USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 549 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 50 ASN : amide:sc= 0.629 K(o=1.4,f=-3.4!) USER MOD Set 1.2: A 52 LYS NZ :NH3+ -156:sc= 0.81 (180deg=0) USER MOD Set 2.1: A 25 SER OG : rot 140:sc= -0.0854 USER MOD Set 2.2: A 47 SER OG : rot 89:sc= 1.98 USER MOD Single : A 2 SER OG : rot -84:sc= 1.01 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 ASN : amide:sc= -0.19 K(o=-0.19,f=-7.1!) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= 0.348 X(o=0.35,f=-0.0064) USER MOD Single : A 18 LYS NZ :NH3+ -171:sc= 1.18 (180deg=1.06) USER MOD Single : A 19 TYR OH : rot 100:sc= 0 USER MOD Single : A 23 SER OG : rot -93:sc= 1.14 USER MOD Single : A 28 SER OG : rot -34:sc= 0.21 USER MOD Single : A 29 HIS : no HD1:sc= -0.647 X(o=-0.65,f=-0.7) USER MOD Single : A 31 LYS NZ :NH3+ 176:sc= 1.27 (180deg=1.15) USER MOD Single : A 32 SER OG : rot 156:sc= 1.28 USER MOD Single : A 35 MET CE :methyl 170:sc= -0.931 (180deg=-1.23) USER MOD Single : A 36 SER OG : rot -39:sc= 0.58 USER MOD Single : A 42 GLN : amide:sc= 0.919 K(o=0.92,f=-0.021) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 176:sc= 2.16 (180deg=2.02) USER MOD Single : A 60 GLN : amide:sc= -0.234 X(o=-0.23,f=-0.37) USER MOD Single : A 61 SER OG : rot 75:sc= 0.501 USER MOD Single : A 65 THR OG1 : rot 81:sc= 0.649 USER MOD Single : A 68 ASN : amide:sc= 0.338 X(o=0.34,f=0) USER MOD Single : A 70 HIS : no HE2:sc= 0.596 K(o=0.6,f=-2.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -33.285 9.497 -4.329 1.00 0.00 N ATOM 2 CA PRO A 1 -32.547 8.447 -5.058 1.00 0.00 C ATOM 3 C PRO A 1 -33.189 7.056 -4.915 1.00 0.00 C ATOM 4 O PRO A 1 -32.896 6.297 -3.989 1.00 0.00 O ATOM 5 CB PRO A 1 -31.088 8.544 -4.589 1.00 0.00 C ATOM 6 CG PRO A 1 -30.924 10.026 -4.214 1.00 0.00 C ATOM 7 CD PRO A 1 -32.329 10.622 -4.355 1.00 0.00 C ATOM 0 H2 PRO A 1 -33.513 9.212 -3.376 1.00 0.00 H new ATOM 0 H3 PRO A 1 -34.165 9.733 -4.788 1.00 0.00 H new ATOM 0 HA PRO A 1 -32.587 8.603 -6.136 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -30.897 7.892 -3.737 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -30.394 8.251 -5.377 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -30.547 10.138 -3.197 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -30.214 10.525 -4.874 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -32.534 11.320 -3.543 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -32.418 11.181 -5.286 1.00 0.00 H new ATOM 15 N SER A 2 -34.105 6.745 -5.832 1.00 0.00 N ATOM 16 CA SER A 2 -34.932 5.527 -5.867 1.00 0.00 C ATOM 17 C SER A 2 -34.158 4.218 -6.093 1.00 0.00 C ATOM 18 O SER A 2 -34.623 3.154 -5.675 1.00 0.00 O ATOM 19 CB SER A 2 -36.013 5.681 -6.948 1.00 0.00 C ATOM 20 OG SER A 2 -35.452 6.074 -8.190 1.00 0.00 O ATOM 0 H SER A 2 -34.305 7.367 -6.616 1.00 0.00 H new ATOM 0 HA SER A 2 -35.367 5.436 -4.872 1.00 0.00 H new ATOM 0 HB2 SER A 2 -36.545 4.737 -7.070 1.00 0.00 H new ATOM 0 HB3 SER A 2 -36.746 6.421 -6.628 1.00 0.00 H new ATOM 0 HG SER A 2 -35.340 7.047 -8.205 1.00 0.00 H new ATOM 26 N GLY A 3 -32.974 4.273 -6.714 1.00 0.00 N ATOM 27 CA GLY A 3 -32.088 3.119 -6.915 1.00 0.00 C ATOM 28 C GLY A 3 -30.977 3.355 -7.944 1.00 0.00 C ATOM 29 O GLY A 3 -30.832 4.451 -8.490 1.00 0.00 O ATOM 0 H GLY A 3 -32.597 5.139 -7.099 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -31.634 2.853 -5.961 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -32.687 2.265 -7.232 1.00 0.00 H new ATOM 33 N LYS A 4 -30.192 2.306 -8.224 1.00 0.00 N ATOM 34 CA LYS A 4 -29.130 2.299 -9.252 1.00 0.00 C ATOM 35 C LYS A 4 -29.672 2.335 -10.696 1.00 0.00 C ATOM 36 O LYS A 4 -28.973 2.796 -11.598 1.00 0.00 O ATOM 37 CB LYS A 4 -28.227 1.074 -9.003 1.00 0.00 C ATOM 38 CG LYS A 4 -26.941 1.083 -9.846 1.00 0.00 C ATOM 39 CD LYS A 4 -26.005 -0.067 -9.449 1.00 0.00 C ATOM 40 CE LYS A 4 -24.748 -0.041 -10.328 1.00 0.00 C ATOM 41 NZ LYS A 4 -23.822 -1.154 -9.995 1.00 0.00 N ATOM 0 H LYS A 4 -30.276 1.416 -7.733 1.00 0.00 H new ATOM 0 HA LYS A 4 -28.550 3.217 -9.157 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -27.960 1.037 -7.947 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -28.790 0.166 -9.222 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -27.196 0.999 -10.902 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -26.426 2.035 -9.717 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -25.727 0.024 -8.399 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -26.519 -1.022 -9.561 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -25.036 -0.109 -11.377 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -24.234 0.911 -10.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -22.984 -1.104 -10.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -23.528 -1.075 -9.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -24.305 -2.063 -10.142 1.00 0.00 H new ATOM 55 N ASN A 5 -30.907 1.871 -10.919 1.00 0.00 N ATOM 56 CA ASN A 5 -31.580 1.865 -12.225 1.00 0.00 C ATOM 57 C ASN A 5 -31.652 3.294 -12.826 1.00 0.00 C ATOM 58 O ASN A 5 -32.273 4.170 -12.215 1.00 0.00 O ATOM 59 CB ASN A 5 -32.972 1.222 -12.051 1.00 0.00 C ATOM 60 CG ASN A 5 -33.784 1.147 -13.340 1.00 0.00 C ATOM 61 OD1 ASN A 5 -33.877 2.089 -14.111 1.00 0.00 O ATOM 62 ND2 ASN A 5 -34.419 0.033 -13.616 1.00 0.00 N ATOM 0 H ASN A 5 -31.483 1.478 -10.175 1.00 0.00 H new ATOM 0 HA ASN A 5 -31.009 1.273 -12.940 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -32.849 0.215 -11.652 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -33.535 1.792 -11.311 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -34.980 -0.037 -14.465 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -34.351 -0.763 -12.982 1.00 0.00 H new ATOM 69 N PRO A 6 -31.056 3.553 -14.010 1.00 0.00 N ATOM 70 CA PRO A 6 -30.974 4.906 -14.555 1.00 0.00 C ATOM 71 C PRO A 6 -32.307 5.451 -15.060 1.00 0.00 C ATOM 72 O PRO A 6 -32.589 6.631 -14.850 1.00 0.00 O ATOM 73 CB PRO A 6 -29.944 4.842 -15.692 1.00 0.00 C ATOM 74 CG PRO A 6 -30.015 3.383 -16.137 1.00 0.00 C ATOM 75 CD PRO A 6 -30.300 2.627 -14.843 1.00 0.00 C ATOM 0 HA PRO A 6 -30.681 5.597 -13.765 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -30.196 5.524 -16.504 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -28.945 5.111 -15.348 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -30.802 3.227 -16.874 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -29.081 3.057 -16.594 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -30.870 1.718 -15.037 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -29.374 2.324 -14.353 1.00 0.00 H new ATOM 83 N VAL A 7 -33.156 4.607 -15.667 1.00 0.00 N ATOM 84 CA VAL A 7 -34.518 5.009 -16.054 1.00 0.00 C ATOM 85 C VAL A 7 -35.221 5.599 -14.840 1.00 0.00 C ATOM 86 O VAL A 7 -35.733 6.708 -14.849 1.00 0.00 O ATOM 87 CB VAL A 7 -35.366 3.832 -16.593 1.00 0.00 C ATOM 88 CG1 VAL A 7 -36.792 4.280 -16.909 1.00 0.00 C ATOM 89 CG2 VAL A 7 -34.643 3.069 -17.704 1.00 0.00 C ATOM 0 H VAL A 7 -32.923 3.642 -15.901 1.00 0.00 H new ATOM 0 HA VAL A 7 -34.423 5.738 -16.858 1.00 0.00 H new ATOM 0 HB VAL A 7 -35.483 3.086 -15.807 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -37.365 3.432 -17.286 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -37.263 4.662 -16.003 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -36.768 5.066 -17.664 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -35.273 2.251 -18.054 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -34.433 3.745 -18.533 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -33.707 2.666 -17.319 1.00 0.00 H new ATOM 99 N MET A 8 -35.240 4.807 -13.783 1.00 0.00 N ATOM 100 CA MET A 8 -35.897 5.081 -12.526 1.00 0.00 C ATOM 101 C MET A 8 -35.495 6.392 -11.824 1.00 0.00 C ATOM 102 O MET A 8 -36.386 7.163 -11.455 1.00 0.00 O ATOM 103 CB MET A 8 -35.683 3.826 -11.706 1.00 0.00 C ATOM 104 CG MET A 8 -36.679 3.674 -10.572 1.00 0.00 C ATOM 105 SD MET A 8 -38.441 3.712 -11.001 1.00 0.00 S ATOM 106 CE MET A 8 -39.139 3.671 -9.327 1.00 0.00 C ATOM 0 H MET A 8 -34.768 3.903 -13.783 1.00 0.00 H new ATOM 0 HA MET A 8 -36.956 5.288 -12.683 1.00 0.00 H new ATOM 0 HB2 MET A 8 -35.752 2.957 -12.360 1.00 0.00 H new ATOM 0 HB3 MET A 8 -34.674 3.836 -11.295 1.00 0.00 H new ATOM 0 HG2 MET A 8 -36.475 2.729 -10.068 1.00 0.00 H new ATOM 0 HG3 MET A 8 -36.491 4.468 -9.849 1.00 0.00 H new ATOM 0 HE1 MET A 8 -40.227 3.688 -9.386 1.00 0.00 H new ATOM 0 HE2 MET A 8 -38.817 2.761 -8.821 1.00 0.00 H new ATOM 0 HE3 MET A 8 -38.792 4.539 -8.767 1.00 0.00 H new ATOM 116 N ILE A 9 -34.201 6.670 -11.617 1.00 0.00 N ATOM 117 CA ILE A 9 -33.749 8.018 -11.213 1.00 0.00 C ATOM 118 C ILE A 9 -34.187 9.143 -12.159 1.00 0.00 C ATOM 119 