USER MOD reduce.3.24.130724 H: found=0, std=0, add=1005, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1005 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 31 SER OG : rot -40:sc= 0.139 USER MOD Set 1.2: A 122 GLN : amide:sc= -3.57 K(o=-3.4,f=-16!) USER MOD Single : A 1 ARG N :NH3+ 151:sc= 0.0185 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 GLN : amide:sc= -0.0477 K(o=-0.048,f=-1.3) USER MOD Single : A 8 SER OG : rot 43:sc= 1.04 USER MOD Single : A 12 LYS NZ :NH3+ -178:sc= -0.467 (180deg=-0.517) USER MOD Single : A 14 SER OG : rot 180:sc= -1.27 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 SER OG : rot 180:sc=-0.00129 USER MOD Single : A 19 ASN : amide:sc=-0.00309 K(o=-0.0031,f=-1.4) USER MOD Single : A 20 LYS NZ :NH3+ -135:sc= -0.579 (180deg=-2.99!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot -84:sc= 2.28 USER MOD Single : A 28 THR OG1 : rot 88:sc= -0.0505 USER MOD Single : A 30 SER OG : rot 180:sc= -0.179 USER MOD Single : A 32 ASN : amide:sc= -0.267 K(o=-0.27,f=-2.9!) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= -3.79! C(o=-3.8!,f=-4.3!) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 42 ASN : amide:sc= -0.331 K(o=-0.33,f=-1.7) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS :FLIP no HD1:sc= -1.55 F(o=-7.1!,f=-1.5) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 112:sc= -2.79 USER MOD Single : A 49 HIS :FLIP no HD1:sc= -0.851 F(o=-1.6,f=-0.85) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 MET CE :methyl 151:sc= -11.3! (180deg=-14.4!) USER MOD Single : A 58 THR OG1 : rot -62:sc= -4.8! USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.2) USER MOD Single : A 72 SER OG : rot -33:sc= -0.0581! USER MOD Single : A 77 SER OG : rot 52:sc= 0.029 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 ASN : amide:sc= -2.65 K(o=-2.6,f=-6.5!) USER MOD Single : A 96 SER OG : rot 62:sc= -0.0719 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot -53:sc= 1.12 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 HIS : no HD1:sc= -7.26! C(o=-7.3!,f=-9.5!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -0.0279 K(o=-0.028,f=-1!) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 1 -14.142 -18.265 14.346 1.00 0.00 N ATOM 2 CA ARG A 1 -14.533 -16.834 14.462 1.00 0.00 C ATOM 3 C ARG A 1 -13.773 -15.972 13.459 1.00 0.00 C ATOM 4 O ARG A 1 -12.661 -16.308 13.053 1.00 0.00 O ATOM 5 CB ARG A 1 -14.246 -16.367 15.891 1.00 0.00 C ATOM 6 CG ARG A 1 -15.488 -16.277 16.762 1.00 0.00 C ATOM 7 CD ARG A 1 -15.492 -15.012 17.606 1.00 0.00 C ATOM 8 NE ARG A 1 -16.821 -14.409 17.682 1.00 0.00 N ATOM 9 CZ ARG A 1 -17.044 -13.146 18.033 1.00 0.00 C ATOM 10 NH1 ARG A 1 -16.028 -12.346 18.340 1.00 0.00 N ATOM 11 NH2 ARG A 1 -18.284 -12.677 18.076 1.00 0.00 N ATOM 0 H1 ARG A 1 -14.251 -18.731 15.269 1.00 0.00 H new ATOM 0 H2 ARG A 1 -14.751 -18.736 13.646 1.00 0.00 H new ATOM 0 H3 ARG A 1 -13.150 -18.330 14.041 1.00 0.00 H new ATOM 0 HA ARG A 1 -15.595 -16.732 14.240 1.00 0.00 H new ATOM 0 HB2 ARG A 1 -13.537 -17.054 16.353 1.00 0.00 H new ATOM 0 HB3 ARG A 1 -13.766 -15.389 15.855 1.00 0.00 H new ATOM 0 HG2 ARG A 1 -16.377 -16.297 16.132 1.00 0.00 H new ATOM 0 HG3 ARG A 1 -15.540 -17.149 17.413 1.00 0.00 H new ATOM 0 HD2 ARG A 1 -15.142 -15.246 18.611 1.00 0.00 H new ATOM 0 HD3 ARG A 1 -14.791 -14.292 17.184 1.00 0.00 H new ATOM 0 HE ARG A 1 -17.626 -14.992 17.452 1.00 0.00 H new ATOM 0 HH11 ARG A 1 -15.072 -12.700 18.307 1.00 0.00 H new ATOM 0 HH12 ARG A 1 -16.204 -11.378 18.609 1.00 0.00 H new ATOM 0 HH21 ARG A 1 -19.068 -13.285 17.840 1.00 0.00 H new ATOM 0 HH22 ARG A 1 -18.454 -11.708 18.345 1.00 0.00 H new ATOM 27 N ALA A 2 -14.380 -14.856 13.066 1.00 0.00 N ATOM 28 CA ALA A 2 -13.761 -13.945 12.110 1.00 0.00 C ATOM 29 C ALA A 2 -13.580 -12.555 12.712 1.00 0.00 C ATOM 30 O ALA A 2 -14.393 -12.105 13.518 1.00 0.00 O ATOM 31 CB ALA A 2 -14.594 -13.865 10.840 1.00 0.00 C ATOM 0 H ALA A 2 -15.299 -14.561 13.395 1.00 0.00 H new ATOM 0 HA ALA A 2 -12.775 -14.337 11.861 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -14.119 -13.181 10.136 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -14.668 -14.855 10.390 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -15.592 -13.501 11.082 1.00 0.00 H new ATOM 37 N ILE A 3 -12.507 -11.880 12.311 1.00 0.00 N ATOM 38 CA ILE A 3 -12.216 -10.541 12.805 1.00 0.00 C ATOM 39 C ILE A 3 -12.057 -9.558 11.647 1.00 0.00 C ATOM 40 O ILE A 3 -11.408 -9.869 10.648 1.00 0.00 O ATOM 41 CB ILE A 3 -10.932 -10.521 13.659 1.00 0.00 C ATOM 42 CG1 ILE A 3 -10.907 -11.712 14.620 1.00 0.00 C ATOM 43 CG2 ILE A 3 -10.825 -9.213 14.427 1.00 0.00 C ATOM 44 CD1 ILE A 3 -9.590 -11.873 15.347 1.00 0.00 C ATOM 0 H ILE A 3 -11.824 -12.240 11.644 1.00 0.00 H new ATOM 0 HA ILE A 3 -13.059 -10.240 13.427 1.00 0.00 H new ATOM 0 HB ILE A 3 -10.073 -10.601 12.992 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -11.705 -11.594 15.353 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -11.119 -12.624 14.062 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -9.913 -9.215 15.025 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -10.796 -8.380 13.725 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -11.689 -9.105 15.083 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -9.644 -12.736 16.011 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -8.790 -12.022 14.622 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -9.386 -10.977 15.933 1.00 0.00 H new ATOM 56 N PRO A 4 -12.646 -8.355 11.761 1.00 0.00 N ATOM 57 CA PRO A 4 -12.559 -7.336 10.710 1.00 0.00 C ATOM 58 C PRO A 4 -11.140 -6.820 10.521 1.00 0.00 C ATOM 59 O PRO A 4 -10.486 -6.387 11.471 1.00 0.00 O ATOM 60 CB PRO A 4 -13.477 -6.216 11.208 1.00 0.00 C ATOM 61 CG PRO A 4 -13.560 -6.412 12.682 1.00 0.00 C ATOM 62 CD PRO A 4 -13.441 -7.894 12.914 1.00 0.00 C ATOM 0 HA PRO A 4 -12.849 -7.734 9.738 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -13.071 -5.235 10.963 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -14.462 -6.278 10.746 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -12.762 -5.872 13.192 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -14.503 -6.031 13.073 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -12.945 -8.115 13.859 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -14.418 -8.376 12.947 1.00 0.00 H new ATOM 70 N ILE A 5 -10.673 -6.866 9.280 1.00 0.00 N ATOM 71 CA ILE A 5 -9.332 -6.404 8.941 1.00 0.00 C ATOM 72 C ILE A 5 -9.336 -4.921 8.570 1.00 0.00 C ATOM 73 O ILE A 5 -8.305 -4.253 8.635 1.00 0.00 O ATOM 74 CB ILE A 5 -8.737 -7.218 7.775 1.00 0.00 C ATOM 75 CG1 ILE A 5 -8.864 -8.717 8.054 1.00 0.00 C ATOM 76 CG2 ILE A 5 -7.282 -6.839 7.547 1.00 0.00 C ATOM 77 CD1 ILE A 5 -8.065 -9.177 9.254 1.00 0.00 C ATOM 0 H ILE A 5 -11.207 -7.221 8.486 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.713 -6.549 9.826 1.00 0.00 H new ATOM 0 HB ILE A 5 -9.297 -6.986 6.869 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -9.914 -8.962 8.211 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.536 -9.271 7.175 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -6.879 -7.424 6.720 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.216 -5.778 7.307 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -6.707 -7.043 8.450 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -8.202 -10.249 9.393 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -7.009 -8.964 9.091 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -8.409 -8.649 10.144 1.00 0.00 H new ATOM 89 N LYS A 6 -10.509 -4.413 8.200 1.00 0.00 N ATOM 90 CA LYS A 6 -10.672 -3.007 7.837 1.00 0.00 C ATOM 91 C LYS A 6 -12.111 -2.755 7.443 1.00 0.00 C ATOM 92 O LYS A 6 -12.557 -3.212 6.408 1.00 0.00 O ATOM 93 CB LYS A 6 -9.763 -2.618 6.660 1.00 0.00 C ATOM 94 CG LYS A 6 -8.872 -1.415 6.923 1.00 0.00 C ATOM 95 CD LYS A 6 -8.057 -1.570 8.198 1.00 0.00 C ATOM 96 CE LYS A 6 -7.665 -0.218 8.774 1.00 0.00 C ATOM 97 NZ LYS A 6 -7.901 -0.148 10.243 1.00 0.00 N ATOM 0 H LYS A 6 -11.368 -4.960 8.143 1.00 0.00 H new ATOM 0 HA LYS A 6 -10.396 -2.404 8.702 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.134 -3.471 6.405 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -10.386 -2.410 5.790 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -8.198 -1.273 6.078 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -9.487 -0.518 6.994 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -8.635 -2.128 8.935 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -7.160 -2.152 7.989 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -6.612 -0.027 8.566 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -8.235 0.567 8.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -7.621 0.790 10.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -8.910 -0.305 10.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -7.337 -0.880 10.720 1.00 0.00 H new ATOM 111 N GLN A 7 -12.831 -2.021 8.258 1.00 0.00 N ATOM 112 CA GLN A 7 -14.220 -1.718 7.952 1.00 0.00 C ATOM 113 C GLN A 7 -14.493 -0.230 8.109 1.00 0.00 C ATOM 114 O GLN A 7 -14.465 0.301 9.220 1.00 0.00 O ATOM 115 CB GLN A 7 -15.155 -2.526 8.853 1.00 0.00 C ATOM 116 CG GLN A 7 -15.031 -2.176 10.327 1.00 0.00 C ATOM 117 CD GLN A 7 -15.678 -3.209 11.229 1.00 0.00 C ATOM 118 OE1 GLN A 7 -15.036 -3.757 12.125 1.00 0.00 O ATOM 119 NE2 GLN A 7 -16.957 -3.480 10.995 1.00 0.00 N ATOM 0 H GLN A 7 -12.487 -1.623 9.132 1.00 0.00 H new ATOM 0 HA GLN A 7 -14.409 -1.996 6.915 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -16.184 -2.362 8.534 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -14.946 -3.588 8.721 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -13.977 -2.082 10.587 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -15.491 -1.204 10.506 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -17.450 -3.001 10.241 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -17.446 -4.167 11.569 1.00 0.00 H new ATOM 128 N SER A 8 -14.748 0.439 6.994 1.00 0.00 N ATOM 129 CA SER A 8 -15.020 1.872 7.014 1.00 0.00 C ATOM 130 C SER A 8 -15.555 2.348 5.669 1.00 0.00 C ATOM 131 O SER A 8 -15.796 1.548 4.765 1.00 0.00 O ATOM 132 CB SER A 8 -13.748 2.644 7.373 1.00 0.00 C ATOM 133 OG SER A 8 -13.666 2.870 8.770 1.00 0.00 O ATOM 0 H SER A 8 -14.773 0.016 6.066 1.00 0.00 H new ATOM 0 HA SER A 8 -15.782 2.061 7.770 1.00 0.00 H new ATOM 0 HB2 SER A 8 -12.873 2.085 7.040 1.00 0.00 H new ATOM 0 HB3 SER A 8 -13.737 3.598 6.846 1.00 0.00 H new ATOM 0 HG SER A 8 -13.919 2.053 9.249 1.00 0.00 H new ATOM 139 N PHE A 9 -15.741 3.659 5.546 1.00 0.00 N ATOM 140 CA PHE A 9 -16.252 4.246 4.312 1.00 0.00 C ATOM 141 C PHE A 9 -15.150 4.368 3.266 1.00 0.00 C ATOM 142 O PHE A 9 -14.056 4.854 3.554 1.00 0.00 O ATOM 143 CB PHE A 9 -16.861 5.625 4.587 1.00 0.00 C ATOM 144 CG PHE A 9 -17.637 5.704 5.873 1.00 0.00 C ATOM 145 CD1 PHE A 9 -18.328 4.603 6.353 1.00 0.00 C ATOM 146 CD2 PHE A 9 -17.675 6.884 6.600 1.00 0.00 C ATOM 147 CE1 PHE A 9 -19.042 4.677 7.535 1.00 0.00 C ATOM 148 CE2 PHE A 9 -18.387 6.963 7.780 1.00 0.00 C ATOM 149 CZ PHE A 9 -19.071 5.858 8.249 1.00 0.00 C ATOM 0 H PHE A 9 -15.546 4.334 6.285 1.00 0.00 H new ATOM 0 HA PHE A 9 -17.026 3.584 3.924 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -16.062 6.366 4.610 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -17.519 5.892 3.760 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -18.309 3.677 5.798 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -17.142 7.751 6.239 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -19.576 3.812 7.899 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -18.409 7.888 8.336 1.00 0.00 H new ATOM 0 HZ PHE A 9 -19.627 5.918 9.173 1.00 0.00 H new ATOM 159 N LEU A 10 -15.450 3.929 2.050 1.00 0.00 N ATOM 160 CA LEU A 10 -14.491 3.991 0.954 1.00 0.00 C ATOM 161 C LEU A 10 -15.097 4.700 -0.248 1.00 0.00 C ATOM 162 O LEU A 10 -16.298 4.595 -0.502 1.00 0.00 O ATOM 163 CB LEU A 10 -14.051 2.582 0.551 1.00 0.00 C ATOM 164 CG LEU A 10 -12.789 2.071 1.244 1.00 0.00 C ATOM 165 CD1 LEU A 10 -13.121 1.538 2.629 1.00 0.00 C ATOM 166 CD2 LEU A 10 -12.116 0.993 0.403 1.00 0.00 C ATOM 0 H LEU A 10 -16.352 3.525 1.797 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.622 4.553 1.295 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -14.867 1.890 0.761 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -13.887 2.564 -0.526 1.00 0.00 H new ATOM 0 HG LEU A 10 -12.095 2.904 1.353 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.211 1.178 3.108 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -13.557 2.335 3.231 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -13.834 0.718 2.542 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -11.219 0.641 0.913 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -12.804 0.159 0.262 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -11.843 1.406 -0.568 1.00 0.00 H new ATOM 178 N LEU A 11 -14.262 5.414 -0.993 1.00 0.00 N ATOM 179 CA LEU A 11 -14.729 6.127 -2.175 1.00 0.00 C ATOM 180 C LEU A 11 -14.817 5.174 -3.363 1.00 0.00 C ATOM 181 O LEU A 11 -13.913 4.369 -3.588 1.00 0.00 O ATOM 182 CB LEU A 11 -13.793 7.295 -2.501 1.00 0.00 C ATOM 183 CG LEU A 11 -14.444 8.679 -2.460 1.00 0.00 C ATOM 184 CD1 LEU A 11 -14.998 8.969 -1.074 1.00 0.00 C ATOM 185 CD2 LEU A 11 -13.443 9.750 -2.871 1.00 0.00 C ATOM 0 H LEU A 11 -13.265 5.514 -0.802 1.00 0.00 H new ATOM 0 HA LEU A 11 -15.722 6.527 -1.970 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -12.961 7.281 -1.797 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -13.373 7.137 -3.494 1.00 0.00 H new ATOM 0 HG LEU A 11 -15.272 8.691 -3.169 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -15.457 9.958 -1.065 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -15.746 8.219 -0.817 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -14.188 8.938 -0.345 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -13.922 10.728 -2.836 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -12.595 9.737 -2.187 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -13.094 9.552 -3.885 1.00 0.00 H new ATOM 197 N LYS A 12 -15.907 5.262 -4.118 1.00 0.00 N ATOM 198 CA LYS A 12 -16.097 4.399 -5.279 1.00 0.00 C ATOM 199 C LYS A 12 -16.460 5.211 -6.517 1.00 0.00 C ATOM 200 O LYS A 12 -17.520 5.834 -6.577 1.00 0.00 O ATOM 201 CB LYS A 12 -17.185 3.361 -4.999 1.00 0.00 C ATOM 202 CG LYS A 12 -16.906 2.006 -5.631 1.00 0.00 C ATOM 203 CD LYS A 12 -17.050 2.056 -7.145 1.00 0.00 C ATOM 204 CE LYS A 12 -15.757 1.662 -7.842 1.00 0.00 C ATOM 205 NZ LYS A 12 -15.993 1.235 -9.248 1.00 0.00 N ATOM 0 H LYS A 12 -16.669 5.919 -3.948 1.00 0.00 H new ATOM 0 HA LYS A 12 -15.154 3.886 -5.471 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -17.289 3.236 -3.921 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -18.139 3.737 -5.369 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -15.898 1.683 -5.371 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -17.594 1.265 -5.223 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -17.851 1.387 -7.457 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -17.337 3.062 -7.451 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -15.066 2.505 -7.830 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -15.280 0.851 -7.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -15.092 0.942 -9.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -16.659 0.436 -9.