 658 O SER A 43 40.653 -16.548 -26.626 1.00 0.00 O ATOM 659 CB SER A 43 41.230 -14.816 -29.294 1.00 0.00 C ATOM 660 OG SER A 43 40.910 -14.201 -30.530 1.00 0.00 O ATOM 0 H SER A 43 38.941 -13.994 -29.696 1.00 0.00 H new ATOM 0 HA SER A 43 39.922 -16.508 -29.070 1.00 0.00 H new ATOM 0 HB2 SER A 43 41.620 -14.069 -28.603 1.00 0.00 H new ATOM 0 HB3 SER A 43 42.018 -15.554 -29.444 1.00 0.00 H new ATOM 0 HG SER A 43 41.711 -13.775 -30.900 1.00 0.00 H new ATOM 666 N GLN A 44 39.704 -14.512 -26.484 1.00 0.00 N ATOM 667 CA GLN A 44 39.787 -14.454 -25.030 1.00 0.00 C ATOM 668 C GLN A 44 38.544 -15.061 -24.389 1.00 0.00 C ATOM 669 O GLN A 44 38.525 -15.341 -23.191 1.00 0.00 O ATOM 670 CB GLN A 44 39.960 -13.007 -24.565 1.00 0.00 C ATOM 671 CG GLN A 44 41.372 -12.679 -24.109 1.00 0.00 C ATOM 672 CD GLN A 44 42.432 -13.278 -25.013 1.00 0.00 C ATOM 673 OE1 GLN A 44 42.872 -14.410 -24.807 1.00 0.00 O ATOM 674 NE2 GLN A 44 42.847 -12.520 -26.021 1.00 0.00 N ATOM 0 H GLN A 44 39.283 -13.690 -26.916 1.00 0.00 H new ATOM 0 HA GLN A 44 40.655 -15.035 -24.718 1.00 0.00 H new ATOM 0 HB2 GLN A 44 39.686 -12.337 -25.380 1.00 0.00 H new ATOM 0 HB3 GLN A 44 39.268 -12.812 -23.746 1.00 0.00 H new ATOM 0 HG2 GLN A 44 41.497 -11.597 -24.077 1.00 0.00 H new ATOM 0 HG3 GLN A 44 41.516 -13.047 -23.093 1.00 0.00 H new ATOM 0 HE21 GLN A 44 42.454 -11.588 -26.153 1.00 0.00 H new ATOM 0 HE22 GLN A 44 43.558 -12.870 -26.663 1.00 0.00 H new ATOM 683 N ALA A 45 37.507 -15.262 -25.196 1.00 0.00 N ATOM 684 CA ALA A 45 36.260 -15.838 -24.708 1.00 0.00 C ATOM 685 C ALA A 45 36.511 -17.150 -23.973 1.00 0.00 C ATOM 686 O ALA A 45 35.742 -17.537 -23.094 1.00 0.00 O ATOM 687 CB ALA A 45 35.291 -16.054 -25.861 1.00 0.00 C ATOM 0 H ALA A 45 37.506 -15.034 -26.190 1.00 0.00 H new ATOM 0 HA ALA A 45 35.817 -15.136 -24.002 1.00 0.00 H new ATOM 0 HB1 ALA A 45 34.364 -16.485 -25.482 1.00 0.00 H new ATOM 0 HB2 ALA A 45 35.078 -15.099 -26.341 1.00 0.00 H new ATOM 0 HB3 ALA A 45 35.736 -16.734 -26.588 1.00 0.00 H new ATOM 693 N GLU A 46 37.592 -17.831 -24.341 1.00 0.00 N ATOM 694 CA GLU A 46 37.943 -19.102 -23.717 1.00 0.00 C ATOM 695 C GLU A 46 38.606 -18.877 -22.361 1.00 0.00 C ATOM 696 O GLU A 46 38.187 -19.443 -21.352 1.00 0.00 O ATOM 697 CB GLU A 46 38.876 -19.902 -24.627 1.00 0.00 C ATOM 698 CG GLU A 46 38.322 -20.122 -26.025 1.00 0.00 C ATOM 699 CD GLU A 46 39.385 -20.563 -27.012 1.00 0.00 C ATOM 700 OE1 GLU A 46 39.793 -21.742 -26.958 1.00 0.00 O ATOM 701 OE2 GLU A 46 39.809 -19.728 -27.838 1.00 0.00 O ATOM 0 H GLU A 46 38.239 -17.524 -25.067 1.00 0.00 H new ATOM 0 HA GLU A 46 37.024 -19.668 -23.564 1.00 0.00 H new ATOM 0 HB2 GLU A 46 39.831 -19.382 -24.702 1.00 0.00 H new ATOM 0 HB3 GLU A 46 39.075 -20.870 -24.168 1.00 0.00 H new ATOM 0 HG2 GLU A 46 37.534 -20.874 -25.985 1.00 0.00 H new ATOM 0 HG3 GLU A 46 37.863 -19.199 -26.379 1.00 0.00 H new ATOM 708 N ARG A 47 39.645 -18.047 -22.348 1.00 0.00 N ATOM 709 CA ARG A 47 40.368 -17.749 -21.117 1.00 0.00 C ATOM 710 C ARG A 47 39.431 -17.162 -20.065 1.00 0.00 C ATOM 711 O ARG A 47 39.579 -17.426 -18.871 1.00 0.00 O ATOM 712 CB ARG A 47 41.512 -16.773 -21.397 1.00 0.00 C ATOM 713 CG ARG A 47 41.095 -15.312 -21.339 1.00 0.00 C ATOM 714 CD ARG A 47 41.265 -14.740 -19.940 1.00 0.00 C ATOM 715 NE ARG A 47 42.597 -14.177 -19.737 1.00 0.00 N ATOM 716 CZ ARG A 47 43.125 -13.953 -18.539 1.00 0.00 C ATOM 717 NH1 ARG A 47 42.438 -14.244 -17.443 1.00 0.00 N ATOM 718 NH2 ARG A 47 44.344 -13.439 -18.436 1.00 0.00 N ATOM 0 H ARG A 47 40.004 -17.570 -23.175 1.00 0.00 H new ATOM 0 HA ARG A 47 40.780 -18.682 -20.732 1.00 0.00 H new ATOM 0 HB2 ARG A 47 42.309 -16.943 -20.673 1.00 0.00 H new ATOM 0 HB3 ARG A 47 41.926 -16.985 -22.383 1.00 0.00 H new ATOM 0 HG2 ARG A 47 41.691 -14.734 -22.045 1.00 0.00 H new ATOM 0 HG3 ARG A 47 40.054 -15.217 -21.648 1.00 0.00 H new ATOM 0 HD2 ARG A 47 40.515 -13.967 -19.771 1.00 0.00 H new ATOM 0 HD3 ARG A 47 41.087 -15.524 -19.204 1.00 0.00 H new ATOM 0 HE ARG A 47 43.152 -13.943 -20.560 1.00 0.00 H new ATOM 0 HH11 ARG A 47 41.501 -14.641 -17.519 1.00 0.00 H new ATOM 0 HH12 ARG A 47 42.846 -14.071 -16.524 1.00 0.00 H new ATOM 0 HH21 ARG A 47 44.876 -13.216 -19.277 1.00 0.00 H new ATOM 0 HH22 ARG A 47 44.749 -13.267 -17.516 1.00 0.00 H new ATOM 732 N VAL A 48 38.467 -16.366 -20.516 1.00 0.00 N ATOM 733 CA VAL A 48 37.506 -15.743 -19.613 1.00 0.00 C ATOM 734 C VAL A 48 36.495 -16.761 -19.099 1.00 0.00 C ATOM 735 O VAL A 48 36.151 -16.767 -17.917 1.00 0.00 O ATOM 736 CB VAL A 48 36.753 -14.591 -20.305 1.00 0.00 C ATOM 737 CG1 VAL A 48 37.721 -13.498 -20.729 1.00 0.00 C ATOM 738 CG2 VAL A 48 35.966 -15.111 -21.498 1.00 0.00 C ATOM 0 H VAL A 48 38.331 -16.137 -21.501 1.00 0.00 H new ATOM 0 HA VAL A 48 38.073 -15.344 -18.772 1.00 0.00 H new ATOM 0 HB VAL A 48 36.048 -14.161 -19.593 1.00 0.00 H new ATOM 0 HG11 VAL A 48 37.170 -12.693 -21.216 1.00 0.00 H new ATOM 0 HG12 VAL A 48 38.235 -13.107 -19.851 1.00 0.00 H new ATOM 0 HG13 VAL A 48 38.453 -13.910 -21.424 1.00 0.00 H new ATOM 0 HG21 VAL A 48 35.440 -14.284 -21.975 1.00 0.00 H new ATOM 0 HG22 VAL A 48 36.650 -15.568 -22.214 1.00 0.00 H new ATOM 0 HG23 VAL A 48 35.244 -15.854 -21.161 1.00 0.00 H new ATOM 748 N ARG A 49 36.022 -17.621 -19.995 1.00 0.00 N ATOM 749 CA ARG A 49 35.049 -18.644 -19.632 1.00 0.00 C ATOM 750 C ARG A 49 35.591 -19.542 -18.524 1.00 0.00 C ATOM 751 O ARG A 49 34.875 -19.888 -17.585 1.00 0.00 O ATOM 752 CB ARG A 49 34.685 -19.489 -20.855 1.00 0.00 C ATOM 753 CG ARG A 49 33.372 -19.085 -21.505 1.00 0.00 C ATOM 754 CD ARG A 49 33.375 -19.384 -22.996 1.00 0.00 C ATOM 755 NE ARG A 49 32.058 -19.797 -23.474 1.00 0.00 N ATOM 756 CZ ARG A 49 31.860 -20.444 -24.617 1.00 0.00 C ATOM 757 NH1 ARG A 49 32.889 -20.750 -25.396 1.00 0.00 N ATOM 758 NH2 ARG A 49 30.632 -20.786 -24.983 1.00 0.00 N ATOM 0 H ARG A 49 36.297 -17.630 -20.977 1.00 0.00 H new ATOM 0 HA ARG A 49 34.153 -18.143 -19.265 1.00 0.00 H new ATOM 0 HB2 ARG A 49 35.485 -19.410 -21.592 1.00 0.00 H new ATOM 0 HB3 ARG A 49 34.627 -20.536 -20.558 1.00 0.00 H new ATOM 0 HG2 ARG A 49 32.549 -19.617 -21.027 1.00 0.00 H new ATOM 0 HG3 ARG A 49 33.198 -18.021 -21.346 1.00 0.00 H new ATOM 0 HD2 ARG A 49 33.698 -18.498 -23.543 1.00 0.00 H new ATOM 0 HD3 ARG A 49 34.100 -20.170 -23.207 1.00 0.00 H new ATOM 0 HE ARG A 49 31.245 -19.576 -22.898 1.00 0.00 H new ATOM 0 HH11 ARG A 49 33.835 -20.488 -25.118 1.00 0.00 H new ATOM 0 HH12 ARG A 49 32.734 -21.247 -26.273 1.00 0.00 H new ATOM 0 HH21 ARG A 49 29.838 -20.552 -24.387 1.00 0.00 H new ATOM 0 HH22 ARG A 49 30.481 -21.283 -25.861 1.00 0.00 H new ATOM 772 N ALA A 50 36.862 -19.915 -18.640 1.00 0.00 N ATOM 773 CA ALA A 50 37.500 -20.770 -17.647 1.00 0.00 C ATOM 774 C ALA A 50 37.678 -20.036 -16.323 1.00 0.00 C ATOM 775 O ALA A 50 37.173 -20.472 -15.289 1.00 0.00 O ATOM 776 CB ALA A 50 38.844 -21.265 -18.163 1.00 0.00 C ATOM 0 H ALA A 50 37.469 -19.638 -19.411 1.00 0.00 H new ATOM 0 HA ALA A 50 36.851 -21.628 -17.472 1.00 0.00 H new ATOM 0 HB1 ALA A 50 39.310 -21.902 -17.412 1.00 0.00 H new ATOM 0 HB2 ALA A 50 38.694 -21.835 -19.080 1.00 0.00 H new ATOM 0 HB3 ALA A 50 39.492 -20.412 -18.367 1.00 0.00 H new ATOM 782 N GLU A 51 38.400 -18.920 -16.362 1.00 0.00 N ATOM 783 CA GLU A 51 38.646 -18.127 -15.163 1.00 0.00 C ATOM 784 C GLU A 51 37.332 -17.738 -14.490 1.00 0.00 C ATOM 785 O GLU A 51 37.220 -17.759 -13.264 1.00 0.00 O ATOM 786 CB GLU A 51 39.446 -16.870 -15.511 1.00 0.00 C ATOM 787 CG GLU A 51 40.868 -17.159 -15.962 1.00 0.00 C ATOM 788 CD GLU A 51 41.515 -18.278 -15.169 1.00 0.00 C ATOM 789 OE1 GLU A 51 41.533 -18.188 -13.923 1.00 0.00 O ATOM 790 OE2 GLU A 51 42.005 -19.242 -15.793 1.00 0.00 O ATOM 0 H GLU A 51 