USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 832 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 64 GLN : amide:sc= -2.85 K(o=-9,f=-12!) USER MOD Set 1.2: B 78 ASN : amide:sc= -6.19 K(o=-9,f=-25!) USER MOD Set 2.1: A 64 GLN : amide:sc= -2.94 K(o=-9,f=-12!) USER MOD Set 2.2: A 78 ASN : amide:sc= -6.07 K(o=-9,f=-25!) USER MOD Single : A 32 SER OG : rot 28:sc= 0.492 USER MOD Single : A 37 HIS : no HE2:sc= 0.134 K(o=0.13,f=-0.93) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.925 K(o=-0.93,f=-1.4) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 159:sc=-0.00381 (180deg=-0.178) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 60 MET CE :methyl 158:sc= -3.1 (180deg=-3.76!) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.0577 USER MOD Single : A 67 GLN : amide:sc= -1.41 K(o=-1.4,f=-7.7!) USER MOD Single : A 68 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.122) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 32 SER OG : rot 29:sc= 0.466 USER MOD Single : B 37 HIS : no HE2:sc= 0.122 K(o=0.12,f=-1) USER MOD Single : B 38 TYR OH : rot 180:sc= 0 USER MOD Single : B 41 GLN : amide:sc= -1 K(o=-1,f=-1.6) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ 158:sc= -0.0172 (180deg=-0.201) USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 55 GLN : amide:sc= 0 X(o=0,f=-0.033) USER MOD Single : B 60 MET CE :methyl 169:sc= -3.15 (180deg=-3.75!) USER MOD Single : B 62 THR OG1 : rot 180:sc= -0.0501 USER MOD Single : B 67 GLN : amide:sc= -1.41 K(o=-1.4,f=-7.7!) USER MOD Single : B 68 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.119) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 27 N SER A 32 5.909 -0.726 0.708 1.00 0.00 N ATOM 28 CA SER A 32 7.317 -1.167 0.479 1.00 0.00 C ATOM 29 C SER A 32 7.915 -0.432 -0.725 1.00 0.00 C ATOM 30 O SER A 32 9.120 -0.374 -0.881 1.00 0.00 O ATOM 31 CB SER A 32 7.341 -2.671 0.213 1.00 0.00 C ATOM 32 OG SER A 32 6.416 -3.318 1.076 1.00 0.00 O ATOM 0 HA SER A 32 7.907 -0.937 1.366 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.086 -2.871 -0.828 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.344 -3.064 0.377 1.00 0.00 H new ATOM 0 HG SER A 32 5.694 -2.697 1.307 1.00 0.00 H new ATOM 38 N ASP A 33 7.088 0.129 -1.578 1.00 0.00 N ATOM 39 CA ASP A 33 7.615 0.855 -2.766 1.00 0.00 C ATOM 40 C ASP A 33 7.928 2.317 -2.413 1.00 0.00 C ATOM 41 O ASP A 33 8.144 3.129 -3.289 1.00 0.00 O ATOM 42 CB ASP A 33 6.584 0.819 -3.895 1.00 0.00 C ATOM 43 CG ASP A 33 6.148 -0.626 -4.149 1.00 0.00 C ATOM 44 OD1 ASP A 33 6.794 -1.288 -4.943 1.00 0.00 O ATOM 45 OD2 ASP A 33 5.176 -1.046 -3.543 1.00 0.00 O ATOM 0 H ASP A 33 6.071 0.112 -1.497 1.00 0.00 H new ATOM 0 HA ASP A 33 8.533 0.364 -3.089 1.00 0.00 H new ATOM 0 HB2 ASP A 33 5.720 1.429 -3.631 1.00 0.00 H new ATOM 0 HB3 ASP A 33 7.010 1.246 -4.803 1.00 0.00 H new ATOM 50 N ALA A 34 7.959 2.661 -1.148 1.00 0.00 N ATOM 51 CA ALA A 34 8.269 4.063 -0.757 1.00 0.00 C ATOM 52 C ALA A 34 9.784 4.224 -0.552 1.00 0.00 C ATOM 