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -16.393 2.028 -9.789 1.00 0.00 H new ATOM 219 N ARG A 13 -15.570 5.196 -7.503 1.00 0.00 N ATOM 220 CA ARG A 13 -15.784 5.930 -8.748 1.00 0.00 C ATOM 221 C ARG A 13 -17.128 5.572 -9.375 1.00 0.00 C ATOM 222 O ARG A 13 -17.607 4.445 -9.245 1.00 0.00 O ATOM 223 CB ARG A 13 -14.654 5.640 -9.741 1.00 0.00 C ATOM 224 CG ARG A 13 -14.193 4.193 -9.747 1.00 0.00 C ATOM 225 CD ARG A 13 -13.302 3.899 -10.943 1.00 0.00 C ATOM 226 NE ARG A 13 -13.216 2.470 -11.228 1.00 0.00 N ATOM 227 CZ ARG A 13 -12.595 1.963 -12.292 1.00 0.00 C ATOM 228 NH1 ARG A 13 -12.001 2.766 -13.166 1.00 0.00 N ATOM 229 NH2 ARG A 13 -12.567 0.651 -12.481 1.00 0.00 N ATOM 0 H ARG A 13 -14.690 4.682 -7.465 1.00 0.00 H new ATOM 0 HA ARG A 13 -15.788 6.994 -8.510 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -14.987 5.909 -10.743 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -13.804 6.280 -9.505 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -13.651 3.979 -8.826 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -15.061 3.533 -9.767 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -13.689 4.420 -11.819 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -12.303 4.291 -10.755 1.00 0.00 H new ATOM 0 HE ARG A 13 -13.657 1.822 -10.575 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -12.019 3.776 -13.025 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -11.527 2.373 -13.979 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -13.021 0.030 -11.812 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -12.091 0.263 -13.296 1.00 0.00 H new ATOM 243 N SER A 14 -17.730 6.541 -10.057 1.00 0.00 N ATOM 244 CA SER A 14 -19.020 6.334 -10.708 1.00 0.00 C ATOM 245 C SER A 14 -18.881 6.393 -12.225 1.00 0.00 C ATOM 246 O SER A 14 -19.317 5.484 -12.934 1.00 0.00 O ATOM 247 CB SER A 14 -20.025 7.386 -10.236 1.00 0.00 C ATOM 248 OG SER A 14 -19.717 8.663 -10.768 1.00 0.00 O ATOM 0 H SER A 14 -17.345 7.478 -10.174 1.00 0.00 H new ATOM 0 HA SER A 14 -19.383 5.343 -10.434 1.00 0.00 H new ATOM 0 HB2 SER A 14 -21.030 7.095 -10.540 1.00 0.00 H new ATOM 0 HB3 SER A 14 -20.023 7.432 -9.147 1.00 0.00 H new ATOM 0 HG SER A 14 -20.375 9.316 -10.452 1.00 0.00 H new ATOM 254 N GLY A 15 -18.271 7.466 -12.721 1.00 0.00 N ATOM 255 CA GLY A 15 -18.090 7.618 -14.153 1.00 0.00 C ATOM 256 C GLY A 15 -17.091 8.705 -14.503 1.00 0.00 C ATOM 257 O GLY A 15 -16.432 9.260 -13.623 1.00 0.00 O ATOM 0 H GLY A 15 -17.900 8.231 -12.158 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -17.754 6.671 -14.575 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -19.050 7.850 -14.614 1.00 0.00 H new ATOM 261 N ASN A 16 -16.977 9.009 -15.793 1.00 0.00 N ATOM 262 CA ASN A 16 -16.053 10.035 -16.263 1.00 0.00 C ATOM 263 C ASN A 16 -14.608 9.637 -15.978 1.00 0.00 C ATOM 264 O ASN A 16 -14.262 9.279 -14.852 1.00 0.00 O ATOM 265 CB ASN A 16 -16.368 11.380 -15.600 1.00 0.00 C ATOM 266 CG ASN A 16 -16.962 12.378 -16.575 1.00 0.00 C ATOM 267 OD1 ASN A 16 -18.115 12.249 -16.987 1.00 0.00 O ATOM 268 ND2 ASN A 16 -16.177 13.383 -16.946 1.00 0.00 N ATOM 0 H ASN A 16 -17.515 8.558 -16.533 1.00 0.00 H new ATOM 0 HA ASN A 16 -16.177 10.134 -17.341 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -17.064 11.222 -14.776 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -15.455 11.794 -15.171 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -16.524 14.087 -17.598 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -15.228 13.451 -16.579 1.00 0.00 H new ATOM 275 N SER A 17 -13.767 9.701 -17.005 1.00 0.00 N ATOM 276 CA SER A 17 -12.359 9.347 -16.865 1.00 0.00 C ATOM 277 C SER A 17 -11.538 10.544 -16.395 1.00 0.00 C ATOM 278 O SER A 17 -10.868 10.484 -15.364 1.00 0.00 O ATOM 279 CB SER A 17 -11.808 8.825 -18.192 1.00 0.00 C ATOM 280 OG SER A 17 -12.142 9.692 -19.261 1.00 0.00 O ATOM 0 H SER A 17 -14.036 9.995 -17.944 1.00 0.00 H new ATOM 0 HA SER A 17 -12.282 8.561 -16.113 1.00 0.00 H new ATOM 0 HB2 SER A 17 -10.725 8.726 -18.125 1.00 0.00 H new ATOM 0 HB3 SER A 17 -12.207 7.830 -18.389 1.00 0.00 H new ATOM 0 HG SER A 17 -11.776 9.336 -20.098 1.00 0.00 H new ATOM 286 N LEU A 18 -11.594 11.632 -17.158 1.00 0.00 N ATOM 287 CA LEU A 18 -10.855 12.843 -16.816 1.00 0.00 C ATOM 288 C LEU A 18 -11.273 13.365 -15.448 1.00 0.00 C ATOM 289 O LEU A 18 -10.447 13.513 -14.548 1.00 0.00 O ATOM 290 CB LEU A 18 -11.080 13.920 -17.880 1.00 0.00 C ATOM 291 CG LEU A 18 -10.323 13.703 -19.191 1.00 0.00 C ATOM 292 CD1 LEU A 18 -11.171 14.130 -20.378 1.00 0.00 C ATOM 293 CD2 LEU A 18 -9.005 14.463 -19.175 1.00 0.00 C ATOM 0 H LEU A 18 -12.142 11.700 -18.015 1.00 0.00 H new ATOM 0 HA LEU A 18 -9.794 12.595 -16.780 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -12.146 13.976 -18.099 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -10.789 14.885 -17.465 1.00 0.00 H new ATOM 0 HG LEU A 18 -10.108 12.639 -19.291 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -10.614 13.967 -21.301 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -12.089 13.542 -20.400 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -11.420 15.187 -20.286 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -8.478 14.298 -20.115 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -9.201 15.528 -19.051 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -8.390 14.108 -18.348 1.00 0.00 H new ATOM 305 N ASN A 19 -12.561 13.635 -15.303 1.00 0.00 N ATOM 306 CA ASN A 19 -13.104 14.135 -14.046 1.00 0.00 C ATOM 307 C ASN A 19 -13.914 13.050 -13.347 1.00 0.00 C ATOM 308 O ASN A 19 -15.144 13.058 -13.381 1.00 0.00 O ATOM 309 CB ASN A 19 -13.979 15.366 -14.293 1.00 0.00 C ATOM 310 CG ASN A 19 -14.313 16.104 -13.012 1.00 0.00 C ATOM 311 OD1 ASN A 19 -13.705 15.867 -11.969 1.00 0.00 O ATOM 312 ND2 ASN A 19 -15.286 17.006 -13.086 1.00 0.00 N ATOM 0 H ASN A 19 -13.254 13.516 -16.042 1.00 0.00 H new ATOM 0 HA ASN A 19 -12.272 14.420 -13.403 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -13.465 16.043 -14.975 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -14.903 15.059 -14.784 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -15.556 17.535 -12.256 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -15.763 17.170 -13.972 1.00 0.00 H new ATOM 319 N LYS A 20 -13.211 12.109 -12.723 1.00 0.00 N ATOM 320 CA LYS A 20 -13.858 11.003 -12.022 1.00 0.00 C ATOM 321 C LYS A 20 -14.906 11.505 -11.032 1.00 0.00 C ATOM 322 O LYS A 20 -15.158 12.705 -10.929 1.00 0.00 O ATOM 323 CB LYS A 20 -12.813 10.154 -11.295 1.00 0.00 C ATOM 324 CG LYS A 20 -12.609 8.778 -11.913 1.00 0.00 C ATOM 325 CD LYS A 20 -13.916 8.006 -12.000 1.00 0.00 C ATOM 326 CE LYS A 20 -13.812 6.845 -12.976 1.00 0.00 C ATOM 327 NZ LYS A 20 -15.136 6.208 -13.228 1.00 0.00 N ATOM 0 H LYS A 20 -12.192 12.090 -12.688 1.00 0.00 H new ATOM 0 HA LYS A 20 -14.366 10.389 -12.766 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.862 10.687 -11.293 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -13.114 10.035 -10.254 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.182 8.886 -12.910 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -11.891 8.214 -11.318 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.184 7.630 -11.013 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -14.716 8.677 -12.314 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -13.395 7.200 -13.919 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -13.120 6.100 -12.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -15.036 5.173 -13.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.814 6.517 -12.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.483 6.488 -14.167 1.00 0.00 H new ATOM 341 N GLU A 21 -15.511 10.571 -10.305 1.00 0.00 N ATOM 342 CA GLU A 21 -16.529 10.903 -9.321 1.00 0.00 C ATOM 343 C GLU A 21 -16.762 9.724 -8.388 1.00 0.00 C ATOM 344 O GLU A 21 -17.483 8.784 -8.719 1.00 0.00 O ATOM 345 CB GLU A 21 -17.837 11.297 -10.010 1.00 0.00 C ATOM 346 CG GLU A 21 -18.693 12.249 -9.191 1.00 0.00 C ATOM 347 CD GLU A 21 -19.712 12.990 -10.035 1.00 0.00 C ATOM 348 OE1 GLU A 21 -19.334 13.994 -10.675 1.00 0.00 O ATOM 349 OE2 GLU A 21 -20.888 12.569 -10.053 1.00 0.00 O ATOM 0 H GLU A 21 -15.311 9.574 -10.381 1.00 0.00 H new ATOM 0 HA GLU A 21 -16.178 11.753 -8.736 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -17.607 11.762 -10.969 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -18.412 10.396 -10.222 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -19.210 11.688 -8.413 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -18.049 12.971 -8.689 1.00 0.00 H new ATOM 356 N TRP A 22 -16.127 9.779 -7.227 1.00 0.00 N ATOM 357 CA TRP A 22 -16.240 8.717 -6.239 1.00 0.00 C ATOM 358 C TRP A 22 -17.259 9.071 -5.163 1.00 0.00 C ATOM 359 O TRP A 22 -17.181 10.133 -4.545 1.00 0.00 O ATOM 360 CB TRP A 22 -14.876 8.452 -5.599 1.00 0.00 C ATOM 361 CG TRP A 22 -13.760 8.316 -6.593 1.00 0.00 C ATOM 362 CD1 TRP A 22 -13.414 9.206 -7.572 1.00 0.00 C ATOM 363 CD2 TRP A 22 -12.836 7.225 -6.702 1.00 0.00 C ATOM 364 NE1 TRP A 22 -12.337 8.734 -8.280 1.00 0.00 N ATOM 365 CE2 TRP A 22 -11.966 7.521 -7.767 1.00 0.00 C ATOM 366 CE3 TRP A 22 -12.661 6.025 -6.005 1.00 0.00 C ATOM 367 CZ2 TRP A 22 -10.941 6.665 -8.148 1.00 0.00 C ATOM 368 CZ3 TRP A 22 -11.639 5.177 -6.387 1.00 0.00 C ATOM 369 CH2 TRP A 22 -10.796 5.502 -7.446 1.00 0.00 C ATOM 0 H TRP A 22 -15.525 10.553 -6.945 1.00 0.00 H new ATOM 0 HA TRP A 22 -16.583 7.816 -6.748 1.00 0.00 H new ATOM 0 HB2 TRP A 22 -14.642 9.266 -4.913 1.00 0.00 H new ATOM 0 HB3 TRP A 22 -14.934 7.540 -5.004 1.00 0.00 H new ATOM 0 HD1 TRP A 22 -13.915 10.144 -7.761 1.00 0.00 H new ATOM 0 HE1 TRP A 22 -11.886 9.210 -9.062 1.00 0.00 H new ATOM 0 HE3 TRP A 22 -13.313 5.766 -5.184 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 -10.283 6.910 -8.969 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 -11.492 4.248 -5.856 1.00 0.00 H new ATOM 0 HH2 TRP A 22 -10.007 4.817 -7.720 1.00 0.00 H new ATOM 380 N LYS A 23 -18.212 8.174 -4.941 1.00 0.00 N ATOM 381 CA LYS A 23 -19.245 8.389 -3.935 1.00 0.00 C ATOM 382 C LYS A 23 -18.886 7.675 -2.637 1.00 0.00 C ATOM 383 O LYS A 23 -18.177 6.669 -2.647 1.00 0.00 O ATOM 384 CB LYS A 23 -20.599 7.893 -4.452 1.00 0.00 C ATOM 385 CG LYS A 23 -21.622 9.003 -4.638 1.00 0.00 C ATOM 386 CD LYS A 23 -21.126 10.060 -5.610 1.00 0.00 C ATOM 387 CE LYS A 23 -21.581 11.452 -5.200 1.00 0.00 C ATOM 388 NZ LYS A 23 -21.215 12.478 -6.215 1.00 0.00 N ATOM 0 H LYS A 23 -18.291 7.290 -5.444 1.00 0.00 H new ATOM 0 HA LYS A 23 -19.314 9.458 -3.735 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -20.451 7.383 -5.404 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -20.997 7.156 -3.755 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -22.557 8.580 -5.005 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -21.838 9.465 -3.675 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -20.037 10.031 -5.656 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -21.494 9.836 -6.611 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -22.661 11.453 -5.056 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -21.132 11.713 -4.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -21.543 13.413 -5.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -20.182 12.495 -6.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -21.664 12.244 -7.123 1.00 0.00 H new ATOM 402 N LYS A 24 -19.378 8.201 -1.520 1.00 0.00 N ATOM 403 CA LYS A 24 -19.106 7.610 -0.215 1.00 0.00 C ATOM 404 C LYS A 24 -19.686 6.202 -0.128 1.00 0.00 C ATOM 405 O LYS A 24 -20.904 6.020 -0.120 1.00 0.00 O ATOM 406 CB LYS A 24 -19.683 8.486 0.897 1.00 0.00 C ATOM 407 CG LYS A 24 -18.760 8.636 2.094 1.00 0.00 C ATOM 408 CD LYS A 24 -17.451 9.311 1.710 1.00 0.00 C ATOM 409 CE LYS A 24 -17.428 10.769 2.139 1.00 0.00 C ATOM 410 NZ LYS A 24 -16.787 11.639 1.115 1.00 0.00 N ATOM 0 H LYS A 24 -19.966 9.034 -1.492 1.00 0.00 H new ATOM 0 HA LYS A 24 -18.025 7.547 -0.089 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -19.903 9.474 0.492 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -20.629 8.060 1.230 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -19.258 9.220 2.868 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -18.553 7.654 2.520 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -16.618 8.782 2.173 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.310 9.246 0.631 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.447 11.111 2.319 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -16.890 10.861 3.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -16.791 12.625 1.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -15.806 11.329 0.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -17.315 11.571 0.222 1.00 0.00 H new ATOM 424 N LYS A 25 -18.805 5.209 -0.064 1.00 0.00 N ATOM 425 CA LYS A 25 -19.226 3.815 0.021 1.00 0.00 C ATOM 426 C LYS A 25 -18.902 3.235 1.393 1.00 0.00 C ATOM 427 O LYS A 25 -18.461 3.949 2.293 1.00 0.00 O ATOM 428 CB LYS A 25 -18.549 2.987 -1.073 1.00 0.00 C ATOM 429 CG LYS A 25 -19.514 2.093 -1.838 1.00 0.00 C ATOM 430 CD LYS A 25 -19.568 2.461 -3.313 1.00 0.00 C ATOM 431 CE LYS A 25 -20.934 2.166 -3.911 1.00 0.00 C ATOM 432 NZ LYS A 25 -20.899 2.157 -5.400 1.00 0.00 N ATOM 0 H LYS A 25 -17.794 5.344 -0.069 1.00 0.00 H new ATOM 0 HA LYS A 25 -20.306 3.776 -0.124 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -18.055 3.660 -1.774 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -17.772 2.369 -0.623 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -19.208 1.052 -1.733 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -20.511 2.177 -1.405 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -19.338 3.520 -3.434 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -18.804 1.905 -3.856 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -21.287 1.200 -3.550 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -21.649 2.914 -3.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -21.850 1.952 -5.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -20.587 3.087 -5.