38.824 -18.545 -17.210 1.00 0.00 H new ATOM 0 HA GLU A 51 39.225 -18.735 -14.468 1.00 0.00 H new ATOM 0 HB2 GLU A 51 38.927 -16.326 -16.300 1.00 0.00 H new ATOM 0 HB3 GLU A 51 39.476 -16.216 -14.640 1.00 0.00 H new ATOM 0 HG2 GLU A 51 40.863 -17.424 -17.019 1.00 0.00 H new ATOM 0 HG3 GLU A 51 41.468 -16.254 -15.863 1.00 0.00 H new ATOM 797 N LEU A 52 36.342 -17.382 -15.301 1.00 0.00 N ATOM 798 CA LEU A 52 35.036 -16.987 -14.786 1.00 0.00 C ATOM 799 C LEU A 52 34.381 -18.134 -14.023 1.00 0.00 C ATOM 800 O LEU A 52 33.938 -17.965 -12.888 1.00 0.00 O ATOM 801 CB LEU A 52 34.128 -16.539 -15.933 1.00 0.00 C ATOM 802 CG LEU A 52 32.764 -15.978 -15.528 1.00 0.00 C ATOM 803 CD1 LEU A 52 32.253 -15.007 -16.582 1.00 0.00 C ATOM 804 CD2 LEU A 52 31.766 -17.106 -15.311 1.00 0.00 C ATOM 0 H LEU A 52 36.419 -17.359 -16.318 1.00 0.00 H new ATOM 0 HA LEU A 52 35.181 -16.154 -14.098 1.00 0.00 H new ATOM 0 HB2 LEU A 52 34.654 -15.779 -16.511 1.00 0.00 H new ATOM 0 HB3 LEU A 52 33.967 -17.389 -16.596 1.00 0.00 H new ATOM 0 HG LEU A 52 32.879 -15.437 -14.589 1.00 0.00 H new ATOM 0 HD11 LEU A 52 31.282 -14.618 -16.278 1.00 0.00 H new ATOM 0 HD12 LEU A 52 32.957 -14.182 -16.689 1.00 0.00 H new ATOM 0 HD13 LEU A 52 32.153 -15.525 -17.536 1.00 0.00 H new ATOM 0 HD21 LEU A 52 30.801 -16.688 -15.023 1.00 0.00 H new ATOM 0 HD22 LEU A 52 31.654 -17.675 -16.234 1.00 0.00 H new ATOM 0 HD23 LEU A 52 32.127 -17.764 -14.520 1.00 0.00 H new ATOM 816 N ALA A 53 34.327 -19.303 -14.654 1.00 0.00 N ATOM 817 CA ALA A 53 33.731 -20.479 -14.033 1.00 0.00 C ATOM 818 C ALA A 53 34.461 -20.850 -12.747 1.00 0.00 C ATOM 819 O ALA A 53 33.867 -21.410 -11.825 1.00 0.00 O ATOM 820 CB ALA A 53 33.740 -21.650 -15.005 1.00 0.00 C ATOM 0 H ALA A 53 34.689 -19.460 -15.595 1.00 0.00 H new ATOM 0 HA ALA A 53 32.698 -20.241 -13.777 1.00 0.00 H new ATOM 0 HB1 ALA A 53 33.292 -22.522 -14.528 1.00 0.00 H new ATOM 0 HB2 ALA A 53 33.167 -21.389 -15.895 1.00 0.00 H new ATOM 0 HB3 ALA A 53 34.767 -21.879 -15.289 1.00 0.00 H new ATOM 826 N ARG A 54 35.751 -20.535 -12.692 1.00 0.00 N ATOM 827 CA ARG A 54 36.562 -20.837 -11.519 1.00 0.00 C ATOM 828 C ARG A 54 36.373 -19.776 -10.439 1.00 0.00 C ATOM 829 O ARG A 54 36.576 -20.038 -9.254 1.00 0.00 O ATOM 830 CB ARG A 54 38.039 -20.931 -11.904 1.00 0.00 C ATOM 831 CG ARG A 54 38.388 -22.192 -12.678 1.00 0.00 C ATOM 832 CD ARG A 54 39.758 -22.086 -13.328 1.00 0.00 C ATOM 833 NE ARG A 54 40.301 -23.396 -13.679 1.00 0.00 N ATOM 834 CZ ARG A 54 40.721 -24.281 -12.782 1.00 0.00 C ATOM 835 NH1 ARG A 54 40.662 -23.999 -11.488 1.00 0.00 N ATOM 836 NH2 ARG A 54 41.202 -25.452 -13.179 1.00 0.00 N ATOM 0 H ARG A 54 36.257 -20.071 -13.446 1.00 0.00 H new ATOM 0 HA ARG A 54 36.236 -21.798 -11.121 1.00 0.00 H new ATOM 0 HB2 ARG A 54 38.305 -20.061 -12.504 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.645 -20.891 -10.999 1.00 0.00 H new ATOM 0 HG2 ARG A 54 38.369 -23.050 -12.006 1.00 0.00 H new ATOM 0 HG3 ARG A 54 37.634 -22.370 -13.444 1.00 0.00 H new ATOM 0 HD2 ARG A 54 39.687 -21.471 -14.225 1.00 0.00 H new ATOM 0 HD3 ARG A 54 40.443 -21.580 -12.648 1.00 0.00 H new ATOM 0 HE ARG A 54 40.361 -23.645 -14.666 1.00 0.00 H new ATOM 0 HH11 ARG A 54 40.293 -23.100 -11.178 1.00 0.00 H new ATOM 0 HH12 ARG A 54 40.985 -24.681 -10.802 1.00 0.00 H new ATOM 0 HH21 ARG A 54 41.249 -25.673 -14.174 1.00 0.00 H new ATOM 0 HH22 ARG A 54 41.524 -26.131 -12.490 1.00 0.00 H new ATOM 850 N PHE A 55 35.984 -18.576 -10.858 1.00 0.00 N ATOM 851 CA PHE A 55 35.770 -17.474 -9.928 1.00 0.00 C ATOM 852 C PHE A 55 34.353 -17.507 -9.363 1.00 0.00 C ATOM 853 O PHE A 55 34.136 -17.234 -8.181 1.00 0.00 O ATOM 854 CB PHE A 55 36.023 -16.135 -10.623 1.00 0.00 C ATOM 855 CG PHE A 55 36.416 -15.034 -9.679 1.00 0.00 C ATOM 856 CD1 PHE A 55 37.505 -15.182 -8.836 1.00 0.00 C ATOM 857 CD2 PHE A 55 35.695 -13.851 -9.636 1.00 0.00 C ATOM 858 CE1 PHE A 55 37.869 -14.171 -7.966 1.00 0.00 C ATOM 859 CE2 PHE A 55 36.055 -12.837 -8.769 1.00 0.00 C ATOM 860 CZ PHE A 55 37.142 -12.997 -7.933 1.00 0.00 C ATOM 0 H PHE A 55 35.811 -18.342 -11.836 1.00 0.00 H new ATOM 0 HA PHE A 55 36.474 -17.586 -9.103 1.00 0.00 H new ATOM 0 HB2 PHE A 55 36.810 -16.264 -11.366 1.00 0.00 H new ATOM 0 HB3 PHE A 55 35.122 -15.838 -11.160 1.00 0.00 H new ATOM 0 HD1 PHE A 55 38.077 -16.098 -8.859 1.00 0.00 H new ATOM 0 HD2 PHE A 55 34.843 -13.720 -10.287 1.00 0.00 H new ATOM 0 HE1 PHE A 55 38.720 -14.299 -7.314 1.00 0.00 H new ATOM 0 HE2 PHE A 55 35.486 -11.919 -8.745 1.00 0.00 H new ATOM 0 HZ PHE A 55 37.423 -12.205 -7.254 1.00 0.00 H new ATOM 989 N MET B 1 31.060 -10.329 -31.026 1.00 0.00 N ATOM 990 CA MET B 1 30.692 -10.265 -29.617 1.00 0.00 C ATOM 991 C MET B 1 30.090 -11.587 -29.151 1.00 0.00 C ATOM 992 O MET B 1 29.082 -12.046 -29.691 1.00 0.00 O ATOM 993 CB MET B 1 29.699 -9.127 -29.378 1.00 0.00 C ATOM 994 CG MET B 1 30.260 -7.752 -29.703 1.00 0.00 C ATOM 995 SD MET B 1 30.248 -6.643 -28.282 1.00 0.00 S ATOM 996 CE MET B 1 31.198 -7.596 -27.100 1.00 0.00 C ATOM 0 H1 MET B 1 31.803 -9.628 -31.223 1.00 0.00 H new ATOM 0 H2 MET B 1 31.414 -11.281 -31.249 1.00 0.00 H new ATOM 0 H3 MET B 1 30.226 -10.123 -31.612 1.00 0.00 H new ATOM 0 HA MET B 1 31.597 -10.075 -29.040 1.00 0.00 H new ATOM 0 HB2 MET B 1 28.809 -9.299 -29.983 1.00 0.00 H new ATOM 0 HB3 MET B 1 29.383 -9.144 -28.335 1.00 0.00 H new ATOM 0 HG2 MET B 1 31.282 -7.858 -30.068 1.00 0.00 H new ATOM 0 HG3 MET B 1 29.678 -7.308 -30.510 1.00 0.00 H new ATOM 0 HE1 MET B 1 31.754 -6.920 -26.450 1.00 0.00 H new ATOM 0 HE2 MET B 1 30.524 -8.205 -26.498 1.00 0.00 H new ATOM 0 HE3 MET B 1 31.895 -8.244 -27.631 1.00 0.00 H new ATOM 1006 N LEU B 2 30.713 -12.195 -28.148 1.00 0.00 N ATOM 1007 CA LEU B 2 30.238 -13.466 -27.610 1.00 0.00 C ATOM 1008 C LEU B 2 29.886 -13.333 -26.132 1.00 0.00 C ATOM 1009 O LEU B 2 30.735 -12.990 -25.310 1.00 0.00 O ATOM 1010 CB LEU B 2 31.300 -14.550 -27.798 1.00 0.00 C ATOM 1011 CG LEU B 2 30.789 -15.918 -28.252 1.00 0.00 C ATOM 1012 CD1 LEU B 2 31.938 -16.909 -28.357 1.00 0.00 C ATOM 1013 CD2 LEU B 2 29.724 -16.434 -27.295 1.00 0.00 C ATOM 0 H LEU B 2 31.548 -11.829 -27.690 1.00 0.00 H new ATOM 0 HA LEU B 2 29.338 -13.750 -28.155 1.00 0.00 H new ATOM 0 HB2 LEU B 2 32.027 -14.195 -28.528 1.00 0.00 H new ATOM 0 HB3 LEU B 2 31.831 -14.677 -26.855 1.00 0.00 H new ATOM 0 HG LEU B 2 30.340 -15.807 -29.239 1.00 0.00 H new ATOM 0 HD11 LEU B 2 31.555 -17.877 -28.681 1.00 0.00 H new ATOM 0 HD12 LEU B 2 32.667 -16.546 -29.082 1.00 0.00 H new ATOM 0 HD13 LEU B 2 32.416 -17.016 -27.383 1.00 0.00 H new ATOM 0 HD21 LEU B 2 29.372 -17.408 -27.634 1.00 0.00 H new ATOM 0 HD22 LEU B 2 30.148 -16.529 -26.295 1.00 0.00 H new ATOM 0 HD23 LEU B 2 28.888 -15.735 -27.270 1.00 0.00 H new ATOM 1025 N MET B 3 28.629 -13.611 -25.801 1.00 0.00 N ATOM 1026 CA MET B 3 28.166 -13.526 -24.421 1.00 0.00 C ATOM 1027 C MET B 3 28.998 -14.425 -23.512 1.00 0.00 C ATOM 1028 O MET B 3 29.040 -15.642 -23.698 1.00 0.00 O ATOM 1029 CB MET B 3 26.689 -13.916 -24.331 1.00 0.00 C ATOM 1030 CG MET B 3 25.922 -13.151 -23.265 1.00 0.00 C ATOM 1031 SD MET B 3 24.639 -14.147 -22.483 1.00 0.00 S ATOM 1032 CE MET B 3 24.551 -13.378 -20.868 1.00 0.00 C ATOM 0 H MET B 3 27.913 -13.897 -26.469 1.00 0.00 H new ATOM 0 HA MET B 3 28.283 -12.495 -24.088 1.00 0.00 H new ATOM 0 HB2 MET B 3 26.217 -13.746 -25.299 1.00 0.00 H new ATOM 0 HB3 MET B 3 26.616 -14.984 -24.124 1.00 0.00 H new ATOM 0 HG2 MET B 3 26.618 -12.800 -22.504 1.00 0.00 H new ATOM 0 HG3 MET B 3 25.468 -12.267 -23.713 1.00 0.00 H new ATOM 0 HE1 MET B 3 24.838 -14.101 -20.105 1.00 0.00 H new ATOM 0 HE2 MET B 3 25.229 -12.526 -20.833 1.00 0.00 H new ATOM 0 HE3 MET B 3 23.532 -13.038 -20.682 1.00 0.00 