53 O ALA A 34 10.290 5.328 -0.468 1.00 0.00 O ATOM 54 CB ALA A 34 7.540 4.398 0.545 1.00 0.00 C ATOM 0 H ALA A 34 7.782 2.025 -0.370 1.00 0.00 H new ATOM 0 HA ALA A 34 7.940 4.739 -1.546 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.765 5.425 0.834 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.465 4.290 0.399 1.00 0.00 H new ATOM 0 HB3 ALA A 34 7.869 3.719 1.331 1.00 0.00 H new ATOM 60 N GLU A 35 10.512 3.133 -0.462 1.00 0.00 N ATOM 61 CA GLU A 35 11.987 3.214 -0.253 1.00 0.00 C ATOM 62 C GLU A 35 12.683 3.932 -1.430 1.00 0.00 C ATOM 63 O GLU A 35 13.544 4.757 -1.196 1.00 0.00 O ATOM 64 CB GLU A 35 12.570 1.802 -0.091 1.00 0.00 C ATOM 65 CG GLU A 35 11.770 1.019 0.963 1.00 0.00 C ATOM 66 CD GLU A 35 12.591 0.895 2.251 1.00 0.00 C ATOM 67 OE1 GLU A 35 12.823 1.914 2.881 1.00 0.00 O ATOM 68 OE2 GLU A 35 12.970 -0.215 2.585 1.00 0.00 O ATOM 0 H GLU A 35 10.140 2.185 -0.525 1.00 0.00 H new ATOM 0 HA GLU A 35 12.167 3.792 0.653 1.00 0.00 H new ATOM 0 HB2 GLU A 35 12.541 1.276 -1.045 1.00 0.00 H new ATOM 0 HB3 GLU A 35 13.617 1.864 0.207 1.00 0.00 H new ATOM 0 HG2 GLU A 35 10.828 1.527 1.169 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.522 0.028 0.582 1.00 0.00 H new ATOM 75 N PRO A 36 12.321 3.615 -2.665 1.00 0.00 N ATOM 76 CA PRO A 36 12.938 4.242 -3.879 1.00 0.00 C ATOM 77 C PRO A 36 12.237 5.559 -4.236 1.00 0.00 C ATOM 78 O PRO A 36 12.876 6.540 -4.560 1.00 0.00 O ATOM 79 CB PRO A 36 12.720 3.196 -4.963 1.00 0.00 C ATOM 80 CG PRO A 36 11.531 2.350 -4.547 1.00 0.00 C ATOM 81 CD PRO A 36 11.265 2.614 -3.063 1.00 0.00 C ATOM 0 HA PRO A 36 13.988 4.498 -3.739 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.533 3.674 -5.925 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.609 2.576 -5.082 1.00 0.00 H new ATOM 0 HG2 PRO A 36 10.654 2.604 -5.143 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.736 1.293 -4.716 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.262 3.010 -2.903 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.344 1.699 -2.476 1.00 0.00 H new ATOM 89 N HIS A 37 10.922 5.580 -4.188 1.00 0.00 N ATOM 90 CA HIS A 37 10.138 6.818 -4.528 1.00 0.00 C ATOM 91 C HIS A 37 10.087 7.040 -6.052 1.00 0.00 C ATOM 92 O HIS A 37 9.443 7.961 -6.519 1.00 0.00 O ATOM 93 CB HIS A 37 10.747 8.057 -3.849 1.00 0.00 C ATOM 94 CG HIS A 37 9.649 9.003 -3.442 1.00 0.00 C ATOM 95 ND1 HIS A 37 8.943 9.757 -4.366 1.00 0.00 N ATOM 96 CD2 HIS A 37 9.124 9.325 -2.216 1.00 0.00 C ATOM 97 CE1 HIS A 37 8.041 10.490 -3.687 1.00 0.00 C ATOM 98 NE2 HIS A 37 8.109 10.265 -2.373 1.00 0.00 N ATOM 0 H HIS A 37 10.349 4.779 -3.923 1.00 0.00 H new ATOM 0 HA HIS A 37 9.123 6.673 -4.159 1.00 0.00 H new ATOM 0 HB2 HIS A 37 11.325 7.757 -2.975 1.00 0.00 H new ATOM 0 HB3 HIS A 37 11.436 8.556 -4.531 1.00 0.00 H new ATOM 0 HD1 HIS A 37 9.082 9.757 -5.377 1.00 0.00 H new ATOM 0 HD2 HIS A 37 9.449 8.912 -1.272 1.00 0.00 H new ATOM 0 HE1 HIS A 37 7.347 11.176 -4.149 1.00 0.00 H new ATOM 106 N TYR A 38 10.736 6.204 -6.831 1.00 0.00 