USER MOD reduce.3.24.130724 H: found=0, std=0, add=952, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 62 THR OG1 : rot 180:sc= -0.0175 USER MOD Set 1.2: B 64 GLN : amide:sc= -0.596 X(o=-5,f=-5.1!) USER MOD Set 1.3: B 78 ASN : amide:sc= -4.35 K(o=-5,f=-3.7!) USER MOD Set 2.1: B 41 GLN : amide:sc= -1.81 X(o=-1.8,f=-2) USER MOD Set 2.2: B 44 LYS NZ :NH3+ -178:sc= 0.00705 (180deg=0) USER MOD Set 3.1: A 62 THR OG1 : rot 180:sc= -0.0157 USER MOD Set 3.2: A 64 GLN : amide:sc= -0.594 X(o=-5,f=-5!) USER MOD Set 3.3: A 78 ASN : amide:sc= -4.36 K(o=-5,f=-3.4) USER MOD Set 4.1: A 41 GLN : amide:sc= -1.65 X(o=-1.6,f=-1.9) USER MOD Set 4.2: A 44 LYS NZ :NH3+ 180:sc= 0.00516 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 HIS : no HD1:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 159:sc=-0.00636 (180deg=-0.198) 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 160:sc= -4.92 (180deg=-6.22!) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.0098) USER MOD Single : A 68 LYS NZ :NH3+ 164:sc=-0.00735 (180deg=-0.186) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 93:sc= 0.133 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 37 HIS : no HD1:sc= 0 X(o=0,f=-0.22) USER MOD Single : B 38 TYR OH : rot 180:sc= 0 USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ 157:sc= -0.0182 (180deg=-0.21) 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 154:sc= -4.98 (180deg=-6.37!) USER MOD Single : B 67 GLN : amide:sc= 0 X(o=0,f=-0.0055) USER MOD Single : B 68 LYS NZ :NH3+ 165:sc= -0.0102 (180deg=-0.2) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot 92:sc= 0.132 USER MOD Single : B 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 31 3.986 0.650 2.529 1.00 0.00 N ATOM 2 CA ARG A 31 4.278 0.395 1.090 1.00 0.00 C ATOM 3 C ARG A 31 5.777 0.146 0.909 1.00 0.00 C ATOM 4 O ARG A 31 6.582 1.050 1.025 1.00 0.00 O ATOM 5 CB ARG A 31 3.858 1.610 0.261 1.00 0.00 C ATOM 6 CG ARG A 31 3.500 1.161 -1.157 1.00 0.00 C ATOM 7 CD ARG A 31 3.102 2.377 -1.995 1.00 0.00 C ATOM 8 NE ARG A 31 1.614 2.531 -1.978 1.00 0.00 N ATOM 9 CZ ARG A 31 1.023 3.560 -2.551 1.00 0.00 C ATOM 10 NH1 ARG A 31 1.711 4.496 -3.164 1.00 0.00 N ATOM 11 NH2 ARG A 31 -0.279 3.650 -2.510 1.00 0.00 N ATOM 0 HA ARG A 31 3.722 -0.481 0.757 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.003 2.102 0.725 1.00 0.00 H new ATOM 0 HB3 ARG A 31 4.667 2.339 0.230 1.00 0.00 H new ATOM 0 HG2 ARG A 31 4.350 0.654 -1.614 1.00 0.00 H new ATOM 0 HG3 ARG A 31 2.680 0.444 -1.126 1.00 0.00 H new ATOM 0 HD2 ARG A 31 3.576 3.275 -1.599 1.00 0.00 H new ATOM 0 HD3 ARG A 31 3.454 2.257 -3.020 1.00 0.00 H new ATOM 0 HE ARG A 31 1.045 1.824 -1.513 1.00 0.00 H new ATOM 0 HH11 ARG A 31 2.728 4.437 -3.205 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.228 5.282 -3.599 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.825 2.929 -2.039 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -0.750 4.441 -2.949 1.00 0.00 H new ATOM 27 N SER A 32 6.153 -1.075 0.626 1.00 0.00 N ATOM 28 CA SER A 32 7.596 -1.398 0.435 1.00 0.00 C ATOM 29 C SER A 32 8.154 -0.649 -0.781 1.00 0.00 C ATOM 30 O SER A 32 9.355 -0.547 -0.949 1.00 0.00 O ATOM 31 CB SER A 32 7.756 -2.902 0.218 1.00 0.00 C ATOM 32 OG SER A 32 7.198 -3.598 1.324 1.00 0.00 O ATOM 0 H SER A 32 5.517 -1.865 0.519 1.00 0.00 H new ATOM 0 HA SER A 32 8.146 -1.090 1.324 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.259 -3.203 -0.704 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.811 -3.155 0.109 1.00 0.00 H new ATOM 0 HG SER A 32 7.298 -4.563 1.187 1.00 0.00 H new ATOM 38 N ASP A 33 7.300 -0.128 -1.635 1.00 0.00 N ATOM 39 CA ASP A 33 7.795 0.605 -2.834 1.00 0.00 C ATOM 40 C ASP A 33 8.055 2.082 -2.501 1.00 0.00 C ATOM 41 O ASP A 33 8.231 2.891 -3.388 1.00 0.00 O ATOM 42 CB ASP A 33 6.758 0.521 -3.955 1.00 0.00 C ATOM 43 CG ASP A 33 6.364 -0.940 -4.187 1.00 0.00 C ATOM 44 OD1 ASP A 33 5.620 -1.468 -3.377 1.00 0.00 O ATOM 45 OD2 ASP A 33 6.813 -1.504 -5.171 1.00 0.00 O ATOM 0 H ASP A 33 6.285 -0.182 -1.548 1.00 0.00 H new ATOM 0 HA ASP A 33 8.729 0.144 -3.155 1.00 0.00 H new ATOM 0 HB2 ASP A 33 5.877 1.108 -3.693 1.00 0.00 H new ATOM 0 HB3 ASP A 33 7.164 0.948 -4.872 1.00 0.00 H new ATOM 50 N ALA A 34 8.087 2.441 -1.239 1.00 0.00 N ATOM 51 CA ALA A 34 8.349 3.857 -0.865 1.00 0.00 C ATOM 52 C ALA A 34 9.859 4.075 -0.663 1.00 0.00 C ATOM 53 O ALA A 34 10.326 5.196 -0.605 1.00 0.00 O ATOM 54 CB ALA A 34 7.610 4.182 0.433 1.00 0.00 C ATOM 0 H ALA A 34 7.942 1.807 -0.453 1.00 0.00 H new ATOM 0 HA ALA A 34 7.997 4.511 -1.663 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.800 5.219 0.710 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.540 4.035 0.289 1.00 0.00 H new ATOM 0 HB3 ALA A 34 7.963 3.524 1.227 1.00 0.00 H new ATOM 60 N GLU A 35 10.619 3.010 -0.549 1.00 0.00 N ATOM 61 CA GLU A 35 12.092 3.142 -0.341 1.00 0.00 C ATOM 62 C GLU A 35 12.768 3.881 -1.519 1.00 0.00 C ATOM 63 O GLU A 35 13.616 4.718 -1.285 1.00 0.00 O ATOM 64 CB GLU A 35 12.719 1.749 -0.184 1.00 0.00 C ATOM 65 CG GLU A 35 11.955 0.941 0.875 1.00 0.00 C ATOM 66 CD GLU A 35 12.786 0.846 2.158 1.00 0.00 C ATOM 67 OE1 GLU A 35 13.428 1.827 2.497 1.00 0.00 O ATOM 68 OE2 GLU A 35 12.765 -0.203 2.779 1.00 0.00 O ATOM 0 H GLU A 35 10.277 2.050 -0.592 1.00 0.00 H new ATOM 0 HA GLU A 35 12.252 3.728 0.564 1.00 0.00 H new ATOM 0 HB2 GLU A 35 12.698 1.223 -1.138 1.00 0.00 H new ATOM 0 HB3 GLU A 35 13.766 1.844 0.105 1.00 0.00 H new ATOM 0 HG2 GLU A 35 10.997 1.416 1.086 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.739 -0.058 0.497 1.00 0.00 H new ATOM 75 N PRO A 36 12.406 3.561 -2.753 1.00 0.00 N ATOM 76 CA PRO A 36 13.009 4.203 -3.967 1.00 0.00 C ATOM 77 C PRO A 36 12.297 5.517 -4.312 1.00 0.00 C ATOM 78 O PRO A 36 12.926 6.501 -4.644 1.00 0.00 O ATOM 79 CB PRO A 36 12.792 3.163 -5.058 1.00 0.00 C ATOM 80 CG PRO A 36 11.615 2.303 -4.638 1.00 0.00 C ATOM 81 CD PRO A 36 11.364 2.547 -3.150 1.00 0.00 C ATOM 0 HA PRO A 36 14.058 4.467 -3.830 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.592 3.646 -6.014 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.686 2.553 -5.190 1.00 0.00 H new ATOM 0 HG2 PRO A 36 10.730 2.556 -5.221 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.827 1.250 -4.822 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.356 2.924 -2.974 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.466 1.627 -2.574 1.00 0.00 H new ATOM 89 N HIS A 37 10.985 5.531 -4.247 1.00 0.00 N ATOM 90 CA HIS A 37 10.193 6.767 -4.576 1.00 0.00 C ATOM 91 C HIS A 37 10.144 7.003 -6.098 1.00 0.00 C ATOM 92 O HIS A 37 9.512 7.936 -6.557 1.00 0.00 O ATOM 93 CB HIS A 37 10.795 8.001 -3.886 1.00 0.00 C ATOM 94 CG HIS A 37 9.704 8.994 -3.593 1.00 0.00 C ATOM 95 ND1 HIS A 37 9.394 10.029 -4.462 1.00 0.00 N ATOM 96 CD2 HIS A 37 8.843 9.125 -2.533 1.00 0.00 C ATOM 97 CE1 HIS A 37 8.385 10.730 -3.914 1.00 0.00 C ATOM 98 NE2 HIS A 37 8.011 10.222 -2.737 1.00 0.00 N ATOM 0 H HIS A 37 10.419 4.727 -3.976 1.00 0.00 H new ATOM 0 HA HIS A 37 9.178 6.613 -4.210 1.00 0.00 H new ATOM 0 HB2 HIS A 37 11.292 7.708 -2.961 1.00 0.00 H new ATOM 0 HB3 HIS A 37 11.552 8.455 -4.525 1.00 0.00 H new ATOM 0 HD2 HIS A 37 8.815 8.475 -1.671 1.00 0.00 H new ATOM 0 HE1 HIS A 37 7.933 11.598 -4.370 1.00 0.00 H new ATOM 0 HE2 HIS A 37 7.274 10.564 -2.120 1.00 0.00 H new ATOM 106 N TYR A 38 10.784 6.168 -6.885 1.00 0.00 N ATOM 107 CA TYR A 38 10.746 6.349 -8.369 1.00 0.00 C ATOM 108 C TYR A 38 10.094 5.117 -9.003 1.00 0.00 C ATOM 109 O TYR A 38 9.383 5.214 -9.984 1.00 0.00 O ATOM 110 CB TYR A 38 12.167 6.530 -8.920 1.00 0.00 C ATOM 111 CG TYR A 38 13.085 5.464 -8.365 1.00 0.00 C ATOM 112 CD1 TYR A 38 13.166 4.213 -8.989 1.00 0.00 C ATOM 113 CD2 TYR A 38 13.860 5.731 -7.231 1.00 0.00 C ATOM 114 CE1 TYR A 38 14.022 3.230 -8.478 1.00 0.00 C ATOM 115 CE2 TYR A 38 14.716 4.748 -6.719 1.00 0.00 C ATOM 116 CZ TYR A 38 14.797 3.498 -7.342 1.00 0.00 C ATOM 117 OH TYR A 38 15.641 2.529 -6.839 1.00 0.00 O ATOM 0 H TYR A 38 11.330 5.370 -6.561 1.00 0.00 H new ATOM 0 HA TYR A 38 10.166 7.240 -8.611 1.00 0.00 H new ATOM 0 HB2 TYR A 38 12.152 6.476 -10.009 1.00 0.00 H new ATOM 0 HB3 TYR A 38 12.544 7.518 -8.655 1.00 0.00 H new ATOM 0 HD1 TYR A 38 12.568 4.006 -9.864 1.00 0.00 H new ATOM 0 HD2 TYR A 38 13.798 6.696 -6.750 1.00 0.00 H new ATOM 0 HE1 TYR A 38 14.085 2.265 -8.959 1.00 0.00 H new ATOM 0 HE2 TYR A 38 15.313 4.955 -5.843 1.00 0.00 H new ATOM 0 HH TYR A 38 16.106 2.878 -6.050 1.00 0.00 H new ATOM 127 N LEU A 39 10.320 3.957 -8.433 1.00 0.00 N ATOM 128 CA LEU A 39 9.711 2.703 -8.971 1.00 0.00 C ATOM 129 C LEU A 39 8.179 2.862 -9.122 1.00 0.00 C ATOM 130 O LEU A 39 7.646 2.574 -10.177 1.00 0.00 O ATOM 131 CB LEU A 39 10.021 1.546 -8.007 1.00 0.00 C ATOM 132 CG LEU A 39 10.703 0.389 -8.759 1.00 0.00 C ATOM 133 CD1 LEU A 39 9.823 -0.086 -9.922 1.00 0.00 C ATOM 134 CD2 LEU A 39 12.053 0.862 -9.305 1.00 0.00 C ATOM 0 H LEU A 39 10.907 3.827 -7.609 1.00 0.00 H new ATOM 0 HA LEU A 39 10.132 2.494 -9.954 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.668 1.897 -7.203 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.100 1.194 -7.543 1.00 0.00 H new ATOM 0 HG LEU A 39 10.852 -0.440 -8.067 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.320 -0.904 -10.443 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.864 -0.431 -9.535 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.659 0.739 -10.615 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.537 0.043 -9.838 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.897 1.697 -9.988 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.688 1.182 -8.479 1.00 0.00 H new ATOM 146 N PRO A 40 7.504 3.317 -8.077 1.00 0.00 N ATOM 147 CA PRO A 40 6.016 3.516 -8.104 1.00 0.00 C ATOM 148 C PRO A 40 5.648 4.740 -8.953 1.00 0.00 C ATOM 149 O PRO A 40 4.515 4.898 -9.372 1.00 0.00 O ATOM 150 CB PRO A 40 5.643 3.702 -6.641 1.00 0.00 C ATOM 151 CG PRO A 40 6.886 4.173 -5.920 1.00 0.00 C ATOM 152 CD PRO A 40 8.089 3.710 -6.739 1.00 0.00 C ATOM 0 HA PRO A 40 5.480 2.682 -8.556 1.00 0.00 H new ATOM 0 HB2 PRO A 40 4.839 4.431 -6.538 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.282 2.767 -6.214 1.00 0.00 H new ATOM 0 HG2 PRO A 40 6.884 5.258 -5.820 1.00 0.00 H new ATOM 0 HG3 PRO A 40 6.925 3.760 -4.912 1.00 0.00 H new ATOM 0 HD2 PRO A 40 8.827 4.505 -6.846 1.00 0.00 H new ATOM 0 HD3 PRO A 40 8.594 2.869 -6.263 1.00 0.00 H new ATOM 160 N GLN A 41 6.602 5.594 -9.231 1.00 0.00 N ATOM 161 CA GLN A 41 6.321 6.787 -10.075 1.00 0.00 C ATOM 162 C GLN A 41 6.260 6.334 -11.538 1.00 0.00 C ATOM 163 O GLN A 41 5.525 6.879 -12.344 1.00 0.00 O ATOM 164 CB GLN A 41 7.453 7.808 -9.886 1.00 0.00 C ATOM 165 CG GLN A 41 7.232 9.025 -10.792 1.00 0.00 C ATOM 166 CD GLN A 41 6.018 9.815 -10.301 1.00 0.00 C ATOM 167 OE1 GLN A 41 5.807 9.951 -9.111 1.00 0.00 O ATOM 168 NE2 GLN A 41 5.204 10.346 -11.172 1.00 0.00 N ATOM 0 H GLN A 41 7.566 5.512 -8.907 1.00 0.00 H new ATOM 0 HA GLN A 41 5.375 7.249 -9.793 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.495 8.125 -8.844 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.412 7.344 -10.117 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.118 9.660 -10.788 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.076 8.702 -11.821 1.00 0.00 H new ATOM 0 HE21 GLN A 41 5.380 10.232 -12.170 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.392 10.875 -10.855 1.00 0.00 H new ATOM 177 N LEU A 42 7.040 5.342 -11.883 1.00 0.00 N ATOM 178 CA LEU A 42 7.057 4.846 -13.279 1.00 0.00 C ATOM 179 C LEU A 42 5.823 3.981 -13.533 1.00 0.00 C ATOM 180 O LEU A 42 5.201 4.067 -14.574 1.00 0.00 O ATOM 181 CB LEU A 42 8.319 3.997 -13.508 1.00 0.00 C ATOM 182 CG LEU A 42 9.652 4.805 -13.395 1.00 0.00 C ATOM 183 CD1 LEU A 42 9.456 6.270 -12.959 1.00 0.00 C ATOM 184 CD2 LEU A 42 10.569 4.115 -12.380 1.00 0.00 C ATOM 0 H LEU A 42 7.670 4.854 -11.246 1.00 0.00 H new ATOM 0 HA LEU A 42 7.055 5.697 -13.960 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.335 3.184 -12.782 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.264 3.541 -14.496 1.00 0.00 H new ATOM 0 HG LEU A 42 10.088 4.824 -14.394 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.425 6.766 -12.903 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.827 6.785 -13.685 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.977 6.297 -11.980 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.502 4.672 -12.295 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.076 4.082 -11.408 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.782 3.100 -12.714 1.00 0.00 H new ATOM 196 N ARG A 43 5.462 3.136 -12.593 1.00 0.00 N ATOM 197 CA ARG A 43 4.269 2.265 -12.792 1.00 0.00 C ATOM 198 C ARG A 43 3.031 3.146 -12.958 1.00 0.00 C ATOM 199 O ARG A 43 2.203 2.913 -13.822 1.00 0.00 O ATOM 200 CB ARG A 43 4.100 1.318 -11.596 1.00 0.00 C ATOM 201 CG ARG A 43 3.749 2.095 -10.324 1.00 0.00 C ATOM 202 CD ARG A 43 3.682 1.130 -9.139 1.00 0.00 C ATOM 203 NE ARG A 43 2.981 1.794 -7.996 1.00 0.00 N ATOM 204 CZ ARG A 43 3.106 1.353 -6.760 1.00 0.00 C ATOM 205 NH1 ARG A 43 3.848 0.309 -6.472 1.00 0.00 N ATOM 206 NH2 ARG A 43 2.476 1.970 -5.798 1.00 0.00 N ATOM 0 H ARG A 43 5.943 3.016 -11.702 1.00 0.00 H new ATOM 0 HA ARG A 43 4.402 1.659 -13.688 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.316 0.592 -11.811 1.00 0.00 H new ATOM 0 HB3 ARG A 43 5.021 0.756 -11.440 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.497 2.865 -10.138 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.793 2.603 -10.448 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.153 0.221 -9.426 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.687 0.833 -8.840 1.00 0.00 H new ATOM 0 HE ARG A 43 2.392 2.607 -8.177 1.00 0.00 H new ATOM 0 HH11 ARG A 43 4.346 -0.183 -7.214 1.00 0.00 H new ATOM 0 HH12 ARG A 43 3.926 -0.010 -5.506 1.00 0.00 H new ATOM 0 HH21 ARG A 43 1.896 2.783 -6.007 1.00 0.00 H new ATOM 0 HH22 ARG A 43 2.564 1.640 -4.837 1.00 0.00 H new ATOM 220 N LYS A 44 2.901 4.170 -12.147 1.00 0.00 N ATOM 221 CA LYS A 44 1.731 5.063 -12.281 1.00 0.00 C ATOM 222 C LYS A 44 1.820 5.769 -13.637 1.00 0.00 C ATOM 223 O LYS A 44 0.820 6.068 -14.263 1.00 0.00 O ATOM 224 CB LYS A 44 1.715 6.084 -11.135 1.00 0.00 C ATOM 225 CG LYS A 44 2.944 6.994 -11.210 1.00 0.00 C ATOM 226 CD LYS A 44 2.800 8.131 -10.197 1.00 0.00 C ATOM 227 CE LYS A 44 2.874 7.564 -8.780 1.00 0.00 C ATOM 228 NZ LYS A 44 2.992 8.684 -7.803 1.00 0.00 N ATOM 0 H LYS A 44 3.557 4.416 -11.405 1.00 0.00 H new ATOM 0 HA LYS A 44 0.806 4.488 -12.228 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.807 6.684 -11.188 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.698 5.564 -10.177 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.847 6.420 -11.003 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.048 7.400 -12.216 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.589 8.868 -10.347 1.00 0.00 H new ATOM 0 HD3 LYS A 44 1.851 8.646 -10.345 1.00 0.00 H new ATOM 0 HE2 LYS A 44 1.984 6.973 -8.566 1.00 0.00 H new ATOM 0 HE3 LYS A 44 3.730 6.895 -8.