O ILE A 9 -34.653 10.182 -11.686 1.00 0.00 O ATOM 120 CB ILE A 9 -32.257 8.129 -10.849 1.00 0.00 C ATOM 121 CG1 ILE A 9 -31.309 7.571 -11.922 1.00 0.00 C ATOM 122 CG2 ILE A 9 -32.012 7.451 -9.492 1.00 0.00 C ATOM 123 CD1 ILE A 9 -29.897 8.153 -11.841 1.00 0.00 C ATOM 0 H ILE A 9 -33.450 5.988 -11.720 1.00 0.00 H new ATOM 0 HA ILE A 9 -34.289 8.170 -10.278 1.00 0.00 H new ATOM 0 HB ILE A 9 -32.023 9.192 -10.786 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -31.254 6.487 -11.821 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -31.724 7.779 -12.908 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -30.956 7.528 -9.232 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -32.611 7.943 -8.726 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -32.294 6.400 -9.554 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -29.278 7.718 -12.626 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -29.941 9.234 -11.972 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -29.464 7.922 -10.868 1.00 0.00 H new ATOM 135 N LEU A 10 -34.017 8.995 -13.475 1.00 0.00 N ATOM 136 CA LEU A 10 -34.507 9.979 -14.460 1.00 0.00 C ATOM 137 C LEU A 10 -36.014 10.267 -14.348 1.00 0.00 C ATOM 138 O LEU A 10 -36.444 11.419 -14.342 1.00 0.00 O ATOM 139 CB LEU A 10 -33.928 9.615 -15.844 1.00 0.00 C ATOM 140 CG LEU A 10 -34.691 9.610 -17.172 1.00 0.00 C ATOM 141 CD1 LEU A 10 -35.781 8.560 -17.312 1.00 0.00 C ATOM 142 CD2 LEU A 10 -35.162 10.986 -17.572 1.00 0.00 C ATOM 0 H LEU A 10 -33.539 8.196 -13.892 1.00 0.00 H new ATOM 0 HA LEU A 10 -34.127 10.977 -14.242 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -33.083 10.287 -15.994 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -33.521 8.610 -15.736 1.00 0.00 H new ATOM 0 HG LEU A 10 -33.939 9.292 -17.894 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -36.251 8.652 -18.291 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -35.344 7.566 -17.211 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -36.530 8.707 -16.534 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -35.697 10.926 -18.520 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -35.828 11.380 -16.804 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -34.302 11.647 -17.681 1.00 0.00 H new ATOM 154 N ASN A 11 -36.797 9.210 -14.169 1.00 0.00 N ATOM 155 CA ASN A 11 -38.229 9.202 -13.872 1.00 0.00 C ATOM 156 C ASN A 11 -38.564 10.034 -12.620 1.00 0.00 C ATOM 157 O ASN A 11 -39.411 10.924 -12.656 1.00 0.00 O ATOM 158 CB ASN A 11 -38.613 7.717 -13.719 1.00 0.00 C ATOM 159 CG ASN A 11 -39.742 7.433 -12.742 1.00 0.00 C ATOM 160 OD1 ASN A 11 -40.915 7.617 -13.031 1.00 0.00 O ATOM 161 ND2 ASN A 11 -39.411 6.983 -11.553 1.00 0.00 N ATOM 0 H ASN A 11 -36.422 8.264 -14.232 1.00 0.00 H new ATOM 0 HA ASN A 11 -38.805 9.672 -14.669 1.00 0.00 H new ATOM 0 HB2 ASN A 11 -38.896 7.330 -14.698 1.00 0.00 H new ATOM 0 HB3 ASN A 11 -37.731 7.162 -13.400 1.00 0.00 H new ATOM 0 HD21 ASN A 11 -40.135 6.784 -10.863 1.00 0.00 H new ATOM 0 HD22 ASN A 11 -38.430 6.832 -11.320 1.00 0.00 H new ATOM 168 N GLU A 12 -37.901 9.717 -11.508 1.00 0.00 N ATOM 169 CA GLU A 12 -37.967 10.419 -10.229 1.00 0.00 C ATOM 170 C GLU A 12 -37.631 11.917 -10.354 1.00 0.00 C ATOM 171 O GLU A 12 -38.455 12.776 -10.043 1.00 0.00 O ATOM 172 CB GLU A 12 -37.042 9.659 -9.261 1.00 0.00 C ATOM 173 CG GLU A 12 -36.656 10.401 -7.970 1.00 0.00 C ATOM 174 CD GLU A 12 -35.678 9.601 -7.089 1.00 0.00 C ATOM 175 OE1 GLU A 12 -34.935 8.733 -7.606 1.00 0.00 O ATOM 176 OE2 GLU A 12 -35.612 9.855 -5.861 1.00 0.00 O ATOM 0 H GLU A 12 -37.268 8.918 -11.475 1.00 0.00 H new ATOM 0 HA GLU A 12 -38.986 10.421 -9.842 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -37.528 8.723 -8.986 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -36.127 9.399 -9.794 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -36.204 11.359 -8.228 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -37.558 10.618 -7.398 1.00 0.00 H new ATOM 183 N LEU A 13 -36.388 12.229 -10.742 1.00 0.00 N ATOM 184 CA LEU A 13 -35.887 13.580 -11.014 1.00 0.00 C ATOM 185 C LEU A 13 -36.663 14.400 -12.067 1.00 0.00 C ATOM 186 O LEU A 13 -36.635 15.629 -11.982 1.00 0.00 O ATOM 187 CB LEU A 13 -34.353 13.558 -11.179 1.00 0.00 C ATOM 188 CG LEU A 13 -33.606 13.076 -9.904 1.00 0.00 C ATOM 189 CD1 LEU A 13 -32.094 13.241 -10.069 1.00 0.00 C ATOM 190 CD2 LEU A 13 -34.015 13.803 -8.618 1.00 0.00 C ATOM 0 H LEU A 13 -35.674 11.514 -10.881 1.00 0.00 H new ATOM 0 HA LEU A 13 -36.107 14.174 -10.127 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -34.093 12.906 -12.013 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -34.008 14.559 -11.438 1.00 0.00 H new ATOM 0 HG LEU A 13 -33.889 12.029 -9.799 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -31.590 12.898 -9.166 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -31.754 12.651 -10.920 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -31.859 14.292 -10.239 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -33.446 13.405 -7.778 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -33.811 14.869 -8.722 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -35.080 13.653 -8.438 1.00 0.00 H new ATOM 202 N ARG A 14 -37.370 13.760 -13.018 1.00 0.00 N ATOM 203 CA ARG A 14 -38.159 14.332 -14.146 1.00 0.00 C ATOM 204 C ARG A 14 -37.776 15.762 -14.602 1.00 0.00 C ATOM 205 O ARG A 14 -38.602 16.668 -14.507 1.00 0.00 O ATOM 206 CB ARG A 14 -39.681 14.089 -13.977 1.00 0.00 C ATOM 207 CG ARG A 14 -40.373 14.343 -12.620 1.00 0.00 C ATOM 208 CD ARG A 14 -40.585 15.804 -12.196 1.00 0.00 C ATOM 209 NE ARG A 14 -39.344 16.434 -11.720 1.00 0.00 N ATOM 210 CZ ARG A 14 -39.115 17.717 -11.527 1.00 0.00 C ATOM 211 NH1 ARG A 14 -40.063 18.612 -11.548 1.00 0.00 N ATOM 212 NH2 ARG A 14 -37.896 18.117 -11.313 1.00 0.00 N ATOM 0 H ARG A 14 -37.413 12.741 -13.025 1.00 0.00 H new ATOM 0 HA ARG A 14 -37.848 13.751 -15.014 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -40.189 14.708 -14.717 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -39.872 13.050 -14.245 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -41.347 13.854 -12.642 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -39.786 13.849 -11.845 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -40.977 16.371 -13.040 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -41.336 15.846 -11.407 1.00 0.00 H new ATOM 0 HE ARG A 14 -38.569 15.803 -11.515 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -41.028 18.329 -11.719 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -39.840 19.595 -11.393 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -37.133 17.441 -11.296 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -37.703 19.107 -11.162 1.00 0.00 H new ATOM 226 N PRO A 15 -36.534 15.994 -15.076 1.00 0.00 N ATOM 227 CA PRO A 15 -35.888 17.319 -15.172 1.00 0.00 C ATOM 228 C PRO A 15 -36.411 18.286 -16.272 1.00 0.00 C ATOM 229 O PRO A 15 -35.631 18.991 -16.914 1.00 0.00 O ATOM 230 CB PRO A 15 -34.388 16.995 -15.292 1.00 0.00 C ATOM 231 CG PRO A 15 -34.363 15.645 -16.000 1.00 0.00 C ATOM 232 CD PRO A 15 -35.556 14.947 -15.366 1.00 0.00 C ATOM 0 HA PRO A 15 -36.134 17.913 -14.291 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -33.859 17.757 -15.864 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -33.911 16.942 -14.314 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -34.473 15.746 -17.080 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -33.432 15.107 -15.824 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -35.974 14.200 -16.041 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -35.263 14.425 -14.455 1.00 0.00 H new ATOM 240 N GLY A 16 -37.726 18.345 -16.511 1.00 0.00 N ATOM 241 CA GLY A 16 -38.364 19.263 -17.469 1.00 0.00 C ATOM 242 C GLY A 16 -38.439 18.710 -18.898 1.00 0.00 C ATOM 243 O GLY A 16 -38.317 19.467 -19.864 1.00 0.00 O ATOM 0 H GLY A 16 -38.395 17.742 -16.033 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -39.373 19.491 -17.124 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -37.812 20.203 -17.481 1.00 0.00 H new ATOM 247 N LEU A 17 -38.579 17.387 -19.035 1.00 0.00 N ATOM 248 CA LEU A 17 -38.458 16.641 -20.284 1.00 0.00 C ATOM 249 C LEU A 17 -39.787 16.190 -20.926 1.00 0.00 C ATOM 250 O LEU A 17 -40.864 16.270 -20.329 1.00 0.00 O ATOM 251 CB LEU A 17 -37.516 15.461 -20.018 1.00 0.00 C ATOM 252 CG LEU A 17 -37.809 14.608 -18.778 1.00 0.00 C ATOM 253 CD1 LEU A 17 -39.174 13.929 -18.763 1.00 0.00 C ATOM 254 CD2 LEU A 17 -36.736 13.547 -18.737 1.00 0.00 C ATOM 0 H LEU A 17 -38.789 16.784 -18.240 1.00 0.00 H new ATOM 0 HA LEU A 17 -38.053 17.317 -21.037 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -37.534 14.809 -20.891 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -36.501 15.849 -19.931 1.00 0.00 H new ATOM 0 HG LEU A 17 -37.816 15.271 -17.913 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -39.283 13.351 -17.845 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -39.957 14.686 -18.810 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -39.259 13.264 -19.623 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -36.892 12.905 -17.870 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -36.782 12.947 -19.646 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -35.757 14.022 -18.665 1.00 0.00 H new ATOM 266 N LYS A 18 -39.672 15.666 -22.150 1.00 0.00 N ATOM 267 CA LYS A 18 -40.637 14.801 -22.853 1.00 0.00 C ATOM 268 C LYS A 18 -39.942 13.621 -23.530 1.00 0.00 C ATOM 269 O LYS A 18 -38.856 13.798 -24.088 1.00 0.00 O ATOM 270 CB LYS A 18 -41.527 15.557 -23.849 1.00 0.00 C ATOM 271 CG LYS A 18 -40.770 16.376 -24.910 1.00 0.00 C ATOM 272 CD LYS A 18 -41.718 17.192 -25.806 1.00 0.00 C ATOM 273 CE LYS A 18 -42.656 16.338 -26.674 1.00 0.00 C ATOM 274 NZ LYS A 18 -41.946 15.693 -27.806 1.00 0.00 N ATOM 0 H LYS A 18 -38.845 15.845 -22.720 1.00 0.00 H new ATOM 0 HA LYS A 18 -41.302 14.416 -22.080 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -42.169 14.838 -24.358 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -42.180 16.229 -23.292 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -40.072 17.051 -24.415 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -40.177 15.703 -25.530 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -42.320 17.847 -25.177 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -41.123 17.833 -26.456 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -43.121 15.570 -26.055 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -43.459 16.965 -27.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -42.639 15.256 -28.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -41.398 16.409 -28.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -41.302 14.962 -27.441 1.00 0.00 H new ATOM 288 N TYR A 19 -40.565 12.442 -23.474 1.00 0.00 N ATOM 289 CA TYR A 19 -40.089 11.221 -24.132 1.00 0.00 C ATOM 290 C TYR A 19 -40.918 10.918 -25.384 1.00 0.00 C ATOM 291 O TYR A 19 -42.150 10.972 -25.369 1.00 0.00 O ATOM 292 CB TYR A 19 -40.192 9.984 -23.226 1.00 0.00 C ATOM 293 CG TYR A 19 -39.630 10.106 -21.835 1.00 0.00 C ATOM 294 CD1 TYR A 19 -40.436 10.658 -20.825 1.00 0.00 C ATOM 295 CD2 TYR A 19 -38.342 9.626 -21.529 1.00 0.00 C ATOM 296 CE1 TYR A 19 -39.944 10.775 -19.517 1.00 0.00 C ATOM 297 CE2 TYR A 19 -37.824 9.800 -20.236 1.00 0.00 C ATOM 298 CZ TYR A 19 -38.629 10.375 -19.221 1.00 0.00 C ATOM 299 OH TYR A 19 -38.207 10.468 -17.939 1.00 0.00 O ATOM 0 H TYR A 19 -41.434 12.305 -22.958 1.00 0.00 H new ATOM 0 HA TYR A 19 -39.045 11.411 -24.379 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -41.244 9.712 -23.143 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -39.687 9.157 -23.724 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -41.436 10.993 -21.056 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -37.755 9.126 -22.286 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -40.576 11.173 -18.736 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -36.812 9.496 -20.015 1.00 0.00 H new ATOM 0 HH TYR A 19 -38.256 9.586 -17.514 1.00 0.00 H new ATOM 309 N ASP A 20 -40.227 10.565 -26.463 1.00 0.00 N ATOM 310 CA ASP A 20 -40.801 10.157 -27.745 1.00 0.00 C ATOM 311 C ASP A 20 -40.173 8.825 -28.185 1.00 0.00 C ATOM 312 O ASP A 20 -38.948 8.668 -28.202 1.00 0.00 O ATOM 313 CB ASP A 20 -40.585 11.254 -28.798 1.00 0.00 C ATOM 314 CG ASP A 20 -41.151 12.617 -28.377 1.00 0.00 C ATOM 315 OD1 ASP A 20 -40.424 13.423 -27.747 1.00 0.00 O ATOM 316 OD2 ASP A 20 -42.322 12.925 -28.707 1.00 0.00 O ATOM 0 H ASP A 20 -39.207 10.554 -26.470 1.00 0.00 H new ATOM 0 HA ASP A 20 -41.876 10.013 -27.636 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -39.517 11.356 -28.993 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -41.052 10.947 -29.734 1.00 0.00 H new ATOM 321 N PHE A 21 -41.020 7.844 -28.505 1.00 0.00 N ATOM 322 CA PHE A 21 -40.626 6.455 -28.751 1.00 0.00 C ATOM 323 C PHE A 21 -40.660 6.114 -30.236 1.00 0.00 C ATOM 324 O PHE A 21 -41.634 6.379 -30.948 1.00 0.00 O ATOM 325 CB PHE A 21 -41.529 5.527 -27.929 1.00 0.00 C ATOM 326 CG PHE A 21 -41.223 4.055 -28.127 1.00 0.00 C ATOM 327 CD1 PHE A 21 -40.204 3.441 -27.377 1.00 0.00 C ATOM 328 CD2 PHE A 21 -41.929 3.309 -29.090 1.00 0.00 C ATOM 329 CE1 PHE A 21 -39.903 2.083 -27.573 1.00 0.00 C ATOM 330 CE2 PHE A 21 -41.622 1.952 -29.293 1.00 0.00 C ATOM 331 CZ PHE A 21 -40.618 1.336 -28.526 1.00 0.00 C ATOM 0 H PHE A 21 -42.024 7.997 -28.603 1.00 0.00 H new ATOM 0 HA PHE A 21 -39.593 6.315 -28.433 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -41.424 5.773 -26.872 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -42.569 5.713 -28.198 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -39.651 4.015 -26.648 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -42.707 3.779 -29.673 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -39.123 1.613 -26.992 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -42.158 1.383 -30.038 1.00 0.00 H new ATOM 0 HZ PHE A 21 -40.396 0.289 -28.669 1.00 0.00 H new ATOM 341 N LEU A 22 -39.563 5.509 -30.677 1.00 0.00 N ATOM 342 CA LEU A 22 -39.279 5.056 -32.014 1.00 0.00 C ATOM 343 C LEU A 22 -38.726 3.627 -31.858 1.00 0.00 C ATOM 344 O LEU A 22 -38.512 3.103 -30.765 1.00 0.00 O ATOM 345 CB LEU A 22 -38.369 6.033 -32.819 1.00 0.00 C ATOM 346 CG LEU A 22 -37.920 7.422 -32.284 1.00 0.00 C ATOM 347 CD1 LEU A 22 -39.042 8.461 -32.248 1.00 0.00 C ATOM 348 CD2 LEU A 22 -37.163 7.457 -30.961 1.00 0.00 C ATOM 0 H LEU A 22 -38.788 5.310 -30.044 1.00 0.00 H new ATOM 0 HA LEU A 22 -40.177 5.040 -32.632 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -37.457 5.483 -33.050 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -38.878 6.218 -33.765 1.00 0.00 H new ATOM 0 HG LEU A 22 -37.188 7.688 -33.046 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -38.653 9.404 -31.864 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -39.430 8.612 -33.255 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -39.844 8.108 -31.599 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -36.914 8.488 -30.712 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -37.787 7.034 -30.174 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -36.247 6.874 -31.051 1.00 0.00 H new ATOM 360 N SER A 23 -38.576 2.920 -32.956 1.00 0.00 N ATOM 361 CA SER A 23 -37.956 1.597 -32.948 1.00 0.00 C ATOM 362 C SER A 23 -37.203 1.352 -34.247 1.00 0.00 C ATOM 363 O SER A 23 -37.284 2.136 -35.195 1.00 0.00 O ATOM 364 CB SER A 23 -39.020 0.540 -32.641 1.00 0.00 C ATOM 365 OG SER A 23 -38.467 -0.750 -32.472 1.00 0.00 O ATOM 0 H SER A 23 -38.875 3.236 -33.878 1.00 0.00 H new ATOM 0 HA SER A 23 -37.208 1.532 -32.158 1.00 0.00 H new ATOM 0 HB2 SER A 23 -39.558 0.823 -31.736 1.00 0.00 H new ATOM 0 HB3 SER A 23 -39.749 0.516 -33.451 1.00 0.00 H new ATOM 0 HG SER A 23 -38.485 -1.228 -33.327 1.00 0.00 H new ATOM 371 N GLU A 24 -36.435 0.271 -34.249 1.00 0.00 N ATOM 372 CA GLU A 24 -35.888 -0.450 -35.398 1.00 0.00 C ATOM 373 C GLU A 24 -34.392 -0.169 -35.631 1.00 0.00 C ATOM 374 O GLU A 24 -33.824 -0.552 -36.659 1.00 0.00 O ATOM 375 CB GLU A 24 -36.708 -0.347 -36.713 1.00 0.00 C ATOM 376 CG GLU A 24 -38.226 -0.601 -36.643 1.00 0.00 C ATOM 377 CD GLU A 24 -38.565 -1.966 -36.031 1.00 0.00 C ATOM 378 OE1 GLU A 24 -38.373 -2.995 -36.722 1.00 0.00 O ATOM 379 OE2 GLU A 24 -39.002 -2.015 -34.858 1.00 0.00 O ATOM 0 H GLU A 24 -36.152 -0.165 -33.371 1.00 0.00 H new ATOM 0 HA GLU A 24 -35.986 -1.494 -35.099 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -36.555 0.651 -37.124 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -36.284 -1.054 -37.427 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -38.696 0.185 -36.052 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -38.648 -0.541 -37.646 1.00 0.00 H new ATOM 386 N SER A 25 -33.729 0.449 -34.647 1.00 0.00 N ATOM 387 CA SER A 25 -32.288 0.273 -34.435 1.00 0.00 C ATOM 388 C SER A 25 -31.938 -1.228 -34.257 1.00 0.00 C ATOM 389 O SER A 25 -32.813 -2.091 -34.119 1.00 0.00 O ATOM 390 CB SER A 25 -31.832 1.161 -33.257 1.00 0.00 C ATOM 391 OG SER A 25 -30.436 1.012 -33.049 1.00 0.00 O ATOM 0 H SER A 25 -34.172 1.081 -33.980 1.00 0.00 H new ATOM 0 HA SER A 25 -31.734 0.600 -35.315 1.00 0.00 H new ATOM 0 HB2 SER A 25 -32.068 2.205 -33.465 1.00 0.00 H new ATOM 0 HB3 SER A 25 -32.374 0.886 -32.352 1.00 0.00 H new ATOM 0 HG SER A 25 -30.041 1.885 -32.843 1.00 0.00 H new ATOM 397 N