USER MOD reduce.3.24.130724 H: found=0, std=0, add=880, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 878 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 Single : A 1 GLY N :NH3+ -120:sc= 0.0797 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0403 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc=-0.00543 X(o=-0.0054,f=-0.25) USER MOD Single : A 13 HIS : no HE2:sc= -0.835 X(o=-0.83,f=-1.3) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 MET CE :methyl 155:sc= -2.17 (180deg=-4.22) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 34 LYS NZ :NH3+ -120:sc= -2.81 (180deg=-5.14!) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.0165 X(o=-0.016,f=-0.27) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 MET CE :methyl 143:sc= -0.0036 (180deg=-0.556) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -128:sc= 1.13 USER MOD Single : A 57 CYS SG : rot 58:sc= 1.13 USER MOD Single : A 62 ASN : amide:sc= -0.971 X(o=-0.97,f=-0.66) USER MOD Single : A 66 GLN : amide:sc=-0.00315 X(o=-0.0032,f=0) USER MOD Single : A 71 ASN : amide:sc= -2.41! C(o=-2.4!,f=-6.4!) USER MOD Single : A 78 HIS : no HD1:sc= -0.167 X(o=-0.17,f=-0.03) USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.0662 USER MOD Single : A 80 HIS :FLIP no HD1:sc= -1.3 F(o=-2.8!,f=-1.3) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 110:sc=-0.00733 USER MOD Single : A 91 CYS SG : rot 180:sc= 0 USER MOD Single : A 94 HIS : no HD1:sc= -2.02 X(o=-2,f=-2.3) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl -173:sc= -0.203 (180deg=-0.301) USER MOD Single : A 105 ASN : amide:sc= -0.78 X(o=-0.78,f=-0.79) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.937 5.337 -30.605 1.00 0.00 N ATOM 2 CA GLY A 1 14.883 4.629 -31.447 1.00 0.00 C ATOM 3 C GLY A 1 16.295 4.675 -30.898 1.00 0.00 C ATOM 4 O GLY A 1 16.556 5.330 -29.889 1.00 0.00 O ATOM 0 H1 GLY A 1 13.203 4.678 -30.277 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.435 5.737 -29.784 1.00 0.00 H new ATOM 0 H3 GLY A 1 13.495 6.105 -31.149 1.00 0.00 H new ATOM 0 HA2 GLY A 1 14.569 3.590 -31.547 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.871 5.063 -32.447 1.00 0.00 H new ATOM 8 N SER A 2 17.210 3.975 -31.562 1.00 0.00 N ATOM 9 CA SER A 2 18.602 3.934 -31.132 1.00 0.00 C ATOM 10 C SER A 2 19.519 3.562 -32.293 1.00 0.00 C ATOM 11 O SER A 2 19.102 2.892 -33.238 1.00 0.00 O ATOM 12 CB SER A 2 18.776 2.932 -29.989 1.00 0.00 C ATOM 13 OG SER A 2 19.875 3.283 -29.166 1.00 0.00 O ATOM 0 H SER A 2 17.011 3.429 -32.400 1.00 0.00 H new ATOM 0 HA SER A 2 18.876 4.928 -30.779 1.00 0.00 H new ATOM 0 HB2 SER A 2 17.866 2.897 -29.390 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.928 1.933 -30.397 1.00 0.00 H new ATOM 0 HG SER A 2 19.964 2.628 -28.442 1.00 0.00 H new ATOM 19 N SER A 3 20.771 4.002 -32.215 1.00 0.00 N ATOM 20 CA SER A 3 21.748 3.719 -33.260 1.00 0.00 C ATOM 21 C SER A 3 21.950 2.215 -33.423 1.00 0.00 C ATOM 22 O SER A 3 21.649 1.436 -32.519 1.00 0.00 O ATOM 23 CB SER A 3 23.083 4.392 -32.936 1.00 0.00 C ATOM 24 OG SER A 3 24.041 4.138 -33.949 1.00 0.00 O ATOM 0 H SER A 3 21.133 4.556 -31.439 1.00 0.00 H new ATOM 0 HA SER A 3 21.365 4.120 -34.198 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.936 5.467 -32.831 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.455 4.027 -31.979 1.00 0.00 H new ATOM 0 HG SER A 3 24.885 4.580 -33.719 1.00 0.00 H new ATOM 30 N GLY A 4 22.461 1.815 -34.583 1.00 0.00 N ATOM 31 CA GLY A 4 22.695 0.407 -34.844 1.00 0.00 C ATOM 32 C GLY A 4 21.439 -0.317 -35.287 1.00 0.00 C ATOM 33 O GLY A 4 20.451 0.314 -35.661 1.00 0.00 O ATOM 0 H GLY A 4 22.717 2.441 -35.347 1.00 0.00 H new ATOM 0 HA2 GLY A 4 23.460 0.306 -35.614 1.00 0.00 H new ATOM 0 HA3 GLY A 4 23.085 -0.066 -33.943 1.00 0.00 H new ATOM 37 N SER A 5 21.478 -1.645 -35.246 1.00 0.00 N ATOM 38 CA SER A 5 20.336 -2.456 -35.652 1.00 0.00 C ATOM 39 C SER A 5 19.320 -2.568 -34.519 1.00 0.00 C ATOM 40 O SER A 5 19.365 -3.504 -33.720 1.00 0.00 O ATOM 41 CB SER A 5 20.799 -3.850 -36.077 1.00 0.00 C ATOM 42 OG SER A 5 21.793 -3.773 -37.084 1.00 0.00 O ATOM 0 H SER A 5 22.288 -2.182 -34.936 1.00 0.00 H new ATOM 0 HA SER A 5 19.857 -1.967 -36.500 1.00 0.00 H new ATOM 0 HB2 SER A 5 21.193 -4.385 -35.213 1.00 0.00 H new ATOM 0 HB3 SER A 5 19.948 -4.423 -36.445 1.00 0.00 H new ATOM 0 HG SER A 5 22.073 -4.677 -37.337 1.00 0.00 H new ATOM 48 N SER A 6 18.404 -1.607 -34.457 1.00 0.00 N ATOM 49 CA SER A 6 17.378 -1.595 -33.421 1.00 0.00 C ATOM 50 C SER A 6 16.137 -0.844 -33.894 1.00 0.00 C ATOM 51 O SER A 6 16.233 0.135 -34.632 1.00 0.00 O ATOM 52 CB SER A 6 17.921 -0.951 -32.143 1.00 0.00 C ATOM 53 OG SER A 6 16.878 -0.688 -31.221 1.00 0.00 O ATOM 0 H SER A 6 18.351 -0.827 -35.112 1.00 0.00 H new ATOM 0 HA SER A 6 17.099 -2.627 -33.209 1.00 0.00 H new ATOM 0 HB2 SER A 6 18.658 -1.611 -31.685 1.00 0.00 H new ATOM 0 HB3 SER A 6 18.435 -0.022 -32.390 1.00 0.00 H new ATOM 0 HG SER A 6 17.251 -0.278 -30.413 1.00 0.00 H new ATOM 59 N GLY A 7 14.969 -1.312 -33.462 1.00 0.00 N ATOM 60 CA GLY A 7 13.725 -0.674 -33.850 1.00 0.00 C ATOM 61 C GLY A 7 12.823 -0.391 -32.665 1.00 0.00 C ATOM 62 O GLY A 7 13.298 -0.210 -31.545 1.00 0.00 O ATOM 0 H GLY A 7 14.863 -2.121 -32.850 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.945 0.260 -34.366 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.198 -1.313 -34.559 1.00 0.00 H new ATOM 66 N ASN A 8 11.518 -0.352 -32.913 1.00 0.00 N ATOM 67 CA ASN A 8 10.548 -0.087 -31.857 1.00 0.00 C ATOM 68 C ASN A 8 9.901 -1.381 -31.374 1.00 0.00 C ATOM 69 O ASN A 8 8.934 -1.862 -31.964 1.00 0.00 O ATOM 70 CB ASN A 8 9.471 0.879 -32.356 1.00 0.00 C ATOM 71 CG ASN A 8 9.880 2.331 -32.200 1.00 0.00 C ATOM 72 OD1 ASN A 8 10.293 2.759 -31.122 1.00 0.00 O ATOM 73 ND2 ASN A 8 9.765 3.098 -33.278 1.00 0.00 N ATOM 0 H ASN A 8 11.108 -0.500 -33.835 1.00 0.00 H new ATOM 0 HA ASN A 8 11.076 0.368 -31.019 1.00 0.00 H new ATOM 0 HB2 ASN A 8 9.261 0.674 -33.406 1.00 0.00 H new ATOM 0 HB3 ASN A 8 8.546 0.704 -31.806 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.024 4.084 -33.233 1.00 0.00 H new ATOM 0 HD22 ASN A 8 9.418 2.701 -34.151 1.00 0.00 H new ATOM 80 N GLY A 9 10.442 -1.941 -30.296 1.00 0.00 N ATOM 81 CA GLY A 9 9.905 -3.175 -29.752 1.00 0.00 C ATOM 82 C GLY A 9 9.946 -3.206 -28.237 1.00 0.00 C ATOM 83 O GLY A 9 11.007 -3.385 -27.642 1.00 0.00 O ATOM 0 H GLY A 9 11.242 -1.562 -29.790 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.875 -3.299 -30.087 1.00 0.00 H new ATOM 0 HA3 GLY A 9 10.472 -4.019 -30.145 1.00 0.00 H new ATOM 87 N GLY A 10 8.786 -3.031 -27.612 1.00 0.00 N ATOM 88 CA GLY A 10 8.716 -3.042 -26.162 1.00 0.00 C ATOM 89 C GLY A 10 7.413 -3.621 -25.649 1.00 0.00 C ATOM 90 O GLY A 10 6.584 -2.901 -25.090 1.00 0.00 O ATOM 0 H GLY A 10 7.894 -2.882 -28.083 1.00 0.00 H new ATOM 0 HA2 GLY A 10 9.549 -3.623 -25.766 1.00 0.00 H new ATOM 0 HA3 GLY A 10 8.830 -2.025 -25.788 1.00 0.00 H new ATOM 94 N ILE A 11 7.230 -4.923 -25.839 1.00 0.00 N ATOM 95 CA ILE A 11 6.018 -5.597 -25.392 1.00 0.00 C ATOM 96 C ILE A 11 5.630 -5.154 -23.985 1.00 0.00 C ATOM 97 O ILE A 11 6.478 -4.839 -23.151 1.00 0.00 O ATOM 98 CB ILE A 11 6.186 -7.128 -25.408 1.00 0.00 C ATOM 99 CG1 ILE A 11 7.273 -7.554 -24.418 1.00 0.00 C ATOM 100 CG2 ILE A 11 6.523 -7.609 -26.811 1.00 0.00 C ATOM 101 CD1 ILE A 11 8.676 -7.248 -24.893 1.00 0.00 C ATOM 0 H ILE A 11 7.906 -5.532 -26.300 1.00 0.00 H new ATOM 0 HA ILE A 11 5.227 -5.319 -26.089 1.00 0.00 H new ATOM 0 HB ILE A 11 5.244 -7.585 -25.104 1.00 0.00 H new ATOM 0 HG12 ILE A 11 7.103 -7.052 -23.466 1.00 0.00 H new ATOM 0 HG13 ILE A 11 7.186 -8.625 -24.234 1.00 0.00 H new ATOM 0 HG21 ILE A 11 6.639 -8.693 -26.806 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.719 -7.333 -27.493 1.00 0.00 H new ATOM 0 HG23 ILE A 11 7.453 -7.146 -27.141 1.00 0.00 H new ATOM 0 HD11 ILE A 11 9.394 -7.577 -24.142 1.00 0.00 H new ATOM 0 HD12 ILE A 11 8.865 -7.772 -25.830 1.00 0.00 H new ATOM 0 HD13 ILE A 11 8.781 -6.174 -25.050 1.00 0.00 H new ATOM 113 N PRO A 12 4.316 -5.131 -23.713 1.00 0.00 N ATOM 114 CA PRO A 12 3.785 -4.731 -22.407 1.00 0.00 C ATOM 115 C PRO A 12 4.093 -5.754 -21.318 1.00 0.00 C ATOM 116 O PRO A 12 4.694 -6.796 -21.583 1.00 0.00 O ATOM 117 CB PRO A 12 2.276 -4.645 -22.649 1.00 0.00 C ATOM 118 CG PRO A 12 2.023 -5.565 -23.792 1.00 0.00 C ATOM 119 CD PRO A 12 3.249 -5.495 -24.660 1.00 0.00 C ATOM 0 HA PRO A 12 4.228 -3.799 -22.055 1.00 0.00 H new ATOM 0 HB2 PRO A 12 1.715 -4.949 -21.765 1.00 0.00 H new ATOM 0 HB3 PRO A 12 1.970 -3.626 -22.886 1.00 0.00 H new ATOM 0 HG2 PRO A 12 1.850 -6.583 -23.443 1.00 0.00 H new ATOM 0 HG3 PRO A 12 1.135 -5.263 -24.347 1.00 0.00 H new ATOM 0 HD2 PRO A 12 3.452 -6.449 -25.147 1.00 0.00 H new ATOM 0 HD3 PRO A 12 3.141 -4.751 -25.449 1.00 0.00 H new ATOM 127 N HIS A 13 3.676 -5.451 -20.093 1.00 0.00 N ATOM 128 CA HIS A 13 3.907 -6.345 -18.964 1.00 0.00 C ATOM 129 C HIS A 13 2.801 -7.391 -18.865 1.00 0.00 C ATOM 130 O HIS A 13 1.745 -7.140 -18.285 1.00 0.00 O ATOM 131 CB HIS A 13 3.987 -5.547 -17.662 1.00 0.00 C ATOM 132 CG HIS A 13 2.962 -4.460 -17.562 1.00 0.00 C ATOM 133 ND1 HIS A 13 1.708 -4.655 -17.022 1.00 0.00 N ATOM 134 CD2 HIS A 13 3.011 -3.159 -17.934 1.00 0.00 C ATOM 135 CE1 HIS A 13 1.030 -3.522 -17.069 1.00 0.00 C ATOM 136 NE2 HIS A 13 1.799 -2.599 -17.618 1.00 0.00 N ATOM 0 H HIS A 13 3.177 -4.594 -19.857 1.00 0.00 H new ATOM 0 HA HIS A 13 4.855 -6.857 -19.126 1.00 0.00 H new ATOM 0 HB2 HIS A 13 3.865 -6.228 -16.820 1.00 0.00 H new ATOM 0 HB3 HIS A 13 4.981 -5.107 -17.575 1.00 0.00 H new ATOM 0 HD1 HIS A 13 1.359 -5.536 -16.645 1.00 0.00 H new ATOM 0 HD2 HIS A 13 3.849 -2.656 -18.394 1.00 0.00 H new ATOM 0 HE1 HIS A 13 0.019 -3.375 -16.718 1.00 0.00 H new ATOM 145 N ASP A 14 3.050 -8.564 -19.437 1.00 0.00 N ATOM 146 CA ASP A 14 2.076 -9.649 -19.414 1.00 0.00 C ATOM 147 C ASP A 14 2.327 -10.580 -18.231 1.00 0.00 C ATOM 148 O ASP A 14 1.389 -11.050 -17.589 1.00 0.00 O ATOM 149 CB ASP A 14 2.129 -10.440 -20.722 1.00 0.00 C ATOM 150 CG ASP A 14 3.282 -11.425 -20.756 1.00 0.00 C ATOM 151 OD1 ASP A 14 4.405 -11.012 -21.113 1.00 0.00 O ATOM 152 OD2 ASP A 14 3.060 -12.608 -20.424 1.00 0.00 O ATOM 0 H ASP A 14 3.919 -8.788 -19.923 1.00 0.00 H new ATOM 0 HA ASP A 14 1.084 -9.211 -19.304 1.00 0.00 H new ATOM 0 HB2 ASP A 14 1.191 -10.978 -20.856 1.00 0.00 H new ATOM 0 HB3 ASP A 14 2.222 -9.748 -21.559 1.00 0.00 H new ATOM 157 N ASN A 15 3.599 -10.841 -17.951 1.00 0.00 N ATOM 158 CA ASN A 15 3.974 -11.717 -16.846 1.00 0.00 C ATOM 159 C ASN A 15 3.558 -11.114 -15.508 1.00 0.00 C ATOM 160 O ASN A 15 2.966 -11.791 -14.667 1.00 0.00 O ATOM 161 CB ASN A 15 5.483 -11.969 -16.857 1.00 0.00 C ATOM 162 CG ASN A 15 5.929 -12.756 -18.075 1.00 0.00 C ATOM 163 OD1 ASN A 15 6.609 -12.227 -18.954 1.00 0.00 O ATOM 164 ND2 ASN A 15 5.546 -14.026 -18.131 1.00 0.00 N ATOM 0 H ASN A 15 4.388 -10.459 -18.473 1.00 0.00 H new ATOM 0 HA ASN A 15 3.453 -12.666 -16.975 1.00 0.00 H new ATOM 0 HB2 ASN A 15 6.008 -11.014 -16.832 1.00 0.00 H new ATOM 0 HB3 ASN A 15 5.765 -12.511 -15.954 1.00 0.00 H new ATOM 0 HD21 ASN A 15 5.815 -14.605 -18.926 1.00 0.00 H new ATOM 0 HD22 ASN A 15 4.983 -14.422 -17.379 1.00 0.00 H new ATOM 171 N LEU A 16 3.871 -9.837 -15.318 1.00 0.00 N ATOM 172 CA LEU A 16 3.529 -9.141 -14.083 1.00 0.00 C ATOM 173 C LEU A 16 2.024 -8.915 -13.983 1.00 0.00 C ATOM 174 O LEU A 16 1.364 -8.612 -14.978 1.00 0.00 O ATOM 175 CB LEU A 16 4.263 -7.801 -14.009 1.00 0.00 C ATOM 176 CG LEU A 16 5.680 -7.843 -13.436 1.00 0.00 C ATOM 177 CD1 LEU A 16 5.649 -7.694 -11.923 1.00 0.00 C ATOM 178 CD2 LEU A 16 6.377 -9.136 -13.833 1.00 0.00 C ATOM 0 H LEU A 16 4.361 -9.263 -16.004 1.00 0.00 H new ATOM 0 HA LEU A 16 3.840 -9.766 -13.246 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.311 -7.380 -15.013 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.668 -7.116 -13.404 1.00 0.00 H new ATOM 0 HG LEU A 16 6.244 -7.007 -13.850 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.666 -7.726 -11.533 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.190 -6.741 -11.661 1.00 0.00 H new ATOM 0 HD13 LEU A 16 5.068 -8.508 -11.489 1.00 0.00 H new ATOM 0 HD21 LEU A 16 7.384 -9.149 -13.417 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.814 -9.986 -13.447 1.00 0.00 H new ATOM 0 HD23 LEU A 16 6.433 -9.201 -14.920 1.00 0.00 H new ATOM 190 N VAL A 17 1.486 -9.062 -12.776 1.00 0.00 N ATOM 191 CA VAL A 17 0.059 -8.871 -12.546 1.00 0.00 C ATOM 192 C VAL A 17 -0.256 -7.413 -12.233 1.00 0.00 C ATOM 193 O VAL A 17 0.538 -6.717 -11.599 1.00 0.00 O ATOM 194 CB VAL A 17 -0.446 -9.755 -11.390 1.00 0.00 C ATOM 195 CG1 VAL A 17 -1.936 -9.546 -11.170 1.00 0.00 C ATOM 196 CG2 VAL A 17 -0.139 -11.219 -11.665 1.00 0.00 C ATOM 0 H VAL A 17 2.017 -9.313 -11.942 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.452 -9.161 -13.464 1.00 0.00 H new ATOM 0 HB VAL A 17 0.076 -9.464 -10.478 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.275 -10.179 -10.350 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.124 -8.501 -10.924 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.478 -9.808 -12.078 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.503 -11.829 -10.838 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.632 -11.527 -12.587 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.938 -11.352 -11.767 1.00 0.00 H new ATOM 206 N LEU A 18 -1.421 -6.956 -12.680 1.00 0.00 N ATOM 207 CA LEU A 18 -1.843 -5.580 -12.446 1.00 0.00 C ATOM 208 C LEU A 18 -3.171 -5.537 -11.697 1.00 0.00 C ATOM 209 O LEU A 18 -4.066 -6.342 -11.954 1.00 0.00 O ATOM 210 CB LEU A 18 -1.970 -4.832 -13.775 1.00 0.00 C ATOM 211 CG LEU A 18 -2.764 -3.526 -13.737 1.00 0.00 C ATOM 212 CD1 LEU A 18 -1.879 -2.376 -13.283 1.00 0.00 C ATOM 213 CD2 LEU A 18 -3.368 -3.230 -15.102 1.00 0.00 C ATOM 0 H LEU A 18 -2.090 -7.518 -13.206 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.085 -5.093 -11.832 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.968 -4.614 -14.143 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.438 -5.498 -14.500 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.576 -3.637 -13.019 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -2.461 -1.455 -13.262 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -1.495 -2.585 -12.285 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -1.046 -2.263 -13.976 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.930 -2.297 -15.057 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -2.571 -3.139 -15.840 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.036 -4.042 -15.388 1.00 0.00 H new ATOM 225 N ILE A 19 -3.291 -4.592 -10.771 1.00 0.00 N ATOM 226 CA ILE A 19 -4.511 -4.442 -9.987 1.00 0.00 C ATOM 227 C ILE A 19 -5.220 -3.133 -10.318 1.00 0.00 C ATOM 228 O ILE A 19 -4.578 -2.118 -10.586 1.00 0.00 O ATOM 229 CB ILE A 19 -4.217 -4.486 -8.475 1.00 0.00 C ATOM 230 CG1 ILE A 19 -3.368 -5.712 -8.134 1.00 0.00 C ATOM 231 CG2 ILE A 19 -5.517 -4.498 -7.684 1.00 0.00 C ATOM 232 CD1 ILE A 19 -4.099 -7.023 -8.314 1.00 0.00 C ATOM 0 H ILE A 19 -2.559 -3.919 -10.545 1.00 0.00 H new ATOM 0 HA ILE A 19 -5.159 -5.279 -10.248 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.656 -3.592 -8.202 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.477 -5.713 -8.762 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -3.029 -5.633 -7.101 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -5.294 -4.529 -6.618 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -6.088 -3.597 -7.909 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -6.102 -5.376 -7.958 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.436 -7.848 -8.054 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -4.975 -7.043 -7.665 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.414 -7.124 -9.353 1.00 0.00 H new ATOM 244 N ARG A 20 -6.549 -3.165 -10.295 1.00 0.00 N ATOM 245 CA ARG A 20 -7.346 -1.981 -10.592 1.00 0.00 C ATOM 246 C ARG A 20 -8.520 -1.860 -9.625 1.00 0.00 C ATOM 247 O ARG A 20 -9.333 -2.776 -9.503 1.00 0.00 O ATOM 248 CB ARG A 20 -7.860 -2.034 -12.032 1.00 0.00 C ATOM 249 CG ARG A 20 -6.754 -2.008 -13.074 1.00 0.00 C ATOM 250 CD ARG A 20 -7.201 -2.655 -14.376 1.00 0.00 C ATOM 251 NE ARG A 20 -7.138 -4.112 -14.312 1.00 0.00 N ATOM 252 CZ ARG A 20 -7.327 -4.903 -15.363 1.00 0.00 C ATOM 253 NH1 ARG A 20 -7.590 -4.379 -16.552 1.00 0.00 N ATOM 254 NH2 ARG A 20 -7.254 -6.220 -15.225 1.00 0.00 N ATOM 0 H ARG A 20 -7.096 -3.997 -10.074 1.00 0.00 H new ATOM 0 HA ARG A 20 -6.708 -1.105 -10.474 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -8.452 -2.940 -12.165 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -8.528 -1.189 -12.202 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -6.454 -0.977 -13.263 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -5.878 -2.529 -12.689 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -8.221 -2.346 -14.603 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -6.571 -2.300 -15.192 1.00 0.00 H new ATOM 0 HE ARG A 20 -6.938 -4.547 -13.411 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -7.648 -3.367 -16.662 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -7.735 -4.988 -17.357 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -7.053 -6.627 -14.312 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -7.399 -6.826 -16.032 1.00 0.00 H new ATOM 268 N MET A 21 -8.602 -0.724 -8.941 1.00 0.00 N ATOM 269 CA MET A 21 -9.677 -0.483 -7.985 1.00 0.00 C ATOM 270 C MET A 21 -9.830 1.009 -7.704 1.00 0.00 C ATOM 271 O MET A 21 -8.917 1.795 -7.953 1.00 0.00 O ATOM 272 CB MET A 21 -9.407 -1.235 -6.681 1.00 0.00 C ATOM 273 CG MET A 21 -8.101 -0.841 -6.011 1.00 0.00 C ATOM 274 SD MET A 21 -7.954 -1.494 -4.337 1.00 0.00 S ATOM 275 CE MET A 21 -6.719 -2.769 -4.579 1.00 0.00 C ATOM 0 H MET A 21 -7.937 0.044 -9.031 1.00 0.00 H new ATOM 0 HA MET A 21 -10.606 -0.850 -8.421 1.00 0.00 H new ATOM 0 HB2 MET A 21 -10.230 -1.053 -5.989 1.00 0.00 H new ATOM 0 HB3 MET A 21 -9.393 -2.306 -6.885 1.00 0.00 H new ATOM 0 HG2 MET A 21 -7.266 -1.201 -6.612 1.00 0.00 H new ATOM 0 HG3 MET A 21 -8.026 0.246 -5.981 1.00 0.00 H new ATOM 0 HE1 MET A 21 -6.200 -2.956 -3.639 1.00 0.00 H new ATOM 0 HE2 MET A 21 -7.204 -3.686 -4.915 1.00 0.00 H new ATOM 0 HE3 MET A 21 -6.001 -2.442 -5.331 1.00 0.00 H new ATOM 285 N LYS A 22 -10.991 1.391 -7.183 1.00 0.00 N ATOM 286 CA LYS A 22 -11.265 2.788 -6.866 1.00 0.00 C ATOM 287 C LYS A 22 -12.023 2.909 -5.548 1.00 0.00 C ATOM 288 O LYS A 22 -12.868 2.079 -5.212 1.00 0.00 O ATOM 289 CB LYS A 22 -12.071 3.439 -7.992 1.00 0.00 C ATOM 290 CG LYS A 22 -13.409 2.768 -8.248 1.00 0.00 C ATOM 291 CD LYS A 22 -13.272 1.599 -9.208 1.00 0.00 C ATOM 292 CE LYS A 22 -14.629 1.028 -9.590 1.00 0.00 C ATOM 293 NZ LYS A 22 -14.609 0.407 -10.943 1.00 0.00 N ATOM 0 H LYS A 22 -11.758 0.753 -6.971 1.00 0.00 H new ATOM 0 HA LYS A 22 -10.311 3.305 -6.764 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -12.241 4.487 -7.747 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -11.482 3.417 -8.909 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -13.828 2.418 -7.305 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -14.110 3.496 -8.657 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -12.747 1.924 -10.106 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -12.664 0.819 -8.749 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -14.930 0.283 -8.853 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -15.376 1.821 -9.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -15.552 0.030 -11.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -14.347 1.123 -11.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -13.914 -0.367 -10.960 1.00 0.00 H new ATOM 307 N PRO A 23 -11.716 3.967 -4.782 1.00 0.00 N ATOM 308 CA PRO A 23 -12.359 4.222 -3.490 1.00 0.00 C ATOM 309 C PRO A 23 -13.820 4.630 -3.640 1.00 0.00 C ATOM 310 O PRO A 23 -14.136 5.816 -3.742 1.00 0.00 O ATOM 311 CB PRO A 23 -11.538 5.375 -2.907 1.00 0.00 C ATOM 312 CG PRO A 23 -10.962 6.067 -4.094 1.00 0.00 C ATOM 313 CD PRO A 23 -10.718 4.996 -5.120 1.00 0.00 C ATOM 0 HA PRO A 23 -12.376 3.332 -2.861 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -12.162 6.049 -2.320 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -10.755 5.008 -2.244 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -11.648 6.824 -4.475 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -10.035 6.578 -3.836 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -10.856 5.372 -6.134 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -9.702 4.606 -5.060 1.00 0.00 H new ATOM 321 N ASP A 24 -14.707 3.641 -3.652 1.00 0.00 N ATOM 322 CA ASP A 24 -16.137 3.898 -3.788 1.00 0.00 C ATOM 323 C ASP A 24 -16.907 3.321 -2.605 1.00 0.00 C ATOM 324 O ASP A 24 -17.410 4.061 -1.759 1.00 0.00 O ATOM 325 CB ASP A 24 -16.662 3.302 -5.095 1.00 0.00 C ATOM 326 CG ASP A 24 -18.078 3.744 -5.405 1.00 0.00 C ATOM 327 OD1 ASP A 24 -18.363 4.953 -5.279 1.00 0.00 O ATOM 328 OD2 ASP A 24 -18.903 2.880 -5.773 1.00 0.00 O ATOM 0 H ASP A 24 -14.462 2.654 -3.569 1.00 0.00 H new ATOM 0 HA ASP A 24 -16.288 4.977 -3.804 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -16.005 3.595 -5.914 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -16.629 2.214 -5.034 1.00 0.00 H new ATOM 333 N GLU A 25 -16.997 1.996 -2.553 1.00 0.00 N ATOM 334 CA GLU A 25 -17.708 1.320 -1.474 1.00 0.00 C ATOM 335 C GLU A 25 -17.529 2.065 -0.154 1.00 0.00 C ATOM 336 O GLU A 25 -18.500 2.510 0.455 1.00 0.00 O ATOM 337 CB GLU A 25 -17.213 -0.121 -1.331 1.00 0.00 C ATOM 338 CG GLU A 25 -17.799 -1.071 -2.361 1.00 0.00 C ATOM 339 CD GLU A 25 -16.974 -1.133 -3.632 1.00 0.00 C ATOM 340 OE1 GLU A 25 -15.736 -0.996 -3.545 1.00 0.00 O ATOM 341 OE2 GLU A 25 -17.568 -1.319 -4.715 1.00 0.00 O ATOM 0 H GLU A 25 -16.587 1.369 -3.245 1.00 0.00 H new ATOM 0 HA GLU A 25 -18.769 1.309 -1.724 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -16.126 -0.133 -1.415 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -17.460 -0.484 -0.333 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -17.871 -2.069 -1.930 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -18.813 -0.756 -2.605 1.00 0.00 H new ATOM 348 N ASN A 26 -16.280 2.195 0.280 1.00 0.00 N ATOM 349 CA ASN A 26 -15.973 2.885 1.528 1.00 0.00 C ATOM 350 C ASN A 26 -14.977 4.016 1.293 1.00 0.00 C ATOM 351 O ASN A 26 -14.327 4.488 2.225 1.00 0.00 O ATOM 352 CB ASN A 26 -15.410 1.899 2.554 1.00 0.00 C ATOM 353 CG ASN A 26 -16.455 0.914 3.043 1.00 0.00 C ATOM 354 OD1 ASN A 26 -17.505 1.307 3.550 1.00 0.00 O ATOM 355 ND2 ASN A 26 -16.169 -0.374 2.892 1.00 0.00 N ATOM 0 H ASN A 26 -15.464 1.832 -0.213 1.00 0.00 H new ATOM 0 HA ASN A 26 -16.897 3.314 1.915 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -14.579 1.352 2.110 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -15.010 2.452 3.404 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -16.833 -1.084 3.202 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -15.285 -0.654 2.466 1.00 0.00 H new ATOM 362 N GLY A 27 -14.863 4.447 0.040 1.00 0.00 N ATOM 363 CA GLY A 27 -13.944 5.520 -0.295 1.00 0.00 C ATOM 364 C GLY A 27 -12.523 5.224 0.143 1.00 0.00 C ATOM 365 O GLY A 27 -11.725 6.140 0.342 1.00 0.00 O ATOM 0 H GLY A 27 -15.390 4.073 -0.749 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -13.962 5.686 -1.372 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -14.281 6.443 0.176 1.00 0.00 H new ATOM 369 N ARG A 28 -12.207 3.942 0.294 1.00 0.00 N ATOM 370 CA ARG A 28 -10.873 3.529 0.714 1.00 0.00 C ATOM 371 C ARG A 28 -10.572 2.108 0.247 1.00 0.00 C ATOM 372 O ARG A 28 -11.483 1.306 0.039 1.00 0.00 O ATOM 373 CB ARG A 28 -10.745 3.615 2.236 1.00 0.00 C ATOM 374 CG ARG A 28 -11.489 2.513 2.973 1.00 0.00 C ATOM 375 CD ARG A 28 -11.406 2.697 4.481 1.00 0.00 C ATOM 376 NE ARG A 28 -12.284 3.764 4.952 1.00 0.00 N ATOM 377 CZ ARG A 28 -12.404 4.107 6.229 1.00 0.00 C ATOM 378 NH1 ARG A 28 -11.705 3.470 7.159 1.00 0.00 N ATOM 379 NH2 ARG A 28 -13.224 5.090 6.580 1.00 0.00 N ATOM 0 H ARG A 28 -12.856 3.172 0.132 1.00 0.00 H new ATOM 0 HA ARG A 28 -10.150 4.204 0.257 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -9.690 3.573 2.506 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.121 4.582 2.570 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -12.534 2.508 2.663 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -11.071 1.544 2.700 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -11.673 1.763 4.975 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -10.378 2.923 4.762 1.00 0.00 H new ATOM 0 HE ARG A 28 -12.836 4.274 4.262 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -11.073 2.714 6.894 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -11.799 3.736 8.139 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -13.763 5.583 5.868 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -13.315 5.352 7.561 1.00 0.00 H new ATOM 393 N PHE A 29 -9.289 1.803 0.084 1.00 0.00 N ATOM 394 CA PHE A 29 -8.868 0.480 -0.360 1.00 0.00 C ATOM 395 C PHE A 29 -8.660 -0.452 0.830 1.00 0.00 C ATOM 396 O PHE A 29 -8.020 -0.087 1.815 1.00 0.00 O ATOM 397 CB PHE A 29 -7.577 0.579 -1.175 1.00 0.00 C ATOM 398 CG PHE A 29 -7.602 1.671 -2.206 1.00 0.00 C ATOM 399 CD1 PHE A 29 -8.475 1.608 -3.280 1.00 0.00 C ATOM 400 CD2 PHE A 29 -6.752 2.760 -2.102 1.00 0.00 C ATOM 401 CE1 PHE A 29 -8.501 2.612 -4.231 1.00 0.00 C ATOM 402 CE2 PHE A 29 -6.773 3.767 -3.049 1.00 0.00 C ATOM 403 CZ PHE A 29 -7.648 3.692 -4.115 1.00 0.00 C ATOM 0 H PHE A 29 -8.523 2.455 0.253 1.00 0.00 H new ATOM 0 HA PHE A 29 -9.657 0.068 -0.989 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -6.741 0.749 -0.497 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -7.396 -0.374 -1.671 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -9.143 0.765 -3.376 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.065 2.823 -1.271 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -9.187 2.552 -5.063 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -6.106 4.611 -2.955 1.00 0.00 H new ATOM 0 HZ PHE A 29 -7.665 4.477 -4.857 1.00 0.00 H new ATOM 413 N GLY A 30 -9.208 -1.660 0.731 1.00 0.00 N ATOM 414 CA GLY A 30 -9.073 -2.626 1.805 1.00 0.00 C ATOM 415 C GLY A 30 -7.848 -3.505 1.645 1.00 0.00 C ATOM 416 O GLY A 30 -7.960 -4.679 1.293 1.00 0.00 O ATOM 0 H GLY A 30 -9.743 -1.986 -0.074 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -9.016 -2.100 2.758 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -9.964 -3.253 1.840 1.00 0.00 