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -20.236 1.426 -5.727 1.00 0.00 H new ATOM 446 N TYR A 26 -19.129 1.936 1.546 1.00 0.00 N ATOM 447 CA TYR A 26 -18.868 1.255 2.809 1.00 0.00 C ATOM 448 C TYR A 26 -18.286 -0.132 2.558 1.00 0.00 C ATOM 449 O TYR A 26 -18.935 -0.981 1.953 1.00 0.00 O ATOM 450 CB TYR A 26 -20.165 1.149 3.614 1.00 0.00 C ATOM 451 CG TYR A 26 -19.996 0.542 4.987 1.00 0.00 C ATOM 452 CD1 TYR A 26 -20.022 -0.834 5.167 1.00 0.00 C ATOM 453 CD2 TYR A 26 -19.818 1.347 6.104 1.00 0.00 C ATOM 454 CE1 TYR A 26 -19.878 -1.392 6.423 1.00 0.00 C ATOM 455 CE2 TYR A 26 -19.671 0.797 7.363 1.00 0.00 C ATOM 456 CZ TYR A 26 -19.702 -0.572 7.517 1.00 0.00 C ATOM 457 OH TYR A 26 -19.556 -1.124 8.769 1.00 0.00 O ATOM 0 H TYR A 26 -19.494 1.332 0.810 1.00 0.00 H new ATOM 0 HA TYR A 26 -18.140 1.833 3.378 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -20.596 2.145 3.720 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -20.881 0.551 3.050 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -20.157 -1.479 4.311 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -19.794 2.420 5.987 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -19.903 -2.465 6.547 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -19.533 1.437 8.222 1.00 0.00 H new ATOM 0 HH TYR A 26 -20.440 -1.308 9.150 1.00 0.00 H new ATOM 467 N VAL A 27 -17.056 -0.355 3.012 1.00 0.00 N ATOM 468 CA VAL A 27 -16.397 -1.645 2.817 1.00 0.00 C ATOM 469 C VAL A 27 -15.930 -2.242 4.131 1.00 0.00 C ATOM 470 O VAL A 27 -15.528 -1.523 5.046 1.00 0.00 O ATOM 471 CB VAL A 27 -15.165 -1.541 1.891 1.00 0.00 C ATOM 472 CG1 VAL A 27 -14.872 -2.887 1.247 1.00 0.00 C ATOM 473 CG2 VAL A 27 -15.362 -0.472 0.825 1.00 0.00 C ATOM 0 H VAL A 27 -16.498 0.335 3.514 1.00 0.00 H new ATOM 0 HA VAL A 27 -17.150 -2.285 2.357 1.00 0.00 H new ATOM 0 HB VAL A 27 -14.310 -1.250 2.501 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.001 -2.798 0.597 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.672 -3.626 2.023 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -15.733 -3.204 0.658 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -14.477 -0.424 0.190 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -16.232 -0.720 0.217 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -15.518 0.495 1.304 1.00 0.00 H new ATOM 483 N THR A 28 -15.943 -3.567 4.201 1.00 0.00 N ATOM 484 CA THR A 28 -15.477 -4.263 5.384 1.00 0.00 C ATOM 485 C THR A 28 -14.658 -5.491 5.004 1.00 0.00 C ATOM 486 O THR A 28 -15.193 -6.486 4.507 1.00 0.00 O ATOM 487 CB THR A 28 -16.629 -4.687 6.295 1.00 0.00 C ATOM 488 OG1 THR A 28 -17.383 -3.562 6.710 1.00 0.00 O ATOM 489 CG2 THR A 28 -16.149 -5.414 7.539 1.00 0.00 C ATOM 0 H THR A 28 -16.271 -4.176 3.452 1.00 0.00 H new ATOM 0 HA THR A 28 -14.850 -3.560 5.932 1.00 0.00 H new ATOM 0 HB THR A 28 -17.244 -5.366 5.704 1.00 0.00 H new ATOM 0 HG1 THR A 28 -18.086 -3.379 6.052 1.00 0.00 H new ATOM 0 HG21 THR A 28 -17.007 -5.693 8.151 1.00 0.00 H new ATOM 0 HG22 THR A 28 -15.604 -6.312 7.248 1.00 0.00 H new ATOM 0 HG23 THR A 28 -15.492 -4.760 8.112 1.00 0.00 H new ATOM 497 N LEU A 29 -13.368 -5.420 5.274 1.00 0.00 N ATOM 498 CA LEU A 29 -12.463 -6.513 5.011 1.00 0.00 C ATOM 499 C LEU A 29 -12.433 -7.408 6.235 1.00 0.00 C ATOM 500 O LEU A 29 -12.028 -6.970 7.311 1.00 0.00 O ATOM 501 CB LEU A 29 -11.060 -5.987 4.714 1.00 0.00 C ATOM 502 CG LEU A 29 -10.407 -6.572 3.467 1.00 0.00 C ATOM 503 CD1 LEU A 29 -10.321 -8.084 3.577 1.00 0.00 C ATOM 504 CD2 LEU A 29 -11.178 -6.168 2.221 1.00 0.00 C ATOM 0 H LEU A 29 -12.921 -4.599 5.683 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.804 -7.073 4.140 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -11.109 -4.903 4.607 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -10.421 -6.194 5.572 1.00 0.00 H new ATOM 0 HG LEU A 29 -9.396 -6.174 3.386 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -9.853 -8.488 2.680 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -9.725 -8.352 4.449 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -11.324 -8.499 3.681 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.697 -6.595 1.341 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -12.201 -6.538 2.290 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -11.190 -5.081 2.137 1.00 0.00 H new ATOM 516 N SER A 30 -12.889 -8.641 6.081 1.00 0.00 N ATOM 517 CA SER A 30 -12.936 -9.575 7.198 1.00 0.00 C ATOM 518 C SER A 30 -11.818 -10.602 7.110 1.00 0.00 C ATOM 519 O SER A 30 -11.222 -10.799 6.051 1.00 0.00 O ATOM 520 CB SER A 30 -14.290 -10.285 7.240 1.00 0.00 C ATOM 521 OG SER A 30 -14.280 -11.350 8.173 1.00 0.00 O ATOM 0 H SER A 30 -13.231 -9.019 5.197 1.00 0.00 H new ATOM 0 HA SER A 30 -12.800 -9.002 8.115 1.00 0.00 H new ATOM 0 HB2 SER A 30 -15.070 -9.572 7.507 1.00 0.00 H new ATOM 0 HB3 SER A 30 -14.534 -10.668 6.249 1.00 0.00 H new ATOM 0 HG SER A 30 -15.158 -11.786 8.181 1.00 0.00 H new ATOM 527 N SER A 31 -11.549 -11.259 8.232 1.00 0.00 N ATOM 528 CA SER A 31 -10.509 -12.277 8.286 1.00 0.00 C ATOM 529 C SER A 31 -11.012 -13.612 7.729 1.00 0.00 C ATOM 530 O SER A 31 -10.300 -14.615 7.767 1.00 0.00 O ATOM 531 CB SER A 31 -10.023 -12.464 9.724 1.00 0.00 C ATOM 532 OG SER A 31 -8.758 -13.104 9.757 1.00 0.00 O ATOM 0 H SER A 31 -12.036 -11.105 9.115 1.00 0.00 H new ATOM 0 HA SER A 31 -9.678 -11.939 7.667 1.00 0.00 H new ATOM 0 HB2 SER A 31 -9.956 -11.494 10.217 1.00 0.00 H new ATOM 0 HB3 SER A 31 -10.748 -13.056 10.282 1.00 0.00 H new ATOM 0 HG SER A 31 -8.732 -13.812 9.079 1.00 0.00 H new ATOM 538 N ASN A 32 -12.243 -13.618 7.214 1.00 0.00 N ATOM 539 CA ASN A 32 -12.840 -14.824 6.652 1.00 0.00 C ATOM 540 C ASN A 32 -12.569 -14.930 5.158 1.00 0.00 C ATOM 541 O ASN A 32 -13.335 -15.550 4.421 1.00 0.00 O ATOM 542 CB ASN A 32 -14.349 -14.842 6.913 1.00 0.00 C ATOM 543 CG ASN A 32 -14.834 -16.193 7.402 1.00 0.00 C ATOM 544 OD1 ASN A 32 -14.041 -17.040 7.813 1.00 0.00 O ATOM 545 ND2 ASN A 32 -16.146 -16.401 7.359 1.00 0.00 N ATOM 0 H ASN A 32 -12.846 -12.796 7.176 1.00 0.00 H new ATOM 0 HA ASN A 32 -12.382 -15.683 7.142 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -14.596 -14.081 7.653 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -14.877 -14.579 5.996 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -16.532 -17.291 7.674 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -16.767 -15.671 7.011 1.00 0.00 H new ATOM 552 N GLY A 33 -11.478 -14.318 4.716 1.00 0.00 N ATOM 553 CA GLY A 33 -11.135 -14.351 3.308 1.00 0.00 C ATOM 554 C GLY A 33 -12.274 -13.852 2.447 1.00 0.00 C ATOM 555 O GLY A 33 -12.518 -14.374 1.359 1.00 0.00 O ATOM 0 H GLY A 33 -10.826 -13.801 5.306 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -10.251 -13.738 3.134 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -10.879 -15.370 3.019 1.00 0.00 H new ATOM 559 N PHE A 34 -12.974 -12.842 2.944 1.00 0.00 N ATOM 560 CA PHE A 34 -14.102 -12.271 2.226 1.00 0.00 C ATOM 561 C PHE A 34 -14.120 -10.755 2.338 1.00 0.00 C ATOM 562 O PHE A 34 -13.964 -10.198 3.424 1.00 0.00 O ATOM 563 CB PHE A 34 -15.413 -12.843 2.768 1.00 0.00 C ATOM 564 CG PHE A 34 -16.232 -13.532 1.725 1.00 0.00 C ATOM 565 CD1 PHE A 34 -15.745 -14.657 1.085 1.00 0.00 C ATOM 566 CD2 PHE A 34 -17.485 -13.057 1.382 1.00 0.00 C ATOM 567 CE1 PHE A 34 -16.493 -15.300 0.119 1.00 0.00 C ATOM 568 CE2 PHE A 34 -18.241 -13.694 0.416 1.00 0.00 C ATOM 569 CZ PHE A 34 -17.744 -14.819 -0.216 1.00 0.00 C ATOM 0 H PHE A 34 -12.779 -12.401 3.843 1.00 0.00 H new ATOM 0 HA PHE A 34 -13.996 -12.534 1.174 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -15.190 -13.547 3.569 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -16.000 -12.036 3.207 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -14.768 -15.037 1.344 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -17.877 -12.179 1.874 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -16.101 -16.177 -0.374 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -19.218 -13.314 0.155 1.00 0.00 H new ATOM 0 HZ PHE A 34 -18.333 -15.321 -0.970 1.00 0.00 H new ATOM 579 N LEU A 35 -14.330 -10.093 1.209 1.00 0.00 N ATOM 580 CA LEU A 35 -14.391 -8.639 1.183 1.00 0.00 C ATOM 581 C LEU A 35 -15.796 -8.187 0.810 1.00 0.00 C ATOM 582 O LEU A 35 -16.275 -8.472 -0.287 1.00 0.00 O ATOM 583 CB LEU A 35 -13.369 -8.076 0.190 1.00 0.00 C ATOM 584 CG LEU A 35 -13.658 -6.664 -0.332 1.00 0.00 C ATOM 585 CD1 LEU A 35 -14.074 -5.738 0.805 1.00 0.00 C ATOM 586 CD2 LEU A 35 -12.442 -6.106 -1.058 1.00 0.00 C ATOM 0 H LEU A 35 -14.461 -10.539 0.301 1.00 0.00 H new ATOM 0 HA LEU A 35 -14.148 -8.260 2.176 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -12.389 -8.074 0.667 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -13.307 -8.753 -0.662 1.00 0.00 H new ATOM 0 HG LEU A 35 -14.486 -6.725 -1.038 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -14.273 -4.742 0.409 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -14.975 -6.127 1.280 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -13.272 -5.682 1.541 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -12.664 -5.103 -1.422 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -11.596 -6.064 -0.372 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.194 -6.751 -1.901 1.00 0.00 H new ATOM 598 N LEU A 36 -16.457 -7.488 1.728 1.00 0.00 N ATOM 599 CA LEU A 36 -17.813 -7.011 1.484 1.00 0.00 C ATOM 600 C LEU A 36 -17.851 -5.492 1.397 1.00 0.00 C ATOM 601 O LEU A 36 -17.037 -4.806 2.012 1.00 0.00 O ATOM 602 CB LEU A 36 -18.759 -7.489 2.590 1.00 0.00 C ATOM 603 CG LEU A 36 -18.355 -8.797 3.277 1.00 0.00 C ATOM 604 CD1 LEU A 36 -17.746 -8.519 4.642 1.00 0.00 C ATOM 605 CD2 LEU A 36 -19.554 -9.726 3.406 1.00 0.00 C ATOM 0 H LEU A 36 -16.078 -7.241 2.642 1.00 0.00 H new ATOM 0 HA LEU A 36 -18.143 -7.422 0.530 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -18.831 -6.708 3.347 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -19.755 -7.614 2.165 1.00 0.00 H new ATOM 0 HG LEU A 36 -17.603 -9.290 2.660 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -17.466 -9.461 5.114 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -16.861 -7.894 4.525 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -18.475 -8.003 5.267 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -19.247 -10.650 3.896 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -20.329 -9.240 3.999 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -19.946 -9.954 2.415 1.00 0.00 H new ATOM 617 N TYR A 37 -18.805 -4.972 0.637 1.00 0.00 N ATOM 618 CA TYR A 37 -18.953 -3.532 0.480 1.00 0.00 C ATOM 619 C TYR A 37 -20.367 -3.181 0.024 1.00 0.00 C ATOM 620 O TYR A 37 -20.931 -3.838 -0.851 1.00 0.00 O ATOM 621 CB TYR A 37 -17.899 -2.985 -0.497 1.00 0.00 C ATOM 622 CG TYR A 37 -18.398 -2.738 -1.907 1.00 0.00 C ATOM 623 CD1 TYR A 37 -18.800 -3.792 -2.717 1.00 0.00 C ATOM 624 CD2 TYR A 37 -18.454 -1.450 -2.427 1.00 0.00 C ATOM 625 CE1 TYR A 37 -19.247 -3.569 -4.007 1.00 0.00 C ATOM 626 CE2 TYR A 37 -18.900 -1.220 -3.715 1.00 0.00 C ATOM 627 CZ TYR A 37 -19.295 -2.283 -4.499 1.00 0.00 C ATOM 628 OH TYR A 37 -19.739 -2.057 -5.782 1.00 0.00 O ATOM 0 H TYR A 37 -19.488 -5.526 0.120 1.00 0.00 H new ATOM 0 HA TYR A 37 -18.790 -3.059 1.448 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -17.506 -2.050 -0.098 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -17.067 -3.687 -0.540 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -18.763 -4.801 -2.334 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -18.144 -0.616 -1.815 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -19.557 -4.399 -4.625 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -18.939 -0.214 -4.105 1.00 0.00 H new ATOM 0 HH TYR A 37 -19.712 -1.096 -5.973 1.00 0.00 H new ATOM 638 N HIS A 38 -20.938 -2.149 0.633 1.00 0.00 N ATOM 639 CA HIS A 38 -22.285 -1.713 0.299 1.00 0.00 C ATOM 640 C HIS A 38 -22.277 -0.282 -0.231 1.00 0.00 C ATOM 641 O HIS A 38 -21.327 0.470 -0.004 1.00 0.00 O ATOM 642 CB HIS A 38 -23.200 -1.802 1.526 1.00 0.00 C ATOM 643 CG HIS A 38 -22.918 -2.967 2.427 1.00 0.00 C ATOM 644 ND1 HIS A 38 -21.688 -3.195 3.007 1.00 0.00 N ATOM 645 CD2 HIS A 38 -23.723 -3.966 2.857 1.00 0.00 C ATOM 646 CE1 HIS A 38 -21.747 -4.286 3.751 1.00 0.00 C ATOM 647 NE2 HIS A 38 -22.972 -4.771 3.678 1.00 0.00 N ATOM 0 H HIS A 38 -20.486 -1.598 1.363 1.00 0.00 H new ATOM 0 HA HIS A 38 -22.666 -2.374 -0.479 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -23.105 -0.882 2.102 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -24.235 -1.862 1.189 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -24.763 -4.105 2.602 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -20.932 -4.708 4.321 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -23.307 -5.608 4.154 1.00 0.00 H new ATOM 656 N PRO A 39 -23.344 0.113 -0.948 1.00 0.00 N ATOM 657 CA PRO A 39 -23.461 1.461 -1.512 1.00 0.00 C ATOM 658 C PRO A 39 -23.257 2.548 -0.461 1.00 0.00 C ATOM 659 O PRO A 39 -22.702 3.609 -0.748 1.00 0.00 O ATOM 660 CB PRO A 39 -24.893 1.500 -2.050 1.00 0.00 C ATOM 661 CG PRO A 39 -25.244 0.076 -2.307 1.00 0.00 C ATOM 662 CD PRO A 39 -24.517 -0.725 -1.261 1.00 0.00 C ATOM 0 HA PRO A 39 -22.702 1.652 -2.271 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -25.574 1.951 -1.328 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -24.956 2.093 -2.962 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -26.321 -0.079 -2.239 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -24.941 -0.226 -3.310 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -25.137 -0.894 -0.381 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -24.223 -1.705 -1.637 1.00 0.00 H new ATOM 670 N SER A 40 -23.712 2.275 0.759 1.00 0.00 N ATOM 671 CA SER A 40 -23.580 3.228 1.856 1.00 0.00 C ATOM 672 C SER A 40 -23.743 2.527 3.201 1.00 0.00 C ATOM 673 O SER A 40 -23.964 1.318 3.259 1.00 0.00 O ATOM 674 CB SER A 40 -24.618 4.344 1.718 1.00 0.00 C ATOM 675 OG SER A 40 -24.050 5.609 2.011 1.00 0.00 O ATOM 0 H SER A 40 -24.175 1.402 1.012 1.00 0.00 H new ATOM 0 HA SER A 40 -22.582 3.665 1.811 1.00 0.00 H new ATOM 0 HB2 SER A 40 -25.019 4.348 0.705 1.00 0.00 H new ATOM 0 HB3 SER A 40 -25.454 4.153 2.391 1.00 0.00 H new ATOM 0 HG SER A 40 -24.733 6.305 1.914 1.00 0.00 H new ATOM 681 N ILE A 41 -23.634 3.294 4.283 1.00 0.00 N ATOM 682 CA ILE A 41 -23.769 2.740 5.625 1.00 0.00 C ATOM 683 C ILE A 41 -25.159 2.141 5.829 1.00 0.00 C ATOM 684 O ILE A 41 -25.294 1.044 6.366 1.00 0.00 O ATOM 685 CB ILE A 41 -23.486 3.806 6.706 1.00 0.00 C ATOM 686 CG1 ILE A 41 -21.996 4.148 6.719 1.00 0.00 C ATOM 687 CG2 ILE A 41 -23.930 3.319 8.082 1.00 0.00 C ATOM 688 CD1 ILE A 41 -21.578 5.078 5.601 1.00 0.00 C ATOM 0 H ILE A 41 -23.453 4.297 4.256 1.00 0.00 H new ATOM 0 HA ILE A 41 -23.028 1.947 5.726 1.00 0.00 H new ATOM 0 HB ILE A 41 -24.057 4.703 6.466 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -21.746 4.607 7.675 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -21.419 3.226 6.648 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -23.720 4.088 8.825 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -25.000 3.112 8.067 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -23.388 2.409 8.338 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -20.509 5.277 5.673 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -21.796 4.613 4.640 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -22.127 6.016 5.683 1.00 0.00 H new ATOM 700 N ASN A 42 -26.188 2.856 5.383 1.00 0.00 N ATOM 701 CA ASN A 42 -27.561 2.372 5.509 1.00 0.00 C ATOM 702 C ASN A 42 -27.674 0.956 4.942 1.00 0.00 C ATOM 703 O ASN A 42 -28.505 0.160 5.370 1.00 0.00 O ATOM 704 CB ASN A 42 -28.524 3.306 4.774 1.00 0.00 C ATOM 705 CG ASN A 42 -28.295 4.763 5.124 1.00 0.00 C ATOM 706 OD1 ASN A 42 -27.629 5.080 6.108 1.00 0.00 O ATOM 707 ND2 ASN A 42 -28.849 5.659 4.314 1.00 0.00 N ATOM 0 H ASN A 42 -26.099 3.767 4.934 1.00 0.00 H new ATOM 0 HA ASN A 42 -27.827 2.354 6.566 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -28.408 3.171 3.699 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -29.550 3.033 5.020 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -28.729 6.655 4.498 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -29.394 5.351 3.509 1.00 0.00 H new ATOM 714 N ASP A 43 -26.820 0.649 3.974 1.00 0.00 N ATOM 715 CA ASP A 43 -26.817 -0.669 3.357 1.00 0.00 C ATOM 716 C ASP A 43 -26.142 -1.691 4.268 1.00 0.00 C ATOM 717 O ASP A 43 -26.595 -2.829 4.379 1.00 0.00 O ATOM 718 CB ASP A 43 -26.112 -0.617 2.002 1.00 0.00 C ATOM 719 CG ASP A 43 -26.749 0.385 1.059 1.00 0.00 C ATOM 720 OD1 ASP A 43 -26.804 1.581 1.413 1.00 0.00 O ATOM 721 OD2 ASP A 43 -27.188 -0.026 -0.035 1.00 0.00 O ATOM 0 H ASP A 43 -26.123 1.293 3.601 1.00 0.00 H new ATOM 0 HA ASP A 43 -27.851 -0.979 3.203 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -25.064 -0.357 2.150 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -26.134 -1.607 1.546 1.00 0.00 H new ATOM 726 N TYR A 44 -25.061 -1.277 4.925 1.00 0.00 N ATOM 727 CA TYR A 44 -24.331 -2.158 5.836 1.00 0.00 C ATOM 728 C TYR A 44 -25.156 -2.415 7.095 1.00 0.00 C ATOM 729 O TYR A 44 -25.366 -3.559 7.499 1.00 0.00 O ATOM 730 CB TYR A 44 -22.976 -1.531 6.199 1.00 0.00 C ATOM 731 CG TYR A 44 -22.579 -1.694 7.652 1.00 0.00 C ATOM 732 CD1 TYR A 44 -22.008 -2.876 8.109 1.00 0.00 C ATOM 733 CD2 TYR A 44 -22.776 -0.666 8.567 1.00 0.00 C ATOM 734 CE1 TYR A 44 -21.645 -3.029 9.433 1.00 0.00 C ATOM 735 CE2 TYR A 44 -22.415 -0.811 9.893 1.00 0.00 C ATOM 736 CZ TYR A 44 -21.850 -1.993 10.321 1.00 0.00 C ATOM 737 OH TYR A 44 -21.491 -2.142 11.641 1.00 0.00 O ATOM 0 H TYR A 44 -24.671 -0.338 4.844 1.00 0.00 H new ATOM 0 HA TYR A 44 -24.153 -3.112 5.340 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -22.204 -1.977 5.572 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -23.006 -0.468 5.960 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -21.845 -3.689 7.417 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -23.219 0.262 8.236 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -21.203 -3.955 9.771 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -22.575 -0.002 10.590 1.00 0.00 H new ATOM 0 HH TYR A 44 -21.701 -1.320 12.132 1.00 0.00 H new ATOM 747 N ILE A 45 -25.620 -1.331 7.701 1.00 0.00 N ATOM 748 CA ILE A 45 -26.427 -1.394 8.911 1.00 0.00 C ATOM 749 C ILE A 45 -27.694 -2.207 8.684 1.00 0.00 C ATOM 750 O ILE A 45 -27.931 -3.226 9.332 1.00 0.00 O ATOM 751 CB ILE A 45 -26.816 0.037 9.364 1.00 0.00 C ATOM 752 CG1 ILE A 45 -25.656 0.685 10.119 1.00 0.00 C ATOM 753 CG2 ILE A 45 -28.084 0.039 10.220 1.00 0.00 C ATOM 754 CD1 ILE A 45 -25.785 2.187 10.242 1.00 0.00 C ATOM 0 H ILE A 45 -25.447 -0.383 7.367 1.00 0.00 H new ATOM 0 HA ILE A 45 -25.832 -1.880 9.685 1.00 0.00 H new ATOM 0 HB ILE A 45 -27.029 0.622 8.469 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -25.593 0.250 11.116 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -24.722 0.448 9.609 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -28.321 1.061 10.516 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -28.912 -0.374 9.644 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -27.923 -0.569 11.110 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -24.929 2.582 10.788 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -25.818 2.632 9.248 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -26.702 2.431 10.779 1.00 0.00 H new ATOM 766 N HIS A 46 -28.511 -1.716 7.769 1.00 0.00 N ATOM 767 CA HIS A 46 -29.781 -2.338 7.435 1.00 0.00 C ATOM 768 C HIS A 46 -29.597 -3.619 6.623 1.00 0.00 C ATOM 769 O HIS A 46 -30.458 -4.500 6.641 1.00 0.00 O ATOM 770 CB HIS A 46 -30.650 -1.316 6.702 1.00 0.00 C ATOM 771 CG HIS A 46 -30.673 0.010 7.412 1.00 0.00 C ATOM 772 ND1 HIS A 46 -29.699 0.937 7.591 1.00 0.00 N flip ATOM 773 CD2 HIS A 46 -31.774 0.487 8.088 1.00 0.00 C flip ATOM 774 CE1 HIS A 46 -30.221 1.937 8.360 1.00 0.00 C flip ATOM 775 NE2 HIS A 46 -31.470 1.646 8.650 1.00 0.00 N flip ATOM 0 H HIS A 46 -28.312 -0.871 7.234 1.00 0.00 H new ATOM 0 HA HIS A 46 -30.282 -2.642 8.354 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -30.273 -1.179 5.688 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -31.667 -1.699 6.615 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -32.733 -0.006 8.150 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -29.693 2.824 8.679 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -32.099 2.218 9.214 1.00 0.00 H new ATOM 784 N SER A 47 -28.469 -3.726 5.922 1.00 0.00 N ATOM 785 CA SER A 47 -28.166 -4.909 5.116 1.00 0.00 C ATOM 786 C SER A 47 -28.918 -4.891 3.790 1.00 0.00 C ATOM 787 O SER A 47 -29.888 -5.625 3.604 1.00 0.00 O ATOM 788 CB SER A 47 -28.499 -6.191 5.886 1.00 0.00 C ATOM 789 OG SER A 47 -27.794 -7.301 5.358 1.00 0.00 O ATOM 0 H SER A 47 -27.747 -3.006 5.896 1.00 0.00 H new ATOM 0 HA SER A 47 -27.097 -4.890 4.902 1.00 0.00 H new ATOM 0 HB2 SER A 47 -28.246 -6.063 6.938 1.00 0.00 H new ATOM 0 HB3 SER A 47 -29.571 -6.380 5.837 1.00 0.00 H new ATOM 0 HG SER A 47 -28.023 -8.106 5.868 1.00 0.00 H new ATOM 795 N THR A 48 -28.458 -4.054 2.866 1.00 0.00 N ATOM 796 CA THR A 48 -29.079 -3.950 1.553 1.00 0.00 C ATOM 797 C THR A 48 -28.076 -4.269 0.450 1.00 0.00 C ATOM 798 O THR A 48 -27.084 -3.564 0.272 1.00 0.00 O ATOM 799 CB THR A 48 -29.665 -2.557 1.339 1.00 0.00 C ATOM 800 OG1 THR A 48 -28.638 -1.585 1.253 1.00 0.00 O ATOM 801 CG2 THR A 48 -30.612 -2.134 2.439 1.00 0.00 C ATOM 0 H THR A 48 -27.657 -3.438 3.003 1.00 0.00 H new ATOM 0 HA THR A 48 -29.888 -4.680 1.509 1.00 0.00 H new ATOM 0 HB THR A 48 -30.223 -2.619 0.405 1.00 0.00 H new ATOM 0 HG1 THR A 48 -28.600 -1.229 0.341 1.00 0.00 H new ATOM 0 HG21 THR A 48 -30.993 -1.135 2.227 1.00 0.00 H new ATOM 0 HG22 THR A 48 -31.444 -2.836 2.493 1.00 0.00 H new ATOM 0 HG23 THR A 48 -30.082 -2.125 3.392 1.00 0.00 H new ATOM 809 N HIS A 49 -28.344 -5.346 -0.281 1.00 0.00 N ATOM 810 CA HIS A 49 -27.476 -5.788 -1.370 1.00 0.00 C ATOM 811 C HIS A 49 -26.229 -6.461 -0.815 1.00 0.00 C ATOM 812 O HIS A 49 -25.979 -7.641 -1.062 1.00 0.00 O ATOM 813 CB HIS A 49 -27.081 -4.608 -2.263 1.00 0.00 C ATOM 814 CG HIS A 49 -26.783 -5.000 -3.676 1.00 0.00 C ATOM 815 ND1 HIS A 49 -26.549 -4.246 -4.777 1.00 0.00 N flip ATOM 816 CD2 HIS A 49 -26.700 -6.313 -4.091 1.00 0.00 C flip ATOM 817 CE1 HIS A 49 -26.331 -5.107 -5.823 1.00 0.00 C flip ATOM 818 NE2 HIS A 49 -26.427 -6.348 -5.383 1.00 0.00 N flip ATOM 0 H HIS A 49 -29.164 -5.935 -0.138 1.00 0.00 H new ATOM 0 HA HIS A 49 -28.028 -6.509 -1.972 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -27.888 -3.875 -2.260 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -26.205 -4.119 -1.838 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -26.837 -7.177 -3.458 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -26.116 -4.817 -6.841 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -26.310 -7.191 -5.945 1.00 0.00 H new ATOM 827 N GLY A 50 -25.460 -5.695 -0.055 1.00 0.00 N ATOM 828 CA GLY A 50 -24.243 -6.205 0.553 1.00 0.00 C ATOM 829 C GLY A 50 -23.413 -7.057 -0.389 1.00 0.00 C ATOM 830 O GLY A 50 -23.566 -8.277 -0.430 1.00 0.00 O ATOM 0 H GLY A 50 -25.659 -4.717 0.155 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -23.640 -5.366 0.900 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -24.504 -6.795 1.431 1.00 0.00 H new ATOM 834 N LYS A 51 -22.528 -6.411 -1.138 1.00 0.00 N ATOM 835 CA LYS A 51 -21.664 -7.120 -2.076 1.00 0.00 C ATOM 836 C LYS A 51 -20.558 -7.862 -1.329 1.00 0.00 C ATOM 837 O LYS A 51 -20.240 -7.533 -0.188 1.00 0.00 O ATOM 838 CB LYS A 51 -21.052 -6.143 -3.081 1.00 0.00 C ATOM 839 CG LYS A 51 -21.947 -5.856 -4.274 1.00 0.00 C ATOM 840 CD LYS A 51 -22.137 -7.093 -5.140 1.00 0.00 C ATOM 841 CE LYS A 51 -23.492 -7.739 -4.900 1.00 0.00 C ATOM 842 NZ LYS A 51 -23.414 -9.225 -4.941 1.00 0.00 N ATOM 0 H LYS A 51 -22.389 -5.401 -1.115 1.00 0.00 H new ATOM 0 HA LYS A 51 -22.270 -7.847 -2.617 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -20.827 -5.205 -2.573 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -20.105 -6.548 -3.437 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -22.917 -5.502 -3.925 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -21.512 -5.055 -4.872 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -22.044 -6.820 -6.191 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -21.347 -7.813 -4.926 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -23.879 -7.422 -3.931 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -24.198 -7.392 -5.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -24.358 -9.627 -4.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -23.069 -9.529 -5.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -22.760 -9.559 -4.205 1.00 0.00 H new ATOM 856 N GLU A 52 -19.979 -8.867 -1.979 1.00 0.00 N ATOM 857 CA GLU A 52 -18.911 -9.655 -1.372 1.00 0.00 C ATOM 858 C GLU A 52 -18.128 -10.417 -2.433 1.00 0.00 C ATOM 859 O GLU A 52 -18.645 -10.717 -3.508 1.00 0.00 O ATOM 860 CB GLU A 52 -19.487 -10.630 -0.346 1.00 0.00 C ATOM 861 CG GLU A 52 -20.626 -11.480 -0.884 1.00 0.00 C ATOM 862 CD GLU A 52 -21.638 -11.844 0.185 1.00 0.00 C ATOM 863 OE1 GLU A 52 -21.216 -12.240 1.291 1.00 0.00 O ATOM 864 OE2 GLU A 52 -22.852 -11.733 -0.084 1.00 0.00 O ATOM 0 H GLU A 52 -20.231 -9.155 -2.925 1.00 0.00 H new ATOM 0 HA GLU A 52 -18.230 -8.970 -0.867 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -18.691 -11.286 0.006 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -19.842 -10.067 0.518 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -21.129 -10.941 -1.687 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -20.219 -12.393 -1.319 1.00 0.00 H new ATOM 871 N MET A 53 -16.873 -10.717 -2.123 1.00 0.00 N ATOM 872 CA MET A 53 -16.010 -11.435 -3.049 1.00 0.00 C ATOM 873 C MET A 53 -15.103 -12.413 -2.313 1.00 0.00 C ATOM 874 O MET A 53 -14.756 -12.199 -1.150 1.00 0.00 O ATOM 875 CB MET A 53 -15.155 -10.451 -3.834 1.00 0.00 C ATOM 876 CG MET A 53 -14.472 -9.416 -2.959 1.00 0.00 C ATOM 877 SD MET A 53 -13.438 -8.290 -3.908 1.00 0.00 S ATOM 878 CE MET A 53 -14.530 -7.942 -5.277 1.00 0.00 C ATOM 0 H MET A 53 -16.431 -10.474 -1.237 1.00 0.00 H new ATOM 0 HA MET A 53 -16.647 -11.998 -3.731 1.00 0.00 H new ATOM 0 HB2 MET A 53 -14.397 -11.003 -4.391 1.00 0.00 H new ATOM 0 HB3 MET A 53 -15.781 -9.941 -4.567 1.00 0.00 H new ATOM 0 HG2 MET A 53 -15.228 -8.844 -2.420 1.00 0.00 H new ATOM 0 HG3 MET A 53 -13.862 -9.922 -2.211 1.00 0.00 H new ATOM 0 HE1 MET A 53 -14.321 -6.945 -5.665 1.00 0.00 H new ATOM 0 HE2 MET A 53 -14.372 -8.678 -6.065 1.00 0.00 H new ATOM 0 HE3 MET A 53 -15.565 -7.990 -4.938 1.00 0.00 H new ATOM 888 N ASP A 54 -14.705 -13.471 -3.009 1.00 0.00 N ATOM 889 CA ASP A 54 -13.819 -14.472 -2.434 1.00 0.00 C ATOM 890 C ASP A 54 -12.377 -13.987 -2.505 1.00 0.00 C ATOM 891 O ASP A 54 -11.880 -13.648 -3.578 1.00 0.00 O ATOM 892 CB ASP A 54 -13.963 -15.805 -3.174 1.00 0.00 C ATOM 893 CG ASP A 54 -14.877 -16.773 -2.448 1.00 0.00 C ATOM 894 OD1 ASP A 54 -14.463 -17.310 -1.400 1.00 0.00 O ATOM 895 OD2 ASP A 54 -16.007 -16.994 -2.931 1.00 0.00 O ATOM 0 H ASP A 54 -14.983 -13.657 -3.973 1.00 0.00 H new ATOM 0 HA ASP A 54 -14.094 -14.625 -1.391 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -14.354 -15.622 -4.175 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -12.979 -16.259 -3.294 1.00 0.00 H new ATOM 900 N LEU A 55 -11.712 -13.944 -1.358 1.00 0.00 N ATOM 901 CA LEU A 55 -10.331 -13.484 -1.298 1.00 0.00 C ATOM 902 C LEU A 55 -9.345 -14.634 -1.483 1.00 0.00 C ATOM 903 O LEU A 55 -8.190 -14.538 -1.073 1.00 0.00 O ATOM 904 CB LEU A 55 -10.065 -12.784 0.036 1.00 0.00 C ATOM 905 CG LEU A 55 -10.408 -11.295 0.071 1.00 0.00 C ATOM 906 CD1 LEU A 55 -10.666 -10.842 1.499 1.00 0.00 C ATOM 907 CD2 LEU A 55 -9.291 -10.474 -0.560 1.00 0.00 C ATOM 0 H LEU A 55 -12.105 -14.221 -0.459 1.00 0.00 H new ATOM 0 HA LEU A 55 -10.183 -12.779 -2.116 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -10.637 -13.290 0.814 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -9.011 -12.903 0.287 1.00 0.00 H new ATOM 0 HG LEU A 55 -11.317 -11.137 -0.509 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -10.909 -9.779 1.505 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -11.500 -11.407 1.915 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -9.774 -11.014 2.102 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -9.553 -9.416 -0.526 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -8.364 -10.636 -0.009 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -9.155 -10.781 -1.597 1.00 0.00 H new ATOM 919 N LEU A 56 -9.797 -15.719 -2.104 1.00 0.00 N ATOM 920 CA LEU A 56 -8.939 -16.875 -2.335 1.00 0.00 C ATOM 921 C LEU A 56 -8.091 -16.682 -3.588 1.00 0.00 C ATOM 922 O LEU A 56 -6.909 -17.027 -3.607 1.00 0.00 O ATOM 923 CB LEU A 56 -9.780 -18.146 -2.460 1.00 0.00 C ATOM 924 CG LEU A 56 -9.032 -19.448 -2.173 1.00 0.00 C ATOM 925 CD1 LEU A 56 -9.970 -20.478 -1.564 1.00 0.00 C ATOM 926 CD2 LEU A 56 -8.398 -19.989 -3.446 1.00 0.00 C ATOM 0 H LEU A 56 -10.749 -15.822 -2.455 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.270 -16.976 -1.480 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -10.626 -18.072 -1.776 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -10.189 -18.195 -3.469 1.00 0.00 H new ATOM 0 HG LEU A 56 -8.239 -19.239 -1.455 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -9.421 -21.398 -1.366 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -10.378 -20.091 -0.630 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -10.785 -20.684 -2.258 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -7.870 -20.916 -3.224 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -9.175 -20.183 -4.186 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -7.695 -19.256 -3.842 1.00 0.00 H new ATOM 938 N ARG A 57 -8.700 -16.129 -4.632 1.00 0.00 N ATOM 939 CA ARG A 57 -7.998 -15.892 -5.887 1.00 0.00 C ATOM 940 C ARG A 57 -8.220 -14.464 -6.375 1.00 0.00 C ATOM 941 O ARG A 57 -8.470 -14.229 -7.557 1.00 0.00 O ATOM 942 CB ARG A 57 -8.463 -16.890 -6.950 1.00 0.00 C ATOM 943 CG ARG A 57 -8.399 -18.338 -6.493 1.00 0.00 C ATOM 944 CD ARG A 57 -8.418 -19.298 -7.672 1.00 0.00 C ATOM 945 NE ARG A 57 -7.440 -18.931 -8.692 1.00 0.00 N ATOM 946 CZ ARG A 57 -6.126 -19.096 -8.553 1.00 0.00 C ATOM 947 NH1 ARG A 57 -5.630 -19.616 -7.437 1.00 0.00 N ATOM 948 NH2 ARG A 57 -5.306 -18.739 -9.532 1.00 0.00 N ATOM 0 H ARG A 57 -9.677 -15.837 -4.633 1.00 0.00 H new ATOM 0 HA ARG A 57 -6.931 -16.031 -5.711 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -9.488 -16.653 -7.236 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.848 -16.771 -7.842 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -7.492 -18.496 -5.909 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -9.243 -18.551 -5.836 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -8.212 -20.309 -7.320 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -9.415 -19.311 -8.113 1.00 0.00 H new ATOM 0 HE ARG A 57 -7.783 -18.524 -9.562 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -6.256 -19.891 -6.680 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.623 -19.740 -7.336 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -5.682 -18.338 -10.391 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.299 -18.865 -9.426 1.00 0.00 H new ATOM 962 N THR A 58 -8.127 -13.511 -5.453 1.00 0.00 N ATOM 963 CA THR A 58 -8.316 -12.104 -5.783 1.00 0.00 C ATOM 964 C THR A 58 -6.987 -11.440 -6.124 1.00 0.00 C ATOM 965 O THR A 58 -5.920 -11.953 -5.785 1.00 0.00 O ATOM 966 CB THR A 58 -8.973 -11.363 -4.619 1.00 0.00 C ATOM 967 OG1 THR A 58 -8.658 -11.988 -3.390 1.00 0.00 O ATOM 968 CG2 THR A 58 -10.481 -11.288 -4.725 1.00 0.00 C ATOM 0 H THR A 58 -7.921 -13.689 -4.470 1.00 0.00 H new ATOM 0 HA THR A 58 -8.968 -12.053 -6.655 1.00 0.00 H new ATOM 0 HB THR A 58 -8.576 -10.349 -4.662 1.00 0.00 H new ATOM 0 HG1 THR A 58 -9.012 -12.902 -3.388 1.00 0.00 H new ATOM 0 HG21 THR A 58 -10.880 -10.749 -3.866 1.00 0.00 H new ATOM 0 HG22 THR A 58 -10.756 -10.765 -5.641 1.00 0.00 H new ATOM 0 HG23 THR A 58 -10.895 -12.296 -4.745 1.00 0.00 H new ATOM 976 N THR A 59 -7.062 -10.294 -6.788 1.00 0.00 N ATOM 977 CA THR A 59 -5.868 -9.550 -7.168 1.00 0.00 C ATOM 978 C THR A 59 -6.020 -8.079 -6.806 1.00 0.00 C ATOM 979 O THR A 59 -7.123 -7.609 -6.524 1.00 0.00 O ATOM 980 CB THR A 59 -5.596 -9.696 -8.668 1.00 0.00 C ATOM 981 OG1 THR A 59 -6.417 -10.702 -9.234 1.00 0.00 O ATOM 982 CG2 THR A 59 -4.158 -10.047 -8.981 1.00 0.00 C ATOM 0 H THR A 59 -7.939 -9.859 -7.075 1.00 0.00 H new ATOM 0 HA THR A 59 -5.021 -9.961 -6.619 1.00 0.00 H new ATOM 0 HB THR A 59 -5.819 -8.720 -9.098 1.00 0.00 H new ATOM 0 HG1 THR A 59 -6.228 -10.777 -10.193 1.00 0.00 H new ATOM 0 HG21 THR A 59 -4.032 -10.136 -10.060 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.502 -9.264 -8.602 1.00 0.00 H new ATOM 0 HG23 THR A 59 -3.903 -10.995 -8.507 1.00 0.00 H new ATOM 990 N VAL A 60 -4.909 -7.355 -6.817 1.00 0.00 N ATOM 991 CA VAL A 60 -4.919 -5.935 -6.492 1.00 0.00 C ATOM 992 C VAL A 60 -4.166 -5.135 -7.547 1.00 0.00 C ATOM 993 O VAL A 60 -3.042 -5.480 -7.914 1.00 0.00 O ATOM 994 CB VAL A 60 -4.299 -5.667 -5.107 1.00 0.00 C ATOM 995 CG1 VAL A 60 -5.300 -5.978 -4.006 1.00 0.00 C ATOM 996 CG2 VAL A 60 -3.024 -6.477 -4.925 1.00 0.00 C ATOM 0 H VAL A 60 -3.988 -7.728 -7.048 1.00 0.00 H new ATOM 0 HA VAL A 60 -5.961 -5.617 -6.472 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.040 -4.610 -5.043 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.845 -5.783 -3.035 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -6.181 -5.348 -4.127 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -5.592 -7.026 -4.066 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.601 -6.274 -3.941 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -3.253 -7.539 -5.010 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -2.303 -6.199 -5.694 1.00 0.00 H new ATOM 1006 N LYS A 61 -4.791 -4.071 -8.042 1.00 0.00 N ATOM 1007 CA LYS A 61 -4.167 -3.239 -9.068 1.00 0.00 C ATOM 1008 C LYS A 61 -4.397 -1.755 -8.802 1.00 0.00 C ATOM 1009 O LYS A 61 -5.259 -1.378 -8.009 1.00 0.00 O ATOM 1010 CB LYS A 61 -4.712 -3.608 -10.450 1.00 0.00 C ATOM 1011 CG LYS A 61 -4.461 -5.057 -10.837 1.00 0.00 C ATOM 1012 CD LYS A 61 -5.042 -5.380 -12.205 1.00 0.00 C ATOM 1013 CE LYS A 61 -5.937 -6.609 -12.157 1.00 0.00 C ATOM 1014 NZ LYS A 61 -5.716 -7.504 -13.326 1.00 0.00 N ATOM 0 H LYS A 61 -5.720 -3.766 -7.753 1.00 0.00 H new ATOM 0 HA LYS A 61 -3.094 -3.426 -9.038 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -5.785 -3.416 -10.471 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -4.257 -2.957 -11.196 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -3.389 -5.253 -10.841 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -4.902 -5.716 -10.089 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -5.614 -4.526 -12.569 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -4.232 -5.547 -12.915 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -5.747 -7.161 -11.236 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -6.981 -6.297 -12.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -6.345 -8.329 -13.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -5.922 -6.986 -14.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -4.726 -7.823 -13.337 1.00 0.00 H new ATOM 1028 N VAL A 62 -3.617 -0.915 -9.478 1.00 0.00 N ATOM 1029 CA VAL A 62 -3.727 0.530 -9.328 1.00 0.00 C ATOM 1030 C VAL A 62 -3.762 1.213 -10.697 1.00 0.00 C ATOM 1031 O VAL A 62 -2.846 1.046 -11.501 1.00 0.00 O ATOM 1032 CB VAL A 62 -2.553 1.102 -8.510 1.00 0.00 C ATOM 1033 CG1 VAL A 62 -2.774 2.577 -8.219 1.00 0.00 C ATOM 1034 CG2 VAL A 62 -2.373 0.318 -7.219 1.00 0.00 C ATOM 0 H VAL A 62 -2.899 -1.214 -10.138 1.00 0.00 H new ATOM 0 HA VAL A 62 -4.657 0.729 -8.795 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.641 1.005 -9.099 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -1.935 2.963 -7.641 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -2.851 3.126 -9.158 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -3.695 2.701 -7.650 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -1.540 0.735 -6.653 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -3.284 0.383 -6.624 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.166 -0.726 -7.453 1.00 0.00 H new ATOM 1044 N PRO A 63 -4.826 1.983 -10.988 1.00 0.00 N ATOM 1045 CA PRO A 63 -4.976 2.673 -12.266 1.00 0.00 C ATOM 1046 C PRO A 63 -4.327 4.054 -12.281 1.00 0.00 C ATOM 1047 O PRO A 63 -4.661 4.918 -11.471 1.00 0.00 O ATOM 1048 CB PRO A 63 -6.490 2.795 -12.392 1.00 0.00 C ATOM 1049 CG PRO A 63 -6.976 2.943 -10.989 1.00 0.00 C ATOM 1050 CD PRO A 63 -5.979 2.233 -10.101 1.00 0.00 C ATOM 0 HA PRO A 63 -4.491 2.138 -13.083 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -6.769 3.655 -13.000 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -6.920 1.914 -12.869 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -7.055 3.996 -10.717 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -7.970 2.510 -10.877 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -5.699 2.847 -9.245 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -6.388 1.303 -9.706 1.00 0.00 H new ATOM 1058 N GLY A 64 -3.405 4.256 -13.218 1.00 0.00 N ATOM 1059 CA GLY A 64 -2.731 5.536 -13.337 1.00 0.00 C ATOM 1060 C GLY A 64 -1.558 5.680 -12.389 1.00 0.00 C ATOM 1061 O GLY A 64 -0.440 5.966 -12.815 1.00 0.00 O ATOM 0 H GLY A 64 -3.113 3.554 -13.898 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.380 5.661 -14.361 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.446 6.336 -13.145 1.00 0.00 H new ATOM 1065 N LYS A 65 -1.812 5.490 -11.099 1.00 0.00 N ATOM 1066 CA LYS A 65 -0.767 5.611 -10.089 1.00 0.00 C ATOM 1067 C LYS A 65 0.132 4.379 -10.073 1.00 0.00 C ATOM 1068 O LYS A 65 -0.305 3.273 -10.395 1.00 0.00 O ATOM 1069 CB LYS A 65 -1.385 5.827 -8.707 1.00 0.00 C ATOM 1070 CG LYS A 65 -0.806 7.021 -7.964 1.00 0.00 C ATOM 1071 CD LYS A 65 -1.860 8.085 -7.704 1.00 0.00 C ATOM 1072 CE LYS A 65 -1.747 9.235 -8.694 1.00 0.00 C ATOM 1073 NZ LYS A 65 -2.134 8.821 -10.071 1.00 0.00 N ATOM 0 H LYS A 65 -2.732 5.252 -10.728 1.00 0.00 H new ATOM 0 HA LYS A 65 -0.154 6.475 -10.345 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.461 5.964 -8.816 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -1.237 4.929 -8.107 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -0.382 6.689 -7.016 1.00 0.00 H new ATOM 0 HG3 LYS A 65 0.010 7.451 -8.545 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -2.853 7.640 -7.773 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.752 8.466 -6.688 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -2.384 10.058 -8.369 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.723 9.609 -8.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.307 9.666 -10.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.366 8.261 -10.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -3.000 8.246 -10.030 1.00 0.00 H new ATOM 1087 N ARG A 66 1.390 4.578 -9.695 1.00 0.00 N ATOM 1088 CA ARG A 66 2.357 3.490 -9.630 1.00 0.00 C ATOM 1089 C ARG A 66 2.146 2.654 -8.368 1.00 0.00 C ATOM 1090 O ARG A 66 1.438 3.071 -7.452 1.00 0.00 O ATOM 1091 CB ARG A 66 3.781 4.048 -9.660 1.00 0.00 C ATOM 1092 CG ARG A 66 4.401 4.065 -11.047 1.00 0.00 C ATOM 1093 CD ARG A 66 5.464 5.144 -11.169 1.00 0.00 C ATOM 1094 NE ARG A 66 6.566 4.936 -10.232 1.00 0.00 N ATOM 1095 CZ ARG A 66 7.430 5.885 -9.880 1.00 0.00 C ATOM 1096 NH1 ARG A 66 7.325 7.108 -10.384 1.00 0.00 N ATOM 1097 NH2 ARG A 66 8.402 5.612 -9.021 1.00 0.00 N ATOM 0 H ARG A 66 1.765 5.488 -9.428 1.00 0.00 H new ATOM 0 HA ARG A 66 2.210 2.847 -10.498 1.00 0.00 H new ATOM 0 HB2 ARG A 66 3.772 5.063 -9.263 1.00 0.00 H new ATOM 0 HB3 ARG A 66 4.409 3.452 -8.998 1.00 0.00 H new ATOM 0 HG2 ARG A 66 4.843 3.092 -11.261 1.00 0.00 H new ATOM 0 HG3 ARG A 66 3.623 4.233 -11.792 1.00 0.00 H new ATOM 0 HD2 ARG A 66 5.852 5.157 -12.188 1.00 0.00 H new ATOM 0 HD3 ARG A 66 5.013 6.119 -10.987 1.00 0.00 H new ATOM 0 HE ARG A 66 6.680 4.008 -9.824 1.00 0.00 H new ATOM 0 HH11 ARG A 66 6.579 7.325 -11.045 1.00 0.00 H new ATOM 0 HH12 ARG A 66 7.990 7.831 -10.110 1.00 0.00 H new ATOM 0 HH21 ARG A 66 8.488 4.674 -8.629 1.00 0.00 H new ATOM 0 HH22 ARG A 66 9.064 6.340 -8.752 1.00 0.00 H new ATOM 1111 N PRO A 67 2.762 1.461 -8.302 1.00 0.00 N ATOM 1112 CA PRO A 67 2.637 0.574 -7.142 1.00 0.00 C ATOM 1113 C PRO A 67 2.981 1.287 -5.835 1.00 0.00 C ATOM 1114 O PRO A 67 4.104 1.758 -5.656 1.00 0.00 O ATOM 1115 CB PRO A 67 3.648 -0.551 -7.424 1.00 0.00 C ATOM 1116 CG PRO A 67 4.492 -0.058 -8.552 1.00 0.00 C ATOM 1117 CD PRO A 67 3.626 0.881 -9.339 1.00 0.00 C ATOM 0 HA PRO A 67 1.616 0.214 -7.016 1.00 0.00 H new ATOM 0 HB2 PRO A 67 4.255 -0.763 -6.544 1.00 0.00 H new ATOM 0 HB3 PRO A 67 3.139 -1.477 -7.691 1.00 0.00 H new ATOM 0 HG2 PRO A 67 5.381 0.451 -8.180 1.00 0.00 H new ATOM 0 HG3 PRO A 67 4.835 -0.886 -9.173 1.00 0.00 H new ATOM 0 HD2 PRO A 67 4.214 1.643 -9.850 1.00 0.00 H new ATOM 0 HD3 PRO A 67 3.049 0.358 -10.102 1.00 0.00 H new ATOM 1125 N PRO A 68 2.017 1.379 -4.899 1.00 0.00 N ATOM 1126 CA PRO A 68 2.233 2.043 -3.609 1.00 0.00 C ATOM 1127 C PRO A 68 3.162 1.250 -2.698 1.00 0.00 C ATOM 1128 O PRO A 68 3.092 0.023 -2.639 1.00 0.00 O ATOM 1129 CB PRO A 68 0.827 2.118 -3.008 1.00 0.00 C ATOM 1130 CG PRO A 68 0.089 0.987 -3.634 1.00 0.00 C ATOM 1131 CD PRO A 68 0.645 0.850 -5.024 1.00 0.00 C ATOM 0 HA PRO A 68 2.713 3.015 -3.726 1.00 0.00 H new ATOM 0 HB2 PRO A 68 0.854 2.021 -1.923 1.00 0.00 H new ATOM 0 HB3 PRO A 68 0.351 3.073 -3.231 1.00 0.00 H new ATOM 0 HG2 PRO A 68 0.228 0.068 -3.065 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -0.982 1.187 -3.660 1.00 0.00 H new ATOM 0 HD2 PRO A 68 0.644 -0.188 -5.356 1.00 0.00 H new ATOM 0 HD3 PRO A 68 0.060 1.417 -5.748 1.00 0.00 H new ATOM 1139 N ARG A 69 4.033 1.961 -1.987 1.00 0.00 N ATOM 1140 CA ARG A 69 4.977 1.322 -1.077 1.00 0.00 C ATOM 1141 C ARG A 69 4.244 0.625 0.063 1.00 0.00 C ATOM 1142 O ARG A 69 3.186 1.075 0.503 1.00 0.00 O ATOM 1143 CB ARG A 69 5.952 2.358 -0.515 1.00 0.00 C ATOM 1144 CG ARG A 69 6.645 3.186 -1.585 1.00 0.00 C ATOM 1145 CD ARG A 69 7.882 3.880 -1.039 1.00 0.00 C ATOM 1146 NE ARG A 69 8.383 4.903 -1.953 1.00 0.00 N ATOM 1147 CZ ARG A 69 9.112 4.638 -3.035 1.00 0.00 C ATOM 1148 NH1 ARG A 69 9.426 3.385 -3.342 1.00 0.00 N ATOM 1149 NH2 ARG A 69 9.529 5.627 -3.813 1.00 0.00 N ATOM 0 H ARG A 69 4.104 2.978 -2.024 1.00 0.00 H new ATOM 0 HA ARG A 69 5.536 0.572 -1.637 1.00 0.00 H new ATOM 0 HB2 ARG A 69 5.412 3.026 0.156 1.00 0.00 H new ATOM 0 HB3 ARG A 69 6.707 1.847 0.083 1.00 0.00 H new ATOM 0 HG2 ARG A 69 6.926 2.543 -2.419 1.00 0.00 H new ATOM 0 HG3 ARG A 69 5.952 3.931 -1.976 1.00 0.00 H new ATOM 0 HD2 ARG A 69 7.647 4.336 -0.077 1.00 0.00 H new ATOM 0 HD3 ARG A 69 8.663 3.141 -0.859 1.00 0.00 H new ATOM 0 HE ARG A 69 8.161 5.878 -1.750 1.00 0.00 H new ATOM 0 HH11 ARG A 69 9.108 2.619 -2.748 1.00 0.00 H new ATOM 0 HH12 ARG A 69 9.985 3.188 -4.172 1.00 0.00 H new ATOM 0 HH21 ARG A 69 9.291 6.592 -3.583 1.00 0.00 H new ATOM 0 HH22 ARG A 69 10.088 5.423 -4.642 1.00 0.00 H new ATOM 1163 N ALA A 70 4.815 -0.477 0.539 1.00 0.00 N ATOM 1164 CA ALA A 70 4.216 -1.238 1.630 1.00 0.00 C ATOM 1165 C ALA A 70 4.370 -0.506 2.958 1.00 0.00 C ATOM 1166 O ALA A 70 3.395 -0.298 3.680 1.00 0.00 O ATOM 1167 CB ALA A 70 4.841 -2.623 1.713 1.00 0.00 C ATOM 0 H ALA A 70 5.691 -0.863 0.187 1.00 0.00 H new ATOM 0 HA ALA A 70 3.151 -1.344 1.424 1.00 0.00 H new ATOM 0 HB1 ALA A 70 4.385 -3.180 2.531 1.00 0.00 H new ATOM 0 HB2 ALA A 70 4.675 -3.154 0.776 1.00 0.00 H new ATOM 0 HB3 ALA A 70 5.912 -2.529 1.891 1.00 0.00 H new ATOM 1173 N ILE A 71 5.600 -0.118 3.276 1.00 0.00 N ATOM 1174 CA ILE A 71 5.882 0.589 4.518 1.00 0.00 C ATOM 1175 C ILE A 71 6.860 1.735 4.290 1.00 0.00 C ATOM 1176 O ILE A 71 6.507 2.906 4.435 1.00 0.00 O ATOM 1177 CB ILE A 71 6.459 -0.359 5.588 1.00 0.00 C ATOM 1178 CG1 ILE A 71 5.600 -1.620 5.699 1.00 0.00 C ATOM 1179 CG2 ILE A 71 6.549 0.350 6.931 1.00 0.00 C ATOM 1180 CD1 ILE A 71 6.276 -2.747 6.452 1.00 0.00 C ATOM 0 H ILE A 71 6.418 -0.282 2.689 1.00 0.00 H new ATOM 0 HA ILE A 71 4.933 0.991 4.874 1.00 0.00 H new ATOM 0 HB ILE A 71 7.465 -0.654 5.288 1.00 0.00 H new ATOM 0 HG12 ILE A 71 4.664 -1.370 6.199 1.00 0.00 H new ATOM 0 HG13 ILE A 71 5.344 -1.965 4.697 1.00 0.00 H new ATOM 0 HG21 ILE A 71 6.958 -0.332 7.676 1.00 0.00 H new ATOM 0 HG22 ILE A 71 7.199 1.220 6.840 1.00 0.00 H new ATOM 0 HG23 ILE A 71 5.554 0.671 7.240 1.00 0.00 H new ATOM 0 HD11 ILE A 71 5.610 -3.609 6.492 1.00 0.00 H new ATOM 0 HD12 ILE A 71 7.198 -3.024 5.941 1.00 0.00 H new ATOM 0 HD13 ILE A 71 6.507 -2.420 7.466 1.00 0.00 H new ATOM 1192 N SER A 72 8.087 1.389 3.934 1.00 0.00 N ATOM 1193 CA SER A 72 9.123 2.385 3.684 1.00 0.00 C ATOM 1194 C SER A 72 10.295 1.776 2.922 1.00 0.00 C ATOM 1195 O SER A 72 11.046 0.964 3.462 1.00 0.00 O ATOM 1196 CB SER A 72 9.614 2.980 5.003 1.00 0.00 C ATOM 1197 OG SER A 72 8.529 3.262 5.872 1.00 0.00 O ATOM 0 H SER A 72 8.393 0.424 3.811 1.00 0.00 H new ATOM 0 HA SER A 72 8.689 3.177 3.073 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.300 2.284 5.486 1.00 0.00 H new ATOM 0 HB3 SER A 72 10.174 3.894 4.807 1.00 0.00 H new ATOM 0 HG SER A 72 7.747 3.525 5.344 1.00 0.00 H new ATOM 1203 N ALA A 73 10.447 2.174 1.662 1.00 0.00 N ATOM 1204 CA ALA A 73 11.528 1.669 0.823 1.00 0.00 C ATOM 1205 C ALA A 73 12.755 2.570 0.882 1.00 0.00 C ATOM 1206 O ALA A 73 13.634 2.501 0.022 1.00 0.00 O ATOM 1207 CB ALA A 73 11.056 1.500 -0.614 1.00 0.00 C ATOM 0 H ALA A 73 9.834 2.846 1.200 1.00 0.00 H new ATOM 0 HA ALA A 73 11.818 0.693 1.213 1.00 0.00 H new ATOM 0 HB1 ALA A 73 11.876 1.122 -1.224 1.00 0.00 H new ATOM 0 HB2 ALA A 73 10.227 0.793 -0.644 1.00 0.00 H new ATOM 0 HB3 ALA A 73 10.727 2.463 -1.004 1.00 0.00 H new ATOM 1213 N PHE A 74 12.807 3.410 1.902 1.00 0.00 N ATOM 1214 CA PHE A 74 13.925 4.331 2.083 1.00 0.00 C ATOM 1215 C PHE A 74 14.014 5.314 0.922 1.00 0.00 C ATOM 1216 O PHE A 74 14.625 5.022 -0.106 1.00 0.00 O ATOM 1217 CB PHE A 74 15.238 3.556 2.214 1.00 0.00 C ATOM 1218 CG PHE A 74 16.185 4.143 3.221 1.00 0.00 C ATOM 1219 CD1 PHE A 74 15.822 4.246 4.555 1.00 0.00 C ATOM 1220 CD2 PHE A 74 17.438 4.590 2.835 1.00 0.00 C ATOM 1221 CE1 PHE A 74 16.691 4.786 5.484 1.00 0.00 C ATOM 1222 CE2 PHE A 74 18.312 5.130 3.761 1.00 0.00 C ATOM 1223 CZ PHE A 74 17.938 5.228 5.086 1.00 0.00 C ATOM 0 H PHE A 74 12.087 3.476 2.622 1.00 0.00 H new ATOM 0 HA PHE A 74 13.753 4.895 3.000 1.00 0.00 H new ATOM 0 HB2 PHE A 74 15.016 2.526 2.494 1.00 0.00 H new ATOM 0 HB3 PHE A 74 15.729 3.523 1.242 1.00 0.00 H new ATOM 0 HD1 PHE A 74 14.849 3.900 4.872 1.00 0.00 H new ATOM 0 HD2 PHE A 74 17.736 4.516 1.799 1.00 0.00 H new ATOM 0 HE1 PHE A 74 16.396 4.862 6.520 1.00 0.00 H new ATOM 0 HE2 PHE A 74 19.286 5.475 3.448 1.00 0.00 H new ATOM 0 HZ PHE A 74 18.619 5.650 5.810 1.00 0.00 H new ATOM 1233 N GLY A 75 13.402 6.482 1.093 1.00 0.00 N ATOM 1234 CA GLY A 75 13.424 7.490 0.050 1.00 0.00 C ATOM 1235 C GLY A 75 13.681 8.884 0.596 1.00 0.00 C ATOM 1236 O GLY A 75 13.879 9.053 1.798 1.00 0.00 O ATOM 0 H GLY A 75 12.892 6.748 1.935 1.00 0.00 H new ATOM 0 HA2 GLY A 75 14.197 7.240 -0.677 1.00 0.00 H new ATOM 0 HA3 GLY A 75 12.472 7.481 -0.481 1.00 0.00 H new ATOM 1240 N PRO A 76 13.682 9.910 -0.273 1.00 0.00 N ATOM 1241 CA PRO A 76 13.918 11.296 0.144 1.00 0.00 C ATOM 1242 C PRO A 76 13.000 11.723 1.285 1.00 0.00 C ATOM 1243 O PRO A 76 13.348 12.593 2.083 1.00 0.00 O ATOM 1244 CB PRO A 76 13.613 12.105 -1.119 1.00 0.00 C ATOM 1245 CG PRO A 76 13.843 11.156 -2.243 1.00 0.00 C ATOM 1246 CD