H new ATOM 1042 N ILE B 4 29.657 -13.819 -22.531 1.00 0.00 N ATOM 1043 CA ILE B 4 30.487 -14.566 -21.593 1.00 0.00 C ATOM 1044 C ILE B 4 29.635 -15.253 -20.532 1.00 0.00 C ATOM 1045 O ILE B 4 29.816 -16.437 -20.243 1.00 0.00 O ATOM 1046 CB ILE B 4 31.514 -13.653 -20.899 1.00 0.00 C ATOM 1047 CG1 ILE B 4 32.506 -13.094 -21.922 1.00 0.00 C ATOM 1048 CG2 ILE B 4 32.247 -14.415 -19.805 1.00 0.00 C ATOM 1049 CD1 ILE B 4 33.168 -14.161 -22.766 1.00 0.00 C ATOM 0 H ILE B 4 29.633 -12.813 -22.364 1.00 0.00 H new ATOM 0 HA ILE B 4 31.018 -15.320 -22.173 1.00 0.00 H new ATOM 0 HB ILE B 4 30.984 -12.818 -20.441 1.00 0.00 H new ATOM 0 HG12 ILE B 4 31.985 -12.395 -22.577 1.00 0.00 H new ATOM 0 HG13 ILE B 4 33.275 -12.527 -21.398 1.00 0.00 H new ATOM 0 HG21 ILE B 4 32.970 -13.756 -19.324 1.00 0.00 H new ATOM 0 HG22 ILE B 4 31.529 -14.769 -19.065 1.00 0.00 H new ATOM 0 HG23 ILE B 4 32.768 -15.267 -20.242 1.00 0.00 H new ATOM 0 HD11 ILE B 4 33.858 -13.693 -23.469 1.00 0.00 H new ATOM 0 HD12 ILE B 4 33.717 -14.847 -22.121 1.00 0.00 H new ATOM 0 HD13 ILE B 4 32.407 -14.713 -23.318 1.00 0.00 H new ATOM 1061 N THR B 5 28.702 -14.503 -19.953 1.00 0.00 N ATOM 1062 CA THR B 5 27.821 -15.039 -18.923 1.00 0.00 C ATOM 1063 C THR B 5 26.781 -14.008 -18.499 1.00 0.00 C ATOM 1064 O THR B 5 26.734 -12.902 -19.036 1.00 0.00 O ATOM 1065 CB THR B 5 28.615 -15.491 -17.683 1.00 0.00 C ATOM 1066 OG1 THR B 5 27.779 -16.274 -16.824 1.00 0.00 O ATOM 1067 CG2 THR B 5 29.153 -14.291 -16.918 1.00 0.00 C ATOM 0 H THR B 5 28.537 -13.522 -20.180 1.00 0.00 H new ATOM 0 HA THR B 5 27.317 -15.903 -19.356 1.00 0.00 H new ATOM 0 HB THR B 5 29.457 -16.096 -18.019 1.00 0.00 H new ATOM 0 HG1 THR B 5 28.292 -16.559 -16.039 1.00 0.00 H new ATOM 0 HG21 THR B 5 29.710 -14.635 -16.047 1.00 0.00 H new ATOM 0 HG22 THR B 5 29.812 -13.713 -17.565 1.00 0.00 H new ATOM 0 HG23 THR B 5 28.322 -13.664 -16.593 1.00 0.00 H new ATOM 1075 N SER B 6 25.949 -14.378 -17.531 1.00 0.00 N ATOM 1076 CA SER B 6 24.907 -13.486 -17.036 1.00 0.00 C ATOM 1077 C SER B 6 24.870 -13.487 -15.511 1.00 0.00 C ATOM 1078 O SER B 6 24.786 -14.541 -14.881 1.00 0.00 O ATOM 1079 CB SER B 6 23.543 -13.903 -17.591 1.00 0.00 C ATOM 1080 OG SER B 6 22.888 -14.802 -16.713 1.00 0.00 O ATOM 0 H SER B 6 25.976 -15.289 -17.074 1.00 0.00 H new ATOM 0 HA SER B 6 25.136 -12.476 -17.376 1.00 0.00 H new ATOM 0 HB2 SER B 6 22.923 -13.020 -17.741 1.00 0.00 H new ATOM 0 HB3 SER B 6 23.672 -14.372 -18.567 1.00 0.00 H new ATOM 0 HG SER B 6 23.540 -15.184 -16.089 1.00 0.00 H new ATOM 1086 N PHE B 7 24.932 -12.297 -14.923 1.00 0.00 N ATOM 1087 CA PHE B 7 24.907 -12.158 -13.472 1.00 0.00 C ATOM 1088 C PHE B 7 23.659 -11.406 -13.018 1.00 0.00 C ATOM 1089 O PHE B 7 22.991 -10.751 -13.818 1.00 0.00 O ATOM 1090 CB PHE B 7 26.160 -11.429 -12.986 1.00 0.00 C ATOM 1091 CG PHE B 7 27.432 -12.186 -13.241 1.00 0.00 C ATOM 1092 CD1 PHE B 7 27.506 -13.547 -12.989 1.00 0.00 C ATOM 1093 CD2 PHE B 7 28.553 -11.538 -13.733 1.00 0.00 C ATOM 1094 CE1 PHE B 7 28.675 -14.247 -13.223 1.00 0.00 C ATOM 1095 CE2 PHE B 7 29.724 -12.233 -13.970 1.00 0.00 C ATOM 1096 CZ PHE B 7 29.785 -13.589 -13.714 1.00 0.00 C ATOM 0 H PHE B 7 25.000 -11.414 -15.430 1.00 0.00 H new ATOM 0 HA PHE B 7 24.885 -13.157 -13.038 1.00 0.00 H new ATOM 0 HB2 PHE B 7 26.220 -10.458 -13.478 1.00 0.00 H new ATOM 0 HB3 PHE B 7 26.068 -11.239 -11.917 1.00 0.00 H new ATOM 0 HD1 PHE B 7 26.640 -14.067 -12.605 1.00 0.00 H new ATOM 0 HD2 PHE B 7 28.512 -10.478 -13.934 1.00 0.00 H new ATOM 0 HE1 PHE B 7 28.720 -15.307 -13.022 1.00 0.00 H new ATOM 0 HE2 PHE B 7 30.591 -11.716 -14.355 1.00 0.00 H new ATOM 0 HZ PHE B 7 30.699 -14.134 -13.898 1.00 0.00 H new ATOM 1106 N ALA B 8 23.350 -11.506 -11.730 1.00 0.00 N ATOM 1107 CA ALA B 8 22.184 -10.835 -11.169 1.00 0.00 C ATOM 1108 C ALA B 8 22.581 -9.914 -10.020 1.00 0.00 C ATOM 1109 O ALA B 8 21.777 -9.633 -9.132 1.00 0.00 O ATOM 1110 CB ALA B 8 21.161 -11.858 -10.699 1.00 0.00 C ATOM 0 H ALA B 8 23.891 -12.046 -11.055 1.00 0.00 H new ATOM 0 HA ALA B 8 21.736 -10.224 -11.952 1.00 0.00 H new ATOM 0 HB1 ALA B 8 20.296 -11.342 -10.282 1.00 0.00 H new ATOM 0 HB2 ALA B 8 20.846 -12.472 -11.543 1.00 0.00 H new ATOM 0 HB3 ALA B 8 21.607 -12.494 -9.934 1.00 0.00 H new ATOM 1116 N ASN B 9 23.825 -9.448 -10.043 1.00 0.00 N ATOM 1117 CA ASN B 9 24.328 -8.560 -9.002 1.00 0.00 C ATOM 1118 C ASN B 9 25.358 -7.587 -9.568 1.00 0.00 C ATOM 1119 O ASN B 9 26.189 -7.941 -10.406 1.00 0.00 O ATOM 1120 CB ASN B 9 24.950 -9.373 -7.865 1.00 0.00 C ATOM 1121 CG ASN B 9 24.040 -9.465 -6.656 1.00 0.00 C ATOM 1122 OD1 ASN B 9 23.902 -8.507 -5.894 1.00 0.00 O ATOM 1123 ND2 ASN B 9 23.414 -10.622 -6.473 1.00 0.00 N ATOM 0 H ASN B 9 24.503 -9.671 -10.771 1.00 0.00 H new ATOM 0 HA ASN B 9 23.487 -7.986 -8.612 1.00 0.00 H new ATOM 0 HB2 ASN B 9 25.178 -10.377 -8.222 1.00 0.00 H new ATOM 0 HB3 ASN B 9 25.895 -8.917 -7.571 1.00 0.00 H new ATOM 0 HD21 ASN B 9 22.789 -10.743 -5.676 1.00 0.00 H new ATOM 0 HD22 ASN B 9 23.558 -11.389 -7.130 1.00 0.00 H new ATOM 1130 N PRO B 10 25.305 -6.330 -9.101 1.00 0.00 N ATOM 1131 CA PRO B 10 26.226 -5.281 -9.546 1.00 0.00 C ATOM 1132 C PRO B 10 27.649 -5.509 -9.048 1.00 0.00 C ATOM 1133 O PRO B 10 28.606 -5.433 -9.819 1.00 0.00 O ATOM 1134 CB PRO B 10 25.641 -4.009 -8.926 1.00 0.00 C ATOM 1135 CG PRO B 10 24.880 -4.483 -7.736 1.00 0.00 C ATOM 1136 CD PRO B 10 24.341 -5.839 -8.102 1.00 0.00 C ATOM 0 HA PRO B 10 26.307 -5.244 -10.632 1.00 0.00 H new ATOM 0 HB2 PRO B 10 26.427 -3.310 -8.640 1.00 0.00 H new ATOM 0 HB3 PRO B 10 24.992 -3.488 -9.630 1.00 0.00 H new ATOM 0 HG2 PRO B 10 25.525 -4.543 -6.859 1.00 0.00 H new ATOM 0 HG3 PRO B 10 24.071 -3.795 -7.491 1.00 0.00 H new ATOM 0 HD2 PRO B 10 24.289 -6.498 -7.236 1.00 0.00 H new ATOM 0 HD3 PRO B 10 23.334 -5.774 -8.514 1.00 0.00 H new ATOM 1144 N ARG B 11 27.781 -5.790 -7.756 1.00 0.00 N ATOM 1145 CA ARG B 11 29.088 -6.029 -7.156 1.00 0.00 C ATOM 1146 C ARG B 11 29.841 -7.121 -7.910 1.00 0.00 C ATOM 1147 O ARG B 11 31.021 -6.971 -8.227 1.00 0.00 O ATOM 1148 CB ARG B 11 28.934 -6.423 -5.686 1.00 0.00 C ATOM 1149 CG ARG B 11 28.047 -5.478 -4.892 1.00 0.00 C ATOM 1150 CD ARG B 11 28.337 -5.561 -3.402 1.00 0.00 C ATOM 1151 NE ARG B 11 28.654 -4.254 -2.832 1.00 0.00 N ATOM 1152 CZ ARG B 11 28.823 -4.041 -1.532 1.00 0.00 C ATOM 1153 NH1 ARG B 11 28.707 -5.043 -0.671 1.00 0.00 N ATOM 1154 NH2 ARG B 11 29.110 -2.823 -1.090 1.00 0.00 N ATOM 0 H ARG B 11 26.999 -5.858 -7.105 1.00 0.00 H new ATOM 0 HA ARG B 11 29.663 -5.105 -7.219 1.00 0.00 H new ATOM 0 HB2 ARG B 11 28.520 -7.430 -5.630 1.00 0.00 H new ATOM 0 HB3 ARG B 11 29.920 -6.458 -5.223 1.00 0.00 H new ATOM 0 HG2 ARG B 11 28.202 -4.456 -5.237 1.00 0.00 H new ATOM 0 HG3 ARG B 11 27.000 -5.721 -5.074 1.00 0.00 H new ATOM 0 HD2 ARG B 11 27.473 -5.981 -2.887 1.00 0.00 H new ATOM 0 HD3 ARG B 11 29.171 -6.242 -3.232 1.00 0.00 H new ATOM 0 HE ARG B 11 28.751 -3.462 -3.467 1.00 0.00 H new ATOM 0 HH11 ARG B 11 28.487 -5.981 -1.007 1.00 0.00 H new ATOM 0 HH12 ARG B 11 28.837 -4.876 0.327 1.00 0.00 H new ATOM 0 HH21 ARG B 11 29.201 -2.050 -1.749 1.00 0.00 H new ATOM 0 HH22 ARG B 11 29.240 -2.660 -0.091 1.00 0.00 H new ATOM 1168 N VAL B 12 29.150 -8.221 -8.194 1.00 0.00 N ATOM 1169 CA VAL B 12 29.753 -9.339 -8.911 1.00 0.00 C ATOM 1170 C VAL B 12 30.117 -8.944 -10.338 1.00 0.00 C ATOM 1171 O VAL B 12 31.257 -9.115 -10.768 1.00 0.00 O ATOM 1172 CB VAL B 12 28.808 -10.554 -8.951 1.00 0.00 C ATOM 1173 CG1 VAL B 12 29.420 -11.679 -9.772 1.00 0.00 C ATOM 1174 CG2 VAL B 12 28.487 -11.026 -7.541 1.00 0.00 C ATOM 0 H VAL B 12 28.173 -8.362 -7.939 1.00 0.00 H new ATOM 0 HA VAL B 12 30.660 -9.611 -8.370 1.00 0.00 H new ATOM 0 HB VAL B 12 27.876 -10.252 -9.429 1.00 0.00 H new ATOM 0 HG11 VAL B 12 28.738 -12.529 -9.789 1.00 0.00 H new ATOM 0 HG12 VAL B 12 29.594 -11.333 -10.791 1.00 0.00 H new ATOM 0 HG13 VAL B 12 30.367 -11.982 -9.325 1.00 0.00 H new ATOM 0 HG21 VAL B 12 27.818 -11.885 -7.588 1.00 0.00 H new ATOM 0 HG22 VAL B 12 29.409 -11.311 -7.034 1.00 0.00 H new ATOM 0 HG23 VAL B 12 28.004 -10.220 -6.989 1.00 0.00 H new ATOM 1184 N ALA B 13 29.140 -8.415 -11.067 1.00 0.00 N ATOM 1185 CA ALA B 13 29.358 -7.993 -12.445 1.00 0.00 C ATOM 1186 C ALA B 13 30.600 -7.116 -12.561 1.00 0.00 C ATOM 1187 O ALA B 13 31.559 -7.471 -13.245 1.00 0.00 O ATOM 1188 CB ALA B 13 28.136 -7.253 -12.970 1.00 0.00 C ATOM 0 H ALA B 13 28.190 -8.268 -10.726 1.00 0.00 H new ATOM 0 HA ALA B 13 29.517 -8.885 -13.051 1.00 0.00 H new ATOM 0 HB1 ALA B 13 28.313 -6.944 -14.000 1.00 0.00 H new ATOM 0 HB2 ALA B 13 27.268 -7.911 -12.933 1.00 0.00 H new ATOM 0 HB3 ALA B 13 27.951 -6.373 -12.354 1.00 0.00 H new ATOM 1194 N GLN B 14 30.574 -5.969 -11.889 1.00 0.00 N ATOM 1195 CA GLN B 14 31.698 -5.041 -11.918 1.00 0.00 C ATOM 1196 C GLN B 14 32.983 -5.729 -11.471 1.00 0.00 C ATOM 1197 O GLN B 14 34.020 -5.613 -12.123 1.00 0.00 O ATOM 1198 CB GLN B 14 31.413 -3.834 -11.023 1.00 0.00 C ATOM 1199 CG GLN B 14 32.607 -2.908 -10.853 1.00 0.00 C ATOM 1200 CD GLN B 14 33.022 -2.246 -12.152 1.00 0.00 C ATOM 1201 OE1 GLN B 14 32.253 -1.495 -12.753 1.00 0.00 O ATOM 1202 NE2 GLN B 14 34.244 -2.520 -12.593 1.00 0.00 N ATOM 0 H GLN B 14 29.787 -5.661 -11.318 1.00 0.00 H new ATOM 0 HA GLN B 14 31.829 -4.700 -12.945 1.00 0.00 H new ATOM 0 HB2 GLN B 14 30.582 -3.268 -11.444 1.00 0.00 H new ATOM 0 HB3 GLN B 14 31.094 -4.187 -10.042 1.00 0.00 H new ATOM 0 HG2 GLN B 14 32.364 -2.139 -10.119 1.00 0.00 H new ATOM 0 HG3 GLN B 14 33.448 -3.475 -10.454 1.00 0.00 H new ATOM 0 HE21 GLN B 14 34.848 -3.148 -12.063 1.00 0.00 H new ATOM 0 HE22 GLN B 14 34.578 -2.102 -13.461 1.00 0.00 H new ATOM 1211 N ALA B 15 32.908 -6.445 -10.354 1.00 0.00 N ATOM 1212 CA ALA B 15 34.065 -7.153 -9.820 1.00 0.00 C ATOM 1213 C ALA B 15 34.697 -8.049 -10.880 1.00 0.00 C ATOM 1214 O ALA B 15 35.916 -8.065 -11.047 1.00 0.00 O ATOM 1215 CB ALA B 15 33.667 -7.972 -8.602 1.00 0.00 C ATOM 0 H ALA B 15 32.057 -6.550 -9.801 1.00 0.00 H new ATOM 0 HA ALA B 15 34.806 -6.413 -9.519 1.00 0.00 H new ATOM 0 HB1 ALA B 15 34.541 -8.495 -8.214 1.00 0.00 H new ATOM 0 HB2 ALA B 15 33.269 -7.310 -7.833 1.00 0.00 H new ATOM 0 HB3 ALA B 15 32.905 -8.698 -8.885 1.00 0.00 H new ATOM 1221 N PHE B 16 33.859 -8.796 -11.593 1.00 0.00 N ATOM 1222 CA PHE B 16 34.336 -9.697 -12.635 1.00 0.00 C ATOM 1223 C PHE B 16 35.076 -8.925 -13.724 1.00 0.00 C ATOM 1224 O PHE B 16 36.255 -9.167 -13.980 1.00 0.00 O ATOM 1225 CB PHE B 16 33.165 -10.469 -13.247 1.00 0.00 C ATOM 1226 CG PHE B 16 32.989 -11.845 -12.671 1.00 0.00 C ATOM 1227 CD1 PHE B 16 33.815 -12.886 -13.065 1.00 0.00 C ATOM 1228 CD2 PHE B 16 31.997 -12.098 -11.738 1.00 0.00 C ATOM 1229 CE1 PHE B 16 33.655 -14.153 -12.537 1.00 0.00 C ATOM 1230 CE2 PHE B 16 31.833 -13.363 -11.206 1.00 0.00 C ATOM 1231 CZ PHE B 16 32.663 -14.392 -11.607 1.00 0.00 C ATOM 0 H PHE B 16 32.847 -8.795 -11.468 1.00 0.00 H new ATOM 0 HA PHE B 16 35.030 -10.404 -12.180 1.00 0.00 H new ATOM 0 HB2 PHE B 16 32.247 -9.901 -13.097 1.00 0.00 H new ATOM 0 HB3 PHE B 16 33.317 -10.551 -14.323 1.00 0.00 H new ATOM 0 HD1 PHE B 16 34.592 -12.705 -13.793 1.00 0.00 H new ATOM 0 HD2 PHE B 16 31.344 -11.298 -11.423 1.00 0.00 H new ATOM 0 HE1 PHE B 16 34.305 -14.956 -12.852 1.00 0.00 H new ATOM 0 HE2 PHE B 16 31.057 -13.547 -10.478 1.00 0.00 H new ATOM 0 HZ PHE B 16 32.536 -15.382 -11.194 1.00 0.00 H new ATOM 1241 N VAL B 17 34.373 -7.996 -14.364 1.00 0.00 N ATOM 1242 CA VAL B 17 34.961 -7.187 -15.425 1.00 0.00 C ATOM 1243 C VAL B 17 36.171 -6.411 -14.918 1.00 0.00 C ATOM 1244 O VAL B 17 37.031 -6.003 -15.699 1.00 0.00 O ATOM 1245 CB VAL B 17 33.937 -6.196 -16.009 1.00 0.00 C ATOM 1246 CG1 VAL B 17 32.812 -6.942 -16.711 1.00 0.00 C ATOM 1247 CG2 VAL B 17 33.387 -5.293 -14.916 1.00 0.00 C ATOM 0 H VAL B 17 33.395 -7.785 -14.166 1.00 0.00 H new ATOM 0 HA VAL B 17 35.277 -7.875 -16.209 1.00 0.00 H new ATOM 0 HB VAL B 17 34.442 -5.571 -16.746 1.00 0.00 H new ATOM 0 HG11 VAL B 17 32.098 -6.225 -17.117 1.00 0.00 H new ATOM 0 HG12 VAL B 17 33.224 -7.543 -17.522 1.00 0.00 H new ATOM 0 HG13 VAL B 17 32.307 -7.593 -15.998 1.00 0.00 H new ATOM 0 HG21 VAL B 17 32.665 -4.599 -15.346 1.00 0.00 H new ATOM 0 HG22 VAL B 17 32.897 -5.900 -14.155 1.00 0.00 H new ATOM 0 HG23 VAL B 17 34.204 -4.732 -14.463 1.00 0.00 H new ATOM 1257 N ASP B 18 36.231 -6.211 -13.606 1.00 0.00 N ATOM 1258 CA ASP B 18 37.337 -5.484 -12.994 1.00 0.00 C ATOM 1259 C ASP B 18 38.613 -6.321 -13.011 1.00 0.00 C ATOM 1260 O ASP B 18 39.622 -5.920 -13.591 1.00 0.00 O ATOM 1261 CB ASP B 18 36.987 -5.096 -11.557 1.00 0.00 C ATOM 1262 CG ASP B 18 38.010 -4.160 -10.944 1.00 0.00 C ATOM 1263 OD1 ASP B 18 38.609 -3.363 -11.695 1.00 0.00 O ATOM 1264 OD2 ASP B 18 38.212 -4.225 -9.713 1.00 0.00 O ATOM 0 H ASP B 18 35.527 -6.542 -12.946 1.00 0.00 H new ATOM 0 HA ASP B 18 37.510 -4.578 -13.575 1.00 0.00 H new ATOM 0 HB2 ASP B 18 36.007 -4.619 -11.541 1.00 0.00 H new ATOM 0 HB3 ASP B 18 36.913 -5.997 -10.948 1.00 0.00 H new ATOM 1269 N TYR B 19 38.560 -7.484 -12.371 1.00 0.00 N ATOM 1270 CA TYR B 19 39.712 -8.375 -12.310 1.00 0.00 C ATOM 1271 C TYR B 19 40.089 -8.875 -13.701 1.00 0.00 C ATOM 1272 O TYR B 19 41.235 -9.249 -13.949 1.00 0.00 O ATOM 1273 CB TYR B 19 39.417 -9.563 -11.392 1.00 0.00 C ATOM 1274 CG TYR B 19 39.108 -10.841 -12.137 1.00 0.00 C ATOM 1275 CD1 TYR B 19 40.128 -11.661 -12.603 1.00 0.00 C ATOM 1276 CD2 TYR B 19 37.795 -11.230 -12.375 1.00 0.00 C ATOM 1277 CE1 TYR B 19 39.850 -12.830 -13.285 1.00 0.00 C ATOM 1278 CE2 TYR B 19 37.508 -12.398 -13.055 1.00 0.00 C ATOM 1279 CZ TYR B 19 38.538 -13.194 -13.508 1.00 0.00 C ATOM 1280 OH TYR B 19 38.258 -14.358 -14.186 1.00 0.00 O ATOM 0 H TYR B 19 37.732 -7.831 -11.887 1.00 0.00 H new ATOM 0 HA TYR B 19 40.553 -7.812 -11.906 1.00 0.00 H new ATOM 0 HB2 TYR B 19 40.275 -9.730 -10.741 1.00 0.00 H new ATOM 0 HB3 TYR B 19 38.573 -9.314 -10.749 1.00 0.00 H new ATOM 0 HD1 TYR B 19 41.156 -11.380 -12.429 1.00 0.00 H new ATOM 0 HD2 TYR B 19 36.985 -10.609 -12.022 1.00 0.00 H new ATOM 0 HE1 TYR B 19 40.655 -13.455 -13.642 1.00 0.00 H new ATOM 0 HE2 TYR B 19 36.482 -12.686 -13.231 1.00 0.00 H new ATOM 0 HH TYR B 19 37.287 -14.469 -14.258 1.00 0.00 H new ATOM 1290 N MET B 20 39.116 -8.876 -14.606 1.00 0.00 N ATOM 1291 CA MET B 20 39.345 -9.328 -15.973 1.00 0.00 C ATOM 1292 C MET B 20 40.021 -8.238 -16.800 1.00 0.00 C ATOM 1293 O MET B 20 40.935 -8.512 -17.576 1.00 0.00 O ATOM 1294 CB MET B 20 38.023 -9.734 -16.627 1.00 0.00 C ATOM 1295 CG MET B 20 37.590 -11.152 -16.293 1.00 0.00 C ATOM 1296 SD MET B 20 38.033 -12.334 -17.581 1.00 0.00 S ATOM 1297 CE MET B 20 39.669 -12.825 -17.042 1.00 0.00 C ATOM 0 H MET B 20 38.162 -8.569 -14.417 1.00 0.00 H new ATOM 0 HA MET B 20 40.005 -10.194 -15.937 1.00 0.00 H new ATOM 0 HB2 MET B 20 37.243 -9.041 -16.311 1.00 0.00 H new ATOM 0 HB3 MET B 20 38.117 -9.637 -17.709 1.00 0.00 H new ATOM 0 HG2 MET B 20 38.049 -11.456 -15.352 1.00 0.00 H new ATOM 0 HG3 MET B 20 36.511 -11.172 -16.142 1.00 0.00 H new ATOM 0 HE1 MET B 20 40.404 -12.518 -17.786 1.00 0.00 H new ATOM 0 HE2 MET B 20 39.896 -12.348 -16.089 1.00 0.00 H new ATOM 0 HE3 MET B 20 39.703 -13.908 -16.923 1.00 0.00 H new ATOM 1307 N ALA B 21 39.564 -7.002 -16.627 1.00 0.00 N ATOM 1308 CA ALA B 21 40.126 -5.871 -17.355 1.00 0.00 C ATOM 1309 C ALA B 21 41.583 -5.640 -16.971 1.00 0.00 C ATOM 1310 O ALA B 21 42.428 -5.373 -17.827 1.00 0.00 O ATOM 1311 CB ALA B 21 