USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 832 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 80 THR OG1 : rot 95:sc= 0.385 USER MOD Set 1.2: B 68 LYS NZ :NH3+ 147:sc= -2.91! (180deg=-6.59!) USER MOD Set 2.1: B 62 THR OG1 : rot 180:sc= -0.308 USER MOD Set 2.2: B 64 GLN : amide:sc= 0.0818 K(o=-4,f=-7!) USER MOD Set 2.3: B 78 ASN : amide:sc= -3.81 K(o=-4,f=-7!) USER MOD Set 3.1: A 68 LYS NZ :NH3+ 146:sc= -3.19! (180deg=-6.56!) USER MOD Set 3.2: B 80 THR OG1 : rot 96:sc= 0.357 USER MOD Set 4.1: A 62 THR OG1 : rot 180:sc= -0.265 USER MOD Set 4.2: A 64 GLN : amide:sc= 0.0598 K(o=-4,f=-7.2!) USER MOD Set 4.3: A 78 ASN : amide:sc= -3.8 K(o=-4,f=-7.2!) USER MOD Single : A 32 SER OG : rot 32:sc= 0.404 USER MOD Single : A 37 HIS : no HD1:sc= -0.813 K(o=-0.81,f=-0.15) USER MOD Single : A 38 TYR OH : rot 180:sc= -0.0159 USER MOD Single : A 41 GLN : amide:sc= -1.65 X(o=-1.7,f=-1.9) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 MET CE :methyl 137:sc= -2.79! (180deg=-7.56!) USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : B 32 SER OG : rot 28:sc= 0.401 USER MOD Single : B 37 HIS : no HD1:sc= -0.805 K(o=-0.8,f=-0.13) USER MOD Single : B 38 TYR OH : rot 180:sc=-0.00921 USER MOD Single : B 41 GLN : amide:sc= -1.83 X(o=-1.8,f=-1.9) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 60 MET CE :methyl 137:sc= -2.89! (180deg=-7.55!) USER MOD Single : B 67 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 27 N SER A 32 6.404 -0.504 1.085 1.00 0.00 N ATOM 28 CA SER A 32 7.743 -1.022 0.685 1.00 0.00 C ATOM 29 C SER A 32 8.232 -0.296 -0.573 1.00 0.00 C ATOM 30 O SER A 32 9.420 -0.209 -0.819 1.00 0.00 O ATOM 31 CB SER A 32 7.647 -2.519 0.396 1.00 0.00 C ATOM 32 OG SER A 32 6.880 -3.146 1.417 1.00 0.00 O ATOM 0 HA SER A 32 8.447 -0.848 1.498 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.184 -2.684 -0.577 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.644 -2.958 0.353 1.00 0.00 H new ATOM 0 HG SER A 32 6.204 -2.519 1.750 1.00 0.00 H new ATOM 38 N ASP A 33 7.327 0.222 -1.369 1.00 0.00 N ATOM 39 CA ASP A 33 7.741 0.936 -2.610 1.00 0.00 C ATOM 40 C ASP A 33 8.065 2.407 -2.309 1.00 0.00 C ATOM 41 O ASP A 33 8.244 3.196 -3.214 1.00 0.00 O ATOM 42 CB ASP A 33 6.618 0.867 -3.646 1.00 0.00 C ATOM 43 CG ASP A 33 5.318 1.388 -3.029 1.00 0.00 C ATOM 44 OD1 ASP A 33 5.233 2.584 -2.801 1.00 0.00 O ATOM 45 OD2 ASP A 33 4.430 0.584 -2.799 1.00 0.00 O ATOM 0 H ASP A 33 6.320 0.179 -1.210 1.00 0.00 H new ATOM 0 HA ASP A 33 8.635 0.452 -3.002 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.880 1.461 -4.522 1.00 0.00 H new ATOM 0 HB3 ASP A 33 6.485 -0.160 -3.985 1.00 0.00 H new ATOM 50 N ALA A 34 8.152 2.782 -1.055 1.00 0.00 N ATOM 51 CA ALA A 34 8.477 4.191 -0.712 1.00 0.00 C ATOM 52 C ALA A 34 9.999 4.350 -0.550 1.00 0.00 C ATOM 53 O ALA A 34 10.509 5.453 -0.502 1.00 0.00 O ATOM 54 CB ALA A 34 7.784 4.563 0.599 1.00 0.00 C ATOM 0 H ALA A 34 8.010 2.165 -0.255 1.00 0.00 H new ATOM 0 HA ALA A 34 8.131 4.847 -1.511 1.00 0.00 H new ATOM 0 HB1 ALA A 34 8.020 5.596 0.855 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.706 4.455 0.484 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.132 3.904 1.394 1.00 0.00 H new ATOM 60 N GLU A 35 10.724 3.258 -0.458 1.00 0.00 N ATOM 61 CA GLU A 35 12.206 3.340 -0.293 1.00 0.00 C ATOM 62 C GLU A 35 12.868 4.044 -1.498 1.00 0.00 C ATOM 63 O GLU A 35 13.739 4.866 -1.298 1.00 0.00 O ATOM 64 CB GLU A 35 12.793 1.930 -0.136 1.00 0.00 C ATOM 65 CG GLU A 35 12.035 1.161 0.957 1.00 0.00 C ATOM 66 CD GLU A 35 12.886 1.095 2.229 1.00 0.00 C ATOM 67 OE1 GLU A 35 14.006 0.619 2.144 1.00 0.00 O ATOM 68 OE2 GLU A 35 12.402 1.520 3.265 1.00 0.00 O ATOM 0 H GLU A 35 10.347 2.311 -0.491 1.00 0.00 H new ATOM 0 HA GLU A 35 12.412 3.927 0.602 1.00 0.00 H new ATOM 0 HB2 GLU A 35 12.727 1.393 -1.082 1.00 0.00 H new ATOM 0 HB3 GLU A 35 13.850 1.994 0.121 1.00 0.00 H new ATOM 0 HG2 GLU A 35 11.085 1.653 1.169 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.802 0.154 0.611 1.00 0.00 H new ATOM 75 N PRO A 36 12.467 3.716 -2.717 1.00 0.00 N ATOM 76 CA PRO A 36 13.051 4.328 -3.955 1.00 0.00 C ATOM 77 C PRO A 36 12.344 5.642 -4.311 1.00 0.00 C ATOM 78 O PRO A 36 12.974 6.611 -4.685 1.00 0.00 O ATOM 79 CB PRO A 36 12.801 3.267 -5.020 1.00 0.00 C ATOM 80 CG PRO A 36 11.623 2.429 -4.559 1.00 0.00 C ATOM 81 CD PRO A 36 11.394 2.718 -3.073 1.00 0.00 C ATOM 0 HA PRO A 36 14.105 4.585 -3.846 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.588 3.732 -5.982 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.685 2.644 -5.156 1.00 0.00 H new ATOM 0 HG2 PRO A 36 10.732 2.673 -5.137 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.824 1.369 -4.715 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.398 3.125 -2.896 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.479 1.811 -2.474 1.00 0.00 H new ATOM 89 N HIS A 37 11.034 5.675 -4.208 1.00 0.00 N ATOM 90 CA HIS A 37 10.251 6.911 -4.546 1.00 0.00 C ATOM 91 C HIS A 37 10.185 7.122 -6.070 1.00 0.00 C ATOM 92 O HIS A 37 9.595 8.080 -6.535 1.00 0.00 O ATOM 93 CB HIS A 37 10.874 8.148 -3.883 1.00 0.00 C ATOM 94 CG HIS A 37 9.819 9.206 -3.703 1.00 0.00 C ATOM 95 ND1 HIS A 37 9.207 9.437 -2.481 1.00 0.00 N ATOM 96 CD2 HIS A 37 9.257 10.100 -4.580 1.00 0.00 C ATOM 97 CE1 HIS A 37 8.321 10.435 -2.655 1.00 0.00 C ATOM 98 NE2 HIS A 37 8.311 10.875 -3.917 1.00 0.00 N ATOM 0 H HIS A 37 10.466 4.886 -3.899 1.00 0.00 H new ATOM 0 HA HIS A 37 9.239 6.774 -4.165 1.00 0.00 H new ATOM 0 HB2 HIS A 37 11.303 7.879 -2.918 1.00 0.00 H new ATOM 0 HB3 HIS A 37 11.688 8.532 -4.498 1.00 0.00 H new ATOM 0 HD2 HIS A 37 9.511 10.188 -5.626 1.00 0.00 H new ATOM 0 HE1 HIS A 37 7.694 10.832 -1.870 1.00 0.00 H new ATOM 0 HE2 HIS A 37 7.734 11.619 -4.309 1.00 0.00 H new ATOM 106 N TYR A 38 10.764 6.239 -6.850 1.00 0.00 N ATOM 107 CA TYR A 38 10.710 6.390 -8.334 1.00 0.00 C ATOM 108 C TYR A 38 10.050 5.147 -8.935 1.00 0.00 C ATOM 109 O TYR A 38 9.314 5.228 -9.900 1.00 0.00 O ATOM 110 CB TYR A 38 12.124 6.557 -8.905 1.00 0.00 C ATOM 111 CG TYR A 38 13.050 5.510 -8.331 1.00 0.00 C ATOM 112 CD1 TYR A 38 13.113 4.235 -8.907 1.00 0.00 C ATOM 113 CD2 TYR A 38 13.851 5.817 -7.224 1.00 0.00 C ATOM 114 CE1 TYR A 38 13.976 3.269 -8.377 1.00 0.00 C ATOM 115 CE2 TYR A 38 14.713 4.850 -6.694 1.00 0.00 C ATOM 116 CZ TYR A 38 14.776 3.577 -7.270 1.00 0.00 C ATOM 117 OH TYR A 38 15.628 2.624 -6.747 1.00 0.00 O ATOM 0 H TYR A 38 11.272 5.419 -6.519 1.00 0.00 H new ATOM 0 HA TYR A 38 10.129 7.277 -8.587 1.00 0.00 H new ATOM 0 HB2 TYR A 38 12.097 6.472 -9.991 1.00 0.00 H new ATOM 0 HB3 TYR A 38 12.502 7.553 -8.673 1.00 0.00 H new ATOM 0 HD1 TYR A 38 12.495 3.997 -9.760 1.00 0.00 H new ATOM 0 HD2 TYR A 38 13.804 6.800 -6.779 1.00 0.00 H new ATOM 0 HE1 TYR A 38 14.025 2.286 -8.822 1.00 0.00 H new ATOM 0 HE2 TYR A 38 15.330 5.087 -5.840 1.00 0.00 H new ATOM 0 HH TYR A 38 16.111 3.001 -5.982 1.00 0.00 H new ATOM 127 N LEU A 39 10.295 3.995 -8.358 1.00 0.00 N ATOM 128 CA LEU A 39 9.679 2.732 -8.865 1.00 0.00 C ATOM 129 C LEU A 39 8.148 2.889 -9.019 1.00 0.00 C ATOM 130 O LEU A 39 7.614 2.574 -10.065 1.00 0.00 O ATOM 131 CB LEU A 39 9.986 1.595 -7.876 1.00 0.00 C ATOM 132 CG LEU A 39 10.653 0.415 -8.604 1.00 0.00 C ATOM 133 CD1 LEU A 39 9.767 -0.071 -9.761 1.00 0.00 C ATOM 134 CD2 LEU A 39 12.008 0.861 -9.159 1.00 0.00 C ATOM 0 H LEU A 39 10.903 3.877 -7.548 1.00 0.00 H new ATOM 0 HA LEU A 39 10.098 2.502 -9.844 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.641 1.960 -7.085 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.065 1.262 -7.398 1.00 0.00 H new ATOM 0 HG LEU A 39 10.791 -0.402 -7.896 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.253 -0.906 -10.266 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.803 -0.395 -9.370 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.616 0.743 -10.470 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.482 0.026 -9.675 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.862 1.684 -9.858 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.646 1.191 -8.339 1.00 0.00 H new ATOM 146 N PRO A 40 7.475 3.373 -7.987 1.00 0.00 N ATOM 147 CA PRO A 40 5.988 3.574 -8.015 1.00 0.00 C ATOM 148 C PRO A 40 5.624 4.792 -8.877 1.00 0.00 C ATOM 149 O PRO A 40 4.507 4.920 -9.345 1.00 0.00 O ATOM 150 CB PRO A 40 5.616 3.777 -6.553 1.00 0.00 C ATOM 151 CG PRO A 40 6.860 4.255 -5.838 1.00 0.00 C ATOM 152 CD PRO A 40 8.064 3.797 -6.660 1.00 0.00 C ATOM 0 HA PRO A 40 5.449 2.736 -8.457 1.00 0.00 H new ATOM 0 HB2 PRO A 40 4.813 4.508 -6.458 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.254 2.847 -6.115 1.00 0.00 H new ATOM 0 HG2 PRO A 40 6.853 5.341 -5.740 1.00 0.00 H new ATOM 0 HG3 PRO A 40 6.905 3.844 -4.830 1.00 0.00 H new ATOM 0 HD2 PRO A 40 8.788 4.602 -6.786 1.00 0.00 H new ATOM 0 HD3 PRO A 40 8.585 2.972 -6.175 1.00 0.00 H new ATOM 160 N GLN A 41 6.567 5.672 -9.111 1.00 0.00 N ATOM 161 CA GLN A 41 6.288 6.857 -9.969 1.00 0.00 C ATOM 162 C GLN A 41 6.214 6.376 -11.421 1.00 0.00 C ATOM 163 O GLN A 41 5.441 6.874 -12.224 1.00 0.00 O ATOM 164 CB GLN A 41 7.429 7.874 -9.808 1.00 0.00 C ATOM 165 CG GLN A 41 7.207 9.075 -10.733 1.00 0.00 C ATOM 166 CD GLN A 41 5.968 9.850 -10.279 1.00 0.00 C ATOM 167 OE1 GLN A 41 5.728 9.997 -9.098 1.00 0.00 O ATOM 168 NE2 GLN A 41 5.165 10.356 -11.176 1.00 0.00 N ATOM 0 H GLN A 41 7.517 5.618 -8.743 1.00 0.00 H new ATOM 0 HA GLN A 41 5.350 7.334 -9.685 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.483 8.209 -8.772 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.383 7.400 -10.039 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.081 9.726 -10.717 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.080 8.736 -11.761 1.00 0.00 H new ATOM 0 HE21 GLN A 41 5.366 10.233 -12.168 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.336 10.875 -10.884 1.00 0.00 H new ATOM 177 N LEU A 42 7.018 5.404 -11.758 1.00 0.00 N ATOM 178 CA LEU A 42 7.016 4.880 -13.140 1.00 0.00 C ATOM 179 C LEU A 42 5.744 4.067 -13.370 1.00 0.00 C ATOM 180 O LEU A 42 5.004 4.327 -14.290 1.00 0.00 O ATOM 181 CB LEU A 42 8.248 3.980 -13.356 1.00 0.00 C ATOM 182 CG LEU A 42 9.609 4.747 -13.275 1.00 0.00 C ATOM 183 CD1 LEU A 42 9.465 6.230 -12.880 1.00 0.00 C ATOM 184 CD2 LEU A 42 10.513 4.056 -12.250 1.00 0.00 C ATOM 0 H LEU A 42 7.678 4.952 -11.126 1.00 0.00 H new ATOM 0 HA LEU A 42 7.051 5.712 -13.843 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.243 3.187 -12.608 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.169 3.499 -14.331 1.00 0.00 H new ATOM 0 HG LEU A 42 10.037 4.723 -14.277 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.450 6.694 -12.845 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.848 6.744 -13.616 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.995 6.301 -11.899 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.464 4.585 -12.188 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.029 4.065 -11.274 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.691 3.026 -12.558 1.00 0.00 H new ATOM 196 N ARG A 43 5.481 3.083 -12.540 1.00 0.00 N ATOM 197 CA ARG A 43 4.251 2.242 -12.718 1.00 0.00 C ATOM 198 C ARG A 43 3.015 3.130 -12.908 1.00 0.00 C ATOM 199 O ARG A 43 2.191 2.882 -13.775 1.00 0.00 O ATOM 200 CB ARG A 43 4.069 1.325 -11.499 1.00 0.00 C ATOM 201 CG ARG A 43 3.731 2.137 -10.246 1.00 0.00 C ATOM 202 CD ARG A 43 3.623 1.198 -9.041 1.00 0.00 C ATOM 203 NE ARG A 43 3.337 2.000 -7.811 1.00 0.00 N ATOM 204 CZ ARG A 43 2.868 1.435 -6.715 1.00 0.00 C ATOM 205 NH1 ARG A 43 2.630 0.145 -6.653 1.00 0.00 N ATOM 206 NH2 ARG A 43 2.635 2.176 -5.667 1.00 0.00 N ATOM 0 H ARG A 43 6.066 2.825 -11.745 1.00 0.00 H new ATOM 0 HA ARG A 43 4.370 1.628 -13.611 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.274 0.606 -11.696 1.00 0.00 H new ATOM 0 HB3 ARG A 43 4.981 0.753 -11.331 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.501 2.887 -10.068 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.792 2.672 -10.389 1.00 0.00 H new ATOM 0 HD2 ARG A 43 2.831 0.468 -9.205 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.551 0.639 -8.917 1.00 0.00 H new ATOM 0 HE ARG A 43 3.508 3.005 -7.820 1.00 0.00 H new ATOM 0 HH11 ARG A 43 2.808 -0.446 -7.465 1.00 0.00 H new ATOM 0 HH12 ARG A 43 2.267 -0.266 -5.793 1.00 0.00 H new ATOM 0 HH21 ARG A 43 2.815 3.179 -5.701 1.00 0.00 H new ATOM 0 HH22 ARG A 43 2.272 1.752 -4.813 1.00 0.00 H new ATOM 220 N LYS A 44 2.886 4.173 -12.123 1.00 0.00 N ATOM 221 CA LYS A 44 1.719 5.063 -12.287 1.00 0.00 C ATOM 222 C LYS A 44 1.822 5.762 -13.646 1.00 0.00 C ATOM 223 O LYS A 44 0.823 6.102 -14.252 1.00 0.00 O ATOM 224 CB LYS A 44 1.672 6.090 -11.150 1.00 0.00 C ATOM 225 CG LYS A 44 2.920 6.971 -11.178 1.00 0.00 C ATOM 226 CD LYS A 44 2.731 8.158 -10.233 1.00 0.00 C ATOM 227 CE LYS A 44 2.726 7.664 -8.785 1.00 0.00 C ATOM 228 NZ LYS A 44 2.438 8.806 -7.871 1.00 0.00 N ATOM 0 H LYS A 44 3.539 4.436 -11.385 1.00 0.00 H new ATOM 0 HA LYS A 44 0.799 4.480 -12.249 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.780 6.709 -11.247 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.602 5.577 -10.191 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.794 6.391 -10.880 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.104 7.326 -12.192 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.532 8.883 -10.378 1.00 0.00 H new ATOM 0 HD3 LYS A 44 1.795 8.669 -10.457 1.00 0.00 H new ATOM 0 HE2 LYS A 44 1.975 6.884 -8.658 1.00 0.00 H new ATOM 0 HE3 LYS A 44 3.690 7.221 -8.