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 3.042 8.299 -6.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 3.854 9.230 -8.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 2.162 9.305 -7.885 1.00 0.00 H new ATOM 242 N ASP A 45 3.026 6.023 -14.098 1.00 0.00 N ATOM 243 CA ASP A 45 3.201 6.686 -15.410 1.00 0.00 C ATOM 244 C ASP A 45 2.676 5.764 -16.511 1.00 0.00 C ATOM 245 O ASP A 45 1.958 6.196 -17.385 1.00 0.00 O ATOM 246 CB ASP A 45 4.682 6.983 -15.647 1.00 0.00 C ATOM 247 CG ASP A 45 5.128 8.143 -14.753 1.00 0.00 C ATOM 248 OD1 ASP A 45 4.312 9.011 -14.490 1.00 0.00 O ATOM 249 OD2 ASP A 45 6.279 8.144 -14.349 1.00 0.00 O ATOM 0 H ASP A 45 3.893 5.794 -13.611 1.00 0.00 H new ATOM 0 HA ASP A 45 2.646 7.624 -15.422 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.279 6.096 -15.433 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.849 7.234 -16.694 1.00 0.00 H new ATOM 254 N ILE A 46 3.019 4.491 -16.473 1.00 0.00 N ATOM 255 CA ILE A 46 2.520 3.552 -17.528 1.00 0.00 C ATOM 256 C ILE A 46 0.985 3.523 -17.489 1.00 0.00 C ATOM 257 O ILE A 46 0.335 3.336 -18.501 1.00 0.00 O ATOM 258 CB ILE A 46 3.121 2.141 -17.331 1.00 0.00 C ATOM 259 CG1 ILE A 46 2.825 1.300 -18.578 1.00 0.00 C ATOM 260 CG2 ILE A 46 2.550 1.434 -16.087 1.00 0.00 C ATOM 261 CD1 ILE A 46 3.553 -0.043 -18.485 1.00 0.00 C ATOM 0 H ILE A 46 3.617 4.069 -15.763 1.00 0.00 H new ATOM 0 HA ILE A 46 2.838 3.901 -18.510 1.00 0.00 H new ATOM 0 HB ILE A 46 4.195 2.248 -17.181 1.00 0.00 H new ATOM 0 HG12 ILE A 46 1.751 1.136 -18.670 1.00 0.00 H new ATOM 0 HG13 ILE A 46 3.144 1.835 -19.472 1.00 0.00 H new ATOM 0 HG21 ILE A 46 3.002 0.447 -15.990 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.774 2.024 -15.198 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.470 1.330 -16.191 1.00 0.00 H new ATOM 0 HD11 ILE A 46 3.338 -0.636 -19.374 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.627 0.129 -18.414 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.213 -0.581 -17.600 1.00 0.00 H new ATOM 273 N LEU A 47 0.408 3.733 -16.329 1.00 0.00 N ATOM 274 CA LEU A 47 -1.073 3.748 -16.219 1.00 0.00 C ATOM 275 C LEU A 47 -1.590 4.966 -16.978 1.00 0.00 C ATOM 276 O LEU A 47 -2.527 4.882 -17.751 1.00 0.00 O ATOM 277 CB LEU A 47 -1.477 3.846 -14.747 1.00 0.00 C ATOM 278 CG LEU A 47 -1.396 2.463 -14.098 1.00 0.00 C ATOM 279 CD1 LEU A 47 -1.518 2.604 -12.580 1.00 0.00 C ATOM 280 CD2 LEU A 47 -2.540 1.590 -14.619 1.00 0.00 C ATOM 0 H LEU A 47 0.907 3.895 -15.454 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.495 2.835 -16.638 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.821 4.542 -14.225 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.490 4.239 -14.663 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.440 2.001 -14.345 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.460 1.619 -12.117 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.707 3.229 -12.206 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.474 3.065 -12.333 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.484 0.604 -14.158 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.494 2.054 -14.370 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.457 1.490 -15.701 1.00 0.00 H new ATOM 292 N GLU A 48 -0.960 6.095 -16.776 1.00 0.00 N ATOM 293 CA GLU A 48 -1.379 7.327 -17.495 1.00 0.00 C ATOM 294 C GLU A 48 -1.021 7.151 -18.957 1.00 0.00 C ATOM 295 O GLU A 48 -1.745 7.562 -19.844 1.00 0.00 O ATOM 296 CB GLU A 48 -0.632 8.551 -16.960 1.00 0.00 C ATOM 297 CG GLU A 48 -0.682 8.585 -15.435 1.00 0.00 C ATOM 298 CD GLU A 48 -1.821 9.497 -14.975 1.00 0.00 C ATOM 299 OE1 GLU A 48 -2.966 9.105 -15.128 1.00 0.00 O ATOM 300 OE2 GLU A 48 -1.528 10.573 -14.477 1.00 0.00 O ATOM 0 H GLU A 48 -0.171 6.213 -16.141 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.449 7.481 -17.355 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.405 8.526 -17.295 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.076 9.461 -17.364 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.829 7.578 -15.044 1.00 0.00 H new ATOM 0 HG3 GLU A 48 0.267 8.945 -15.039 1.00 0.00 H new ATOM 307 N VAL A 49 0.104 6.527 -19.213 1.00 0.00 N ATOM 308 CA VAL A 49 0.532 6.300 -20.616 1.00 0.00 C ATOM 309 C VAL A 49 -0.541 5.457 -21.307 1.00 0.00 C ATOM 310 O VAL A 49 -1.102 5.856 -22.304 1.00 0.00 O ATOM 311 CB VAL A 49 1.885 5.574 -20.643 1.00 0.00 C ATOM 312 CG1 VAL A 49 2.323 5.346 -22.094 1.00 0.00 C ATOM 313 CG2 VAL A 49 2.940 6.425 -19.923 1.00 0.00 C ATOM 0 H VAL A 49 0.742 6.167 -18.503 1.00 0.00 H new ATOM 0 HA VAL A 49 0.651 7.251 -21.136 1.00 0.00 H new ATOM 0 HB VAL A 49 1.784 4.613 -20.140 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.283 4.831 -22.107 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.578 4.738 -22.608 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.420 6.307 -22.600 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.900 5.908 -19.943 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.036 7.388 -20.425 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.635 6.584 -18.889 1.00 0.00 H new ATOM 323 N ILE A 50 -0.872 4.314 -20.750 1.00 0.00 N ATOM 324 CA ILE A 50 -1.955 3.473 -21.353 1.00 0.00 C ATOM 325 C ILE A 50 -3.236 4.315 -21.449 1.00 0.00 C ATOM 326 O ILE A 50 -4.098 4.057 -22.266 1.00 0.00 O ATOM 327 CB ILE A 50 -2.201 2.236 -20.479 1.00 0.00 C ATOM 328 CG1 ILE A 50 -0.899 1.442 -20.340 1.00 0.00 C ATOM 329 CG2 ILE A 50 -3.265 1.349 -21.129 1.00 0.00 C ATOM 330 CD1 ILE A 50 -0.915 0.660 -19.025 1.00 0.00 C ATOM 0 H ILE A 50 -0.441 3.930 -19.909 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.658 3.141 -22.348 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.544 2.554 -19.495 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.787 0.758 -21.181 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.044 2.118 -20.363 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.437 0.471 -20.506 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.194 1.910 -21.231 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.923 1.033 -22.114 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.012 0.095 -18.926 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.007 1.354 -18.190 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.761 -0.027 -19.021 1.00 0.00 H new ATOM 342 N CYS A 51 -3.350 5.334 -20.627 1.00 0.00 N ATOM 343 CA CYS A 51 -4.543 6.213 -20.672 1.00 0.00 C ATOM 344 C CYS A 51 -4.449 7.124 -21.901 1.00 0.00 C ATOM 345 O CYS A 51 -5.397 7.281 -22.643 1.00 0.00 O ATOM 346 CB CYS A 51 -4.588 7.068 -19.399 1.00 0.00 C ATOM 347 SG CYS A 51 -6.282 7.637 -19.114 1.00 0.00 S ATOM 0 H CYS A 51 -2.656 5.589 -19.924 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.448 5.609 -20.735 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.240 6.487 -18.545 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -3.918 7.922 -19.498 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.321 8.360 -18.034 1.00 0.00 H new ATOM 353 N LYS A 52 -3.307 7.722 -22.123 1.00 0.00 N ATOM 354 CA LYS A 52 -3.137 8.631 -23.303 1.00 0.00 C ATOM 355 C LYS A 52 -3.458 7.882 -24.600 1.00 0.00 C ATOM 356 O LYS A 52 -3.935 8.459 -25.559 1.00 0.00 O ATOM 357 CB LYS A 52 -1.690 9.125 -23.383 1.00 0.00 C ATOM 358 CG LYS A 52 -1.288 9.835 -22.090 1.00 0.00 C ATOM 359 CD LYS A 52 0.238 9.822 -21.970 1.00 0.00 C ATOM 360 CE LYS A 52 0.808 11.121 -22.542 1.00 0.00 C ATOM 361 NZ LYS A 52 0.556 12.237 -21.588 1.00 0.00 N ATOM 0 H LYS A 52 -2.479 7.621 -21.536 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.816 9.475 -23.181 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.022 8.282 -23.563 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.579 9.806 -24.227 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.657 10.861 -22.093 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.738 9.337 -21.231 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.530 9.714 -20.925 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.648 8.966 -22.506 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.878 11.014 -22.719 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.346 11.340 -23.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.221 13.014 -21.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.419 12.580 -21.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.690 11.898 -20.614 1.00 0.00 H new ATOM 375 N TYR A 53 -3.178 6.608 -24.635 1.00 0.00 N ATOM 376 CA TYR A 53 -3.432 5.809 -25.861 1.00 0.00 C ATOM 377 C TYR A 53 -4.709 4.967 -25.692 1.00 0.00 C ATOM 378 O TYR A 53 -5.245 4.453 -26.656 1.00 0.00 O ATOM 379 CB TYR A 53 -2.245 4.866 -26.088 1.00 0.00 C ATOM 380 CG TYR A 53 -0.959 5.641 -26.316 1.00 0.00 C ATOM 381 CD1 TYR A 53 -0.412 6.422 -25.288 1.00 0.00 C ATOM 382 CD2 TYR A 53 -0.298 5.556 -27.546 1.00 0.00 C ATOM 383 CE1 TYR A 53 0.785 7.114 -25.487 1.00 0.00 C ATOM 384 CE2 TYR A 53 0.904 6.247 -27.744 1.00 0.00 C ATOM 385 CZ TYR A 53 1.445 7.027 -26.713 1.00 0.00 C ATOM 386 OH TYR A 53 2.629 7.708 -26.909 1.00 0.00 O ATOM 0 H TYR A 53 -2.780 6.083 -23.856 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.557 6.482 -26.709 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.129 4.210 -25.225 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.445 4.228 -26.949 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -0.919 6.489 -24.337 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.715 4.958 -28.343 1.00 0.00 H new ATOM 0 HE1 TYR A 53 1.199 7.716 -24.692 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.415 6.179 -28.693 1.00 0.00 H new ATOM 0 HH TYR A 53 2.957 7.539 -27.817 1.00 0.00 H new ATOM 396 N VAL A 54 -5.192 4.804 -24.478 1.00 0.00 N ATOM 397 CA VAL A 54 -6.423 3.973 -24.253 1.00 0.00 C ATOM 398 C VAL A 54 -7.142 4.508 -22.992 1.00 0.00 C ATOM 399 O VAL A 54 -7.238 5.705 -22.812 1.00 0.00 O ATOM 400 CB VAL A 54 -6.042 2.480 -24.081 1.00 0.00 C ATOM 401 CG1 VAL A 54 -7.248 1.608 -24.441 1.00 0.00 C ATOM 402 CG2 VAL A 54 -4.874 2.096 -25.001 1.00 0.00 C ATOM 0 H VAL A 54 -4.787 5.210 -23.635 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.088 4.044 -25.113 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.743 2.323 -23.045 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.985 0.557 -24.322 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -8.082 1.851 -23.782 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.536 1.795 -25.475 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.629 1.043 -24.858 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.158 2.265 -26.040 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.004 2.707 -24.759 1.00 0.00 H new ATOM 412 N GLN A 55 -7.656 3.659 -22.119 1.00 0.00 N ATOM 413 CA GLN A 55 -8.346 4.172 -20.898 1.00 0.00 C ATOM 414 C GLN A 55 -8.664 3.006 -19.960 1.00 0.00 C ATOM 415 O GLN A 55 -9.525 2.191 -20.231 1.00 0.00 O ATOM 416 CB GLN A 55 -9.641 4.885 -21.301 1.00 0.00 C ATOM 417 CG GLN A 55 -9.502 6.389 -21.051 1.00 0.00 C ATOM 418 CD GLN A 55 -10.429 7.154 -21.998 1.00 0.00 C ATOM 419 OE1 GLN A 55 -11.636 7.049 -21.901 1.00 0.00 O ATOM 420 NE2 GLN A 55 -9.912 7.923 -22.917 1.00 0.00 N ATOM 0 H GLN A 55 -7.624 2.643 -22.206 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.695 4.878 -20.383 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.857 4.700 -22.353 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.479 4.488 -20.729 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.752 6.620 -20.016 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -8.469 6.700 -21.207 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -8.899 8.011 -22.998 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -10.521 8.436 -23.554 1.00 0.00 H new ATOM 429 N ILE A 56 -7.968 2.931 -18.859 1.00 0.00 N ATOM 430 CA ILE A 56 -8.204 1.830 -17.878 1.00 0.00 C ATOM 431 C ILE A 56 -8.107 2.392 -16.461 1.00 0.00 C ATOM 432 O ILE A 56 -7.654 3.503 -16.256 1.00 0.00 O ATOM 433 CB ILE A 56 -7.153 0.726 -18.054 1.00 0.00 C ATOM 434 CG1 ILE A 56 -5.775 1.343 -18.334 1.00 0.00 C ATOM 435 CG2 ILE A 56 -7.555 -0.177 -19.220 1.00 0.00 C ATOM 436 CD1 ILE A 56 -4.700 0.566 -17.571 1.00 0.00 C ATOM 0 H ILE A 56 -7.238 3.592 -18.593 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.195 1.409 -18.049 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.097 0.140 -17.137 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.565 1.319 -19.403 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -5.766 2.390 -18.031 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.809 -0.962 -19.346 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -8.525 -0.628 -19.013 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.618 0.414 -20.133 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.723 1.005 -17.771 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -4.907 0.613 -16.502 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.703 -0.474 -17.896 1.00 0.00 H new ATOM 448 N ASP A 57 -8.520 1.628 -15.485 1.00 0.00 N ATOM 449 CA ASP A 57 -8.445 2.105 -14.076 1.00 0.00 C ATOM 450 C ASP A 57 -7.232 1.458 -13.394 1.00 0.00 C ATOM 451 O ASP A 57 -6.704 0.486 -13.897 1.00 0.00 O ATOM 452 CB ASP A 57 -9.722 1.705 -13.334 1.00 0.00 C ATOM 453 CG ASP A 57 -10.792 2.779 -13.539 1.00 0.00 C ATOM 454 OD1 ASP A 57 -10.439 3.947 -13.539 1.00 0.00 O ATOM 455 OD2 ASP