N ATOM 107 CA TYR A 38 10.697 6.371 -8.316 1.00 0.00 C ATOM 108 C TYR A 38 10.053 5.130 -8.938 1.00 0.00 C ATOM 109 O TYR A 38 9.344 5.214 -9.923 1.00 0.00 O ATOM 110 CB TYR A 38 12.117 6.552 -8.870 1.00 0.00 C ATOM 111 CG TYR A 38 13.042 5.503 -8.297 1.00 0.00 C ATOM 112 CD1 TYR A 38 13.175 4.262 -8.931 1.00 0.00 C ATOM 113 CD2 TYR A 38 13.773 5.777 -7.136 1.00 0.00 C ATOM 114 CE1 TYR A 38 14.037 3.295 -8.402 1.00 0.00 C ATOM 115 CE2 TYR A 38 14.636 4.810 -6.606 1.00 0.00 C ATOM 116 CZ TYR A 38 14.768 3.568 -7.240 1.00 0.00 C ATOM 117 OH TYR A 38 15.619 2.614 -6.718 1.00 0.00 O ATOM 0 H TYR A 38 11.290 5.414 -6.500 1.00 0.00 H new ATOM 0 HA TYR A 38 10.113 7.257 -8.565 1.00 0.00 H new ATOM 0 HB2 TYR A 38 12.102 6.479 -9.957 1.00 0.00 H new ATOM 0 HB3 TYR A 38 12.487 7.547 -8.623 1.00 0.00 H new ATOM 0 HD1 TYR A 38 12.612 4.051 -9.828 1.00 0.00 H new ATOM 0 HD2 TYR A 38 13.672 6.735 -6.648 1.00 0.00 H new ATOM 0 HE1 TYR A 38 14.138 2.337 -8.891 1.00 0.00 H new ATOM 0 HE2 TYR A 38 15.199 5.022 -5.709 1.00 0.00 H new ATOM 0 HH TYR A 38 16.049 2.966 -5.911 1.00 0.00 H new ATOM 127 N LEU A 39 10.284 3.978 -8.358 1.00 0.00 N ATOM 128 CA LEU A 39 9.685 2.716 -8.886 1.00 0.00 C ATOM 129 C LEU A 39 8.153 2.862 -9.053 1.00 0.00 C ATOM 130 O LEU A 39 7.631 2.549 -10.108 1.00 0.00 O ATOM 131 CB LEU A 39 9.997 1.570 -7.908 1.00 0.00 C ATOM 132 CG LEU A 39 10.737 0.432 -8.635 1.00 0.00 C ATOM 133 CD1 LEU A 39 9.906 -0.070 -9.824 1.00 0.00 C ATOM 134 CD2 LEU A 39 12.089 0.943 -9.142 1.00 0.00 C ATOM 0 H LEU A 39 10.869 3.859 -7.531 1.00 0.00 H new ATOM 0 HA LEU A 39 10.113 2.500 -9.865 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.607 1.942 -7.085 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.072 1.192 -7.474 1.00 0.00 H new ATOM 0 HG LEU A 39 10.891 -0.390 -7.936 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.442 -0.874 -10.328 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.946 -0.442 -9.466 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.739 0.749 -10.523 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.613 0.137 -9.657 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.929 1.771 -9.832 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.688 1.285 -8.298 1.00 0.00 H new ATOM 146 N PRO A 40 7.464 3.334 -8.026 1.00 0.00 N ATOM 147 CA PRO A 40 5.976 3.523 -8.075 1.00 0.00 C ATOM 148 C PRO A 40 5.614 4.728 -8.953 1.00 0.00 C ATOM 149 O PRO A 40 4.487 4.870 -9.395 1.00 0.00 O ATOM 150 CB PRO A 40 5.582 3.736 -6.622 1.00 0.00 C ATOM 151 CG PRO A 40 6.813 4.229 -5.896 1.00 0.00 C ATOM 152 CD PRO A 40 8.030 3.758 -6.690 1.00 0.00 C ATOM 0 HA PRO A 40 5.450 2.676 -8.516 1.00 0.00 H new ATOM 0 HB2 PRO A 40 4.773 4.462 -6.545 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.220 2.807 -6.181 1.00 0.00 H new ATOM 0 HG2 PRO A 40 6.803 5.316 -5.818 1.00 0.00 H new ATOM 0 HG3 PRO A 40 6.842 3.836 -4.880 1.00 0.00 H new ATOM 0 HD2 PRO A 40 8.764 4.556 -6.804 1.00 0.00 H new ATOM 0 HD3 PRO A 40 8.534 2.930 -6.191 