PRO A 76 13.453 9.800 -1.726 1.00 0.00 C ATOM 0 HA PRO A 76 14.929 11.440 0.524 1.00 0.00 H new ATOM 0 HB2 PRO A 76 12.587 12.472 -1.115 1.00 0.00 H new ATOM 0 HB3 PRO A 76 14.263 12.976 -1.197 1.00 0.00 H new ATOM 0 HG2 PRO A 76 13.245 11.429 -3.113 1.00 0.00 H new ATOM 0 HG3 PRO A 76 14.887 11.169 -2.557 1.00 0.00 H new ATOM 0 HD2 PRO A 76 12.412 9.568 -1.952 1.00 0.00 H new ATOM 0 HD3 PRO A 76 14.060 9.011 -2.170 1.00 0.00 H new ATOM 1254 N SER A 77 11.826 11.103 1.354 1.00 0.00 N ATOM 1255 CA SER A 77 10.856 11.419 2.397 1.00 0.00 C ATOM 1256 C SER A 77 11.373 10.993 3.766 1.00 0.00 C ATOM 1257 O SER A 77 11.064 9.903 4.246 1.00 0.00 O ATOM 1258 CB SER A 77 9.521 10.732 2.106 1.00 0.00 C ATOM 1259 OG SER A 77 9.721 9.424 1.596 1.00 0.00 O ATOM 0 H SER A 77 11.524 10.380 0.701 1.00 0.00 H new ATOM 0 HA SER A 77 10.706 12.499 2.405 1.00 0.00 H new ATOM 0 HB2 SER A 77 8.927 10.683 3.019 1.00 0.00 H new ATOM 0 HB3 SER A 77 8.953 11.323 1.387 1.00 0.00 H new ATOM 0 HG SER A 77 10.315 8.926 2.196 1.00 0.00 H new ATOM 1265 N ALA A 78 12.163 11.861 4.392 1.00 0.00 N ATOM 1266 CA ALA A 78 12.723 11.574 5.707 1.00 0.00 C ATOM 1267 C ALA A 78 11.802 12.062 6.813 1.00 0.00 C ATOM 1268 O ALA A 78 11.289 11.274 7.607 1.00 0.00 O ATOM 1269 CB ALA A 78 14.091 12.220 5.849 1.00 0.00 C ATOM 0 H ALA A 78 12.429 12.768 4.009 1.00 0.00 H new ATOM 0 HA ALA A 78 12.826 10.493 5.800 1.00 0.00 H new ATOM 0 HB1 ALA A 78 14.498 11.998 6.836 1.00 0.00 H new ATOM 0 HB2 ALA A 78 14.760 11.827 5.084 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.998 13.299 5.730 1.00 0.00 H new ATOM 1275 N SER A 79 11.606 13.371 6.858 1.00 0.00 N ATOM 1276 CA SER A 79 10.754 13.988 7.868 1.00 0.00 C ATOM 1277 C SER A 79 10.718 15.503 7.686 1.00 0.00 C ATOM 1278 O SER A 79 10.955 16.010 6.588 1.00 0.00 O ATOM 1279 CB SER A 79 11.257 13.629 9.270 1.00 0.00 C ATOM 1280 OG SER A 79 10.177 13.349 10.143 1.00 0.00 O ATOM 0 H SER A 79 12.027 14.031 6.204 1.00 0.00 H new ATOM 0 HA SER A 79 9.740 13.606 7.750 1.00 0.00 H new ATOM 0 HB2 SER A 79 11.916 12.763 9.213 1.00 0.00 H new ATOM 0 HB3 SER A 79 11.848 14.453 9.670 1.00 0.00 H new ATOM 0 HG SER A 79 10.524 13.121 11.031 1.00 0.00 H new ATOM 1286 N GLY A 80 10.424 16.223 8.763 1.00 0.00 N ATOM 1287 CA GLY A 80 10.365 17.672 8.695 1.00 0.00 C ATOM 1288 C GLY A 80 9.172 18.167 7.904 1.00 0.00 C ATOM 1289 O GLY A 80 8.031 18.065 8.356 1.00 0.00 O ATOM 0 H GLY A 80 10.225 15.829 9.683 1.00 0.00 H new ATOM 0 HA2 GLY A 80 10.321 18.079 9.705 1.00 0.00 H new ATOM 0 HA3 GLY A 80 11.281 18.049 8.239 1.00 0.00 H new ATOM 1293 N SER A 81 9.434 18.708 6.717 1.00 0.00 N ATOM 1294 CA SER A 81 8.372 19.223 5.860 1.00 0.00 C ATOM 1295 C SER A 81 8.504 18.671 4.443 1.00 0.00 C ATOM 1296 O SER A 81 9.354 17.823 4.174 1.00 0.00 O ATOM 1297 CB SER A 81 8.407 20.752 5.834 1.00 0.00 C ATOM 1298 OG SER A 81 7.113 21.296 6.029 1.00 0.00 O ATOM 0 H SER A 81 10.372 18.801 6.328 1.00 0.00 H new ATOM 0 HA SER A 81 7.415 18.898 6.269 1.00 0.00 H new ATOM 0 HB2 SER A 81 9.079 21.117 6.611 1.00 0.00 H new ATOM 0 HB3 SER A 81 8.808 21.093 4.880 1.00 0.00 H new ATOM 0 HG SER A 81 7.163 22.275 6.010 1.00 0.00 H new ATOM 1304 N ALA A 82 7.655 19.159 3.544 1.00 0.00 N ATOM 1305 CA ALA A 82 7.678 18.714 2.155 1.00 0.00 C ATOM 1306 C ALA A 82 6.802 19.604 1.280 1.00 0.00 C ATOM 1307 O ALA A 82 5.628 19.310 1.058 1.00 0.00 O ATOM 1308 CB ALA A 82 7.225 17.265 2.060 1.00 0.00 C ATOM 0 H ALA A 82 6.944 19.861 3.752 1.00 0.00 H new ATOM 0 HA ALA A 82 8.703 18.788 1.791 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.246 16.945 1.018 1.00 0.00 H new ATOM 0 HB2 ALA A 82 7.894 16.636 2.647 1.00 0.00 H new ATOM 0 HB3 ALA A 82 6.210 17.175 2.446 1.00 0.00 H new ATOM 1314 N GLY A 83 7.382 20.691 0.783 1.00 0.00 N ATOM 1315 CA GLY A 83 6.639 21.605 -0.064 1.00 0.00 C ATOM 1316 C GLY A 83 6.837 21.323 -1.541 1.00 0.00 C ATOM 1317 O GLY A 83 6.649 22.204 -2.379 1.00 0.00 O ATOM 0 H GLY A 83 8.353 20.955 0.951 1.00 0.00 H new ATOM 0 HA2 GLY A 83 5.578 21.536 0.176 1.00 0.00 H new ATOM 0 HA3 GLY A 83 6.949 22.628 0.152 1.00 0.00 H new ATOM 1321 N GLN A 84 7.217 20.088 -1.861 1.00 0.00 N ATOM 1322 CA GLN A 84 7.439 19.692 -3.247 1.00 0.00 C ATOM 1323 C GLN A 84 6.623 18.454 -3.597 1.00 0.00 C ATOM 1324 O GLN A 84 6.017 18.377 -4.666 1.00 0.00 O ATOM 1325 CB GLN A 84 8.926 19.425 -3.490 1.00 0.00 C ATOM 1326 CG GLN A 84 9.820 20.606 -3.150 1.00 0.00 C ATOM 1327 CD GLN A 84 10.379 21.290 -4.383 1.00 0.00 C ATOM 1328 OE1 GLN A 84 11.592 21.341 -4.581 1.00 0.00 O ATOM 1329 NE2 GLN A 84 9.493 21.822 -5.216 1.00 0.00 N ATOM 0 H GLN A 84 7.377 19.346 -1.179 1.00 0.00 H new ATOM 0 HA GLN A 84 7.114 20.510 -3.890 1.00 0.00 H new ATOM 0 HB2 GLN A 84 9.234 18.564 -2.896 1.00 0.00 H new ATOM 0 HB3 GLN A 84 9.072 19.159 -4.537 1.00 0.00 H new ATOM 0 HG2 GLN A 84 9.253 21.329 -2.564 1.00 0.00 H new ATOM 0 HG3 GLN A 84 10.644 20.264 -2.524 1.00 0.00 H new ATOM 0 HE21 GLN A 84 8.496 21.755 -5.011 1.00 0.00 H new ATOM 0 HE22 GLN A 84 9.809 22.297 -6.061 1.00 0.00 H new ATOM 1338 N ALA A 85 6.611 17.488 -2.687 1.00 0.00 N ATOM 1339 CA ALA A 85 5.869 16.250 -2.892 1.00 0.00 C ATOM 1340 C ALA A 85 4.553 16.268 -2.124 1.00 0.00 C ATOM 1341 O ALA A 85 4.543 16.332 -0.894 1.00 0.00 O ATOM 1342 CB ALA A 85 6.711 15.055 -2.474 1.00 0.00 C ATOM 0 H ALA A 85 7.108 17.538 -1.798 1.00 0.00 H new ATOM 0 HA ALA A 85 5.639 16.163 -3.954 1.00 0.00 H new ATOM 0 HB1 ALA A 85 6.144 14.137 -2.632 1.00 0.00 H new ATOM 0 HB2 ALA A 85 7.623 15.026 -3.070 1.00 0.00 H new ATOM 0 HB3 ALA A 85 6.970 15.144 -1.419 1.00 0.00 H new ATOM 1348 N GLU A 86 3.444 16.212 -2.855 1.00 0.00 N ATOM 1349 CA GLU A 86 2.122 16.224 -2.238 1.00 0.00 C ATOM 1350 C GLU A 86 1.072 15.651 -3.190 1.00 0.00 C ATOM 1351 O GLU A 86 0.009 16.237 -3.387 1.00 0.00 O ATOM 1352 CB GLU A 86 1.745 17.649 -1.827 1.00 0.00 C ATOM 1353 CG GLU A 86 1.346 17.774 -0.365 1.00 0.00 C ATOM 1354 CD GLU A 86 0.106 16.970 -0.029 1.00 0.00 C ATOM 1355 OE1 GLU A 86 -0.096 15.904 -0.647 1.00 0.00 O ATOM 1356 OE2 GLU A 86 -0.664 17.407 0.852 1.00 0.00 O ATOM 0 H GLU A 86 3.434 16.158 -3.874 1.00 0.00 H new ATOM 0 HA GLU A 86 2.153 15.596 -1.348 1.00 0.00 H new ATOM 0 HB2 GLU A 86 2.589 18.310 -2.023 1.00 0.00 H new ATOM 0 HB3 GLU A 86 0.920 17.992 -2.451 1.00 0.00 H new ATOM 0 HG2 GLU A 86 2.172 17.441 0.263 1.00 0.00 H new ATOM 0 HG3 GLU A 86 1.169 18.823 -0.129 1.00 0.00 H new ATOM 1363 N GLU A 87 1.381 14.499 -3.777 1.00 0.00 N ATOM 1364 CA GLU A 87 0.466 13.844 -4.706 1.00 0.00 C ATOM 1365 C GLU A 87 -0.861 13.524 -4.028 1.00 0.00 C ATOM 1366 O GLU A 87 -1.930 13.736 -4.603 1.00 0.00 O ATOM 1367 CB GLU A 87 1.095 12.562 -5.253 1.00 0.00 C ATOM 1368 CG GLU A 87 0.348 11.975 -6.439 1.00 0.00 C ATOM 1369 CD GLU A 87 0.985 10.700 -6.956 1.00 0.00 C ATOM 1370 OE1 GLU A 87 1.261 9.799 -6.135 1.00 0.00 O ATOM 1371 OE2 GLU A 87 1.209 10.601 -8.180 1.00 0.00 O ATOM 0 H GLU A 87 2.258 14.000 -3.626 1.00 0.00 H new ATOM 0 HA GLU A 87 0.274 14.528 -5.532 1.00 0.00 H new ATOM 0 HB2 GLU A 87 2.123 12.770 -5.549 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.136 11.819 -4.456 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -0.683 11.770 -6.149 1.00 0.00 H new ATOM 0 HG3 GLU A 87 0.313 12.711 -7.242 1.00 0.00 H new ATOM 1378 N GLU A 88 -0.785 13.010 -2.803 1.00 0.00 N ATOM 1379 CA GLU A 88 -1.975 12.652 -2.030 1.00 0.00 C ATOM 1380 C GLU A 88 -3.001 11.919 -2.889 1.00 0.00 C ATOM 1381 O GLU A 88 -4.125 12.388 -3.070 1.00 0.00 O ATOM 1382 CB GLU A 88 -2.606 13.900 -1.406 1.00 0.00 C ATOM 1383 CG GLU A 88 -2.902 15.003 -2.408 1.00 0.00 C ATOM 1384 CD GLU A 88 -3.678 16.153 -1.796 1.00 0.00 C ATOM 1385 OE1 GLU A 88 -4.908 16.020 -1.636 1.00 0.00 O ATOM 1386 OE2 GLU A 88 -3.053 17.186 -1.476 1.00 0.00 O ATOM 0 H GLU A 88 0.095 12.830 -2.320 1.00 0.00 H new ATOM 0 HA GLU A 88 -1.659 11.978 -1.234 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -3.533 13.617 -0.907 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -1.937 14.289 -0.638 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -1.964 15.379 -2.817 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -3.470 14.589 -3.241 1.00 0.00 H new ATOM 1393 N ASN A 89 -2.608 10.764 -3.413 1.00 0.00 N ATOM 1394 CA ASN A 89 -3.496 9.965 -4.245 1.00 0.00 C ATOM 1395 C ASN A 89 -3.349 8.481 -3.924 1.00 0.00 C ATOM 1396 O ASN A 89 -2.379 7.841 -4.329 1.00 0.00 O ATOM 1397 CB ASN A 89 -3.200 10.213 -5.726 1.00 0.00 C ATOM 1398 CG ASN A 89 -3.846 11.484 -6.240 1.00 0.00 C ATOM 1399 OD1 ASN A 89 -3.888 12.499 -5.544 1.00 0.00 O ATOM 1400 ND2 ASN A 89 -4.357 11.435 -7.465 1.00 0.00 N ATOM 0 H ASN A 89 -1.681 10.361 -3.276 1.00 0.00 H new ATOM 0 HA ASN A 89 -4.523 10.264 -4.033 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -2.122 10.272 -5.873 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -3.556 9.365 -6.312 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -4.806 12.259 -7.864 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -4.300 10.573 -8.007 1.00 0.00 H new ATOM 1407 N PHE A 90 -4.319 7.944 -3.191 1.00 0.00 N ATOM 1408 CA PHE A 90 -4.302 6.536 -2.808 1.00 0.00 C ATOM 1409 C PHE A 90 -5.573 5.828 -3.268 1.00 0.00 C ATOM 1410 O PHE A 90 -6.657 6.065 -2.736 1.00 0.00 O ATOM 1411 CB PHE A 90 -4.135 6.382 -1.288 1.00 0.00 C ATOM 1412 CG PHE A 90 -4.545 7.590 -0.485 1.00 0.00 C ATOM 1413 CD1 PHE A 90 -3.891 8.803 -0.642 1.00 0.00 C ATOM 1414 CD2 PHE A 90 -5.578 7.508 0.434 1.00 0.00 C ATOM 1415 CE1 PHE A 90 -4.258 9.907 0.101 1.00 0.00 C ATOM 1416 CE2 PHE A 90 -5.951 8.609 1.180 1.00 0.00 C ATOM 1417 CZ PHE A 90 -5.290 9.811 1.013 1.00 0.00 C ATOM 0 H PHE A 90 -5.128 8.463 -2.850 1.00 0.00 H new ATOM 0 HA PHE A 90 -3.448 6.071 -3.301 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -4.722 5.526 -0.956 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.091 6.156 -1.072 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -3.084 8.885 -1.355 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -6.098 6.571 0.569 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -3.738 10.845 -0.031 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -6.758 8.531 1.893 1.00 0.00 H new ATOM 0 HZ PHE A 90 -5.580 10.673 1.595 1.00 0.00 H new ATOM 1427 N GLU A 91 -5.425 4.955 -4.260 1.00 0.00 N ATOM 1428 CA GLU A 91 -6.555 4.202 -4.800 1.00 0.00 C ATOM 1429 C GLU A 91 -6.120 2.788 -5.176 1.00 0.00 C ATOM 1430 O GLU A 91 -5.118 2.600 -5.866 1.00 0.00 O ATOM 1431 CB GLU A 91 -7.139 4.916 -6.023 1.00 0.00 C ATOM 1432 CG GLU A 91 -7.053 6.432 -5.950 1.00 0.00 C ATOM 1433 CD GLU A 91 -5.717 6.963 -6.434 1.00 0.00 C ATOM 1434 OE1 GLU A 91 -5.167 6.394 -7.400 1.00 0.00 O ATOM 1435 OE2 GLU A 91 -5.224 7.948 -5.847 1.00 0.00 O ATOM 0 H GLU A 91 -4.532 4.750 -4.708 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.326 4.139 -4.032 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.615 4.575 -6.916 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -8.184 4.626 -6.136 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -7.852 6.867 -6.550 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -7.216 6.753 -4.921 1.00 0.00 H new ATOM 1442 N PHE A 92 -6.874 1.793 -4.713 1.00 0.00 N ATOM 1443 CA PHE A 92 -6.550 0.397 -5.000 1.00 0.00 C ATOM 1444 C PHE A 92 -7.735 -0.329 -5.636 1.00 0.00 C ATOM 1445 O PHE A 92 -8.892 -0.038 -5.335 1.00 0.00 O ATOM 1446 CB PHE A 92 -6.120 -0.324 -3.717 1.00 0.00 C ATOM 1447 CG PHE A 92 -7.206 -0.427 -2.684 1.00 0.00 C ATOM 1448 CD1 PHE A 92 -8.261 -1.308 -2.853 1.00 0.00 C ATOM 1449 CD2 PHE A 92 -7.171 0.358 -1.541 1.00 0.00 C ATOM 1450 CE1 PHE A 92 -9.262 -1.406 -1.904 1.00 0.00 C ATOM 1451 CE2 PHE A 92 -8.169 0.265 -0.587 1.00 0.00 C ATOM 1452 CZ PHE A 92 -9.216 -0.619 -0.770 1.00 0.00 C ATOM 0 H PHE A 92 -7.708 1.926 -4.141 1.00 0.00 H new ATOM 0 HA PHE A 92 -5.724 0.386 -5.711 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.779 -1.327 -3.973 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -5.269 0.202 -3.284 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -8.303 -1.927 -3.737 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -6.355 1.050 -1.394 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -10.079 -2.097 -2.049 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -8.130 0.882 0.299 1.00 0.00 H new ATOM 0 HZ PHE A 92 -9.997 -0.694 -0.027 1.00 0.00 H new ATOM 1462 N LEU A 93 -7.429 -1.278 -6.518 1.00 0.00 N ATOM 1463 CA LEU A 93 -8.460 -2.054 -7.203 1.00 0.00 C ATOM 1464 C LEU A 93 -8.514 -3.477 -6.657 1.00 0.00 C ATOM 1465 O LEU A 93 -7.478 -4.081 -6.377 1.00 0.00 O ATOM 1466 CB LEU A 93 -8.191 -2.089 -8.709 1.00 0.00 C ATOM 1467 CG LEU A 93 -8.624 -0.838 -9.477 1.00 0.00 C ATOM 1468 CD1 LEU A 93 -7.693 -0.586 -10.652 1.00 0.00 C ATOM 1469 CD2 LEU A 93 -10.060 -0.982 -9.955 1.00 0.00 C ATOM 0 H LEU A 93 -6.474 -1.528 -6.775 1.00 0.00 H new ATOM 0 HA LEU A 93 -9.421 -1.572 -7.024 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -7.124 -2.242 -8.868 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -8.704 -2.952 -9.134 1.00 0.00 H new ATOM 0 HG LEU A 93 -8.568 0.018 -8.805 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -8.016 0.307 -11.187 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -6.676 -0.443 -10.286 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -7.719 -1.442 -11.327 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -10.354 -0.085 -10.500 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -10.140 -1.848 -10.612 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -10.718 -1.117 -9.096 1.00 0.00 H new ATOM 1481 N ILE A 94 -9.727 -4.006 -6.508 1.00 0.00 N ATOM 1482 CA ILE A 94 -9.918 -5.358 -5.990 1.00 0.00 C ATOM 1483 C ILE A 94 -10.568 -6.256 -7.040 1.00 0.00 C ATOM 1484 O ILE A 94 -11.727 -6.067 -7.394 1.00 0.00 O ATOM 1485 CB ILE A 94 -10.801 -5.346 -4.727 1.00 0.00 C ATOM 1486 CG1 ILE A 94 -10.395 -4.202 -3.795 1.00 0.00 C ATOM 1487 CG2 ILE A 94 -10.713 -6.679 -4.003 1.00 0.00 C ATOM 1488 CD1 ILE A 94 -9.010 -4.360 -3.208 1.00 0.00 C ATOM 0 H ILE A 94 -10.592 -3.518 -6.739 1.00 0.00 H new ATOM 0 HA ILE A 94 -8.933 -5.750 -5.737 1.00 0.00 H new ATOM 0 HB ILE A 94 -11.835 -5.187 -5.034 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -10.442 -3.262 -4.345 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -11.119 -4.132 -2.983 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -11.343 -6.652 -3.114 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -11.053 -7.476 -4.665 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -9.680 -6.867 -3.710 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -8.791 -3.513 -2.558 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -8.963 -5.282 -2.629 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -8.276 -4.399 -4.013 1.00 0.00 H new ATOM 1500 N VAL A 95 -9.819 -7.236 -7.535 1.00 0.00 N ATOM 1501 CA VAL A 95 -10.340 -8.151 -8.546 1.00 0.00 C ATOM 1502 C VAL A 95 -10.713 -9.499 -7.938 1.00 0.00 C ATOM 1503 O VAL A 95 -9.904 -10.131 -7.261 1.00 0.00 O ATOM 1504 CB VAL A 95 -9.326 -8.376 -9.685 1.00 0.00 C ATOM 1505 CG1 VAL A 95 -9.886 -9.330 -10.729 1.00 0.00 C ATOM 1506 CG2 VAL A 95 -8.938 -7.050 -10.321 1.00 0.00 C ATOM 0 H VAL A 95 -8.855 -7.417 -7.255 1.00 0.00 H new ATOM 0 HA VAL A 95 -11.235 -7.683 -8.955 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.431 -8.830 -9.260 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -9.152 -9.473 -11.522 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -10.108 -10.290 -10.263 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -10.800 -8.912 -11.151 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.222 -7.227 -11.123 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -9.827 -6.568 -10.728 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -8.487 -6.403 -9.568 1.00 0.00 H new ATOM 1516 N SER A 96 -11.942 -9.936 -8.198 1.00 0.00 N ATOM 1517 CA SER A 96 -12.422 -11.214 -7.689 1.00 0.00 C ATOM 1518 C SER A 96 -12.111 -12.332 -8.677 1.00 0.00 C ATOM 1519 O SER A 96 -11.452 -12.109 -9.694 1.00 0.00 O ATOM 1520 CB SER A 96 -13.929 -11.149 -7.427 1.00 0.00 C ATOM 1521 OG SER A 96 -14.433 -12.409 -7.019 1.00 0.00 O ATOM 0 H SER A 96 -12.623 -9.423 -8.758 1.00 0.00 H new ATOM 0 HA SER A 96 -11.910 -11.425 -6.750 1.00 0.00 H new ATOM 0 HB2 SER A 96 -14.135 -10.405 -6.657 1.00 0.00 H new ATOM 0 HB3 SER A 96 -14.444 -10.824 -8.331 1.00 0.00 H new ATOM 0 HG SER A 96 -14.006 -12.675 -6.178 1.00 0.00 H new ATOM 1527 N SER A 97 -12.584 -13.535 -8.374 1.00 0.00 N ATOM 1528 CA SER A 97 -12.350 -14.684 -9.240 1.00 0.00 C ATOM 1529 C SER A 97 -13.344 -14.719 -10.399 1.00 0.00 C ATOM 1530 O SER A 97 -13.160 -15.467 -11.358 1.00 0.00 O ATOM 1531 CB SER A 97 -12.439 -15.981 -8.435 1.00 0.00 C ATOM 1532 OG SER A 97 -11.670 -17.008 -9.036 1.00 0.00 O ATOM 0 H SER A 97 -13.130 -13.740 -7.537 1.00 0.00 H new ATOM 0 HA SER A 97 -11.347 -14.588 -9.657 1.00 0.00 H new ATOM 0 HB2 SER A 97 -12.087 -15.806 -7.418 1.00 0.00 H new ATOM 0 HB3 SER A 97 -13.480 -16.297 -8.362 1.00 0.00 H new ATOM 0 HG SER A 97 -11.742 -17.826 -8.501 1.00 0.00 H new ATOM 1538 N THR A 98 -14.396 -13.909 -10.311 1.00 0.00 N ATOM 1539 CA THR A 98 -15.403 -13.862 -11.363 1.00 0.00 C ATOM 1540 C THR A 98 -15.228 -12.626 -12.237 1.00 0.00 C ATOM 1541 O THR A 98 -16.176 -12.162 -12.872 1.00 0.00 O ATOM 1542 CB THR A 98 -16.809 -13.883 -10.760 1.00 0.00 C ATOM 1543 OG1 THR A 98 -17.789 -13.704 -11.765 1.00 0.00 O ATOM 1544 CG2 THR A 98 -17.027 -12.815 -9.711 1.00 0.00 C ATOM 0 H THR A 98 -14.571 -13.281 -9.527 1.00 0.00 H new ATOM 0 HA THR A 98 -15.273 -14.745 -11.989 1.00 0.00 H new ATOM 0 HB THR A 98 -16.904 -14.860 -10.286 1.00 0.00 H new ATOM 0 HG1 THR A 98 -17.580 -12.901 -12.286 1.00 0.00 H new ATOM 0 HG21 THR A 98 -18.044 -12.886 -9.325 1.00 0.00 H new ATOM 0 HG22 THR A 98 -16.318 -12.956 -8.895 1.00 0.00 H new ATOM 0 HG23 THR A 98 -16.876 -11.832 -10.156 1.00 0.00 H new ATOM 1552 N GLY A 99 -14.008 -12.105 -12.271 1.00 0.00 N ATOM 1553 CA GLY A 99 -13.723 -10.933 -13.080 1.00 0.00 C ATOM 1554 C GLY A 99 -14.201 -9.633 -12.452 1.00 0.00 C ATOM 1555 O GLY A 99 -13.888 -8.552 -12.950 1.00 0.00 O ATOM 0 H GLY A 99 -13.210 -12.472 -11.753 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.648 -10.871 -13.251 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -14.194 -11.051 -14.056 1.00 0.00 H new ATOM 1559 N GLN A 100 -14.957 -9.725 -11.359 1.00 0.00 N ATOM 1560 CA GLN A 100 -15.462 -8.536 -10.683 1.00 0.00 C ATOM 1561 C GLN A 100 -14.308 -7.654 -10.219 1.00 0.00 C ATOM 1562 O GLN A 100 -13.275 -8.154 -9.776 1.00 0.00 O ATOM 1563 CB GLN A 100 -16.336 -8.931 -9.490 1.00 0.00 C ATOM 1564 CG GLN A 100 -17.651 -8.173 -9.423 1.00 0.00 C ATOM 1565 CD GLN A 100 -18.795 -8.932 -10.066 1.00 0.00 C ATOM 1566 OE1 GLN A 100 -18.664 -9.452 -11.175 1.00 0.00 O ATOM 1567 NE2 GLN A 100 -19.925 -9.001 -9.372 1.00 0.00 N ATOM 0 H GLN A 100 -15.231 -10.607 -10.926 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.069 -7.971 -11.390 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.544 -10.000 -9.541 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.779 -8.758 -8.569 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -17.896 -7.969 -8.381 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.536 -7.209 -9.918 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -19.989 -8.555 -8.457 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.729 -9.500 -9.754 1.00 0.00 H new ATOM 1576 N THR A 101 -14.483 -6.340 -10.330 1.00 0.00 N ATOM 1577 CA THR A 101 -13.443 -5.405 -9.924 1.00 0.00 C ATOM 1578 C THR A 101 -14.013 -4.248 -9.106 1.00 0.00 C ATOM 1579 O THR A 101 -14.782 -3.432 -9.614 1.00 0.00 O ATOM 1580 CB THR A 101 -12.714 -4.859 -11.152 1.00 0.00 C ATOM 1581 OG1 THR A 101 -12.464 -5.894 -12.087 1.00 0.00 O ATOM 1582 CG2 THR A 101 -11.389 -4.209 -10.821 1.00 0.00 C ATOM 0 H THR A 101 -15.329 -5.903 -10.695 1.00 0.00 H new ATOM 0 HA THR A 101 -12.739 -5.950 -9.294 1.00 0.00 H new ATOM 0 HB THR A 101 -13.377 -4.101 -11.569 1.00 0.00 H new ATOM 0 HG1 THR A 101 -11.998 -5.525 -12.866 1.00 0.00 H new ATOM 0 HG21 THR A 101 -10.924 -3.843 -11.737 1.00 0.00 H new ATOM 0 HG22 THR A 101 -11.553 -3.375 -10.139 1.00 0.00 H new ATOM 0 HG23 THR A 101 -10.733 -4.940 -10.348 1.00 0.00 H new ATOM 1590 N TRP A 102 -13.614 -4.179 -7.839 1.00 0.00 N ATOM 1591 CA TRP A 102 -14.063 -3.120 -6.946 1.00 0.00 C ATOM 1592 C TRP A 102 -12.989 -2.054 -6.799 1.00 0.00 C ATOM 1593 O TRP A 102 -11.993 -2.264 -6.105 1.00 0.00 O ATOM 1594 CB TRP A 102 -14.378 -3.679 -5.564 1.00 0.00 C ATOM 1595 CG TRP A 102 -15.454 -4.713 -5.546 1.00 0.00 C ATOM 1596 CD1 TRP A 102 -16.127 -5.234 -6.611 1.00 0.00 C ATOM 1597 CD2 TRP A 102 -15.973 -5.356 -4.386 1.00 0.00 C ATOM 1598 NE1 TRP A 102 -17.036 -6.171 -6.177 1.00 0.00 N ATOM 1599 CE2 TRP A 102 -16.961 -6.260 -4.811 1.00 0.00 C ATOM 1600 CE3 TRP A 102 -15.692 -5.251 -3.026 1.00 0.00 C ATOM 1601 CZ2 TRP A 102 -17.671 -7.057 -3.912 1.00 0.00 C ATOM 1602 CZ3 TRP A 102 -16.399 -6.044 -2.141 1.00 0.00 C ATOM 1603 CH2 TRP A 102 -17.370 -6.931 -2.588 1.00 0.00 C ATOM 0 H TRP A 102 -12.977 -4.849 -7.408 1.00 0.00 H new ATOM 0 HA TRP A 102 -14.962 -2.683 -7.380 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -13.469 -4.111 -5.145 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -14.671 -2.857 -4.911 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -15.970 -4.953 -7.642 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -17.663 -6.711 -6.774 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -14.938 -4.565 -2.670 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -18.429 -7.747 -4.252 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -16.193 -5.972 -1.083 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -17.900 -7.537 -1.868 1.00 0.00 H new ATOM 1614 N HIS A 103 -13.190 -0.907 -7.429 1.00 0.00 N ATOM 1615 CA HIS A 103 -12.222 0.172 -7.326 1.00 0.00 C ATOM 1616 C HIS A 103 -12.576 1.089 -6.164 1.00 0.00 C ATOM 1617 O HIS A 103 -13.629 1.727 -6.162 1.00 0.00 O ATOM 1618 CB HIS A 103 -12.152 0.975 -8.625 1.00 0.00 C ATOM 1619 CG HIS A 103 -10.950 1.861 -8.682 1.00 0.00 C ATOM 1620 ND1 HIS A 103 -10.079 1.989 -7.624 1.00 0.00 N ATOM 1621 CD2 HIS A 103 -10.474 2.668 -9.661 1.00 0.00 C ATOM 1622 CE1 HIS A 103 -9.125 2.836 -7.938 1.00 0.00 C ATOM 1623 NE2 HIS A 103 -9.336 3.263 -9.172 1.00 0.00 N ATOM 0 H HIS A 103 -14.003 -0.701 -8.009 1.00 0.00 H new ATOM 0 HA HIS A 103 -11.242 -0.271 -7.146 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -12.135 0.290 -9.472 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -13.052 1.582 -8.723 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -10.907 2.815 -10.639 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -8.308 3.133 -7.298 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -8.749 3.926 -9.678 1.00 0.00 H new ATOM 1632 N PHE A 104 -11.699 1.151 -5.167 1.00 0.00 N ATOM 1633 CA PHE A 104 -11.943 1.989 -4.002 1.00 0.00 C ATOM 1634 C PHE A 104 -10.823 2.996 -3.779 1.00 0.00 C ATOM 1635 O PHE A 104 -9.706 2.834 -4.274 1.00 0.00 O ATOM 1636 CB PHE A 104 -12.098 1.133 -2.742 1.00 0.00 C ATOM 1637 CG PHE A 104 -13.209 0.119 -2.807 1.00 0.00 C ATOM 1638 CD1 PHE A 104 -14.420 0.429 -3.401 1.00 0.00 C ATOM 1639 CD2 PHE A 104 -13.039 -1.145 -2.259 1.00 0.00 C ATOM 1640 CE1 PHE A 104 -15.443 -0.499 -3.449 1.00 0.00 C ATOM 1641 CE2 PHE A 104 -14.057 -2.077 -2.306 1.00 0.00 C ATOM 1642 CZ PHE A 104 -15.261 -1.754 -2.901 1.00 0.00 C ATOM 0 H PHE A 104 -10.820 0.635 -5.143 1.00 0.00 H new ATOM 0 HA PHE A 104 -12.867 2.534 -4.197 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -11.159 0.612 -2.554 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -12.273 1.791 -1.891 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -14.567 1.408 -3.832 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.100 -1.402 -1.791 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -16.383 -0.243 -3.914 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -13.912 -3.058 -1.878 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.059 -2.481 -2.938 1.00 0.00 H new ATOM 1652 N GLU A 105 -11.137 4.030 -3.004 1.00 0.00 N ATOM 1653 CA GLU A 105 -10.181 5.072 -2.669 1.00 0.00 C ATOM 1654 C GLU A 105 -10.209 5.330 -1.167 1.00 0.00 C ATOM 1655 O GLU A 105 -11.142 5.948 -0.649 1.00 0.00 O ATOM 1656 CB GLU A 105 -10.499 6.360 -3.433 1.00 0.00 C ATOM 1657 CG GLU A 105 -9.591 7.526 -3.073 1.00 0.00 C ATOM 1658 CD GLU A 105 -9.663 8.654 -4.085 1.00 0.00 C ATOM 1659 OE1 GLU A 105 -9.817 8.362 -5.288 1.00 0.00 O ATOM 1660 OE2 GLU A 105 -9.564 9.828 -3.671 1.00 0.00 O ATOM 0 H GLU A 105 -12.061 4.166 -2.593 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.184 4.741 -2.958 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -10.419 6.166 -4.503 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -11.533 6.642 -3.236 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -9.867 7.907 -2.090 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -8.563 7.172 -3.001 1.00 0.00 H new ATOM 1667 N ALA A 106 -9.192 4.833 -0.472 1.00 0.00 N ATOM 1668 CA ALA A 106 -9.096 4.985 0.976 1.00 0.00 C ATOM 1669 C ALA A 106 -9.314 6.430 1.411 1.00 0.00 C ATOM 1670 O ALA A 106 -8.636 7.342 0.940 1.00 0.00 O ATOM 1671 CB ALA A 106 -7.745 4.486 1.462 1.00 0.00 C ATOM 0 H ALA A 106 -8.418 4.318 -0.891 1.00 0.00 H new ATOM 0 HA ALA A 106 -9.887 4.386 1.427 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -7.682 4.603 2.544 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -7.632 3.433 1.204 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -6.952 5.063 0.987 1.00 0.00 H new ATOM 1677 N ALA A 107 -10.257 6.627 2.330 1.00 0.00 N ATOM 1678 CA ALA A 107 -10.554 7.959 2.842 1.00 0.00 C ATOM 1679 C ALA A 107 -9.339 8.532 3.563 1.00 0.00 C ATOM 1680 O ALA A 107 -9.115 9.743 3.564 1.00 0.00 O ATOM 1681 CB ALA A 107 -11.758 7.912 3.773 1.00 0.00 C ATOM 0 H ALA A 107 -10.826 5.882 2.733 1.00 0.00 H new ATOM 0 HA ALA A 107 -10.795 8.611 2.002 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.968 8.914 4.147 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -12.625 7.539 3.228 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -11.544 7.249 4.611 1.00 0.00 H new ATOM 1687 N SER A 108 -8.553 7.647 4.168 1.00 0.00 N ATOM 1688 CA SER A 108 -7.351 8.046 4.885 1.00 0.00 C ATOM 1689 C SER A 108 -6.119 7.399 4.261 1.00 0.00 C ATOM 1690 O SER A 108 -6.188 6.282 3.750 1.00 0.00 O ATOM 1691 CB SER A 108 -7.457 7.656 6.361 1.00 0.00 C ATOM 1692 OG SER A 108 -8.811 7.562 6.769 1.00 0.00 O ATOM 0 H SER A 108 -8.730 6.643 4.175 1.00 0.00 H new ATOM 0 HA SER A 108 -7.252 9.129 4.814 1.00 0.00 H new ATOM 0 HB2 SER A 108 -6.958 6.701 6.525 1.00 0.00 H new ATOM 0 HB3 SER A 108 -6.940 8.395 6.973 1.00 0.00 H new ATOM 0 HG SER A 108 -8.851 7.310 7.715 1.00 0.00 H new ATOM 1698 N PHE A 109 -4.998 8.109 4.294 1.00 0.00 N ATOM 1699 CA PHE A 109 -3.758 7.600 3.721 1.00 0.00 C ATOM 1700 C PHE A 109 -3.316 6.313 4.410 1.00 0.00 C ATOM 1701 O PHE A 109 -2.750 5.423 3.777 1.00 0.00 O ATOM 1702 CB PHE A 109 -2.654 8.654 3.815 1.00 0.00 C ATOM 1703 CG PHE A 109 -2.080 9.027 2.479 1.00 0.00 C ATOM 1704 CD1 PHE A 109 -1.673 8.046 1.588 1.00 0.00 C ATOM 1705 CD2 PHE A 109 -1.955 10.355 2.110 1.00 0.00 C ATOM 1706 CE1 PHE A 109 -1.155 8.383 0.353 1.00 0.00 C ATOM 1707 CE2 PHE A 109 -1.435 10.700 0.878 1.00 0.00 C ATOM 1708 CZ PHE A 109 -1.035 9.712 -0.002 1.00 0.00 C ATOM 0 H PHE A 109 -4.922 9.037 4.711 1.00 0.00 H new ATOM 0 HA PHE A 109 -3.945 7.375 2.671 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -3.053 9.548 4.294 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -1.855 8.279 4.455 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -1.762 7.005 1.863 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -2.268 11.131 2.793 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -0.845 7.609 -0.333 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -1.341 11.740 0.603 1.00 0.00 H new ATOM 0 HZ PHE A 109 -0.629 9.979 -0.966 1.00 0.00 H new ATOM 1718 N GLU A 110 -3.577 6.218 5.708 1.00 0.00 N ATOM 1719 CA GLU A 110 -3.205 5.034 6.474 1.00 0.00 C ATOM 1720 C GLU A 110 -4.125 3.863 6.144 1.00 0.00 C ATOM 1721 O GLU A 110 -3.707 2.704 6.164 1.00 0.00 O ATOM 1722 CB GLU A 110 -3.260 5.334 7.974 1.00 0.00 C ATOM 1723 CG GLU A 110 -4.641 5.742 8.461 1.00 0.00 C ATOM 1724 CD GLU A 110 -4.661 6.075 9.941 1.00 0.00 C ATOM 1725 OE1 GLU A 110 -4.298 5.198 10.752 1.00 0.00 O ATOM 1726 OE2 GLU A 110 -5.038 7.213 10.289 1.00 0.00 O ATOM 0 H GLU A 110 -4.044 6.944 6.251 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.186 4.760 6.202 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -2.935 4.451 8.525 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -2.553 6.131 8.203 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -4.982 6.607 7.893 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.345 4.934 8.264 1.00 0.00 H new ATOM 1733 N GLU A 111 -5.380 4.175 5.843 1.00 0.00 N ATOM 1734 CA GLU A 111 -6.367 3.155 5.514 1.00 0.00 C ATOM 1735 C GLU A 111 -6.093 2.536 4.145 1.00 0.00 C ATOM 1736 O GLU A 111 -6.339 1.349 3.933 1.00 0.00 O ATOM 1737 CB GLU A 111 -7.776 3.753 5.543 1.00 0.00 C ATOM 1738 CG GLU A 111 -8.789 2.886 6.273 1.00 0.00 C ATOM 1739 CD GLU A 111 -10.219 3.313 6.006 1.00 0.00 C ATOM 1740 OE1 GLU A 111 -10.812 2.820 5.023 1.00 0.00 O ATOM 1741 OE2 GLU A 111 -10.747 4.140 6.782 1.00 0.00 O ATOM 0 H GLU A 111 -5.739 5.130 5.820 1.00 0.00 H new ATOM 0 HA GLU A 111 -6.294 2.367 6.263 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -7.737 4.732 6.021 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -8.116 3.911 4.520 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -8.660 1.848 5.968 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -8.594 2.930 7.345 1.00 0.00 H new ATOM 1748 N ARG A 112 -5.589 3.342 3.214 1.00 0.00 N ATOM 1749 CA ARG A 112 -5.297 2.855 1.869 1.00 0.00 C ATOM 1750 C ARG A 112 -4.336 1.672 1.914 1.00 0.00 C ATOM 1751 O ARG A 112 -4.519 0.685 1.200 1.00 0.00 O ATOM 1752 CB ARG A 112 -4.731 3.987 0.995 1.00 0.00 C ATOM 1753 CG ARG A 112 -3.223 4.175 1.103 1.00 0.00 C ATOM 1754 CD ARG A 112 -2.474 3.225 0.180 1.00 0.00 C ATOM 1755 NE ARG A 112 -1.896 3.917 -0.968 1.00 0.00 N ATOM 1756 CZ ARG A 112 -0.743 4.582 -0.930 1.00 0.00 C ATOM 1757 NH1 ARG A 112 -0.045 4.654 0.197 1.00 0.00 N ATOM 1758 NH2 ARG A 112 -0.286 5.178 -2.023 1.00 0.00 N ATOM 0 H ARG A 112 -5.376 4.328 3.364 1.00 0.00 H new ATOM 0 HA ARG A 112 -6.230 2.512 1.422 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -4.986 3.787 -0.046 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -5.221 4.921 1.270 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -2.965 5.204 0.854 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -2.907 4.007 2.133 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -1.682 2.727 0.739 