A 57 -11.947 2.416 -13.695 1.00 0.00 O ATOM 0 H ASP A 57 -8.907 0.692 -15.605 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.343 3.190 -14.058 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.082 0.744 -13.701 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.514 1.583 -12.271 1.00 0.00 H new ATOM 460 N PRO A 58 -6.818 1.997 -12.266 1.00 0.00 N ATOM 461 CA PRO A 58 -5.650 1.462 -11.498 1.00 0.00 C ATOM 462 C PRO A 58 -6.042 0.163 -10.802 1.00 0.00 C ATOM 463 O PRO A 58 -5.230 -0.725 -10.622 1.00 0.00 O ATOM 464 CB PRO A 58 -5.325 2.566 -10.502 1.00 0.00 C ATOM 465 CG PRO A 58 -6.592 3.379 -10.318 1.00 0.00 C ATOM 466 CD PRO A 58 -7.436 3.192 -11.580 1.00 0.00 C ATOM 0 HA PRO A 58 -4.790 1.221 -12.122 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -4.995 2.145 -9.552 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -4.514 3.193 -10.872 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -7.139 3.045 -9.436 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.355 4.432 -10.166 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.483 3.013 -11.336 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -7.403 4.077 -12.216 1.00 0.00 H new ATOM 474 N GLU A 59 -7.294 0.030 -10.450 1.00 0.00 N ATOM 475 CA GLU A 59 -7.760 -1.229 -9.808 1.00 0.00 C ATOM 476 C GLU A 59 -7.698 -2.370 -10.838 1.00 0.00 C ATOM 477 O GLU A 59 -7.783 -3.532 -10.487 1.00 0.00 O ATOM 478 CB GLU A 59 -9.201 -1.054 -9.323 1.00 0.00 C ATOM 479 CG GLU A 59 -9.274 0.126 -8.352 1.00 0.00 C ATOM 480 CD GLU A 59 -8.523 -0.225 -7.065 1.00 0.00 C ATOM 481 OE1 GLU A 59 -7.315 -0.059 -7.045 1.00 0.00 O ATOM 482 OE2 GLU A 59 -9.170 -0.652 -6.123 1.00 0.00 O ATOM 0 H GLU A 59 -8.013 0.742 -10.581 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.122 -1.466 -8.957 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.863 -0.882 -10.172 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.543 -1.965 -8.831 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.838 1.014 -8.809 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -10.314 0.361 -8.126 1.00 0.00 H new ATOM 489 N MET A 60 -7.546 -2.048 -12.108 1.00 0.00 N ATOM 490 CA MET A 60 -7.474 -3.105 -13.153 1.00 0.00 C ATOM 491 C MET A 60 -6.012 -3.521 -13.359 1.00 0.00 C ATOM 492 O MET A 60 -5.730 -4.614 -13.811 1.00 0.00 O ATOM 493 CB MET A 60 -8.035 -2.545 -14.465 1.00 0.00 C ATOM 494 CG MET A 60 -9.571 -2.574 -14.427 1.00 0.00 C ATOM 495 SD MET A 60 -10.192 -3.934 -15.450 1.00 0.00 S ATOM 496 CE MET A 60 -10.110 -3.074 -17.039 1.00 0.00 C ATOM 0 H MET A 60 -7.469 -1.093 -12.457 1.00 0.00 H new ATOM 0 HA MET A 60 -8.055 -3.973 -12.842 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.685 -1.524 -14.615 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.671 -3.133 -15.307 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.915 -2.695 -13.400 1.00 0.00 H new ATOM 0 HG3 MET A 60 -9.970 -1.626 -14.788 1.00 0.00 H new ATOM 0 HE1 MET A 60 -10.104 -3.804 -17.848 1.00 0.00 H new ATOM 0 HE2 MET A 60 -10.977 -2.422 -17.145 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.199 -2.476 -17.083 1.00 0.00 H new ATOM 506 N VAL A 61 -5.083 -2.653 -13.034 1.00 0.00 N ATOM 507 CA VAL A 61 -3.640 -2.989 -13.213 1.00 0.00 C ATOM 508 C VAL A 61 -3.043 -3.424 -11.871 1.00 0.00 C ATOM 509 O VAL A 61 -3.074 -2.687 -10.903 1.00 0.00 O ATOM 510 CB VAL A 61 -2.897 -1.754 -13.729 1.00 0.00 C ATOM 511 CG1 VAL A 61 -1.451 -2.125 -14.063 1.00 0.00 C ATOM 512 CG2 VAL A 61 -3.591 -1.232 -14.990 1.00 0.00 C ATOM 0 H VAL A 61 -5.266 -1.725 -12.652 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.540 -3.803 -13.931 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.904 -0.981 -12.960 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.925 -1.244 -14.430 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -0.955 -2.497 -13.167 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.442 -2.899 -14.831 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.063 -0.353 -15.358 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.584 -2.007 -15.756 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.621 -0.964 -14.754 1.00 0.00 H new ATOM 522 N THR A 62 -2.500 -4.615 -11.808 1.00 0.00 N ATOM 523 CA THR A 62 -1.901 -5.105 -10.536 1.00 0.00 C ATOM 524 C THR A 62 -0.426 -4.713 -10.474 1.00 0.00 C ATOM 525 O THR A 62 0.201 -4.449 -11.482 1.00 0.00 O ATOM 526 CB THR A 62 -2.010 -6.631 -10.458 1.00 0.00 C ATOM 527 OG1 THR A 62 -3.322 -7.034 -10.825 1.00 0.00 O ATOM 528 CG2 THR A 62 -1.713 -7.092 -9.029 1.00 0.00 C ATOM 0 H THR A 62 -2.448 -5.269 -12.589 1.00 0.00 H new ATOM 0 HA THR A 62 -2.439 -4.656 -9.701 1.00 0.00 H new ATOM 0 HB THR A 62 -1.290 -7.081 -11.141 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.390 -8.010 -10.776 1.00 0.00 H new ATOM 0 HG21 THR A 62 -1.791 -8.178 -8.973 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.705 -6.785 -8.750 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.432 -6.641 -8.345 1.00 0.00 H new ATOM 536 N VAL A 63 0.129 -4.688 -9.293 1.00 0.00 N ATOM 537 CA VAL A 63 1.564 -4.332 -9.133 1.00 0.00 C ATOM 538 C VAL A 63 2.159 -5.200 -8.028 1.00 0.00 C ATOM 539 O VAL A 63 1.650 -5.242 -6.923 1.00 0.00 O ATOM 540 CB VAL A 63 1.683 -2.859 -8.751 1.00 0.00 C ATOM 541 CG1 VAL A 63 3.159 -2.459 -8.691 1.00 0.00 C ATOM 542 CG2 VAL A 63 0.966 -2.006 -9.795 1.00 0.00 C ATOM 0 H VAL A 63 -0.358 -4.902 -8.423 1.00 0.00 H new ATOM 0 HA VAL A 63 2.100 -4.501 -10.067 1.00 0.00 H new ATOM 0 HB VAL A 63 1.228 -2.701 -7.773 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.240 -1.407 -8.418 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.671 -3.068 -7.946 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.619 -2.617 -9.667 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.049 -0.953 -9.524 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.422 -2.167 -10.772 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -0.086 -2.288 -9.835 1.00 0.00 H new ATOM 552 N GLN A 64 3.220 -5.902 -8.320 1.00 0.00 N ATOM 553 CA GLN A 64 3.840 -6.782 -7.294 1.00 0.00 C ATOM 554 C GLN A 64 5.362 -6.776 -7.458 1.00 0.00 C ATOM 555 O GLN A 64 5.878 -6.995 -8.537 1.00 0.00 O ATOM 556 CB GLN A 64 3.291 -8.203 -7.466 1.00 0.00 C ATOM 557 CG GLN A 64 3.614 -8.717 -8.873 1.00 0.00 C ATOM 558 CD GLN A 64 2.535 -9.704 -9.328 1.00 0.00 C ATOM 559 OE1 GLN A 64 1.753 -10.185 -8.531 1.00 0.00 O ATOM 560 NE2 GLN A 64 2.462 -10.030 -10.589 1.00 0.00 N ATOM 0 H GLN A 64 3.684 -5.903 -9.228 1.00 0.00 H new ATOM 0 HA GLN A 64 3.599 -6.418 -6.295 1.00 0.00 H new ATOM 0 HB2 GLN A 64 3.728 -8.865 -6.718 1.00 0.00 H new ATOM 0 HB3 GLN A 64 2.213 -8.208 -7.305 1.00 0.00 H new ATOM 0 HG2 GLN A 64 3.672 -7.881 -9.570 1.00 0.00 H new ATOM 0 HG3 GLN A 64 4.589 -9.204 -8.877 1.00 0.00 H new ATOM 0 HE21 GLN A 64 3.117 -9.627 -11.259 1.00 0.00 H new ATOM 0 HE22 GLN A 64 1.749 -10.688 -10.905 1.00 0.00 H new ATOM 569 N LEU A 65 6.080 -6.516 -6.393 1.00 0.00 N ATOM 570 CA LEU A 65 7.561 -6.481 -6.478 1.00 0.00 C ATOM 571 C LEU A 65 8.155 -7.783 -5.944 1.00 0.00 C ATOM 572 O LEU A 65 7.653 -8.372 -5.004 1.00 0.00 O ATOM 573 CB LEU A 65 8.082 -5.309 -5.649 1.00 0.00 C ATOM 574 CG LEU A 65 7.549 -5.408 -4.212 1.00 0.00 C ATOM 575 CD1 LEU A 65 8.675 -5.098 -3.224 1.00 0.00 C ATOM 576 CD2 LEU A 65 6.411 -4.402 -4.017 1.00 0.00 C ATOM 0 H LEU A 65 5.696 -6.327 -5.467 1.00 0.00 H new ATOM 0 HA LEU A 65 7.855 -6.362 -7.521 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.172 -5.313 -5.643 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.769 -4.367 -6.098 1.00 0.00 H new ATOM 0 HG LEU A 65 7.178 -6.417 -4.035 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.295 -5.169 -2.205 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.485 -5.814 -3.359 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.048 -4.090 -3.403 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.033 -4.473 -2.997 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.782 -3.393 -4.197 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.606 -4.623 -4.718 1.00 0.00 H new ATOM 588 N GLU A 66 9.232 -8.223 -6.536 1.00 0.00 N ATOM 589 CA GLU A 66 9.896 -9.475 -6.079 1.00 0.00 C ATOM 590 C GLU A 66 11.398 -9.212 -5.966 1.00 0.00 C ATOM 591 O GLU A 66 11.862 -8.128 -6.263 1.00 0.00 O ATOM 592 CB GLU A 66 9.635 -10.597 -7.094 1.00 0.00 C ATOM 593 CG GLU A 66 8.219 -11.153 -6.920 1.00 0.00 C ATOM 594 CD GLU A 66 8.052 -11.737 -5.514 1.00 0.00 C ATOM 595 OE1 GLU A 66 8.990 -12.351 -5.032 1.00 0.00 O ATOM 596 OE2 GLU A 66 6.988 -11.560 -4.943 1.00 0.00 O ATOM 0 H GLU A 66 9.684 -7.762 -7.326 1.00 0.00 H new ATOM 0 HA GLU A 66 9.499 -9.780 -5.111 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.761 -10.216 -8.107 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.365 -11.395 -6.960 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.487 -10.362 -7.083 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.028 -11.923 -7.667 1.00 0.00 H new ATOM 603 N GLN A 67 12.159 -10.184 -5.536 1.00 0.00 N ATOM 604 CA GLN A 67 13.633 -9.981 -5.400 1.00 0.00 C ATOM 605 C GLN A 67 14.359 -11.311 -5.620 1.00 0.00 C ATOM 606 O GLN A 67 13.810 -12.371 -5.380 1.00 0.00 O ATOM 607 CB GLN A 67 13.946 -9.455 -3.995 1.00 0.00 C ATOM 608 CG GLN A 67 14.078 -7.930 -4.031 1.00 0.00 C ATOM 609 CD GLN A 67 13.741 -7.357 -2.653 1.00 0.00 C ATOM 610 OE1 GLN A 67 14.281 -7.788 -1.653 1.00 0.00 O ATOM 611 NE2 GLN A 67 12.865 -6.395 -2.557 1.00 0.00 N ATOM 0 H GLN A 67 11.824 -11.111 -5.273 1.00 0.00 H new ATOM 0 HA GLN A 67 13.969 -9.259 -6.144 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.155 -9.745 -3.303 1.00 0.00 H new ATOM 0 HB3 GLN A 67 14.870 -9.901 -3.627 1.00 0.00 H new ATOM 0 HG2 GLN A 67 15.092 -7.649 -4.316 1.00 0.00 H new ATOM 0 HG3 GLN A 67 13.408 -7.514 -4.784 1.00 0.00 H new ATOM 0 HE21 GLN A 67 12.411 -6.033 -3.396 1.00 0.00 H new ATOM 0 HE22 GLN A 67 12.634 -6.005 -1.643 1.00 0.00 H new ATOM 620 N LYS A 68 15.588 -11.261 -6.067 1.00 0.00 N ATOM 621 CA LYS A 68 16.359 -12.519 -6.296 1.00 0.00 C ATOM 622 C LYS A 68 17.423 -12.668 -5.206 1.00 0.00 C ATOM 623 O LYS A 68 17.607 -11.791 -4.384 1.00 0.00 O ATOM 624 CB LYS A 68 17.039 -12.468 -7.667 1.00 0.00 C ATOM 625 CG LYS A 68 16.003 -12.721 -8.771 1.00 0.00 C ATOM 626 CD LYS A 68 16.167 -11.683 -9.887 1.00 0.00 C ATOM 627 CE LYS A 68 17.533 -11.854 -10.553 1.00 0.00 C ATOM 628 NZ LYS A 68 17.532 -13.097 -11.377 1.00 0.00 N ATOM 0 H LYS A 68 16.091 -10.401 -6.284 1.00 0.00 H new ATOM 0 HA LYS A 68 15.678 -13.370 -6.263 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.510 -11.496 -7.814 1.00 0.00 H new ATOM 0 HB3 LYS A 68 17.830 -13.217 -7.719 1.00 0.00 H new ATOM 0 HG2 LYS A 68 16.127 -13.726 -9.175 1.00 0.00 H new ATOM 0 HG3 LYS A 68 14.996 -12.667 -8.357 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.374 -11.801 -10.626 1.00 0.00 H new ATOM 0 HD3 LYS A 68 16.075 -10.677 -9.478 1.00 0.00 H new ATOM 0 HE2 LYS A 68 17.755 -10.990 -11.179 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.315 -11.908 -9.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.338 -13.079 -12.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.611 -13.926 -10.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.646 -13.154 -11.919 1.00 0.00 H new ATOM 642 N ASP A 69 18.120 -13.775 -5.194 1.00 0.00 N ATOM 643 CA ASP A 69 19.171 -13.996 -4.162 1.00 0.00 C ATOM 644 C ASP A 69 20.460 -13.243 -4.527 1.00 0.00 C ATOM 645 O ASP A 69 21.402 -13.222 -3.755 1.00 0.00 O ATOM 646 CB ASP A 69 19.471 -15.493 -4.062 1.00 0.00 C ATOM 647 CG ASP A 69 18.581 -16.124 -2.990 1.00 0.00 C ATOM 648 OD1 ASP A 69 17.487 -16.544 -3.329 1.00 0.00 O ATOM 649 OD2 ASP A 69 19.007 -16.175 -1.848 1.00 0.00 O ATOM 0 H ASP A 69 18.004 -14.539 -5.860 1.00 0.00 H new ATOM 0 HA ASP A 69 18.807 -13.620 -3.206 1.00 0.00 H new ATOM 0 HB2 ASP A 69 19.296 -15.974 -5.024 1.00 0.00 H new ATOM 0 HB3 ASP A 69 20.521 -15.648 -3.815 1.00 0.00 H new ATOM 654 N GLY A 70 20.521 -12.631 -5.688 1.00 0.00 N ATOM 655 CA GLY A 70 21.758 -11.893 -6.084 1.00 0.00 C ATOM 656 C GLY A 70 21.582 -10.397 -5.814 1.00 0.00 C ATOM 657 O GLY A 70 22.111 -9.565 -6.527 1.00 0.00 O ATOM 0 H GLY A 70 19.767 -12.613 -6.375 1.00 0.00 H new ATOM 0 HA2 GLY A 70 22.613 -12.274 -5.526 1.00 0.00 H new ATOM 0 HA3 GLY A 70 21.968 -12.058 -7.141 1.00 0.00 H new ATOM 661 N ASP A 71 20.838 -10.051 -4.793 1.00 0.00 N ATOM 662 CA ASP A 71 20.614 -8.608 -4.464 1.00 0.00 C ATOM 663 C ASP A 71 19.965 -7.911 -5.661 1.00 0.00 C ATOM 664 O ASP A 71 20.406 -6.867 -6.106 1.00 0.00 O ATOM 665 CB ASP A 71 21.952 -7.937 -4.134 1.00 0.00 C ATOM 666 CG ASP A 71 22.349 -8.267 -2.695 1.00 0.00 C ATOM 667 OD1 ASP A 71 21.818 -7.637 -1.795 1.00 0.00 O ATOM 668 OD2 ASP A 71 23.177 -9.145 -2.516 1.00 0.00 O ATOM 0 H ASP A 71 20.373 -10.710 -4.169 1.00 0.00 H new ATOM 0 HA ASP A 71 19.956 -8.530 -3.598 1.00 0.00 H new ATOM 0 HB2 ASP A 71 22.723 -8.282 -4.823 1.00 0.00 H new ATOM 0 HB3 ASP A 71 21.870 -6.858 -4.261 1.00 0.00 H new ATOM 673 N ILE A 72 18.927 -8.499 -6.189 1.00 0.00 N ATOM 674 CA ILE A 72 18.242 -7.906 -7.371 1.00 0.00 C ATOM 675 C ILE A 72 16.747 -7.769 -7.074 1.00 0.00 C ATOM 676 O ILE A 72 16.223 -8.418 -6.188 1.00 0.00 O ATOM 677 CB ILE A 72 18.458 -8.818 -8.583 1.00 0.00 C ATOM 678 CG1 ILE A 72 19.953 -9.199 -8.667 1.00 0.00 C ATOM 679 CG2 ILE A 72 18.021 -8.077 -9.849 1.00 0.00 C ATOM 680 CD1 ILE A 72 20.263 -9.944 -9.973 1.00 0.00 C ATOM 0 H ILE A 72 18.522 -9.371 -5.849 1.00 0.00 H new ATOM 0 HA ILE A 72 18.652 -6.919 -7.586 1.00 0.00 H new ATOM 0 HB ILE A 72 17.867 -9.728 -8.484 1.00 0.00 H new ATOM 0 HG12 ILE A 72 20.565 -8.299 -8.605 1.00 0.00 H new ATOM 0 HG13 ILE A 72 20.220 -9.825 -7.816 1.00 0.00 H new ATOM 0 HG21 ILE A 72 18.171 -8.719 -10.717 1.00 0.00 H new ATOM 0 HG22 ILE A 72 16.966 -7.814 -9.771 1.00 0.00 H new ATOM 0 HG23 ILE A 72 18.614 -7.169 -9.962 1.00 0.00 H new ATOM 0 HD11 ILE A 72 21.322 -10.199 -10.004 1.00 0.00 H new ATOM 0 HD12 ILE A 72 19.669 -10.856 -10.021 1.00 0.00 H new ATOM 0 HD13 ILE A 72 20.019 -9.306 -10.823 1.00 0.00 H new ATOM 692 N SER A 73 16.059 -6.928 -7.806 1.00 0.00 N ATOM 693 CA SER A 73 14.599 -6.741 -7.566 1.00 0.00 C ATOM 694 C SER A 73 13.822 -7.135 -8.821 1.00 0.00 C ATOM 695 O SER A 73 14.385 -7.294 -9.888 1.00 0.00 O ATOM 696 CB SER A 73 14.319 -5.277 -7.231 1.00 0.00 C ATOM 697 OG SER A 73 14.806 -4.993 -5.925 1.00 0.00 O ATOM 0 H SER A 73 16.449 -6.363 -8.560 1.00 0.00 H new ATOM 0 HA SER A 73 14.285 -7.369 -6.732 1.00 0.00 H new ATOM 0 HB2 SER A 73 14.801 -4.626 -7.961 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.249 -5.078 -7.284 1.00 0.00 H new ATOM 0 HG SER A 73 14.630 -4.054 -5.707 1.00 0.00 H new ATOM 703 N ILE A 74 12.533 -7.306 -8.693 1.00 0.00 N ATOM 704 CA ILE A 74 11.701 -7.707 -9.861 1.00 0.00 C ATOM 705 C ILE A 74 10.299 -7.093 -9.714 1.00 0.00 C ATOM 706 O ILE A 74 9.400 -7.709 -9.172 1.00 0.00 O ATOM 707 CB ILE A 74 11.619 -9.244 -9.897 1.00 0.00 C ATOM 708 CG1 ILE A 74 13.018 -9.816 -10.186 1.00 0.00 C ATOM 709 CG2 ILE A 74 10.625 -9.705 -10.975 1.00 0.00 C ATOM 710 CD1 ILE A 74 12.964 -11.349 -10.275 1.00 0.00 C ATOM 0 H ILE A 74 12.018 -7.184 -7.821 1.00 0.00 H new ATOM 0 HA ILE A 74 12.142 -7.349 -10.791 1.00 0.00 H new ATOM 0 HB ILE A 74 11.267 -9.608 -8.932 1.00 0.00 H new ATOM 0 HG12 ILE A 74 13.400 -9.405 -11.120 1.00 0.00 H new ATOM 0 HG13 ILE A 74 13.710 -9.516 -9.399 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.580 -10.794 -10.986 1.00 0.00 H new ATOM 0 HG22 ILE A 74 9.636 -9.303 -10.754 1.00 0.00 H new ATOM 0 HG23 ILE A 74 10.953 -9.345 -11.950 1.00 0.00 H new ATOM 0 HD11 ILE A 74 13.962 -11.737 -10.480 1.00 0.00 H new ATOM 0 HD12 ILE A 74 12.603 -11.756 -9.330 1.00 0.00 H new ATOM 0 HD13 ILE A 74 12.288 -11.643 -11.078 1.00 0.00 H new ATOM 722 N LEU A 75 10.113 -5.889 -10.194 1.00 0.00 N ATOM 723 CA LEU A 75 8.782 -5.231 -10.089 1.00 0.00 C ATOM 724 C LEU A 75 7.891 -5.680 -11.244 1.00 0.00 C ATOM 725 O LEU A 75 8.048 -5.246 -12.369 1.00 0.00 O ATOM 726 CB LEU A 75 8.953 -3.711 -10.133 1.00 0.00 C ATOM 727 CG LEU A 75 7.663 -3.027 -9.655 1.00 0.00 C ATOM 728 CD1 LEU A 75 7.876 -2.442 -8.257 1.00 0.00 C ATOM 729 CD2 LEU A 75 7.289 -1.900 -10.624 1.00 0.00 C ATOM 0 H LEU A 75 10.833 -5.333 -10.656 1.00 0.00 H new ATOM 0 HA LEU A 75 8.316 -5.514 -9.145 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.789 -3.412 -9.501 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.190 -3.392 -11.148 1.00 0.00 H new ATOM 0 HG LEU A 75 6.859 -3.763 -9.622 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.959 -1.958 -7.922 1.00 0.00 H new ATOM 0 HD12 LEU A 75 8.139 -3.241 -7.564 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.683 -1.709 -8.288 1.00 0.00 H new ATOM 0 HD21 LEU A 75 6.374 -1.416 -10.283 1.00 0.00 H new ATOM 0 HD22 LEU A 75 8.095 -1.168 -10.659 1.00 0.00 H new ATOM 0 HD23 LEU A 75 7.131 -2.314 -11.620 1.00 0.00 H new ATOM 741 N GLU A 76 6.952 -6.544 -10.965 1.00 0.00 N ATOM 742 CA GLU A 76 6.033 -7.031 -12.030 1.00 0.00 C ATOM 743 C GLU A 76 4.678 -6.346 -11.858 1.00 0.00 C ATOM 744 O GLU A 76 4.252 -6.085 -10.752 1.00 0.00 O ATOM 745 CB GLU A 76 5.858 -8.549 -11.902 1.00 0.00 C ATOM 746 CG GLU A 76 7.232 -9.234 -11.859 1.00 0.00 C ATOM 747 CD GLU A 76 7.225 -10.335 -10.796 1.00 0.00 C ATOM 748 OE1 GLU A 76 7.384 -10.008 -9.631 1.00 0.00 O ATOM 749 OE2 GLU A 76 7.062 -11.486 -11.165 1.00 0.00 O ATOM 0 H GLU A 76 6.782 -6.935 -10.038 1.00 0.00 H new ATOM 0 HA GLU A 76 6.446 -6.800 -13.012 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.297 -8.784 -10.997 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.279 -8.929 -12.744 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.468 -9.658 -12.835 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.007 -8.502 -11.633 1.00 0.00 H new ATOM 756 N LEU A 77 4.001 -6.051 -12.938 1.00 0.00 N ATOM 757 CA LEU A 77 2.672 -5.381 -12.822 1.00 0.00 C ATOM 758 C LEU A 77 1.707 -5.966 -13.854 1.00 0.00 C ATOM 759 O LEU A 77 2.016 -6.064 -15.025 1.00 0.00 O ATOM 760 CB LEU A 77 2.824 -3.871 -13.055 1.00 0.00 C ATOM 761 CG LEU A 77 3.616 -3.608 -14.340 1.00 0.00 C ATOM 762 CD1 LEU A 77 3.240 -2.234 -14.896 1.00 0.00 C ATOM 763 CD2 LEU A 77 5.115 -3.636 -14.030 1.00 0.00 C ATOM 0 H LEU A 77 4.310 -6.244 -13.891 1.00 0.00 H new ATOM 0 HA LEU A 77 2.275 -5.549 -11.821 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.841 -3.406 -13.124 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.333 -3.415 -12.206 1.00 0.00 H new ATOM 0 HG LEU A 77 3.381 -4.377 -15.076 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.803 -2.045 -15.810 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.173 -2.210 -15.115 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.477 -1.466 -14.159 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.679 -3.449 -14.944 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.349 -2.866 -13.295 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.386 -4.613 -13.630 1.00 0.00 H new ATOM 775 N ASN A 78 0.535 -6.353 -13.424 1.00 0.00 N ATOM 776 CA ASN A 78 -0.462 -6.925 -14.364 1.00 0.00 C ATOM 777 C ASN A 78 -1.310 -5.788 -14.919 1.00 0.00 C ATOM 778 O ASN A 78 -1.619 -4.847 -14.218 1.00 0.00 O ATOM 779 CB ASN A 78 -1.379 -7.888 -13.614 1.00 0.00 C ATOM 780 CG ASN A 78 -0.567 -8.851 -12.732 1.00 0.00 C ATOM 781 OD1 ASN A 78 -1.051 -9.301 -11.711 1.00 0.00 O ATOM 782 ND2 ASN A 78 0.646 -9.190 -13.076 1.00 0.00 N ATOM 0 H ASN A 78 0.227 -6.295 -12.453 1.00 0.00 H new ATOM 0 HA ASN A 78 0.051 -7.454 -15.167 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.076 -7.323 -12.995 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -1.975 -8.458 -14.327 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.183 -9.829 -12.490 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.057 -8.816 -13.931 1.00 0.00 H new ATOM 789 N VAL A 79 -1.690 -5.864 -16.165 1.00 0.00 N ATOM 790 CA VAL A 79 -2.527 -4.780 -16.753 1.00 0.00 C ATOM 791 C VAL A 79 -3.813 -5.384 -17.318 1.00 0.00 C ATOM 792 O VAL A 79 -3.872 -5.780 -18.467 1.00 0.00 O ATOM 793 CB VAL A 79 -1.755 -4.079 -17.867 1.00 0.00 C ATOM 794 CG1 VAL A 79 -2.536 -2.848 -18.319 1.00 0.00 C ATOM 795 CG2 VAL A 79 -0.379 -3.649 -17.346 1.00 0.00 C ATOM 0 H VAL A 79 -1.458 -6.628 -16.800 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.775 -4.053 -15.980 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.625 -4.761 -18.707 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.989 -2.342 -19.115 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.515 -3.154 -18.688 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.662 -2.168 -17.477 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.172 -3.148 -18.143 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.505 -2.965 -16.507 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.177 -4.527 -17.018 1.00 0.00 H new ATOM 805 N THR A 80 -4.841 -5.456 -16.512 1.00 0.00 N ATOM 806 CA THR A 80 -6.132 -6.036 -16.983 1.00 0.00 C ATOM 807 C THR A 80 -6.888 -5.001 -17.820 1.00 0.00 C ATOM 808 O THR A 80 -7.621 -4.186 -17.294 1.00 0.00 O ATOM 809 CB THR A 80 -6.983 -6.429 -15.772 1.00 0.00 C ATOM 810 OG1 THR A 80 -6.235 -7.296 -14.931 1.00 0.00 O ATOM 811 CG2 THR A 80 -8.253 -7.140 -16.243 1.00 0.00 C ATOM 0 H THR A 80 -4.840 -5.136 -15.543 1.00 0.00 H new ATOM 0 HA THR A 80 -5.931 -6.917 -17.593 1.00 0.00 H new ATOM 0 HB THR A 80 -7.259 -5.532 -15.217 1.00 0.00 H new ATOM 0 HG1 THR A 80 -5.778 -6.770 -14.242 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.856 -7.418 -15.379 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.827 -6.472 -16.886 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.982 -8.037 -16.800 1.00 0.00 H new ATOM 819 N LEU A 81 -6.721 -5.035 -19.118 1.00 0.00 N ATOM 820 CA LEU A 81 -7.432 -4.069 -19.995 1.00 0.00 C ATOM 821 C LEU A 81 -8.844 -4.611 -20.280 1.00 0.00 C ATOM 822 O LEU A 81 -8.997 -5.797 -20.495 1.00 0.00 O ATOM 823 CB LEU A 81 -6.661 -3.931 -21.306 1.00 0.00 C ATOM 824 CG LEU A 81 -5.244 -3.430 -21.020 1.00 0.00 C ATOM 825 CD1 LEU A 81 -4.265 -4.076 -22.003 1.00 0.00 C ATOM 826 CD2 LEU A 81 -5.197 -1.909 -21.184 1.00 0.00 C ATOM 0 H LEU A 81 -6.118 -5.697 -19.606 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.502 -3.095 -19.511 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.621 -4.892 -21.818 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.175 -3.237 -21.970 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.965 -3.696 -20.000 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.256 -3.719 -21.799 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.297 -5.160 -21.889 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.545 -3.810 -23.022 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.187 -1.552 -20.980 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.477 -1.644 -22.204 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -5.893 -1.446 -20.485 1.00 0.00 H new ATOM 838 N PRO A 82 -9.843 -3.748 -20.272 1.00 0.00 N ATOM 839 CA PRO A 82 -11.265 -4.145 -20.526 1.00 0.00 C ATOM 840 C PRO A 82 -11.548 -4.222 -22.027 1.00 0.00 C ATOM 841 O PRO A 82 -10.678 -3.991 -22.846 1.00 0.00 O ATOM 842 CB PRO A 82 -12.067 -3.026 -19.876 1.00 0.00 C ATOM 843 CG PRO A 82 -11.174 -1.801 -19.830 1.00 0.00 C ATOM 844 CD PRO A 82 -9.728 -2.267 -20.020 1.00 0.00 C ATOM 0 HA PRO A 82 -11.511 -5.129 -20.127 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.973 -2.820 -20.447 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.381 -3.311 -18.872 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.454 -1.095 -20.612 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.286 -1.282 -18.878 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -9.253 -1.757 -20.858 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -9.124 -2.060 -19.137 1.00 0.00 H new ATOM 852 N GLU A 83 -12.761 -4.551 -22.389 1.00 0.00 N ATOM 853 CA GLU A 83 -13.120 -4.653 -23.837 1.00 0.00 C ATOM 854 C GLU A 83 -12.977 -3.279 -24.480 1.00 0.00 C ATOM 855 O GLU A 83 -12.447 -2.358 -23.887 1.00 0.00 O ATOM 856 CB GLU A 83 -14.576 -5.118 -24.005 1.00 0.00 C ATOM 857 CG GLU A 83 -14.898 -6.232 -23.013 1.00 0.00 C ATOM 858 CD GLU A 83 -15.810 -7.270 -23.672 1.00 0.00 C ATOM 859 OE1 GLU A 83 -15.641 -7.515 -24.855 1.00 0.00 O ATOM 860 OE2 GLU A 83 -16.664 -7.803 -22.981 1.00 0.00 O ATOM 0 H GLU A 83 -13.522 -4.755 -21.742 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.456 -5.376 -24.311 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -15.253 -4.278 -23.850 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -14.736 -5.472 -25.023 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -13.977 -6.707 -22.675 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -15.384 -5.816 -22.131 1.00 0.00 H new ATOM 867 N ALA A 84 -13.467 -3.129 -25.684 1.00 0.00 N ATOM 868 CA ALA A 84 -13.384 -1.812 -26.362 1.00 0.00 C ATOM 869 C ALA A 84 -14.090 -1.888 -27.718 1.00 0.00 C ATOM 870 O ALA A 84 -13.469 -2.127 -28.736 1.00 0.00 O ATOM 871 CB ALA A 84 -11.918 -1.423 -26.568 1.00 0.00 C ATOM 0 H ALA A 84 -13.921 -3.866 -26.223 1.00 0.00 H new ATOM 0 HA ALA A 84 -13.870 -1.059 -25.741 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.865 -0.455 -27.066 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -11.419 -1.361 -25.601 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.425 -2.175 -27.184 1.00 0.00 H new ATOM 877 N GLU A 85 -15.383 -1.686 -27.735 1.00 0.00 N ATOM 878 CA GLU A 85 -16.141 -1.744 -29.018 1.00 0.00 C ATOM 879 C GLU A 85 -15.634 -0.653 -29.964 1.00 0.00 C ATOM 880 O GLU A 85 -16.144 0.450 -29.982 1.00 0.00 O ATOM 881 CB GLU A 85 -17.630 -1.525 -28.741 1.00 0.00 C ATOM 882 CG GLU A 85 -18.147 -2.635 -27.822 1.00 0.00 C ATOM 883 CD GLU A 85 -18.529 -3.855 -28.661 1.00 0.00 C ATOM 884 OE1 GLU A 85 -19.523 -3.779 -29.365 1.00 0.00 O ATOM 885 OE2 GLU A 85 -17.820 -4.846 -28.586 1.00 0.00 O ATOM 0 H GLU A 85 -15.948 -1.482 -26.910 1.00 0.00 H new ATOM 0 HA GLU A 85 -15.995 -2.721 -29.480 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -17.785 -0.551 -28.276 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -18.189 -1.524 -29.677 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -17.381 -2.906 -27.095 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -19.011 -2.283 -27.259 1.00 0.00 H new ATOM 892 N GLU A 86 -14.629 -0.957 -30.751 1.00 0.00 N ATOM 893 CA GLU A 86 -14.076 0.056 -31.703 1.00 0.00 C ATOM 894 C GLU A 86 -13.562 1.270 -30.924 1.00 0.00 C ATOM 895 O GLU A 86 -14.287 2.219 -30.691 1.00 0.00 O ATOM 896 CB GLU A 86 -15.171 0.500 -32.677 1.00 0.00 C ATOM 897 CG GLU A 86 -14.548 0.818 -34.038 1.00 0.00 C ATOM 898 CD GLU A 86 -14.193 2.305 -34.102 1.00 0.00 C ATOM 899 OE1 GLU A 86 -13.425 2.748 -33.262 1.00 0.00 O ATOM 900 OE2 GLU A 86 -14.694 2.976 -34.988 1.00 0.00 O ATOM 0 H GLU A 86 -14.167 -1.866 -30.774 1.00 0.00 H new ATOM 0 HA GLU A 86 -13.253 -0.390 -32.262 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -15.919 -0.286 -32.783 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -15.685 1.378 -32.287 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -13.654 0.213 -34.191 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.245 0.565 -34.837 1.00 0.00 H new ATOM 907 N LEU A 87 -12.316 1.242 -30.523 1.00 0.00 N ATOM 908 CA LEU A 87 -11.745 2.389 -29.757 1.00 0.00 C ATOM 909 C LEU A 87 -10.365 2.739 -30.316 1.00 0.00 C ATOM 910 O LEU A 87 -9.584 1.869 -30.656 1.00 0.00 O ATOM 911 CB LEU A 87 -11.614 2.003 -28.282 1.00 0.00 C ATOM 912 CG LEU A 87 -11.624 3.266 -27.420 1.00 0.00 C ATOM 913 CD1 LEU A 87 -13.053 3.566 -26.968 1.00 0.00 C ATOM 914 CD2 LEU A 87 -10.736 3.051 -26.192 1.00 0.00 C ATOM 0 H LEU A 87 -11.669 0.472 -30.694 1.00 0.00 H new ATOM 0 HA LEU A 87 -12.405 3.252 -29.850 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -12.435 1.346 -27.993 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -10.690 1.448 -28.121 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.244 4.106 -28.002 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -13.059 4.466 -26.354 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -13.686 3.719 -27.842 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -13.434 2.727 -26.386 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.742 3.951 -25.577 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -11.116 2.211 -25.611 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -9.716 2.838 -26.513 1.00 0.00 H new ATOM 926 N LYS A 88 -10.060 4.008 -30.414 1.00 0.00 N ATOM 927 CA LYS A 88 -8.731 4.427 -30.950 1.00 0.00 C ATOM 928 C LYS A 88 -7.814 4.819 -29.790 1.00 0.00 C ATOM 929 O LYS A 88 -6.696 5.228 -30.057 1.00 0.00 O ATOM 930 CB LYS A 88 -8.912 5.625 -31.883 1.00 0.00 C ATOM 931 CG LYS A 88 -9.679 6.732 -31.157 1.00 0.00 C ATOM 932 CD LYS A 88 -9.154 8.099 -31.602 1.00 0.00 C ATOM 933 CE LYS A 88 -9.872 9.201 -30.823 1.00 0.00 C ATOM 934 NZ LYS A 88 -8.949 10.355 -30.628 1.00 0.00 N ATOM 935 OXT LYS A 88 -8.244 4.703 -28.654 1.00 0.00 O ATOM 0 H LYS A 88 -10.677 4.774 -30.145 1.00 0.00 H new ATOM 0 HA LYS A 88 -8.285 3.600 -31.503 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -7.940 5.996 -32.208 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -9.453 5.322 -32.779 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -10.744 6.652 -31.374 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -9.564 6.621 -30.079 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -8.079 8.160 -31.432 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -9.315 8.231 -32.672 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -10.763 9.522 -31.363 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -10.205 8.821 -29.