H new ATOM 420 N PHE A 31 -6.675 -2.935 1.901 1.00 0.00 N ATOM 421 CA PHE A 31 -5.424 -3.674 1.780 1.00 0.00 C ATOM 422 C PHE A 31 -4.321 -3.014 2.603 1.00 0.00 C ATOM 423 O PHE A 31 -4.073 -1.816 2.480 1.00 0.00 O ATOM 424 CB PHE A 31 -4.998 -3.760 0.313 1.00 0.00 C ATOM 425 CG PHE A 31 -4.329 -2.513 -0.191 1.00 0.00 C ATOM 426 CD1 PHE A 31 -2.989 -2.276 0.071 1.00 0.00 C ATOM 427 CD2 PHE A 31 -5.039 -1.579 -0.927 1.00 0.00 C ATOM 428 CE1 PHE A 31 -2.370 -1.130 -0.392 1.00 0.00 C ATOM 429 CE2 PHE A 31 -4.426 -0.432 -1.393 1.00 0.00 C ATOM 430 CZ PHE A 31 -3.090 -0.206 -1.124 1.00 0.00 C ATOM 0 H PHE A 31 -6.565 -1.964 2.193 1.00 0.00 H new ATOM 0 HA PHE A 31 -5.587 -4.681 2.164 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -4.318 -4.603 0.189 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -5.875 -3.965 -0.300 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -2.422 -2.995 0.644 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -6.084 -1.749 -1.139 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.325 -0.957 -0.182 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -4.991 0.287 -1.967 1.00 0.00 H new ATOM 0 HZ PHE A 31 -2.609 0.691 -1.485 1.00 0.00 H new ATOM 440 N ASN A 32 -3.665 -3.807 3.444 1.00 0.00 N ATOM 441 CA ASN A 32 -2.589 -3.301 4.289 1.00 0.00 C ATOM 442 C ASN A 32 -1.226 -3.691 3.727 1.00 0.00 C ATOM 443 O ASN A 32 -1.126 -4.550 2.851 1.00 0.00 O ATOM 444 CB ASN A 32 -2.738 -3.836 5.715 1.00 0.00 C ATOM 445 CG ASN A 32 -3.697 -3.007 6.547 1.00 0.00 C ATOM 446 OD1 ASN A 32 -4.749 -2.586 6.067 1.00 0.00 O ATOM 447 ND2 ASN A 32 -3.335 -2.768 7.802 1.00 0.00 N ATOM 0 H ASN A 32 -3.859 -4.802 3.559 1.00 0.00 H new ATOM 0 HA ASN A 32 -2.656 -2.213 4.307 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -3.091 -4.867 5.678 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.761 -3.851 6.198 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -3.939 -2.215 8.410 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -2.453 -3.137 8.158 1.00 0.00 H new ATOM 454 N VAL A 33 -0.177 -3.054 4.238 1.00 0.00 N ATOM 455 CA VAL A 33 1.181 -3.336 3.789 1.00 0.00 C ATOM 456 C VAL A 33 2.159 -3.336 4.959 1.00 0.00 C ATOM 457 O VAL A 33 1.818 -2.920 6.067 1.00 0.00 O ATOM 458 CB VAL A 33 1.651 -2.308 2.743 1.00 0.00 C ATOM 459 CG1 VAL A 33 0.764 -2.360 1.508 1.00 0.00 C ATOM 460 CG2 VAL A 33 1.665 -0.909 3.340 1.00 0.00 C ATOM 0 H VAL A 33 -0.242 -2.339 4.963 1.00 0.00 H new ATOM 0 HA VAL A 33 1.164 -4.326 3.334 1.00 0.00 H new ATOM 0 HB VAL A 33 2.668 -2.560 2.442 1.00 0.00 H new ATOM 0 HG11 VAL A 33 1.111 -1.627 0.780 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.809 -3.357 1.069 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.265 -2.134 1.789 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.000 -0.195 2.587 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.660 -0.644 3.670 1.00 0.00 H new ATOM 0 HG23 VAL A 33 2.345 -0.884 4.191 1.00 0.00 H new ATOM 470 N LYS A 34 3.376 -3.803 4.706 1.00 0.00 N ATOM 471 CA LYS A 34 4.405 -3.856 5.738 1.00 0.00 C ATOM 472 C LYS A 34 5.799 -3.801 5.119 1.00 0.00 C ATOM 473 O LYS A 34 5.951 -3.875 3.901 1.00 0.00 O ATOM 474 CB LYS A 34 4.256 -5.131 6.571 1.00 0.00 C ATOM 475 CG LYS A 34 4.540 -6.404 5.793 1.00 0.00 C ATOM 476 CD LYS A 34 3.895 -7.614 6.448 1.00 0.00 C ATOM 477 CE LYS A 34 3.784 -8.780 5.478 1.00 0.00 C ATOM 478 NZ LYS A 34 2.800 -8.508 4.394 1.00 0.00 N ATOM 0 H LYS A 34 3.675 -4.151 3.795 1.00 0.00 H new ATOM 0 HA LYS A 34 4.279 -2.989 6.386 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.932 -5.078 7.424 1.00 0.00 H new ATOM 0 HB3 LYS A 34 3.243 -5.178 6.970 1.00 0.00 H new ATOM 0 HG2 LYS A 34 4.168 -6.299 4.774 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.617 -6.557 5.725 1.00 0.00 H new ATOM 0 HD2 LYS A 34 4.482 -7.916 7.315 1.00 0.00 H new ATOM 0 HD3 LYS A 34 2.903 -7.346 6.812 1.00 0.00 H new ATOM 0 HE2 LYS A 34 4.761 -8.982 5.039 1.00 0.00 H new ATOM 0 HE3 LYS A 34 3.487 -9.677 6.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 2.045 -9.222 4.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 2.388 -7.563 4.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 3.279 -8.549 3.472 1.00 0.00 H new ATOM 492 N GLY A 35 6.814 -3.672 5.968 1.00 0.00 N ATOM 493 CA GLY A 35 8.181 -3.611 5.486 1.00 0.00 C ATOM 494 C GLY A 35 8.566 -2.225 5.010 1.00 0.00 C ATOM 495 O GLY A 35 7.995 -1.228 5.450 1.00 0.00 O ATOM 0 H GLY A 35 6.714 -3.609 6.981 1.00 0.00 H new ATOM 0 HA2 GLY A 35 8.858 -3.919 6.283 1.00 0.00 H new ATOM 0 HA3 GLY A 35 8.307 -4.321 4.668 1.00 0.00 H new ATOM 499 N GLY A 36 9.540 -2.160 4.106 1.00 0.00 N ATOM 500 CA GLY A 36 9.986 -0.881 3.586 1.00 0.00 C ATOM 501 C GLY A 36 11.493 -0.726 3.640 1.00 0.00 C ATOM 502 O GLY A 36 12.184 -1.531 4.265 1.00 0.00 O ATOM 0 H GLY A 36 10.028 -2.971 3.725 1.00 0.00 H new ATOM 0 HA2 GLY A 36 9.650 -0.775 2.555 1.00 0.00 H new ATOM 0 HA3 GLY A 36 9.521 -0.078 4.157 1.00 0.00 H new ATOM 506 N TYR A 37 12.003 0.309 2.983 1.00 0.00 N ATOM 507 CA TYR A 37 13.438 0.564 2.955 1.00 0.00 C ATOM 508 C TYR A 37 14.006 0.641 4.369 1.00 0.00 C ATOM 509 O TYR A 37 15.205 0.458 4.580 1.00 0.00 O ATOM 510 CB TYR A 37 13.732 1.865 2.205 1.00 0.00 C ATOM 511 CG TYR A 37 15.204 2.098 1.950 1.00 0.00 C ATOM 512 CD1 TYR A 37 16.001 2.729 2.897 1.00 0.00 C ATOM 513 CD2 TYR A 37 15.797 1.687 0.763 1.00 0.00 C ATOM 514 CE1 TYR A 37 17.347 2.945 2.669 1.00 0.00 C ATOM 515 CE2 TYR A 37 17.142 1.898 0.527 1.00 0.00 C ATOM 516 CZ TYR A 37 17.912 2.527 1.482 1.00 0.00 C ATOM 517 OH TYR A 37 19.252 2.739 1.250 1.00 0.00 O ATOM 0 H TYR A 37 11.444 0.985 2.463 1.00 0.00 H new ATOM 0 HA TYR A 37 13.918 -0.265 2.434 1.00 0.00 H new ATOM 0 HB2 TYR A 37 13.204 1.852 1.251 1.00 0.00 H new ATOM 0 HB3 TYR A 37 13.334 2.703 2.778 1.00 0.00 H new ATOM 0 HD1 TYR A 37 15.561 3.056 3.827 1.00 0.00 H new ATOM 0 HD2 TYR A 37 15.197 1.194 0.012 1.00 0.00 H new ATOM 0 HE1 TYR A 37 17.952 3.438 3.415 1.00 0.00 H new ATOM 0 HE2 TYR A 37 17.588 1.572 -0.401 1.00 0.00 H new ATOM 0 HH TYR A 37 19.492 2.384 0.368 1.00 0.00 H new ATOM 527 N ASP A 38 13.135 0.911 5.335 1.00 0.00 N ATOM 528 CA ASP A 38 13.546 1.010 6.731 1.00 0.00 C ATOM 529 C ASP A 38 14.041 -0.337 7.248 1.00 0.00 C ATOM 530 O ASP A 38 15.007 -0.403 8.007 1.00 0.00 O ATOM 531 CB ASP A 38 12.385 1.507 7.593 1.00 0.00 C ATOM 532 CG ASP A 38 12.637 1.306 9.075 1.00 0.00 C ATOM 533 OD1 ASP A 38 13.484 2.032 9.637 1.00 0.00 O ATOM 534 OD2 ASP A 38 11.987 0.423 9.672 1.00 0.00 O ATOM 0 H ASP A 38 12.139 1.065 5.177 1.00 0.00 H new ATOM 0 HA ASP A 38 14.366 1.726 6.793 1.00 0.00 H new ATOM 0 HB2 ASP A 38 12.217 2.566 7.396 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.474 0.982 7.308 1.00 0.00 H new ATOM 539 N GLN A 39 13.371 -1.407 6.833 1.00 0.00 N ATOM 540 CA GLN A 39 13.742 -2.752 7.256 1.00 0.00 C ATOM 541 C GLN A 39 14.376 -3.529 6.107 1.00 0.00 C ATOM 542 O GLN A 39 14.344 -4.759 6.083 1.00 0.00 O ATOM 543 CB GLN A 39 12.515 -3.502 7.778 1.00 0.00 C ATOM 544 CG GLN A 39 12.170 -3.173 9.222 1.00 0.00 C ATOM 545 CD GLN A 39 12.986 -3.978 10.214 1.00 0.00 C ATOM 546 OE1 GLN A 39 13.103 -5.198 10.096 1.00 0.00 O ATOM 547 NE2 GLN A 39 13.558 -3.298 11.201 1.00 0.00 N ATOM 0 H GLN A 39 12.569 -1.369 6.204 1.00 0.00 H new ATOM 0 HA GLN A 39 14.474 -2.664 8.059 1.00 0.00 H new ATOM 0 HB2 GLN A 39 11.659 -3.266 7.146 1.00 0.00 H new ATOM 0 HB3 GLN A 39 12.690 -4.574 7.690 1.00 0.00 H new ATOM 0 HG2 GLN A 39 12.336 -2.110 9.398 1.00 0.00 H new ATOM 0 HG3 GLN A 39 11.110 -3.362 9.391 1.00 0.00 H new ATOM 0 HE21 GLN A 39 13.436 -2.287 11.262 1.00 0.00 H new ATOM 0 HE22 GLN A 39 14.120 -3.787 11.898 1.00 0.00 H new ATOM 556 N LYS A 40 14.953 -2.803 5.156 1.00 0.00 N ATOM 557 CA LYS A 40 15.597 -3.422 4.004 1.00 0.00 C ATOM 558 C LYS A 40 14.792 -4.621 3.511 1.00 0.00 C ATOM 559 O LYS A 40 15.358 -5.645 3.129 1.00 0.00 O ATOM 560 CB LYS A 40 17.018 -3.861 4.362 1.00 0.00 C ATOM 561 CG LYS A 40 17.978 -2.703 4.573 1.00 0.00 C ATOM 562 CD LYS A 40 17.942 -2.203 6.008 1.00 0.00 C ATOM 563 CE LYS A 40 18.668 -3.154 6.948 1.00 0.00 C ATOM 564 NZ LYS A 40 20.140 -2.932 6.932 1.00 0.00 N ATOM 0 H LYS A 40 14.988 -1.784 5.160 1.00 0.00 H new ATOM 0 HA LYS A 40 15.643 -2.683 3.204 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.985 -4.464 5.269 1.00 0.00 H new ATOM 0 HB3 LYS A 40 17.403 -4.501 3.568 1.00 0.00 H new ATOM 0 HG2 LYS A 40 18.991 -3.018 4.322 1.00 0.00 H new ATOM 0 HG3 LYS A 40 17.721 -1.888 3.896 1.00 0.00 H new ATOM 0 HD2 LYS A 40 18.401 -1.216 6.062 1.00 0.00 H new ATOM 0 HD3 LYS A 40 16.907 -2.092 6.330 1.00 0.00 H new ATOM 0 HE2 LYS A 40 18.291 -3.020 7.962 1.00 0.00 H new ATOM 0 HE3 LYS A 40 18.453 -4.183 6.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 20.599 -3.599 7.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 20.504 -3.084 5.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 20.347 -1.958 7.230 1.00 0.00 H new ATOM 578 N MET A 41 13.470 -4.485 3.521 1.00 0.00 N ATOM 579 CA MET A 41 12.589 -5.557 3.072 1.00 0.00 C ATOM 580 C MET A 41 11.546 -5.028 2.092 1.00 0.00 C ATOM 581 O MET A 41 11.157 -3.861 2.133 1.00 0.00 O ATOM 582 CB MET A 41 11.897 -6.212 4.268 1.00 0.00 C ATOM 583 CG MET A 41 10.727 -5.406 4.809 1.00 0.00 C ATOM 584 SD MET A 41 9.659 -6.373 5.893 1.00 0.00 S ATOM 585 CE MET A 41 8.691 -7.283 4.692 1.00 0.00 C ATOM 0 H MET A 41 12.986 -3.644 3.835 1.00 0.00 H new ATOM 0 HA MET A 41 13.197 -6.303 2.561 1.00 0.00 H new ATOM 0 HB2 MET A 41 11.543 -7.200 3.976 1.00 0.00 H new ATOM 0 HB3 MET A 41 12.627 -6.358 5.065 1.00 0.00 H new ATOM 0 HG2 MET A 41 11.107 -4.543 5.356 1.00 0.00 H new ATOM 0 HG3 MET A 41 10.139 -5.021 3.975 1.00 0.00 H new ATOM 0 HE1 MET A 41 8.504 -8.290 5.064 1.00 0.00 H new ATOM 0 HE2 MET A 41 7.741 -6.774 4.529 1.00 0.00 H new ATOM 0 HE3 MET A 41 9.238 -7.339 3.751 1.00 0.00 H new ATOM 595 N PRO A 42 11.081 -5.906 1.190 1.00 0.00 N ATOM 596 CA PRO A 42 10.077 -5.550 0.184 1.00 0.00 C ATOM 597 C PRO A 42 8.703 -5.304 0.798 1.00 0.00 C ATOM 598 O PRO A 42 8.395 -5.809 1.877 1.00 0.00 O ATOM 599 CB PRO A 42 10.042 -6.776 -0.732 1.00 0.00 C ATOM 600 CG PRO A 42 10.502 -7.903 0.127 1.00 0.00 C ATOM 601 CD PRO A 42 11.501 -7.313 1.084 1.00 0.00 C ATOM 0 HA PRO A 42 10.328 -4.623 -0.332 1.00 0.00 H new ATOM 0 HB2 PRO A 42 9.038 -6.955 -1.116 1.00 0.00 H new ATOM 0 HB3 PRO A 42 10.694 -6.644 -1.595 1.00 0.00 H new ATOM 0 HG2 PRO A 42 9.666 -8.352 0.663 1.00 0.00 H new ATOM 0 HG3 PRO A 42 10.955 -8.692 -0.474 1.00 0.00 H new ATOM 0 HD2 PRO A 42 11.475 -7.814 2.052 1.00 0.00 H new ATOM 0 HD3 PRO A 42 12.520 -7.401 0.707 1.00 0.00 H new ATOM 609 N VAL A 43 7.880 -4.525 0.103 1.00 0.00 N ATOM 610 CA VAL A 43 6.537 -4.214 0.579 1.00 0.00 C ATOM 611 C VAL A 43 5.534 -5.266 0.120 1.00 0.00 C ATOM 612 O VAL A 43 5.178 -5.327 -1.057 1.00 0.00 O ATOM 613 CB VAL A 43 6.074 -2.830 0.087 1.00 0.00 C ATOM 614 CG1 VAL A 43 4.706 -2.491 0.658 1.00 0.00 C ATOM 615 CG2 VAL A 43 7.095 -1.764 0.458 1.00 0.00 C ATOM 0 H VAL A 43 8.120 -4.098 -0.792 1.00 0.00 H new ATOM 0 HA VAL A 43 6.580 -4.209 1.668 1.00 0.00 H new ATOM 0 HB VAL A 43 5.991 -2.859 -0.999 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.395 -1.510 0.300 1.00 0.00 H new ATOM 0 HG12 VAL A 43 3.982 -3.240 0.338 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.759 -2.480 1.747 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.752 -0.792 0.103 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.212 -1.734 1.541 1.00 0.00 H new ATOM 0 HG23 VAL A 43 8.053 -2.002 -0.004 1.00 0.00 H new ATOM 625 N ILE A 44 5.081 -6.092 1.057 1.00 0.00 N ATOM 626 CA ILE A 44 4.116 -7.141 0.749 1.00 0.00 C ATOM 627 C ILE A 44 2.812 -6.929 1.511 1.00 0.00 C ATOM 628 O ILE A 44 2.818 -6.522 2.672 1.00 0.00 O ATOM 629 CB ILE A 44 4.675 -8.536 1.088 1.00 0.00 C ATOM 630 CG1 ILE A 44 5.973 -8.790 0.319 1.00 0.00 C ATOM 631 CG2 ILE A 44 3.645 -9.610 0.769 1.00 0.00 C ATOM 632 CD1 ILE A 44 7.197 -8.210 0.992 1.00 0.00 C ATOM 0 H ILE A 44 5.366 -6.055 2.036 1.00 0.00 H new ATOM 0 HA ILE A 44 3.921 -7.087 -0.322 1.00 0.00 H new ATOM 0 HB ILE A 44 4.894 -8.575 2.155 1.00 0.00 H new ATOM 0 HG12 ILE A 44 6.110 -9.865 0.198 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.883 -8.365 -0.681 1.00 0.00 H new ATOM 0 HG21 ILE A 44 4.054 -10.590 1.014 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.744 -9.436 1.357 1.00 0.00 H new ATOM 0 HG23 ILE A 44 3.399 -9.574 -0.292 1.00 0.00 H new ATOM 0 HD11 ILE A 44 8.080 -8.428 0.392 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.082 -7.130 1.089 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.312 -8.653 1.981 1.00 0.00 H new ATOM 644 N VAL A 45 1.695 -7.210 0.848 1.00 0.00 N ATOM 645 CA VAL A 45 0.382 -7.054 1.463 1.00 0.00 C ATOM 646 C VAL A 45 0.313 -7.775 2.804 1.00 0.00 C ATOM 647 O VAL A 45 0.645 -8.957 2.903 1.00 0.00 O ATOM 648 CB VAL A 45 -0.734 -7.590 0.547 1.00 0.00 C ATOM 649 CG1 VAL A 45 -2.077 -7.547 1.260 1.00 0.00 C ATOM 650 CG2 VAL A 45 -0.785 -6.798 -0.751 1.00 0.00 C ATOM 0 H VAL A 45 1.673 -7.547 -0.115 1.00 0.00 H new ATOM 0 HA VAL A 45 0.232 -5.986 1.620 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.512 -8.629 0.303 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -2.853 -7.930 0.597 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -2.032 -8.162 2.159 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -2.310 -6.518 1.536 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -1.579 -7.191 -1.386 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -0.982 -5.749 -0.530 1.00 0.00 H new ATOM 0 HG23 VAL A 45 0.170 -6.886 -1.269 1.00 0.00 H new ATOM 660 N SER A 46 -0.119 -7.056 3.835 1.00 0.00 N ATOM 661 CA SER A 46 -0.228 -7.627 5.173 1.00 0.00 C ATOM 662 C SER A 46 -1.535 -8.398 5.329 1.00 0.00 C ATOM 663 O SER A 46 -1.531 -9.611 5.542 1.00 0.00 O ATOM 664 CB SER A 46 -0.144 -6.523 6.229 1.00 0.00 C ATOM 665 OG SER A 46 -0.447 -7.027 7.518 1.00 0.00 O ATOM 0 H SER A 46 -0.399 -6.077 3.770 1.00 0.00 H new ATOM 0 HA SER A 46 0.601 -8.320 5.315 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.857 -6.091 6.230 1.00 0.00 H new ATOM 0 HB3 SER A 46 -0.837 -5.720 5.977 1.00 0.00 H new ATOM 0 HG SER A 46 -0.385 -6.303 8.175 1.00 0.00 H new ATOM 671 N ARG A 47 -2.652 -7.686 5.223 1.00 0.00 N ATOM 672 CA ARG A 47 -3.967 -8.302 5.354 1.00 0.00 C ATOM 673 C ARG A 47 -4.965 -7.661 4.395 1.00 0.00 C ATOM 674 O ARG A 47 -4.724 -6.577 3.864 1.00 0.00 O ATOM 675 CB ARG A 47 -4.472 -8.175 6.793 1.00 0.00 C ATOM 676 CG ARG A 47 -5.719 -8.997 7.075 1.00 0.00 C ATOM 677 CD ARG A 47 -5.773 -9.446 8.527 1.00 0.00 C ATOM 678 NE ARG A 47 -6.464 -8.478 9.374 1.00 0.00 N ATOM 679 CZ ARG A 47 -6.645 -8.641 10.680 1.00 0.00 C ATOM 680 NH1 ARG A 47 -6.186 -9.728 11.285 1.00 0.00 N ATOM 681 NH2 ARG A 47 -7.284 -7.715 11.383 1.00 0.00 N ATOM 0 H ARG A 47 -2.673 -6.682 5.047 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.873 -9.358 5.101 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.681 -8.485 7.476 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -4.683 -7.127 7.004 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -6.605 -8.407 6.842 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -5.736 -9.870 6.422 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -6.279 -10.409 8.590 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -4.759 -9.594 8.899 1.00 0.00 H new ATOM 0 HE ARG A 47 -6.828 -7.630 8.939 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -5.693 -10.441 10.748 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -6.326 -9.851 12.288 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -7.637 -6.877 10.921 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -7.422 -7.841 12.386 1.00 0.00 H new ATOM 695 N VAL A 48 -6.088 -8.339 4.177 1.00 0.00 N ATOM 696 CA VAL A 48 -7.123 -7.836 3.283 1.00 0.00 C ATOM 697 C VAL A 48 -8.514 -8.108 3.845 1.00 0.00 C ATOM 698 O VAL A 48 -8.910 -9.260 4.021 1.00 0.00 O ATOM 699 CB VAL A 48 -7.014 -8.471 1.884 1.00 0.00 C ATOM 700 CG1 VAL A 48 -7.961 -7.787 0.911 1.00 0.00 C ATOM 701 CG2 VAL A 48 -5.580 -8.406 1.380 1.00 0.00 C ATOM 0 H VAL A 48 -6.303 -9.238 4.608 1.00 0.00 H new ATOM 0 HA VAL A 48 -6.972 -6.760 3.198 1.00 0.00 H new ATOM 0 HB VAL A 48 -7.302 -9.520 1.957 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -7.869 -8.250 -0.072 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -8.986 -7.891 1.267 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -7.707 -6.729 0.839 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.521 -8.859 0.390 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.262 -7.365 1.322 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.928 -8.947 2.066 1.00 0.00 H new ATOM 711 N ALA A 49 -9.253 -7.039 4.124 1.00 0.00 N ATOM 712 CA ALA A 49 -10.601 -7.162 4.664 1.00 0.00 C ATOM 713 C ALA A 49 -11.617 -7.405 3.553 1.00 0.00 C ATOM 714 O ALA A 49 -11.449 -6.963 2.417 1.00 0.00 O ATOM 715 CB ALA A 49 -10.969 -5.914 5.454 1.00 0.00 C ATOM 0 H ALA A 49 -8.940 -6.078 3.985 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.621 -8.022 5.334 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -11.978 -6.020 5.852 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -10.266 -5.784 6.277 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -10.926 -5.043 4.800 1.00 0.00 H new ATOM 721 N PRO A 50 -12.698 -8.127 3.886 1.00 0.00 N ATOM 722 CA PRO A 50 -13.762 -8.446 2.930 1.00 0.00 C ATOM 723 C PRO A 50 -14.580 -7.219 2.542 1.00 0.00 C ATOM 724 O PRO A 50 -14.377 -6.131 3.079 1.00 0.00 O ATOM 725 CB PRO A 50 -14.632 -9.451 3.690 1.00 0.00 C ATOM 726 CG PRO A 50 -14.392 -9.147 5.128 1.00 0.00 C ATOM 727 CD PRO A 50 -12.964 -8.687 5.222 1.00 0.00 C ATOM 0 HA PRO A 50 -13.364 -8.830 1.991 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -15.685 -9.338 3.432 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.353 -10.477 3.450 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -15.075 -8.375 5.483 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -14.559 -10.029 5.746 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -12.833 -7.940 6.004 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -12.290 -9.512 5.453 1.00 0.00 H new ATOM 735 N GLY A 51 -15.506 -7.402 1.606 1.00 0.00 N ATOM 736 CA GLY A 51 -16.341 -6.301 1.163 1.00 0.00 C ATOM 737 C GLY A 51 -15.540 -5.048 0.868 1.00 0.00 C ATOM 738 O GLY A 51 -15.882 -3.960 1.332 1.00 0.00 O ATOM 0 H GLY A 51 -15.693 -8.293 1.147 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -16.886 -6.600 0.267 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.084 -6.081 1.930 1.00 0.00 H new ATOM 742 N THR A 52 -14.469 -5.201 0.095 1.00 0.00 N ATOM 743 CA THR A 52 -13.616 -4.074 -0.259 1.00 0.00 C ATOM 744 C THR A 52 -13.332 -4.048 -1.756 1.00 0.00 C ATOM 745 O THR A 52 -13.382 -5.070 -2.440 1.00 0.00 O ATOM 746 CB THR A 52 -12.279 -4.121 0.505 1.00 0.00 C ATOM 747 OG1 THR A 52 -11.743 -5.448 0.474 1.00 0.00 O ATOM 748 CG2 THR A 52 -12.463 -3.676 1.948 1.00 0.00 C ATOM 0 H THR A 52 -14.172 -6.094 -0.298 1.00 0.00 H new ATOM 0 HA THR A 52 -14.155 -3.169 0.021 1.00 0.00 H new ATOM 0 HB THR A 52 -11.584 -3.438 0.017 1.00 0.00 H new ATOM 0 HG1 THR A 52 -11.530 -5.736 1.386 1.00 0.00 H new ATOM 0 HG21 THR A 52 -11.505 -3.718 2.467 1.00 0.00 H new ATOM 0 HG22 THR A 52 -12.842 -2.654 1.968 1.00 0.00 H new ATOM 0 HG23 THR A 52 -13.174 -4.337 2.445 1.00 0.00 H new ATOM 756 N PRO A 53 -13.027 -2.851 -2.281 1.00 0.00 N ATOM 757 CA PRO A 53 -12.728 -2.664 -3.704 1.00 0.00 C ATOM 758 C PRO A 53 -11.396 -3.289 -4.103 1.00 0.00 C ATOM 759 O PRO A 53 -10.969 -3.181 -5.253 1.00 0.00 O ATOM 760 CB PRO A 53 -12.672 -1.142 -3.857 1.00 0.00 C ATOM 761 CG PRO A 53 -12.316 -0.638 -2.501 1.00 0.00 C ATOM 762 CD PRO A 53 -12.949 -1.590 -1.525 1.00 0.00 C ATOM 0 HA PRO A 53 -13.469 -3.143 -4.343 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -11.929 -0.846 -4.597 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.630 -0.742 -4.189 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -11.235 -0.605 -2.369 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.686 0.376 -2.352 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -12.348 -1.699 -0.622 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -13.935 -1.248 -1.212 1.00 0.00 H new ATOM 770 N ALA A 54 -10.744 -3.943 -3.148 1.00 0.00 N ATOM 771 CA ALA A 54 -9.461 -4.587 -3.401 1.00 0.00 C ATOM 772 C ALA A 54 -9.614 -6.102 -3.482 1.00 0.00 C ATOM 773 O ALA A 54 -8.747 -6.796 -4.012 1.00 0.00 O ATOM 774 CB ALA A 54 -8.459 -4.213 -2.319 1.00 0.00 C ATOM 0 H ALA A 54 -11.083 -4.041 -2.191 1.00 0.00 H new ATOM 0 HA ALA A 54 -9.089 -4.233 -4.363 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -7.506 -4.701 -2.521 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.319 -3.132 -2.311 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -8.834 -4.537 -1.348 1.00 0.00 H new ATOM 780 N ASP A 55 -10.722 -6.609 -2.952 1.00 0.00 N ATOM 781 CA ASP A 55 -10.989 -8.043 -2.964 1.00 0.00 C ATOM 782 C ASP A 55 -11.899 -8.416 -4.131 1.00 0.00 C ATOM 783 O ASP A 55 -11.595 -9.326 -4.903 1.00 0.00 O ATOM 784 CB ASP A 55 -11.628 -8.476 -1.644 1.00 0.00 C ATOM 785 CG ASP A 55 -11.542 -9.973 -1.423 1.00 0.00 C ATOM 786 OD1 ASP A 55 -10.503 -10.439 -0.912 1.00 0.00 O ATOM 787 OD2 ASP A 55 -12.515 -10.679 -1.761 1.00 0.00 O ATOM 0 H ASP A 55 -11.450 -6.048 -2.509 1.00 0.00 H new ATOM 0 HA ASP A 55 -10.039 -8.564 -3.086 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -11.136 -7.961 -0.819 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -12.674 -8.169 -1.632 1.00 0.00 H new ATOM 792 N LEU A 56 -13.017 -7.709 -4.252 1.00 0.00 N ATOM 793 CA LEU A 56 -13.973 -7.966 -5.323 1.00 0.00 C ATOM 794 C LEU A 56 -13.353 -7.679 -6.687 1.00 0.00 C ATOM 795 O LEU A 56 -13.810 -8.192 -7.709 1.00 0.00 O ATOM 796 CB LEU A 56 -15.227 -7.112 -5.130 1.00 0.00 C ATOM 797 CG LEU A 56 -15.869 -7.167 -3.744 1.00 0.00 C ATOM 798 CD1 LEU A 56 -16.619 -5.876 -3.451 1.00 0.00 C ATOM 799 CD2 LEU A 56 -16.803 -8.364 -3.635 1.00 0.00 C ATOM 0 H LEU A 56 -13.284 -6.953 -3.621 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.249 -9.020 -5.285 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.974 -6.075 -5.350 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.970 -7.422 -5.865 1.00 0.00 H new ATOM 0 HG LEU A 56 -15.078 -7.280 -3.003 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -17.069 -5.934 -2.460 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -15.925 -5.036 -3.486 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.401 -5.732 -4.197 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -17.251 -8.387 -2.642 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -17.589 -8.282 -4.386 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -16.239 -9.282 -3.800 1.00 0.00 H new ATOM 811 N CYS A 57 -12.309 -6.857 -6.695 1.00 0.00 N ATOM 812 CA CYS A 57 -11.625 -6.502 -7.933 1.00 0.00 C ATOM 813 C CYS A 57 -10.963 -7.726 -8.559 1.00 0.00 C ATOM 814 O CYS A 57 -10.755 -8.740 -7.893 1.00 0.00 O ATOM 815 CB CYS A 57 -10.577 -5.420 -7.669 1.00 0.00 C ATOM 816 SG CYS A 57 -8.999 -6.054 -7.053 1.00 0.00 S ATOM 0 H CYS A 57 -11.918 -6.424 -5.858 1.00 0.00 H new ATOM 0 HA CYS A 57 -12.368 -6.116 -8.631 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -10.399 -4.869 -8.592 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -10.978 -4.710 -6.946 1.00 0.00 H new ATOM 0 HG CYS A 57 -8.507 -6.900 -7.909 1.00 0.00 H new ATOM 822 N VAL A 58 -10.636 -7.623 -9.843 1.00 0.00 N ATOM 823 CA VAL A 58 -9.999 -8.722 -10.559 1.00 0.00 C ATOM 824 C VAL A 58 -8.694 -8.272 -11.206 1.00 0.00 C ATOM 825 O VAL A 58 -8.651 -7.311 -11.974 1.00 0.00 O ATOM 826 CB VAL A 58 -10.926 -9.296 -11.646 1.00 0.00 C ATOM 827 CG1 VAL A 58 -10.161 -10.246 -12.555 1.00 0.00 C ATOM 828 CG2 VAL A 58 -12.119 -9.997 -11.013 1.00 0.00 C ATOM 0 H VAL A 58 -10.801 -6.790 -10.409 1.00 0.00 H new ATOM 0 HA VAL A 58 -9.789 -9.499 -9.824 1.00 0.00 H new ATOM 0 HB VAL A 58 -11.298 -8.471 -12.253 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -10.833 -10.641 -13.317 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -9.343 -9.710 -13.036 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.758 -11.069 -11.965 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -12.764 -10.397 -11.796 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -11.768 -10.812 -10.380 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -12.681 -9.285 -10.409 1.00 0.00 H new ATOM 838 N PRO A 59 -7.601 -8.983 -10.890 1.00 0.00 N ATOM 839 CA PRO A 59 -7.639 -10.129 -9.977 1.00 0.00 C ATOM 840 C PRO A 59 -7.904 -9.712 -8.534 1.00 0.00 C ATOM 841 O PRO A 59 -8.050 -8.526 -8.238 1.00 0.00 O ATOM 842 CB PRO A 59 -6.239 -10.735 -10.109 1.00 0.00 C ATOM 843 CG PRO A 59 -5.375 -9.601 -10.543 1.00 0.00 C ATOM 844 CD PRO A 59 -6.244 -8.723 -11.400 1.00 0.00 C ATOM 0 HA PRO A 59 -8.443 -10.821 -10.226 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -5.898 -11.153 -9.162 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -6.225 -11.545 -10.838 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -4.992 -9.051 -9.683 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -4.511 -9.960 -11.102 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -5.973 -7.672 -11.303 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -6.156 -8.979 -12.456 1.00 0.00 H new ATOM 852 N ARG A 60 -7.966 -10.694 -7.641 1.00 0.00 N ATOM 853 CA ARG A 60 -8.215 -10.428 -6.229 1.00 0.00 C ATOM 854 C ARG A 60 -6.905 -10.199 -5.481 1.00 0.00 C ATOM 855 O ARG A 60 -6.025 -11.060 -5.469 1.00 0.00 O ATOM 856 CB ARG A 60 -8.979 -11.593 -5.596 1.00 0.00 C ATOM 857 CG ARG A 60 -9.127 -11.476 -4.088 1.00 0.00 C ATOM 858 CD ARG A 60 -9.467 -12.817 -3.456 1.00 0.00 C ATOM 859 NE ARG A 60 -8.982 -12.913 -2.082 1.00 0.00 N ATOM 860 CZ ARG A 60 -9.341 -13.877 -1.242 1.00 0.00 C ATOM 861 NH1 ARG A 60 -10.183 -14.823 -1.634 1.00 0.00 N ATOM 862 NH2 ARG A 60 -8.856 -13.897 -0.007 1.00 0.00 N ATOM 0 H ARG A 60 -7.847 -11.681 -7.870 1.00 0.00 H new ATOM 0 HA ARG A 60 -8.819 -9.524 -6.156 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -9.970 -11.654 -6.046 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.464 -12.525 -5.831 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.200 -11.095 -3.659 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -9.908 -10.753 -3.853 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -10.547 -12.961 -3.470 