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 2.435 8.470 -6.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 3.170 9.536 -7.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 1.508 9.210 -8.102 1.00 0.00 H new ATOM 242 N ASP A 45 3.029 5.965 -14.138 1.00 0.00 N ATOM 243 CA ASP A 45 3.186 6.623 -15.458 1.00 0.00 C ATOM 244 C ASP A 45 2.602 5.715 -16.543 1.00 0.00 C ATOM 245 O ASP A 45 1.841 6.163 -17.372 1.00 0.00 O ATOM 246 CB ASP A 45 4.664 6.893 -15.745 1.00 0.00 C ATOM 247 CG ASP A 45 5.203 7.914 -14.742 1.00 0.00 C ATOM 248 OD1 ASP A 45 4.456 8.804 -14.373 1.00 0.00 O ATOM 249 OD2 ASP A 45 6.355 7.788 -14.359 1.00 0.00 O ATOM 0 H ASP A 45 3.899 5.701 -13.676 1.00 0.00 H new ATOM 0 HA ASP A 45 2.656 7.575 -15.451 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.233 5.966 -15.677 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.785 7.268 -16.761 1.00 0.00 H new ATOM 254 N ILE A 46 2.940 4.438 -16.545 1.00 0.00 N ATOM 255 CA ILE A 46 2.377 3.517 -17.588 1.00 0.00 C ATOM 256 C ILE A 46 0.844 3.554 -17.522 1.00 0.00 C ATOM 257 O ILE A 46 0.171 3.453 -18.527 1.00 0.00 O ATOM 258 CB ILE A 46 2.929 2.085 -17.398 1.00 0.00 C ATOM 259 CG1 ILE A 46 2.893 1.375 -18.751 1.00 0.00 C ATOM 260 CG2 ILE A 46 2.126 1.271 -16.371 1.00 0.00 C ATOM 261 CD1 ILE A 46 3.892 2.031 -19.703 1.00 0.00 C ATOM 0 H ILE A 46 3.574 4.002 -15.876 1.00 0.00 H new ATOM 0 HA ILE A 46 2.684 3.849 -18.580 1.00 0.00 H new ATOM 0 HB ILE A 46 3.947 2.162 -17.015 1.00 0.00 H new ATOM 0 HG12 ILE A 46 3.135 0.320 -18.625 1.00 0.00 H new ATOM 0 HG13 ILE A 46 1.889 1.424 -19.172 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.558 0.275 -16.278 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.159 1.772 -15.404 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.091 1.188 -16.702 1.00 0.00 H new ATOM 0 HD11 ILE A 46 3.864 1.523 -20.667 1.00 0.00 H new ATOM 0 HD12 ILE A 46 3.630 3.080 -19.839 1.00 0.00 H new ATOM 0 HD13 ILE A 46 4.896 1.959 -19.284 1.00 0.00 H new ATOM 273 N LEU A 47 0.294 3.727 -16.342 1.00 0.00 N ATOM 274 CA LEU A 47 -1.186 3.805 -16.211 1.00 0.00 C ATOM 275 C LEU A 47 -1.671 5.027 -16.995 1.00 0.00 C ATOM 276 O LEU A 47 -2.640 4.971 -17.731 1.00 0.00 O ATOM 277 CB LEU A 47 -1.561 3.956 -14.736 1.00 0.00 C ATOM 278 CG LEU A 47 -1.514 2.589 -14.051 1.00 0.00 C ATOM 279 CD1 LEU A 47 -1.641 2.771 -12.538 1.00 0.00 C ATOM 280 CD2 LEU A 47 -2.672 1.727 -14.559 1.00 0.00 C ATOM 0 H LEU A 47 0.811 3.817 -15.468 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.650 2.899 -16.602 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.873 4.644 -14.244 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.559 4.385 -14.646 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.567 2.100 -14.279 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.607 1.797 -12.050 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.818 3.387 -12.175 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.588 3.259 -12.308 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.641 0.752 -14.072 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.618 2.217 -14.330 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.583 1.597 -15.638 1.00 0.00 H new ATOM 292 N GLU A 48 -0.972 6.124 -16.857 1.00 0.00 N ATOM 293 CA GLU A 48 -1.351 7.359 -17.602 1.00 0.00 C ATOM 294 C GLU A 48 -0.992 7.142 -19.068 1.00 0.00 C ATOM 295 O GLU A 48 -1.703 7.552 -19.963 1.00 0.00 O ATOM 296 CB GLU A 48 -0.588 8.597 -17.085 1.00 0.00 C ATOM 297 CG GLU A 48 -0.272 8.474 -15.587 1.00 0.00 C ATOM 298 CD GLU A 48 -0.505 9.819 -14.894 1.00 0.00 C ATOM 299 OE1 GLU A 48 -0.180 10.834 -15.489 1.00 0.00 O ATOM 300 OE2 GLU A 48 -1.003 9.813 -13.780 1.00 0.00 O ATOM 0 H GLU A 48 -0.152 6.217 -16.258 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.417 7.541 -17.465 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.339 8.715 -17.646 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.183 9.493 -17.261 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.902 7.708 -15.135 1.00 0.00 H new ATOM 0 HG3 GLU A 48 0.762 8.158 -15.449 1.00 0.00 H new ATOM 307 N VAL A 49 0.113 6.480 -19.311 1.00 0.00 N ATOM 308 CA VAL A 49 0.543 6.203 -20.710 1.00 0.00 C ATOM 309 C VAL A 49 -0.543 5.375 -21.393 1.00 0.00 C ATOM 310 O VAL A 49 -1.137 5.803 -22.358 1.00 0.00 O ATOM 311 CB VAL A 49 1.868 5.430 -20.697 1.00 0.00 C ATOM 312 CG1 VAL A 49 2.344 5.182 -22.134 1.00 0.00 C ATOM 313 CG2 VAL A 49 2.927 6.241 -19.934 1.00 0.00 C ATOM 0 H VAL A 49 0.738 6.118 -18.591 1.00 0.00 H new ATOM 0 HA VAL A 49 0.691 7.136 -21.253 1.00 0.00 H new ATOM 0 HB VAL A 49 1.718 4.470 -20.202 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.285 4.633 -22.116 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.594 4.600 -22.670 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.491 6.137 -22.639 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.869 5.692 -19.925 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.073 7.203 -20.426 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.592 6.404 -18.910 1.00 0.00 H new ATOM 323 N ILE A 50 -0.846 4.209 -20.869 1.00 0.00 N ATOM 324 CA ILE A 50 -1.935 3.373 -21.467 1.00 0.00 C ATOM 325 C ILE A 50 -3.218 4.214 -21.550 1.00 0.00 C ATOM 326 O ILE A 50 -4.074 3.973 -22.377 1.00 0.00 O ATOM 327 CB ILE A 50 -2.176 2.134 -20.597 1.00 0.00 C ATOM 328 CG1 ILE A 50 -0.869 1.346 -20.461 1.00 0.00 C ATOM 329 CG2 ILE A 50 -3.236 1.245 -21.252 1.00 0.00 C ATOM 330 CD1 ILE A 50 -0.791 0.721 -19.067 1.00 0.00 C ATOM 0 H ILE A 50 -0.386 3.802 -20.055 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.645 3.047 -22.466 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.521 2.446 -19.611 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.820 0.568 -21.223 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.016 2.005 -20.624 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.406 0.365 -20.632 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.167 1.803 -21.353 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.891 0.933 -22.238 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.139 0.161 -18.971 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.820 1.508 -18.313 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.636 0.048 -18.922 1.00 0.00 H new ATOM 342 N CYS A 51 -3.336 5.215 -20.708 1.00 0.00 N ATOM 343 CA CYS A 51 -4.531 6.093 -20.743 1.00 0.00 C ATOM 344 C CYS A 51 -4.448 7.010 -21.971 1.00 0.00 C ATOM 345 O CYS A 51 -5.397 7.159 -22.711 1.00 0.00 O ATOM 346 CB CYS A 51 -4.572 6.940 -19.466 1.00 0.00 C ATOM 347 SG CYS A 51 -6.253 7.556 -19.204 1.00 0.00 S ATOM 0 H CYS A 51 -2.646 5.456 -19.996 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.435 5.487 -20.804 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.255 6.343 -18.611 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -3.876 7.775 -19.548 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.289 8.273 -18.120 1.00 0.00 H new ATOM 353 N LYS A 52 -3.311 7.622 -22.194 1.00 0.00 N ATOM 354 CA LYS A 52 -3.158 8.539 -23.373 1.00 0.00 C ATOM 355 C LYS A 52 -3.467 7.789 -24.672 1.00 0.00 C ATOM 356 O LYS A 52 -3.954 8.361 -25.629 1.00 0.00 O ATOM 357 CB LYS A 52 -1.719 9.056 -23.454 1.00 0.00 C ATOM 358 CG LYS A 52 -1.334 9.775 -22.163 1.00 0.00 C ATOM 359 CD LYS A 52 0.186 9.684 -21.974 1.00 0.00 C ATOM 360 CE LYS A 52 0.843 10.970 -22.479 1.00 0.00 C ATOM 361 NZ LYS A 52 0.817 11.999 -21.401 1.00 0.00 N ATOM 0 H LYS A 52 -2.479 7.528 -21.611 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.851 9.370 -23.247 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.037 8.224 -23.631 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.618 9.736 -24.300 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.646 10.818 -22.206 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.847 9.324 -21.314 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.423 9.531 -20.921 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.580 8.825 -22.517 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.871 10.771 -22.781 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.317 11.338 -23.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.264 12.873 -21.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.168 12.196 -21.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.338 11.647 -20.572 1.00 0.00 H new ATOM 375 N TYR A 53 -3.163 6.521 -24.715 1.00 0.00 N ATOM 376 CA TYR A 53 -3.402 5.723 -25.946 1.00 0.00 C ATOM 377 C TYR A 53 -4.673 4.872 -25.790 1.00 0.00 C ATOM 378 O TYR A 53 -5.194 4.351 -26.758 1.00 0.00 O ATOM 379 CB TYR A 53 -2.205 4.791 -26.166 1.00 0.00 C ATOM 380 CG TYR A 53 -0.924 5.579 -26.377 1.00 0.00 C ATOM 381 CD1 TYR A 53 -0.388 6.355 -25.340 1.00 0.00 C ATOM 382 CD2 TYR A 53 -0.255 5.509 -27.606 1.00 0.00 C ATOM 383 CE1 TYR A 53 0.806 7.055 -25.526 1.00 0.00 C ATOM 384 CE2 TYR A 53 0.941 6.215 -27.793 1.00 0.00 C ATOM 385 CZ TYR A 53 1.472 6.987 -26.749 1.00 0.00 C ATOM 386 OH TYR A 53 2.652 7.679 -26.933 1.00 0.00 O ATOM 0 H TYR A 53 -2.754 6.000 -23.939 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.526 6.397 -26.794 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.092 4.132 -25.305 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.390 4.155 -27.032 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -0.901 6.412 -24.392 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.661 4.911 -28.409 1.00 0.00 H new ATOM 0 HE1 TYR A 53 1.214 7.649 -24.722 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.454 6.165 -28.742 1.00 0.00 H new ATOM 0 HH TYR A 53 2.985 7.522 -27.841 1.00 0.00 H new ATOM 396 N VAL A 54 -5.166 4.705 -24.581 1.00 0.00 N ATOM 397 CA VAL A 54 -6.391 3.864 -24.363 1.00 0.00 C ATOM 398 C VAL A 54 -7.119 4.394 -23.104 1.00 0.00 C ATOM 399 O VAL A 54 -7.229 5.589 -22.927 1.00 0.00 O ATOM 400 CB VAL A 54 -5.999 2.375 -24.192 1.00 0.00 C ATOM 401 CG1 VAL A 54 -7.200 1.493 -24.545 1.00 0.00 C ATOM 402 CG2 VAL A 54 -4.833 1.998 -25.118 1.00 0.00 C ATOM 0 H VAL A 54 -4.771 5.116 -23.735 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.054 3.929 -25.226 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.694 2.222 -23.157 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.929 0.444 -24.426 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -8.033 1.730 -23.882 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.495 1.676 -25.578 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.580 0.947 -24.976 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.124 2.164 -26.155 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.966 2.615 -24.881 1.00 0.00 H new ATOM 412 N GLN A 55 -7.622 3.541 -22.229 1.00 0.00 N ATOM 413 CA GLN A 55 -8.320 4.048 -21.009 1.00 0.00 C ATOM 414 C GLN A 55 -8.609 2.879 -20.065 1.00 0.00 C ATOM 415 O GLN A 55 -9.421 2.020 -20.350 1.00 0.00 O ATOM 416 CB GLN A 55 -9.630 4.732 -21.412 1.00 0.00 C ATOM 417 CG GLN A 55 -9.551 6.232 -21.107 1.00 0.00 C ATOM 418 CD GLN A 55 -10.858 6.908 -21.525 1.00 0.00 C ATOM 419 OE1 GLN A 55 -10.951 7.460 -22.604 1.00 0.00 O ATOM 420 NE2 GLN A 55 -11.877 6.890 -20.711 1.00 0.00 N ATOM 0 H GLN A 55 -7.576 2.525 -22.313 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.684 4.772 -20.499 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.819 