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -9.438 11.105 -30.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -8.112 10.044 -30.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -8.653 10.723 -31.555 1.00 0.00 H new TER 949 LYS A 88 ATOM 950 N ARG B 31 4.211 -11.221 -33.397 1.00 0.00 N ATOM 951 CA ARG B 31 3.973 -10.514 -32.107 1.00 0.00 C ATOM 952 C ARG B 31 2.472 -10.284 -31.920 1.00 0.00 C ATOM 953 O ARG B 31 1.870 -9.475 -32.601 1.00 0.00 O ATOM 954 CB ARG B 31 4.698 -9.166 -32.123 1.00 0.00 C ATOM 955 CG ARG B 31 5.051 -8.761 -30.691 1.00 0.00 C ATOM 956 CD ARG B 31 5.755 -7.401 -30.702 1.00 0.00 C ATOM 957 NE ARG B 31 7.236 -7.608 -30.701 1.00 0.00 N ATOM 958 CZ ARG B 31 8.071 -6.592 -30.802 1.00 0.00 C ATOM 959 NH1 ARG B 31 7.642 -5.356 -30.907 1.00 0.00 N ATOM 960 NH2 ARG B 31 9.356 -6.822 -30.797 1.00 0.00 N ATOM 0 HA ARG B 31 4.352 -11.121 -31.285 1.00 0.00 H new ATOM 0 HB2 ARG B 31 5.603 -9.235 -32.727 1.00 0.00 H new ATOM 0 HB3 ARG B 31 4.066 -8.406 -32.582 1.00 0.00 H new ATOM 0 HG2 ARG B 31 4.148 -8.709 -30.083 1.00 0.00 H new ATOM 0 HG3 ARG B 31 5.697 -9.513 -30.238 1.00 0.00 H new ATOM 0 HD2 ARG B 31 5.457 -6.832 -31.583 1.00 0.00 H new ATOM 0 HD3 ARG B 31 5.458 -6.818 -29.830 1.00 0.00 H new ATOM 0 HE ARG B 31 7.608 -8.554 -30.621 1.00 0.00 H new ATOM 0 HH11 ARG B 31 6.641 -5.162 -30.912 1.00 0.00 H new ATOM 0 HH12 ARG B 31 8.310 -4.589 -30.984 1.00 0.00 H new ATOM 0 HH21 ARG B 31 9.703 -7.778 -30.716 1.00 0.00 H new ATOM 0 HH22 ARG B 31 10.013 -6.046 -30.874 1.00 0.00 H new ATOM 976 N SER B 32 1.867 -10.992 -31.002 1.00 0.00 N ATOM 977 CA SER B 32 0.405 -10.826 -30.758 1.00 0.00 C ATOM 978 C SER B 32 0.105 -9.408 -30.256 1.00 0.00 C ATOM 979 O SER B 32 -1.033 -8.975 -30.265 1.00 0.00 O ATOM 980 CB SER B 32 -0.055 -11.839 -29.712 1.00 0.00 C ATOM 981 OG SER B 32 0.264 -13.152 -30.155 1.00 0.00 O ATOM 0 H SER B 32 2.327 -11.682 -30.408 1.00 0.00 H new ATOM 0 HA SER B 32 -0.128 -10.991 -31.694 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.430 -11.638 -28.757 1.00 0.00 H new ATOM 0 HB3 SER B 32 -1.129 -11.749 -29.550 1.00 0.00 H new ATOM 0 HG SER B 32 -0.029 -13.804 -29.484 1.00 0.00 H new ATOM 987 N ASP B 33 1.106 -8.680 -29.814 1.00 0.00 N ATOM 988 CA ASP B 33 0.864 -7.299 -29.312 1.00 0.00 C ATOM 989 C ASP B 33 0.900 -6.287 -30.467 1.00 0.00 C ATOM 990 O ASP B 33 0.962 -5.096 -30.239 1.00 0.00 O ATOM 991 CB ASP B 33 1.935 -6.927 -28.286 1.00 0.00 C ATOM 992 CG ASP B 33 2.025 -8.015 -27.214 1.00 0.00 C ATOM 993 OD1 ASP B 33 2.583 -9.061 -27.506 1.00 0.00 O ATOM 994 OD2 ASP B 33 1.537 -7.784 -26.120 1.00 0.00 O ATOM 0 H ASP B 33 2.078 -8.988 -29.782 1.00 0.00 H new ATOM 0 HA ASP B 33 -0.122 -7.271 -28.847 1.00 0.00 H new ATOM 0 HB2 ASP B 33 2.900 -6.809 -28.780 1.00 0.00 H new ATOM 0 HB3 ASP B 33 1.694 -5.969 -27.826 1.00 0.00 H new ATOM 999 N ALA B 34 0.857 -6.740 -31.697 1.00 0.00 N ATOM 1000 CA ALA B 34 0.876 -5.797 -32.848 1.00 0.00 C ATOM 1001 C ALA B 34 -0.564 -5.427 -33.245 1.00 0.00 C ATOM 1002 O ALA B 34 -0.787 -4.486 -33.982 1.00 0.00 O ATOM 1003 CB ALA B 34 1.574 -6.463 -34.035 1.00 0.00 C ATOM 0 H ALA B 34 0.809 -7.727 -31.949 1.00 0.00 H new ATOM 0 HA ALA B 34 1.413 -4.892 -32.564 1.00 0.00 H new ATOM 0 HB1 ALA B 34 1.590 -5.775 -34.880 1.00 0.00 H new ATOM 0 HB2 ALA B 34 2.596 -6.721 -33.758 1.00 0.00 H new ATOM 0 HB3 ALA B 34 1.034 -7.368 -34.314 1.00 0.00 H new ATOM 1009 N GLU B 35 -1.540 -6.164 -32.765 1.00 0.00 N ATOM 1010 CA GLU B 35 -2.962 -5.871 -33.112 1.00 0.00 C ATOM 1011 C GLU B 35 -3.381 -4.459 -32.643 1.00 0.00 C ATOM 1012 O GLU B 35 -4.047 -3.763 -33.383 1.00 0.00 O ATOM 1013 CB GLU B 35 -3.880 -6.918 -32.465 1.00 0.00 C ATOM 1014 CG GLU B 35 -3.379 -8.334 -32.791 1.00 0.00 C ATOM 1015 CD GLU B 35 -4.299 -8.984 -33.828 1.00 0.00 C ATOM 1016 OE1 GLU B 35 -4.741 -8.281 -34.723 1.00 0.00 O ATOM 1017 OE2 GLU B 35 -4.545 -10.173 -33.711 1.00 0.00 O ATOM 0 H GLU B 35 -1.407 -6.961 -32.143 1.00 0.00 H new ATOM 0 HA GLU B 35 -3.057 -5.911 -34.197 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -3.906 -6.773 -31.385 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -4.900 -6.792 -32.828 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -2.359 -8.290 -33.173 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -3.354 -8.938 -31.884 1.00 0.00 H new ATOM 1024 N PRO B 36 -3.010 -4.060 -31.435 1.00 0.00 N ATOM 1025 CA PRO B 36 -3.378 -2.719 -30.875 1.00 0.00 C ATOM 1026 C PRO B 36 -2.380 -1.641 -31.319 1.00 0.00 C ATOM 1027 O PRO B 36 -2.763 -0.543 -31.674 1.00 0.00 O ATOM 1028 CB PRO B 36 -3.311 -2.936 -29.370 1.00 0.00 C ATOM 1029 CG PRO B 36 -2.374 -4.104 -29.120 1.00 0.00 C ATOM 1030 CD PRO B 36 -2.182 -4.842 -30.447 1.00 0.00 C ATOM 0 HA PRO B 36 -4.354 -2.371 -31.214 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -2.948 -2.039 -28.869 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -4.302 -3.146 -28.968 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -1.416 -3.750 -28.737 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -2.790 -4.773 -28.367 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -1.132 -4.866 -30.740 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.518 -5.877 -30.378 1.00 0.00 H new ATOM 1038 N HIS B 37 -1.103 -1.946 -31.288 1.00 0.00 N ATOM 1039 CA HIS B 37 -0.047 -0.954 -31.694 1.00 0.00 C ATOM 1040 C HIS B 37 0.158 0.113 -30.602 1.00 0.00 C ATOM 1041 O HIS B 37 1.004 0.978 -30.736 1.00 0.00 O ATOM 1042 CB HIS B 37 -0.421 -0.268 -33.017 1.00 0.00 C ATOM 1043 CG HIS B 37 0.833 0.104 -33.761 1.00 0.00 C ATOM 1044 ND1 HIS B 37 1.415 1.357 -33.645 1.00 0.00 N ATOM 1045 CD2 HIS B 37 1.627 -0.598 -34.632 1.00 0.00 C ATOM 1046 CE1 HIS B 37 2.509 1.369 -34.429 1.00 0.00 C ATOM 1047 NE2 HIS B 37 2.684 0.201 -35.053 1.00 0.00 N ATOM 0 H HIS B 37 -0.740 -2.853 -30.995 1.00 0.00 H new ATOM 0 HA HIS B 37 0.884 -1.504 -31.829 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.033 -0.935 -33.625 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -1.018 0.623 -32.821 1.00 0.00 H new ATOM 0 HD2 HIS B 37 1.457 -1.618 -34.944 1.00 0.00 H new ATOM 0 HE1 HIS B 37 3.165 2.219 -34.540 1.00 0.00 H new ATOM 0 HE2 HIS B 37 3.432 -0.051 -35.699 1.00 0.00 H new ATOM 1055 N TYR B 38 -0.588 0.058 -29.521 1.00 0.00 N ATOM 1056 CA TYR B 38 -0.410 1.063 -28.428 1.00 0.00 C ATOM 1057 C TYR B 38 0.009 0.335 -27.147 1.00 0.00 C ATOM 1058 O TYR B 38 0.792 0.836 -26.364 1.00 0.00 O ATOM 1059 CB TYR B 38 -1.717 1.829 -28.189 1.00 0.00 C ATOM 1060 CG TYR B 38 -2.876 0.865 -28.074 1.00 0.00 C ATOM 1061 CD1 TYR B 38 -3.178 0.272 -26.842 1.00 0.00 C ATOM 1062 CD2 TYR B 38 -3.656 0.572 -29.201 1.00 0.00 C ATOM 1063 CE1 TYR B 38 -4.256 -0.614 -26.738 1.00 0.00 C ATOM 1064 CE2 TYR B 38 -4.733 -0.314 -29.096 1.00 0.00 C ATOM 1065 CZ TYR B 38 -5.033 -0.908 -27.864 1.00 0.00 C ATOM 1066 OH TYR B 38 -6.097 -1.782 -27.760 1.00 0.00 O ATOM 0 H TYR B 38 -1.312 -0.641 -29.351 1.00 0.00 H new ATOM 0 HA TYR B 38 0.360 1.778 -28.716 1.00 0.00 H new ATOM 0 HB2 TYR B 38 -1.637 2.423 -27.278 1.00 0.00 H new ATOM 0 HB3 TYR B 38 -1.894 2.525 -29.009 1.00 0.00 H new ATOM 0 HD1 TYR B 38 -2.579 0.498 -25.972 1.00 0.00 H new ATOM 0 HD2 TYR B 38 -3.425 1.031 -30.151 1.00 0.00 H new ATOM 0 HE1 TYR B 38 -4.489 -1.071 -25.788 1.00 0.00 H new ATOM 0 HE2 TYR B 38 -5.333 -0.540 -29.965 1.00 0.00 H new ATOM 0 HH TYR B 38 -6.531 -1.875 -28.634 1.00 0.00 H new ATOM 1076 N LEU B 39 -0.496 -0.857 -26.942 1.00 0.00 N ATOM 1077 CA LEU B 39 -0.130 -1.650 -25.730 1.00 0.00 C ATOM 1078 C LEU B 39 1.407 -1.762 -25.595 1.00 0.00 C ATOM 1079 O LEU B 39 1.940 -1.481 -24.537 1.00 0.00 O ATOM 1080 CB LEU B 39 -0.745 -3.056 -25.848 1.00 0.00 C ATOM 1081 CG LEU B 39 -1.603 -3.373 -24.611 1.00 0.00 C ATOM 1082 CD1 LEU B 39 -0.763 -3.247 -23.333 1.00 0.00 C ATOM 1083 CD2 LEU B 39 -2.780 -2.397 -24.543 1.00 0.00 C ATOM 0 H LEU B 39 -1.154 -1.318 -27.571 1.00 0.00 H new ATOM 0 HA LEU B 39 -0.516 -1.146 -24.844 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -1.357 -3.118 -26.748 1.00 0.00 H new ATOM 0 HB3 LEU B 39 0.047 -3.799 -25.949 1.00 0.00 H new ATOM 0 HG LEU B 39 -1.974 -4.395 -24.692 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -1.383 -3.474 -22.466 1.00 0.00 H new ATOM 0 HD12 LEU B 39 0.071 -3.947 -23.376 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -0.380 -2.230 -23.248 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -3.388 -2.621 -23.667 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -2.403 -1.377 -24.472 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -3.388 -2.497 -25.442 1.00 0.00 H new ATOM 1095 N PRO B 40 2.088 -2.164 -26.656 1.00 0.00 N ATOM 1096 CA PRO B 40 3.582 -2.308 -26.648 1.00 0.00 C ATOM 1097 C PRO B 40 4.261 -0.930 -26.656 1.00 0.00 C ATOM 1098 O PRO B 40 5.428 -0.801 -26.332 1.00 0.00 O ATOM 1099 CB PRO B 40 3.885 -3.100 -27.911 1.00 0.00 C ATOM 1100 CG PRO B 40 2.722 -2.892 -28.856 1.00 0.00 C ATOM 1101 CD PRO B 40 1.508 -2.518 -28.007 1.00 0.00 C ATOM 0 HA PRO B 40 3.958 -2.809 -25.756 1.00 0.00 H new ATOM 0 HB2 PRO B 40 4.816 -2.760 -28.365 1.00 0.00 H new ATOM 0 HB3 PRO B 40 4.010 -4.158 -27.681 1.00 0.00 H new ATOM 0 HG2 PRO B 40 2.947 -2.103 -29.574 1.00 0.00 H new ATOM 0 HG3 PRO B 40 2.526 -3.798 -29.429 1.00 0.00 H new ATOM 0 HD2 PRO B 40 0.965 -1.677 -28.439 1.00 0.00 H new ATOM 0 HD3 PRO B 40 0.805 -3.347 -27.932 1.00 0.00 H new ATOM 1109 N GLN B 41 3.531 0.102 -27.000 1.00 0.00 N ATOM 1110 CA GLN B 41 4.117 1.470 -27.001 1.00 0.00 C ATOM 1111 C GLN B 41 4.182 1.963 -25.550 1.00 0.00 C ATOM 1112 O GLN B 41 5.070 2.705 -25.170 1.00 0.00 O ATOM 1113 CB GLN B 41 3.216 2.396 -27.831 1.00 0.00 C ATOM 1114 CG GLN B 41 3.753 3.832 -27.800 1.00 0.00 C ATOM 1115 CD GLN B 41 5.070 3.903 -28.576 1.00 0.00 C ATOM 1116 OE1 GLN B 41 5.220 3.267 -29.599 1.00 0.00 O ATOM 1117 NE2 GLN B 41 6.036 4.657 -28.128 1.00 0.00 N ATOM 0 H GLN B 41 2.552 0.052 -27.280 1.00 0.00 H new ATOM 0 HA GLN B 41 5.117 1.464 -27.434 1.00 0.00 H new ATOM 0 HB2 GLN B 41 3.168 2.041 -28.860 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.199 2.372 -27.438 1.00 0.00 H new ATOM 0 HG2 GLN B 41 3.024 4.513 -28.238 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.909 4.151 -26.769 1.00 0.00 H new ATOM 0 HE21 GLN B 41 5.909 5.191 -27.268 1.00 0.00 H new ATOM 0 HE22 GLN B 41 6.918 4.712 -28.637 1.00 0.00 H new ATOM 1126 N LEU B 42 3.236 1.554 -24.744 1.00 0.00 N ATOM 1127 CA LEU B 42 3.212 1.990 -23.328 1.00 0.00 C ATOM 1128 C LEU B 42 4.250 1.202 -22.529 1.00 0.00 C ATOM 1129 O LEU B 42 4.947 1.750 -21.697 1.00 0.00 O ATOM 1130 CB LEU B 42 1.818 1.730 -22.733 1.00 0.00 C ATOM 1131 CG LEU B 42 0.681 2.577 -23.392 1.00 0.00 C ATOM 1132 CD1 LEU B 42 1.153 3.423 -24.590 1.00 0.00 C ATOM 1133 CD2 LEU B 42 -0.429 1.636 -23.870 1.00 0.00 C ATOM 0 H LEU B 42 2.475 0.931 -25.015 1.00 0.00 H new ATOM 0 HA LEU B 42 3.442 3.054 -23.278 1.00 0.00 H new ATOM 0 HB2 LEU B 42 1.579 0.672 -22.841 1.00 0.00 H new ATOM 0 HB3 LEU B 42 1.844 1.943 -21.664 1.00 0.00 H new ATOM 0 HG LEU B 42 0.328 3.270 -22.629 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.310 3.983 -24.995 1.00 0.00 H new ATOM 0 HD12 LEU B 42 1.926 4.118 -24.263 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.557 2.768 -25.361 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.226 2.219 -24.331 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -0.023 0.935 -24.600 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.829 1.083 -23.020 1.00 0.00 H new ATOM 1145 N ARG B 43 4.355 -0.086 -22.766 1.00 0.00 N ATOM 1146 CA ARG B 43 5.349 -0.902 -22.011 1.00 0.00 C ATOM 1147 C ARG B 43 6.754 -0.379 -22.308 1.00 0.00 C ATOM 1148 O ARG B 43 7.571 -0.229 -21.417 1.00 0.00 O ATOM 1149 CB ARG B 43 5.229 -2.381 -22.407 1.00 0.00 C ATOM 1150 CG ARG B 43 5.647 -2.595 -23.865 1.00 0.00 C ATOM 1151 CD ARG B 43 5.425 -4.059 -24.249 1.00 0.00 C ATOM 1152 NE ARG B 43 6.169 -4.359 -25.512 1.00 0.00 N ATOM 1153 CZ ARG B 43 5.867 -5.403 -26.258 1.00 0.00 C ATOM 1154 NH1 ARG B 43 4.902 -6.230 -25.929 1.00 0.00 N ATOM 1155 NH2 ARG B 43 6.545 -5.620 -27.353 1.00 0.00 N ATOM 0 H ARG B 43 3.797 -0.601 -23.447 1.00 0.00 H new ATOM 0 HA ARG B 43 5.154 -0.820 -20.942 1.00 0.00 H new ATOM 0 HB2 ARG B 43 5.855 -2.988 -21.753 1.00 0.00 H new ATOM 0 HB3 ARG B 43 4.201 -2.716 -22.267 1.00 0.00 H new ATOM 0 HG2 ARG B 43 5.068 -1.944 -24.520 1.00 0.00 H new ATOM 0 HG3 ARG B 43 6.696 -2.328 -23.997 1.00 0.00 H new ATOM 0 HD2 ARG B 43 5.768 -4.713 -23.447 1.00 0.00 H new ATOM 0 HD3 ARG B 43 4.361 -4.254 -24.385 1.00 0.00 H new ATOM 0 HE ARG B 43 6.927 -3.742 -25.802 1.00 0.00 H new ATOM 0 HH11 ARG B 43 4.364 -6.073 -25.077 1.00 0.00 H new ATOM 0 HH12 ARG B 43 4.690 -7.030 -26.526 1.00 0.00 H new ATOM 0 HH21 ARG B 43 7.297 -4.986 -27.621 1.00 0.00 H new ATOM 0 HH22 ARG B 43 6.322 -6.424 -27.940 1.00 0.00 H new ATOM 1169 N LYS B 44 7.039 -0.083 -23.554 1.00 0.00 N ATOM 1170 CA LYS