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -9.031 -13.619 -4.051 1.00 0.00 H new ATOM 0 HE ARG A 60 -8.332 -12.201 -1.749 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -10.557 -14.812 -2.583 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -10.457 -15.562 -0.987 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -8.207 -13.172 0.298 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -9.132 -14.638 0.637 1.00 0.00 H new ATOM 876 N LEU A 61 -6.783 -9.032 -4.857 1.00 0.00 N ATOM 877 CA LEU A 61 -5.581 -8.688 -4.106 1.00 0.00 C ATOM 878 C LEU A 61 -5.469 -9.533 -2.841 1.00 0.00 C ATOM 879 O LEU A 61 -6.035 -9.193 -1.803 1.00 0.00 O ATOM 880 CB LEU A 61 -5.592 -7.202 -3.741 1.00 0.00 C ATOM 881 CG LEU A 61 -4.237 -6.587 -3.390 1.00 0.00 C ATOM 882 CD1 LEU A 61 -3.340 -6.537 -4.617 1.00 0.00 C ATOM 883 CD2 LEU A 61 -4.418 -5.196 -2.802 1.00 0.00 C ATOM 0 H LEU A 61 -7.502 -8.308 -4.856 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.716 -8.895 -4.737 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -6.015 -6.646 -4.578 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.263 -7.062 -2.893 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.758 -7.216 -2.640 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.380 -6.096 -4.348 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.183 -7.548 -4.994 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.814 -5.931 -5.390 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.443 -4.774 -2.558 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.919 -4.556 -3.529 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -5.022 -5.259 -1.897 1.00 0.00 H new ATOM 895 N ASN A 62 -4.732 -10.635 -2.936 1.00 0.00 N ATOM 896 CA ASN A 62 -4.543 -11.529 -1.799 1.00 0.00 C ATOM 897 C ASN A 62 -3.195 -11.280 -1.130 1.00 0.00 C ATOM 898 O ASN A 62 -2.306 -10.661 -1.714 1.00 0.00 O ATOM 899 CB ASN A 62 -4.641 -12.988 -2.249 1.00 0.00 C ATOM 900 CG ASN A 62 -3.432 -13.427 -3.053 1.00 0.00 C ATOM 901 OD1 ASN A 62 -2.512 -14.049 -2.521 1.00 0.00 O ATOM 902 ND2 ASN A 62 -3.430 -13.105 -4.341 1.00 0.00 N ATOM 0 H ASN A 62 -4.256 -10.930 -3.788 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.331 -11.326 -1.074 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -4.744 -13.629 -1.374 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -5.541 -13.121 -2.849 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -2.644 -13.374 -4.933 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -4.215 -12.589 -4.739 1.00 0.00 H new ATOM 909 N GLU A 63 -3.051 -11.769 0.098 1.00 0.00 N ATOM 910 CA GLU A 63 -1.811 -11.599 0.847 1.00 0.00 C ATOM 911 C GLU A 63 -0.645 -12.268 0.125 1.00 0.00 C ATOM 912 O GLU A 63 -0.824 -13.259 -0.581 1.00 0.00 O ATOM 913 CB GLU A 63 -1.956 -12.180 2.255 1.00 0.00 C ATOM 914 CG GLU A 63 -2.953 -11.432 3.123 1.00 0.00 C ATOM 915 CD GLU A 63 -4.373 -11.932 2.944 1.00 0.00 C ATOM 916 OE1 GLU A 63 -4.973 -11.650 1.886 1.00 0.00 O ATOM 917 OE2 GLU A 63 -4.884 -12.606 3.863 1.00 0.00 O ATOM 0 H GLU A 63 -3.777 -12.285 0.595 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.605 -10.531 0.923 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.264 -13.223 2.179 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -0.982 -12.171 2.745 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.665 -11.533 4.170 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -2.913 -10.370 2.883 1.00 0.00 H new ATOM 924 N GLY A 64 0.552 -11.718 0.310 1.00 0.00 N ATOM 925 CA GLY A 64 1.730 -12.273 -0.330 1.00 0.00 C ATOM 926 C GLY A 64 2.183 -11.454 -1.522 1.00 0.00 C ATOM 927 O GLY A 64 3.381 -11.267 -1.736 1.00 0.00 O ATOM 0 H GLY A 64 0.726 -10.898 0.892 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.541 -12.331 0.396 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.518 -13.292 -0.653 1.00 0.00 H new ATOM 931 N ASP A 65 1.224 -10.966 -2.301 1.00 0.00 N ATOM 932 CA ASP A 65 1.531 -10.163 -3.479 1.00 0.00 C ATOM 933 C ASP A 65 2.469 -9.013 -3.124 1.00 0.00 C ATOM 934 O ASP A 65 2.053 -8.026 -2.518 1.00 0.00 O ATOM 935 CB ASP A 65 0.244 -9.615 -4.098 1.00 0.00 C ATOM 936 CG ASP A 65 -0.616 -10.706 -4.707 1.00 0.00 C ATOM 937 OD1 ASP A 65 -0.383 -11.057 -5.882 1.00 0.00 O ATOM 938 OD2 ASP A 65 -1.522 -11.207 -4.009 1.00 0.00 O ATOM 0 H ASP A 65 0.228 -11.112 -2.138 1.00 0.00 H new ATOM 0 HA ASP A 65 2.030 -10.804 -4.205 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -0.328 -9.089 -3.334 1.00 0.00 H new ATOM 0 HB3 ASP A 65 0.496 -8.884 -4.866 1.00 0.00 H new ATOM 943 N GLN A 66 3.735 -9.150 -3.505 1.00 0.00 N ATOM 944 CA GLN A 66 4.731 -8.123 -3.224 1.00 0.00 C ATOM 945 C GLN A 66 4.515 -6.899 -4.108 1.00 0.00 C ATOM 946 O GLN A 66 4.604 -6.981 -5.333 1.00 0.00 O ATOM 947 CB GLN A 66 6.140 -8.679 -3.438 1.00 0.00 C ATOM 948 CG GLN A 66 7.225 -7.614 -3.409 1.00 0.00 C ATOM 949 CD GLN A 66 8.521 -8.083 -4.040 1.00 0.00 C ATOM 950 OE1 GLN A 66 9.140 -9.040 -3.575 1.00 0.00 O ATOM 951 NE2 GLN A 66 8.938 -7.411 -5.107 1.00 0.00 N ATOM 0 H GLN A 66 4.095 -9.961 -4.008 1.00 0.00 H new ATOM 0 HA GLN A 66 4.621 -7.820 -2.183 1.00 0.00 H new ATOM 0 HB2 GLN A 66 6.350 -9.421 -2.667 1.00 0.00 H new ATOM 0 HB3 GLN A 66 6.176 -9.196 -4.397 1.00 0.00 H new ATOM 0 HG2 GLN A 66 6.871 -6.726 -3.933 1.00 0.00 H new ATOM 0 HG3 GLN A 66 7.414 -7.321 -2.376 1.00 0.00 H new ATOM 0 HE21 GLN A 66 8.393 -6.624 -5.459 1.00 0.00 H new ATOM 0 HE22 GLN A 66 9.803 -7.682 -5.575 1.00 0.00 H new ATOM 960 N VAL A 67 4.229 -5.764 -3.478 1.00 0.00 N ATOM 961 CA VAL A 67 4.001 -4.522 -4.207 1.00 0.00 C ATOM 962 C VAL A 67 5.289 -4.013 -4.842 1.00 0.00 C ATOM 963 O VAL A 67 6.192 -3.541 -4.150 1.00 0.00 O ATOM 964 CB VAL A 67 3.428 -3.428 -3.286 1.00 0.00 C ATOM 965 CG1 VAL A 67 3.034 -2.201 -4.094 1.00 0.00 C ATOM 966 CG2 VAL A 67 2.240 -3.962 -2.499 1.00 0.00 C ATOM 0 H VAL A 67 4.150 -5.679 -2.465 1.00 0.00 H new ATOM 0 HA VAL A 67 3.276 -4.743 -4.991 1.00 0.00 H new ATOM 0 HB VAL A 67 4.202 -3.133 -2.577 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.631 -1.439 -3.426 1.00 0.00 H new ATOM 0 HG12 VAL A 67 3.911 -1.807 -4.608 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.277 -2.477 -4.828 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.848 -3.176 -1.854 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.462 -4.286 -3.190 1.00 0.00 H new ATOM 0 HG23 VAL A 67 2.558 -4.807 -1.889 1.00 0.00 H new ATOM 976 N VAL A 68 5.369 -4.110 -6.165 1.00 0.00 N ATOM 977 CA VAL A 68 6.547 -3.658 -6.896 1.00 0.00 C ATOM 978 C VAL A 68 6.492 -2.156 -7.151 1.00 0.00 C ATOM 979 O VAL A 68 7.415 -1.421 -6.797 1.00 0.00 O ATOM 980 CB VAL A 68 6.688 -4.391 -8.243 1.00 0.00 C ATOM 981 CG1 VAL A 68 7.920 -3.904 -8.990 1.00 0.00 C ATOM 982 CG2 VAL A 68 6.746 -5.896 -8.027 1.00 0.00 C ATOM 0 H VAL A 68 4.631 -4.498 -6.753 1.00 0.00 H new ATOM 0 HA VAL A 68 7.412 -3.887 -6.274 1.00 0.00 H new ATOM 0 HB VAL A 68 5.812 -4.168 -8.852 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.003 -4.433 -9.939 1.00 0.00 H new ATOM 0 HG12 VAL A 68 7.832 -2.834 -9.178 1.00 0.00 H new ATOM 0 HG13 VAL A 68 8.809 -4.095 -8.389 1.00 0.00 H new ATOM 0 HG21 VAL A 68 6.846 -6.398 -8.989 1.00 0.00 H new ATOM 0 HG22 VAL A 68 7.603 -6.141 -7.400 1.00 0.00 H new ATOM 0 HG23 VAL A 68 5.831 -6.229 -7.537 1.00 0.00 H new ATOM 992 N LEU A 69 5.404 -1.705 -7.766 1.00 0.00 N ATOM 993 CA LEU A 69 5.228 -0.289 -8.068 1.00 0.00 C ATOM 994 C LEU A 69 3.780 0.139 -7.847 1.00 0.00 C ATOM 995 O LEU A 69 2.850 -0.618 -8.125 1.00 0.00 O ATOM 996 CB LEU A 69 5.643 0.001 -9.512 1.00 0.00 C ATOM 997 CG LEU A 69 7.132 -0.149 -9.825 1.00 0.00 C ATOM 998 CD1 LEU A 69 7.366 -0.134 -11.328 1.00 0.00 C ATOM 999 CD2 LEU A 69 7.933 0.953 -9.147 1.00 0.00 C ATOM 0 H LEU A 69 4.631 -2.299 -8.065 1.00 0.00 H new ATOM 0 HA LEU A 69 5.864 0.283 -7.392 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.085 -0.665 -10.170 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.341 1.019 -9.758 1.00 0.00 H new ATOM 0 HG LEU A 69 7.471 -1.109 -9.435 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.431 -0.242 -11.531 1.00 0.00 H new ATOM 0 HD12 LEU A 69 6.823 -0.959 -11.789 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.011 0.810 -11.742 1.00 0.00 H new ATOM 0 HD21 LEU A 69 8.991 0.830 -9.381 1.00 0.00 H new ATOM 0 HD22 LEU A 69 7.592 1.924 -9.506 1.00 0.00 H new ATOM 0 HD23 LEU A 69 7.791 0.895 -8.068 1.00 0.00 H new ATOM 1011 N ILE A 70 3.598 1.357 -7.349 1.00 0.00 N ATOM 1012 CA ILE A 70 2.264 1.886 -7.094 1.00 0.00 C ATOM 1013 C ILE A 70 1.933 3.026 -8.052 1.00 0.00 C ATOM 1014 O ILE A 70 2.544 4.092 -7.998 1.00 0.00 O ATOM 1015 CB ILE A 70 2.125 2.390 -5.646 1.00 0.00 C ATOM 1016 CG1 ILE A 70 2.333 1.239 -4.660 1.00 0.00 C ATOM 1017 CG2 ILE A 70 0.762 3.033 -5.437 1.00 0.00 C ATOM 1018 CD1 ILE A 70 2.432 1.688 -3.219 1.00 0.00 C ATOM 0 H ILE A 70 4.357 1.996 -7.114 1.00 0.00 H new ATOM 0 HA ILE A 70 1.564 1.066 -7.253 1.00 0.00 H new ATOM 0 HB ILE A 70 2.892 3.143 -5.464 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.507 0.535 -4.757 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.243 0.702 -4.928 1.00 0.00 H new ATOM 0 HG21 ILE A 70 0.679 3.384 -4.408 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.649 3.876 -6.119 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.020 2.300 -5.634 1.00 0.00 H new ATOM 0 HD11 ILE A 70 2.579 0.820 -2.577 1.00 0.00 H new ATOM 0 HD12 ILE A 70 3.276 2.369 -3.107 1.00 0.00 H new ATOM 0 HD13 ILE A 70 1.513 2.199 -2.933 1.00 0.00 H new ATOM 1030 N ASN A 71 0.960 2.793 -8.927 1.00 0.00 N ATOM 1031 CA ASN A 71 0.546 3.801 -9.896 1.00 0.00 C ATOM 1032 C ASN A 71 1.715 4.213 -10.785 1.00 0.00 C ATOM 1033 O ASN A 71 1.939 5.399 -11.024 1.00 0.00 O ATOM 1034 CB ASN A 71 -0.020 5.027 -9.177 1.00 0.00 C ATOM 1035 CG ASN A 71 -1.077 4.661 -8.153 1.00 0.00 C ATOM 1036 OD1 ASN A 71 -2.073 4.014 -8.477 1.00 0.00 O ATOM 1037 ND2 ASN A 71 -0.863 5.074 -6.909 1.00 0.00 N ATOM 0 H ASN A 71 0.444 1.915 -8.985 1.00 0.00 H new ATOM 0 HA ASN A 71 -0.231 3.367 -10.526 1.00 0.00 H new ATOM 0 HB2 ASN A 71 0.791 5.561 -8.682 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -0.450 5.709 -9.911 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -1.539 4.857 -6.176 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -0.023 5.608 -6.686 1.00 0.00 H new ATOM 1044 N GLY A 72 2.459 3.225 -11.272 1.00 0.00 N ATOM 1045 CA GLY A 72 3.596 3.504 -12.130 1.00 0.00 C ATOM 1046 C GLY A 72 4.585 4.458 -11.488 1.00 0.00 C ATOM 1047 O GLY A 72 5.222 5.256 -12.175 1.00 0.00 O ATOM 0 H GLY A 72 2.295 2.235 -11.088 1.00 0.00 H new ATOM 0 HA2 GLY A 72 4.102 2.570 -12.373 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.243 3.929 -13.070 1.00 0.00 H new ATOM 1051 N ARG A 73 4.712 4.377 -10.168 1.00 0.00 N ATOM 1052 CA ARG A 73 5.628 5.241 -9.434 1.00 0.00 C ATOM 1053 C ARG A 73 6.548 4.420 -8.535 1.00 0.00 C ATOM 1054 O ARG A 73 6.136 3.408 -7.967 1.00 0.00 O ATOM 1055 CB ARG A 73 4.845 6.252 -8.593 1.00 0.00 C ATOM 1056 CG ARG A 73 4.115 7.297 -9.421 1.00 0.00 C ATOM 1057 CD ARG A 73 2.984 7.940 -8.634 1.00 0.00 C ATOM 1058 NE ARG A 73 2.052 8.656 -9.501 1.00 0.00 N ATOM 1059 CZ ARG A 73 0.822 8.999 -9.134 1.00 0.00 C ATOM 1060 NH1 ARG A 73 0.378 8.692 -7.923 1.00 0.00 N ATOM 1061 NH2 ARG A 73 0.033 9.650 -9.980 1.00 0.00 N ATOM 0 H ARG A 73 4.192 3.722 -9.585 1.00 0.00 H new ATOM 0 HA ARG A 73 6.241 5.777 -10.158 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.121 5.717 -7.978 1.00 0.00 H new ATOM 0 HB3 ARG A 73 5.532 6.755 -7.912 1.00 0.00 H new ATOM 0 HG2 ARG A 73 4.819 8.065 -9.742 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.715 6.834 -10.323 1.00 0.00 H new ATOM 0 HD2 ARG A 73 2.446 7.171 -8.079 1.00 0.00 H new ATOM 0 HD3 ARG A 73 3.400 8.630 -7.900 1.00 0.00 H new ATOM 0 HE ARG A 73 2.362 8.906 -10.440 1.00 0.00 H new ATOM 0 HH11 ARG A 73 0.981 8.191 -7.270 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -0.567 8.957 -7.644 1.00 0.00 H new ATOM 0 HH21 ARG A 73 0.371 9.887 -10.913 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -0.911 9.913 -9.697 1.00 0.00 H new ATOM 1075 N ASP A 74 7.794 4.862 -8.412 1.00 0.00 N ATOM 1076 CA ASP A 74 8.773 4.169 -7.582 1.00 0.00 C ATOM 1077 C ASP A 74 8.583 4.520 -6.110 1.00 0.00 C ATOM 1078 O ASP A 74 8.864 5.642 -5.688 1.00 0.00 O ATOM 1079 CB ASP A 74 10.193 4.526 -8.025 1.00 0.00 C ATOM 1080 CG ASP A 74 10.487 6.007 -7.889 1.00 0.00 C ATOM 1081 OD1 ASP A 74 9.785 6.813 -8.535 1.00 0.00 O ATOM 1082 OD2 ASP A 74 11.419 6.360 -7.137 1.00 0.00 O ATOM 0 H ASP A 74 8.151 5.697 -8.876 1.00 0.00 H new ATOM 0 HA ASP A 74 8.622 3.096 -7.704 1.00 0.00 H new ATOM 0 HB2 ASP A 74 10.909 3.960 -7.429 1.00 0.00 H new ATOM 0 HB3 ASP A 74 10.333 4.225 -9.063 1.00 0.00 H new ATOM 1087 N ILE A 75 8.104 3.554 -5.334 1.00 0.00 N ATOM 1088 CA ILE A 75 7.876 3.761 -3.909 1.00 0.00 C ATOM 1089 C ILE A 75 8.817 2.901 -3.071 1.00 0.00 C ATOM 1090 O ILE A 75 8.578 2.677 -1.885 1.00 0.00 O ATOM 1091 CB ILE A 75 6.421 3.441 -3.519 1.00 0.00 C ATOM 1092 CG1 ILE A 75 6.108 1.969 -3.796 1.00 0.00 C ATOM 1093 CG2 ILE A 75 5.459 4.345 -4.274 1.00 0.00 C ATOM 1094 CD1 ILE A 75 6.491 1.045 -2.662 1.00 0.00 C ATOM 0 H ILE A 75 7.866 2.620 -5.668 1.00 0.00 H new ATOM 0 HA ILE