GLY A 26 -30.651 -1.561 -34.242 1.00 0.00 N ATOM 398 CA GLY A 26 -30.128 -2.924 -34.075 1.00 0.00 C ATOM 399 C GLY A 26 -28.623 -2.927 -33.787 1.00 0.00 C ATOM 400 O GLY A 26 -27.880 -3.750 -34.320 1.00 0.00 O ATOM 0 H GLY A 26 -29.911 -0.867 -34.349 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -30.655 -3.418 -33.258 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -30.326 -3.502 -34.978 1.00 0.00 H new ATOM 404 N GLU A 27 -28.161 -1.949 -32.999 1.00 0.00 N ATOM 405 CA GLU A 27 -26.742 -1.613 -32.783 1.00 0.00 C ATOM 406 C GLU A 27 -25.830 -2.761 -32.289 1.00 0.00 C ATOM 407 O GLU A 27 -24.622 -2.725 -32.540 1.00 0.00 O ATOM 408 CB GLU A 27 -26.641 -0.359 -31.887 1.00 0.00 C ATOM 409 CG GLU A 27 -26.883 -0.573 -30.381 1.00 0.00 C ATOM 410 CD GLU A 27 -28.248 -1.207 -30.088 1.00 0.00 C ATOM 411 OE1 GLU A 27 -29.277 -0.495 -30.157 1.00 0.00 O ATOM 412 OE2 GLU A 27 -28.302 -2.438 -29.852 1.00 0.00 O ATOM 0 H GLU A 27 -28.789 -1.343 -32.471 1.00 0.00 H new ATOM 0 HA GLU A 27 -26.337 -1.405 -33.773 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -25.649 0.074 -32.016 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -27.359 0.377 -32.247 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -26.096 -1.210 -29.977 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -26.813 0.385 -29.866 1.00 0.00 H new ATOM 419 N SER A 28 -26.385 -3.793 -31.636 1.00 0.00 N ATOM 420 CA SER A 28 -25.659 -5.005 -31.206 1.00 0.00 C ATOM 421 C SER A 28 -26.470 -6.317 -31.327 1.00 0.00 C ATOM 422 O SER A 28 -25.973 -7.383 -30.950 1.00 0.00 O ATOM 423 CB SER A 28 -25.156 -4.789 -29.768 1.00 0.00 C ATOM 424 OG SER A 28 -24.161 -5.732 -29.394 1.00 0.00 O ATOM 0 H SER A 28 -27.373 -3.812 -31.385 1.00 0.00 H new ATOM 0 HA SER A 28 -24.823 -5.142 -31.892 1.00 0.00 H new ATOM 0 HB2 SER A 28 -24.751 -3.781 -29.675 1.00 0.00 H new ATOM 0 HB3 SER A 28 -25.997 -4.859 -29.078 1.00 0.00 H new ATOM 0 HG SER A 28 -24.345 -6.591 -29.827 1.00 0.00 H new ATOM 430 N HIS A 29 -27.705 -6.281 -31.846 1.00 0.00 N ATOM 431 CA HIS A 29 -28.581 -7.457 -32.006 1.00 0.00 C ATOM 432 C HIS A 29 -29.657 -7.242 -33.092 1.00 0.00 C ATOM 433 O HIS A 29 -29.897 -6.113 -33.527 1.00 0.00 O ATOM 434 CB HIS A 29 -29.234 -7.770 -30.646 1.00 0.00 C ATOM 435 CG HIS A 29 -30.049 -9.040 -30.602 1.00 0.00 C ATOM 436 ND1 HIS A 29 -29.576 -10.321 -30.787 1.00 0.00 N ATOM 437 CD2 HIS A 29 -31.401 -9.134 -30.404 1.00 0.00 C ATOM 438 CE1 HIS A 29 -30.618 -11.167 -30.706 1.00 0.00 C ATOM 439 NE2 HIS A 29 -31.756 -10.487 -30.480 1.00 0.00 N ATOM 0 H HIS A 29 -28.135 -5.416 -32.174 1.00 0.00 H new ATOM 0 HA HIS A 29 -27.975 -8.300 -32.337 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -28.451 -7.834 -29.891 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -29.877 -6.935 -30.369 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -32.075 -8.310 -30.221 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -30.551 -12.240 -30.808 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -32.693 -10.879 -30.383 1.00 0.00 H new ATOM 447 N ALA A 30 -30.343 -8.318 -33.497 1.00 0.00 N ATOM 448 CA ALA A 30 -31.383 -8.349 -34.533 1.00 0.00 C ATOM 449 C ALA A 30 -32.567 -7.373 -34.332 1.00 0.00 C ATOM 450 O ALA A 30 -33.236 -7.034 -35.315 1.00 0.00 O ATOM 451 CB ALA A 30 -31.878 -9.798 -34.661 1.00 0.00 C ATOM 0 H ALA A 30 -30.179 -9.239 -33.090 1.00 0.00 H new ATOM 0 HA ALA A 30 -30.920 -7.993 -35.453 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -32.653 -9.851 -35.425 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -31.046 -10.443 -34.942 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -32.287 -10.129 -33.706 1.00 0.00 H new ATOM 457 N LYS A 31 -32.820 -6.883 -33.106 1.00 0.00 N ATOM 458 CA LYS A 31 -33.758 -5.773 -32.850 1.00 0.00 C ATOM 459 C LYS A 31 -33.364 -4.892 -31.664 1.00 0.00 C ATOM 460 O LYS A 31 -32.856 -5.371 -30.647 1.00 0.00 O ATOM 461 CB LYS A 31 -35.186 -6.324 -32.656 1.00 0.00 C ATOM 462 CG LYS A 31 -36.285 -5.250 -32.806 1.00 0.00 C ATOM 463 CD LYS A 31 -36.248 -4.466 -34.133 1.00 0.00 C ATOM 464 CE LYS A 31 -36.239 -5.411 -35.343 1.00 0.00 C ATOM 465 NZ LYS A 31 -36.186 -4.674 -36.629 1.00 0.00 N ATOM 0 H LYS A 31 -32.379 -7.246 -32.261 1.00 0.00 H new ATOM 0 HA LYS A 31 -33.719 -5.129 -33.729 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -35.363 -7.117 -33.382 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -35.262 -6.775 -31.666 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -37.258 -5.731 -32.712 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -36.198 -4.543 -31.981 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -37.114 -3.806 -34.191 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -35.362 -3.832 -34.158 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -35.381 -6.079 -35.274 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -37.132 -6.036 -35.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -36.113 -5.352 -37.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -37.051 -4.107 -36.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -35.357 -4.046 -36.635 1.00 0.00 H new ATOM 479 N SER A 32 -33.582 -3.589 -31.818 1.00 0.00 N ATOM 480 CA SER A 32 -33.476 -2.527 -30.816 1.00 0.00 C ATOM 481 C SER A 32 -34.670 -1.570 -30.899 1.00 0.00 C ATOM 482 O SER A 32 -35.077 -1.151 -31.990 1.00 0.00 O ATOM 483 CB SER A 32 -32.166 -1.759 -30.956 1.00 0.00 C ATOM 484 OG SER A 32 -31.761 -1.261 -29.705 1.00 0.00 O ATOM 0 H SER A 32 -33.862 -3.215 -32.725 1.00 0.00 H new ATOM 0 HA SER A 32 -33.485 -3.003 -29.835 1.00 0.00 H new ATOM 0 HB2 SER A 32 -31.394 -2.412 -31.363 1.00 0.00 H new ATOM 0 HB3 SER A 32 -32.291 -0.936 -31.660 1.00 0.00 H new ATOM 0 HG SER A 32 -30.790 -1.125 -29.706 1.00 0.00 H new ATOM 490 N PHE A 33 -35.221 -1.203 -29.748 1.00 0.00 N ATOM 491 CA PHE A 33 -36.298 -0.224 -29.625 1.00 0.00 C ATOM 492 C PHE A 33 -35.661 1.064 -29.110 1.00 0.00 C ATOM 493 O PHE A 33 -34.779 1.033 -28.255 1.00 0.00 O ATOM 494 CB PHE A 33 -37.341 -0.641 -28.585 1.00 0.00 C ATOM 495 CG PHE A 33 -38.072 -1.965 -28.714 1.00 0.00 C ATOM 496 CD1 PHE A 33 -37.975 -2.793 -29.851 1.00 0.00 C ATOM 497 CD2 PHE A 33 -38.880 -2.364 -27.635 1.00 0.00 C ATOM 498 CE1 PHE A 33 -38.652 -4.026 -29.881 1.00 0.00 C ATOM 499 CE2 PHE A 33 -39.541 -3.601 -27.657 1.00 0.00 C ATOM 500 CZ PHE A 33 -39.428 -4.436 -28.781 1.00 0.00 C ATOM 0 H PHE A 33 -34.925 -1.587 -28.851 1.00 0.00 H new ATOM 0 HA PHE A 33 -36.789 -0.121 -30.593 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -36.845 -0.641 -27.614 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -38.098 0.143 -28.557 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -37.382 -2.481 -30.698 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -38.993 -1.712 -26.781 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -38.576 -4.660 -30.752 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -40.136 -3.911 -26.811 1.00 0.00 H new ATOM 0 HZ PHE A 33 -39.935 -5.389 -28.801 1.00 0.00 H new ATOM 510 N VAL A 34 -36.019 2.203 -29.689 1.00 0.00 N ATOM 511 CA VAL A 34 -35.296 3.460 -29.425 1.00 0.00 C ATOM 512 C VAL A 34 -36.130 4.549 -28.750 1.00 0.00 C ATOM 513 O VAL A 34 -37.270 4.842 -29.089 1.00 0.00 O ATOM 514 CB VAL A 34 -34.550 3.889 -30.686 1.00 0.00 C ATOM 515 CG1 VAL A 34 -35.438 4.076 -31.884 1.00 0.00 C ATOM 516 CG2 VAL A 34 -33.648 5.112 -30.501 1.00 0.00 C ATOM 0 H VAL A 34 -36.798 2.292 -30.341 1.00 0.00 H new ATOM 0 HA VAL A 34 -34.548 3.268 -28.655 1.00 0.00 H new ATOM 0 HB VAL A 34 -33.900 3.037 -30.885 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -34.835 4.380 -32.740 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -35.944 3.138 -32.112 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -36.180 4.846 -31.670 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -33.157 5.348 -31.445 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -34.250 5.963 -30.183 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -32.894 4.897 -29.743 1.00 0.00 H new ATOM 526 N MET A 35 -35.525 5.170 -27.750 1.00 0.00 N ATOM 527 CA MET A 35 -36.132 6.234 -26.948 1.00 0.00 C ATOM 528 C MET A 35 -35.379 7.529 -27.141 1.00 0.00 C ATOM 529 O MET A 35 -34.161 7.587 -27.008 1.00 0.00 O ATOM 530 CB MET A 35 -36.142 5.840 -25.458 1.00 0.00 C ATOM 531 CG MET A 35 -37.267 4.862 -25.100 1.00 0.00 C ATOM 532 SD MET A 35 -38.750 5.569 -24.314 1.00 0.00 S ATOM 533 CE MET A 35 -39.124 6.975 -25.391 1.00 0.00 C ATOM 0 H MET A 35 -34.573 4.946 -27.462 1.00 0.00 H new ATOM 0 HA MET A 35 -37.161 6.376 -27.279 1.00 0.00 H new ATOM 0 HB2 MET A 35 -35.183 5.390 -25.201 1.00 0.00 H new ATOM 0 HB3 MET A 35 -36.245 6.740 -24.851 1.00 0.00 H new ATOM 0 HG2 MET A 35 -37.576 4.352 -26.012 1.00 0.00 H new ATOM 0 HG3 MET A 35 -36.858 4.103 -24.433 1.00 0.00 H new ATOM 0 HE1 MET A 35 -40.100 7.384 -25.130 1.00 0.00 H new ATOM 0 HE2 MET A 35 -38.363 7.744 -25.263 1.00 0.00 H new ATOM 0 HE3 MET A 35 -39.135 6.645 -26.430 1.00 0.00 H new ATOM 543 N SER A 36 -36.130 8.583 -27.422 1.00 0.00 N ATOM 544 CA SER A 36 -35.615 9.933 -27.568 1.00 0.00 C ATOM 545 C SER A 36 -36.235 10.880 -26.545 1.00 0.00 C ATOM 546 O SER A 36 -37.427 10.796 -26.252 1.00 0.00 O ATOM 547 CB SER A 36 -35.774 10.395 -29.008 1.00 0.00 C ATOM 548 OG SER A 36 -37.114 10.666 -29.369 1.00 0.00 O ATOM 0 H SER A 36 -37.139 8.520 -27.558 1.00 0.00 H new ATOM 0 HA SER A 36 -34.547 9.939 -27.351 1.00 0.00 H new ATOM 0 HB2 SER A 36 -35.176 11.293 -29.161 1.00 0.00 H new ATOM 0 HB3 SER A 36 -35.375 9.629 -29.673 1.00 0.00 H new ATOM 0 HG SER A 36 -37.704 10.000 -28.959 1.00 0.00 H new ATOM 554 N VAL A 37 -35.411 11.721 -25.921 1.00 0.00 N ATOM 555 CA VAL A 37 -35.851 12.736 -24.949 1.00 0.00 C ATOM 556 C VAL A 37 -35.440 14.136 -25.379 1.00 0.00 C ATOM 557 O VAL A 37 -34.298 14.363 -25.781 1.00 0.00 O ATOM 558 CB VAL A 37 -35.415 12.493 -23.489 1.00 0.00 C ATOM 559 CG1 VAL A 37 -36.279 11.493 -22.755 1.00 0.00 C ATOM 560 CG2 VAL A 37 -33.936 12.133 -23.319 1.00 0.00 C ATOM 0 H VAL A 37 -34.403 11.721 -26.075 1.00 0.00 H new ATOM 0 HA VAL A 37 -36.937 12.642 -24.953 1.00 0.00 H new ATOM 0 HB VAL A 37 -35.562 13.469 -23.027 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -35.912 11.374 -21.736 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -37.308 11.850 -22.731 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -36.240 10.532 -23.269 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -33.718 11.980 -22.262 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -33.718 11.218 -23.871 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -33.318 12.944 -23.703 1.00 0.00 H new ATOM 570 N VAL A 38 -36.378 15.074 -25.251 1.00 0.00 N ATOM 571 CA VAL A 38 -36.096 16.516 -25.304 1.00 0.00 C ATOM 572 C VAL A 38 -36.163 17.022 -23.867 1.00 0.00 C ATOM 573 O VAL A 38 -37.143 16.766 -23.167 1.00 0.00 O ATOM 574 CB VAL A 38 -37.123 17.284 -26.164 1.00 0.00 C ATOM 575 CG1 VAL A 38 -36.841 18.794 -26.163 1.00 0.00 C ATOM 576 CG2 VAL A 38 -37.127 16.829 -27.626 1.00 0.00 C ATOM 0 H VAL A 38 -37.364 14.857 -25.106 1.00 0.00 H new ATOM 0 HA VAL A 38 -35.120 16.680 -25.761 1.00 0.00 H new ATOM 0 HB VAL A 38 -38.090 17.069 -25.710 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -37.583 19.303 -26.778 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -36.894 19.173 -25.142 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -35.846 18.979 -26.568 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -37.868 17.402 -28.183 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -36.140 16.991 -28.060 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -37.376 15.769 -27.676 1.00 0.00 H new ATOM 586 N VAL A 39 -35.112 17.709 -23.416 1.00 0.00 N ATOM 587 CA VAL A 39 -34.971 18.260 -22.056 1.00 0.00 C ATOM 588 C VAL A 39 -34.142 19.550 -22.100 1.00 0.00 C ATOM 589 O VAL A 39 -33.256 19.669 -22.945 1.00 0.00 O ATOM 590 CB VAL A 39 -34.343 17.205 -21.112 1.00 0.00 C ATOM 591 CG1 VAL A 39 -32.905 16.814 -21.443 1.00 0.00 C ATOM 592 CG2 VAL A 39 -34.413 17.658 -19.653 1.00 0.00 C ATOM 0 H VAL A 39 -34.303 17.907 -24.005 1.00 0.00 H new ATOM 0 HA VAL A 39 -35.956 18.508 -21.660 1.00 0.00 H new ATOM 0 HB VAL A 39 -34.950 16.313 -21.270 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -32.556 16.071 -20.726 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -32.864 16.395 -22.448 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -32.267 17.696 -21.391 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -33.965 16.897 -19.014 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -33.870 18.596 -19.537 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -35.455 17.804 -19.367 1.00 0.00 H new ATOM 602 N ASP A 40 -34.410 20.504 -21.195 1.00 0.00 N ATOM 603 CA ASP A 40 -33.795 21.849 -21.094 1.00 0.00 C ATOM 604 C ASP A 40 -34.001 22.739 -22.346 1.00 0.00 C ATOM 605 O ASP A 40 -34.728 23.734 -22.308 1.00 0.00 O ATOM 606 CB ASP A 40 -32.312 21.700 -20.686 1.00 0.00 C ATOM 607 CG ASP A 40 -31.509 22.998 -20.861 1.00 0.00 C ATOM 608 OD1 ASP A 40 -31.768 23.979 -20.126 1.00 0.00 O ATOM 609 OD2 ASP A 40 -30.623 23.024 -21.751 1.00 0.00 O ATOM 0 H ASP A 40 -35.106 20.353 -20.465 1.00 0.00 H new ATOM 0 HA ASP A 40 -34.321 22.397 -20.313 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -32.257 21.383 -19.645 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -31.854 20.912 -21.284 1.00 0.00 H new ATOM 614 N GLY A 41 -33.402 22.340 -23.465 1.00 0.00 N ATOM 615 CA GLY A 41 -33.568 22.871 -24.824 1.00 0.00 C ATOM 616 C GLY A 41 -32.826 22.027 -25.879 1.00 0.00 C ATOM 617 O GLY A 41 -32.493 22.526 -26.955 1.00 0.00 O ATOM 0 H GLY A 41 -32.731 21.572 -23.448 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -34.629 22.905 -25.071 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -33.200 23.896 -24.858 1.00 0.00 H new ATOM 621 N GLN A 42 -32.492 20.778 -25.530 1.00 0.00 N ATOM 622 CA GLN A 42 -31.596 19.862 -26.239 1.00 0.00 C ATOM 623 C GLN A 42 -32.188 18.443 -26.328 1.00 0.00 C ATOM 624 O GLN A 42 -33.175 18.128 -25.657 1.00 0.00 O ATOM 625 CB GLN A 42 -30.185 19.910 -25.612 1.00 0.00 C ATOM 626 CG GLN A 42 -30.106 20.059 -24.077 1.00 0.00 C ATOM 627 CD GLN A 42 -28.685 20.371 -23.611 1.00 0.00 C ATOM 628 OE1 GLN A 42 -27.710 19.753 -24.020 1.00 0.00 O ATOM 629 NE2 GLN A 42 -28.498 21.359 -22.762 1.00 0.00 N ATOM 0 H GLN A 42 -32.869 20.353 -24.683 1.00 0.00 H new ATOM 0 HA GLN A 42 -31.493 20.191 -27.273 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -29.659 18.997 -25.892 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -29.642 20.741 -26.062 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -30.778 20.854 -23.754 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -30.450 19.139 -23.604 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -29.297 21.886 -22.409 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -27.554 21.597 -22.457 1.00 0.00 H new ATOM 638 N PHE A 43 -31.595 17.589 -27.166 1.00 0.00 N ATOM 639 CA PHE A 43 -32.180 16.320 -27.616 1.00 0.00 C ATOM 640 C PHE A 43 -31.171 15.160 -27.568 1.00 0.00 C ATOM 641 O PHE A 43 -30.015 15.306 -27.973 1.00 0.00 O ATOM 642 CB PHE A 43 -32.716 16.537 -29.038 1.00 0.00 C ATOM 643 CG PHE A 43 -33.258 15.304 -29.736 1.00 0.00 C ATOM 644 CD1 PHE A 43 -34.513 14.780 -29.376 1.00 0.00 C ATOM 645 CD2 PHE A 43 -32.527 14.703 -30.779 1.00 0.00 C ATOM 646 CE1 PHE A 43 -35.057 13.695 -30.084 1.00 0.00 C ATOM 647 CE2 PHE A 43 -33.060 13.601 -31.471 1.00 0.00 C ATOM 648 CZ PHE A 43 -34.330 13.101 -31.129 1.00 0.00 C ATOM 0 H PHE A 43 -30.671 17.764 -27.561 1.00 0.00 H new ATOM 0 HA PHE A 43 -32.987 16.032 -26.942 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -33.508 17.285 -28.997 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -31.915 16.954 -29.648 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -35.061 15.213 -28.552 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -31.555 15.089 -31.048 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -36.035 13.317 -29.825 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -32.494 13.138 -32.266 1.00 0.00 H new ATOM 0 HZ PHE A 43 -34.745 12.263 -31.669 1.00 0.00 H new ATOM 658 N PHE A 44 -31.632 14.005 -27.078 1.00 0.00 N ATOM 659 CA PHE A 44 -30.837 12.792 -26.838 1.00 0.00 C ATOM 660 C PHE A 44 -31.571 11.546 -27.348 1.00 0.00 C ATOM 661 O PHE A 44 -32.803 11.520 -27.376 1.00 0.00 O ATOM 662 CB PHE A 44 -30.535 12.656 -25.332 1.00 0.00 C ATOM 663 CG PHE A 44 -30.018 13.928 -24.685 1.00 0.00 C ATOM 664 CD1 PHE A 44 -30.928 14.917 -24.260 1.00 0.00 C ATOM 665 CD2 PHE A 44 -28.634 14.168 -24.597 1.00 0.00 C ATOM 666 CE1 PHE A 44 -30.457 16.154 -23.796 1.00 0.00 C ATOM 667 CE2 PHE A 44 -28.166 15.399 -24.103 1.00 0.00 C ATOM 668 CZ PHE A 44 -29.079 16.391 -23.709 1.00 0.00 C ATOM 0 H PHE A 44 -32.613 13.882 -26.826 1.00 0.00 H new ATOM 0 HA PHE A 44 -29.899 12.878 -27.386 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -31.443 12.343 -24.817 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -29.799 11.864 -25.190 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -31.990 14.722 -24.292 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -27.932 13.408 -24.908 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -31.157 16.924 -23.506 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -27.104 15.582 -24.027 1.00 0.00 H new ATOM 0 HZ PHE A 44 -28.718 17.339 -23.338 1.00 0.00 H new ATOM 678 