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -3.154 2.449 -0.170 1.00 0.00 H new ATOM 0 HE ARG A 112 -2.405 3.890 -1.851 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -0.391 4.198 1.041 1.00 0.00 H new ATOM 0 HH12 ARG A 112 0.837 5.165 0.219 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -0.818 5.127 -2.892 1.00 0.00 H new ATOM 0 HH22 ARG A 112 0.597 5.688 -1.995 1.00 0.00 H new ATOM 1772 N ASP A 113 -3.318 1.769 2.760 1.00 0.00 N ATOM 1773 CA ASP A 113 -2.343 0.698 2.898 1.00 0.00 C ATOM 1774 C ASP A 113 -2.935 -0.467 3.676 1.00 0.00 C ATOM 1775 O ASP A 113 -2.809 -1.623 3.270 1.00 0.00 O ATOM 1776 CB ASP A 113 -1.078 1.209 3.591 1.00 0.00 C ATOM 1777 CG ASP A 113 -1.382 1.947 4.881 1.00 0.00 C ATOM 1778 OD1 ASP A 113 -1.684 1.277 5.890 1.00 0.00 O ATOM 1779 OD2 ASP A 113 -1.317 3.194 4.880 1.00 0.00 O ATOM 0 H ASP A 113 -3.147 2.577 3.359 1.00 0.00 H new ATOM 0 HA ASP A 113 -2.076 0.349 1.900 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -0.419 0.367 3.804 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -0.539 1.873 2.914 1.00 0.00 H new ATOM 1784 N ALA A 114 -3.592 -0.161 4.793 1.00 0.00 N ATOM 1785 CA ALA A 114 -4.211 -1.195 5.612 1.00 0.00 C ATOM 1786 C ALA A 114 -5.120 -2.068 4.761 1.00 0.00 C ATOM 1787 O ALA A 114 -4.986 -3.289 4.750 1.00 0.00 O ATOM 1788 CB ALA A 114 -4.986 -0.572 6.762 1.00 0.00 C ATOM 0 H ALA A 114 -3.708 0.788 5.148 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.425 -1.823 6.032 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.441 -1.359 7.363 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.308 0.012 7.384 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.766 0.078 6.365 1.00 0.00 H new ATOM 1794 N TRP A 115 -6.032 -1.433 4.034 1.00 0.00 N ATOM 1795 CA TRP A 115 -6.949 -2.150 3.161 1.00 0.00 C ATOM 1796 C TRP A 115 -6.187 -2.998 2.155 1.00 0.00 C ATOM 1797 O TRP A 115 -6.389 -4.208 2.075 1.00 0.00 O ATOM 1798 CB TRP A 115 -7.846 -1.161 2.434 1.00 0.00 C ATOM 1799 CG TRP A 115 -9.051 -0.802 3.230 1.00 0.00 C ATOM 1800 CD1 TRP A 115 -9.225 0.302 4.003 1.00 0.00 C ATOM 1801 CD2 TRP A 115 -10.242 -1.572 3.355 1.00 0.00 C ATOM 1802 NE1 TRP A 115 -10.465 0.285 4.578 1.00 0.00 N ATOM 1803 CE2 TRP A 115 -11.111 -0.859 4.196 1.00 0.00 C ATOM 1804 CE3 TRP A 115 -10.665 -2.789 2.826 1.00 0.00 C ATOM 1805 CZ2 TRP A 115 -12.375 -1.328 4.518 1.00 0.00 C ATOM 1806 CZ3 TRP A 115 -11.920 -3.248 3.159 1.00 0.00 C ATOM 1807 CH2 TRP A 115 -12.758 -2.524 3.989 1.00 0.00 C ATOM 0 H TRP A 115 -6.155 -0.420 4.033 1.00 0.00 H new ATOM 0 HA TRP A 115 -7.562 -2.813 3.772 1.00 0.00 H new ATOM 0 HB2 TRP A 115 -7.279 -0.257 2.209 1.00 0.00 H new ATOM 0 HB3 TRP A 115 -8.157 -1.588 1.481 1.00 0.00 H new ATOM 0 HD1 TRP A 115 -8.490 1.081 4.143 1.00 0.00 H new ATOM 0 HE1 TRP A 115 -10.846 1.006 5.191 1.00 0.00 H new ATOM 0 HE3 TRP A 115 -10.024 -3.359 2.170 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 -13.032 -0.766 5.165 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 -12.258 -4.194 2.763 1.00 0.00 H new ATOM 0 HH2 TRP A 115 -13.737 -2.916 4.223 1.00 0.00 H new ATOM 1818 N VAL A 116 -5.295 -2.365 1.395 1.00 0.00 N ATOM 1819 CA VAL A 116 -4.504 -3.086 0.410 1.00 0.00 C ATOM 1820 C VAL A 116 -3.784 -4.255 1.072 1.00 0.00 C ATOM 1821 O VAL A 116 -3.623 -5.322 0.477 1.00 0.00 O ATOM 1822 CB VAL A 116 -3.482 -2.160 -0.284 1.00 0.00 C ATOM 1823 CG1 VAL A 116 -2.565 -2.952 -1.205 1.00 0.00 C ATOM 1824 CG2 VAL A 116 -4.200 -1.063 -1.054 1.00 0.00 C ATOM 0 H VAL A 116 -5.106 -1.364 1.444 1.00 0.00 H new ATOM 0 HA VAL A 116 -5.184 -3.465 -0.353 1.00 0.00 H new ATOM 0 HB VAL A 116 -2.864 -1.697 0.485 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -1.855 -2.276 -1.681 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -2.022 -3.698 -0.624 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -3.160 -3.450 -1.970 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -3.466 -0.418 -1.538 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -4.844 -1.511 -1.811 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -4.805 -0.472 -0.366 1.00 0.00 H new ATOM 1834 N GLN A 117 -3.374 -4.053 2.323 1.00 0.00 N ATOM 1835 CA GLN A 117 -2.695 -5.096 3.074 1.00 0.00 C ATOM 1836 C GLN A 117 -3.706 -6.101 3.614 1.00 0.00 C ATOM 1837 O GLN A 117 -3.388 -7.272 3.809 1.00 0.00 O ATOM 1838 CB GLN A 117 -1.887 -4.490 4.223 1.00 0.00 C ATOM 1839 CG GLN A 117 -0.436 -4.214 3.865 1.00 0.00 C ATOM 1840 CD GLN A 117 0.167 -3.100 4.696 1.00 0.00 C ATOM 1841 OE1 GLN A 117 -0.435 -2.039 4.866 1.00 0.00 O ATOM 1842 NE2 GLN A 117 1.365 -3.335 5.220 1.00 0.00 N ATOM 0 H GLN A 117 -3.502 -3.179 2.832 1.00 0.00 H new ATOM 0 HA GLN A 117 -2.009 -5.614 2.403 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -2.359 -3.559 4.537 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -1.920 -5.167 5.076 1.00 0.00 H new ATOM 0 HG2 GLN A 117 0.148 -5.124 4.005 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -0.370 -3.951 2.809 1.00 0.00 H new ATOM 0 HE21 GLN A 117 1.828 -4.228 5.054 1.00 0.00 H new ATOM 0 HE22 GLN A 117 1.822 -2.622 5.789 1.00 0.00 H new ATOM 1851 N ALA A 118 -4.931 -5.633 3.843 1.00 0.00 N ATOM 1852 CA ALA A 118 -5.993 -6.487 4.348 1.00 0.00 C ATOM 1853 C ALA A 118 -6.452 -7.457 3.271 1.00 0.00 C ATOM 1854 O ALA A 118 -6.664 -8.641 3.531 1.00 0.00 O ATOM 1855 CB ALA A 118 -7.161 -5.644 4.837 1.00 0.00 C ATOM 0 H ALA A 118 -5.209 -4.664 3.685 1.00 0.00 H new ATOM 0 HA ALA A 118 -5.605 -7.063 5.188 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -7.949 -6.297 5.212 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -6.824 -4.985 5.637 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -7.548 -5.045 4.012 1.00 0.00 H new ATOM 1861 N ILE A 119 -6.594 -6.944 2.055 1.00 0.00 N ATOM 1862 CA ILE A 119 -7.016 -7.761 0.931 1.00 0.00 C ATOM 1863 C ILE A 119 -5.940 -8.788 0.591 1.00 0.00 C ATOM 1864 O ILE A 119 -6.229 -9.978 0.462 1.00 0.00 O ATOM 1865 CB ILE A 119 -7.340 -6.893 -0.309 1.00 0.00 C ATOM 1866 CG1 ILE A 119 -8.687 -6.189 -0.123 1.00 0.00 C ATOM 1867 CG2 ILE A 119 -7.357 -7.736 -1.580 1.00 0.00 C ATOM 1868 CD1 ILE A 119 -8.607 -4.926 0.705 1.00 0.00 C ATOM 0 H ILE A 119 -6.422 -5.965 1.825 1.00 0.00 H new ATOM 0 HA ILE A 119 -7.928 -8.283 1.221 1.00 0.00 H new ATOM 0 HB ILE A 119 -6.557 -6.142 -0.412 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -9.097 -5.944 -1.103 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -9.385 -6.879 0.351 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -7.587 -7.100 -2.435 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -6.380 -8.198 -1.724 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -8.116 -8.513 -1.491 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -9.600 -4.485 0.792 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -8.228 -5.166 1.698 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -7.936 -4.216 0.222 1.00 0.00 H new ATOM 1880 N GLU A 120 -4.695 -8.332 0.464 1.00 0.00 N ATOM 1881 CA GLU A 120 -3.594 -9.237 0.159 1.00 0.00 C ATOM 1882 C GLU A 120 -3.366 -10.197 1.320 1.00 0.00 C ATOM 1883 O GLU A 120 -2.985 -11.351 1.121 1.00 0.00 O ATOM 1884 CB GLU A 120 -2.315 -8.451 -0.136 1.00 0.00 C ATOM 1885 CG GLU A 120 -1.780 -7.691 1.065 1.00 0.00 C ATOM 1886 CD GLU A 120 -0.645 -6.753 0.702 1.00 0.00 C ATOM 1887 OE1 GLU A 120 0.516 -7.211 0.669 1.00 0.00 O ATOM 1888 OE2 GLU A 120 -0.917 -5.560 0.451 1.00 0.00 O ATOM 0 H GLU A 120 -4.428 -7.353 0.566 1.00 0.00 H new ATOM 0 HA GLU A 120 -3.857 -9.812 -0.729 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -1.548 -9.140 -0.491 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -2.509 -7.746 -0.945 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -2.589 -7.118 1.518 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -1.434 -8.402 1.815 1.00 0.00 H new ATOM 1895 N SER A 121 -3.617 -9.715 2.534 1.00 0.00 N ATOM 1896 CA SER A 121 -3.451 -10.536 3.728 1.00 0.00 C ATOM 1897 C SER A 121 -4.430 -11.699 3.709 1.00 0.00 C ATOM 1898 O SER A 121 -4.077 -12.828 4.051 1.00 0.00 O ATOM 1899 CB SER A 121 -3.661 -9.696 4.990 1.00 0.00 C ATOM 1900 OG SER A 121 -3.867 -10.521 6.124 1.00 0.00 O ATOM 0 H SER A 121 -3.935 -8.763 2.716 1.00 0.00 H new ATOM 0 HA SER A 121 -2.435 -10.930 3.735 1.00 0.00 H new ATOM 0 HB2 SER A 121 -2.793 -9.057 5.154 1.00 0.00 H new ATOM 0 HB3 SER A 121 -4.520 -9.038 4.854 1.00 0.00 H new ATOM 0 HG SER A 121 -3.997 -9.960 6.917 1.00 0.00 H new ATOM 1906 N GLN A 122 -5.660 -11.417 3.296 1.00 0.00 N ATOM 1907 CA GLN A 122 -6.692 -12.443 3.221 1.00 0.00 C ATOM 1908 C GLN A 122 -6.360 -13.451 2.128 1.00 0.00 C ATOM 1909 O GLN A 122 -6.652 -14.641 2.256 1.00 0.00 O ATOM 1910 CB GLN A 122 -8.055 -11.805 2.952 1.00 0.00 C ATOM 1911 CG GLN A 122 -8.634 -11.076 4.154 1.00 0.00 C ATOM 1912 CD GLN A 122 -8.675 -11.941 5.399 1.00 0.00 C ATOM 1913 OE1 GLN A 122 -9.504 -12.843 5.514 1.00 0.00 O ATOM 1914 NE2 GLN A 122 -7.776 -11.670 6.339 1.00 0.00 N ATOM 0 H GLN A 122 -5.966 -10.488 3.008 1.00 0.00 H new ATOM 0 HA GLN A 122 -6.731 -12.965 4.177 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -7.961 -11.104 2.123 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -8.754 -12.580 2.637 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -8.039 -10.185 4.355 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -9.643 -10.738 3.918 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -7.107 -10.912 6.202 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -7.755 -12.220 7.198 1.00 0.00 H new ATOM 1923 N ILE A 123 -5.744 -12.967 1.053 1.00 0.00 N ATOM 1924 CA ILE A 123 -5.367 -13.826 -0.061 1.00 0.00 C ATOM 1925 C ILE A 123 -4.220 -14.752 0.328 1.00 0.00 C ATOM 1926 O ILE A 123 -4.180 -15.913 -0.079 1.00 0.00 O ATOM 1927 CB ILE A 123 -4.959 -13.000 -1.298 1.00 0.00 C ATOM 1928 CG1 ILE A 123 -6.059 -12.001 -1.659 1.00 0.00 C ATOM 1929 CG2 ILE A 123 -4.669 -13.913 -2.478 1.00 0.00 C ATOM 1930 CD1 ILE A 123 -5.543 -10.738 -2.313 1.00 0.00 C ATOM 0 H ILE A 123 -5.496 -11.985 0.932 1.00 0.00 H new ATOM 0 HA ILE A 123 -6.243 -14.424 -0.313 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.051 -12.447 -1.057 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -6.769 -12.483 -2.331 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -6.606 -11.734 -0.755 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -4.383 -13.312 -3.341 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -3.855 -14.591 -2.222 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -5.561 -14.492 -2.718 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.380 -10.078 -2.540 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -4.855 -10.232 -1.635 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.021 -10.993 -3.235 1.00 0.00 H new ATOM 1942 N LEU A 124 -3.290 -14.232 1.118 1.00 0.00 N ATOM 1943 CA LEU A 124 -2.145 -15.016 1.566 1.00 0.00 C ATOM 1944 C LEU A 124 -2.582 -16.111 2.532 1.00 0.00 C ATOM 1945 O LEU A 124 -2.074 -17.233 2.487 1.00 0.00 O ATOM 1946 CB LEU A 124 -1.108 -14.112 2.235 1.00 0.00 C ATOM 1947 CG LEU A 124 0.339 -14.595 2.127 1.00 0.00 C ATOM 1948 CD1 LEU A 124 0.801 -14.574 0.678 1.00 0.00 C ATOM 1949 CD2 LEU A 124 1.251 -13.740 2.993 1.00 0.00 C ATOM 0 H LEU A 124 -3.305 -13.272 1.462 1.00 0.00 H new ATOM 0 HA LEU A 124 -1.694 -15.485 0.692 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -1.177 -13.118 1.794 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -1.363 -14.011 3.290 1.00 0.00 H new ATOM 0 HG LEU A 124 0.388 -15.623 2.487 1.00 0.00 H new ATOM 0 HD11 LEU A 124 1.833 -14.921 0.620 1.00 0.00 H new ATOM 0 HD12 LEU A 124 0.164 -15.229 0.084 1.00 0.00 H new ATOM 0 HD13 LEU A 124 0.738 -13.557 0.291 1.00 0.00 H new ATOM 0 HD21 LEU A 124 2.277 -14.097 2.904 1.00 0.00 H new ATOM 0 HD22 LEU A 124 1.198 -12.702 2.663 1.00 0.00 H new ATOM 0 HD23 LEU A 124 0.932 -13.806 4.033 1.00 0.00 H new ATOM 1961 N ALA A 125 -3.528 -15.780 3.403 1.00 0.00 N ATOM 1962 CA ALA A 125 -4.037 -16.735 4.380 1.00 0.00 C ATOM 1963 C ALA A 125 -4.988 -17.732 3.727 1.00 0.00 C ATOM 1964 O ALA A 125 -5.110 -18.873 4.174 1.00 0.00 O ATOM 1965 CB ALA A 125 -4.733 -16.006 5.518 1.00 0.00 C ATOM 0 H ALA A 125 -3.958 -14.857 3.453 1.00 0.00 H new ATOM 0 HA ALA A 125 -3.191 -17.290 4.784 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -5.108 -16.732 6.240 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -4.025 -15.338 6.009 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -5.566 -15.425 5.122 1.00 0.00 H new ATOM 1971 N SER A 126 -5.662 -17.295 2.669 1.00 0.00 N ATOM 1972 CA SER A 126 -6.604 -18.148 1.955 1.00 0.00 C ATOM 1973 C SER A 126 -5.885 -19.022 0.932 1.00 0.00 C ATOM 1974 O SER A 126 -6.332 -20.128 0.624 1.00 0.00 O ATOM 1975 CB SER A 126 -7.667 -17.298 1.258 1.00 0.00 C ATOM 1976 OG SER A 126 -8.743 -17.008 2.133 1.00 0.00 O ATOM 0 H SER A 126 -5.573 -16.354 2.287 1.00 0.00 H new ATOM 0 HA SER A 126 -7.088 -18.798 2.684 1.00 0.00 H new ATOM 0 HB2 SER A 126 -7.220 -16.368 0.906 1.00 0.00 H new ATOM 0 HB3 SER A 126 -8.040 -17.825 0.380 1.00 0.00 H new ATOM 0 HG SER A 126 -9.408 -16.462 1.664 1.00 0.00 H new ATOM 1982 N LEU A 127 -4.771 -18.521 0.408 1.00 0.00 N ATOM 1983 CA LEU A 127 -3.994 -19.260 -0.581 1.00 0.00 C ATOM 1984 C LEU A 127 -3.529 -20.600 -0.020 1.00 0.00 C ATOM 1985 O LEU A 127 -3.583 -21.624 -0.701 1.00 0.00 O ATOM 1986 CB LEU A 127 -2.788 -18.434 -1.036 1.00 0.00 C ATOM 1987 CG LEU A 127 -2.843 -17.950 -2.484 1.00 0.00 C ATOM 1988 CD1 LEU A 127 -1.571 -17.199 -2.846 1.00 0.00 C ATOM 1989 CD2 LEU A 127 -3.057 -19.124 -3.429 1.00 0.00 C ATOM 0 H LEU A 127 -4.387 -17.608 0.651 1.00 0.00 H new ATOM 0 HA LEU A 127 -4.637 -19.452 -1.440 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -2.694 -17.567 -0.383 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -1.887 -19.032 -0.903 1.00 0.00 H new ATOM 0 HG LEU A 127 -3.685 -17.266 -2.586 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -1.629 -16.862 -3.881 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -1.459 -16.336 -2.190 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -0.712 -17.860 -2.727 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -3.094 -18.762 -4.456 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -2.234 -19.831 -3.323 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -3.996 -19.621 -3.185 1.00 0.00 H new ATOM 2001 N GLN A 128 -3.076 -20.582 1.227 1.00 0.00 N ATOM 2002 CA GLN A 128 -2.601 -21.790 1.886 1.00 0.00 C ATOM 2003 C GLN A 128 -3.563 -22.225 2.986 1.00 0.00 C ATOM 2004 O GLN A 128 -3.760 -23.447 3.151 1.00 0.00 O ATOM 2005 CB GLN A 128 -1.207 -21.563 2.473 1.00 0.00 C ATOM 2006 CG GLN A 128 -1.141 -20.403 3.451 1.00 0.00 C ATOM 2007 CD GLN A 128 -0.020 -20.554 4.461 1.00 0.00 C ATOM 2008 OE1 GLN A 128 1.060 -21.046 4.137 1.00 0.00 O ATOM 2009 NE2 GLN A 128 -0.274 -20.131 5.695 1.00 0.00 N ATOM 2010 OXT GLN A 128 -4.113 -21.339 3.674 1.00 0.00 O ATOM 0 H GLN A 128 -3.028 -19.742 1.803 1.00 0.00 H new ATOM 0 HA GLN A 128 -2.549 -22.583 1.140 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -0.882 -22.472 2.978 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -0.504 -21.382 1.660 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -1.004 -19.474 2.898 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -2.092 -20.323 3.978 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -1.184 -19.729 5.919 1.00 0.00 H new ATOM 0 HE22 GLN A 128 0.441 -20.208 6.418 1.00 0.00 H new TER 2019 GLN A 128