A 75 8.074 4.814 -3.707 1.00 0.00 H new ATOM 0 HB ILE A 75 6.298 3.624 -2.452 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.041 1.864 -3.995 1.00 0.00 H new ATOM 0 HG13 ILE A 75 6.633 1.658 -4.700 1.00 0.00 H new ATOM 0 HG21 ILE A 75 4.435 4.106 -3.987 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.671 5.386 -4.030 1.00 0.00 H new ATOM 0 HG23 ILE A 75 5.581 4.191 -5.346 1.00 0.00 H new ATOM 0 HD11 ILE A 75 6.240 0.018 -2.929 1.00 0.00 H new ATOM 0 HD12 ILE A 75 7.563 1.120 -2.477 1.00 0.00 H new ATOM 0 HD13 ILE A 75 5.947 1.329 -1.761 1.00 0.00 H new ATOM 1106 N ALA A 76 9.888 2.424 -3.697 1.00 0.00 N ATOM 1107 CA ALA A 76 10.867 1.592 -3.008 1.00 0.00 C ATOM 1108 C ALA A 76 11.742 2.427 -2.081 1.00 0.00 C ATOM 1109 O ALA A 76 12.387 1.897 -1.177 1.00 0.00 O ATOM 1110 CB ALA A 76 11.726 0.844 -4.017 1.00 0.00 C ATOM 0 H ALA A 76 10.100 2.599 -4.679 1.00 0.00 H new ATOM 0 HA ALA A 76 10.327 0.867 -2.399 1.00 0.00 H new ATOM 0 HB1 ALA A 76 12.453 0.227 -3.489 1.00 0.00 H new ATOM 0 HB2 ALA A 76 11.091 0.209 -4.635 1.00 0.00 H new ATOM 0 HB3 ALA A 76 12.250 1.560 -4.650 1.00 0.00 H new ATOM 1116 N GLU A 77 11.760 3.737 -2.312 1.00 0.00 N ATOM 1117 CA GLU A 77 12.558 4.645 -1.497 1.00 0.00 C ATOM 1118 C GLU A 77 11.711 5.274 -0.394 1.00 0.00 C ATOM 1119 O GLU A 77 12.195 6.097 0.383 1.00 0.00 O ATOM 1120 CB GLU A 77 13.175 5.740 -2.369 1.00 0.00 C ATOM 1121 CG GLU A 77 12.152 6.699 -2.955 1.00 0.00 C ATOM 1122 CD GLU A 77 12.753 8.042 -3.320 1.00 0.00 C ATOM 1123 OE1 GLU A 77 13.679 8.071 -4.157 1.00 0.00 O ATOM 1124 OE2 GLU A 77 12.297 9.065 -2.767 1.00 0.00 O ATOM 0 H GLU A 77 11.231 4.192 -3.056 1.00 0.00 H new ATOM 0 HA GLU A 77 13.357 4.067 -1.032 1.00 0.00 H new ATOM 0 HB2 GLU A 77 13.892 6.306 -1.774 1.00 0.00 H new ATOM 0 HB3 GLU A 77 13.732 5.275 -3.182 1.00 0.00 H new ATOM 0 HG2 GLU A 77 11.707 6.251 -3.843 1.00 0.00 H new ATOM 0 HG3 GLU A 77 11.347 6.849 -2.236 1.00 0.00 H new ATOM 1131 N HIS A 78 10.443 4.880 -0.333 1.00 0.00 N ATOM 1132 CA HIS A 78 9.527 5.405 0.674 1.00 0.00 C ATOM 1133 C HIS A 78 9.434 4.460 1.869 1.00 0.00 C ATOM 1134 O HIS A 78 9.555 3.243 1.723 1.00 0.00 O ATOM 1135 CB HIS A 78 8.139 5.619 0.070 1.00 0.00 C ATOM 1136 CG HIS A 78 8.016 6.890 -0.712 1.00 0.00 C ATOM 1137 ND1 HIS A 78 7.103 7.062 -1.732 1.00 0.00 N ATOM 1138 CD2 HIS A 78 8.696 8.057 -0.618 1.00 0.00 C ATOM 1139 CE1 HIS A 78 7.228 8.278 -2.231 1.00 0.00 C ATOM 1140 NE2 HIS A 78 8.188 8.903 -1.573 1.00 0.00 N ATOM 0 H HIS A 78 10.026 4.199 -0.968 1.00 0.00 H new ATOM 0 HA HIS A 78 9.916 6.363 1.019 1.00 0.00 H new ATOM 0 HB2 HIS A 78 7.901 4.777 -0.580 1.00 0.00 H new ATOM 0 HB3 HIS A 78 7.400 5.622 0.871 1.00 0.00 H new ATOM 0 HD2 HIS A 78 9.490 8.281 0.079 1.00 0.00 H new ATOM 0 HE1 HIS A 78 6.644 8.692 -3.040 1.00 0.00 H new ATOM 0 HE2 HIS A 78 8.501 9.858 -1.746 1.00 0.00 H new ATOM 1149 N THR A 79 9.220 5.029 3.051 1.00 0.00 N ATOM 1150 CA THR A 79 9.113 4.239 4.271 1.00 0.00 C ATOM 1151 C THR A 79 7.676 3.793 4.513 1.00 0.00 C ATOM 1152 O THR A 79 6.732 4.417 4.029 1.00 0.00 O ATOM 1153 CB THR A 79 9.607 5.030 5.498 1.00 0.00 C ATOM 1154 OG1 THR A 79 8.949 6.300 5.558 1.00 0.00 O ATOM 1155 CG2 THR A 79 11.113 5.234 5.439 1.00 0.00 C ATOM 0 H THR A 79 9.117 6.034 3.189 1.00 0.00 H new ATOM 0 HA THR A 79 9.745 3.361 4.135 1.00 0.00 H new ATOM 0 HB THR A 79 9.370 4.456 6.394 1.00 0.00 H new ATOM 0 HG1 THR A 79 9.267 6.796 6.341 1.00 0.00 H new ATOM 0 HG21 THR A 79 11.439 5.795 6.315 1.00 0.00 H new ATOM 0 HG22 THR A 79 11.611 4.265 5.423 1.00 0.00 H new ATOM 0 HG23 THR A 79 11.370 5.789 4.537 1.00 0.00 H new ATOM 1163 N HIS A 80 7.516 2.709 5.267 1.00 0.00 N ATOM 1164 CA HIS A 80 6.192 2.180 5.574 1.00 0.00 C ATOM 1165 C HIS A 80 5.179 3.310 5.733 1.00 0.00 C ATOM 1166 O HIS A 80 4.149 3.332 5.059 1.00 0.00 O ATOM 1167 CB HIS A 80 6.240 1.339 6.850 1.00 0.00 C ATOM 1168 CG HIS A 80 4.887 0.959 7.368 1.00 0.00 C ATOM 1169 ND1 HIS A 80 3.804 1.717 7.655 1.00 0.00 N flip ATOM 1170 CD2 HIS A 80 4.527 -0.342 7.650 1.00 0.00 C flip ATOM 1171 CE1 HIS A 80 2.819 0.870 8.100 1.00 0.00 C flip ATOM 1172 NE2 HIS A 80 3.281 -0.368 8.087 1.00 0.00 N flip ATOM 0 H HIS A 80 8.287 2.181 5.676 1.00 0.00 H new ATOM 0 HA HIS A 80 5.878 1.549 4.743 1.00 0.00 H new ATOM 0 HB2 HIS A 80 6.814 0.433 6.657 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.773 1.895 7.622 1.00 0.00 H new ATOM 0 HD2 HIS A 80 5.165 -1.205 7.532 1.00 0.00 H new ATOM 0 HE1 HIS A 80 1.828 1.167 8.410 1.00 0.00 H new ATOM 0 HE2 HIS A 80 2.764 -1.201 8.367 1.00 0.00 H new ATOM 1181 N ASP A 81 5.479 4.245 6.628 1.00 0.00 N ATOM 1182 CA ASP A 81 4.595 5.378 6.875 1.00 0.00 C ATOM 1183 C ASP A 81 4.321 6.145 5.585 1.00 0.00 C ATOM 1184 O ASP A 81 3.173 6.277 5.162 1.00 0.00 O ATOM 1185 CB ASP A 81 5.207 6.312 7.919 1.00 0.00 C ATOM 1186 CG ASP A 81 4.254 7.412 8.343 1.00 0.00 C ATOM 1187 OD1 ASP A 81 3.915 8.263 7.494 1.00 0.00 O ATOM 1188 OD2 ASP A 81 3.846 7.422 9.524 1.00 0.00 O ATOM 0 H ASP A 81 6.327 4.241 7.194 1.00 0.00 H new ATOM 0 HA ASP A 81 3.649 4.993 7.255 1.00 0.00 H new ATOM 0 HB2 ASP A 81 5.499 5.732 8.794 1.00 0.00 H new ATOM 0 HB3 ASP A 81 6.115 6.758 7.514 1.00 0.00 H new ATOM 1193 N GLN A 82 5.384 6.651 4.967 1.00 0.00 N ATOM 1194 CA GLN A 82 5.258 7.407 3.727 1.00 0.00 C ATOM 1195 C GLN A 82 4.405 6.651 2.713 1.00 0.00 C ATOM 1196 O GLN A 82 3.337 7.117 2.314 1.00 0.00 O ATOM 1197 CB GLN A 82 6.639 7.694 3.136 1.00 0.00 C ATOM 1198 CG GLN A 82 7.391 8.801 3.856 1.00 0.00 C ATOM 1199 CD GLN A 82 8.430 9.468 2.977 1.00 0.00 C ATOM 1200 OE1 GLN A 82 9.513 8.926 2.756 1.00 0.00 O ATOM 1201 NE2 GLN A 82 8.106 10.652 2.470 1.00 0.00 N ATOM 0 H GLN A 82 6.341 6.551 5.305 1.00 0.00 H new ATOM 0 HA GLN A 82 4.766 8.352 3.956 1.00 0.00 H new ATOM 0 HB2 GLN A 82 7.235 6.782 3.167 1.00 0.00 H new ATOM 0 HB3 GLN A 82 6.526 7.966 2.086 1.00 0.00 H new ATOM 0 HG2 GLN A 82 6.680 9.550 4.205 1.00 0.00 H new ATOM 0 HG3 GLN A 82 7.879 8.389 4.739 1.00 0.00 H new ATOM 0 HE21 GLN A 82 7.197 11.065 2.679 1.00 0.00 H new ATOM 0 HE22 GLN A 82 8.766 11.148 1.872 1.00 0.00 H new ATOM 1210 N VAL A 83 4.884 5.482 2.298 1.00 0.00 N ATOM 1211 CA VAL A 83 4.166 4.661 1.331 1.00 0.00 C ATOM 1212 C VAL A 83 2.666 4.670 1.609 1.00 0.00 C ATOM 1213 O VAL A 83 1.864 4.999 0.735 1.00 0.00 O ATOM 1214 CB VAL A 83 4.670 3.206 1.346 1.00 0.00 C ATOM 1215 CG1 VAL A 83 3.740 2.310 0.542 1.00 0.00 C ATOM 1216 CG2 VAL A 83 6.092 3.131 0.809 1.00 0.00 C ATOM 0 H VAL A 83 5.767 5.083 2.617 1.00 0.00 H new ATOM 0 HA VAL A 83 4.354 5.093 0.348 1.00 0.00 H new ATOM 0 HB VAL A 83 4.675 2.851 2.377 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.112 1.286 0.564 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.740 2.342 0.975 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.700 2.659 -0.490 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.433 2.096 0.826 1.00 0.00 H new ATOM 0 HG22 VAL A 83 6.114 3.503 -0.215 1.00 0.00 H new ATOM 0 HG23 VAL A 83 6.748 3.740 1.431 1.00 0.00 H new ATOM 1226 N VAL A 84 2.294 4.307 2.832 1.00 0.00 N ATOM 1227 CA VAL A 84 0.891 4.275 3.226 1.00 0.00 C ATOM 1228 C VAL A 84 0.174 5.554 2.811 1.00 0.00 C ATOM 1229 O VAL A 84 -0.931 5.511 2.268 1.00 0.00 O ATOM 1230 CB VAL A 84 0.740 4.085 4.747 1.00 0.00 C ATOM 1231 CG1 VAL A 84 -0.689 4.374 5.182 1.00 0.00 C ATOM 1232 CG2 VAL A 84 1.155 2.679 5.153 1.00 0.00 C ATOM 0 H VAL A 84 2.945 4.031 3.567 1.00 0.00 H new ATOM 0 HA VAL A 84 0.438 3.426 2.714 1.00 0.00 H new ATOM 0 HB VAL A 84 1.398 4.793 5.251 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.777 4.235 6.259 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.946 5.402 4.927 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.370 3.693 4.672 1.00 0.00 H new ATOM 0 HG21 VAL A 84 1.042 2.563 6.231 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.525 1.952 4.642 1.00 0.00 H new ATOM 0 HG23 VAL A 84 2.197 2.513 4.878 1.00 0.00 H new ATOM 1242 N LEU A 85 0.809 6.692 3.069 1.00 0.00 N ATOM 1243 CA LEU A 85 0.232 7.986 2.721 1.00 0.00 C ATOM 1244 C LEU A 85 0.252 8.203 1.211 1.00 0.00 C ATOM 1245 O LEU A 85 -0.636 8.850 0.655 1.00 0.00 O ATOM 1246 CB LEU A 85 0.996 9.112 3.420 1.00 0.00 C ATOM 1247 CG LEU A 85 0.494 9.501 4.811 1.00 0.00 C ATOM 1248 CD1 LEU A 85 0.920 8.467 5.841 1.00 0.00 C ATOM 1249 CD2 LEU A 85 1.005 10.882 5.195 1.00 0.00 C ATOM 0 H LEU A 85 1.723 6.745 3.518 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.805 7.996 3.057 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.042 8.817 3.502 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.963 9.996 2.783 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.595 9.532 4.788 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.554 8.761 6.825 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.504 7.495 5.574 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.008 8.402 5.863 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.638 11.143 6.188 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.095 10.878 5.200 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.648 11.616 4.472 1.00 0.00 H new ATOM 1261 N PHE A 86 1.269 7.657 0.554 1.00 0.00 N ATOM 1262 CA PHE A 86 1.405 7.789 -0.892 1.00 0.00 C ATOM 1263 C PHE A 86 0.177 7.234 -1.607 1.00 0.00 C ATOM 1264 O PHE A 86 -0.324 7.833 -2.559 1.00 0.00 O ATOM 1265 CB PHE A 86 2.662 7.064 -1.376 1.00 0.00 C ATOM 1266 CG PHE A 86 3.233 7.635 -2.643 1.00 0.00 C ATOM 1267 CD1 PHE A 86 3.652 8.955 -2.697 1.00 0.00 C ATOM 1268 CD2 PHE A 86 3.350 6.853 -3.780 1.00 0.00 C ATOM 1269 CE1 PHE A 86 4.178 9.483 -3.861 1.00 0.00 C ATOM 1270 CE2 PHE A 86 3.875 7.375 -4.947 1.00 0.00 C ATOM 1271 CZ PHE A 86 4.289 8.692 -4.987 1.00 0.00 C ATOM 0 H PHE A 86 2.012 7.119 1.000 1.00 0.00 H new ATOM 0 HA PHE A 86 1.492 8.850 -1.128 1.00 0.00 H new ATOM 0 HB2 PHE A 86 3.420 7.106 -0.594 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.426 6.012 -1.535 1.00 0.00 H new ATOM 0 HD1 PHE A 86 3.566 9.578 -1.819 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.027 5.823 -3.754 1.00 0.00 H new ATOM 0 HE1 PHE A 86 4.502 10.513 -3.890 1.00 0.00 H new ATOM 0 HE2 PHE A 86 3.961 6.754 -5.826 1.00 0.00 H new ATOM 0 HZ PHE A 86 4.699 9.103 -5.898 1.00 0.00 H new ATOM 1281 N ILE A 87 -0.303 6.086 -1.140 1.00 0.00 N ATOM 1282 CA ILE A 87 -1.472 5.449 -1.734 1.00 0.00 C ATOM 1283 C ILE A 87 -2.731 6.273 -1.486 1.00 0.00 C ATOM 1284 O ILE A 87 -3.603 6.370 -2.350 1.00 0.00 O ATOM 1285 CB ILE A 87 -1.683 4.029 -1.177 1.00 0.00 C ATOM 1286 CG1 ILE A 87 -0.415 3.193 -1.358 1.00 0.00 C ATOM 1287 CG2 ILE A 87 -2.866 3.362 -1.863 1.00 0.00 C ATOM 1288 CD1 ILE A 87 -0.392 1.938 -0.513 1.00 0.00 C ATOM 0 H ILE A 87 0.100 5.578 -0.352 1.00 0.00 H new ATOM 0 HA ILE A 87 -1.287 5.386 -2.806 1.00 0.00 H new ATOM 0 HB ILE A 87 -1.899 4.101 -0.111 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.319 2.916 -2.408 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.452 3.805 -1.109 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.003 2.359 -1.459 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -3.767 3.950 -1.688 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -2.677 3.299 -2.935 1.00 0.00 H new ATOM 0 HD11 ILE A 87 0.536 1.395 -0.693 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -0.456 2.208 0.541 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -1.239 1.306 -0.778 1.00 0.00 H new ATOM 1300 N LYS A 88 -2.819 6.867 -0.301 1.00 0.00 N ATOM 1301 CA LYS A 88 -3.970 7.686 0.062 1.00 0.00 C ATOM 1302 C LYS A 88 -4.165 8.823 -0.936 1.00 0.00 C ATOM 1303 O LYS A 88 -5.284 9.096 -1.369 1.00 0.00 O ATOM 1304 CB LYS A 88 -3.793 8.255 1.471 1.00 0.00 C ATOM 1305 CG LYS A 88 -3.966 7.222 2.571 1.00 0.00 C ATOM 1306 CD LYS A 88 -4.261 7.876 3.910 1.00 0.00 C ATOM 1307 CE LYS A 88 -2.988 8.373 4.579 1.00 0.00 C ATOM 1308 NZ LYS A 88 -3.222 8.758 5.999 1.00 0.00 N ATOM 0 H LYS A 88 -2.106 6.797 0.425 1.00 0.00 H new ATOM 0 HA LYS A 88 -4.856 7.052 0.042 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -2.800 8.698 1.553 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.514 9.059 1.622 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -4.778 6.544 2.310 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -3.061 6.620 2.651 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -4.947 8.710 3.765 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -4.762 7.161 4.563 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -2.226 7.594 4.534 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -2.600 9.230 4.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -2.331 9.091 6.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -3.930 9.519 6.