4.578 -22.474 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.465 4.286 -20.871 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.372 6.389 -20.043 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -8.712 6.678 -21.640 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -11.798 6.427 -19.806 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.752 7.339 -20.980 1.00 0.00 H new ATOM 429 N ILE A 56 -7.943 2.850 -18.945 1.00 0.00 N ATOM 430 CA ILE A 56 -8.153 1.749 -17.957 1.00 0.00 C ATOM 431 C ILE A 56 -8.128 2.329 -16.546 1.00 0.00 C ATOM 432 O ILE A 56 -7.731 3.462 -16.339 1.00 0.00 O ATOM 433 CB ILE A 56 -7.043 0.698 -18.088 1.00 0.00 C ATOM 434 CG1 ILE A 56 -5.691 1.382 -18.334 1.00 0.00 C ATOM 435 CG2 ILE A 56 -7.362 -0.239 -19.250 1.00 0.00 C ATOM 436 CD1 ILE A 56 -4.597 0.640 -17.566 1.00 0.00 C ATOM 0 H ILE A 56 -7.254 3.549 -18.667 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.116 1.277 -18.152 1.00 0.00 H new ATOM 0 HB ILE A 56 -6.986 0.126 -17.162 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.462 1.387 -19.400 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -5.734 2.423 -18.012 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.573 -0.985 -19.343 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -8.313 -0.738 -19.065 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.428 0.336 -20.174 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.637 1.125 -17.740 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -4.824 0.658 -16.500 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.549 -0.393 -17.909 1.00 0.00 H new ATOM 448 N ASP A 57 -8.538 1.559 -15.574 1.00 0.00 N ATOM 449 CA ASP A 57 -8.530 2.053 -14.170 1.00 0.00 C ATOM 450 C ASP A 57 -7.308 1.471 -13.447 1.00 0.00 C ATOM 451 O ASP A 57 -6.731 0.507 -13.914 1.00 0.00 O ATOM 452 CB ASP A 57 -9.810 1.602 -13.461 1.00 0.00 C ATOM 453 CG ASP A 57 -10.934 2.595 -13.758 1.00 0.00 C ATOM 454 OD1 ASP A 57 -11.587 2.434 -14.776 1.00 0.00 O ATOM 455 OD2 ASP A 57 -11.124 3.500 -12.962 1.00 0.00 O ATOM 0 H ASP A 57 -8.879 0.605 -15.694 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.481 3.142 -14.160 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.093 0.605 -13.798 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.640 1.539 -12.386 1.00 0.00 H new ATOM 460 N PRO A 58 -6.939 2.054 -12.326 1.00 0.00 N ATOM 461 CA PRO A 58 -5.766 1.586 -11.520 1.00 0.00 C ATOM 462 C PRO A 58 -6.123 0.288 -10.805 1.00 0.00 C ATOM 463 O PRO A 58 -5.284 -0.570 -10.600 1.00 0.00 O ATOM 464 CB PRO A 58 -5.514 2.724 -10.541 1.00 0.00 C ATOM 465 CG PRO A 58 -6.818 3.483 -10.403 1.00 0.00 C ATOM 466 CD PRO A 58 -7.618 3.240 -11.683 1.00 0.00 C ATOM 0 HA PRO A 58 -4.880 1.369 -12.117 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -5.188 2.338 -9.575 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -4.723 3.379 -10.906 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -7.373 3.139 -9.531 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.631 4.548 -10.262 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.665 3.029 -11.464 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -7.598 4.112 -12.336 1.00 0.00 H new ATOM 474 N GLU A 59 -7.373 0.123 -10.460 1.00 0.00 N ATOM 475 CA GLU A 59 -7.806 -1.136 -9.796 1.00 0.00 C ATOM 476 C GLU A 59 -7.717 -2.296 -10.801 1.00 0.00 C ATOM 477 O GLU A 59 -7.800 -3.451 -10.427 1.00 0.00 O ATOM 478 CB GLU A 59 -9.250 -0.988 -9.312 1.00 0.00 C ATOM 479 CG GLU A 59 -9.278 -0.128 -8.046 1.00 0.00 C ATOM 480 CD GLU A 59 -10.726 0.232 -7.707 1.00 0.00 C ATOM 481 OE1 GLU A 59 -11.189 1.255 -8.185 1.00 0.00 O ATOM 482 OE2 GLU A 59 -11.348 -0.521 -6.975 1.00 0.00 O ATOM 0 H GLU A 59 -8.112 0.809 -10.611 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.159 -1.341 -8.943 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.860 -0.529 -10.090 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.679 -1.969 -9.108 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.822 -0.668 -7.216 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -8.692 0.779 -8.196 1.00 0.00 H new ATOM 489 N MET A 60 -7.546 -2.003 -12.077 1.00 0.00 N ATOM 490 CA MET A 60 -7.450 -3.086 -13.093 1.00 0.00 C ATOM 491 C MET A 60 -5.981 -3.472 -13.299 1.00 0.00 C ATOM 492 O MET A 60 -5.678 -4.561 -13.747 1.00 0.00 O ATOM 493 CB MET A 60 -8.043 -2.590 -14.415 1.00 0.00 C ATOM 494 CG MET A 60 -9.569 -2.685 -14.352 1.00 0.00 C ATOM 495 SD MET A 60 -10.294 -1.616 -15.619 1.00 0.00 S ATOM 496 CE MET A 60 -9.975 -2.698 -17.033 1.00 0.00 C ATOM 0 H MET A 60 -7.470 -1.056 -12.448 1.00 0.00 H new ATOM 0 HA MET A 60 -8.003 -3.960 -12.749 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.739 -1.560 -14.600 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.664 -3.188 -15.244 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.886 -3.716 -14.506 1.00 0.00 H new ATOM 0 HG3 MET A 60 -9.922 -2.387 -13.365 1.00 0.00 H new ATOM 0 HE1 MET A 60 -10.853 -2.721 -17.679 1.00 0.00 H new ATOM 0 HE2 MET A 60 -9.121 -2.320 -17.595 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.759 -3.706 -16.679 1.00 0.00 H new ATOM 506 N VAL A 61 -5.066 -2.587 -12.976 1.00 0.00 N ATOM 507 CA VAL A 61 -3.619 -2.904 -13.156 1.00 0.00 C ATOM 508 C VAL A 61 -3.021 -3.346 -11.816 1.00 0.00 C ATOM 509 O VAL A 61 -3.032 -2.607 -10.850 1.00 0.00 O ATOM 510 CB VAL A 61 -2.886 -1.658 -13.660 1.00 0.00 C ATOM 511 CG1 VAL A 61 -1.437 -2.016 -13.990 1.00 0.00 C ATOM 512 CG2 VAL A 61 -3.582 -1.135 -14.919 1.00 0.00 C ATOM 0 H VAL A 61 -5.262 -1.661 -12.596 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.509 -3.709 -13.882 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.902 -0.889 -12.888 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.916 -1.129 -14.349 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -0.942 -2.391 -13.094 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.419 -2.785 -14.763 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.062 -0.248 -15.280 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.565 -1.905 -15.691 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.615 -0.880 -14.684 1.00 0.00 H new ATOM 522 N THR A 62 -2.507 -4.550 -11.752 1.00 0.00 N ATOM 523 CA THR A 62 -1.915 -5.050 -10.482 1.00 0.00 C ATOM 524 C THR A 62 -0.425 -4.711 -10.430 1.00 0.00 C ATOM 525 O THR A 62 0.202 -4.461 -11.442 1.00 0.00 O ATOM 526 CB THR A 62 -2.083 -6.571 -10.397 1.00 0.00 C ATOM 527 OG1 THR A 62 -3.361 -6.934 -10.902 1.00 0.00 O ATOM 528 CG2 THR A 62 -1.965 -7.017 -8.939 1.00 0.00 C ATOM 0 H THR A 62 -2.474 -5.208 -12.531 1.00 0.00 H new ATOM 0 HA THR A 62 -2.426 -4.574 -9.645 1.00 0.00 H new ATOM 0 HB THR A 62 -1.307 -7.056 -10.988 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.469 -7.907 -10.850 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.085 -8.099 -8.879 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.985 -6.738 -8.551 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.741 -6.533 -8.346 1.00 0.00 H new ATOM 536 N VAL A 63 0.144 -4.713 -9.253 1.00 0.00 N ATOM 537 CA VAL A 63 1.595 -4.408 -9.109 1.00 0.00 C ATOM 538 C VAL A 63 2.186 -5.334 -8.047 1.00 0.00 C ATOM 539 O VAL A 63 1.631 -5.489 -6.975 1.00 0.00 O ATOM 540 CB VAL A 63 1.771 -2.955 -8.676 1.00 0.00 C ATOM 541 CG1 VAL A 63 3.261 -2.602 -8.647 1.00 0.00 C ATOM 542 CG2 VAL A 63 1.049 -2.040 -9.666 1.00 0.00 C ATOM 0 H VAL A 63 -0.341 -4.915 -8.378 1.00 0.00 H new ATOM 0 HA VAL A 63 2.104 -4.560 -10.061 1.00 0.00 H new ATOM 0 HB VAL A 63 1.350 -2.820 -7.680 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.383 -1.564 -8.338 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.776 -3.254 -7.941 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.686 -2.736 -9.642 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.173 -1.002 -9.359 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.471 -2.177 -10.662 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -0.012 -2.289 -9.684 1.00 0.00 H new ATOM 552 N GLN A 64 3.296 -5.959 -8.340 1.00 0.00 N ATOM 553 CA GLN A 64 3.914 -6.887 -7.350 1.00 0.00 C ATOM 554 C GLN A 64 5.438 -6.848 -7.479 1.00 0.00 C ATOM 555 O GLN A 64 5.984 -7.030 -8.550 1.00 0.00 O ATOM 556 CB GLN A 64 3.399 -8.310 -7.604 1.00 0.00 C ATOM 557 CG GLN A 64 3.582 -8.679 -9.085 1.00 0.00 C ATOM 558 CD GLN A 64 2.223 -8.683 -9.790 1.00 0.00 C ATOM 559 OE1 GLN A 64 1.665 -7.639 -10.065 1.00 0.00 O ATOM 560 NE2 GLN A 64 1.664 -9.822 -10.096 1.00 0.00 N ATOM 0 H GLN A 64 3.800 -5.867 -9.222 1.00 0.00 H new ATOM 0 HA GLN A 64 3.642 -6.578 -6.341 1.00 0.00 H new ATOM 0 HB2 GLN A 64 3.938 -9.018 -6.975 1.00 0.00 H new ATOM 0 HB3 GLN A 64 2.346 -8.379 -7.331 1.00 0.00 H new ATOM 0 HG2 GLN A 64 4.250 -7.965 -9.567 1.00 0.00 H new ATOM 0 HG3 GLN A 64 4.049 -9.660 -9.170 1.00 0.00 H new ATOM 0 HE21 GLN A 64 2.132 -10.698 -9.865 1.00 0.00 H new ATOM 0 HE22 GLN A 64 0.759 -9.836 -10.566 1.00 0.00 H new ATOM 569 N LEU A 65 6.126 -6.595 -6.392 1.00 0.00 N ATOM 570 CA LEU A 65 7.607 -6.523 -6.440 1.00 0.00 C ATOM 571 C LEU A 65 8.228 -7.803 -5.877 1.00 0.00 C ATOM 572 O LEU A 65 7.919 -8.229 -4.780 1.00 0.00 O ATOM 573 CB LEU A 65 8.074 -5.323 -5.616 1.00 0.00 C ATOM 574 CG LEU A 65 7.547 -5.430 -4.174 1.00 0.00 C ATOM 575 CD1 LEU A 65 8.723 -5.460 -3.193 1.00 0.00 C ATOM 576 CD2 LEU A 65 6.660 -4.222 -3.857 1.00 0.00 C ATOM 0 H LEU A 65 5.716 -6.435 -5.472 1.00 0.00 H new ATOM 0 HA LEU A 65 7.924 -6.412 -7.477 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.163 -5.278 -5.610 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.719 -4.399 -6.073 1.00 0.00 H new ATOM 0 HG LEU A 65 6.966 -6.347 -4.076 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.345 -5.536 -2.174 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.356 -6.320 -3.410 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.306 -4.545 -3.296 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.289 -4.301 -2.835 1.00 0.00 H new ATOM 0 HD22 LEU A 65 7.242 -3.306 -3.962 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.818 -4.198 -4.548 1.00 0.00 H new ATOM 588 N GLU A 66 9.116 -8.407 -6.624 1.00 0.00 N ATOM 589 CA GLU A 66 9.787 -9.650 -6.150 1.00 0.00 C ATOM 590 C GLU A 66 11.284 -9.374 -6.017 1.00 0.00 C ATOM 591 O GLU A 66 11.743 -8.285 -6.303 1.00 0.00 O ATOM 592 CB GLU A 66 9.548 -10.787 -7.155 1.00 0.00 C ATOM 593 CG GLU A 66 8.125 -11.333 -7.010 1.00 0.00 C ATOM 594 CD GLU A 66 7.914 -11.887 -5.597 1.00 0.00 C ATOM 595 OE1 GLU A 66 8.546 -12.876 -5.269 1.00 0.00 O ATOM 596 OE2 GLU A 66 7.123 -11.310 -4.869 1.00 0.00 O ATOM 0 H GLU A 66 9.406 -8.088 -7.549 1.00 0.00 H new ATOM 0 HA GLU A 66 9.379 -9.950 -5.185 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.703 -10.423 -8.171 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.270 -11.586 -6.989 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.402 -10.542 -7.211 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.952 -12.118 -7.746 1.00 0.00 H new ATOM 603 N GLN A 67 12.048 -10.342 -5.574 1.00 0.00 N ATOM 604 CA GLN A 67 13.515 -10.114 -5.415 1.00 0.00 C ATOM 605 C GLN A 67 14.290 -11.360 -5.839 1.00 0.00 C ATOM 606 O GLN A 67 13.717 -12.395 -6.126 1.00 0.00 O ATOM 607 CB GLN A 67 13.823 -9.786 -3.952 1.00 0.00 C ATOM 608 CG GLN A 67 12.934 -8.624 -3.497 1.00 0.00 C ATOM 609 CD GLN A 67 13.435 -8.076 -2.158 1.00 0.00 C ATOM 610 OE1 GLN A 67 14.166 -8.737 -1.449 1.00 0.00 O ATOM 611 NE2 GLN A 67 13.064 -6.882 -1.781 1.00 0.00 N ATOM 0 H GLN A 67 11.721 -11.273 -5.318 1.00 0.00 H new ATOM 0 HA GLN A 67 13.818 -9.280 -6.048 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.647 -10.661 -3.326 1.00 0.00 H new ATOM 0 HB3 GLN A 67 14.874 -9.521 -3.840 1.00 0.00 H new ATOM 0 HG2 GLN A 67 12.941 -7.834 -4.248 1.00 0.00 H new ATOM 0 HG3 GLN A 67 11.902 -8.961 -3.398 1.00 0.00 H new ATOM 0 HE21 GLN A 67 12.450 -6.327 -2.377 1.00 0.00 H new ATOM 0 HE22 GLN A 67 13.388 -6.505 -0.891 1.00 0.00 H new ATOM 620 N LYS A 68 15.593 -11.257 -5.893 1.00 0.00 N ATOM 621 CA LYS A 68 16.427 -12.422 -6.313 1.00 0.00 C ATOM 622 C LYS A 68 17.505 -12.686 -5.260 1.00 0.00 C ATOM 623 O LYS A 68 17.761 -11.863 -4.401 1.00 0.00 O ATOM 624 CB LYS A 68 17.104 -12.118 -7.655 1.00 0.00 C ATOM 625 CG LYS A 68 16.089 -11.521 -8.635 1.00 0.00 C ATOM 626 CD LYS A 68 16.571 -11.755 -10.069 1.00 0.00 C ATOM 627 CE LYS A 68 16.108 -10.615 -10.979 1.00 0.00 C ATOM 628 NZ LYS A 68 15.332 -11.176 -12.125 1.00 0.00 N ATOM 0 H LYS A 68 16.117 -10.413 -5.663 1.00 0.00 H new ATOM 0 HA LYS A 68 15.788 -13.299 -6.416 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.929 -11.422 -7.505 1.00 0.00 H new ATOM 0 HB3 LYS A 68 17.529 -13.031 -8.071 1.00 0.00 H new ATOM 0 HG2 LYS A 68 15.111 -11.980 -8.488 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.971 -10.454 -8.449 1.00 0.00 H new ATOM 0 HD2 LYS A 68 17.659 -11.825 -10.087 1.00 0.00 H new ATOM 0 HD3 LYS A 68 16.184 -12.705 -10.439 1.00 0.00 H new ATOM 0 HE2 LYS A 68 15.491 -9.914 -10.417 1.00 0.00 H new ATOM 0 HE3 LYS A 68 16.969 -10.057 -11.