39.305 -4.616 -17.098 1.00 0.00 C ATOM 0 H ALA B 21 38.806 -6.759 -15.989 1.00 0.00 H new ATOM 0 HA ALA B 21 40.090 -6.103 -18.419 1.00 0.00 H new ATOM 0 HB1 ALA B 21 39.737 -3.780 -17.648 1.00 0.00 H new ATOM 0 HB2 ALA B 21 38.279 -4.778 -17.430 1.00 0.00 H new ATOM 0 HB3 ALA B 21 39.310 -4.390 -16.032 1.00 0.00 H new ATOM 1317 N THR B 22 41.873 -5.743 -15.678 1.00 0.00 N ATOM 1318 CA THR B 22 43.228 -5.543 -15.180 1.00 0.00 C ATOM 1319 C THR B 22 44.132 -6.710 -15.562 1.00 0.00 C ATOM 1320 O THR B 22 45.353 -6.625 -15.443 1.00 0.00 O ATOM 1321 CB THR B 22 43.245 -5.375 -13.649 1.00 0.00 C ATOM 1322 OG1 THR B 22 44.564 -5.035 -13.208 1.00 0.00 O ATOM 1323 CG2 THR B 22 42.788 -6.652 -12.959 1.00 0.00 C ATOM 0 H THR B 22 41.187 -5.964 -14.956 1.00 0.00 H new ATOM 0 HA THR B 22 43.603 -4.630 -15.642 1.00 0.00 H new ATOM 0 HB THR B 22 42.556 -4.572 -13.386 1.00 0.00 H new ATOM 0 HG1 THR B 22 45.218 -5.327 -13.877 1.00 0.00 H new ATOM 0 HG21 THR B 22 42.808 -6.509 -11.879 1.00 0.00 H new ATOM 0 HG22 THR B 22 41.773 -6.892 -13.274 1.00 0.00 H new ATOM 0 HG23 THR B 22 43.455 -7.470 -13.229 1.00 0.00 H new ATOM 1331 N GLN B 23 43.523 -7.799 -16.021 1.00 0.00 N ATOM 1332 CA GLN B 23 44.274 -8.983 -16.420 1.00 0.00 C ATOM 1333 C GLN B 23 44.601 -8.944 -17.909 1.00 0.00 C ATOM 1334 O GLN B 23 45.258 -9.841 -18.435 1.00 0.00 O ATOM 1335 CB GLN B 23 43.481 -10.250 -16.093 1.00 0.00 C ATOM 1336 CG GLN B 23 43.660 -10.726 -14.660 1.00 0.00 C ATOM 1337 CD GLN B 23 44.917 -11.552 -14.472 1.00 0.00 C ATOM 1338 OE1 GLN B 23 44.889 -12.779 -14.572 1.00 0.00 O ATOM 1339 NE2 GLN B 23 46.031 -10.882 -14.199 1.00 0.00 N ATOM 0 H GLN B 23 42.512 -7.885 -16.126 1.00 0.00 H new ATOM 0 HA GLN B 23 45.210 -8.994 -15.861 1.00 0.00 H new ATOM 0 HB2 GLN B 23 42.423 -10.064 -16.276 1.00 0.00 H new ATOM 0 HB3 GLN B 23 43.787 -11.046 -16.772 1.00 0.00 H new ATOM 0 HG2 GLN B 23 43.695 -9.862 -13.996 1.00 0.00 H new ATOM 0 HG3 GLN B 23 42.793 -11.319 -14.367 1.00 0.00 H new ATOM 0 HE21 GLN B 23 46.009 -9.865 -14.125 1.00 0.00 H new ATOM 0 HE22 GLN B 23 46.908 -11.385 -14.063 1.00 0.00 H new ATOM 1348 N GLY B 24 44.137 -7.897 -18.585 1.00 0.00 N ATOM 1349 CA GLY B 24 44.389 -7.761 -20.007 1.00 0.00 C ATOM 1350 C GLY B 24 43.186 -8.138 -20.849 1.00 0.00 C ATOM 1351 O GLY B 24 43.212 -8.013 -22.073 1.00 0.00 O ATOM 0 H GLY B 24 43.591 -7.141 -18.172 1.00 0.00 H new ATOM 0 HA2 GLY B 24 44.673 -6.732 -20.225 1.00 0.00 H new ATOM 0 HA3 GLY B 24 45.234 -8.391 -20.285 1.00 0.00 H new ATOM 1355 N VAL B 25 42.129 -8.602 -20.191 1.00 0.00 N ATOM 1356 CA VAL B 25 40.910 -9.000 -20.887 1.00 0.00 C ATOM 1357 C VAL B 25 39.778 -8.014 -20.619 1.00 0.00 C ATOM 1358 O VAL B 25 39.293 -7.902 -19.493 1.00 0.00 O ATOM 1359 CB VAL B 25 40.458 -10.410 -20.465 1.00 0.00 C ATOM 1360 CG1 VAL B 25 39.427 -10.955 -21.442 1.00 0.00 C ATOM 1361 CG2 VAL B 25 41.654 -11.345 -20.364 1.00 0.00 C ATOM 0 H VAL B 25 42.091 -8.712 -19.178 1.00 0.00 H new ATOM 0 HA VAL B 25 41.140 -9.004 -21.952 1.00 0.00 H new ATOM 0 HB VAL B 25 39.993 -10.344 -19.481 1.00 0.00 H new ATOM 0 HG11 VAL B 25 39.119 -11.952 -21.128 1.00 0.00 H new ATOM 0 HG12 VAL B 25 38.559 -10.296 -21.460 1.00 0.00 H new ATOM 0 HG13 VAL B 25 39.863 -11.008 -22.440 1.00 0.00 H new ATOM 0 HG21 VAL B 25 41.316 -12.337 -20.065 1.00 0.00 H new ATOM 0 HG22 VAL B 25 42.150 -11.408 -21.333 1.00 0.00 H new ATOM 0 HG23 VAL B 25 42.354 -10.961 -19.622 1.00 0.00 H new ATOM 1371 N ILE B 26 39.363 -7.302 -21.661 1.00 0.00 N ATOM 1372 CA ILE B 26 38.286 -6.327 -21.538 1.00 0.00 C ATOM 1373 C ILE B 26 36.921 -7.005 -21.589 1.00 0.00 C ATOM 1374 O ILE B 26 36.668 -7.850 -22.449 1.00 0.00 O ATOM 1375 CB ILE B 26 38.361 -5.264 -22.650 1.00 0.00 C ATOM 1376 CG1 ILE B 26 39.711 -4.546 -22.610 1.00 0.00 C ATOM 1377 CG2 ILE B 26 37.220 -4.267 -22.507 1.00 0.00 C ATOM 1378 CD1 ILE B 26 39.995 -3.866 -21.289 1.00 0.00 C ATOM 0 H ILE B 26 39.756 -7.382 -22.599 1.00 0.00 H new ATOM 0 HA ILE B 26 38.410 -5.840 -20.571 1.00 0.00 H new ATOM 0 HB ILE B 26 38.265 -5.762 -23.615 1.00 0.00 H new ATOM 0 HG12 ILE B 26 40.503 -5.266 -22.816 1.00 0.00 H new ATOM 0 HG13 ILE B 26 39.742 -3.802 -23.406 1.00 0.00 H new ATOM 0 HG21 ILE B 26 37.286 -3.522 -23.300 1.00 0.00 H new ATOM 0 HG22 ILE B 26 36.267 -4.791 -22.581 1.00 0.00 H new ATOM 0 HG23 ILE B 26 37.288 -3.773 -21.538 1.00 0.00 H new ATOM 0 HD11 ILE B 26 40.968 -3.378 -21.333 1.00 0.00 H new ATOM 0 HD12 ILE B 26 39.224 -3.121 -21.090 1.00 0.00 H new ATOM 0 HD13 ILE B 26 39.997 -4.608 -20.491 1.00 0.00 H new ATOM 1390 N LEU B 27 36.045 -6.628 -20.665 1.00 0.00 N ATOM 1391 CA LEU B 27 34.704 -7.198 -20.605 1.00 0.00 C ATOM 1392 C LEU B 27 33.646 -6.099 -20.564 1.00 0.00 C ATOM 1393 O LEU B 27 33.941 -4.951 -20.232 1.00 0.00 O ATOM 1394 CB LEU B 27 34.566 -8.100 -19.377 1.00 0.00 C ATOM 1395 CG LEU B 27 34.993 -9.557 -19.564 1.00 0.00 C ATOM 1396 CD1 LEU B 27 34.080 -10.257 -20.558 1.00 0.00 C ATOM 1397 CD2 LEU B 27 36.442 -9.634 -20.022 1.00 0.00 C ATOM 0 H LEU B 27 36.239 -5.930 -19.947 1.00 0.00 H new ATOM 0 HA LEU B 27 34.549 -7.793 -21.505 1.00 0.00 H new ATOM 0 HB2 LEU B 27 35.156 -7.670 -18.567 1.00 0.00 H new ATOM 0 HB3 LEU B 27 33.525 -8.086 -19.055 1.00 0.00 H new ATOM 0 HG LEU B 27 34.909 -10.066 -18.604 1.00 0.00 H new ATOM 0 HD11 LEU B 27 34.399 -11.292 -20.678 1.00 0.00 H new ATOM 0 HD12 LEU B 27 33.055 -10.234 -20.189 1.00 0.00 H new ATOM 0 HD13 LEU B 27 34.131 -9.747 -21.520 1.00 0.00 H new ATOM 0 HD21 LEU B 27 36.728 -10.678 -20.150 1.00 0.00 H new ATOM 0 HD22 LEU B 27 36.552 -9.109 -20.971 1.00 0.00 H new ATOM 0 HD23 LEU B 27 37.085 -9.170 -19.274 1.00 0.00 H new ATOM 1409 N THR B 28 32.412 -6.460 -20.902 1.00 0.00 N ATOM 1410 CA THR B 28 31.310 -5.506 -20.902 1.00 0.00 C ATOM 1411 C THR B 28 30.137 -6.020 -20.076 1.00 0.00 C ATOM 1412 O THR B 28 29.890 -7.225 -20.014 1.00 0.00 O ATOM 1413 CB THR B 28 30.825 -5.210 -22.334 1.00 0.00 C ATOM 1414 OG1 THR B 28 31.768 -5.715 -23.285 1.00 0.00 O ATOM 1415 CG2 THR B 28 30.637 -3.715 -22.543 1.00 0.00 C ATOM 0 H THR B 28 32.151 -7.406 -21.179 1.00 0.00 H new ATOM 0 HA THR B 28 31.688 -4.586 -20.456 1.00 0.00 H new ATOM 0 HB THR B 28 29.865 -5.705 -22.478 1.00 0.00 H new ATOM 0 HG1 THR B 28 31.737 -6.694 -23.288 1.00 0.00 H new ATOM 0 HG21 THR B 28 30.294 -3.530 -23.561 1.00 0.00 H new ATOM 0 HG22 THR B 28 29.896 -3.339 -21.837 1.00 0.00 H new ATOM 0 HG23 THR B 28 31.585 -3.203 -22.381 1.00 0.00 H new ATOM 1423 N ILE B 29 29.416 -5.100 -19.444 1.00 0.00 N ATOM 1424 CA ILE B 29 28.267 -5.462 -18.623 1.00 0.00 C ATOM 1425 C ILE B 29 27.017 -4.710 -19.066 1.00 0.00 C ATOM 1426 O ILE B 29 27.091 -3.553 -19.478 1.00 0.00 O ATOM 1427 CB ILE B 29 28.527 -5.172 -17.133 1.00 0.00 C ATOM 1428 CG1 ILE B 29 29.727 -5.979 -16.635 1.00 0.00 C ATOM 1429 CG2 ILE B 29 27.289 -5.490 -16.308 1.00 0.00 C ATOM 1430 CD1 ILE B 29 29.500 -7.474 -16.654 1.00 0.00 C ATOM 0 H ILE B 29 29.607 -4.099 -19.485 1.00 0.00 H new ATOM 0 HA ILE B 29 28.109 -6.533 -18.754 1.00 0.00 H new ATOM 0 HB ILE B 29 28.754 -4.112 -17.019 1.00 0.00 H new ATOM 0 HG12 ILE B 29 30.594 -5.744 -17.252 1.00 0.00 H new ATOM 0 HG13 ILE B 29 29.966 -5.669 -15.618 1.00 0.00 H new ATOM 0 HG21 ILE B 29 27.488 -5.280 -15.257 1.00 0.00 H new ATOM 0 HG22 ILE B 29 26.456 -4.875 -16.649 1.00 0.00 H new ATOM 0 HG23 ILE B 29 27.034 -6.543 -16.426 1.00 0.00 H new ATOM 0 HD11 ILE B 29 30.392 -7.982 -16.288 1.00 0.00 H new ATOM 0 HD12 ILE B 29 28.653 -7.722 -16.014 1.00 0.00 H new ATOM 0 HD13 ILE B 29 29.291 -7.797 -17.674 1.00 0.00 H new ATOM 1442 N GLN B 30 25.870 -5.376 -18.976 1.00 0.00 N ATOM 1443 CA GLN B 30 24.603 -4.769 -19.366 1.00 0.00 C ATOM 1444 C GLN B 30 23.588 -4.850 -18.231 