N GLU A 45 -30.827 10.492 -27.697 1.00 0.00 N ATOM 679 CA GLU A 45 -31.357 9.231 -28.238 1.00 0.00 C ATOM 680 C GLU A 45 -30.656 8.006 -27.628 1.00 0.00 C ATOM 681 O GLU A 45 -29.432 7.959 -27.488 1.00 0.00 O ATOM 682 CB GLU A 45 -31.251 9.184 -29.772 1.00 0.00 C ATOM 683 CG GLU A 45 -32.195 10.176 -30.460 1.00 0.00 C ATOM 684 CD GLU A 45 -32.311 9.875 -31.966 1.00 0.00 C ATOM 685 OE1 GLU A 45 -33.144 9.020 -32.354 1.00 0.00 O ATOM 686 OE2 GLU A 45 -31.569 10.485 -32.774 1.00 0.00 O ATOM 0 H GLU A 45 -29.811 10.490 -27.610 1.00 0.00 H new ATOM 0 HA GLU A 45 -32.411 9.195 -27.961 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -30.225 9.400 -30.068 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -31.476 8.175 -30.117 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -33.181 10.125 -29.998 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -31.828 11.192 -30.316 1.00 0.00 H new ATOM 693 N GLY A 46 -31.466 7.017 -27.258 1.00 0.00 N ATOM 694 CA GLY A 46 -31.112 5.816 -26.516 1.00 0.00 C ATOM 695 C GLY A 46 -31.717 4.567 -27.153 1.00 0.00 C ATOM 696 O GLY A 46 -32.920 4.351 -27.040 1.00 0.00 O ATOM 0 H GLY A 46 -32.460 7.039 -27.487 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -30.027 5.717 -26.477 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -31.461 5.906 -25.487 1.00 0.00 H new ATOM 700 N SER A 47 -30.914 3.733 -27.816 1.00 0.00 N ATOM 701 CA SER A 47 -31.397 2.530 -28.522 1.00 0.00 C ATOM 702 C SER A 47 -31.058 1.267 -27.732 1.00 0.00 C ATOM 703 O SER A 47 -29.899 0.999 -27.402 1.00 0.00 O ATOM 704 CB SER A 47 -30.898 2.465 -29.969 1.00 0.00 C ATOM 705 OG SER A 47 -29.512 2.196 -30.065 1.00 0.00 O ATOM 0 H SER A 47 -29.905 3.868 -27.883 1.00 0.00 H new ATOM 0 HA SER A 47 -32.483 2.597 -28.585 1.00 0.00 H new ATOM 0 HB2 SER A 47 -31.450 1.692 -30.503 1.00 0.00 H new ATOM 0 HB3 SER A 47 -31.114 3.411 -30.465 1.00 0.00 H new ATOM 0 HG SER A 47 -29.367 1.227 -30.084 1.00 0.00 H new ATOM 711 N GLY A 48 -32.116 0.606 -27.272 1.00 0.00 N ATOM 712 CA GLY A 48 -32.060 -0.510 -26.322 1.00 0.00 C ATOM 713 C GLY A 48 -32.954 -1.704 -26.654 1.00 0.00 C ATOM 714 O GLY A 48 -34.069 -1.512 -27.133 1.00 0.00 O ATOM 0 H GLY A 48 -33.068 0.836 -27.557 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -31.029 -0.858 -26.257 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -32.333 -0.138 -25.335 1.00 0.00 H new ATOM 718 N ARG A 49 -32.491 -2.937 -26.385 1.00 0.00 N ATOM 719 CA ARG A 49 -33.260 -4.200 -26.531 1.00 0.00 C ATOM 720 C ARG A 49 -34.782 -4.053 -26.315 1.00 0.00 C ATOM 721 O ARG A 49 -35.549 -4.383 -27.218 1.00 0.00 O ATOM 722 CB ARG A 49 -32.693 -5.301 -25.606 1.00 0.00 C ATOM 723 CG ARG A 49 -31.226 -5.724 -25.816 1.00 0.00 C ATOM 724 CD ARG A 49 -30.951 -6.540 -27.088 1.00 0.00 C ATOM 725 NE ARG A 49 -31.036 -5.732 -28.317 1.00 0.00 N ATOM 726 CZ ARG A 49 -30.181 -4.818 -28.733 1.00 0.00 C ATOM 727 NH1 ARG A 49 -29.110 -4.455 -28.098 1.00 0.00 N ATOM 728 NH2 ARG A 49 -30.382 -4.220 -29.856 1.00 0.00 N ATOM 0 H ARG A 49 -31.541 -3.095 -26.049 1.00 0.00 H new ATOM 0 HA ARG A 49 -33.134 -4.490 -27.574 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -32.801 -4.962 -24.576 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -33.317 -6.187 -25.717 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -30.607 -4.827 -25.839 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -30.907 -6.309 -24.953 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -29.959 -6.986 -27.020 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -31.666 -7.361 -27.149 1.00 0.00 H new ATOM 0 HE ARG A 49 -31.847 -5.898 -28.913 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -28.876 -4.887 -27.204 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -28.501 -3.738 -28.493 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -31.200 -4.454 -30.419 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -29.724 -3.512 -30.182 1.00 0.00 H new ATOM 742 N ASN A 50 -35.200 -3.480 -25.176 1.00 0.00 N ATOM 743 CA ASN A 50 -36.529 -2.863 -24.980 1.00 0.00 C ATOM 744 C ASN A 50 -36.402 -1.532 -24.193 1.00 0.00 C ATOM 745 O ASN A 50 -35.285 -1.138 -23.846 1.00 0.00 O ATOM 746 CB ASN A 50 -37.554 -3.814 -24.300 1.00 0.00 C ATOM 747 CG ASN A 50 -37.372 -5.318 -24.456 1.00 0.00 C ATOM 748 OD1 ASN A 50 -37.208 -6.036 -23.480 1.00 0.00 O ATOM 749 ND2 ASN A 50 -37.418 -5.856 -25.650 1.00 0.00 N ATOM 0 H ASN A 50 -34.613 -3.430 -24.344 1.00 0.00 H new ATOM 0 HA ASN A 50 -36.923 -2.653 -25.974 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -37.555 -3.590 -23.233 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -38.543 -3.560 -24.680 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -37.317 -6.865 -25.759 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -37.554 -5.266 -26.470 1.00 0.00 H new ATOM 756 N LYS A 51 -37.519 -0.863 -23.836 1.00 0.00 N ATOM 757 CA LYS A 51 -37.548 0.399 -23.042 1.00 0.00 C ATOM 758 C LYS A 51 -36.632 0.399 -21.820 1.00 0.00 C ATOM 759 O LYS A 51 -35.895 1.362 -21.664 1.00 0.00 O ATOM 760 CB LYS A 51 -38.970 0.811 -22.633 1.00 0.00 C ATOM 761 CG LYS A 51 -39.753 1.348 -23.846 1.00 0.00 C ATOM 762 CD LYS A 51 -41.234 1.591 -23.533 1.00 0.00 C ATOM 763 CE LYS A 51 -41.955 2.079 -24.798 1.00 0.00 C ATOM 764 NZ LYS A 51 -43.414 2.250 -24.578 1.00 0.00 N ATOM 0 H LYS A 51 -38.451 -1.187 -24.094 1.00 0.00 H new ATOM 0 HA LYS A 51 -37.152 1.145 -23.731 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -39.493 -0.045 -22.206 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -38.923 1.575 -21.857 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -39.299 2.280 -24.183 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -39.671 0.638 -24.669 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -41.695 0.672 -23.171 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -41.331 2.331 -22.738 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -41.523 3.027 -25.118 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -41.792 1.366 -25.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -43.861 2.580 -25.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -43.832 1.340 -24.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -43.572 2.950 -23.825 1.00 0.00 H new ATOM 778 N LYS A 52 -36.577 -0.673 -21.022 1.00 0.00 N ATOM 779 CA LYS A 52 -35.676 -0.792 -19.846 1.00 0.00 C ATOM 780 C LYS A 52 -34.181 -0.548 -20.119 1.00 0.00 C ATOM 781 O LYS A 52 -33.430 -0.279 -19.185 1.00 0.00 O ATOM 782 CB LYS A 52 -35.911 -2.136 -19.118 1.00 0.00 C ATOM 783 CG LYS A 52 -35.171 -3.372 -19.674 1.00 0.00 C ATOM 784 CD LYS A 52 -35.515 -3.727 -21.129 1.00 0.00 C ATOM 785 CE LYS A 52 -34.756 -4.967 -21.625 1.00 0.00 C ATOM 786 NZ LYS A 52 -35.435 -6.234 -21.243 1.00 0.00 N ATOM 0 H LYS A 52 -37.159 -1.498 -21.167 1.00 0.00 H new ATOM 0 HA LYS A 52 -35.955 0.035 -19.193 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -35.624 -2.011 -18.074 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -36.980 -2.347 -19.132 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -34.097 -3.199 -19.601 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -35.399 -4.230 -19.042 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -36.587 -3.903 -21.213 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -35.280 -2.879 -21.772 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -34.660 -4.922 -22.710 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -33.746 -4.960 -21.215 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -34.740 -7.007 -21.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -35.865 -6.127 -20.