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 14.578 -10.511 -12.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 15.967 -11.323 -12.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 14.910 -12.085 -11.847 1.00 0.00 H new ATOM 642 N ASP A 69 18.140 -13.827 -5.329 1.00 0.00 N ATOM 643 CA ASP A 69 19.208 -14.159 -4.346 1.00 0.00 C ATOM 644 C ASP A 69 20.503 -13.407 -4.694 1.00 0.00 C ATOM 645 O ASP A 69 21.428 -13.367 -3.904 1.00 0.00 O ATOM 646 CB ASP A 69 19.474 -15.665 -4.376 1.00 0.00 C ATOM 647 CG ASP A 69 18.532 -16.370 -3.399 1.00 0.00 C ATOM 648 OD1 ASP A 69 17.365 -16.508 -3.728 1.00 0.00 O ATOM 649 OD2 ASP A 69 18.993 -16.759 -2.339 1.00 0.00 O ATOM 0 H ASP A 69 17.962 -14.546 -6.030 1.00 0.00 H new ATOM 0 HA ASP A 69 18.880 -13.860 -3.351 1.00 0.00 H new ATOM 0 HB2 ASP A 69 19.325 -16.051 -5.384 1.00 0.00 H new ATOM 0 HB3 ASP A 69 20.511 -15.867 -4.108 1.00 0.00 H new ATOM 654 N GLY A 70 20.582 -12.813 -5.865 1.00 0.00 N ATOM 655 CA GLY A 70 21.820 -12.072 -6.252 1.00 0.00 C ATOM 656 C GLY A 70 21.647 -10.578 -5.967 1.00 0.00 C ATOM 657 O GLY A 70 22.193 -9.742 -6.661 1.00 0.00 O ATOM 0 H GLY A 70 19.841 -12.812 -6.566 1.00 0.00 H new ATOM 0 HA2 GLY A 70 22.674 -12.460 -5.697 1.00 0.00 H new ATOM 0 HA3 GLY A 70 22.030 -12.227 -7.310 1.00 0.00 H new ATOM 661 N ASP A 71 20.886 -10.241 -4.956 1.00 0.00 N ATOM 662 CA ASP A 71 20.662 -8.804 -4.609 1.00 0.00 C ATOM 663 C ASP A 71 20.006 -8.092 -5.789 1.00 0.00 C ATOM 664 O ASP A 71 20.428 -7.027 -6.204 1.00 0.00 O ATOM 665 CB ASP A 71 21.999 -8.135 -4.269 1.00 0.00 C ATOM 666 CG ASP A 71 22.390 -8.476 -2.830 1.00 0.00 C ATOM 667 OD1 ASP A 71 21.896 -7.817 -1.930 1.00 0.00 O ATOM 668 OD2 ASP A 71 23.178 -9.390 -2.652 1.00 0.00 O ATOM 0 H ASP A 71 20.406 -10.907 -4.350 1.00 0.00 H new ATOM 0 HA ASP A 71 20.006 -8.739 -3.741 1.00 0.00 H new ATOM 0 HB2 ASP A 71 22.773 -8.475 -4.957 1.00 0.00 H new ATOM 0 HB3 ASP A 71 21.918 -7.055 -4.389 1.00 0.00 H new ATOM 673 N ILE A 72 18.977 -8.680 -6.334 1.00 0.00 N ATOM 674 CA ILE A 72 18.281 -8.060 -7.494 1.00 0.00 C ATOM 675 C ILE A 72 16.785 -7.962 -7.192 1.00 0.00 C ATOM 676 O ILE A 72 16.269 -8.663 -6.342 1.00 0.00 O ATOM 677 CB ILE A 72 18.505 -8.915 -8.744 1.00 0.00 C ATOM 678 CG1 ILE A 72 19.997 -9.299 -8.836 1.00 0.00 C ATOM 679 CG2 ILE A 72 18.083 -8.106 -9.977 1.00 0.00 C ATOM 680 CD1 ILE A 72 20.300 -9.999 -10.167 1.00 0.00 C ATOM 0 H ILE A 72 18.587 -9.569 -6.023 1.00 0.00 H new ATOM 0 HA ILE A 72 18.680 -7.061 -7.670 1.00 0.00 H new ATOM 0 HB ILE A 72 17.911 -9.827 -8.693 1.00 0.00 H new ATOM 0 HG12 ILE A 72 20.613 -8.405 -8.742 1.00 0.00 H new ATOM 0 HG13 ILE A 72 20.260 -9.956 -8.007 1.00 0.00 H new ATOM 0 HG21 ILE A 72 18.238 -8.704 -10.875 1.00 0.00 H new ATOM 0 HG22 ILE A 72 17.029 -7.841 -9.895 1.00 0.00 H new ATOM 0 HG23 ILE A 72 18.682 -7.197 -10.039 1.00 0.00 H new ATOM 0 HD11 ILE A 72 21.358 -10.260 -10.208 1.00 0.00 H new ATOM 0 HD12 ILE A 72 19.699 -10.905 -10.247 1.00 0.00 H new ATOM 0 HD13 ILE A 72 20.059 -9.330 -10.993 1.00 0.00 H new ATOM 692 N SER A 73 16.088 -7.091 -7.876 1.00 0.00 N ATOM 693 CA SER A 73 14.626 -6.933 -7.631 1.00 0.00 C ATOM 694 C SER A 73 13.853 -7.364 -8.874 1.00 0.00 C ATOM 695 O SER A 73 14.416 -7.546 -9.937 1.00 0.00 O ATOM 696 CB SER A 73 14.318 -5.468 -7.319 1.00 0.00 C ATOM 697 OG SER A 73 14.642 -5.199 -5.961 1.00 0.00 O ATOM 0 H SER A 73 16.472 -6.480 -8.597 1.00 0.00 H new ATOM 0 HA SER A 73 14.329 -7.554 -6.786 1.00 0.00 H new ATOM 0 HB2 SER A 73 14.891 -4.816 -7.978 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.264 -5.259 -7.502 1.00 0.00 H new ATOM 0 HG SER A 73 14.447 -4.260 -5.758 1.00 0.00 H new ATOM 703 N ILE A 74 12.565 -7.530 -8.743 1.00 0.00 N ATOM 704 CA ILE A 74 11.733 -7.954 -9.902 1.00 0.00 C ATOM 705 C ILE A 74 10.340 -7.322 -9.765 1.00 0.00 C ATOM 706 O ILE A 74 9.420 -7.938 -9.261 1.00 0.00 O ATOM 707 CB ILE A 74 11.634 -9.486 -9.904 1.00 0.00 C ATOM 708 CG1 ILE A 74 13.036 -10.066 -10.143 1.00 0.00 C ATOM 709 CG2 ILE A 74 10.665 -9.958 -11.005 1.00 0.00 C ATOM 710 CD1 ILE A 74 12.971 -11.593 -10.278 1.00 0.00 C ATOM 0 H ILE A 74 12.050 -7.388 -7.874 1.00 0.00 H new ATOM 0 HA ILE A 74 12.180 -7.627 -10.841 1.00 0.00 H new ATOM 0 HB ILE A 74 11.249 -9.833 -8.945 1.00 0.00 H new ATOM 0 HG12 ILE A 74 13.466 -9.633 -11.046 1.00 0.00 H new ATOM 0 HG13 ILE A 74 13.693 -9.796 -9.317 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.605 -11.046 -10.995 1.00 0.00 H new ATOM 0 HG22 ILE A 74 9.676 -9.538 -10.823 1.00 0.00 H new ATOM 0 HG23 ILE A 74 11.028 -9.624 -11.977 1.00 0.00 H new ATOM 0 HD11 ILE A 74 13.973 -11.986 -10.447 1.00 0.00 H new ATOM 0 HD12 ILE A 74 12.562 -12.022 -9.363 1.00 0.00 H new ATOM 0 HD13 ILE A 74 12.331 -11.857 -11.120 1.00 0.00 H new ATOM 722 N LEU A 75 10.186 -6.096 -10.198 1.00 0.00 N ATOM 723 CA LEU A 75 8.865 -5.417 -10.083 1.00 0.00 C ATOM 724 C LEU A 75 7.963 -5.807 -11.252 1.00 0.00 C ATOM 725 O LEU A 75 8.121 -5.333 -12.361 1.00 0.00 O ATOM 726 CB LEU A 75 9.066 -3.900 -10.068 1.00 0.00 C ATOM 727 CG LEU A 75 7.801 -3.210 -9.523 1.00 0.00 C ATOM 728 CD1 LEU A 75 8.168 -2.323 -8.329 1.00 0.00 C ATOM 729 CD2 LEU A 75 7.170 -2.347 -10.623 1.00 0.00 C ATOM 0 H LEU A 75 10.923 -5.536 -10.627 1.00 0.00 H new ATOM 0 HA LEU A 75 8.388 -5.729 -9.154 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.926 -3.644 -9.449 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.281 -3.543 -11.075 1.00 0.00 H new ATOM 0 HG LEU A 75 7.089 -3.971 -9.203 1.00 0.00 H new ATOM 0 HD11 LEU A 75 7.270 -1.837 -7.947 1.00 0.00 H new ATOM 0 HD12 LEU A 75 8.611 -2.935 -7.544 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.884 -1.565 -8.646 1.00 0.00 H new ATOM 0 HD21 LEU A 75 6.275 -1.860 -10.235 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.884 -1.590 -10.946 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.901 -2.977 -11.471 1.00 0.00 H new ATOM 741 N GLU A 76 7.004 -6.657 -10.995 1.00 0.00 N ATOM 742 CA GLU A 76 6.061 -7.084 -12.066 1.00 0.00 C ATOM 743 C GLU A 76 4.740 -6.340 -11.873 1.00 0.00 C ATOM 744 O GLU A 76 4.387 -5.975 -10.769 1.00 0.00 O ATOM 745 CB GLU A 76 5.803 -8.592 -11.963 1.00 0.00 C ATOM 746 CG GLU A 76 7.134 -9.350 -11.855 1.00 0.00 C ATOM 747 CD GLU A 76 7.323 -9.860 -10.423 1.00 0.00 C ATOM 748 OE1 GLU A 76 7.078 -9.095 -9.505 1.00 0.00 O ATOM 749 OE2 GLU A 76 7.709 -11.008 -10.270 1.00 0.00 O ATOM 0 H GLU A 76 6.834 -7.076 -10.081 1.00 0.00 H new ATOM 0 HA GLU A 76 6.489 -6.859 -13.043 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.183 -8.804 -11.092 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.251 -8.935 -12.838 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.145 -10.187 -12.554 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.960 -8.694 -12.130 1.00 0.00 H new ATOM 756 N LEU A 77 4.003 -6.119 -12.931 1.00 0.00 N ATOM 757 CA LEU A 77 2.701 -5.407 -12.795 1.00 0.00 C ATOM 758 C LEU A 77 1.706 -5.966 -13.811 1.00 0.00 C ATOM 759 O LEU A 77 2.000 -6.085 -14.984 1.00 0.00 O ATOM 760 CB LEU A 77 2.894 -3.902 -13.027 1.00 0.00 C ATOM 761 CG LEU A 77 3.666 -3.658 -14.325 1.00 0.00 C ATOM 762 CD1 LEU A 77 3.300 -2.282 -14.882 1.00 0.00 C ATOM 763 CD2 LEU A 77 5.169 -3.706 -14.038 1.00 0.00 C ATOM 0 H LEU A 77 4.247 -6.401 -13.880 1.00 0.00 H new ATOM 0 HA LEU A 77 2.314 -5.559 -11.787 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.924 -3.407 -13.075 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.434 -3.464 -12.187 1.00 0.00 H new ATOM 0 HG LEU A 77 3.408 -4.427 -15.053 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.849 -2.106 -15.807 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.229 -2.244 -15.083 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.560 -1.514 -14.154 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.721 -3.532 -14.961 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.425 -2.935 -13.311 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.432 -4.685 -13.637 1.00 0.00 H new ATOM 775 N ASN A 78 0.530 -6.315 -13.365 1.00 0.00 N ATOM 776 CA ASN A 78 -0.494 -6.868 -14.287 1.00 0.00 C ATOM 777 C ASN A 78 -1.314 -5.714 -14.852 1.00 0.00 C ATOM 778 O ASN A 78 -1.588 -4.750 -14.166 1.00 0.00 O ATOM 779 CB ASN A 78 -1.425 -7.796 -13.509 1.00 0.00 C ATOM 780 CG ASN A 78 -0.620 -8.787 -12.654 1.00 0.00 C ATOM 781 OD1 ASN A 78 -1.064 -9.192 -11.598 1.00 0.00 O ATOM 782 ND2 ASN A 78 0.548 -9.201 -13.066 1.00 0.00 N ATOM 0 H ASN A 78 0.235 -6.239 -12.391 1.00 0.00 H new ATOM 0 HA ASN A 78 -0.009 -7.421 -15.092 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.081 -7.206 -12.869 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -2.063 -8.343 -14.203 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.083 -9.861 -12.502 1.00 0.00 H new ATOM 0 HD22 ASN A 78 0.925 -8.864 -13.952 1.00 0.00 H new ATOM 789 N VAL A 79 -1.705 -5.804 -16.095 1.00 0.00 N ATOM 790 CA VAL A 79 -2.512 -4.708 -16.702 1.00 0.00 C ATOM 791 C VAL A 79 -3.793 -5.294 -17.298 1.00 0.00 C ATOM 792 O VAL A 79 -3.819 -5.738 -18.430 1.00 0.00 O ATOM 793 CB VAL A 79 -1.704 -4.014 -17.800 1.00 0.00 C ATOM 794 CG1 VAL A 79 -2.429 -2.738 -18.223 1.00 0.00 C ATOM 795 CG2 VAL A 79 -0.311 -3.653 -17.269 1.00 0.00 C ATOM 0 H VAL A 79 -1.501 -6.588 -16.715 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.767 -3.978 -15.934 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.601 -4.684 -18.654 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.859 -2.238 -19.006 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.420 -2.991 -18.601 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.527 -2.074 -17.365 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.261 -3.159 -18.054 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.410 -2.982 -16.415 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.207 -4.561 -16.959 1.00 0.00 H new ATOM 805 N THR A 80 -4.856 -5.300 -16.534 1.00 0.00 N ATOM 806 CA THR A 80 -6.146 -5.858 -17.033 1.00 0.00 C ATOM 807 C THR A 80 -6.807 -4.854 -17.987 1.00 0.00 C ATOM 808 O THR A 80 -7.390 -3.875 -17.560 1.00 0.00 O ATOM 809 CB THR A 80 -7.072 -6.129 -15.834 1.00 0.00 C ATOM 810 OG1 THR A 80 -6.491 -7.130 -15.010 1.00 0.00 O ATOM 811 CG2 THR A 80 -8.449 -6.603 -16.316 1.00 0.00 C ATOM 0 H THR A 80 -4.884 -4.940 -15.580 1.00 0.00 H new ATOM 0 HA THR A 80 -5.963 -6.789 -17.570 1.00 0.00 H new ATOM 0 HB THR A 80 -7.197 -5.206 -15.268 1.00 0.00 H new ATOM 0 HG1 THR A 80 -5.984 -6.705 -14.287 1.00 0.00 H new ATOM 0 HG21 THR A 80 -9.091 -6.790 -15.455 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.899 -5.834 -16.944 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.337 -7.522 -16.891 1.00 0.00 H new ATOM 819 N LEU A 81 -6.734 -5.104 -19.269 1.00 0.00 N ATOM 820 CA LEU A 81 -7.371 -4.186 -20.252 1.00 0.00 C ATOM 821 C LEU A 81 -8.815 -4.667 -20.504 1.00 0.00 C ATOM 822 O LEU A 81 -9.036 -5.852 -20.649 1.00 0.00 O ATOM 823 CB LEU A 81 -6.585 -4.235 -21.570 1.00 0.00 C ATOM 824 CG LEU A 81 -5.323 -3.364 -21.484 1.00 0.00 C ATOM 825 CD1 LEU A 81 -5.705 -1.906 -21.198 1.00 0.00 C ATOM 826 CD2 LEU A 81 -4.410 -3.884 -20.369 1.00 0.00 C ATOM 0 H LEU A 81 -6.258 -5.909 -19.676 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.375 -3.166 -19.868 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.307 -5.265 -21.795 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.216 -3.889 -22.388 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.796 -3.413 -22.437 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -4.802 -1.298 -21.139 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.342 -1.533 -22.000 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.243 -1.850 -20.251 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -3.516 -3.263 -20.312 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -4.940 -3.846 -19.417 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -4.124 -4.914 -20.584 1.00 0.00 H new ATOM 838 N PRO A 82 -9.764 -3.750 -20.548 1.00 0.00 N ATOM 839 CA PRO A 82 -11.207 -4.081 -20.780 1.00 0.00 C ATOM 840 C PRO A 82 -11.489 -4.249 -22.275 1.00 0.00 C ATOM 841 O PRO A 82 -10.599 -4.147 -23.099 1.00 0.00 O ATOM 842 CB PRO A 82 -11.944 -2.874 -20.219 1.00 0.00 C ATOM 843 CG PRO A 82 -10.981 -1.702 -20.256 1.00 0.00 C ATOM 844 CD PRO A 82 -9.565 -2.267 -20.377 1.00 0.00 C ATOM 0 HA PRO A 82 -11.511 -5.017 -20.311 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.835 -2.659 -20.809 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.277 -3.066 -19.199 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.206 -1.049 -21.099 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.077 -1.100 -19.352 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -9.037 -1.837 -21.228 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -8.972 -2.046 -19.489 1.00 0.00 H new ATOM 976 N SER B 32 1.711 -10.762 -31.724 1.00 0.00 N ATOM 977 CA SER B 32 0.324 -10.648 -31.191 1.00 0.00 C ATOM 978 C SER B 32 0.089 -9.240 -30.637 1.00 0.00 C ATOM 979 O SER B 32 -1.033 -8.773 -30.573 1.00 0.00 O ATOM 980 CB SER B 32 0.121 -11.667 -30.072 1.00 0.00 C ATOM 981 OG SER B 32 0.664 -12.920 -30.474 1.00 0.00 O ATOM 0 HA SER B 32 -0.382 -10.841 -31.999 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.607 -11.323 -29.159 1.00 0.00 H new ATOM 0 HB3 SER B 32 -0.941 -11.772 -29.848 1.00 0.00 H new ATOM 0 HG SER B 32 1.391 -12.771 -31.114 1.00 0.00 H new ATOM 987 N ASP B 33 1.137 -8.558 -30.235 1.00 0.00 N ATOM 988 CA ASP B 33 0.971 -7.184 -29.683 1.00 0.00 C ATOM 989 C ASP B 33 0.946 -6.143 -30.812 1.00 0.00 C ATOM 990 O ASP B 33 1.003 -4.957 -30.559 1.00 0.00 O ATOM 991 CB ASP B 33 2.123 -6.868 -28.729 1.00 0.00 C ATOM 992 CG ASP B 33 3.458 -7.098 -29.441 1.00 0.00 C ATOM 993 OD1 ASP B 33 3.779 -6.317 -30.322 1.00 0.00 O ATOM 994 OD2 ASP B 33 4.136 -8.050 -29.094 1.00 0.00 O ATOM 0 H ASP B 33 2.098 -8.898 -30.267 1.00 0.00 H new ATOM 0 HA ASP B 33 0.024 -7.142 -29.146 1.00 0.00 H new ATOM 0 HB2 ASP B 33 2.054 -5.835 -28.389 1.00 0.00 H new ATOM 0 HB3 ASP B 33 2.058 -7.500 -27.843 1.00 0.00 H new ATOM 999 N ALA B 34 0.853 -6.568 -32.050 1.00 0.00 N ATOM 1000 CA ALA B 34 0.810 -5.600 -33.176 1.00 0.00 C ATOM 1001 C ALA B 34 -0.650 -5.248 -33.508 1.00 0.00 C ATOM 1002 O ALA B 34 -0.917 -4.305 -34.229 1.00 0.00 O ATOM 1003 CB ALA B 34 1.474 -6.225 -34.404 1.00 0.00 C ATOM 0 H ALA B 34 0.805 -7.550 -32.323 1.00 0.00 H new ATOM 0 HA ALA B 34 1.341 -4.692 -32.891 1.00 0.00 H new ATOM 0 HB1 ALA B 34 1.445 -5.518 -35.233 1.00 0.00 H new ATOM 0 HB2 ALA B 34 2.511 -6.470 -34.172 1.00 0.00 H new ATOM 0 HB3 ALA B 34 0.941 -7.134 -34.683 1.00 0.00 H new ATOM 1009 N GLU B 35 -1.596 -6.001 -32.991 1.00 0.00 N ATOM 1010 CA GLU B 35 -3.033 -5.721 -33.276 1.00 0.00 C ATOM 1011 C GLU B 35 -3.446 -4.323 -32.764 1.00 0.00 C ATOM 1012 O GLU B 35 -4.135 -3.613 -33.469 1.00 0.00 O ATOM 1013 CB GLU B 35 -3.916 -6.791 -32.614 1.00 0.00 C ATOM 1014 CG GLU B 35 -3.416 -8.194 -32.993 1.00 0.00 C ATOM 1015 CD GLU B 35 -4.348 -8.811 -34.038 1.00 0.00 C ATOM 1016 OE1 GLU B 35 -5.535 -8.896 -33.769 1.00 0.00 O ATOM 1017 OE2 GLU B 35 -3.859 -9.189 -35.090 1.00 0.00 O ATOM 0 H GLU B 35 -1.428 -6.801 -32.381 1.00 0.00 H new ATOM 0 HA GLU B 35 -3.171 -5.745 -34.357 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -3.898 -6.670 -31.531 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -4.951 -6.667 -32.931 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -2.401 -8.134 -33.387 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -3.377 -8.828 -32.107 1.00 0.00 H new ATOM 1024 N PRO B 36 -3.039 -3.948 -31.559 1.00 0.00 N ATOM 1025 CA PRO B 36 -3.392 -2.620 -30.962 1.00 0.00 C ATOM 1026 C PRO B 36 -2.399 -1.534 -31.396 1.00 0.00 C ATOM 1027 O PRO B 36 -2.782 -0.424 -31.707 1.00 0.00 O ATOM 1028 CB PRO B 36 -3.298 -2.876 -29.463 1.00 0.00 C ATOM 1029 CG PRO B 36 -2.360 -4.052 -29.260 1.00 0.00 C ATOM 1030 CD PRO B 36 -2.180 -4.746 -30.611 1.00 0.00 C ATOM 0 HA PRO B 36 -4.372 -2.260 -31.276 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -2.923 -1.993 -28.946 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -4.282 -3.094 -29.049 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -1.399 -3.712 -28.874 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -2.770 -4.746 -28.526 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -1.136 -4.744 -30.923 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.497 -5.788 -30.568 1.00 0.00 H new ATOM 1038 N HIS B 37 -1.123 -1.847 -31.407 1.00 0.00 N ATOM 1039 CA HIS B 37 -0.073 -0.848 -31.806 1.00 0.00 C ATOM 1040 C HIS B 37 0.142 0.198 -30.698 1.00 0.00 C ATOM 1041 O HIS B 37 0.952 1.094 -30.843 1.00 0.00 O ATOM 1042 CB HIS B 37 -0.466 -0.138 -33.111 1.00 0.00 C ATOM 1043 CG HIS B 37 0.773 0.358 -33.804 1.00 0.00 C ATOM 1044 ND1 HIS B 37 1.334 -0.308 -34.882 1.00 0.00 N ATOM 1045 CD2 HIS B 37 1.572 1.452 -33.582 1.00 0.00 C ATOM 1046 CE1 HIS B 37 2.421 0.386 -35.266 1.00 0.00 C ATOM 1047 NE2 HIS B 37 2.612 1.468 -34.507 1.00 0.00 N ATOM 0 H HIS B 37 -0.758 -2.765 -31.153 1.00 0.00 H new ATOM 0 HA HIS B 37 0.858 -1.393 -31.962 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.010 -0.824 -33.761 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -1.134 0.696 -32.897 1.00 0.00 H new ATOM 0 HD2 HIS B 37 1.417 2.188 -32.807 1.00 0.00 H new ATOM 0 HE1 HIS B 37 3.061 0.102 -36.088 1.00 0.00 H new ATOM 0 HE2 HIS B 37 3.359 2.158 -34.588 1.00 0.00 H new ATOM 1055 N TYR B 38 -0.556 0.088 -29.590 1.00 0.00 N ATOM 1056 CA TYR B 38 -0.367 1.068 -28.478 1.00 0.00 C ATOM 1057 C TYR B 38 0.056 0.308 -27.217 1.00 0.00 C ATOM 1058 O TYR B 38 0.856 0.783 -26.436 1.00 0.00 O ATOM 1059 CB TYR B 38 -1.671 1.833 -28.214 1.00 0.00 C ATOM 1060 CG TYR B 38 -2.836 0.873 -28.128 1.00 0.00 C ATOM 1061 CD1 TYR B 38 -3.127 0.230 -26.919 1.00 0.00 C ATOM 1062 CD2 TYR B 38 -3.628 0.634 -29.256 1.00 0.00 C ATOM 1063 CE1 TYR B 38 -4.210 -0.654 -26.839 1.00 0.00 C ATOM 1064 CE2 TYR B 38 -4.711 -0.251 -29.177 1.00 0.00 C ATOM 1065 CZ TYR B 38 -5.002 -0.894 -27.968 1.00 0.00 C ATOM 1066 OH TYR B 38 -6.069 -1.764 -27.890 1.00 0.00 O ATOM 0 H TYR B 38 -1.248 -0.640 -29.411 1.00 0.00 H new ATOM 0 HA TYR B 38 0.404 1.788 -28.754 1.00 0.00 H new ATOM 0 HB2 TYR B 38 -1.587 2.398 -27.285 1.00 0.00 H new ATOM 0 HB3 TYR B 38 -1.845 2.555 -29.012 1.00 0.00 H new ATOM 0 HD1 TYR B 38 -2.516 0.416 -26.048 1.00 0.00 H new ATOM 0 HD2 TYR B 38 -3.404 1.132 -30.188 1.00 0.00 H new ATOM 0 HE1 TYR B 38 -4.434 -1.151 -25.906 1.00 0.00 H new ATOM 0 HE2 TYR B 38 -5.321 -0.437 -30.048 1.00 0.00 H new ATOM 0 HH TYR B 38 -6.513 -1.816 -28.762 1.00 0.00 H new ATOM 1076 N LEU B 39 -0.469 -0.877 -27.023 1.00 0.00 N ATOM 1077 CA LEU B 39 -0.101 -1.697 -25.829 1.00 0.00 C ATOM 1078 C LEU B 39 1.436 -1.809 -25.691 1.00 0.00 C ATOM 1079 O LEU B 39 1.964 -1.553 -24.625 1.00 0.00 O ATOM 1080 CB LEU B 39 -0.710 -3.101 -25.982 1.00 0.00 C ATOM 1081 CG LEU B 39 -1.559 -3.455 -24.747 1.00 0.00 C ATOM 1082 CD1 LEU B 39 -0.718 -3.342 -23.468 1.00 0.00 C ATOM 1083 CD2 LEU B 39 -2.746 -2.494 -24.656 1.00 0.00 C ATOM 0 H LEU B 39 -1.145 -1.315 -27.649 1.00 0.00 H new ATOM 0 HA LEU B 39 -0.490 -1.214 -24.933 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -1.328 -3.141 -26.879 1.00 0.00 H new ATOM 0 HB3 LEU B 39 0.084 -3.837 -26.109 1.00 0.00 H new ATOM 0 HG LEU B 39 -1.915 -4.480 -24.847 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -1.333 -3.595 -22.605 1.00 0.00 H new ATOM 0 HD12 LEU B 39 0.127 -4.029 -23.526 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -0.349 -2.322 -23.364 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -3.349 -2.742 -23.783 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -2.380 -1.471 -24.566 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -3.356 -2.583 -25.555 1.00 0.00 H new ATOM 1095 N PRO B 40 2.123 -2.179 -26.760 1.00 0.00 N ATOM 1096 CA PRO B 40 3.616 -2.320 -26.751 1.00 0.00 C ATOM 1097 C PRO B 40 4.289 -0.940 -26.747 1.00 0.00 C ATOM 1098 O PRO B 40 5.439 -0.802 -26.365 1.00 0.00 O ATOM 1099 CB PRO B 40 3.921 -3.100 -28.023 1.00 0.00 C ATOM 1100 CG PRO B 40 2.759 -2.883 -28.968 1.00 0.00 C ATOM 1101 CD PRO B 40 1.545 -2.502 -28.121 1.00 0.00 C ATOM 0 HA PRO B 40 3.994 -2.828 -25.864 1.00 0.00 H new ATOM 0 HB2 PRO B 40 4.852 -2.755 -28.472 1.00 0.00 H new ATOM 0 HB3 PRO B 40 4.046 -4.160 -27.804 1.00 0.00 H new ATOM 0 HG2 PRO B 40 2.989 -2.095 -29.685 1.00 0.00 H new ATOM 0 HG3 PRO B 40 2.558 -3.787 -29.542 1.00 0.00 H new ATOM 0 HD2 PRO B 40 1.019 -1.646 -28.543 1.00 0.00 H new ATOM 0 HD3 PRO B 40 0.827 -3.320 -28.064 1.00 0.00 H new ATOM 1109 N GLN B 41 3.573 0.084 -27.140 1.00 0.00 N ATOM 1110 CA GLN B 41 4.156 1.455 -27.124 1.00 0.00 C ATOM 1111 C GLN B 41 4.229 1.916 -25.666 1.00 0.00 C ATOM 1112 O GLN B 41 5.143 2.612 -25.257 1.00 0.00 O ATOM 1113 CB GLN B 41 3.248 2.395 -27.931 1.00 0.00 C ATOM 1114 CG GLN B 41 3.784 3.830 -27.876 1.00 0.00 C ATOM 1115 CD GLN B 41 5.124 3.907 -28.609 1.00 0.00 C ATOM 1116 OE1 GLN B 41 5.307 3.277 -29.631 1.00 0.00 O ATOM 1117 NE2 GLN B 41 6.076 4.658 -28.127 1.00 0.00 N ATOM 0 H GLN B 41 2.610 0.027 -27.471 1.00 0.00 H new ATOM 0 HA GLN B 41 5.152 1.463 -27.567 1.00 0.00 H new ATOM 0 HB2 GLN B 41 3.194 2.059 -28.967 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.234 2.363 -27.532 1.00 0.00 H new ATOM 0 HG2 GLN B 41 3.069 4.514 -28.333 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.907 4.143 -26.839 1.00 0.00 H new ATOM 0 HE21 GLN B 41 5.923 5.187 -27.269 1.00 0.00 H new ATOM 0 HE22 GLN B 41 6.973 4.716 -28.609 1.00 0.00 H new ATOM 1126 N LEU B 42 3.262 1.525 -24.880 1.00 0.00 N ATOM 1127 CA LEU B 42 3.248 1.926 -23.457 1.00 0.00 C ATOM 1128 C LEU B 42 4.332 1.158 -22.705 1.00 0.00 C ATOM 1129 O LEU B 42 5.174 1.744 -22.063 1.00 0.00 O ATOM 1130 CB LEU B 42 1.873 1.612 -22.842 1.00 0.00 C ATOM 1131 CG LEU B 42 0.703 2.451 -23.452 1.00 0.00 C ATOM 1132 CD1 LEU B 42 1.130 3.347 -24.632 1.00 0.00 C ATOM 1133 CD2 LEU B 42 -0.396 1.501 -23.936 1.00 0.00 C ATOM 0 H LEU B 42 2.478 0.941 -25.172 1.00 0.00 H new ATOM 0 HA LEU B 42 3.438 2.996 -23.380 1.00 0.00 H new ATOM 0 HB2 LEU B 42 1.658 0.552 -22.979 1.00 0.00 H new ATOM 0 HB3 LEU B 42 1.916 1.793 -21.768 1.00 0.00 H new ATOM 0 HG LEU B 42 0.351 3.111 -22.660 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.265 3.898 -25.002 1.00 0.00 H new ATOM 0 HD12 LEU B 42 1.892 4.051 -24.297 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.535 2.727 -25.432 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.215 2.080 -24.363 1.00 0.00 H new ATOM 0 HD22 LEU B 42 0.010 0.832 -24.695 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.766 0.914 -23.095 1.00 0.00 H new ATOM 1145 N ARG B 43 4.322 -0.155 -22.779 1.00 0.00 N ATOM 1146 CA ARG B 43 5.355 -0.968 -22.055 1.00 0.00 C ATOM 1147 C ARG B 43 6.763 -0.424 -22.337 1.00 0.00 C ATOM 1148 O ARG B 43 7.573 -0.284 -21.436 1.00 0.00 O ATOM 1149 CB ARG B 43 5.255 -2.439 -22.488 1.00 0.00 C ATOM 1150 CG ARG B 43 5.668 -2.612 -23.951 1.00 0.00 C ATOM 1151 CD ARG B 43 5.490 -4.075 -24.364 1.00 0.00 C ATOM 1152 NE ARG B 43 5.852 -4.233 -25.806 1.00 0.00 N ATOM 1153 CZ ARG B 43 6.113 -5.416 -26.326 1.00 0.00 C ATOM 1154 NH1 ARG B 43 6.068 -6.511 -25.602 1.00 0.00 N ATOM 1155 NH2 ARG B 43 6.424 -5.503 -27.591 1.00 0.00 N ATOM 0 H ARG B 43 3.642 -0.699 -23.310 1.00 0.00 H new ATOM 0 HA ARG B 43 5.170 -0.899 -20.983 1.00 0.00 H new ATOM 0 HB2 ARG B 43 5.893 -3.053 -21.852 1.00 0.00 H new ATOM 0 HB3 ARG B 43 4.233 -2.793 -22.351 1.00 0.00 H new ATOM 0 HG2 ARG B 43 5.064 -1.967 -24.589 1.00 0.00 H new ATOM 0 HG3 ARG B 43 6.707 -2.309 -24.085 1.00 0.00 H new ATOM 0 HD2 ARG B 43 6.119 -4.717 -23.748 1.00 0.00 H new ATOM 0 HD3 ARG B 43 4.459 -4.387 -24.201 1.00 0.00 H new ATOM 0 HE ARG B 43 5.898 -3.406 -26.401 1.00 0.00 H new ATOM 0 HH11 ARG B 43 5.827 -6.458 -24.612 1.00 0.00 H new ATOM 0 HH12 ARG B 43 6.274 -7.414 -26.029 1.00 0.00 H new ATOM 0 HH21 ARG B 43 6.463 -4.661 -28.166 1.00 0.00 H new ATOM 0 HH22 ARG B 43 6.628 -6.413 -28.005 1.00 0.00 H new ATOM 1169 N LYS B 44 7.054 -0.098 -23.573 1.00 0.00 N ATOM 1170 CA LYS B 44 8.392 0.446 -23.883 1.00 0.00 C ATOM 1171 C LYS B 44 8.533 1.812 -23.204 1.00 0.00 C ATOM 1172 O LYS B 44 9.622 2.221 -22.846 1.00 0.00 O ATOM 1173 CB LYS B 44 8.577 0.571 -25.399 1.00 0.00 C ATOM 1174 CG LYS B 44 7.547 1.540 -25.982 1.00 0.00 C ATOM 1175 CD LYS B 44 7.918 1.873 -27.428 1.00 0.00 C ATOM 1176 CE LYS B 44 7.716 0.635 -28.304 1.00 0.00 C ATOM 1177 NZ LYS B 44 8.176 0.929 -29.691 1.00 0.00 N ATOM 0 H LYS B 44 6.421 -0.188 -24.368 1.00 0.00 H new ATOM 0 HA LYS B 44 9.163 -0.227 -23.509 1.00 0.00 H new ATOM 0 HB2 LYS B 44 9.584 0.923 -25.621 1.00 0.00 H new ATOM 0 HB3 LYS B 44 8.471 -0.408 -25.867 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.552 1.096 -25.944 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.512 2.452 -25.386 1.00 0.00 H new ATOM 0 HD2 LYS B 44 7.302 2.694 -27.793 1.00 0.00 H new ATOM 0 HD3 LYS B 44 8.955 2.204 -27.482 1.00 0.00 H new ATOM 0 HE2 LYS B 44 8.273 -0.208 -27.895 1.00 0.00 H new ATOM 0 HE3 LYS B 44 6.664 0.349 -28.311 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 8.039 0.088 -30.288 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 7.626 1.722 -30.079 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 9.185 1.182 -29.676 1.00 0.00 H new ATOM 1191 N ASP B 45 7.436 2.516 -23.011 1.00 0.00 N ATOM 1192 CA ASP B 45 7.514 3.838 -22.344 1.00 0.00 C ATOM 1193 C ASP B 45 7.966 3.643 -20.896 1.00 0.00 C ATOM 1194 O ASP B 45 8.861 4.318 -20.436 1.00 0.00 O ATOM 1195 CB ASP B 45 6.150 4.530 -22.375 1.00 0.00 C ATOM 1196 CG ASP B 45 5.771 4.854 -23.821 1.00 0.00 C ATOM 1197 OD1 ASP B 45 6.662 5.174 -24.588 1.00 0.00 O ATOM 1198 OD2 ASP B 45 4.595 4.774 -24.136 1.00 0.00 O ATOM 0 H ASP B 45 6.499 2.224 -23.289 1.00 0.00 H new ATOM 0 HA ASP B 45 8.232 4.465 -22.872 1.00 0.00 H new ATOM 0 HB2 ASP B 45 5.394 3.886 -21.926 1.00 0.00 H new ATOM 0 HB3 ASP B 45 6.182 5.445 -21.783 1.00 0.00 H new ATOM 1203 N ILE B 46 7.366 2.717 -20.167 1.00 0.00 N ATOM 1204 CA ILE B 46 7.792 2.492 -18.745 1.00 0.00 C ATOM 1205 C ILE B 46 9.290 2.156 -18.715 1.00 0.00 C ATOM 1206 O ILE B 46 9.995 2.525 -17.796 1.00 0.00 O ATOM 1207 CB ILE B 46 6.938 1.378 -18.097 1.00 0.00 C ATOM 1208 CG1 ILE B 46 6.917 1.610 -16.585 1.00 0.00 C ATOM 1209 CG2 ILE B 46 7.476 -0.032 -18.391 1.00 0.00 C ATOM 1210 CD1 ILE B 46 6.149 2.894 -16.273 1.00 0.00 C ATOM 0 H ILE B 46 6.609 2.117 -20.495 1.00 0.00 H new ATOM 0 HA ILE B 46 7.632 3.398 -18.161 1.00 0.00 H new ATOM 0 HB ILE B 46 5.936 1.429 -18.523 1.00 0.00 H new ATOM 0 HG12 ILE B 46 6.448 0.763 -16.084 1.00 0.00 H new ATOM 0 HG13 ILE B 46 7.936 1.682 -16.204 1.00 0.00 H new ATOM 0 HG21 ILE B 46 6.837 -0.773 -17.911 1.00 0.00 H new ATOM 0 HG22 ILE B 46 7.483 -0.202 -19.468 1.00 0.00 H new ATOM 0 HG23 ILE B 46 8.491 -0.122 -18.003 1.00 0.00 H new ATOM 0 HD11 ILE B 46 6.135 3.057 -15.195 1.00 0.00 H new ATOM 0 HD12 ILE B 46 6.637 3.738 -16.762 1.00 0.00 H new ATOM 0 HD13 ILE B 46 5.126 2.804 -16.639 1.00 0.00 H new ATOM 1222 N LEU B 47 9.782 1.481 -19.729 1.00 0.00 N ATOM 1223 CA LEU B 47 11.232 1.152 -19.776 1.00 0.00 C ATOM 1224 C LEU B 47 12.017 2.465 -19.828 1.00 0.00 C ATOM 1225 O LEU B 47 13.002 2.647 -19.135 1.00 0.00 O ATOM 1226 CB LEU B 47 11.525 0.324 -21.028 1.00 0.00 C ATOM 1227 CG LEU B 47 11.143 -1.135 -20.782 1.00 0.00 C ATOM 1228 CD1 LEU B 47 11.199 -1.909 -22.100 1.00 0.00 C ATOM 1229 CD2 LEU B 47 12.123 -1.756 -19.784 1.00 0.00 C ATOM 0 H LEU B 47 9.236 1.146 -20.523 1.00 0.00 H new ATOM 0 HA LEU B 47 11.521 0.576 -18.897 1.00 0.00 H new ATOM 0 HB2 LEU B 47 10.965 0.719 -21.876 1.00 0.00 H new ATOM 0 HB3 LEU B 47 12.582 0.395 -21.283 1.00 0.00 H new ATOM 0 HG LEU B 47 10.132 -1.182 -20.378 1.00 0.00 H new ATOM 0 HD11 LEU B 47 10.926 -2.949 -21.923 1.00 0.00 H new ATOM 0 HD12 LEU B 47 10.501 -1.467 -22.811 1.00 0.00 H new ATOM 0 HD13 LEU B 47 12.209 -1.863 -22.506 1.00 0.00 H new ATOM 0 HD21 LEU B 47 11.852 -2.797 -19.607 1.00 0.00 H new ATOM 0 HD22 LEU B 47 13.134 -1.708 -20.189 1.00 0.00 H new ATOM 0 HD23 LEU B 47 12.082 -1.206 -18.844 1.00 0.00 H new ATOM 1241 N GLU B 48 11.559 3.389 -20.634 1.00 0.00 N ATOM 1242 CA GLU B 48 12.242 4.711 -20.731 1.00 0.00 C ATOM 1243 C GLU B 48 11.949 5.478 -19.447 1.00 0.00 C ATOM 1244 O GLU B 48 12.791 6.173 -18.915 1.00 0.00 O ATOM 1245 CB GLU B 48 11.725 5.535 -21.928 1.00 0.00 C ATOM 1246 CG GLU B 48 11.286 4.627 -23.087 1.00 0.00 C ATOM 1247 CD GLU B 48 11.749 5.222 -24.418 1.00 0.00 C ATOM 1248 OE1 GLU B 48 11.689 6.432 -24.557 1.00 0.00 O ATOM 1249 OE2 GLU B 48 12.156 4.456 -25.277 1.00 0.00 O ATOM 0 H GLU B 48 10.738 3.283 -21.230 1.00 0.00 H new ATOM 0 HA GLU B 48 13.310 4.547 -20.874 1.00 0.00 H new ATOM 0 HB2 GLU B 48 10.885 6.153 -21.610 1.00 0.00 H new ATOM 0 HB3 GLU B 48 12.508 6.212 -22.271 1.00 0.00 H new ATOM 0 HG2 GLU B 48 11.707 3.630 -22.959 1.00 0.00 H new ATOM 0 HG3 GLU B 48 10.201 4.518 -23.085 1.00 0.00 H new ATOM 1256 N VAL B 49 10.748 5.338 -18.939 1.00 0.00 N ATOM 1257 CA VAL B 49 10.368 6.034 -17.677 1.00 0.00 C ATOM 1258 C VAL B 49 11.300 5.558 -16.565 1.00 0.00 C ATOM 1259 O VAL B 49 12.037 6.333 -15.996 1.00 0.00 O ATOM 1260 CB VAL B 49 8.912 5.703 -17.327 1.00 0.00 C ATOM 1261 CG1 VAL B 49 8.496 6.455 -16.055 1.00 0.00 C ATOM 1262 CG2 VAL B 49 7.999 6.114 -18.492 1.00 0.00 C ATOM 0 H VAL B 49 10.011 4.766 -19.351 1.00 0.00 H new ATOM 0 HA VAL B 49 10.459 7.114 -17.796 1.00 0.00 H new ATOM 0 HB VAL B 49 8.819 4.631 -17.153 1.00 0.00 H new ATOM 0 HG11 VAL B 49 7.461 6.215 -15.813 1.00 0.00 H new ATOM 0 HG12 VAL B 49 9.141 6.156 -15.228 1.00 0.00 H new ATOM 0 HG13 VAL B 49 8.591 7.528 -16.220 1.00 0.00 H new ATOM 0 HG21 VAL B 49 6.964 5.879 -18.244 1.00 0.00 H new ATOM 0 HG22 VAL B 49 8.095 7.185 -18.669 1.00 0.00 H new ATOM 0 HG23 VAL B 49 8.289 5.570 -19.391 1.00 0.00 H new ATOM 1272 N ILE B 50 11.310 4.275 -16.281 1.00 0.00 N ATOM 1273 CA ILE B 50 12.237 3.742 -15.232 1.00 0.00 C ATOM 1274 C ILE B 50 13.671 4.177 -15.569 1.00 0.00 C ATOM 1275 O ILE B 50 14.512 4.292 -14.702 1.00 0.00 O ATOM 1276 CB ILE B 50 12.149 2.213 -15.188 1.00 0.00 C ATOM 1277 CG1 ILE B 50 10.697 1.795 -14.928 1.00 0.00 C ATOM 1278 CG2 ILE B 50 13.040 1.678 -14.065 1.00 0.00 C ATOM 1279 CD1 ILE B 50 10.392 0.504 -15.690 1.00 0.00 C ATOM 0 H ILE B 50 10.717 3.577 -16.730 1.00 0.00 H new ATOM 0 HA ILE B 50 11.955 4.135 -14.255 1.00 0.00 H new ATOM 0 HB ILE B 50 12.484 1.804 -16.141 1.00 0.00 H new ATOM 0 HG12 ILE B 50 10.536 1.646 -13.860 1.00 0.00 H new ATOM 0 HG13 ILE B 50 10.018 2.586 -15.245 1.00 0.00 H new ATOM 0 HG21 ILE B 50 12.975 0.590 -14.036 1.00 0.00 H new ATOM 0 HG22 ILE B 50 14.073 1.975 -14.247 1.00 0.00 H new ATOM 0 HG23 ILE B 50 12.708 2.087 -13.111 1.00 0.00 H new ATOM 0 HD11 ILE B 50 9.360 0.207 -15.505 1.00 0.00 H new ATOM 0 HD12 ILE B 50 10.536 0.669 -16.758 1.00 0.00 H new ATOM 0 HD13 ILE B 50 11.063 -0.286 -15.351 1.00 0.00 H new ATOM 1291 N CYS B 51 13.939 4.439 -16.828 1.00 0.00 N ATOM 1292 CA CYS B 51 15.293 4.892 -17.232 1.00 0.00 C ATOM 1293 C CYS B 51 15.492 6.348 -16.786 1.00 0.00 C ATOM 1294 O CYS B 51 16.501 6.697 -16.211 1.00 0.00 O ATOM 1295 CB CYS B 51 15.423 4.794 -18.756 1.00 0.00 C ATOM 1296 SG CYS B 51 17.174 4.766 -19.212 1.00 0.00 S ATOM 0 H CYS B 51 13.268 4.355 -17.591 1.00 0.00 H new ATOM 0 HA CYS B 51 16.051 4.264 -16.764 1.00 0.00 H new ATOM 0 HB2 CYS B 51 14.928 3.892 -19.117 1.00 0.00 H new ATOM 0 HB3 CYS B 51 14.927 5.641 -19.229 1.00 0.00 H new ATOM 0 HG CYS B 51 17.285 4.681 -20.504 1.00 0.00 H new ATOM 1302 N LYS B 52 14.530 7.197 -17.046 1.00 0.00 N ATOM 1303 CA LYS B 52 14.657 8.637 -16.643 1.00 0.00 C ATOM 1304 C LYS B 52 14.890 8.750 -15.134 1.00 0.00 C ATOM 1305 O LYS B 52 15.553 9.656 -14.664 1.00 0.00 O ATOM 1306 CB LYS B 52 13.370 9.395 -16.982 1.00 0.00 C ATOM 1307 CG LYS B 52 13.056 9.279 -18.473 1.00 0.00 C ATOM 1308 CD LYS B 52 11.542 9.420 -18.678 1.00 0.00 C ATOM 1309 CE LYS B 52 11.210 10.860 -19.072 1.00 0.00 C ATOM 1310 NZ LYS B 52 11.378 11.026 -20.543 1.00 0.00 N ATOM 0 H LYS B 52 13.659 6.958 -17.521 1.00 0.00 H new ATOM 0 HA LYS B 52 15.501 9.064 -17.185 1.00 0.00 H new ATOM 0 HB2 LYS B 52 12.541 8.995 -16.398 1.00 0.00 H new ATOM 0 HB3 LYS B 52 13.476 10.445 -16.708 1.00 0.00 H new ATOM 0 HG2 LYS B 52 13.585 10.052 -19.030 1.00 0.00 H new ATOM 0 HG3 LYS B 52 13.400 8.318 -18.856 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.204 8.733 -19.454 1.00 0.00 H new ATOM 0 HD3 LYS B 52 11.014 9.152 -17.763 1.00 0.00 H new ATOM 0 HE2 LYS B 52 10.187 11.100 -18.783 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.862 11.553 -18.541 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 11.152 12.005 -20.810 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 12.361 10.814 -20.806 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 10.738 10.375 -21.041 1.00 0.00 H new ATOM 1324 N TYR B 53 14.327 7.849 -14.375 1.00 0.00 N ATOM 1325 CA TYR B 53 14.478 7.898 -12.899 1.00 0.00 C ATOM 1326 C TYR B 53 15.526 6.871 -12.435 1.00 0.00 C ATOM 1327 O TYR B 53 15.991 6.923 -11.313 1.00 0.00 O ATOM 1328 CB TYR B 53 13.128 7.552 -12.257 1.00 0.00 C ATOM 1329 CG TYR B 53 12.061 8.564 -12.639 1.00 0.00 C ATOM 1330 CD1 TYR B 53 11.631 8.673 -13.968 1.00 0.00 C ATOM 1331 CD2 TYR B 53 11.480 9.372 -11.654 1.00 0.00 C ATOM 1332 CE1 TYR B 53 10.628 9.584 -14.313 1.00 0.00 C ATOM 1333 CE2 TYR B 53 10.477 10.288 -12.002 1.00 0.00 C ATOM 1334 CZ TYR B 53 10.051 10.390 -13.333 1.00 0.00 C ATOM 1335 OH TYR B 53 9.060 11.288 -13.673 1.00 0.00 O ATOM 0 H TYR B 53 13.763 7.073 -14.722 1.00 0.00 H new ATOM 0 HA TYR B 53 14.802 8.896 -12.603 1.00 0.00 H new ATOM 0 HB2 TYR B 53 12.817 6.556 -12.572 1.00 0.00 H new ATOM 0 HB3 TYR B 53 13.235 7.524 -11.173 1.00 0.00 H new ATOM 0 HD1 TYR B 53 12.076 8.050 -14.730 1.00 0.00 H new ATOM 0 HD2 TYR B 53 11.804 9.290 -10.627 1.00 0.00 H new ATOM 0 HE1 TYR B 53 10.300 9.663 -15.339 1.00 0.00 H new ATOM 0 HE2 TYR B 53 10.032 10.915 -11.244 1.00 0.00 H new ATOM 0 HH TYR B 53 8.766 11.770 -12.872 1.00 0.00 H new ATOM 1345 N VAL B 54 15.887 5.927 -13.277 1.00 0.00 N ATOM 1346 CA VAL B 54 16.887 4.883 -12.874 1.00 0.00 C ATOM 1347 C VAL B 54 17.621 4.402 -14.149 1.00 0.00 C ATOM 1348 O VAL B 54 17.969 5.209 -14.986 1.00 0.00 O ATOM 1349 CB VAL B 54 16.176 3.702 -12.164 1.00 0.00 C ATOM 1350 CG1 VAL B 54 17.186 2.965 -11.279 1.00 0.00 C ATOM 1351 CG2 VAL B 54 15.025 4.199 -11.278 1.00 0.00 C ATOM 0 H VAL B 54 15.531 5.835 -14.228 1.00 0.00 H new ATOM 0 HA VAL B 54 17.608 5.300 -12.171 1.00 0.00 H new ATOM 0 HB VAL B 54 15.772 3.039 -12.929 1.00 0.00 H new ATOM 0 HG11 VAL B 54 16.691 2.133 -10.777 1.00 0.00 H new ATOM 0 HG12 VAL B 54 18.000 2.584 -11.896 1.00 0.00 H new ATOM 0 HG13 VAL B 54 17.586 3.652 -10.534 1.00 0.00 H new ATOM 0 HG21 VAL B 54 14.546 3.349 -10.793 1.00 0.00 H new ATOM 0 HG22 VAL B 54 15.416 4.876 -10.519 1.00 0.00 H new ATOM 0 HG23 VAL B 54 14.295 4.726 -11.892 1.00 0.00 H new ATOM 1361 N GLN B 55 17.869 3.116 -14.319 1.00 0.00 N ATOM 1362 CA GLN B 55 18.572 2.648 -15.551 1.00 0.00 C ATOM 1363 C GLN B 55 18.540 1.119 -15.607 1.00 0.00 C ATOM 1364 O GLN B 55 19.170 0.444 -14.815 1.00 0.00 O ATOM 1365 CB GLN B 55 20.021 3.141 -15.537 1.00 0.00 C ATOM 1366 CG GLN B 55 20.241 4.151 -16.668 1.00 0.00 C ATOM 1367 CD GLN B 55 21.688 4.648 -16.638 1.00 0.00 C ATOM 1368 OE1 GLN B 55 21.972 5.692 -16.085 1.00 0.00 O ATOM 1369 NE2 GLN B 55 22.621 3.939 -17.213 1.00 0.00 N ATOM 0 H GLN B 55 17.614 2.382 -13.659 1.00 0.00 H new ATOM 0 HA GLN B 55 18.070 3.049 -16.431 1.00 0.00 H new ATOM 0 HB2 GLN B 55 20.247 3.603 -14.576 1.00 0.00 H new ATOM 0 HB3 GLN B 55 20.702 2.298 -15.653 1.00 0.00 H new ATOM 0 HG2 GLN B 55 20.025 3.687 -17.630 1.00 0.00 H new ATOM 0 HG3 GLN B 55 19.555 4.991 -16.558 1.00 0.00 H new ATOM 0 HE21 GLN B 55 22.382 3.063 -17.677 1.00 0.00 H new ATOM 0 HE22 GLN B 55 23.589 4.261 -17.198 1.00 0.00 H new ATOM 1378 N ILE B 56 17.805 0.580 -16.539 1.00 0.00 N ATOM 1379 CA ILE B 56 17.709 -0.905 -16.675 1.00 0.00 C ATOM 1380 C ILE B 56 17.709 -1.275 -18.155 1.00 0.00 C ATOM 1381 O ILE B 56 17.547 -0.428 -19.014 1.00 0.00 O ATOM 1382 CB ILE B 56 16.413 -1.415 -16.030 1.00 0.00 C ATOM 1383 CG1 ILE B 56 15.257 -0.450 -16.327 1.00 0.00 C ATOM 1384 CG2 ILE B 56 16.607 -1.532 -14.520 1.00 0.00 C ATOM 1385 CD1 ILE B 56 13.980 -1.248 -16.587 1.00 0.00 C ATOM 0 H ILE B 56 17.260 1.108 -17.221 1.00 0.00 H new ATOM 0 HA ILE B 56 18.562 -1.363 -16.173 1.00 0.00 H new ATOM 