1.00 0.00 C ATOM 1445 O GLN B 30 23.013 -5.908 -17.974 1.00 0.00 O ATOM 1446 CB GLN B 30 24.047 -5.458 -20.614 1.00 0.00 C ATOM 1447 CG GLN B 30 24.326 -4.701 -21.902 1.00 0.00 C ATOM 1448 CD GLN B 30 23.059 -4.237 -22.593 1.00 0.00 C ATOM 1449 OE1 GLN B 30 22.042 -4.931 -22.581 1.00 0.00 O ATOM 1450 NE2 GLN B 30 23.114 -3.058 -23.201 1.00 0.00 N ATOM 0 H GLN B 30 25.792 -6.335 -18.637 1.00 0.00 H new ATOM 0 HA GLN B 30 24.786 -3.718 -19.590 1.00 0.00 H new ATOM 0 HB2 GLN B 30 24.477 -6.457 -20.689 1.00 0.00 H new ATOM 0 HB3 GLN B 30 22.970 -5.582 -20.501 1.00 0.00 H new ATOM 0 HG2 GLN B 30 24.953 -3.837 -21.682 1.00 0.00 H new ATOM 0 HG3 GLN B 30 24.891 -5.341 -22.580 1.00 0.00 H new ATOM 0 HE21 GLN B 30 23.978 -2.516 -23.186 1.00 0.00 H new ATOM 0 HE22 GLN B 30 22.292 -2.694 -23.683 1.00 0.00 H new ATOM 1459 N GLN B 31 23.373 -3.726 -17.555 1.00 0.00 N ATOM 1460 CA GLN B 31 22.428 -3.672 -16.446 1.00 0.00 C ATOM 1461 C GLN B 31 20.998 -3.524 -16.956 1.00 0.00 C ATOM 1462 O GLN B 31 20.604 -2.458 -17.431 1.00 0.00 O ATOM 1463 CB GLN B 31 22.771 -2.510 -15.512 1.00 0.00 C ATOM 1464 CG GLN B 31 23.436 -2.947 -14.216 1.00 0.00 C ATOM 1465 CD GLN B 31 24.500 -1.973 -13.750 1.00 0.00 C ATOM 1466 OE1 GLN B 31 24.666 -0.896 -14.322 1.00 0.00 O ATOM 1467 NE2 GLN B 31 25.229 -2.349 -12.705 1.00 0.00 N ATOM 0 H GLN B 31 23.840 -2.842 -17.756 1.00 0.00 H new ATOM 0 HA GLN B 31 22.502 -4.608 -15.893 1.00 0.00 H new ATOM 0 HB2 GLN B 31 23.432 -1.818 -16.034 1.00 0.00 H new ATOM 0 HB3 GLN B 31 21.858 -1.963 -15.276 1.00 0.00 H new ATOM 0 HG2 GLN B 31 22.678 -3.050 -13.440 1.00 0.00 H new ATOM 0 HG3 GLN B 31 23.885 -3.930 -14.356 1.00 0.00 H new ATOM 0 HE21 GLN B 31 25.057 -3.251 -12.261 1.00 0.00 H new ATOM 0 HE22 GLN B 31 25.961 -1.736 -12.346 1.00 0.00 H new ATOM 1524 N SER B 35 10.218 -3.169 -15.009 1.00 0.00 N ATOM 1525 CA SER B 35 9.306 -2.730 -13.959 1.00 0.00 C ATOM 1526 C SER B 35 8.023 -3.555 -13.974 1.00 0.00 C ATOM 1527 O SER B 35 7.123 -3.310 -14.779 1.00 0.00 O ATOM 1528 CB SER B 35 8.974 -1.246 -14.130 1.00 0.00 C ATOM 1529 OG SER B 35 10.104 -0.519 -14.580 1.00 0.00 O ATOM 0 HA SER B 35 9.800 -2.876 -12.998 1.00 0.00 H new ATOM 0 HB2 SER B 35 8.157 -1.133 -14.843 1.00 0.00 H new ATOM 0 HB3 SER B 35 8.628 -0.836 -13.181 1.00 0.00 H new ATOM 0 HG SER B 35 10.707 -1.120 -15.066 1.00 0.00 H new ATOM 1535 N ASP B 36 7.946 -4.534 -13.079 1.00 0.00 N ATOM 1536 CA ASP B 36 6.773 -5.395 -12.988 1.00 0.00 C ATOM 1537 C ASP B 36 5.687 -4.747 -12.134 1.00 0.00 C ATOM 1538 O ASP B 36 5.932 -4.354 -10.993 1.00 0.00 O ATOM 1539 CB ASP B 36 7.157 -6.754 -12.400 1.00 0.00 C ATOM 1540 CG ASP B 36 8.001 -7.579 -13.352 1.00 0.00 C ATOM 1541 OD1 ASP B 36 8.310 -7.081 -14.455 1.00 0.00 O ATOM 1542 OD2 ASP B 36 8.353 -8.722 -12.994 1.00 0.00 O ATOM 0 H ASP B 36 8.682 -4.751 -12.407 1.00 0.00 H new ATOM 0 HA ASP B 36 6.380 -5.540 -13.994 1.00 0.00 H new ATOM 0 HB2 ASP B 36 7.706 -6.602 -11.471 1.00 0.00 H new ATOM 0 HB3 ASP B 36 6.252 -7.307 -12.149 1.00 0.00 H new ATOM 1547 N VAL B 37 4.487 -4.637 -12.695 1.00 0.00 N ATOM 1548 CA VAL B 37 3.364 -4.037 -11.986 1.00 0.00 C ATOM 1549 C VAL B 37 2.447 -5.106 -11.402 1.00 0.00 C ATOM 1550 O VAL B 37 1.896 -5.930 -12.131 1.00 0.00 O ATOM 1551 CB VAL B 37 2.541 -3.120 -12.911 1.00 0.00 C ATOM 1552 CG1 VAL B 37 1.556 -2.290 -12.102 1.00 0.00 C ATOM 1553 CG2 VAL B 37 3.461 -2.225 -13.728 1.00 0.00 C ATOM 0 H VAL B 37 4.268 -4.956 -13.639 1.00 0.00 H new ATOM 0 HA VAL B 37 3.784 -3.441 -11.176 1.00 0.00 H new ATOM 0 HB VAL B 37 1.972 -3.744 -13.600 1.00 0.00 H new ATOM 0 HG11 VAL B 37 0.984 -1.649 -12.772 1.00 0.00 H new ATOM 0 HG12 VAL B 37 0.876 -2.952 -11.566 1.00 0.00 H new ATOM 0 HG13 VAL B 37 2.101 -1.673 -11.387 1.00 0.00 H new ATOM 0 HG21 VAL B 37 2.863 -1.584 -14.376 1.00 0.00 H new ATOM 0 HG22 VAL B 37 4.058 -1.607 -13.057 1.00 0.00 H new ATOM 0 HG23 VAL B 37 4.122 -2.842 -14.337 1.00 0.00 H new ATOM 1563 N TRP B 38 2.288 -5.086 -10.084 1.00 0.00 N ATOM 1564 CA TRP B 38 1.437 -6.054 -9.402 1.00 0.00 C ATOM 1565 C TRP B 38 0.444 -5.353 -8.482 1.00 0.00 C ATOM 1566 O TRP B 38 0.759 -4.326 -7.879 1.00 0.00 O ATOM 1567 CB TRP B 38 2.290 -7.036 -8.597 1.00 0.00 C ATOM 1568 CG TRP B 38 3.629 -6.483 -8.212 1.00 0.00 C ATOM 1569 CD1 TRP B 38 4.610 -6.049 -9.057 1.00 0.00 C ATOM 1570 CD2 TRP B 38 4.133 -6.307 -6.884 1.00 0.00 C ATOM 1571 NE1 TRP B 38 5.694 -5.614 -8.334 1.00 0.00 N ATOM 1572 CE2 TRP B 38 5.427 -5.760 -6.999 1.00 0.00 C ATOM 1573 CE3 TRP B 38 3.618 -6.555 -5.609 1.00 0.00 C ATOM 1574 CZ2 TRP B 38 6.209 -5.461 -5.887 1.00 0.00 C ATOM 1575 CZ3 TRP B 38 4.396 -6.257 -4.506 1.00 0.00 C ATOM 1576 CH2 TRP B 38 5.679 -5.714 -4.651 1.00 0.00 C ATOM 0 H TRP B 38 2.737 -4.410 -9.466 1.00 0.00 H new ATOM 0 HA TRP B 38 0.877 -6.604 -10.158 1.00 0.00 H new ATOM 0 HB2 TRP B 38 1.749 -7.321 -7.694 1.00 0.00 H new ATOM 0 HB3 TRP B 38 2.435 -7.944 -9.182 1.00 0.00 H new ATOM 0 HD1 TRP B 38 4.543 -6.048 -10.135 1.00 0.00 H new ATOM 0 HE1 TRP B 38 6.558 -5.242 -8.728 1.00 0.00 H new ATOM 0 HE3 TRP B 38 2.629 -6.972 -5.487 1.00 0.00 H new ATOM 0 HZ2 TRP B 38 7.199 -5.044 -5.996 1.00 0.00 H new ATOM 0 HZ3 TRP B 38 4.008 -6.446 -3.516 1.00 0.00 H new ATOM 0 HH2 TRP B 38 6.262 -5.490 -3.770 1.00 0.00 H new ATOM 1587 N LEU B 39 -0.757 -5.912 -8.378 1.00 0.00 N ATOM 1588 CA LEU B 39 -1.797 -5.340 -7.531 1.00 0.00 C ATOM 1589 C LEU B 39 -2.192 -6.311 -6.422 1.00 0.00 C ATOM 1590 O LEU B 39 -2.072 -7.526 -6.576 1.00 0.00 O ATOM 1591 CB LEU B 39 -3.024 -4.979 -8.369 1.00 0.00 C ATOM 1592 CG LEU B 39 -4.290 -4.624 -7.588 1.00 0.00 C ATOM 1593 CD1 LEU B 39 -4.108 -3.309 -6.846 1.00 0.00 C ATOM 1594 CD2 LEU B 39 -5.490 -4.551 -8.521 1.00 0.00 C ATOM 0 H LEU B 39 -1.034 -6.761 -8.870 1.00 0.00 H new ATOM 0 HA LEU B 39 -1.400 -4.435 -7.072 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -2.767 -4.134 -9.008 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -3.250 -5.819 -9.026 1.00 0.00 H new ATOM 0 HG LEU B 39 -4.473 -5.409 -6.854 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -5.019 -3.073 -6.296 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -3.275 -3.397 -6.148 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -3.899 -2.513 -7.561 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -6.382 -4.297 -7.948 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -5.316 -3.787 -9.278 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -5.633 -5.517 -9.006 1.00 0.00 H new ATOM 1606 N ALA B 40 -2.664 -5.766 -5.306 1.00 0.00 N ATOM 1607 CA ALA B 40 -3.081 -6.584 -4.174 1.00 0.00 C ATOM 1608 C ALA B 40 -4.601 -6.683 -4.098 1.00 0.00 C ATOM 1609 O ALA B 40 -5.144 -7.665 -3.590 1.00 0.00 O ATOM 1610 CB ALA B 40 -2.521 -6.015 -2.878 1.00 0.00 C ATOM 0 H ALA B 40 -2.767 -4.762 -5.162 1.00 0.00 H new ATOM 0 HA ALA B 40 -2.685 -7.589 -4.318 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -2.840 -6.635 -2.040 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -1.432 -6.003 -2.927 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -2.889 -4.999 -2.738 1.00 0.00 H new ATOM 1616 N ASP B 41 -5.281 -5.661 -4.604 1.00 0.00 N ATOM 1617 CA ASP B 41 -6.739 -5.633 -4.593 1.00 0.00 C ATOM 1618 C ASP B 41 -7.304 -6.289 -5.849 1.00 0.00 C ATOM 1619 O ASP B 41 -7.542 -5.622 -6.856 1.00 0.00 O ATOM 1620 CB ASP B 41 -7.243 -4.193 -4.485 1.00 0.00 C ATOM 1621 CG ASP B 41 -8.726 -4.119 -4.183 1.00 0.00 C ATOM 1622 OD1 ASP B 41 -9.503 -4.841 -4.843 1.00 0.00 O ATOM 1623 OD2 ASP B 41 -9.111 -3.339 -3.287 1.00 0.00 O ATOM 0 H ASP B 41 -4.846 -4.841 -5.027 1.00 0.00 H new ATOM 0 HA ASP B 41 -7.082 -6.195 -3.724 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -6.690 -3.675 -3.701 