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -36.176 -6.455 -21.939 1.00 0.00 H new ATOM 800 N LEU A 53 -33.769 -0.603 -21.388 1.00 0.00 N ATOM 801 CA LEU A 53 -32.428 -0.288 -21.874 1.00 0.00 C ATOM 802 C LEU A 53 -32.445 0.941 -22.803 1.00 0.00 C ATOM 803 O LEU A 53 -31.557 1.781 -22.703 1.00 0.00 O ATOM 804 CB LEU A 53 -31.866 -1.564 -22.530 1.00 0.00 C ATOM 805 CG LEU A 53 -30.450 -1.462 -23.127 1.00 0.00 C ATOM 806 CD1 LEU A 53 -29.418 -0.883 -22.161 1.00 0.00 C ATOM 807 CD2 LEU A 53 -29.980 -2.859 -23.523 1.00 0.00 C ATOM 0 H LEU A 53 -34.397 -0.883 -22.142 1.00 0.00 H new ATOM 0 HA LEU A 53 -31.766 0.001 -21.058 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -31.866 -2.359 -21.785 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -32.549 -1.870 -23.322 1.00 0.00 H new ATOM 0 HG LEU A 53 -30.522 -0.787 -23.980 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -28.445 -0.841 -22.650 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -29.719 0.122 -21.866 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -29.352 -1.516 -21.276 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -28.978 -2.799 -23.947 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -29.963 -3.501 -22.642 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -30.663 -3.276 -24.263 1.00 0.00 H new ATOM 819 N ALA A 54 -33.460 1.102 -23.658 1.00 0.00 N ATOM 820 CA ALA A 54 -33.659 2.288 -24.498 1.00 0.00 C ATOM 821 C ALA A 54 -33.707 3.585 -23.667 1.00 0.00 C ATOM 822 O ALA A 54 -32.903 4.499 -23.863 1.00 0.00 O ATOM 823 CB ALA A 54 -34.909 2.063 -25.359 1.00 0.00 C ATOM 0 H ALA A 54 -34.183 0.395 -23.788 1.00 0.00 H new ATOM 0 HA ALA A 54 -32.804 2.425 -25.161 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -35.076 2.934 -25.993 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -34.766 1.182 -25.984 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -35.774 1.913 -24.713 1.00 0.00 H new ATOM 829 N LYS A 55 -34.599 3.632 -22.667 1.00 0.00 N ATOM 830 CA LYS A 55 -34.544 4.599 -21.565 1.00 0.00 C ATOM 831 C LYS A 55 -33.216 4.570 -20.835 1.00 0.00 C ATOM 832 O LYS A 55 -32.756 5.652 -20.576 1.00 0.00 O ATOM 833 CB LYS A 55 -35.689 4.415 -20.564 1.00 0.00 C ATOM 834 CG LYS A 55 -37.015 4.999 -20.986 1.00 0.00 C ATOM 835 CD LYS A 55 -37.383 6.316 -20.304 1.00 0.00 C ATOM 836 CE LYS A 55 -38.903 6.240 -20.325 1.00 0.00 C ATOM 837 NZ LYS A 55 -39.604 7.383 -19.689 1.00 0.00 N ATOM 0 H LYS A 55 -35.389 2.990 -22.602 1.00 0.00 H new ATOM 0 HA LYS A 55 -34.656 5.576 -22.035 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -35.822 3.349 -20.381 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -35.397 4.867 -19.616 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -37.000 5.157 -22.064 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -37.799 4.269 -20.782 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -36.987 6.380 -19.290 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -37.006 7.182 -20.849 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -39.232 6.164 -21.361 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -39.211 5.322 -19.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -40.631 7.273 -19.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -39.379 7.407 -18.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -39.295 8.271 -20.133 1.00 0.00 H new ATOM 851 N ALA A 56 -32.575 3.450 -20.478 1.00 0.00 N ATOM 852 CA ALA A 56 -31.312 3.509 -19.728 1.00 0.00 C ATOM 853 C ALA A 56 -30.267 4.363 -20.455 1.00 0.00 C ATOM 854 O ALA A 56 -29.674 5.256 -19.862 1.00 0.00 O ATOM 855 CB ALA A 56 -30.787 2.102 -19.424 1.00 0.00 C ATOM 0 H ALA A 56 -32.902 2.508 -20.691 1.00 0.00 H new ATOM 0 HA ALA A 56 -31.513 3.996 -18.774 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -29.852 2.175 -18.869 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -31.522 1.560 -18.828 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -30.613 1.569 -20.359 1.00 0.00 H new ATOM 861 N ARG A 57 -30.100 4.119 -21.757 1.00 0.00 N ATOM 862 CA ARG A 57 -29.299 4.913 -22.698 1.00 0.00 C ATOM 863 C ARG A 57 -29.712 6.399 -22.726 1.00 0.00 C ATOM 864 O ARG A 57 -28.914 7.276 -22.376 1.00 0.00 O ATOM 865 CB ARG A 57 -29.410 4.237 -24.080 1.00 0.00 C ATOM 866 CG ARG A 57 -28.991 2.754 -24.139 1.00 0.00 C ATOM 867 CD ARG A 57 -27.694 2.510 -24.906 1.00 0.00 C ATOM 868 NE ARG A 57 -27.867 2.703 -26.365 1.00 0.00 N ATOM 869 CZ ARG A 57 -27.444 3.699 -27.125 1.00 0.00 C ATOM 870 NH1 ARG A 57 -26.753 4.699 -26.656 1.00 0.00 N ATOM 871 NH2 ARG A 57 -27.740 3.733 -28.392 1.00 0.00 N ATOM 0 H ARG A 57 -30.543 3.319 -22.210 1.00 0.00 H new ATOM 0 HA ARG A 57 -28.258 4.931 -22.376 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -30.442 4.317 -24.420 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -28.797 4.796 -24.787 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -28.877 2.378 -23.122 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -29.791 2.178 -24.604 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -26.923 3.188 -24.540 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -27.344 1.496 -24.713 1.00 0.00 H new ATOM 0 HE ARG A 57 -28.382 1.968 -26.849 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -26.517 4.735 -25.664 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -26.448 5.445 -27.281 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -28.302 2.988 -28.805 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -27.410 4.504 -28.972 1.00 0.00 H new ATOM 885 N ALA A 58 -30.958 6.673 -23.135 1.00 0.00 N ATOM 886 CA ALA A 58 -31.547 8.018 -23.221 1.00 0.00 C ATOM 887 C ALA A 58 -31.469 8.783 -21.888 1.00 0.00 C ATOM 888 O ALA A 58 -30.873 9.861 -21.821 1.00 0.00 O ATOM 889 CB ALA A 58 -32.994 7.897 -23.718 1.00 0.00 C ATOM 0 H ALA A 58 -31.606 5.941 -23.425 1.00 0.00 H new ATOM 0 HA ALA A 58 -30.965 8.605 -23.932 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -33.440 8.889 -23.785 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -33.003 7.428 -24.702 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -33.569 7.288 -23.020 1.00 0.00 H new ATOM 895 N ALA A 59 -32.011 8.184 -20.824 1.00 0.00 N ATOM 896 CA ALA A 59 -31.804 8.575 -19.429 1.00 0.00 C ATOM 897 C ALA A 59 -30.359 8.930 -19.086 1.00 0.00 C ATOM 898 O ALA A 59 -30.135 10.075 -18.729 1.00 0.00 O ATOM 899 CB ALA A 59 -32.300 7.485 -18.463 1.00 0.00 C ATOM 0 H ALA A 59 -32.632 7.380 -20.916 1.00 0.00 H new ATOM 0 HA ALA A 59 -32.394 9.483 -19.306 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -32.132 7.806 -17.435 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -33.365 7.316 -18.621 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -31.755 6.559 -18.648 1.00 0.00 H new ATOM 905 N GLN A 60 -29.390 8.009 -19.160 1.00 0.00 N ATOM 906 CA GLN A 60 -27.999 8.280 -18.760 1.00 0.00 C ATOM 907 C GLN A 60 -27.423 9.497 -19.503 1.00 0.00 C ATOM 908 O GLN A 60 -26.832 10.376 -18.875 1.00 0.00 O ATOM 909 CB GLN A 60 -27.122 7.026 -18.960 1.00 0.00 C ATOM 910 CG GLN A 60 -25.956 6.877 -17.970 1.00 0.00 C ATOM 911 CD GLN A 60 -25.004 8.070 -17.890 1.00 0.00 C ATOM 912 OE1 GLN A 60 -24.889 8.735 -16.869 1.00 0.00 O ATOM 913 NE2 GLN A 60 -24.277 8.379 -18.944 1.00 0.00 N ATOM 0 H GLN A 60 -29.544 7.059 -19.497 1.00 0.00 H new ATOM 0 HA GLN A 60 -27.997 8.526 -17.698 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -27.757 6.143 -18.885 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -26.718 7.043 -19.972 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -26.367 6.695 -16.977 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -25.380 5.993 -18.244 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -24.363 7.833 -19.801 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -23.628 9.165 -18.903 1.00 0.00 H new ATOM 922 N SER A 61 -27.640 9.576 -20.823 1.00 0.00 N ATOM 923 CA SER A 61 -27.223 10.726 -21.644 1.00 0.00 C ATOM 924 C SER A 61 -27.779 12.056 -21.110 1.00 0.00 C ATOM 925 O SER A 61 -27.024 12.976 -20.759 1.00 0.00 O ATOM 926 CB SER A 61 -27.637 10.530 -23.112 1.00 0.00 C ATOM 927 OG SER A 61 -27.133 9.311 -23.637 1.00 0.00 O ATOM 0 H SER A 61 -28.111 8.844 -21.355 1.00 0.00 H new ATOM 0 HA SER A 61 -26.136 10.777 -21.585 1.00 0.00 H new ATOM 0 HB2 SER A 61 -28.724 10.538 -23.189 1.00 0.00 H new ATOM 0 HB3 SER A 61 -27.269 11.364 -23.709 1.00 0.00 H new ATOM 0 HG SER A 61 -27.654 8.561 -23.281 1.00 0.00 H new ATOM 933 N ALA A 62 -29.110 12.135 -21.008 1.00 0.00 N ATOM 934 CA ALA A 62 -29.823 13.268 -20.435 1.00 0.00 C ATOM 935 C ALA A 62 -29.354 13.598 -19.009 1.00 0.00 C ATOM 936 O ALA A 62 -28.992 14.740 -18.759 1.00 0.00 O ATOM 937 CB ALA A 62 -31.326 12.987 -20.506 1.00 0.00 C ATOM 0 H ALA A 62 -29.731 11.393 -21.331 1.00 0.00 H new ATOM 0 HA ALA A 62 -29.599 14.161 -21.018 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -31.874 13.828 -20.080 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -31.622 12.851 -21.546 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -31.554 12.082 -19.942 1.00 0.00 H new ATOM 943 N LEU A 63 -29.300 12.610 -18.105 1.00 0.00 N ATOM 944 CA LEU A 63 -28.869 12.728 -16.708 1.00 0.00 C ATOM 945 C LEU A 63 -27.499 13.385 -16.609 1.00 0.00 C ATOM 946 O LEU A 63 -27.393 14.460 -16.033 1.00 0.00 O ATOM 947 CB LEU A 63 -28.843 11.348 -16.005 1.00 0.00 C ATOM 948 CG LEU A 63 -30.025 10.976 -15.084 1.00 0.00 C ATOM 949 CD1 LEU A 63 -31.263 11.871 -15.181 1.00 0.00 C ATOM 950 CD2 LEU A 63 -30.439 9.524 -15.310 1.00 0.00 C ATOM 0 H LEU A 63 -29.571 11.656 -18.343 1.00 0.00 H new ATOM 0 HA LEU A 63 -29.598 13.360 -16.200 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -28.769 10.582 -16.777 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -27.929 11.293 -15.413 1.00 0.00 H new ATOM 0 HG LEU A 63 -29.634 11.132 -14.079 