B 44 8.380 0.445 -23.889 1.00 0.00 C ATOM 1171 C LYS B 44 8.537 1.812 -23.216 1.00 0.00 C ATOM 1172 O LYS B 44 9.619 2.201 -22.816 1.00 0.00 O ATOM 1173 CB LYS B 44 8.532 0.568 -25.411 1.00 0.00 C ATOM 1174 CG LYS B 44 7.531 1.583 -25.971 1.00 0.00 C ATOM 1175 CD LYS B 44 7.842 1.846 -27.445 1.00 0.00 C ATOM 1176 CE LYS B 44 7.551 0.585 -28.261 1.00 0.00 C ATOM 1177 NZ LYS B 44 7.604 0.911 -29.714 1.00 0.00 N ATOM 0 H LYS B 44 6.400 -0.187 -24.342 1.00 0.00 H new ATOM 0 HA LYS B 44 9.155 -0.232 -23.530 1.00 0.00 H new ATOM 0 HB2 LYS B 44 9.548 0.877 -25.657 1.00 0.00 H new ATOM 0 HB3 LYS B 44 8.373 -0.404 -25.878 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.515 1.204 -25.865 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.585 2.513 -25.405 1.00 0.00 H new ATOM 0 HD2 LYS B 44 7.239 2.677 -27.812 1.00 0.00 H new ATOM 0 HD3 LYS B 44 8.887 2.134 -27.561 1.00 0.00 H new ATOM 0 HE2 LYS B 44 8.280 -0.190 -28.024 1.00 0.00 H new ATOM 0 HE3 LYS B 44 6.569 0.189 -28.002 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 7.373 0.062 -30.269 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 6.916 1.662 -29.927 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 8.560 1.237 -29.962 1.00 0.00 H new ATOM 1191 N ASP B 45 7.448 2.536 -23.077 1.00 0.00 N ATOM 1192 CA ASP B 45 7.509 3.863 -22.421 1.00 0.00 C ATOM 1193 C ASP B 45 7.902 3.677 -20.956 1.00 0.00 C ATOM 1194 O ASP B 45 8.755 4.376 -20.454 1.00 0.00 O ATOM 1195 CB ASP B 45 6.144 4.547 -22.507 1.00 0.00 C ATOM 1196 CG ASP B 45 5.894 5.023 -23.941 1.00 0.00 C ATOM 1197 OD1 ASP B 45 6.854 5.373 -24.606 1.00 0.00 O ATOM 1198 OD2 ASP B 45 4.744 5.031 -24.348 1.00 0.00 O ATOM 0 H ASP B 45 6.521 2.254 -23.395 1.00 0.00 H new ATOM 0 HA ASP B 45 8.249 4.486 -22.924 1.00 0.00 H new ATOM 0 HB2 ASP B 45 5.360 3.854 -22.202 1.00 0.00 H new ATOM 0 HB3 ASP B 45 6.107 5.393 -21.821 1.00 0.00 H new ATOM 1203 N ILE B 46 7.295 2.733 -20.263 1.00 0.00 N ATOM 1204 CA ILE B 46 7.657 2.514 -18.825 1.00 0.00 C ATOM 1205 C ILE B 46 9.144 2.143 -18.732 1.00 0.00 C ATOM 1206 O ILE B 46 9.809 2.453 -17.762 1.00 0.00 O ATOM 1207 CB ILE B 46 6.759 1.422 -18.198 1.00 0.00 C ATOM 1208 CG1 ILE B 46 6.956 1.435 -16.677 1.00 0.00 C ATOM 1209 CG2 ILE B 46 7.078 0.019 -18.744 1.00 0.00 C ATOM 1210 CD1 ILE B 46 5.955 0.486 -16.015 1.00 0.00 C ATOM 0 H ILE B 46 6.573 2.113 -20.630 1.00 0.00 H new ATOM 0 HA ILE B 46 7.490 3.431 -18.260 1.00 0.00 H new ATOM 0 HB ILE B 46 5.724 1.645 -18.459 1.00 0.00 H new ATOM 0 HG12 ILE B 46 7.974 1.133 -16.431 1.00 0.00 H new ATOM 0 HG13 ILE B 46 6.821 2.446 -16.293 1.00 0.00 H new ATOM 0 HG21 ILE B 46 6.421 -0.713 -18.273 1.00 0.00 H new ATOM 0 HG22 ILE B 46 6.923 0.005 -19.823 1.00 0.00 H new ATOM 0 HG23 ILE B 46 8.116 -0.230 -18.523 1.00 0.00 H new ATOM 0 HD11 ILE B 46 6.100 0.500 -14.935 1.00 0.00 H new ATOM 0 HD12 ILE B 46 4.940 0.807 -16.249 1.00 0.00 H new ATOM 0 HD13 ILE B 46 6.111 -0.526 -16.389 1.00 0.00 H new ATOM 1222 N LEU B 47 9.670 1.503 -19.751 1.00 0.00 N ATOM 1223 CA LEU B 47 11.109 1.137 -19.744 1.00 0.00 C ATOM 1224 C LEU B 47 11.925 2.424 -19.812 1.00 0.00 C ATOM 1225 O LEU B 47 12.875 2.614 -19.074 1.00 0.00 O ATOM 1226 CB LEU B 47 11.421 0.263 -20.961 1.00 0.00 C ATOM 1227 CG LEU B 47 11.004 -1.181 -20.679 1.00 0.00 C ATOM 1228 CD1 LEU B 47 11.046 -1.989 -21.976 1.00 0.00 C ATOM 1229 CD2 LEU B 47 11.970 -1.800 -19.665 1.00 0.00 C ATOM 0 H LEU B 47 9.157 1.221 -20.586 1.00 0.00 H new ATOM 0 HA LEU B 47 11.356 0.581 -18.840 1.00 0.00 H new ATOM 0 HB2 LEU B 47 10.892 0.640 -21.837 1.00 0.00 H new ATOM 0 HB3 LEU B 47 12.486 0.306 -21.188 1.00 0.00 H new ATOM 0 HG LEU B 47 9.991 -1.193 -20.276 1.00 0.00 H new ATOM 0 HD11 LEU B 47 10.749 -3.018 -21.773 1.00 0.00 H new ATOM 0 HD12 LEU B 47 10.361 -1.549 -22.701 1.00 0.00 H new ATOM 0 HD13 LEU B 47 12.058 -1.977 -22.380 1.00 0.00 H new ATOM 0 HD21 LEU B 47 11.675 -2.829 -19.463 1.00 0.00 H new ATOM 0 HD22 LEU B 47 12.982 -1.786 -20.071 1.00 0.00 H new ATOM 0 HD23 LEU B 47 11.943 -1.226 -18.739 1.00 0.00 H new ATOM 1241 N GLU B 48 11.536 3.321 -20.681 1.00 0.00 N ATOM 1242 CA GLU B 48 12.255 4.617 -20.797 1.00 0.00 C ATOM 1243 C GLU B 48 11.971 5.414 -19.539 1.00 0.00 C ATOM 1244 O GLU B 48 12.827 6.102 -19.015 1.00 0.00 O ATOM 1245 CB GLU B 48 11.749 5.417 -21.999 1.00 0.00 C ATOM 1246 CG GLU B 48 11.698 4.537 -23.245 1.00 0.00 C ATOM 1247 CD GLU B 48 12.970 4.739 -24.072 1.00 0.00 C ATOM 1248 OE1 GLU B 48 14.014 4.280 -23.639 1.00 0.00 O ATOM 1249 OE2 GLU B 48 12.878 5.349 -25.125 1.00 0.00 O ATOM 0 H GLU B 48 10.747 3.207 -21.317 1.00 0.00 H new ATOM 0 HA GLU B 48 13.321 4.429 -20.927 1.00 0.00 H new ATOM 0 HB2 GLU B 48 10.757 5.815 -21.787 1.00 0.00 H new ATOM 0 HB3 GLU B 48 12.403 6.271 -22.176 1.00 0.00 H new ATOM 0 HG2 GLU B 48 11.601 3.490 -22.959 1.00 0.00 H new ATOM 0 HG3 GLU B 48 10.821 4.786 -23.842 1.00 0.00 H new ATOM 1256 N VAL B 49 10.760 5.315 -19.045 1.00 0.00 N ATOM 1257 CA VAL B 49 10.392 6.052 -17.809 1.00 0.00 C ATOM 1258 C VAL B 49 11.309 5.573 -16.683 1.00 0.00 C ATOM 1259 O VAL B 49 12.010 6.351 -16.074 1.00 0.00 O ATOM 1260 CB VAL B 49 8.923 5.788 -17.456 1.00 0.00 C ATOM 1261 CG1 VAL B 49 8.549 6.555 -16.183 1.00 0.00 C ATOM 1262 CG2 VAL B 49 8.024 6.254 -18.610 1.00 0.00 C ATOM 0 H VAL B 49 10.013 4.752 -19.451 1.00 0.00 H new ATOM 0 HA VAL B 49 10.513 7.125 -17.956 1.00 0.00 H new ATOM 0 HB VAL B 49 8.783 4.720 -17.291 1.00 0.00 H new ATOM 0 HG11 VAL B 49 7.505 6.364 -15.937 1.00 0.00 H new ATOM 0 HG12 VAL B 49 9.182 6.224 -15.360 1.00 0.00 H new ATOM 0 HG13 VAL B 49 8.694 7.623 -16.346 1.00 0.00 H new ATOM 0 HG21 VAL B 49 6.981 6.066 -18.357 1.00 0.00 H new ATOM 0 HG22 VAL B 49 8.170 7.321 -18.777 1.00 0.00 H new ATOM 0 HG23 VAL B 49 8.282 5.706 -19.516 1.00 0.00 H new ATOM 1272 N ILE B 50 11.350 4.282 -16.437 1.00 0.00 N ATOM 1273 CA ILE B 50 12.269 3.749 -15.382 1.00 0.00 C ATOM 1274 C ILE B 50 13.704 4.192 -15.709 1.00 0.00 C ATOM 1275 O ILE B 50 14.546 4.288 -14.839 1.00 0.00 O ATOM 1276 CB ILE B 50 12.187 2.218 -15.343 1.00 0.00 C ATOM 1277 CG1 ILE B 50 10.740 1.792 -15.079 1.00 0.00 C ATOM 1278 CG2 ILE B 50 13.081 1.682 -14.223 1.00 0.00 C ATOM 1279 CD1 ILE B 50 10.498 0.406 -15.680 1.00 0.00 C ATOM 0 H ILE B 50 10.789 3.580 -16.919 1.00 0.00 H new ATOM 0 HA ILE B 50 11.977 4.136 -14.406 1.00 0.00 H new ATOM 0 HB ILE B 50 12.521 1.816 -16.299 1.00 0.00 H new ATOM 0 HG12 ILE B 50 10.545 1.774 -14.007 1.00 0.00 H new ATOM 0 HG13 ILE B 50 10.051 2.515 -15.516 1.00 0.00 H new ATOM 0 HG21 ILE B 50 13.020 0.594 -14.198 1.00 0.00 H new ATOM 0 HG22 ILE B 50 14.112 1.984 -14.405 1.00 0.00 H new ATOM 0 HG23 ILE B 50 12.748 2.086 -13.267 1.00 0.00 H new ATOM 0 HD11 ILE B 50 9.468 0.103 -15.492 1.00 0.00 H new ATOM 0 HD12 ILE B 50 10.676 0.439 -16.755 1.00 0.00 H new ATOM 0 HD13 ILE B 50 11.177 -0.313 -15.222 1.00 0.00 H new ATOM 1291 N CYS B 51 13.973 4.482 -16.963 1.00 0.00 N ATOM 1292 CA CYS B 51 15.326 4.942 -17.360 1.00 0.00 C ATOM 1293 C CYS B 51 15.513 6.395 -16.909 1.00 0.00 C ATOM 1294 O CYS B 51 16.521 6.753 -16.337 1.00 0.00 O ATOM 1295 CB CYS B 51 15.461 4.852 -18.885 1.00 0.00 C ATOM 1296 SG CYS B 51 17.214 4.770 -19.331 1.00 0.00 S ATOM 0 H CYS B 51 13.301 4.416 -17.727 1.00 0.00 H new ATOM 0 HA CYS B 51 16.086 4.316 -16.892 1.00 0.00 H new ATOM 0 HB2 CYS B 51 14.939 3.970 -19.256 1.00 0.00 H new ATOM 0 HB3 CYS B 51 14.995 5.719 -19.354 1.00 0.00 H new ATOM 0 HG CYS B 51 17.330 4.692 -20.623 1.00 0.00 H new ATOM 1302 N LYS B 52 14.541 7.235 -17.161 1.00 0.00 N ATOM 1303 CA LYS B 52 14.651 8.674 -16.755 1.00 0.00 C ATOM 1304 C LYS B 52 14.896 8.782 -15.248 1.00 0.00 C ATOM 1305 O LYS B 52 15.550 9.695 -14.780 1.00 0.00 O ATOM 1306 CB LYS B 52 13.351 9.414 -17.082 1.00 0.00 C ATOM 1307 CG LYS B 52 13.020 9.295 -18.569 1.00 0.00 C ATOM 1308 CD LYS B 52 11.519 9.536 -18.765 1.00 0.00 C ATOM 1309 CE LYS B 52 11.280 11.008 -19.106 1.00 0.00 C ATOM 1310 NZ LYS B 52 11.696 11.266 -20.513 1.00 0.00 N ATOM 0 H LYS B 52 13.671 6.987 -17.632 1.00 0.00 H new ATOM 0 HA LYS B 52 15.484 9.117 -17.301 1.00 0.00 H new ATOM 0 HB2 LYS B 52 12.534 9.003 -16.489 1.00 0.00 H new ATOM 0 HB3 LYS B 52 13.446 10.465 -16.809 1.00 0.00 H new ATOM 0 HG2 LYS B 52 13.596 10.021 -19.143 1.00 0.00 H new ATOM 0 HG3 LYS B 52 13.294 8.307 -18.938 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.139 8.900 -19.564 1.00 0.00 H new ATOM 0 HD3 LYS B 52 10.975 9.268 -17.859 1.00 0.00 H new ATOM 0 HE2 LYS B 52 10.227 11.256 -18.976 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.844 11.646 -18.426 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 11.201 12.107 -20.873 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 12.723 11.428 -20.547 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 11.455 10.444 -21.102 1.00 0.00 H new ATOM 1324 N TYR B 53 14.355 7.867 -14.490 1.00 0.00 N ATOM 1325 CA TYR B 53 14.520 7.908 -13.016 1.00 0.00 C ATOM 1326 C TYR B 53 15.574 6.881 -12.567 1.00 0.00 C ATOM 1327 O TYR B 53 16.055 6.932 -11.452 1.00 0.00 O ATOM 1328 CB TYR B 53 13.177 7.556 -12.361 1.00 0.00 C ATOM 1329 CG TYR B 53 12.105 8.569 -12.723 1.00 0.00 C ATOM 1330 CD1 TYR B 53 11.665 8.690 -14.048 1.00 0.00 C ATOM 1331 CD2 TYR B 53 11.528 9.364 -11.726 1.00 0.00 C ATOM 1332 CE1 TYR B 53 10.659 9.602 -14.378 1.00 0.00 C ATOM 1333 CE2 TYR B 53 10.517 10.276 -12.056 1.00 0.00 C ATOM 1334 CZ TYR B 53 10.083 10.394 -13.385 1.00 0.00 C ATOM 1335 OH TYR B 53 9.087 11.292 -13.708 1.00 0.00 O ATOM 0 H TYR B 53 13.800 7.085 -14.837 1.00 0.00 H new ATOM 0 HA TYR B 53 14.845 8.905 -12.719 1.00 0.00 H new ATOM 0 HB2 TYR B 53 12.864 6.562 -12.680 1.00 0.00 H new ATOM 0 HB3 TYR B 53 13.296 7.520 -11.278 1.00 0.00 H new ATOM 0 HD1 TYR B 53 12.106 8.075 -14.818 1.00 0.00 H new ATOM 0 HD2 TYR B 53 11.862 9.274 -10.703 1.00 0.00 H new ATOM 0 HE1 TYR B 53 10.328 9.694 -15.402 1.00 0.00 H new ATOM 0 HE2 TYR B 53 10.071 10.889 -11.287 1.00 0.00 H new ATOM 0 HH TYR B 53 8.795 11.762 -12.899 1.00 0.00 H new ATOM 1345 N VAL B 54 15.925 5.938 -13.417 1.00 0.00 N ATOM 1346 CA VAL B 54 16.934 4.896 -13.025 1.00 0.00 C ATOM 1347 C VAL B 54 17.661 4.422 -14.306 1.00 0.00 C ATOM 1348 O VAL B 54 17.994 5.231 -15.147 1.00 0.00 O ATOM 1349 CB VAL B 54 16.234 3.710 -12.313 1.00 0.00 C ATOM 1350 CG1 VAL B 54 17.250 2.984 -11.427 1.00 0.00 C ATOM 1351 CG2 VAL B 54 15.078 4.198 -11.428 1.00 0.00 C ATOM 0 H VAL B 54 15.556 5.846 -14.364 1.00 0.00 H new ATOM 0 HA VAL B 54 17.659 5.315 -12.327 1.00 0.00 H new ATOM 0 HB VAL B 54 15.836 3.042 -13.077 1.00 0.00 H new ATOM 0 HG11 VAL B 54 16.763 2.149 -10.924 1.00 0.00 H new ATOM 0 HG12 VAL B 54 18.068 2.610 -12.043 1.00 0.00 H new ATOM 0 HG13 VAL B 54 17.644 3.676 -10.683 1.00 0.00 H new ATOM 0 HG21 VAL B 54 14.606 3.344 -10.942 1.00 0.00 H new ATOM 0 HG22 VAL B 54 15.463 4.880 -10.670 1.00 0.00 H new ATOM 0 HG23 VAL B 54 14.343 4.717 -12.043 1.00 0.00 H new ATOM 1361 N GLN B 55 17.920 3.136 -14.476 1.00 0.00 N ATOM 1362 CA GLN B 55 18.617 2.674 -15.713 1.00 0.00 C ATOM 1363 C GLN B 55 18.613 1.145 -15.762 1.00 0.00 C ATOM 1364 O GLN B 55 19.299 0.485 -15.006 1.00 0.00 O ATOM 1365 CB GLN B 55 20.058 3.193 -15.716 1.00 0.00 C ATOM 1366 CG GLN B 55 20.224 4.251 -16.811 1.00 0.00 C ATOM 1367 CD GLN B 55 21.355 5.208 -16.431 1.00 0.00 C ATOM 1368 OE1 GLN B 55 22.502 4.814 -16.363 1.00 0.00 O ATOM 1369 NE2 GLN B 55 21.078 6.458 -16.178 1.00 0.00 N ATOM 0 H GLN B 55 17.678 2.400 -13.813 1.00 0.00 H new ATOM 0 HA GLN B 55 18.097 3.061 -16.589 1.00 0.00 H new ATOM 0 HB2 GLN B 55 20.303 3.621 -14.744 1.00 0.00 H new ATOM 0 HB3 GLN B 55 20.751 2.369 -15.885 1.00 0.00 H new ATOM 0 HG2 GLN B 55 20.445 3.771 -17.764 1.00 0.00 H new ATOM 0 HG3 GLN B 55 19.294 4.804 -16.941 1.00 0.00 H new ATOM 0 HE21 GLN B 55 20.115 6.789 -16.235 1.00 0.00 H new ATOM 0 HE22 GLN B 55 21.825 7.104 -15.923 1.00 0.00 H new ATOM 1378 N ILE B 56 17.842 0.588 -16.654 1.00 0.00 N ATOM 1379 CA ILE B 56 17.770 -0.899 -16.783 1.00 0.00 C ATOM 1380 C ILE B 56 17.696 -1.271 -18.262 1.00 0.00 C ATOM 1381 O ILE B 56 17.476 -0.428 -19.111 1.00 0.00 O ATOM 1382 CB ILE B 56 16.524 -1.435 -16.065 1.00 0.00 C ATOM 1383 CG1 ILE B 56 15.331 -0.496 -16.298 1.00 0.00 C ATOM 1384 CG2 ILE B 56 16.806 -1.541 -14.568 1.00 0.00 C ATOM 1385 CD1 ILE B 56 14.065 -1.323 -16.532 1.00 0.00 C ATOM 0 H ILE B 56 17.252 1.103 -17.307 1.00 0.00 H new ATOM 0 HA ILE B 56 18.658 -1.339 -16.330 1.00 0.00 H new ATOM 0 HB ILE B 56 16.281 -2.420 -16.464 1.00 0.00 H new ATOM 0 HG12 ILE B 56 15.196 0.158 -15.436 1.00 0.00 H new ATOM 0 HG13 ILE B 56 15.523 0.145 -17.158 1.00 0.00 H new ATOM 0 HG21 ILE B 56 15.922 -1.922 -14.057 1.00 0.00 H new ATOM 0 HG22 ILE B 56 17.642 -2.221 -14.402 1.00 0.00 H new ATOM 0 HG23 ILE B 56 17.057 -0.556 -14.174 1.00 0.00 H new ATOM 0 HD11 ILE B 56 13.220 -0.655 -16.697 1.00 0.00 H new ATOM 0 HD12 ILE B 56 14.202 -1.958 -17.407 1.00 0.00 H new ATOM 0 HD13 ILE B 56 13.870 -1.946 -15.659 1.00 0.00 H new ATOM 1397 N ASP B 57 17.867 -2.528 -18.572 1.00 0.00 N ATOM 1398 CA ASP B 57 17.798 -2.968 -19.994 1.00 0.00 C ATOM 1399 C ASP B 57 16.431 -3.616 -20.247 1.00 0.00 C ATOM 1400 O ASP B 57 15.744 -3.969 -19.308 1.00 0.00 O ATOM 1401 CB ASP B 57 18.906 -3.987 -20.267 1.00 0.00 C ATOM 1402 CG ASP B 57 20.191 -3.253 -20.657 1.00 0.00 C ATOM 1403 OD1 ASP B 57 20.094 -2.266 -21.368 1.00 0.00 O ATOM 1404 OD2 ASP B 57 21.250 -3.691 -20.239 1.00 0.00 O ATOM 0 H ASP B 57 18.052 -3.271 -17.898 1.00 0.00 H new ATOM 0 HA ASP B 57 17.928 -2.111 -20.654 1.00 0.00 H new ATOM 0 HB2 ASP B 57 19.079 -4.598 -19.381 1.00 0.00 H new ATOM 0 HB3 ASP B 57 18.604 -4.663 -21.067 1.00 0.00 H new ATOM 1409 N PRO B 58 16.062 -3.770 -21.503 1.00 0.00 N ATOM 1410 CA PRO B 58 14.756 -4.392 -21.891 1.00 0.00 C ATOM 1411 C PRO B 58 14.816 -5.898 -21.660 1.00 0.00 C ATOM 1412 O PRO B 58 13.822 -6.525 -21.341 1.00 0.00 O ATOM 1413 CB PRO B 58 14.605 -4.045 -23.364 1.00 0.00 C ATOM 1414 CG PRO B 58 15.998 -3.786 -23.901 1.00 0.00 C ATOM 1415 CD PRO B 58 16.870 -3.370 -22.715 1.00 0.00 C ATOM 0 HA PRO B 58 13.908 -4.033 -21.308 1.00 0.00 H new ATOM 0 HB2 PRO B 58 14.128 -4.862 -23.906 1.00 0.00 H new ATOM 0 HB3 PRO B 58 13.973 -3.166 -23.491 1.00 0.00 H new ATOM 0 HG2 PRO B 58 16.399 -4.680 -24.378 1.00 0.00 H new ATOM 0 HG3 PRO B 58 15.979 -3.002 -24.658 1.00 0.00 H new ATOM 0 HD2 PRO B 58 17.836 -3.875 -22.734 1.00 0.00 H new ATOM 0 HD3 PRO B 58 17.070 -2.299 -22.724 1.00 0.00 H new ATOM 1423 N GLU B 59 15.983 -6.474 -21.780 1.00 0.00 N ATOM 1424 CA GLU B 59 16.125 -7.934 -21.525 1.00 0.00 C ATOM 1425 C GLU B 59 15.895 -8.207 -20.028 1.00 0.00 C ATOM 1426 O GLU B 59 15.707 -9.338 -19.623 1.00 0.00 O ATOM 1427 CB GLU B 59 17.533 -8.387 -21.918 1.00 0.00 C ATOM 1428 CG GLU B 59 17.786 -8.051 -23.389 1.00 0.00 C ATOM 1429 CD GLU B 59 16.891 -8.921 -24.272 1.00 0.00 C ATOM 1430 OE1 GLU B 59 15.746 -8.549 -24.471 1.00 0.00 O ATOM 1431 OE2 GLU B 59 17.365 -9.946 -24.736 1.00 0.00 O ATOM 0 H GLU B 59 16.844 -5.994 -22.044 1.00 0.00 H new ATOM 0 HA GLU B 59 15.393 -8.484 -22.116 1.00 0.00 H new ATOM 0 HB2 GLU B 59 18.274 -7.894 -21.289 1.00 0.00 H new ATOM 0 HB3 GLU B 59 17.640 -9.459 -21.755 1.00 0.00 H new ATOM 0 HG2 GLU B 59 17.581 -6.996 -23.573 1.00 0.00 H new ATOM 0 HG3 GLU B 59 18.834 -8.220 -23.637 1.00 0.00 H new ATOM 1438 N MET B 60 15.904 -7.177 -19.204 1.00 0.00 N ATOM 1439 CA MET B 60 15.682 -7.374 -17.746 1.00 0.00 C ATOM 1440 C MET B 60 14.184 -7.269 -17.437 1.00 0.00 C ATOM 1441 O MET B 60 13.709 -7.797 -16.451 1.00 0.00 O ATOM 1442 CB MET B 60 16.439 -6.285 -16.977 1.00 0.00 C ATOM 1443 CG MET B 60 17.928 -6.655 -16.884 1.00 0.00 C ATOM 1444 SD MET B 60 18.317 -7.249 -15.217 1.00 0.00 S ATOM 1445 CE MET B 60 18.530 -5.625 -14.446 1.00 0.00 C ATOM 0 H MET B 60 16.057 -6.210 -19.489 1.00 0.00 H new ATOM 0 HA MET B 60 16.043 -8.358 -17.447 1.00 0.00 H new ATOM 0 HB2 MET B 60 16.324 -5.325 -17.480 1.00 0.00 H new ATOM 0 HB3 MET B 60 16.019 -6.174 -15.977 1.00 0.00 H new ATOM 0 HG2 MET B 60 18.166 -7.425 -17.618 1.00 0.00 H new ATOM 0 HG3 MET B 60 18.542 -5.787 -17.122 1.00 0.00 H new ATOM 0 HE1 MET B 60 18.321 -5.699 -13.379 1.00 0.00 H new ATOM 0 HE2 MET B 60 19.555 -5.284 -14.593 1.00 0.00 H new ATOM 0 HE3 MET B 60 17.842 -4.913 -14.902 1.00 0.00 H new ATOM 1455 N VAL B 61 13.440 -6.584 -18.275 1.00 0.00 N ATOM 1456 CA VAL B 61 11.975 -6.436 -18.033 1.00 0.00 C ATOM 1457 C VAL B 61 11.206 -7.437 -18.902 1.00 0.00 C ATOM 1458 O VAL B 61 11.325 -7.436 -20.113 1.00 0.00 O ATOM 1459 CB VAL B 61 11.547 -5.010 -18.394 1.00 0.00 C ATOM 1460 CG1 VAL B 61 10.082 -4.798 -18.009 1.00 0.00 C ATOM 1461 CG2 VAL B 61 12.422 -4.008 -17.635 1.00 0.00 C ATOM 0 H VAL B 61 13.788 -6.122 -19.115 1.00 0.00 H new ATOM 0 HA VAL B 61 11.757 -6.630 -16.983 1.00 0.00 H new ATOM 0 HB VAL B 61 11.664 -4.859 -19.467 1.00 0.00 H new ATOM 0 HG11 VAL B 61 9.781 -3.783 -18.267 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.457 -5.510 -18.549 1.00 0.00 H new ATOM 0 HG13 VAL B 61 9.962 -4.950 -16.936 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.118 -2.993 -17.891 1.00 0.00 H new ATOM 0 HG22 VAL B 61 12.305 -4.162 -16.562 1.00 0.00 H new ATOM 0 HG23 VAL B 61 13.466 -4.155 -17.911 1.00 0.00 H new ATOM 1471 N THR B 62 10.420 -8.291 -18.291 1.00 0.00 N ATOM 1472 CA THR B 62 9.643 -9.293 -19.071 1.00 0.00 C ATOM 1473 C THR B 62 8.284 -8.710 -19.454 1.00 0.00 C ATOM 1474 O THR B 62 7.799 -7.778 -18.840 1.00 0.00 O ATOM 1475 CB THR B 62 9.421 -10.554 -18.230 1.00 0.00 C ATOM 1476 OG1 THR B 62 10.640 -10.931 -17.606 1.00 0.00 O ATOM 1477 CG2 THR B 62 8.933 -11.689 -19.132 1.00 0.00 C ATOM 0 H THR B 62 10.286 -8.333 -17.281 1.00 0.00 H new ATOM 0 HA THR B 62 10.204 -9.546 -19.971 1.00 0.00 H new ATOM 0 HB THR B 62 8.672 -10.352 -17.464 1.00 0.00 H new ATOM 0 HG1 THR B 62 10.496 -11.737 -17.067 1.00 0.00 H new ATOM 0 HG21 THR B 62 8.775 -12.587 -18.534 1.00 0.00 H new ATOM 0 HG22 THR B 62 7.995 -11.399 -19.606 1.00 0.00 H new ATOM 0 HG23 THR B 62 9.681 -11.891 -19.899 1.00 0.00 H new ATOM 1485 N VAL B 63 7.666 -9.266 -20.460 1.00 0.00 N ATOM 1486 CA VAL B 63 6.332 -8.777 -20.898 1.00 0.00 C ATOM 1487 C VAL B 63 5.491 -9.979 -21.321 1.00 0.00 C ATOM 1488 O VAL B 63 5.900 -10.768 -22.152 1.00 0.00 O ATOM 1489 CB VAL B 63 6.500 -7.827 -22.080 1.00 0.00 C ATOM 1490 CG1 VAL B 63 5.143 -7.235 -22.466 1.00 0.00 C ATOM 1491 CG2 VAL B 63 7.454 -6.699 -21.688 1.00 0.00 C ATOM 0 H VAL B 63 8.035 -10.047 -21.002 1.00 0.00 H new ATOM 0 HA VAL B 63 5.841 -8.246 -20.083 1.00 0.00 H new ATOM 0 HB VAL B 63 6.907 -8.375 -22.930 1.00 0.00 H new ATOM 0 HG11 VAL B 63 5.269 -6.557 -23.310 1.00 0.00 H new ATOM 0 HG12 VAL B 63 4.461 -8.039 -22.744 1.00 0.00 H new ATOM 0 HG13 VAL B 63 4.731 -6.687 -21.619 1.00 0.00 H new ATOM 0 HG21 VAL B 63 7.577 -6.018 -22.530 1.00 0.00 H new ATOM 0 HG22 VAL B 63 7.044 -6.155 -20.837 1.00 0.00 H new ATOM 0 HG23 VAL B 63 8.422 -7.119 -21.417 1.00 0.00 H new ATOM 1501 N GLN B 64 4.328 -10.130 -20.748 1.00 0.00 N ATOM 1502 CA GLN B 64 3.465 -11.289 -21.102 1.00 0.00 C ATOM 1503 C GLN B 64 1.995 -10.866 -21.079 1.00 0.00 C ATOM 1504 O GLN B 64 1.521 -10.293 -20.116 1.00 0.00 O ATOM 1505 CB GLN B 64 3.712 -12.415 -20.090 1.00 0.00 C ATOM 1506 CG GLN B 64 3.387 -11.922 -18.675 1.00 0.00 C ATOM 1507 CD GLN B 64 4.260 -12.654 -17.654 1.00 0.00 C ATOM 1508 OE1 GLN B 64 4.864 -13.664 -17.960 1.00 0.00 O ATOM 1509 NE2 GLN B 64 4.351 -12.183 -16.440 1.00 0.00 N ATOM 0 H GLN B 64 3.939 -9.498 -20.048 1.00 0.00 H new ATOM 0 HA GLN B 64 3.706 -11.642 -22.105 1.00 0.00 H new ATOM 0 HB2 GLN B 64 3.094 -13.279 -20.335 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.751 -12.741 -20.142 1.00 0.00 H new ATOM 0 HG2 GLN B 64 3.557 -10.847 -18.607 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.333 -12.093 -18.454 1.00 0.00 H new ATOM 0 HE21 GLN B 64 3.845 -11.336 -16.182 1.00 0.00 H new ATOM 0 HE22 GLN B 64 4.928 -12.662 -15.749 1.00 0.00 H new ATOM 1518 N LEU B 65 1.275 -11.136 -22.140 1.00 0.00 N ATOM 1519 CA LEU B 65 -0.155 -10.744 -22.196 1.00 0.00 C ATOM 1520 C LEU B 65 -1.047 -11.950 -21.904 1.00 0.00 C ATOM 1521 O LEU B 65 -0.749 -13.067 -22.281 1.00 0.00 O ATOM 1522 CB LEU B 65 -0.472 -10.206 -23.590 1.00 0.00 C ATOM 1523 CG LEU B 65 -0.074 -11.240 -24.652 1.00 0.00 C ATOM 1524 CD1 LEU B 65 -1.175 -11.339 -25.711 1.00 0.00 C ATOM 1525 CD2 LEU B 65 1.234 -10.809 -25.322 1.00 0.00 C ATOM 0 H LEU B 65 1.624 -11.614 -22.971 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.344 -9.975 -21.446 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -1.536 -9.981 -23.669 1.00 0.00 H new ATOM 0 HB3 LEU B 65 0.065 -9.273 -23.760 1.00 0.00 H new ATOM 0 HG LEU B 65 0.062 -12.211 -24.175 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.890 -12.074 -26.464 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -2.108 -11.646 -25.238 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.312 -10.367 -26.186 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.516 -11.544 -26.076 1.00 0.00 H new ATOM 0 HD22 LEU B 65 1.097 -9.837 -25.796 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.021 -10.739 -24.571 1.00 0.00 H new ATOM 1537 N GLU B 66 -2.150 -11.717 -21.244 1.00 0.00 N ATOM 1538 CA GLU B 66 -3.094 -12.822 -20.923 1.00 0.00 C ATOM 1539 C GLU B 66 -4.511 -12.364 -21.273 1.00 0.00 C ATOM 1540 O GLU B 66 -4.713 -11.246 -21.702 1.00 0.00 O ATOM 1541 CB GLU B 66 -3.006 -13.158 -19.427 1.00 0.00 C ATOM 1542 CG GLU B 66 -1.756 -13.995 -19.143 1.00 0.00 C ATOM 1543 CD GLU B 66 -1.815 -15.312 -19.922 1.00 0.00 C ATOM 1544 OE1 GLU B 66 -2.893 -15.875 -20.015 1.00 0.00 O ATOM 1545 OE2 GLU B 66 -0.780 -15.735 -20.412 1.00 0.00 O ATOM 0 H GLU B 66 -2.439 -10.797 -20.911 1.00 0.00 H new ATOM 0 HA GLU B 66 -2.840 -13.713 -21.497 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -2.977 -12.239 -18.842 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -3.896 -13.705 -19.117 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -0.863 -13.437 -19.425 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -1.680 -14.199 -18.075 1.00 0.00 H new ATOM 1552 N GLN B 67 -5.488 -13.217 -21.102 1.00 0.00 N ATOM 1553 CA GLN B 67 -6.892 -12.824 -21.434 1.00 0.00 C ATOM 1554 C GLN B 67 -7.865 -13.582 -20.527 1.00 0.00 C ATOM 1555 O GLN B 67 -7.573 -14.667 -20.059 1.00 0.00 O ATOM 1556 CB GLN B 67 -7.184 -13.173 -22.898 1.00 0.00 C ATOM 1557 CG GLN B 67 -6.987 -11.933 -23.774 1.00 0.00 C ATOM 1558 CD GLN B 67 -6.633 -12.365 -25.198 1.00 0.00 C ATOM 1559 OE1 GLN B 67 -7.320 -13.175 -25.788 1.00 0.00 O ATOM 1560 NE2 GLN B 67 -5.581 -11.856 -25.779 1.00 0.00 N ATOM 0 H GLN B 67 -5.376 -14.167 -20.748 1.00 0.00 H new ATOM 0 HA GLN B 67 -7.015 -11.752 -21.281 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -6.523 -13.973 -23.230 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -8.205 -13.542 -22.997 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -7.896 -11.331 -23.781 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -6.194 -11.308 -23.364 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -5.004 -11.176 -25.284 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -5.336 -12.138 -26.728 1.00 0.00 H new ATOM 1569 N LYS B 68 -9.022 -13.019 -20.282 1.00 0.00 N ATOM 1570 CA LYS B 68 -10.024 -13.703 -19.412 1.00 0.00 C ATOM 1571 C LYS B 68 -11.169 -14.234 -20.278 1.00 0.00 C ATOM 1572 O LYS B 68 -11.219 -13.994 -21.469 1.00 0.00 O ATOM 1573 CB LYS B 68 -10.579 -12.715 -18.385 1.00 0.00 C ATOM 1574 CG LYS B 68 -9.547 -12.482 -17.271 1.00 0.00 C ATOM 1575 CD LYS B 68 -9.409 -10.983 -16.995 1.00 0.00 C ATOM 1576 CE LYS B 68 -10.730 -10.435 -16.452 1.00 0.00 C ATOM 1577 NZ LYS B 68 -10.935 -10.923 -15.057 1.00 0.00 N ATOM 0 H LYS B 68 -9.315 -12.113 -20.648 1.00 0.00 H new ATOM 0 HA LYS B 68 -9.543 -14.531 -18.891 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -10.822 -11.770 -18.871 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -11.505 -13.102 -17.959 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -9.855 -13.001 -16.363 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -8.583 -12.897 -17.564 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -8.609 -10.808 -16.276 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -9.135 -10.458 -17.911 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -10.719 -9.345 -16.469 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -11.557 -10.755 -17.086 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -11.683 -10.363 -14.600 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -11.216 -11.924 -15.077 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -10.050 -10.822 -14.520 1.00 0.00 H new ATOM 1591 N ASP B 69 -12.084 -14.959 -19.685 1.00 0.00 N ATOM 1592 CA ASP B 69 -13.226 -15.515 -20.462 1.00 0.00 C ATOM 1593 C ASP B 69 -14.299 -14.439 -20.701 1.00 0.00 C ATOM 1594 O ASP B 69 -15.266 -14.675 -21.400 1.00 0.00 O ATOM 1595 CB ASP B 69 -13.845 -16.680 -19.685 1.00 0.00 C ATOM 1596 CG ASP B 69 -13.184 -17.990 -20.116 1.00 0.00 C ATOM 1597 OD1 ASP B 69 -12.184 -18.351 -19.519 1.00 0.00 O ATOM 1598 OD2 ASP B 69 -13.690 -18.611 -21.037 1.00 0.00 O ATOM 0 H ASP B 69 -12.086 -15.189 -18.691 1.00 0.00 H new ATOM 0 HA ASP B 69 -12.856 -15.860 -21.428 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -13.711 -16.528 -18.614 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -14.918 -16.724 -19.869 1.00 0.00 H new ATOM 1603 N GLY B 70 -14.147 -13.266 -20.127 1.00 0.00 N ATOM 1604 CA GLY B 70 -15.169 -12.194 -20.328 1.00 0.00 C ATOM 1605 C GLY B 70 -14.700 -11.222 -21.411 1.00 0.00 C ATOM 1606 O GLY B 70 -14.989 -10.042 -21.362 1.00 0.00 O ATOM 0 H GLY B 70 -13.361 -13.009 -19.530 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -16.122 -12.638 -20.614 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -15.335 -11.658 -19.393 1.00 0.00 H new ATOM 1610 N ASP B 71 -13.972 -11.709 -22.387 1.00 0.00 N ATOM 1611 CA ASP B 71 -13.471 -10.822 -23.483 1.00 0.00 C ATOM 1612 C ASP B 71 -12.607 -9.713 -22.883 1.00 0.00 C ATOM 1613 O ASP B 71 -12.784 -8.542 -23.167 1.00 0.00 O ATOM 1614 CB ASP B 71 -14.656 -10.208 -24.236 1.00 0.00 C ATOM 1615 CG ASP B 71 -15.214 -11.228 -25.231 1.00 0.00 C ATOM 1616 OD1 ASP B 71 -14.625 -11.376 -26.289 1.00 0.00 O ATOM 1617 OD2 ASP B 71 -16.219 -11.843 -24.918 1.00 0.00 O ATOM 0 H ASP B 71 -13.702 -12.689 -22.471 1.00 0.00 H new ATOM 0 HA ASP B 71 -12.873 -11.409 -24.180 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -15.432 -9.909 -23.532 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -14.339 -9.307 -24.762 1.00 0.00 H new ATOM 1622 N ILE B 72 -11.683 -10.082 -22.038 1.00 0.00 N ATOM 1623 CA ILE B 72 -10.807 -9.069 -21.386 1.00 0.00 C ATOM 1624 C ILE B 72 -9.341 -9.455 -21.600 1.00 0.00 C ATOM 1625 O ILE B 72 -9.030 -10.592 -21.898 1.00 0.00 O ATOM 1626 CB ILE B 72 -11.126 -9.025 -19.887 1.00 0.00 C ATOM 1627 CG1 ILE B 72 -12.657 -8.957 -19.701 1.00 0.00 C ATOM 1628 CG2 ILE B 72 -10.454 -7.795 -19.272 1.00 0.00 C ATOM 1629 CD1 ILE B 72 -13.027 -8.706 -18.232 1.00 0.00 C ATOM 0 H ILE B 72 -11.497 -11.048 -21.770 1.00 0.00 H new ATOM 0 HA ILE B 72 -10.983 -8.085 -21.822 1.00 0.00 H new ATOM 0 HB ILE B 72 -10.750 -9.919 -19.390 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -13.067 -8.161 -20.323 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -13.109 -9.890 -20.038 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -10.675 -7.755 -18.205 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -9.376 -7.859 -19.417 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -10.832 -6.894 -19.755 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -14.112 -8.663 -18.132 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -12.638 -9.516 -17.615 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -12.595 -7.760 -17.904 1.00 0.00 H new ATOM 1641 N SER B 73 -8.441 -8.514 -21.457 1.00 0.00 N ATOM 1642 CA SER B 73 -6.994 -8.819 -21.657 1.00 0.00 C ATOM 1643 C SER B 73 -6.233 -8.554 -20.360 1.00 0.00 C ATOM 1644 O SER B 73 -6.741 -7.932 -19.446 1.00 0.00 O ATOM 1645 CB SER B 73 -6.436 -7.931 -22.769 1.00 0.00 C ATOM 1646 OG SER B 73 -6.940 -8.372 -24.021 1.00 0.00 O ATOM 0 H SER B 73 -8.648 -7.546 -21.210 1.00 0.00 H new ATOM 0 HA SER B 73 -6.878 -9.866 -21.937 1.00 0.00 H new ATOM 0 HB2 SER B 73 -6.718 -6.892 -22.596 1.00 0.00 H new ATOM 0 HB3 SER B 73 -5.347 -7.970 -22.769 1.00 0.00 H new ATOM 0 HG SER B 73 -6.585 -7.803 -24.735 1.00 0.00 H new ATOM 