0 HB ILE B 56 16.171 -2.393 -16.445 1.00 0.00 H new ATOM 0 HG12 ILE B 56 15.110 0.228 -15.486 1.00 0.00 H new ATOM 0 HG13 ILE B 56 15.497 0.165 -17.194 1.00 0.00 H new ATOM 0 HG21 ILE B 56 15.687 -1.894 -14.062 1.00 0.00 H new ATOM 0 HG22 ILE B 56 17.416 -2.231 -14.310 1.00 0.00 H new ATOM 0 HG23 ILE B 56 16.857 -0.554 -14.108 1.00 0.00 H new ATOM 0 HD11 ILE B 56 13.159 -0.563 -16.798 1.00 0.00 H new ATOM 0 HD12 ILE B 56 14.131 -1.907 -17.442 1.00 0.00 H new ATOM 0 HD13 ILE B 56 13.738 -1.844 -15.707 1.00 0.00 H new ATOM 1397 N ASP B 57 17.878 -2.535 -18.458 1.00 0.00 N ATOM 1398 CA ASP B 57 17.876 -2.971 -19.881 1.00 0.00 C ATOM 1399 C ASP B 57 16.511 -3.592 -20.207 1.00 0.00 C ATOM 1400 O ASP B 57 15.778 -3.948 -19.306 1.00 0.00 O ATOM 1401 CB ASP B 57 18.979 -4.010 -20.097 1.00 0.00 C ATOM 1402 CG ASP B 57 20.306 -3.299 -20.363 1.00 0.00 C ATOM 1403 OD1 ASP B 57 20.979 -2.965 -19.403 1.00 0.00 O ATOM 1404 OD2 ASP B 57 20.627 -3.101 -21.523 1.00 0.00 O ATOM 0 H ASP B 57 18.018 -3.282 -17.777 1.00 0.00 H new ATOM 0 HA ASP B 57 18.057 -2.116 -20.533 1.00 0.00 H new ATOM 0 HB2 ASP B 57 19.067 -4.650 -19.219 1.00 0.00 H new ATOM 0 HB3 ASP B 57 18.725 -4.655 -20.938 1.00 0.00 H new ATOM 1409 N PRO B 58 16.196 -3.716 -21.480 1.00 0.00 N ATOM 1410 CA PRO B 58 14.898 -4.307 -21.937 1.00 0.00 C ATOM 1411 C PRO B 58 14.921 -5.817 -21.726 1.00 0.00 C ATOM 1412 O PRO B 58 13.906 -6.429 -21.446 1.00 0.00 O ATOM 1413 CB PRO B 58 14.824 -3.940 -23.412 1.00 0.00 C ATOM 1414 CG PRO B 58 16.247 -3.704 -23.877 1.00 0.00 C ATOM 1415 CD PRO B 58 17.065 -3.310 -22.646 1.00 0.00 C ATOM 0 HA PRO B 58 14.031 -3.938 -21.390 1.00 0.00 H new ATOM 0 HB2 PRO B 58 14.357 -4.740 -23.986 1.00 0.00 H new ATOM 0 HB3 PRO B 58 14.217 -3.047 -23.558 1.00 0.00 H new ATOM 0 HG2 PRO B 58 16.655 -4.603 -24.339 1.00 0.00 H new ATOM 0 HG3 PRO B 58 16.280 -2.916 -24.630 1.00 0.00 H new ATOM 0 HD2 PRO B 58 18.026 -3.824 -22.625 1.00 0.00 H new ATOM 0 HD3 PRO B 58 17.275 -2.241 -22.633 1.00 0.00 H new ATOM 1423 N GLU B 59 16.079 -6.412 -21.819 1.00 0.00 N ATOM 1424 CA GLU B 59 16.188 -7.877 -21.586 1.00 0.00 C ATOM 1425 C GLU B 59 15.927 -8.174 -20.099 1.00 0.00 C ATOM 1426 O GLU B 59 15.737 -9.315 -19.718 1.00 0.00 O ATOM 1427 CB GLU B 59 17.593 -8.352 -21.962 1.00 0.00 C ATOM 1428 CG GLU B 59 17.716 -8.430 -23.486 1.00 0.00 C ATOM 1429 CD GLU B 59 19.179 -8.655 -23.870 1.00 0.00 C ATOM 1430 OE1 GLU B 59 19.881 -7.673 -24.053 1.00 0.00 O ATOM 1431 OE2 GLU B 59 19.574 -9.804 -23.974 1.00 0.00 O ATOM 0 H GLU B 59 16.956 -5.944 -22.047 1.00 0.00 H new ATOM 0 HA GLU B 59 15.454 -8.400 -22.199 1.00 0.00 H new ATOM 0 HB2 GLU B 59 18.339 -7.666 -21.561 1.00 0.00 H new ATOM 0 HB3 GLU B 59 17.788 -9.329 -21.520 1.00 0.00 H new ATOM 0 HG2 GLU B 59 17.099 -9.243 -23.870 1.00 0.00 H new ATOM 0 HG3 GLU B 59 17.348 -7.509 -23.939 1.00 0.00 H new ATOM 1438 N MET B 60 15.911 -7.160 -19.255 1.00 0.00 N ATOM 1439 CA MET B 60 15.659 -7.390 -17.807 1.00 0.00 C ATOM 1440 C MET B 60 14.160 -7.259 -17.517 1.00 0.00 C ATOM 1441 O MET B 60 13.664 -7.782 -16.537 1.00 0.00 O ATOM 1442 CB MET B 60 16.434 -6.351 -16.991 1.00 0.00 C ATOM 1443 CG MET B 60 17.897 -6.786 -16.879 1.00 0.00 C ATOM 1444 SD MET B 60 18.920 -5.360 -16.434 1.00 0.00 S ATOM 1445 CE MET B 60 18.477 -5.307 -14.681 1.00 0.00 C ATOM 0 H MET B 60 16.063 -6.186 -19.517 1.00 0.00 H new ATOM 0 HA MET B 60 15.989 -8.392 -17.533 1.00 0.00 H new ATOM 0 HB2 MET B 60 16.369 -5.374 -17.469 1.00 0.00 H new ATOM 0 HB3 MET B 60 15.995 -6.250 -15.998 1.00 0.00 H new ATOM 0 HG2 MET B 60 17.998 -7.568 -16.127 1.00 0.00 H new ATOM 0 HG3 MET B 60 18.235 -7.208 -17.825 1.00 0.00 H new ATOM 0 HE1 MET B 60 19.372 -5.132 -14.085 1.00 0.00 H new ATOM 0 HE2 MET B 60 17.764 -4.501 -14.510 1.00 0.00 H new ATOM 0 HE3 MET B 60 18.028 -6.257 -14.390 1.00 0.00 H new ATOM 1455 N VAL B 61 13.433 -6.563 -18.360 1.00 0.00 N ATOM 1456 CA VAL B 61 11.968 -6.398 -18.131 1.00 0.00 C ATOM 1457 C VAL B 61 11.197 -7.403 -18.993 1.00 0.00 C ATOM 1458 O VAL B 61 11.297 -7.395 -20.205 1.00 0.00 O ATOM 1459 CB VAL B 61 11.553 -4.974 -18.507 1.00 0.00 C ATOM 1460 CG1 VAL B 61 10.087 -4.752 -18.132 1.00 0.00 C ATOM 1461 CG2 VAL B 61 12.429 -3.973 -17.750 1.00 0.00 C ATOM 0 H VAL B 61 13.794 -6.103 -19.196 1.00 0.00 H new ATOM 0 HA VAL B 61 11.741 -6.577 -17.080 1.00 0.00 H new ATOM 0 HB VAL B 61 11.678 -4.831 -19.580 1.00 0.00 H new ATOM 0 HG11 VAL B 61 9.792 -3.737 -18.400 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.462 -5.465 -18.669 1.00 0.00 H new ATOM 0 HG13 VAL B 61 9.960 -4.895 -17.059 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.135 -2.958 -18.017 1.00 0.00 H new ATOM 0 HG22 VAL B 61 12.303 -4.118 -16.677 1.00 0.00 H new ATOM 0 HG23 VAL B 61 13.474 -4.130 -18.017 1.00 0.00 H new ATOM 1471 N THR B 62 10.437 -8.273 -18.374 1.00 0.00 N ATOM 1472 CA THR B 62 9.664 -9.284 -19.145 1.00 0.00 C ATOM 1473 C THR B 62 8.281 -8.734 -19.490 1.00 0.00 C ATOM 1474 O THR B 62 7.793 -7.811 -18.865 1.00 0.00 O ATOM 1475 CB THR B 62 9.500 -10.557 -18.309 1.00 0.00 C ATOM 1476 OG1 THR B 62 10.704 -10.816 -17.600 1.00 0.00 O ATOM 1477 CG2 THR B 62 9.189 -11.737 -19.231 1.00 0.00 C ATOM 0 H THR B 62 10.321 -8.323 -17.362 1.00 0.00 H new ATOM 0 HA THR B 62 10.204 -9.512 -20.064 1.00 0.00 H new ATOM 0 HB THR B 62 8.682 -10.423 -17.601 1.00 0.00 H new ATOM 0 HG1 THR B 62 10.599 -11.629 -17.064 1.00 0.00 H new ATOM 0 HG21 THR B 62 9.072 -12.643 -18.636 1.00 0.00 H new ATOM 0 HG22 THR B 62 8.266 -11.539 -19.776 1.00 0.00 H new ATOM 0 HG23 THR B 62 10.007 -11.871 -19.939 1.00 0.00 H new ATOM 1485 N VAL B 63 7.643 -9.307 -20.477 1.00 0.00 N ATOM 1486 CA VAL B 63 6.284 -8.845 -20.875 1.00 0.00 C ATOM 1487 C VAL B 63 5.438 -10.067 -21.229 1.00 0.00 C ATOM 1488 O VAL B 63 5.870 -10.936 -21.964 1.00 0.00 O ATOM 1489 CB VAL B 63 6.391 -7.927 -22.090 1.00 0.00 C ATOM 1490 CG1 VAL B 63 5.010 -7.352 -22.425 1.00 0.00 C ATOM 1491 CG2 VAL B 63 7.358 -6.784 -21.778 1.00 0.00 C ATOM 0 H VAL B 63 8.011 -10.082 -21.028 1.00 0.00 H new ATOM 0 HA VAL B 63 5.821 -8.296 -20.055 1.00 0.00 H new ATOM 0 HB VAL B 63 6.761 -8.496 -22.943 1.00 0.00 H new ATOM 0 HG11 VAL B 63 5.089 -6.697 -23.293 1.00 0.00 H new ATOM 0 HG12 VAL B 63 4.321 -8.167 -22.647 1.00 0.00 H new ATOM 0 HG13 VAL B 63 4.637 -6.783 -21.574 1.00 0.00 H new ATOM 0 HG21 VAL B 63 7.436 -6.127 -22.644 1.00 0.00 H new ATOM 0 HG22 VAL B 63 6.987 -6.217 -20.924 1.00 0.00 H new ATOM 0 HG23 VAL B 63 8.341 -7.193 -21.543 1.00 0.00 H new ATOM 1501 N GLN B 64 4.243 -10.148 -20.704 1.00 0.00 N ATOM 1502 CA GLN B 64 3.374 -11.323 -21.001 1.00 0.00 C ATOM 1503 C GLN B 64 1.907 -10.894 -21.026 1.00 0.00 C ATOM 1504 O GLN B 64 1.410 -10.292 -20.093 1.00 0.00 O ATOM 1505 CB GLN B 64 3.593 -12.394 -19.923 1.00 0.00 C ATOM 1506 CG GLN B 64 3.440 -11.774 -18.526 1.00 0.00 C ATOM 1507 CD GLN B 64 4.813 -11.651 -17.859 1.00 0.00 C ATOM 1508 OE1 GLN B 64 5.597 -10.792 -18.211 1.00 0.00 O ATOM 1509 NE2 GLN B 64 5.139 -12.480 -16.905 1.00 0.00 N ATOM 0 H GLN B 64 3.832 -9.451 -20.083 1.00 0.00 H new ATOM 0 HA GLN B 64 3.633 -11.732 -21.978 1.00 0.00 H new ATOM 0 HB2 GLN B 64 2.874 -13.203 -20.051 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.586 -12.831 -20.029 1.00 0.00 H new ATOM 0 HG2 GLN B 64 2.974 -10.792 -18.603 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.782 -12.392 -17.914 1.00 0.00 H new ATOM 0 HE21 GLN B 64 4.481 -13.201 -16.609 1.00 0.00 H new ATOM 0 HE22 GLN B 64 6.052 -12.407 -16.455 1.00 0.00 H new ATOM 1518 N LEU B 65 1.214 -11.188 -22.098 1.00 0.00 N ATOM 1519 CA LEU B 65 -0.212 -10.790 -22.205 1.00 0.00 C ATOM 1520 C LEU B 65 -1.127 -11.989 -21.951 1.00 0.00 C ATOM 1521 O LEU B 65 -0.993 -13.031 -22.564 1.00 0.00 O ATOM 1522 CB LEU B 65 -0.470 -10.237 -23.607 1.00 0.00 C ATOM 1523 CG LEU B 65 -0.080 -11.280 -24.671 1.00 0.00 C ATOM 1524 CD1 LEU B 65 -1.301 -11.630 -25.526 1.00 0.00 C ATOM 1525 CD2 LEU B 65 1.019 -10.711 -25.574 1.00 0.00 C ATOM 0 H LEU B 65 1.583 -11.690 -22.906 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.426 -10.028 -21.456 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -1.522 -9.974 -23.714 1.00 0.00 H new ATOM 0 HB3 LEU B 65 0.104 -9.322 -23.756 1.00 0.00 H new ATOM 0 HG LEU B 65 0.285 -12.177 -24.171 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -1.020 -12.368 -26.277 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -2.085 -12.040 -24.890 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.669 -10.731 -26.021 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.292 -11.452 -26.325 1.00 0.00 H new ATOM 0 HD22 LEU B 65 0.654 -9.811 -26.068 1.00 0.00 H new ATOM 0 HD23 LEU B 65 1.894 -10.465 -24.972 1.00 0.00 H new ATOM 1537 N GLU B 66 -2.069 -11.834 -21.055 1.00 0.00 N ATOM 1538 CA GLU B 66 -3.020 -12.940 -20.755 1.00 0.00 C ATOM 1539 C GLU B 66 -4.431 -12.486 -21.129 1.00 0.00 C ATOM 1540 O GLU B 66 -4.628 -11.370 -21.570 1.00 0.00 O ATOM 1541 CB GLU B 66 -2.958 -13.290 -19.260 1.00 0.00 C ATOM 1542 CG GLU B 66 -1.697 -14.103 -18.957 1.00 0.00 C ATOM 1543 CD GLU B 66 -1.706 -15.410 -19.757 1.00 0.00 C ATOM 1544 OE1 GLU B 66 -2.555 -16.242 -19.484 1.00 0.00 O ATOM 1545 OE2 GLU B 66 -0.864 -15.555 -20.628 1.00 0.00 O ATOM 0 H GLU B 66 -2.219 -10.981 -20.516 1.00 0.00 H new ATOM 0 HA GLU B 66 -2.753 -13.827 -21.330 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -2.962 -12.377 -18.665 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -3.843 -13.859 -18.976 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -0.811 -13.520 -19.208 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -1.643 -14.321 -17.890 1.00 0.00 H new ATOM 1552 N GLN B 67 -5.411 -13.340 -20.971 1.00 0.00 N ATOM 1553 CA GLN B 67 -6.803 -12.946 -21.335 1.00 0.00 C ATOM 1554 C GLN B 67 -7.793 -13.506 -20.316 1.00 0.00 C ATOM 1555 O GLN B 67 -7.434 -14.267 -19.437 1.00 0.00 O ATOM 1556 CB GLN B 67 -7.136 -13.483 -22.731 1.00 0.00 C ATOM 1557 CG GLN B 67 -6.054 -13.031 -23.717 1.00 0.00 C ATOM 1558 CD GLN B 67 -6.520 -13.282 -25.153 1.00 0.00 C ATOM 1559 OE1 GLN B 67 -7.424 -14.061 -25.388 1.00 0.00 O ATOM 1560 NE2 GLN B 67 -5.933 -12.650 -26.132 1.00 0.00 N ATOM 0 H GLN B 67 -5.307 -14.287 -20.608 1.00 0.00 H new ATOM 0 HA GLN B 67 -6.878 -11.859 -21.335 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -7.194 -14.571 -22.711 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -8.112 -13.117 -23.051 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -5.840 -11.972 -23.575 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -5.127 -13.572 -23.526 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -5.175 -11.997 -25.935 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -6.232 -12.809 -27.094 1.00 0.00 H new ATOM 1569 N LYS B 68 -9.038 -13.117 -20.424 1.00 0.00 N ATOM 1570 CA LYS B 68 -10.068 -13.605 -19.461 1.00 0.00 C ATOM 1571 C LYS B 68 -11.248 -14.200 -20.230 1.00 0.00 C ATOM 1572 O LYS B 68 -11.383 -14.007 -21.423 1.00 0.00 O ATOM 1573 CB LYS B 68 -10.570 -12.435 -18.604 1.00 0.00 C ATOM 1574 CG LYS B 68 -9.385 -11.608 -18.093 1.00 0.00 C ATOM 1575 CD LYS B 68 -9.805 -10.847 -16.833 1.00 0.00 C ATOM 1576 CE LYS B 68 -9.048 -9.520 -16.736 1.00 0.00 C ATOM 1577 NZ LYS B 68 -8.331 -9.450 -15.429 1.00 0.00 N ATOM 0 H LYS B 68 -9.386 -12.480 -21.141 1.00 0.00 H new ATOM 0 HA LYS B 68 -9.624 -14.366 -18.820 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -11.237 -11.804 -19.191 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -11.149 -12.814 -17.762 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -8.540 -12.260 -17.873 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -9.057 -10.908 -18.862 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -10.879 -10.660 -16.854 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -9.604 -11.453 -15.950 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -8.337 -9.434 -17.558 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -9.743 -8.685 -16.827 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -7.444 -8.919 -15.547 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -8.931 -8.969 -14.729 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -8.117 -10.413 -15.099 1.00 0.00 H new ATOM 1591 N ASP B 69 -12.104 -14.917 -19.549 1.00 0.00 N ATOM 1592 CA ASP B 69 -13.285 -15.526 -20.220 1.00 0.00 C ATOM 1593 C ASP B 69 -14.363 -14.460 -20.473 1.00 0.00 C ATOM 1594 O ASP B 69 -15.312 -14.698 -21.197 1.00 0.00 O ATOM 1595 CB ASP B 69 -13.861 -16.628 -19.330 1.00 0.00 C ATOM 1596 CG ASP B 69 -13.160 -17.953 -19.639 1.00 0.00 C ATOM 1597 OD1 ASP B 69 -12.029 -18.115 -19.210 1.00 0.00 O ATOM 1598 OD2 ASP B 69 -13.767 -18.782 -20.298 1.00 0.00 O ATOM 0 H ASP B 69 -12.033 -15.107 -18.549 1.00 0.00 H new ATOM 0 HA ASP B 69 -12.972 -15.946 -21.176 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -13.726 -16.369 -18.280 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -14.933 -16.724 -19.500 1.00 0.00 H new ATOM 1603 N GLY B 70 -14.233 -13.291 -19.882 1.00 0.00 N ATOM 1604 CA GLY B 70 -15.256 -12.224 -20.091 1.00 0.00 C ATOM 1605 C GLY B 70 -14.791 -11.261 -21.187 1.00 0.00 C ATOM 1606 O GLY B 70 -15.097 -10.084 -21.157 1.00 0.00 O ATOM 0 H GLY B 70 -13.462 -13.035 -19.266 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -16.210 -12.672 -20.370 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -15.420 -11.679 -19.162 1.00 0.00 H new ATOM 1610 N ASP B 71 -14.047 -11.753 -22.147 1.00 0.00 N ATOM 1611 CA ASP B 71 -13.550 -10.881 -23.255 1.00 0.00 C ATOM 1612 C ASP B 71 -12.676 -9.770 -22.676 1.00 0.00 C ATOM 1613 O ASP B 71 -12.834 -8.606 -22.995 1.00 0.00 O ATOM 1614 CB ASP B 71 -14.735 -10.274 -24.016 1.00 0.00 C ATOM 1615 CG ASP B 71 -15.288 -11.303 -25.003 1.00 0.00 C ATOM 1616 OD1 ASP B 71 -14.729 -11.422 -26.081 1.00 0.00 O ATOM 1617 OD2 ASP B 71 -16.262 -11.955 -24.664 1.00 0.00 O ATOM 0 H ASP B 71 -13.761 -12.730 -22.210 1.00 0.00 H new ATOM 0 HA ASP B 71 -12.959 -11.480 -23.947 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -15.514 -9.971 -23.316 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -14.418 -9.377 -24.548 1.00 0.00 H new ATOM 1622 N ILE B 72 -11.759 -10.129 -21.819 1.00 0.00 N ATOM 1623 CA ILE B 72 -10.868 -9.110 -21.198 1.00 0.00 C ATOM 1624 C ILE B 72 -9.410 -9.528 -21.396 1.00 0.00 C ATOM 1625 O ILE B 72 -9.115 -10.685 -21.633 1.00 0.00 O ATOM 1626 CB ILE B 72 -11.181 -8.998 -19.704 1.00 0.00 C ATOM 1627 CG1 ILE B 72 -12.710 -8.926 -19.509 1.00 0.00 C ATOM 1628 CG2 ILE B 72 -10.512 -7.730 -19.156 1.00 0.00 C ATOM 1629 CD1 ILE B 72 -13.060 -8.627 -18.045 1.00 0.00 C ATOM 0 H ILE B 72 -11.589 -11.090 -21.521 1.00 0.00 H new ATOM 0 HA ILE B 72 -11.033 -8.141 -21.669 1.00 0.00 H new ATOM 0 HB ILE B 72 -10.800 -9.867 -19.168 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -13.127 -8.151 -20.153 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -13.164 -9.870 -19.811 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -10.726 -7.637 -18.091 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -9.434 -7.794 -19.305 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -10.900 -6.858 -19.682 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -14.143 -8.581 -17.932 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -12.662 -9.416 -17.407 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -12.624 -7.671 -17.755 1.00 0.00 H new ATOM 1641 N SER B 73 -8.499 -8.595 -21.307 1.00 0.00 N ATOM 1642 CA SER B 73 -7.056 -8.925 -21.495 1.00 0.00 C ATOM 1643 C SER B 73 -6.308 -8.694 -20.184 1.00 0.00 C ATOM 1644 O SER B 73 -6.821 -8.093 -19.260 1.00 0.00 O ATOM 1645 CB SER B 73 -6.468 -8.028 -22.585 1.00 0.00 C ATOM 1646 OG SER B 73 -6.822 -8.547 -23.860 1.00 0.00 O ATOM 0 H SER B 73 -8.694 -7.613 -21.111 1.00 0.00 H new ATOM 0 HA SER B 73 -6.955 -9.969 -21.791 1.00 0.00 H new ATOM 0 HB2 SER B 73 -6.843 -7.010 -22.477 1.00 0.00 H new ATOM 0 HB3 SER B 73 -5.383 -7.980 -22.487 1.00 0.00 H new ATOM 0 HG SER B 73 -6.448 -7.974 -24.562 1.00 0.00 H new ATOM 1652 N ILE B 74 -5.098 -9.174 -20.103 1.00 0.00 N ATOM 1653 CA ILE B 74 -4.295 -9.000 -18.862 1.00 0.00 C ATOM 1654 C ILE B 74 -2.813 -8.883 -19.246 1.00 0.00 C ATOM 1655 O ILE B 74 -2.082 -9.856 -19.226 1.00 0.00 O ATOM 1656 CB ILE B 74 -4.523 -10.218 -17.954 1.00 0.00 C ATOM 1657 CG1 ILE B 74 -5.995 -10.233 -17.517 1.00 0.00 C ATOM 1658 CG2 ILE B 74 -3.602 -10.146 -16.722 1.00 0.00 C ATOM 1659 CD1 ILE B 74 -6.247 -11.360 -16.509 1.00 0.00 C ATOM 0 H ILE B 74 -4.628 -9.684 -20.851 1.00 0.00 H new ATOM 0 HA ILE B 74 -4.595 -8.098 -18.329 1.00 0.00 H new ATOM 0 HB ILE B 74 -4.289 -11.133 -18.498 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -6.257 -9.274 -17.071 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -6.637 -10.366 -18.388 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -3.774 -11.015 -16.088 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.561 -10.134 -17.046 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.817 -9.238 -16.159 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -7.296 -11.354 -16.211 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -6.005 -12.319 -16.967 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -5.620 -11.209 -15.630 1.00 0.00 H new ATOM 1671 N LEU B 75 -2.372 -7.703 -19.606 1.00 0.00 N ATOM 1672 CA LEU B 75 -0.949 -7.521 -20.004 1.00 0.00 C ATOM 1673 C LEU B 75 -0.070 -7.330 -18.772 1.00 0.00 C ATOM 1674 O LEU B 75 -0.047 -6.276 -18.166 1.00 0.00 O ATOM 1675 CB LEU B 75 -0.824 -6.301 -20.922 1.00 0.00 C ATOM 1676 CG LEU B 75 0.516 -6.351 -21.678 1.00 0.00 C ATOM 1677 CD1 LEU B 75 0.264 -6.281 -23.188 1.00 0.00 C ATOM 1678 CD2 LEU B 75 1.391 -5.163 -21.254 1.00 0.00 C ATOM 0 H LEU B 75 -2.941 -6.857 -19.640 1.00 0.00 H new ATOM 0 HA LEU B 75 -0.616 -8.413 -20.535 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -1.651 -6.282 -21.631 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -0.887 -5.385 -20.335 1.00 0.00 H new ATOM 0 HG LEU B 75 1.025 -7.285 -21.439 1.00 0.00 H new ATOM 0 HD11 LEU B 75 1.216 -6.317 -23.718 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -0.353 -7.126 -23.493 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -0.250 -5.350 -23.428 1.00 0.00 H new ATOM 0 HD21 LEU B 75 2.339 -5.200 -21.790 1.00 0.00 H new ATOM 0 HD22 LEU B 75 0.877 -4.231 -21.489 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.578 -5.214 -20.181 1.00 0.00 H new ATOM 1690 N GLU B 76 0.665 -8.348 -18.412 1.00 0.00 N ATOM 1691 CA GLU B 76 1.570 -8.253 -17.231 1.00 0.00 C ATOM 1692 C GLU B 76 3.002 -8.064 -17.731 1.00 0.00 C ATOM 1693 O GLU B 76 3.345 -8.503 -18.812 1.00 0.00 O ATOM 1694 CB GLU B 76 1.494 -9.545 -16.411 1.00 0.00 C ATOM 1695 CG GLU B 76 0.029 -9.919 -16.146 1.00 0.00 C ATOM 1696 CD GLU B 76 -0.364 -11.118 -17.014 1.00 0.00 C ATOM 1697 OE1 GLU B 76 -0.026 -11.111 -18.187 1.00 0.00 O ATOM 1698 OE2 GLU B 76 -0.995 -12.022 -16.491 1.00 0.00 O ATOM 0 H GLU B 76 0.677 -9.249 -18.890 1.00 0.00 H new ATOM 0 HA GLU B 76 1.269 -7.413 -16.605 1.00 0.00 H new ATOM 0 HB2 GLU B 76 1.992 -10.354 -16.946 1.00 0.00 H new ATOM 0 HB3 GLU B 76 2.021 -9.416 -15.466 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.110 -10.160 -15.092 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -0.618 -9.070 -16.367 1.00 0.00 H new ATOM 1705 N LEU B 77 3.840 -7.427 -16.957 1.00 0.00 N ATOM 1706 CA LEU B 77 5.253 -7.226 -17.393 1.00 0.00 C ATOM 1707 C LEU B 77 6.174 -7.278 -16.175 1.00 0.00 C ATOM 1708 O LEU B 77 5.944 -6.619 -15.181 1.00 0.00 O ATOM 1709 CB LEU B 77 5.399 -5.873 -18.104 1.00 0.00 C ATOM 1710 CG LEU B 77 4.788 -4.757 -17.253 1.00 0.00 C ATOM 1711 CD1 LEU B 77 5.475 -3.432 -17.588 1.00 0.00 C ATOM 1712 CD2 LEU B 77 3.292 -4.644 -17.562 1.00 0.00 C ATOM 0 H LEU B 77 3.608 -7.038 -16.043 1.00 0.00 H new ATOM 0 HA LEU B 77 5.530 -8.018 -18.089 1.00 0.00 H new ATOM 0 HB2 LEU B 77 6.453 -5.663 -18.289 1.00 0.00 H new ATOM 0 HB3 LEU B 77 4.906 -5.910 -19.076 1.00 0.00 H new ATOM 0 HG LEU B 77 4.927 -4.985 -16.196 1.00 0.00 H new ATOM 0 HD11 LEU B 77 5.042 -2.635 -16.984 1.00 0.00 H new ATOM 0 HD12 LEU B 77 6.541 -3.511 -17.375 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.332 -3.205 -18.644 1.00 0.00 H new ATOM 0 HD21 LEU B 77 2.855 -3.850 -16.957 1.00 0.00 H new ATOM 0 HD22 LEU B 77 3.155 -4.413 -18.618 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.800 -5.589 -17.331 1.00 0.00 H new ATOM 1724 N ASN B 78 7.215 -8.061 -16.250 1.00 0.00 N ATOM 1725 CA ASN B 78 8.160 -8.169 -15.110 1.00 0.00 C ATOM 1726 C ASN B 78 9.243 -7.109 -15.272 1.00 0.00 C ATOM 1727 O ASN B 78 9.668 -6.818 -16.373 1.00 0.00 O ATOM 1728 CB ASN B 78 8.817 -9.547 -15.127 1.00 0.00 C ATOM 1729 CG ASN B 78 7.762 -10.653 -15.290 1.00 0.00 C ATOM 1730 OD1 ASN B 78 8.036 -11.684 -15.873 1.00 0.00 O ATOM 1731 ND2 ASN B 78 6.565 -10.487 -14.797 1.00 0.00 N ATOM 0 H ASN B 78 7.451 -8.634 -17.060 1.00 0.00 H new ATOM 0 HA ASN B 78 7.625 -8.027 -14.171 1.00 0.00 H new ATOM 0 HB2 ASN B 78 9.537 -9.602 -15.944 1.00 0.00 H new ATOM 0 HB3 ASN B 78 9.372 -9.701 -14.202 1.00 0.00 H new ATOM 0 HD21 ASN B 78 5.864 -11.221 -14.902 1.00 0.00 H new ATOM 0 HD22 ASN B 78 6.330 -9.624 -14.307 1.00 0.00 H new ATOM 1738 N VAL B 79 9.692 -6.533 -14.192 1.00 0.00 N ATOM 1739 CA VAL B 79 10.754 -5.490 -14.288 1.00 0.00 C ATOM 1740 C VAL B 79 11.920 -5.871 -13.375 1.00 0.00 C ATOM 1741 O VAL B 79 11.930 -5.557 -12.199 1.00 0.00 O ATOM 1742 CB VAL B 79 10.190 -4.132 -13.868 1.00 0.00 C ATOM 1743 CG1 VAL B 79 11.196 -3.041 -14.225 1.00 0.00 C ATOM 1744 CG2 VAL B 79 8.872 -3.867 -14.605 1.00 0.00 C ATOM 0 H VAL B 79 9.370 -6.739 -13.246 1.00 0.00 H new ATOM 0 HA VAL B 79 11.104 -5.424 -15.318 1.00 0.00 H new ATOM 0 HB VAL B 79 10.007 -4.132 -12.793 1.00 0.00 H new ATOM 0 HG11 VAL B 79 10.800 -2.070 -13.928 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.134 -3.226 -13.702 1.00 0.00 H new ATOM 0 HG13 VAL B 79 11.373 -3.047 -15.300 1.00 0.00 H new ATOM 0 HG21 VAL B 79 8.474 -2.898 -14.302 1.00 0.00 H new ATOM 0 HG22 VAL B 79 9.050 -3.866 -15.680 1.00 0.00 H new ATOM 0 HG23 VAL B 79 8.153 -4.648 -14.357 1.00 0.00 H new ATOM 1754 N THR B 80 12.901 -6.548 -13.913 1.00 0.00 N ATOM 1755 CA THR B 80 14.076 -6.965 -13.093 1.00 0.00 C ATOM 1756 C THR B 80 14.999 -5.760 -12.867 1.00 0.00 C ATOM 1757 O THR B 80 15.745 -5.369 -13.744 1.00 0.00 O ATOM 1758 CB THR B 80 14.837 -8.076 -13.836 1.00 0.00 C ATOM 1759 OG1 THR B 80 14.001 -9.219 -13.953 1.00 0.00 O ATOM 1760 CG2 THR B 80 16.113 -8.456 -13.073 1.00 0.00 C ATOM 0 H THR B 80 12.938 -6.832 -14.892 1.00 0.00 H new ATOM 0 HA THR B 80 13.739 -7.339 -12.126 1.00 0.00 H new ATOM 0 HB THR B 80 15.114 -7.713 -14.826 1.00 0.00 H new ATOM 0 HG1 THR B 80 13.559 -9.213 -14.827 1.00 0.00 H new ATOM 0 HG21 THR B 80 16.639 -9.243 -13.613 1.00 0.00 H new ATOM 0 HG22 THR B 80 16.759 -7.582 -12.986 1.00 0.00 H new ATOM 0 HG23 THR B 80 15.849 -8.813 -12.077 1.00 0.00 H new ATOM 1768 N LEU B 81 14.965 -5.188 -11.692 1.00 0.00 N ATOM 1769 CA LEU B 81 15.849 -4.028 -11.392 1.00 0.00 C ATOM 1770 C LEU B 81 17.172 -4.561 -10.807 1.00 0.00 C ATOM 1771 O LEU B 81 17.146 -5.450 -9.979 1.00 0.00 O ATOM 1772 CB LEU B 81 15.165 -3.126 -10.357 1.00 0.00 C ATOM 1773 CG LEU B 81 14.113 -2.228 -11.027 1.00 0.00 C ATOM 1774 CD1 LEU B 81 14.775 -1.338 -12.085 1.00 0.00 C ATOM 1775 CD2 LEU B 81 13.035 -3.097 -11.684 1.00 0.00 C ATOM 0 H LEU B 81 14.359 -5.478 -10.925 1.00 0.00 H new ATOM 0 HA LEU B 81 16.042 -3.457 -12.300 1.00 0.00 H new ATOM 0 HB2 LEU B 81 14.691 -3.739 -9.590 1.00 0.00 H new ATOM 0 HB3 LEU B 81 15.911 -2.509 -9.856 1.00 0.00 H new ATOM 0 HG LEU B 81 13.654 -1.594 -10.268 1.00 0.00 H new ATOM 0 HD11 LEU B 81 14.020 -0.706 -12.553 1.00 0.00 H new ATOM 0 HD12 LEU B 81 15.531 -0.711 -11.612 1.00 0.00 H new ATOM 0 HD13 LEU B 81 15.246 -1.963 -12.844 1.00 0.00 H new ATOM 0 HD21 LEU B 81 12.291 -2.457 -12.158 1.00 0.00 H new ATOM 0 HD22 LEU B 81 13.494 -3.739 -12.436 1.00 0.00 H new ATOM 0 HD23 LEU B 81 12.553 -3.714 -10.926 1.00 0.00 H new ATOM 1787 N PRO B 82 18.295 -4.022 -11.243 1.00 0.00 N ATOM 1788 CA PRO B 82 19.647 -4.448 -10.760 1.00 0.00 C ATOM 1789 C PRO B 82 19.990 -3.762 -9.437 1.00 0.00 C ATOM 1790 O PRO B 82 19.202 -3.010 -8.895 1.00 0.00 O ATOM 1791 CB PRO B 82 20.582 -3.991 -11.871 1.00 0.00 C ATOM 1792 CG PRO B 82 19.894 -2.850 -12.597 1.00 0.00 C ATOM 1793 CD PRO B 82 18.403 -2.921 -12.266 1.00 0.00 C ATOM 0 HA PRO B 82 19.714 -5.519 -10.566 1.00 0.00 H new ATOM 0 HB2 PRO B 82 21.537 -3.665 -11.460 1.00 0.00 H new ATOM 0 HB3 PRO B 82 20.794 -4.811 -12.557 1.00 0.00 H new ATOM 0 HG2 PRO B 82 20.310 -1.892 -12.285 1.00 0.00 H new ATOM 0 HG3 PRO B 82 20.051 -2.931 -13.673 1.00 0.00 H new ATOM 0 HD2 PRO B 82 18.039 -1.973 -11.869 1.00 0.00 H new ATOM 0 HD3 PRO B 82 17.810 -3.144 -13.153 1.00 0.00 H new