1.00 0.00 H new ATOM 160 N GLN A 41 6.566 5.583 -9.232 1.00 0.00 N ATOM 161 CA GLN A 41 6.291 6.754 -10.107 1.00 0.00 C ATOM 162 C GLN A 41 6.244 6.261 -11.557 1.00 0.00 C ATOM 163 O GLN A 41 5.510 6.776 -12.381 1.00 0.00 O ATOM 164 CB GLN A 41 7.420 7.782 -9.936 1.00 0.00 C ATOM 165 CG GLN A 41 7.200 8.976 -10.870 1.00 0.00 C ATOM 166 CD GLN A 41 5.965 9.757 -10.420 1.00 0.00 C ATOM 167 OE1 GLN A 41 5.704 9.877 -9.240 1.00 0.00 O ATOM 168 NE2 GLN A 41 5.187 10.298 -11.318 1.00 0.00 N ATOM 0 H GLN A 41 7.524 5.516 -8.888 1.00 0.00 H new ATOM 0 HA GLN A 41 5.343 7.223 -9.844 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.456 8.123 -8.901 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.381 7.315 -10.152 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.076 9.624 -10.861 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.070 8.630 -11.895 1.00 0.00 H new ATOM 0 HE21 GLN A 41 5.406 10.198 -12.309 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.361 10.821 -11.028 1.00 0.00 H new ATOM 177 N LEU A 42 7.035 5.264 -11.866 1.00 0.00 N ATOM 178 CA LEU A 42 7.068 4.724 -13.246 1.00 0.00 C ATOM 179 C LEU A 42 5.824 3.871 -13.497 1.00 0.00 C ATOM 180 O LEU A 42 5.204 3.961 -14.538 1.00 0.00 O ATOM 181 CB LEU A 42 8.317 3.846 -13.420 1.00 0.00 C ATOM 182 CG LEU A 42 9.660 4.642 -13.359 1.00 0.00 C ATOM 183 CD1 LEU A 42 9.486 6.119 -12.956 1.00 0.00 C ATOM 184 CD2 LEU A 42 10.594 3.972 -12.345 1.00 0.00 C ATOM 0 H LEU A 42 7.663 4.801 -11.209 1.00 0.00 H new ATOM 0 HA LEU A 42 7.093 5.552 -13.954 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.323 3.081 -12.644 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.255 3.328 -14.377 1.00 0.00 H new ATOM 0 HG LEU A 42 10.074 4.628 -14.367 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.460 6.608 -12.935 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.844 6.621 -13.680 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.030 6.175 -11.967 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.534 4.522 -12.297 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.123 3.971 -11.362 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.790 2.945 -12.654 1.00 0.00 H new ATOM 196 N ARG A 43 5.457 3.035 -12.555 1.00 0.00 N ATOM 197 CA ARG A 43 4.254 2.175 -12.750 1.00 0.00 C ATOM 198 C ARG A 43 3.029 3.066 -12.951 1.00 0.00 C ATOM 199 O ARG A 43 2.200 2.810 -13.807 1.00 0.00 O ATOM 200 CB ARG A 43 4.057 1.260 -11.533 1.00 0.00 C ATOM 201 CG ARG A 43 3.727 2.080 -10.284 1.00 0.00 C ATOM 202 CD ARG A 43 3.624 1.149 -9.073 1.00 0.00 C ATOM 203 NE ARG A 43 2.927 1.862 -7.957 1.00 0.00 N ATOM 204 CZ ARG A 43 3.021 1.444 -6.709 1.00 0.00 C ATOM 205 NH1 ARG A 43 3.730 0.387 -6.386 1.00 0.00 N ATOM 206 NH2 ARG A 43 2.394 2.100 -5.770 1.00 0.00 N ATOM 0 H ARG A 43 5.938 2.913 -11.664 1.00 0.00 H new ATOM 0 HA ARG A 43 4.391 1.548 -13.631 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.253 0.552 -11.731 1.00 0.00 H new ATOM 0 HB3 ARG A 43 4.961 0.676 -11.362 