1652 N ILE B 74 -5.022 -9.034 -20.272 1.00 0.00 N ATOM 1653 CA ILE B 74 -4.215 -8.838 -19.037 1.00 0.00 C ATOM 1654 C ILE B 74 -2.728 -8.742 -19.418 1.00 0.00 C ATOM 1655 O ILE B 74 -2.020 -9.731 -19.431 1.00 0.00 O ATOM 1656 CB ILE B 74 -4.457 -10.035 -18.102 1.00 0.00 C ATOM 1657 CG1 ILE B 74 -5.922 -10.016 -17.628 1.00 0.00 C ATOM 1658 CG2 ILE B 74 -3.510 -9.973 -16.891 1.00 0.00 C ATOM 1659 CD1 ILE B 74 -6.188 -11.173 -16.653 1.00 0.00 C ATOM 0 H ILE B 74 -4.554 -9.558 -21.011 1.00 0.00 H new ATOM 0 HA ILE B 74 -4.505 -7.919 -18.528 1.00 0.00 H new ATOM 0 HB ILE B 74 -4.258 -10.960 -18.644 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -6.141 -9.065 -17.142 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -6.589 -10.096 -18.486 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -3.695 -10.828 -16.240 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.476 -9.997 -17.236 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.687 -9.051 -16.338 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -7.228 -11.144 -16.329 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -5.990 -12.122 -17.152 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -5.535 -11.076 -15.786 1.00 0.00 H new ATOM 1671 N LEU B 75 -2.259 -7.559 -19.725 1.00 0.00 N ATOM 1672 CA LEU B 75 -0.828 -7.389 -20.103 1.00 0.00 C ATOM 1673 C LEU B 75 0.026 -7.251 -18.846 1.00 0.00 C ATOM 1674 O LEU B 75 0.043 -6.217 -18.205 1.00 0.00 O ATOM 1675 CB LEU B 75 -0.670 -6.139 -20.973 1.00 0.00 C ATOM 1676 CG LEU B 75 0.700 -6.159 -21.670 1.00 0.00 C ATOM 1677 CD1 LEU B 75 0.518 -6.478 -23.155 1.00 0.00 C ATOM 1678 CD2 LEU B 75 1.370 -4.788 -21.525 1.00 0.00 C ATOM 0 H LEU B 75 -2.811 -6.701 -19.729 1.00 0.00 H new ATOM 0 HA LEU B 75 -0.500 -8.263 -20.665 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -1.466 -6.099 -21.717 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -0.763 -5.243 -20.359 1.00 0.00 H new ATOM 0 HG LEU B 75 1.326 -6.922 -21.208 1.00 0.00 H new ATOM 0 HD11 LEU B 75 1.491 -6.491 -23.646 1.00 0.00 H new ATOM 0 HD12 LEU B 75 0.044 -7.454 -23.262 1.00 0.00 H new ATOM 0 HD13 LEU B 75 -0.111 -5.717 -23.616 1.00 0.00 H new ATOM 0 HD21 LEU B 75 2.341 -4.804 -22.020 1.00 0.00 H new ATOM 0 HD22 LEU B 75 0.741 -4.025 -21.984 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.505 -4.559 -20.468 1.00 0.00 H new ATOM 1690 N GLU B 76 0.738 -8.288 -18.499 1.00 0.00 N ATOM 1691 CA GLU B 76 1.606 -8.238 -17.290 1.00 0.00 C ATOM 1692 C GLU B 76 3.059 -8.090 -17.735 1.00 0.00 C ATOM 1693 O GLU B 76 3.454 -8.627 -18.751 1.00 0.00 O ATOM 1694 CB GLU B 76 1.446 -9.535 -16.489 1.00 0.00 C ATOM 1695 CG GLU B 76 -0.042 -9.805 -16.218 1.00 0.00 C ATOM 1696 CD GLU B 76 -0.344 -11.291 -16.427 1.00 0.00 C ATOM 1697 OE1 GLU B 76 -0.509 -11.686 -17.570 1.00 0.00 O ATOM 1698 OE2 GLU B 76 -0.403 -12.008 -15.442 1.00 0.00 O ATOM 0 H GLU B 76 0.755 -9.173 -19.005 1.00 0.00 H new ATOM 0 HA GLU B 76 1.321 -7.393 -16.663 1.00 0.00 H new ATOM 0 HB2 GLU B 76 1.881 -10.369 -17.040 1.00 0.00 H new ATOM 0 HB3 GLU B 76 1.988 -9.459 -15.546 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.295 -9.513 -15.199 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -0.658 -9.202 -16.885 1.00 0.00 H new ATOM 1705 N LEU B 77 3.858 -7.370 -16.991 1.00 0.00 N ATOM 1706 CA LEU B 77 5.287 -7.195 -17.385 1.00 0.00 C ATOM 1707 C LEU B 77 6.176 -7.252 -16.142 1.00 0.00 C ATOM 1708 O LEU B 77 5.936 -6.575 -15.161 1.00 0.00 O ATOM 1709 CB LEU B 77 5.474 -5.848 -18.094 1.00 0.00 C ATOM 1710 CG LEU B 77 4.848 -4.720 -17.268 1.00 0.00 C ATOM 1711 CD1 LEU B 77 5.545 -3.400 -17.600 1.00 0.00 C ATOM 1712 CD2 LEU B 77 3.360 -4.606 -17.607 1.00 0.00 C ATOM 0 H LEU B 77 3.583 -6.897 -16.130 1.00 0.00 H new ATOM 0 HA LEU B 77 5.569 -7.998 -18.066 1.00 0.00 H new ATOM 0 HB2 LEU B 77 6.536 -5.652 -18.243 1.00 0.00 H new ATOM 0 HB3 LEU B 77 5.014 -5.883 -19.082 1.00 0.00 H new ATOM 0 HG LEU B 77 4.965 -4.939 -16.207 1.00 0.00 H new ATOM 0 HD11 LEU B 77 5.101 -2.596 -17.013 1.00 0.00 H new ATOM 0 HD12 LEU B 77 6.606 -3.479 -17.363 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.426 -3.183 -18.661 1.00 0.00 H new ATOM 0 HD21 LEU B 77 2.913 -3.804 -17.020 1.00 0.00 H new ATOM 0 HD22 LEU B 77 3.244 -4.386 -18.668 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.861 -5.547 -17.375 1.00 0.00 H new ATOM 1724 N ASN B 78 7.205 -8.055 -16.179 1.00 0.00 N ATOM 1725 CA ASN B 78 8.122 -8.161 -15.015 1.00 0.00 C ATOM 1726 C ASN B 78 9.228 -7.126 -15.176 1.00 0.00 C ATOM 1727 O ASN B 78 9.680 -6.869 -16.272 1.00 0.00 O ATOM 1728 CB ASN B 78 8.759 -9.548 -14.991 1.00 0.00 C ATOM 1729 CG ASN B 78 7.703 -10.646 -15.194 1.00 0.00 C ATOM 1730 OD1 ASN B 78 8.007 -11.699 -15.718 1.00 0.00 O ATOM 1731 ND2 ASN B 78 6.472 -10.452 -14.801 1.00 0.00 N ATOM 0 H ASN B 78 7.449 -8.646 -16.974 1.00 0.00 H new ATOM 0 HA ASN B 78 7.566 -7.994 -14.092 1.00 0.00 H new ATOM 0 HB2 ASN B 78 9.515 -9.618 -15.773 1.00 0.00 H new ATOM 0 HB3 ASN B 78 9.269 -9.701 -14.040 1.00 0.00 H new ATOM 0 HD21 ASN B 78 5.773 -11.182 -14.935 1.00 0.00 H new ATOM 0 HD22 ASN B 78 6.210 -9.570 -14.360 1.00 0.00 H new ATOM 1738 N VAL B 79 9.671 -6.535 -14.101 1.00 0.00 N ATOM 1739 CA VAL B 79 10.757 -5.520 -14.204 1.00 0.00 C ATOM 1740 C VAL B 79 11.922 -5.932 -13.304 1.00 0.00 C ATOM 1741 O VAL B 79 11.976 -5.579 -12.142 1.00 0.00 O ATOM 1742 CB VAL B 79 10.231 -4.155 -13.772 1.00 0.00 C ATOM 1743 CG1 VAL B 79 11.285 -3.092 -14.077 1.00 0.00 C ATOM 1744 CG2 VAL B 79 8.944 -3.833 -14.541 1.00 0.00 C ATOM 0 H VAL B 79 9.328 -6.711 -13.156 1.00 0.00 H new ATOM 0 HA VAL B 79 11.099 -5.459 -15.237 1.00 0.00 H new ATOM 0 HB VAL B 79 10.019 -4.167 -12.703 1.00 0.00 H new ATOM 0 HG11 VAL B 79 10.915 -2.114 -13.770 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.201 -3.321 -13.532 1.00 0.00 H new ATOM 0 HG13 VAL B 79 11.493 -3.082 -15.147 1.00 0.00 H new ATOM 0 HG21 VAL B 79 8.569 -2.857 -14.231 1.00 0.00 H new ATOM 0 HG22 VAL B 79 9.153 -3.818 -15.611 1.00 0.00 H new ATOM 0 HG23 VAL B 79 8.193 -4.594 -14.329 1.00 0.00 H new ATOM 1754 N THR B 80 12.852 -6.680 -13.840 1.00 0.00 N ATOM 1755 CA THR B 80 14.021 -7.129 -13.030 1.00 0.00 C ATOM 1756 C THR B 80 15.035 -5.990 -12.910 1.00 0.00 C ATOM 1757 O THR B 80 15.886 -5.818 -13.761 1.00 0.00 O ATOM 1758 CB THR B 80 14.682 -8.328 -13.716 1.00 0.00 C ATOM 1759 OG1 THR B 80 13.711 -9.342 -13.937 1.00 0.00 O ATOM 1760 CG2 THR B 80 15.803 -8.877 -12.830 1.00 0.00 C ATOM 0 H THR B 80 12.851 -7.000 -14.809 1.00 0.00 H new ATOM 0 HA THR B 80 13.682 -7.416 -12.034 1.00 0.00 H new ATOM 0 HB THR B 80 15.101 -8.011 -14.671 1.00 0.00 H new ATOM 0 HG1 THR B 80 13.318 -9.230 -14.828 1.00 0.00 H new ATOM 0 HG21 THR B 80 16.271 -9.730 -13.322 1.00 0.00 H new ATOM 0 HG22 THR B 80 16.549 -8.100 -12.664 1.00 0.00 H new ATOM 0 HG23 THR B 80 15.389 -9.193 -11.873 1.00 0.00 H new ATOM 1768 N LEU B 81 14.956 -5.220 -11.855 1.00 0.00 N ATOM 1769 CA LEU B 81 15.916 -4.100 -11.666 1.00 0.00 C ATOM 1770 C LEU B 81 17.196 -4.656 -11.018 1.00 0.00 C ATOM 1771 O LEU B 81 17.110 -5.488 -10.138 1.00 0.00 O ATOM 1772 CB LEU B 81 15.286 -3.058 -10.743 1.00 0.00 C ATOM 1773 CG LEU B 81 13.990 -2.534 -11.366 1.00 0.00 C ATOM 1774 CD1 LEU B 81 12.967 -2.255 -10.263 1.00 0.00 C ATOM 1775 CD2 LEU B 81 14.277 -1.240 -12.132 1.00 0.00 C ATOM 0 H LEU B 81 14.262 -5.323 -11.114 1.00 0.00 H new ATOM 0 HA LEU B 81 16.157 -3.639 -12.624 1.00 0.00 H new ATOM 0 HB2 LEU B 81 15.080 -3.499 -9.768 1.00 0.00 H new ATOM 0 HB3 LEU B 81 15.981 -2.235 -10.580 1.00 0.00 H new ATOM 0 HG LEU B 81 13.591 -3.282 -12.051 1.00 0.00 H new ATOM 0 HD11 LEU B 81 12.045 -1.882 -10.708 1.00 0.00 H new ATOM 0 HD12 LEU B 81 12.760 -3.176 -9.717 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.366 -1.508 -9.577 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.354 -0.867 -12.575 1.00 0.00 H new ATOM 0 HD22 LEU B 81 14.678 -0.493 -11.447 1.00 0.00 H new ATOM 0 HD23 LEU B 81 15.004 -1.437 -12.920 1.00 0.00 H new ATOM 1787 N PRO B 82 18.353 -4.198 -11.461 1.00 0.00 N ATOM 1788 CA PRO B 82 19.674 -4.660 -10.924 1.00 0.00 C ATOM 1789 C PRO B 82 20.037 -3.898 -9.648 1.00 0.00 C ATOM 1790 O PRO B 82 19.295 -3.053 -9.185 1.00 0.00 O ATOM 1791 CB PRO B 82 20.646 -4.338 -12.049 1.00 0.00 C ATOM 1792 CG PRO B 82 20.032 -3.218 -12.869 1.00 0.00 C ATOM 1793 CD PRO B 82 18.538 -3.165 -12.543 1.00 0.00 C ATOM 0 HA PRO B 82 19.679 -5.715 -10.651 1.00 0.00 H new ATOM 0 HB2 PRO B 82 21.612 -4.034 -11.647 1.00 0.00 H new ATOM 0 HB3 PRO B 82 20.821 -5.217 -12.669 1.00 0.00 H new ATOM 0 HG2 PRO B 82 20.508 -2.266 -12.633 1.00 0.00 H new ATOM 0 HG3 PRO B 82 20.185 -3.396 -13.933 1.00 0.00 H new ATOM 0 HD2 PRO B 82 18.241 -2.174 -12.201 1.00 0.00 H new ATOM 0 HD3 PRO B 82 17.932 -3.395 -13.419 1.00 0.00 H new ATOM 1801 N GLU B 83 21.176 -4.200 -9.079 1.00 0.00 N ATOM 1802 CA GLU B 83 21.605 -3.505 -7.827 1.00 0.00 C ATOM 1803 C GLU B 83 21.801 -2.024 -8.124 1.00 0.00 C ATOM 1804 O GLU B 83 21.438 -1.541 -9.181 1.00 0.00 O ATOM 1805 CB GLU B 83 22.937 -4.079 -7.317 1.00 0.00 C ATOM 1806 CG GLU B 83 22.946 -5.600 -7.440 1.00 0.00 C ATOM 1807 CD GLU B 83 23.661 -6.218 -6.235 1.00 0.00 C ATOM 1808 OE1 GLU B 83 23.526 -5.678 -5.149 1.00 0.00 O ATOM 1809 OE2 GLU B 83 24.332 -7.220 -6.419 1.00 0.00 O ATOM 0 H GLU B 83 21.830 -4.900 -9.429 1.00 0.00 H new ATOM 0 HA GLU B 83 20.837 -3.650 -7.067 1.00 0.00 H new ATOM 0 HB2 GLU B 83 23.764 -3.657 -7.888 1.00 0.00 H new ATOM 0 HB3 GLU B 83 23.089 -3.792 -6.277 1.00 0.00 H new ATOM 0 HG2 GLU B 83 21.924 -5.975 -7.498 1.00 0.00 H new ATOM 0 HG3 GLU B 83 23.447 -5.896 -8.362 1.00 0.00 H new ATOM 1816 N ALA B 84 22.394 -1.304 -7.209 1.00 0.00 N ATOM 1817 CA ALA B 84 22.640 0.141 -7.440 1.00 0.00 C ATOM 1818 C ALA B 84 23.407 0.728 -6.254 1.00 0.00 C ATOM 1819 O ALA B 84 22.823 1.271 -5.335 1.00 0.00 O ATOM 1820 CB ALA B 84 21.309 0.876 -7.606 1.00 0.00 C ATOM 0 H ALA B 84 22.718 -1.660 -6.310 1.00 0.00 H new ATOM 0 HA ALA B 84 23.230 0.262 -8.348 1.00 0.00 H new ATOM 0 HB1 ALA B 84 21.497 1.936 -7.775 1.00 0.00 H new ATOM 0 HB2 ALA B 84 20.769 0.463 -8.458 1.00 0.00 H new ATOM 0 HB3 ALA B 84 20.711 0.753 -6.703 1.00 0.00 H new ATOM 1826 N GLU B 85 24.713 0.621 -6.268 1.00 0.00 N ATOM 1827 CA GLU B 85 25.528 1.169 -5.146 1.00 0.00 C ATOM 1828 C GLU B 85 25.330 2.685 -5.059 1.00 0.00 C ATOM 1829 O GLU B 85 26.063 3.449 -5.657 1.00 0.00 O ATOM 1830 CB GLU B 85 27.007 0.861 -5.393 1.00 0.00 C ATOM 1831 CG GLU B 85 27.211 -0.654 -5.447 1.00 0.00 C ATOM 1832 CD GLU B 85 27.383 -1.196 -4.027 1.00 0.00 C ATOM 1833 OE1 GLU B 85 28.417 -0.934 -3.435 1.00 0.00 O ATOM 1834 OE2 GLU B 85 26.477 -1.864 -3.554 1.00 0.00 O ATOM 0 H GLU B 85 25.249 0.175 -7.012 1.00 0.00 H new ATOM 0 HA GLU B 85 25.211 0.709 -4.210 1.00 0.00 H new ATOM 0 HB2 GLU B 85 27.333 1.316 -6.328 1.00 0.00 H new ATOM 0 HB3 GLU B 85 27.617 1.293 -4.599 1.00 0.00 H new ATOM 0 HG2 GLU B 85 26.357 -1.130 -5.928 1.00 0.00 H new ATOM 0 HG3 GLU B 85 28.089 -0.892 -6.048 1.00 0.00 H new ATOM 1841 N GLU B 86 24.343 3.122 -4.316 1.00 0.00 N ATOM 1842 CA GLU B 86 24.084 4.590 -4.181 1.00 0.00 C ATOM 1843 C GLU B 86 23.786 5.190 -5.559 1.00 0.00 C ATOM 1844 O GLU B 86 24.676 5.639 -6.253 1.00 0.00 O ATOM 1845 CB GLU B 86 25.314 5.276 -3.581 1.00 0.00 C ATOM 1846 CG GLU B 86 24.868 6.457 -2.714 1.00 0.00 C ATOM 1847 CD GLU B 86 24.842 7.731 -3.560 1.00 0.00 C ATOM 1848 OE1 GLU B 86 24.129 7.746 -4.551 1.00 0.00 O ATOM 1849 OE2 GLU B 86 25.535 8.670 -3.205 1.00 0.00 O ATOM 0 H GLU B 86 23.703 2.523 -3.795 1.00 0.00 H new ATOM 0 HA GLU B 86 23.227 4.745 -3.526 1.00 0.00 H new ATOM 0 HB2 GLU B 86 25.884 4.566 -2.982 1.00 0.00 H new ATOM 0 HB3 GLU B 86 25.974 5.623 -4.376 1.00 0.00 H new ATOM 0 HG2 GLU B 86 23.879 6.264 -2.299 1.00 0.00 H new ATOM 0 HG3 GLU B 86 25.549 6.581 -1.872 1.00 0.00 H new ATOM 1856 N LEU B 87 22.538 5.196 -5.953 1.00 0.00 N ATOM 1857 CA LEU B 87 22.170 5.763 -7.285 1.00 0.00 C ATOM 1858 C LEU B 87 20.938 6.658 -7.135 1.00 0.00 C ATOM 1859 O LEU B 87 20.017 6.343 -6.405 1.00 0.00 O ATOM 1860 CB LEU B 87 21.857 4.623 -8.256 1.00 0.00 C ATOM 1861 CG LEU B 87 22.074 5.102 -9.693 1.00 0.00 C ATOM 1862 CD1 LEU B 87 23.500 4.767 -10.133 1.00 0.00 C ATOM 1863 CD2 LEU B 87 21.077 4.400 -10.618 1.00 0.00 C ATOM 0 H LEU B 87 21.756 4.832 -5.408 1.00 0.00 H new ATOM 0 HA LEU B 87 23.002 6.351 -7.672 1.00 0.00 H new ATOM 0 HB2 LEU B 87 22.498 3.766 -8.046 1.00 0.00 H new ATOM 0 HB3 LEU B 87 20.827 4.291 -8.124 1.00 0.00 H new ATOM 0 HG LEU B 87 21.923 6.180 -9.744 1.00 0.00 H new ATOM 0 HD11 LEU B 87 23.655 5.108 -11.157 1.00 0.00 H new ATOM 0 HD12 LEU B 87 24.211 5.265 -9.473 1.00 0.00 H new ATOM 0 HD13 LEU B 87 23.652 3.689 -10.083 1.00 0.00 H new ATOM 0 HD21 LEU B 87 21.230 4.740 -11.642 1.00 0.00 H new ATOM 0 HD22 LEU B 87 21.230 3.322 -10.567 1.00 0.00 H new ATOM 0 HD23 LEU B 87 20.060 4.638 -10.305 1.00 0.00 H new ATOM 1875 N LYS B 88 20.916 7.771 -7.824 1.00 0.00 N ATOM 1876 CA LYS B 88 19.748 8.694 -7.730 1.00 0.00 C ATOM 1877 C LYS B 88 18.856 8.514 -8.959 1.00 0.00 C ATOM 1878 O LYS B 88 17.872 9.227 -9.062 1.00 0.00 O ATOM 1879 CB LYS B 88 20.243 10.141 -7.668 1.00 0.00 C ATOM 1880 CG LYS B 88 21.175 10.415 -8.851 1.00 0.00 C ATOM 1881 CD LYS B 88 20.983 11.856 -9.331 1.00 0.00 C ATOM 1882 CE LYS B 88 21.863 12.108 -10.556 1.00 0.00 C ATOM 1883 NZ LYS B 88 21.194 13.089 -11.455 1.00 0.00 N ATOM 1884 OXT LYS B 88 19.171 7.665 -9.777 1.00 0.00 O ATOM 0 H LYS B 88 21.660 8.080 -8.449 1.00 0.00 H new ATOM 0 HA LYS B 88 19.178 8.466 -6.829 1.00 0.00 H new ATOM 0 HB2 LYS B 88 19.396 10.827 -7.692 1.00 0.00 H new ATOM 0 HB3 LYS B 88 20.769 10.316 -6.729 1.00 0.00 H new ATOM 0 HG2 LYS B 88 22.212 10.254 -8.555 1.00 0.00 H new ATOM 0 HG3 LYS B 88 20.963 9.719 -9.663 1.00 0.00 H new ATOM 0 HD2 LYS B 88 19.936 12.031 -9.580 1.00 0.00 H new ATOM 0 HD3 LYS B 88 21.242 12.553 -8.534 1.00 0.00 H new ATOM 0 HE2 LYS B 88 22.836 12.488 -10.246 1.00 0.00 H new ATOM 0 HE3 LYS B 88 22.040 11.173 -11.088 1.00 0.00 H new ATOM 0 HZ1 LYS B 88 21.792 13.261 -12.288 1.00 0.00 H new ATOM 0 HZ2 LYS B 88 20.275 12.709 -11.761 1.00 0.00 H new ATOM 0 HZ3 LYS B 88 21.047 13.983 -10.945 1.00 0.00 H new TER 1898 LYS B 88