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -3.568 7.933 6.530 1.00 0.00 H new ATOM 1322 N ALA A 89 -3.068 9.480 -1.298 1.00 0.00 N ATOM 1323 CA ALA A 89 -3.118 10.585 -2.248 1.00 0.00 C ATOM 1324 C ALA A 89 -4.112 10.300 -3.369 1.00 0.00 C ATOM 1325 O ALA A 89 -4.929 11.152 -3.719 1.00 0.00 O ATOM 1326 CB ALA A 89 -1.735 10.851 -2.822 1.00 0.00 C ATOM 0 H ALA A 89 -2.134 9.266 -0.948 1.00 0.00 H new ATOM 0 HA ALA A 89 -3.455 11.474 -1.716 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -1.788 11.678 -3.530 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -1.049 11.107 -2.015 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -1.376 9.958 -3.334 1.00 0.00 H new ATOM 1332 N SER A 90 -4.036 9.097 -3.930 1.00 0.00 N ATOM 1333 CA SER A 90 -4.926 8.702 -5.015 1.00 0.00 C ATOM 1334 C SER A 90 -6.313 9.308 -4.828 1.00 0.00 C ATOM 1335 O SER A 90 -6.911 9.821 -5.775 1.00 0.00 O ATOM 1336 CB SER A 90 -5.029 7.177 -5.089 1.00 0.00 C ATOM 1337 OG SER A 90 -3.970 6.631 -5.855 1.00 0.00 O ATOM 0 H SER A 90 -3.367 8.379 -3.651 1.00 0.00 H new ATOM 0 HA SER A 90 -4.508 9.077 -5.949 1.00 0.00 H new ATOM 0 HB2 SER A 90 -5.007 6.759 -4.083 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.985 6.895 -5.531 1.00 0.00 H new ATOM 0 HG SER A 90 -3.354 6.148 -5.265 1.00 0.00 H new ATOM 1343 N CYS A 91 -6.818 9.246 -3.602 1.00 0.00 N ATOM 1344 CA CYS A 91 -8.136 9.788 -3.289 1.00 0.00 C ATOM 1345 C CYS A 91 -8.331 11.153 -3.940 1.00 0.00 C ATOM 1346 O CYS A 91 -9.302 11.373 -4.664 1.00 0.00 O ATOM 1347 CB CYS A 91 -8.318 9.901 -1.775 1.00 0.00 C ATOM 1348 SG CYS A 91 -10.015 10.254 -1.259 1.00 0.00 S ATOM 0 H CYS A 91 -6.335 8.826 -2.808 1.00 0.00 H new ATOM 0 HA CYS A 91 -8.886 9.105 -3.687 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -7.995 8.969 -1.311 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -7.664 10.688 -1.399 1.00 0.00 H new ATOM 0 HG CYS A 91 -10.068 10.329 0.038 1.00 0.00 H new ATOM 1354 N GLU A 92 -7.402 12.067 -3.676 1.00 0.00 N ATOM 1355 CA GLU A 92 -7.474 13.412 -4.235 1.00 0.00 C ATOM 1356 C GLU A 92 -6.537 13.555 -5.431 1.00 0.00 C ATOM 1357 O GLU A 92 -5.449 14.118 -5.317 1.00 0.00 O ATOM 1358 CB GLU A 92 -7.119 14.451 -3.169 1.00 0.00 C ATOM 1359 CG GLU A 92 -7.129 15.880 -3.685 1.00 0.00 C ATOM 1360 CD GLU A 92 -6.723 16.886 -2.625 1.00 0.00 C ATOM 1361 OE1 GLU A 92 -7.603 17.321 -1.853 1.00 0.00 O ATOM 1362 OE2 GLU A 92 -5.526 17.237 -2.568 1.00 0.00 O ATOM 0 H GLU A 92 -6.592 11.901 -3.079 1.00 0.00 H new ATOM 0 HA GLU A 92 -8.496 13.583 -4.573 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -7.825 14.367 -2.343 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -6.131 14.225 -2.768 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -6.451 15.960 -4.535 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -8.127 16.124 -4.049 1.00 0.00 H new ATOM 1369 N ARG A 93 -6.969 13.039 -6.578 1.00 0.00 N ATOM 1370 CA ARG A 93 -6.169 13.107 -7.795 1.00 0.00 C ATOM 1371 C ARG A 93 -7.047 12.942 -9.032 1.00 0.00 C ATOM 1372 O ARG A 93 -7.884 12.041 -9.096 1.00 0.00 O ATOM 1373 CB ARG A 93 -5.084 12.029 -7.779 1.00 0.00 C ATOM 1374 CG ARG A 93 -3.856 12.388 -8.600 1.00 0.00 C ATOM 1375 CD ARG A 93 -2.973 13.390 -7.874 1.00 0.00 C ATOM 1376 NE ARG A 93 -1.572 13.270 -8.266 1.00 0.00 N ATOM 1377 CZ ARG A 93 -0.785 12.269 -7.888 1.00 0.00 C ATOM 1378 NH1 ARG A 93 -1.261 11.305 -7.112 1.00 0.00 N ATOM 1379 NH2 ARG A 93 0.479 12.229 -8.287 1.00 0.00 N ATOM 0 H ARG A 93 -7.868 12.570 -6.689 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.696 14.088 -7.834 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -4.781 11.846 -6.748 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -5.504 11.097 -8.158 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -3.284 11.485 -8.814 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -4.167 12.803 -9.559 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -3.323 14.401 -8.084 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -3.063 13.239 -6.798 1.00 0.00 H new ATOM 0 HE ARG A 93 -1.175 13.995 -8.863 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -2.233 11.331 -6.804 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -0.655 10.537 -6.823 1.00 0.00 H new ATOM 0 HH21 ARG A 93 0.849 12.968 -8.885 1.00 0.00 H new ATOM 0 HH22 ARG A 93 1.082 11.459 -7.996 1.00 0.00 H new ATOM 1393 N HIS A 94 -6.849 13.817 -10.013 1.00 0.00 N ATOM 1394 CA HIS A 94 -7.623 13.768 -11.248 1.00 0.00 C ATOM 1395 C HIS A 94 -7.857 12.326 -11.686 1.00 0.00 C ATOM 1396 O HIS A 94 -8.997 11.894 -11.852 1.00 0.00 O ATOM 1397 CB HIS A 94 -6.904 14.540 -12.356 1.00 0.00 C ATOM 1398 CG HIS A 94 -5.487 14.103 -12.567 1.00 0.00 C ATOM 1399 ND1 HIS A 94 -4.450 14.489 -11.744 1.00 0.00 N ATOM 1400 CD2 HIS A 94 -4.937 13.308 -13.514 1.00 0.00 C ATOM 1401 CE1 HIS A 94 -3.324 13.951 -12.176 1.00 0.00 C ATOM 1402 NE2 HIS A 94 -3.592 13.229 -13.249 1.00 0.00 N ATOM 0 H HIS A 94 -6.160 14.568 -9.977 1.00 0.00 H new ATOM 0 HA HIS A 94 -8.591 14.233 -11.060 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -7.456 14.419 -13.288 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -6.916 15.603 -12.114 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -5.459 12.825 -14.327 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -2.350 14.080 -11.728 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -2.911 12.699 -13.792 1.00 0.00 H new ATOM 1411 N SER A 95 -6.769 11.585 -11.873 1.00 0.00 N ATOM 1412 CA SER A 95 -6.855 10.193 -12.296 1.00 0.00 C ATOM 1413 C SER A 95 -7.901 9.440 -11.479 1.00 0.00 C ATOM 1414 O SER A 95 -8.955 9.067 -11.992 1.00 0.00 O ATOM 1415 CB SER A 95 -5.494 9.509 -12.155 1.00 0.00 C ATOM 1416 OG SER A 95 -5.369 8.429 -13.063 1.00 0.00 O ATOM 0 H SER A 95 -5.817 11.926 -11.738 1.00 0.00 H new ATOM 0 HA SER A 95 -7.155 10.176 -13.344 1.00 0.00 H new ATOM 0 HB2 SER A 95 -4.699 10.233 -12.335 1.00 0.00 H new ATOM 0 HB3 SER A 95 -5.370 9.146 -11.135 1.00 0.00 H new ATOM 0 HG SER A 95 -4.490 8.010 -12.954 1.00 0.00 H new ATOM 1422 N GLY A 96 -7.601 9.222 -10.202 1.00 0.00 N ATOM 1423 CA GLY A 96 -8.524 8.515 -9.333 1.00 0.00 C ATOM 1424 C GLY A 96 -8.205 7.037 -9.228 1.00 0.00 C ATOM 1425 O GLY A 96 -7.518 6.609 -8.301 1.00 0.00 O ATOM 0 H GLY A 96 -6.735 9.522 -9.754 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -8.496 8.961 -8.339 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -9.539 8.638 -9.709 1.00 0.00 H new ATOM 1429 N GLU A 97 -8.707 6.256 -10.179 1.00 0.00 N ATOM 1430 CA GLU A 97 -8.473 4.816 -10.186 1.00 0.00 C ATOM 1431 C GLU A 97 -7.014 4.501 -9.872 1.00 0.00 C ATOM 1432 O GLU A 97 -6.109 4.889 -10.612 1.00 0.00 O ATOM 1433 CB GLU A 97 -8.854 4.222 -11.544 1.00 0.00 C ATOM 1434 CG GLU A 97 -8.443 2.769 -11.709 1.00 0.00 C ATOM 1435 CD GLU A 97 -9.489 1.804 -11.183 1.00 0.00 C ATOM 1436 OE1 GLU A 97 -10.146 2.133 -10.174 1.00 0.00 O ATOM 1437 OE2 GLU A 97 -9.649 0.720 -11.782 1.00 0.00 O ATOM 0 H GLU A 97 -9.277 6.595 -10.954 1.00 0.00 H new ATOM 0 HA GLU A 97 -9.098 4.368 -9.413 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -9.933 4.303 -11.677 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -8.390 4.814 -12.333 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -8.263 2.564 -12.764 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -7.502 2.600 -11.186 1.00 0.00 H new ATOM 1444 N LEU A 98 -6.792 3.795 -8.768 1.00 0.00 N ATOM 1445 CA LEU A 98 -5.442 3.427 -8.354 1.00 0.00 C ATOM 1446 C LEU A 98 -5.060 2.055 -8.900 1.00 0.00 C ATOM 1447 O LEU A 98 -5.924 1.217 -9.158 1.00 0.00 O ATOM 1448 CB LEU A 98 -5.337 3.429 -6.828 1.00 0.00 C ATOM 1449 CG LEU A 98 -4.333 2.448 -6.223 1.00 0.00 C ATOM 1450 CD1 LEU A 98 -3.808 2.972 -4.896 1.00 0.00 C ATOM 1451 CD2 LEU A 98 -4.968 1.077 -6.043 1.00 0.00 C ATOM 0 H LEU A 98 -7.529 3.466 -8.144 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.750 4.165 -8.760 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -5.072 4.435 -6.503 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.322 3.210 -6.416 1.00 0.00 H new ATOM 0 HG LEU A 98 -3.492 2.349 -6.910 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.095 2.260 -4.480 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -3.314 3.931 -5.053 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -4.638 3.101 -4.202 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -4.238 0.392 -5.611 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -5.827 1.159 -5.377 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.294 0.697 -7.011 1.00 0.00 H new ATOM 1463 N MET A 99 -3.761 1.832 -9.071 1.00 0.00 N ATOM 1464 CA MET A 99 -3.265 0.560 -9.582 1.00 0.00 C ATOM 1465 C MET A 99 -2.043 0.098 -8.796 1.00 0.00 C ATOM 1466 O MET A 99 -1.194 0.906 -8.416 1.00 0.00 O ATOM 1467 CB MET A 99 -2.915 0.684 -11.066 1.00 0.00 C ATOM 1468 CG MET A 99 -4.130 0.835 -11.967 1.00 0.00 C ATOM 1469 SD MET A 99 -3.745 1.667 -13.520 1.00 0.00 S ATOM 1470 CE MET A 99 -4.847 0.812 -14.644 1.00 0.00 C ATOM 0 H MET A 99 -3.033 2.516 -8.863 1.00 0.00 H new ATOM 0 HA MET A 99 -4.053 -0.183 -9.463 1.00 0.00 H new ATOM 0 HB2 MET A 99 -2.260 1.544 -11.206 1.00 0.00 H new ATOM 0 HB3 MET A 99 -2.353 -0.198 -11.373 1.00 0.00 H new ATOM 0 HG2 MET A 99 -4.544 -0.151 -12.180 1.00 0.00 H new ATOM 0 HG3 MET A 99 -4.901 1.397 -11.440 1.00 0.00 H new ATOM 0 HE1 MET A 99 -4.639 1.126 -15.667 1.00 0.00 H new ATOM 0 HE2 MET A 99 -4.693 -0.264 -14.557 1.00 0.00 H new ATOM 0 HE3 MET A 99 -5.880 1.052 -14.394 1.00 0.00 H new ATOM 1480 N LEU A 100 -1.958 -1.206 -8.555 1.00 0.00 N ATOM 1481 CA LEU A 100 -0.839 -1.776 -7.814 1.00 0.00 C ATOM 1482 C LEU A 100 -0.158 -2.879 -8.618 1.00 0.00 C ATOM 1483 O LEU A 100 -0.746 -3.930 -8.873 1.00 0.00 O ATOM 1484 CB LEU A 100 -1.320 -2.331 -6.472 1.00 0.00 C ATOM 1485 CG LEU A 100 -2.405 -1.522 -5.761 1.00 0.00 C ATOM 1486 CD1 LEU A 100 -3.247 -2.423 -4.871 1.00 0.00 C ATOM 1487 CD2 LEU A 100 -1.782 -0.397 -4.946 1.00 0.00 C ATOM 0 H LEU A 100 -2.651 -1.888 -8.862 1.00 0.00 H new ATOM 0 HA LEU A 100 -0.114 -0.983 -7.634 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.695 -3.342 -6.633 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.461 -2.412 -5.806 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.056 -1.081 -6.516 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -4.014 -1.829 -4.373 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.722 -3.193 -5.479 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.610 -2.893 -4.122 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -2.568 0.169 -4.446 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.108 -0.818 -4.200 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -1.223 0.265 -5.607 1.00 0.00 H new ATOM 1499 N LEU A 101 1.086 -2.632 -9.014 1.00 0.00 N ATOM 1500 CA LEU A 101 1.850 -3.605 -9.788 1.00 0.00 C ATOM 1501 C LEU A 101 2.527 -4.619 -8.872 1.00 0.00 C ATOM 1502 O LEU A 101 3.565 -4.335 -8.274 1.00 0.00 O ATOM 1503 CB LEU A 101 2.899 -2.894 -10.645 1.00 0.00 C ATOM 1504 CG LEU A 101 3.459 -3.695 -11.821 1.00 0.00 C ATOM 1505 CD1 LEU A 101 2.345 -4.082 -12.782 1.00 0.00 C ATOM 1506 CD2 LEU A 101 4.536 -2.898 -12.544 1.00 0.00 C ATOM 0 H LEU A 101 1.587 -1.767 -8.812 1.00 0.00 H new ATOM 0 HA LEU A 101 1.158 -4.138 -10.440 1.00 0.00 H new ATOM 0 HB2 LEU A 101 2.460 -1.975 -11.033 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.729 -2.603 -10.001 1.00 0.00 H new ATOM 0 HG LEU A 101 3.909 -4.608 -11.432 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.762 -4.651 -13.612 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.608 -4.691 -12.258 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.865 -3.181 -13.165 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.923 -3.483 -13.378 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.110 -1.968 -12.920 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.347 -2.671 -11.852 1.00 0.00 H new ATOM 1518 N VAL A 102 1.934 -5.804 -8.768 1.00 0.00 N ATOM 1519 CA VAL A 102 2.481 -6.862 -7.927 1.00 0.00 C ATOM 1520 C VAL A 102 3.138 -7.949 -8.770 1.00 0.00 C ATOM 1521 O VAL A 102 2.989 -7.976 -9.992 1.00 0.00 O ATOM 1522 CB VAL A 102 1.391 -7.500 -7.046 1.00 0.00 C ATOM 1523 CG1 VAL A 102 0.623 -6.428 -6.287 1.00 0.00 C ATOM 1524 CG2 VAL A 102 0.449 -8.344 -7.891 1.00 0.00 C ATOM 0 H VAL A 102 1.074 -6.055 -9.256 1.00 0.00 H new ATOM 0 HA VAL A 102 3.231 -6.400 -7.285 1.00 0.00 H new ATOM 0 HB VAL A 102 1.873 -8.153 -6.318 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.143 -6.897 -5.670 1.00 0.00 H new ATOM 0 HG12 VAL A 102 1.310 -5.870 -5.651 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.151 -5.748 -6.996 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.315 -8.787 -7.252 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -0.027 -7.715 -8.643 1.00 0.00 H new ATOM 0 HG23 VAL A 102 1.013 -9.135 -8.384 1.00 0.00 H new ATOM 1534 N ARG A 103 3.864 -8.845 -8.110 1.00 0.00 N ATOM 1535 CA ARG A 103 4.544 -9.935 -8.799 1.00 0.00 C ATOM 1536 C ARG A 103 3.854 -11.268 -8.522 1.00 0.00 C ATOM 1537 O ARG A 103 3.480 -11.578 -7.391 1.00 0.00 O ATOM 1538 CB ARG A 103 6.009 -10.007 -8.363 1.00 0.00 C ATOM 1539 CG ARG A 103 6.862 -10.909 -9.240 1.00 0.00 C ATOM 1540 CD ARG A 103 8.250 -11.107 -8.652 1.00 0.00 C ATOM 1541 NE ARG A 103 9.244 -11.402 -9.681 1.00 0.00 N ATOM 1542 CZ ARG A 103 9.653 -10.515 -10.581 1.00 0.00 C ATOM 1543 NH1 ARG A 103 9.158 -9.285 -10.579 1.00 0.00 N ATOM 1544 NH2 ARG A 103 10.561 -10.859 -11.486 1.00 0.00 N ATOM 0 H ARG A 103 3.997 -8.838 -7.099 1.00 0.00 H new ATOM 0 HA ARG A 103 4.500 -9.738 -9.870 1.00 0.00 H new ATOM 0 HB2 ARG A 103 6.431 -9.002 -8.371 1.00 0.00 H new ATOM 0 HB3 ARG A 103 6.056 -10.365 -7.334 1.00 0.00 H new ATOM 0 HG2 ARG A 103 6.373 -11.876 -9.354 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.946 -10.475 -10.236 1.00 0.00 H new ATOM 0 HD2 ARG A 103 8.545 -10.209 -8.110 1.00 0.00 H new ATOM 0 HD3 ARG A 103 8.224 -11.922 -7.929 1.00 0.00 H new ATOM 0 HE ARG A 103 9.645 -12.339 -9.710 1.00 0.00 H new ATOM 0 HH11 ARG A 103 8.461 -9.017 -9.885 1.00 0.00 H new ATOM 0 HH12 ARG A 103 9.475 -8.607 -11.272 1.00 0.00 H new ATOM 0 HH21 ARG A 103 10.944 -11.804 -11.490 1.00 0.00 H new ATOM 0 HH22 ARG A 103 10.875 -10.178 -12.177 1.00 0.00 H new ATOM 1558 N PRO A 104 3.681 -12.075 -9.579 1.00 0.00 N ATOM 1559 CA PRO A 104 3.035 -13.387 -9.476 1.00 0.00 C ATOM 1560 C PRO A 104 3.892 -14.397 -8.722 1.00 0.00 C ATOM 1561 O PRO A 104 5.115 -14.409 -8.854 1.00 0.00 O ATOM 1562 CB PRO A 104 2.865 -13.815 -10.936 1.00 0.00 C ATOM 1563 CG PRO A 104 3.932 -13.081 -11.672 1.00 0.00 C ATOM 1564 CD PRO A 104 4.102 -11.769 -10.957 1.00 0.00 C ATOM 0 HA PRO A 104 2.099 -13.337 -8.920 1.00 0.00 H new ATOM 0 HB2 PRO A 104 2.977 -14.893 -11.048 1.00 0.00 H new ATOM 0 HB3 PRO A 104 1.875 -13.556 -11.312 1.00 0.00 H new ATOM 0 HG2 PRO A 104 4.864 -13.647 -11.675 1.00 0.00 H new ATOM 0 HG3 PRO A 104 3.650 -12.924 -12.713 1.00 0.00 H new ATOM 0 HD2 PRO A 104 5.135 -11.422 -10.994 1.00 0.00 H new ATOM 0 HD3 PRO A 104 3.487 -10.987 -11.401 1.00 0.00 H new ATOM 1572 N ASN A 105 3.242 -15.244 -7.930 1.00 0.00 N ATOM 1573 CA ASN A 105 3.946 -16.259 -7.154 1.00 0.00 C ATOM 1574 C ASN A 105 3.400 -17.651 -7.457 1.00 0.00 C ATOM 1575 O ASN A 105 3.309 -18.499 -6.570 1.00 0.00 O ATOM 1576 CB ASN A 105 3.821 -15.964 -5.658 1.00 0.00 C ATOM 1577 CG ASN A 105 4.636 -16.921 -4.810 1.00 0.00 C ATOM 1578 OD1 ASN A 105 5.837 -17.088 -5.023 1.00 0.00 O ATOM 1579 ND2 ASN A 105 3.985 -17.556 -3.842 1.00 0.00 N ATOM 0 H ASN A 105 2.229 -15.248 -7.809 1.00 0.00 H new ATOM 0 HA ASN A 105 4.998 -16.232 -7.436 1.00 0.00 H new ATOM 0 HB2 ASN A 105 4.147 -14.942 -5.463 1.00 0.00 H new ATOM 0 HB3 ASN A 105 2.773 -16.025 -5.365 1.00 0.00 H new ATOM 0 HD21 ASN A 105 4.481 -18.213 -3.239 1.00 0.00 H new ATOM 0 HD22 ASN A 105 2.989 -17.387 -3.701 1.00 0.00 H new ATOM 1586 N ALA A 106 3.040 -17.878 -8.716 1.00 0.00 N ATOM 1587 CA ALA A 106 2.506 -19.168 -9.136 1.00 0.00 C ATOM 1588 C ALA A 106 3.559 -19.982 -9.881 1.00 0.00 C ATOM 1589 O ALA A 106 4.624 -19.469 -10.227 1.00 0.00 O ATOM 1590 CB ALA A 106 1.275 -18.970 -10.009 1.00 0.00 C ATOM 0 H ALA A 106 3.108 -17.186 -9.462 1.00 0.00 H new ATOM 0 HA ALA A 106 2.220 -19.723 -8.243 1.00 0.00 H new ATOM 0 HB1 ALA A 106 0.886 -19.941 -10.316 1.00 0.00 H new ATOM 0 HB2 ALA A 106 0.511 -18.435 -9.445 1.00 0.00 H new ATOM 0 HB3 ALA A 106 1.545 -18.392 -10.893 1.00 0.00 H new ATOM 1596 N VAL A 107 3.256 -21.253 -10.123 1.00 0.00 N ATOM 1597 CA VAL A 107 4.177 -22.138 -10.826 1.00 0.00 C ATOM 1598 C VAL A 107 3.453 -22.945 -11.898 1.00 0.00 C ATOM 1599 O VAL A 107 2.379 -23.496 -11.655 1.00 0.00 O ATOM 1600 CB VAL A 107 4.877 -23.107 -9.855 1.00 0.00 C ATOM 1601 CG1 VAL A 107 5.737 -24.102 -10.620 1.00 0.00 C ATOM 1602 CG2 VAL A 107 5.711 -22.336 -8.843 1.00 0.00 C ATOM 0 H VAL A 107 2.380 -21.693 -9.843 1.00 0.00 H new ATOM 0 HA VAL A 107 4.927 -21.503 -11.297 1.00 0.00 H new ATOM 0 HB VAL A 107 4.114 -23.665 -9.313 1.00 0.00 H new ATOM 0 HG11 VAL A 107 6.224 -24.778 -9.917 1.00 0.00 H new ATOM 0 HG12 VAL A 107 5.110 -24.677 -11.301 1.00 0.00 H new ATOM 0 HG13 VAL A 107 6.495 -23.565 -11.190 1.00 0.00 H new ATOM 0 HG21 VAL A 107 6.199 -23.036 -8.165 1.00 0.00 H new ATOM 0 HG22 VAL A 107 6.467 -21.750 -9.366 1.00 0.00 H new ATOM 0 HG23 VAL A 107 5.065 -21.668 -8.273 1.00 0.00 H new ATOM 1612 N TYR A 108 4.047 -23.011 -13.084 1.00 0.00 N ATOM 1613 CA TYR A 108 3.458 -23.749 -14.194 1.00 0.00 C ATOM 1614 C TYR A 108 3.773 -25.238 -14.086 1.00 0.00 C ATOM 1615 O TYR A 108 4.937 -25.636 -14.033 1.00 0.00 O ATOM 1616 CB TYR A 108 3.972 -23.203 -15.527 1.00 0.00 C ATOM 1617 CG TYR A 108 3.860 -21.700 -15.650 1.00 0.00 C ATOM 1618 CD1 TYR A 108 2.623 -21.070 -15.603 1.00 0.00 C ATOM 1619 CD2 TYR A 108 4.992 -20.910 -15.813 1.00 0.00 C ATOM 1620 CE1 TYR A 108 2.515 -19.697 -15.715 1.00 0.00 C ATOM 1621 CE2 TYR A 108 4.894 -19.537 -15.924 1.00 0.00 C ATOM 1622 CZ TYR A 108 3.654 -18.935 -15.875 1.00 0.00 C ATOM 1623 OH TYR A 108 3.552 -17.567 -15.987 1.00 0.00 O ATOM 0 H TYR A 108 4.937 -22.562 -13.301 1.00 0.00 H new ATOM 0 HA TYR A 108 2.377 -23.621 -14.149 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.016 -23.492 -15.650 1.00 0.00 H new ATOM 0 HB3 TYR A 108 3.414 -23.668 -16.340 1.00 0.00 H new ATOM 0 HD1 TYR A 108 1.730 -21.664 -15.477 1.00 0.00 H new ATOM 0 HD2 TYR A 108 5.965 -21.378 -15.854 1.00 0.00 H new ATOM 0 HE1 TYR A 108 1.545 -19.223 -15.678 1.00 0.00 H new ATOM 0 HE2 TYR A 108 5.784 -18.938 -16.049 1.00 0.00 H new ATOM 0 HH TYR A 108 4.446 -17.180 -16.093 1.00 0.00 H new ATOM 1633 N ASP A 109 2.726 -26.056 -14.056 1.00 0.00 N ATOM 1634 CA ASP A 109 2.889 -27.502 -13.956 1.00 0.00 C ATOM 1635 C ASP A 109 1.775 -28.227 -14.705 1.00 0.00 C ATOM 1636 O ASP A 109 0.653 -27.730 -14.803 1.00 0.00 O ATOM 1637 CB ASP A 109 2.901 -27.936 -12.490 1.00 0.00 C ATOM 1638 CG ASP A 109 1.717 -27.391 -11.715 1.00 0.00 C ATOM 1639 OD1 ASP A 109 0.568 -27.630 -12.142 1.00 0.00 O ATOM 1640 OD2 ASP A 109 1.940 -26.726 -10.682 1.00 0.00 O ATOM 0 H ASP A 109 1.756 -25.743 -14.099 1.00 0.00 H new ATOM 0 HA ASP A 109 3.843 -27.768 -14.413 1.00 0.00 H new ATOM 0 HB2 ASP A 109 2.897 -29.025 -12.436 1.00 0.00 H new ATOM 0 HB3 ASP A 109 3.825 -27.598 -12.021 1.00 0.00 H new ATOM 1645 N VAL A 110 2.093 -29.405 -15.232 1.00 0.00 N ATOM 1646 CA VAL A 110 1.119 -30.199 -15.972 1.00 0.00 C ATOM 1647 C VAL A 110 -0.280 -30.038 -15.387 1.00 0.00 C ATOM 1648 O VAL A 110 -0.441 -29.812 -14.188 1.00 0.00 O ATOM 1649 CB VAL A 110 1.495 -31.693 -15.971 1.00 0.00 C ATOM 1650 CG1 VAL A 110 1.821 -32.160 -14.560 1.00 0.00 C ATOM 1651 CG2 VAL A 110 0.372 -32.525 -16.570 1.00 0.00 C ATOM 0 H VAL A 110 3.017 -29.831 -15.160 1.00 0.00 H new ATOM 0 HA VAL A 110 1.125 -29.831 -16.998 1.00 0.00 H new ATOM 0 HB VAL A 110 2.384 -31.827 -16.587 1.00 0.00 H new ATOM 0 HG11 VAL A 110 2.084 -33.218 -14.578 1.00 0.00 H new ATOM 0 HG12 VAL A 110 2.660 -31.584 -14.171 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.952 -32.014 -13.918 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.655 -33.578 -16.561 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.536 -32.388 -15.982 1.00 0.00 H new ATOM 0 HG23 VAL A 110 0.191 -32.206 -17.597 1.00 0.00 H new ATOM 1661 N VAL A 111 -1.290 -30.155 -16.243 1.00 0.00 N ATOM 1662 CA VAL A 111 -2.677 -30.024 -15.812 1.00 0.00 C ATOM 1663 C VAL A 111 -3.438 -31.331 -16.003 1.00 0.00 C ATOM 1664 O VAL A 111 -4.101 -31.531 -17.020 1.00 0.00 O ATOM 1665 CB VAL A 111 -3.401 -28.904 -16.582 1.00 0.00 C ATOM 1666 CG1 VAL A 111 -4.861 -28.825 -16.163 1.00 0.00 C ATOM 1667 CG2 VAL A 111 -2.702 -27.570 -16.363 1.00 0.00 C ATOM 0 H VAL A 111 -1.174 -30.340 -17.239 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.656 -29.771 -14.752 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.366 -29.137 -17.646 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -5.356 -28.028 -16.718 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -5.352 -29.774 -16.376 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -4.922 -28.616 -15.095 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -3.227 -26.790 -16.914 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -2.705 -27.328 -15.300 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -1.673 -27.636 -16.718 1.00 0.00 H new ATOM 1677 N GLU A 112 -3.337 -32.218 -15.017 1.00 0.00 N ATOM 1678 CA GLU A 112 -4.016 -33.507 -15.078 1.00 0.00 C ATOM 1679 C GLU A 112 -5.138 -33.579 -14.047 1.00 0.00 C ATOM 1680 O GLU A 112 -4.893 -33.518 -12.843 1.00 0.00 O ATOM 1681 CB GLU A 112 -3.020 -34.644 -14.845 1.00 0.00 C ATOM 1682 CG GLU A 112 -3.641 -36.028 -14.948 1.00 0.00 C ATOM 1683 CD GLU A 112 -2.721 -37.119 -14.437 1.00 0.00 C ATOM 1684 OE1 GLU A 112 -2.748 -37.394 -13.219 1.00 0.00 O ATOM 1685 OE2 GLU A 112 -1.975 -37.699 -15.254 1.00 0.00 O ATOM 0 H GLU A 112 -2.792 -32.067 -14.168 1.00 0.00 H new ATOM 0 HA GLU A 112 -4.451 -33.614 -16.072 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -2.212 -34.563 -15.572 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -2.573 -34.528 -13.858 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -4.572 -36.048 -14.381 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -3.897 -36.231 -15.988 1.00 0.00 H new ATOM 1692 N GLU A 113 -6.370 -33.709 -14.530 1.00 0.00 N ATOM 1693 CA GLU A 113 -7.530 -33.789 -13.650 1.00 0.00 C ATOM 1694 C GLU A 113 -8.756 -34.287 -14.410 1.00 0.00 C ATOM 1695 O GLU A 113 -9.321 -33.571 -15.236 1.00 0.00 O ATOM 1696 CB GLU A 113 -7.823 -32.420 -13.030 1.00 0.00 C ATOM 1697 CG GLU A 113 -8.581 -32.497 -11.716 1.00 0.00 C ATOM 1698 CD GLU A 113 -8.793 -31.135 -11.084 1.00 0.00 C ATOM 1699 OE1 GLU A 113 -9.191 -30.200 -11.809 1.00 0.00 O ATOM 1700 OE2 GLU A 113 -8.561 -31.005 -9.864 1.00 0.00 O ATOM 0 H GLU A 113 -6.590 -33.761 -15.525 1.00 0.00 H new ATOM 0 HA GLU A 113 -7.303 -34.499 -12.855 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -6.882 -31.896 -12.866 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -8.400 -31.826 -13.738 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -9.549 -32.969 -11.886 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -8.033 -33.134 -11.022 1.00 0.00 H new ATOM 1707 N SER A 114 -9.161 -35.521 -14.124 1.00 0.00 N ATOM 1708 CA SER A 114 -10.317 -36.118 -14.782 1.00 0.00 C ATOM 1709 C SER A 114 -11.612 -35.688 -14.101 1.00 0.00 C ATOM 1710 O SER A 114 -11.652 -35.486 -12.888 1.00 0.00 O ATOM 1711 CB SER A 114 -10.204 -37.644 -14.772 1.00 0.00 C ATOM 1712 OG SER A 114 -10.471 -38.167 -13.482 1.00 0.00 O ATOM 0 H SER A 114 -8.705 -36.126 -13.441 1.00 0.00 H new ATOM 0 HA SER A 114 -10.337 -35.769 -15.814 1.00 0.00 H new ATOM 0 HB2 SER A 114 -10.904 -38.068 -15.492 1.00 0.00 H new ATOM 0 HB3 SER A 114 -9.204 -37.940 -15.088 1.00 0.00 H new ATOM 0 HG SER A 114 -10.394 -39.144 -13.503 1.00 0.00 H new ATOM 1718 N GLY A 115 -12.672 -35.550 -14.892 1.00 0.00 N ATOM 1719 CA GLY A 115 -13.956 -35.145 -14.350 1.00 0.00 C ATOM 1720 C GLY A 115 -15.061 -35.180 -15.386 1.00 0.00 C ATOM 1721 O GLY A 115 -14.814 -35.324 -16.584 1.00 0.00 O ATOM 0 H GLY A 115 -12.664 -35.712 -15.899 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -14.220 -35.801 -13.520 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -13.874 -34.136 -13.945 1.00 0.00 H new ATOM 1725 N PRO A 116 -16.314 -35.049 -14.926 1.00 0.00 N ATOM 1726 CA PRO A 116 -17.486 -35.064 -15.806 1.00 0.00 C ATOM 1727 C PRO A 116 -17.572 -33.817 -16.680 1.00 0.00 C ATOM 1728 O PRO A 116 -17.839 -32.721 -16.189 1.00 0.00 O ATOM 1729 CB PRO A 116 -18.663 -35.114 -14.828 1.00 0.00 C ATOM 1730 CG PRO A 116 -18.139 -34.505 -13.574 1.00 0.00 C ATOM 1731 CD PRO A 116 -16.682 -34.874 -13.511 1.00 0.00 C ATOM 0 HA PRO A 116 -17.459 -35.899 -16.506 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -19.519 -34.558 -15.210 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -18.996 -36.138 -14.662 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -18.267 -33.423 -13.583 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -18.675 -34.883 -12.703 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -16.090 -34.092 -13.035 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -16.523 -35.788 -12.938 1.00 0.00 H new ATOM 1739 N SER A 117 -17.344 -33.993 -17.977 1.00 0.00 N ATOM 1740 CA SER A 117 -17.392 -32.881 -18.919 1.00 0.00 C ATOM 1741 C SER A 117 -18.733 -32.842 -19.646 1.00 0.00 C ATOM 1742 O SER A 117 -19.452 -33.840 -19.698 1.00 0.00 O ATOM 1743 CB SER A 117 -16.252 -32.994 -19.934 1.00 0.00 C ATOM 1744 OG SER A 117 -16.549 -33.959 -20.928 1.00 0.00 O ATOM 0 H SER A 117 -17.124 -34.895 -18.400 1.00 0.00 H new ATOM 0 HA SER A 117 -17.277 -31.955 -18.355 1.00 0.00 H new ATOM 0 HB2 SER A 117 -16.081 -32.025 -20.403 1.00 0.00 H new ATOM 0 HB3 SER A 117 -15.330 -33.267 -19.421 1.00 0.00 H new ATOM 0 HG SER A 117 -15.806 -34.011 -21.565 1.00 0.00 H new ATOM 1750 N SER A 118 -19.062 -31.683 -20.206 1.00 0.00 N ATOM 1751 CA SER A 118 -20.318 -31.511 -20.927 1.00 0.00 C ATOM 1752 C SER A 118 -20.062 -31.104 -22.375 1.00 0.00 C ATOM 1753 O SER A 118 -19.766 -29.945 -22.663 1.00 0.00 O ATOM 1754 CB SER A 118 -21.188 -30.460 -20.236 1.00 0.00 C ATOM 1755 OG SER A 118 -20.397 -29.404 -19.718 1.00 0.00 O ATOM 0 H SER A 118 -18.476 -30.849 -20.175 1.00 0.00 H new ATOM 0 HA SER A 118 -20.844 -32.466 -20.924 1.00 0.00 H new ATOM 0 HB2 SER A 118 -21.914 -30.061 -20.945 1.00 0.00 H new ATOM 0 HB3 SER A 118 -21.753 -30.925 -19.428 1.00 0.00 H new ATOM 0 HG SER A 118 -20.976 -28.744 -19.283 1.00 0.00 H new ATOM 1761 N GLY A 119 -20.178 -32.067 -23.284 1.00 0.00 N ATOM 1762 CA GLY A 119 -19.955 -31.791 -24.691 1.00 0.00 C ATOM 1763 C GLY A 119 -18.838 -32.630 -25.278 1.00 0.00 C ATOM 1764 O GLY A 119 -18.304 -33.517 -24.612 1.00 0.00 O ATOM 0 H GLY A 119 -20.423 -33.034 -23.071 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -20.875 -31.978 -25.245 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -19.716 -30.735 -24.817 1.00 0.00 H new TER 1768 GLY A 119