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -32.026 11.513 -14.489 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -30.992 12.895 -14.925 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -31.654 11.843 -16.198 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -31.273 9.277 -14.653 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -30.742 9.390 -16.348 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -29.597 8.867 -15.090 1.00 0.00 H new ATOM 962 N ALA A 64 -26.466 12.780 -17.206 1.00 0.00 N ATOM 963 CA ALA A 64 -25.117 13.332 -17.192 1.00 0.00 C ATOM 964 C ALA A 64 -25.108 14.785 -17.701 1.00 0.00 C ATOM 965 O ALA A 64 -24.554 15.669 -17.037 1.00 0.00 O ATOM 966 CB ALA A 64 -24.201 12.416 -18.013 1.00 0.00 C ATOM 0 H ALA A 64 -26.547 11.897 -17.710 1.00 0.00 H new ATOM 0 HA ALA A 64 -24.741 13.370 -16.170 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -23.188 12.818 -18.011 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -24.197 11.418 -17.574 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -24.567 12.360 -19.038 1.00 0.00 H new ATOM 972 N THR A 65 -25.773 15.042 -18.836 1.00 0.00 N ATOM 973 CA THR A 65 -25.968 16.405 -19.357 1.00 0.00 C ATOM 974 C THR A 65 -26.633 17.368 -18.359 1.00 0.00 C ATOM 975 O THR A 65 -25.967 18.277 -17.857 1.00 0.00 O ATOM 976 CB THR A 65 -26.685 16.402 -20.714 1.00 0.00 C ATOM 977 OG1 THR A 65 -25.995 15.565 -21.618 1.00 0.00 O ATOM 978 CG2 THR A 65 -26.707 17.811 -21.309 1.00 0.00 C ATOM 0 H THR A 65 -26.190 14.315 -19.418 1.00 0.00 H new ATOM 0 HA THR A 65 -24.964 16.800 -19.512 1.00 0.00 H new ATOM 0 HB THR A 65 -27.703 16.045 -20.557 1.00 0.00 H new ATOM 0 HG1 THR A 65 -26.240 14.631 -21.451 1.00 0.00 H new ATOM 0 HG21 THR A 65 -27.219 17.792 -22.271 1.00 0.00 H new ATOM 0 HG22 THR A 65 -27.233 18.484 -20.632 1.00 0.00 H new ATOM 0 HG23 THR A 65 -25.685 18.163 -21.449 1.00 0.00 H new ATOM 986 N VAL A 66 -27.931 17.212 -18.063 1.00 0.00 N ATOM 987 CA VAL A 66 -28.674 18.108 -17.158 1.00 0.00 C ATOM 988 C VAL A 66 -28.033 18.244 -15.775 1.00 0.00 C ATOM 989 O VAL A 66 -27.981 19.344 -15.235 1.00 0.00 O ATOM 990 CB VAL A 66 -30.185 17.815 -17.060 1.00 0.00 C ATOM 991 CG1 VAL A 66 -30.891 18.134 -18.380 1.00 0.00 C ATOM 992 CG2 VAL A 66 -30.589 16.395 -16.646 1.00 0.00 C ATOM 0 H VAL A 66 -28.500 16.457 -18.446 1.00 0.00 H new ATOM 0 HA VAL A 66 -28.596 19.081 -17.643 1.00 0.00 H new ATOM 0 HB VAL A 66 -30.501 18.469 -16.247 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -31.955 17.919 -18.285 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -30.754 19.188 -18.620 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -30.467 17.522 -19.176 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -31.676 16.320 -16.615 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -30.197 15.680 -17.369 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -30.182 16.174 -15.659 1.00 0.00 H new ATOM 1002 N PHE A 67 -27.510 17.169 -15.187 1.00 0.00 N ATOM 1003 CA PHE A 67 -26.696 17.226 -13.968 1.00 0.00 C ATOM 1004 C PHE A 67 -25.464 18.139 -14.081 1.00 0.00 C ATOM 1005 O PHE A 67 -25.220 18.928 -13.171 1.00 0.00 O ATOM 1006 CB PHE A 67 -26.374 15.824 -13.448 1.00 0.00 C ATOM 1007 CG PHE A 67 -27.576 14.955 -13.090 1.00 0.00 C ATOM 1008 CD1 PHE A 67 -28.906 15.432 -13.171 1.00 0.00 C ATOM 1009 CD2 PHE A 67 -27.350 13.621 -12.699 1.00 0.00 C ATOM 1010 CE1 PHE A 67 -29.986 14.582 -12.900 1.00 0.00 C ATOM 1011 CE2 PHE A 67 -28.432 12.773 -12.409 1.00 0.00 C ATOM 1012 CZ PHE A 67 -29.748 13.252 -12.527 1.00 0.00 C ATOM 0 H PHE A 67 -27.639 16.223 -15.545 1.00 0.00 H new ATOM 0 HA PHE A 67 -27.310 17.712 -13.210 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -25.786 15.303 -14.203 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -25.744 15.921 -12.564 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -29.090 16.461 -13.444 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -26.339 13.248 -12.622 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -30.998 14.950 -12.978 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -28.253 11.755 -12.096 1.00 0.00 H new ATOM 0 HZ PHE A 67 -30.580 12.592 -12.329 1.00 0.00 H new ATOM 1022 N ASN A 68 -24.680 18.062 -15.169 1.00 0.00 N ATOM 1023 CA ASN A 68 -23.673 19.081 -15.521 1.00 0.00 C ATOM 1024 C ASN A 68 -24.235 20.517 -15.645 1.00 0.00 C ATOM 1025 O ASN A 68 -23.533 21.470 -15.303 1.00 0.00 O ATOM 1026 CB ASN A 68 -22.898 18.638 -16.782 1.00 0.00 C ATOM 1027 CG ASN A 68 -21.476 19.181 -16.900 1.00 0.00 C ATOM 1028 OD1 ASN A 68 -20.550 18.462 -17.252 1.00 0.00 O ATOM 1029 ND2 ASN A 68 -21.227 20.443 -16.626 1.00 0.00 N ATOM 0 H ASN A 68 -24.726 17.289 -15.833 1.00 0.00 H new ATOM 0 HA ASN A 68 -22.979 19.144 -14.683 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -22.856 17.549 -16.798 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -23.462 18.948 -17.662 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -20.277 20.805 -16.709 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -21.984 21.060 -16.331 1.00 0.00 H new ATOM 1036 N LEU A 69 -25.471 20.698 -16.132 1.00 0.00 N ATOM 1037 CA LEU A 69 -26.159 22.011 -16.094 1.00 0.00 C ATOM 1038 C LEU A 69 -26.559 22.435 -14.661 1.00 0.00 C ATOM 1039 O LEU A 69 -26.637 23.630 -14.370 1.00 0.00 O ATOM 1040 CB LEU A 69 -27.425 22.017 -16.972 1.00 0.00 C ATOM 1041 CG LEU A 69 -27.311 21.402 -18.372 1.00 0.00 C ATOM 1042 CD1 LEU A 69 -28.652 21.532 -19.095 1.00 0.00 C ATOM 1043 CD2 LEU A 69 -26.241 22.080 -19.229 1.00 0.00 C ATOM 0 H LEU A 69 -26.022 19.954 -16.559 1.00 0.00 H new ATOM 0 HA LEU A 69 -25.434 22.726 -16.483 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -28.212 21.488 -16.434 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -27.754 23.050 -17.083 1.00 0.00 H new ATOM 0 HG LEU A 69 -27.028 20.358 -18.237 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -28.572 21.095 -20.090 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -29.423 21.008 -18.529 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -28.918 22.585 -19.181 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -26.204 21.604 -20.209 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -26.485 23.136 -19.347 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -25.270 21.984 -18.742 1.00 0.00 H new ATOM 1055 N HIS A 70 -26.815 21.442 -13.801 1.00 0.00 N ATOM 1056 CA HIS A 70 -27.123 21.477 -12.363 1.00 0.00 C ATOM 1057 C HIS A 70 -28.638 21.529 -12.044 1.00 0.00 C ATOM 1058 O HIS A 70 -29.051 22.195 -11.088 1.00 0.00 O ATOM 1059 CB HIS A 70 -26.249 22.486 -11.585 1.00 0.00 C ATOM 1060 CG HIS A 70 -24.758 22.349 -11.825 1.00 0.00 C ATOM 1061 ND1 HIS A 70 -24.047 21.180 -11.980 1.00 0.00 N ATOM 1062 CD2 HIS A 70 -23.855 23.372 -11.942 1.00 0.00 C ATOM 1063 CE1 HIS A 70 -22.757 21.487 -12.192 1.00 0.00 C ATOM 1064 NE2 HIS A 70 -22.584 22.820 -12.163 1.00 0.00 N ATOM 0 H HIS A 70 -26.811 20.478 -14.136 1.00 0.00 H new ATOM 0 HA HIS A 70 -26.825 20.505 -11.970 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -26.556 23.496 -11.856 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -26.444 22.369 -10.519 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -24.436 20.238 -11.940 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -24.083 24.426 -11.875 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -21.971 20.766 -12.362 1.00 0.00 H new ATOM 1072 N LEU A 71 -29.470 20.809 -12.822 1.00 0.00 N ATOM 1073 CA LEU A 71 -30.912 20.592 -12.558 1.00 0.00 C ATOM 1074 C LEU A 71 -31.413 19.165 -12.873 1.00 0.00 C ATOM 1075 O LEU A 71 -30.740 18.436 -13.631 1.00 0.00 O ATOM 1076 CB LEU A 71 -31.770 21.684 -13.247 1.00 0.00 C ATOM 1077 CG LEU A 71 -32.107 21.498 -14.740 1.00 0.00 C ATOM 1078 CD1 LEU A 71 -33.062 22.612 -15.168 1.00 0.00 C ATOM 1079 CD2 LEU A 71 -30.880 21.566 -15.644 1.00 0.00 C ATOM 1080 OXT LEU A 71 -32.477 18.792 -12.328 1.00 0.00 O ATOM 0 H LEU A 71 -29.152 20.349 -13.675 1.00 0.00 H new ATOM 0 HA LEU A 71 -31.036 20.687 -11.479 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -32.709 21.767 -12.700 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -31.251 22.636 -13.137 1.00 0.00 H new ATOM 0 HG LEU A 71 -32.548 20.507 -14.846 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -33.310 22.494 -16.223 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -33.974 22.558 -14.573 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -32.585 23.580 -15.014 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -31.184 21.428 -16.681 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -30.400 22.538 -15.533 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -30.178 20.781 -15.364 1.00 0.00 H new TER 1092 LEU A 71