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -7.039 -3.669 -5.419 1.00 0.00 H new ATOM 1628 N GLU B 42 -7.516 -7.600 -5.782 1.00 0.00 N ATOM 1629 CA GLU B 42 -8.051 -8.346 -6.915 1.00 0.00 C ATOM 1630 C GLU B 42 -9.293 -7.661 -7.479 1.00 0.00 C ATOM 1631 O GLU B 42 -9.449 -7.538 -8.694 1.00 0.00 O ATOM 1632 CB GLU B 42 -8.391 -9.778 -6.497 1.00 0.00 C ATOM 1633 CG GLU B 42 -7.211 -10.538 -5.916 1.00 0.00 C ATOM 1634 CD GLU B 42 -7.595 -11.917 -5.415 1.00 0.00 C ATOM 1635 OE1 GLU B 42 -8.435 -12.572 -6.067 1.00 0.00 O ATOM 1636 OE2 GLU B 42 -7.056 -12.341 -4.371 1.00 0.00 O ATOM 0 H GLU B 42 -7.326 -8.167 -4.956 1.00 0.00 H new ATOM 0 HA GLU B 42 -7.287 -8.374 -7.692 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -9.194 -9.752 -5.760 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -8.771 -10.320 -7.363 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -6.436 -10.635 -6.676 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -6.782 -9.964 -5.095 1.00 0.00 H new ATOM 1643 N SER B 43 -10.174 -7.217 -6.588 1.00 0.00 N ATOM 1644 CA SER B 43 -11.404 -6.549 -6.996 1.00 0.00 C ATOM 1645 C SER B 43 -11.102 -5.375 -7.923 1.00 0.00 C ATOM 1646 O SER B 43 -11.869 -5.082 -8.840 1.00 0.00 O ATOM 1647 CB SER B 43 -12.175 -6.060 -5.769 1.00 0.00 C ATOM 1648 OG SER B 43 -11.963 -6.915 -4.659 1.00 0.00 O ATOM 0 H SER B 43 -10.059 -7.308 -5.579 1.00 0.00 H new ATOM 0 HA SER B 43 -12.017 -7.269 -7.538 1.00 0.00 H new ATOM 0 HB2 SER B 43 -11.860 -5.047 -5.517 1.00 0.00 H new ATOM 0 HB3 SER B 43 -13.240 -6.015 -5.999 1.00 0.00 H new ATOM 0 HG SER B 43 -12.465 -6.580 -3.887 1.00 0.00 H new ATOM 1654 N GLN B 44 -9.980 -4.708 -7.676 1.00 0.00 N ATOM 1655 CA GLN B 44 -9.577 -3.565 -8.488 1.00 0.00 C ATOM 1656 C GLN B 44 -8.749 -4.014 -9.687 1.00 0.00 C ATOM 1657 O GLN B 44 -8.527 -3.246 -10.623 1.00 0.00 O ATOM 1658 CB GLN B 44 -8.777 -2.570 -7.644 1.00 0.00 C ATOM 1659 CG GLN B 44 -9.557 -1.318 -7.278 1.00 0.00 C ATOM 1660 CD GLN B 44 -10.988 -1.619 -6.876 1.00 0.00 C ATOM 1661 OE1 GLN B 44 -11.888 -1.647 -7.716 1.00 0.00 O ATOM 1662 NE2 GLN B 44 -11.205 -1.846 -5.586 1.00 0.00 N ATOM 0 H GLN B 44 -9.334 -4.938 -6.921 1.00 0.00 H new ATOM 0 HA GLN B 44 -10.479 -3.076 -8.856 1.00 0.00 H new ATOM 0 HB2 GLN B 44 -8.449 -3.064 -6.729 1.00 0.00 H new ATOM 0 HB3 GLN B 44 -7.879 -2.282 -8.191 1.00 0.00 H new ATOM 0 HG2 GLN B 44 -9.053 -0.807 -6.458 1.00 0.00 H new ATOM 0 HG3 GLN B 44 -9.558 -0.634 -8.127 1.00 0.00 H new ATOM 0 HE21 GLN B 44 -10.429 -1.813 -4.925 1.00 0.00 H new ATOM 0 HE22 GLN B 44 -12.148 -2.054 -5.256 1.00 0.00 H new ATOM 1671 N ALA B 45 -8.293 -5.262 -9.651 1.00 0.00 N ATOM 1672 CA ALA B 45 -7.491 -5.814 -10.736 1.00 0.00 C ATOM 1673 C ALA B 45 -8.189 -5.636 -12.080 1.00 0.00 C ATOM 1674 O ALA B 45 -7.538 -5.565 -13.122 1.00 0.00 O ATOM 1675 CB ALA B 45 -7.199 -7.285 -10.481 1.00 0.00 C ATOM 0 H ALA B 45 -8.465 -5.910 -8.882 1.00 0.00 H new ATOM 0 HA ALA B 45 -6.548 -5.269 -10.771 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -6.599 -7.684 -11.299 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -6.651 -7.390 -9.545 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -8.137 -7.836 -10.416 1.00 0.00 H new ATOM 1681 N GLU B 46 -9.516 -5.566 -12.048 1.00 0.00 N ATOM 1682 CA GLU B 46 -10.301 -5.398 -13.266 1.00 0.00 C ATOM 1683 C GLU B 46 -10.285 -3.944 -13.727 1.00 0.00 C ATOM 1684 O GLU B 46 -9.962 -3.650 -14.879 1.00 0.00 O ATOM 1685 CB GLU B 46 -11.742 -5.857 -13.037 1.00 0.00 C ATOM 1686 CG GLU B 46 -11.853 -7.280 -12.517 1.00 0.00 C ATOM 1687 CD GLU B 46 -13.221 -7.584 -11.936 1.00 0.00 C ATOM 1688 OE1 GLU B 46 -14.172 -7.770 -12.724 1.00 0.00 O ATOM 1689 OE2 GLU B 46 -13.339 -7.636 -10.694 1.00 0.00 O ATOM 0 H GLU B 46 -10.070 -5.623 -11.193 1.00 0.00 H new ATOM 0 HA GLU B 46 -9.851 -6.013 -14.046 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -12.221 -5.182 -12.328 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -12.293 -5.778 -13.974 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -11.644 -7.977 -13.329 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -11.093 -7.444 -11.753 1.00 0.00 H new ATOM 1696 N ARG B 47 -10.635 -3.038 -12.820 1.00 0.00 N ATOM 1697 CA ARG B 47 -10.664 -1.614 -13.134 1.00 0.00 C ATOM 1698 C ARG B 47 -9.296 -1.136 -13.613 1.00 0.00 C ATOM 1699 O ARG B 47 -9.199 -0.276 -14.489 1.00 0.00 O ATOM 1700 CB ARG B 47 -11.097 -0.809 -11.908 1.00 0.00 C ATOM 1701 CG ARG B 47 -9.949 -0.444 -10.981 1.00 0.00 C ATOM 1702 CD ARG B 47 -9.336 0.897 -11.355 1.00 0.00 C ATOM 1703 NE ARG B 47 -9.992 2.008 -10.670 1.00 0.00 N ATOM 1704 CZ ARG B 47 -9.916 3.269 -11.078 1.00 0.00 C ATOM 1705 NH1 ARG B 47 -9.217 3.579 -12.161 1.00 0.00 N ATOM 1706 NH2 ARG B 47 -10.541 4.225 -10.402 1.00 0.00 N ATOM 0 H ARG B 47 -10.902 -3.264 -11.862 1.00 0.00 H new ATOM 0 HA ARG B 47 -11.386 -1.458 -13.936 1.00 0.00 H new ATOM 0 HB2 ARG B 47 -11.589 0.105 -12.240 1.00 0.00 H new ATOM 0 HB3 ARG B 47 -11.835 -1.384 -11.349 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -10.308 -0.407 -9.952 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -9.184 -1.220 -11.024 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -8.275 0.893 -11.106 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -9.409 1.041 -12.433 1.00 0.00 H new ATOM 0 HE ARG B 47 -10.538 1.804 -9.833 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -8.735 2.848 -12.684 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -9.161 4.549 -12.471 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -11.080 3.991 -9.568 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -10.482 5.194 -10.716 1.00 0.00 H new ATOM 1720 N VAL B 48 -8.241 -1.698 -13.031 1.00 0.00 N ATOM 1721 CA VAL B 48 -6.879 -1.330 -13.399 1.00 0.00 C ATOM 1722 C VAL B 48 -6.501 -1.908 -14.758 1.00 0.00 C ATOM 1723 O VAL B 48 -5.885 -1.231 -15.582 1.00 0.00 O ATOM 1724 CB VAL B 48 -5.864 -1.815 -12.347 1.00 0.00 C ATOM 1725 CG1 VAL B 48 -6.131 -1.156 -11.002 1.00 0.00 C ATOM 1726 CG2 VAL B 48 -5.906 -3.331 -12.225 1.00 0.00 C ATOM 0 H VAL B 48 -8.304 -2.410 -12.303 1.00 0.00 H new ATOM 0 HA VAL B 48 -6.848 -0.242 -13.450 1.00 0.00 H new ATOM 0 HB VAL B 48 -4.865 -1.527 -12.673 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -5.404 -1.511 -10.272 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -6.045 -0.074 -11.103 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -7.136 -1.410 -10.666 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -5.182 -3.656 -11.477 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -6.905 -3.644 -11.923 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -5.660 -3.780 -13.187 1.00 0.00 H new ATOM 1736 N ARG B 49 -6.874 -3.163 -14.986 1.00 0.00 N ATOM 1737 CA ARG B 49 -6.574 -3.832 -16.246 1.00 0.00 C ATOM 1738 C ARG B 49 -7.161 -3.061 -17.425 1.00 0.00 C ATOM 1739 O ARG B 49 -6.519 -2.914 -18.464 1.00 0.00 O ATOM 1740 CB ARG B 49 -7.122 -5.260 -16.233 1.00 0.00 C ATOM 1741 CG ARG B 49 -6.071 -6.313 -15.924 1.00 0.00 C ATOM 1742 CD ARG B 49 -6.686 -7.538 -15.264 1.00 0.00 C ATOM 1743 NE ARG B 49 -6.018 -8.772 -15.669 1.00 0.00 N ATOM 1744 CZ ARG B 49 -6.555 -9.978 -15.529 1.00 0.00 C ATOM 1745 NH1 ARG B 49 -7.762 -10.113 -14.997 1.00 0.00 N ATOM 1746 NH2 ARG B 49 -5.884 -11.054 -15.922 1.00 0.00 N ATOM 0 H ARG B 49 -7.384 -3.737 -14.315 1.00 0.00 H new ATOM 0 HA ARG B 49 -5.491 -3.867 -16.361 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -7.920 -5.327 -15.493 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -7.568 -5.478 -17.203 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -5.569 -6.608 -16.845 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -5.311 -5.888 -15.268 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -6.628 -7.433 -14.181 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -7.743 -7.597 -15.523 1.00 0.00 H new ATOM 0 HE ARG B 49 -5.088 -8.703 -16.082 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -8.281 -9.289 -14.694 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -8.172 -11.041 -14.891 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -4.955 -10.954 -16.332 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -6.297 -11.980 -15.814 1.00 0.00 H new ATOM 1760 N ALA B 50 -8.385 -2.572 -17.255 1.00 0.00 N ATOM 1761 CA ALA B 50 -9.058 -1.816 -18.303 1.00 0.00 C ATOM 1762 C ALA B 50 -8.395 -0.459 -18.513 1.00 0.00 C ATOM 1763 O ALA B 50 -7.926 -0.150 -19.608 1.00 0.00 O ATOM 1764 CB ALA B 50 -10.531 -1.639 -17.964 1.00 0.00 C ATOM 0 H ALA B 50 -8.931 -2.686 -16.401 1.00 0.00 H new ATOM 0 HA ALA B 50 -8.976 -2.379 -19.233 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.021 -1.072 -18.756 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -11.003 -2.617 -17.872 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -10.625 -1.101 -17.021 1.00 0.00 H new ATOM 1770 N GLU B 51 -8.360 0.347 -17.456 1.00 0.00 N ATOM 1771 CA GLU B 51 -7.756 1.672 -17.527 1.00 0.00 C ATOM 1772 C GLU B 51 -6.315 1.587 -18.024 1.00 0.00 C ATOM 1773 O GLU B 51 -5.862 2.432 -18.797 1.00 0.00 O ATOM 1774 CB GLU B 51 -7.794 2.348 -16.154 1.00 0.00 C ATOM 1775 CG GLU B 51 -9.198 2.683 -15.680 1.00 0.00 C ATOM 1776 CD GLU B 51 -10.095 3.165 -16.804 1.00 0.00 C ATOM 1777 OE1 GLU B 51 -9.705 4.123 -17.503 1.00 0.00 O ATOM 1778 OE2 GLU B 51 -11.185 2.584 -16.985 1.00 0.00 O ATOM 0 H GLU B 51 -8.742 0.106 -16.542 1.00 0.00 H new ATOM 0 HA GLU B 51 -8.332 2.269 -18.234 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -7.319 1.694 -15.423 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.204 3.264 -16.193 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -9.642 1.801 -15.219 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -9.143 3.452 -14.909 1.00 0.00 H new ATOM 1785 N LEU B 52 -5.600 0.562 -17.574 1.00 0.00 N ATOM 1786 CA LEU B 52 -4.210 0.366 -17.971 1.00 0.00 C ATOM 1787 C LEU B 52 -4.104 0.115 -19.472 1.00 0.00 C ATOM 1788 O LEU B 52 -3.316 0.758 -20.165 1.00 0.00 O ATOM 1789 CB LEU B 52 -3.600 -0.807 -17.202 1.00 0.00 C ATOM 1790 CG LEU B 52 -2.113 -1.068 -17.444 1.00 0.00 C ATOM 1791 CD1 LEU B 52 -1.484 -1.737 -16.232 1.00 0.00 C ATOM 1792 CD2 LEU B 52 -1.917 -1.921 -18.689 1.00 0.00 C ATOM 0 H LEU B 52 -5.960 -0.146 -16.934 1.00 0.00 H new ATOM 0 HA LEU B 52 -3.658 1.275 -17.733 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -3.749 -0.633 -16.136 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -4.153 -1.710 -17.458 1.00 0.00 H new ATOM 0 HG LEU B 52 -1.617 -0.111 -17.602 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -0.426 -1.915 -16.423 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -1.592 -1.089 -15.362 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -1.983 -2.687 -16.041 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -0.853 -2.097 -18.846 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -2.427 -2.876 -18.560 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -2.330 -1.403 -19.554 1.00 0.00 H new ATOM 1804 N ALA B 53 -4.904 -0.823 -19.968 1.00 0.00 N ATOM 1805 CA ALA B 53 -4.902 -1.156 -21.388 1.00 0.00 C ATOM 1806 C ALA B 53 -5.290 0.052 -22.235 1.00 0.00 C ATOM 1807 O ALA B 53 -4.879 0.170 -23.389 1.00 0.00 O ATOM 1808 CB ALA B 53 -5.847 -2.318 -21.658 1.00 0.00 C ATOM 0 H ALA B 53 -5.562 -1.366 -19.408 1.00 0.00 H new ATOM 0 HA ALA B 53 -3.891 -1.452 -21.666 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -5.836 -2.556 -22.722 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -5.525 -3.189 -21.088 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -6.858 -2.042 -21.359 1.00 0.00 H new ATOM 1814 N ARG B 54 -6.084 0.945 -21.654 1.00 0.00 N ATOM 1815 CA ARG B 54 -6.529 2.143 -22.357 1.00 0.00 C ATOM 1816 C ARG B 54 -5.466 3.235 -22.297 1.00 0.00 C ATOM 1817 O ARG B 54 -5.391 4.094 -23.176 1.00 0.00 O ATOM 1818 CB ARG B 54 -7.838 2.657 -21.756 1.00 0.00 C ATOM 1819 CG ARG B 54 -9.043 1.794 -22.093 1.00 0.00 C ATOM 1820 CD ARG B 54 -10.231 2.123 -21.202 1.00 0.00 C ATOM 1821 NE ARG B 54 -11.492 1.665 -21.779 1.00 0.00 N ATOM 1822 CZ ARG B 54 -12.055 2.216 -22.848 1.00 0.00 C ATOM 1823 NH1 ARG B 54 -11.471 3.241 -23.454 1.00 0.00 N ATOM 1824 NH2 ARG B 54 -13.203 1.742 -23.314 1.00 0.00 N ATOM 0 H ARG B 54 -6.432 0.862 -20.699 1.00 0.00 H new ATOM 0 HA ARG B 54 -6.696 1.879 -23.401 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -7.733 2.713 -20.672 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -8.018 3.672 -22.112 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.318 1.943 -23.137 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.782 0.742 -21.979 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.090 1.660 -20.225 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.276 3.200 -21.041 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.967 0.878 -21.336 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -10.588 3.607 -23.099 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -11.905 3.663 -24.275 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -13.655 0.953 -22.851 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -13.634 2.166 -24.135 1.00 0.00 H new ATOM 1838 N PHE B 55 -4.644 3.197 -21.253 1.00 0.00 N ATOM 1839 CA PHE B 55 -3.586 4.185 -21.076 1.00 0.00 C ATOM 1840 C PHE B 55 -2.329 3.777 -21.839 1.00 0.00 C ATOM 1841 O PHE B 55 -1.629 4.620 -22.401 1.00 0.00 O ATOM 1842 CB PHE B 55 -3.262 4.356 -19.590 1.00 0.00 C ATOM 1843 CG PHE B 55 -2.612 5.671 -19.266 1.00 0.00 C ATOM 1844 CD1 PHE B 55 -3.223 6.865 -19.613 1.00 0.00 C ATOM 1845 CD2 PHE B 55 -1.389 5.712 -18.615 1.00 0.00 C ATOM 1846 CE1 PHE B 55 -2.628 8.076 -19.316 1.00 0.00 C ATOM 1847 CE2 PHE B 55 -0.790 6.921 -18.315 1.00 0.00 C ATOM 1848 CZ PHE B 55 -1.409 8.104 -18.667 1.00 0.00 C ATOM 0 H PHE B 55 -4.690 2.493 -20.517 1.00 0.00 H new ATOM 0 HA PHE B 55 -3.940 5.136 -21.475 1.00 0.00 H new ATOM 0 HB2 PHE B 55 -4.182 4.262 -19.013 1.00 0.00 H new ATOM 0 HB3 PHE B 55 -2.604 3.547 -19.274 1.00 0.00 H new ATOM 0 HD1 PHE B 55 -4.176 6.849 -20.122 1.00 0.00 H new ATOM 0 HD2 PHE B 55 -0.899 4.790 -18.339 1.00 0.00 H new ATOM 0 HE1 PHE B 55 -3.115 9.000 -19.591 1.00 0.00 H new ATOM 0 HE2 PHE B 55 0.162 6.940 -17.805 1.00 0.00 H new ATOM 0 HZ PHE B 55 -0.941 9.049 -18.435 1.00 0.00 H new ATOM 1858 N LEU B 56 -2.048 2.478 -21.853 1.00 0.00 N ATOM 1859 CA LEU B 56 -0.875 1.957 -22.546 1.00 0.00 C ATOM 1860 C LEU B 56 -0.903 2.333 -24.023 1.00 0.00 C ATOM 1861 O LEU B 56 0.133 2.628 -24.618 1.00 0.00 O ATOM 1862 CB LEU B 56 -0.804 0.436 -22.396 1.00 0.00 C ATOM 1863 CG LEU B 56 0.140 -0.089 -21.315 1.00 0.00 C ATOM 1864 CD1 LEU B 56 0.057 -1.605 -21.224 1.00 0.00 C ATOM 1865 CD2 LEU B 56 1.569 0.353 -21.595 1.00 0.00 C ATOM 0 H LEU B 56 -2.616 1.767 -21.393 1.00 0.00 H new ATOM 0 HA LEU B 56 0.011 2.403 -22.094 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -1.807 0.065 -22.186 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -0.501 0.011 -23.353 1.00 0.00 H new ATOM 0 HG LEU B 56 -0.167 0.329 -20.356 1.00 0.00 H new ATOM 0 HD11 LEU B 56 0.736 -1.961 -20.449 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -0.963 -1.899 -20.976 1.00 0.00 H new ATOM 0 HD13 LEU B 56 0.338 -2.043 -22.182 1.00 0.00 H new ATOM 0 HD21 LEU B 56 2.228 -0.030 -20.815 1.00 0.00 H new ATOM 0 HD22 LEU B 56 1.887 -0.036 -22.562 1.00 0.00 H new ATOM 0 HD23 LEU B 56 1.617 1.442 -21.608 1.00 0.00 H new