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.499 2.830 -10.114 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.788 2.615 -10.425 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.076 0.245 -9.340 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.619 0.836 -8.755 1.00 0.00 H new ATOM 0 HE ARG A 43 2.367 2.689 -8.166 1.00 0.00 H new ATOM 0 HH11 ARG A 43 4.226 -0.134 -7.109 1.00 0.00 H new ATOM 0 HH12 ARG A 43 3.784 0.087 -5.413 1.00 0.00 H new ATOM 0 HH21 ARG A 43 1.841 2.924 -6.006 1.00 0.00 H new ATOM 0 HH22 ARG A 43 2.458 1.789 -4.801 1.00 0.00 H new ATOM 220 N LYS A 44 2.912 4.123 -12.181 1.00 0.00 N ATOM 221 CA LYS A 44 1.752 5.020 -12.356 1.00 0.00 C ATOM 222 C LYS A 44 1.861 5.683 -13.732 1.00 0.00 C ATOM 223 O LYS A 44 0.871 5.959 -14.377 1.00 0.00 O ATOM 224 CB LYS A 44 1.715 6.073 -11.233 1.00 0.00 C ATOM 225 CG LYS A 44 2.896 7.050 -11.337 1.00 0.00 C ATOM 226 CD LYS A 44 2.597 8.293 -10.497 1.00 0.00 C ATOM 227 CE LYS A 44 1.970 9.370 -11.385 1.00 0.00 C ATOM 228 NZ LYS A 44 1.072 10.230 -10.563 1.00 0.00 N ATOM 0 H LYS A 44 3.569 4.392 -11.449 1.00 0.00 H new ATOM 0 HA LYS A 44 0.823 4.452 -12.299 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.778 6.627 -11.283 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.739 5.574 -10.264 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.811 6.572 -10.987 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.061 7.331 -12.377 1.00 0.00 H new ATOM 0 HD2 LYS A 44 1.920 8.040 -9.681 1.00 0.00 H new ATOM 0 HD3 LYS A 44 3.515 8.669 -10.044 1.00 0.00 H new ATOM 0 HE2 LYS A 44 2.750 9.976 -11.846 1.00 0.00 H new ATOM 0 HE3 LYS A 44 1.406 8.906 -12.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 0.645 10.962 -11.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 0.321 9.646 -10.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 1.623 10.683 -9.806 1.00 0.00 H new ATOM 242 N ASP A 45 3.072 5.922 -14.186 1.00 0.00 N ATOM 243 CA ASP A 45 3.262 6.547 -15.517 1.00 0.00 C ATOM 244 C ASP A 45 2.717 5.608 -16.591 1.00 0.00 C ATOM 245 O ASP A 45 2.012 6.032 -17.482 1.00 0.00 O ATOM 246 CB ASP A 45 4.749 6.806 -15.761 1.00 0.00 C ATOM 247 CG ASP A 45 5.232 7.937 -14.852 1.00 0.00 C ATOM 248 OD1 ASP A 45 4.449 8.837 -14.589 1.00 0.00 O ATOM 249 OD2 ASP A 45 6.377 7.886 -14.433 1.00 0.00 O ATOM 0 H ASP A 45 3.933 5.707 -13.683 1.00 0.00 H new ATOM 0 HA ASP A 45 2.728 7.497 -15.555 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.322 5.900 -15.566 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.915 7.070 -16.805 1.00 0.00 H new ATOM 254 N ILE A 46 3.025 4.331 -16.510 1.00 0.00 N ATOM 255 CA ILE A 46 2.505 3.373 -17.533 1.00 0.00 C ATOM 256 C ILE A 46 0.970 3.367 -17.479 1.00 0.00 C ATOM 257 O ILE A 46 0.308 3.153 -18.476 1.00 0.00 O ATOM 258 CB ILE A 46 3.091 1.960 -17.297 1.00 0.00 C ATOM 259 CG1 ILE A 46 2.787 1.091 -18.523 1.00 0.00 C ATOM 260 CG2 ILE A 46 2.515 1.291 -16.036 1.00 0.00 C ATOM 261 CD1 ILE A 46 3.514 -0.248 -18.400 1.00 0.00 C ATOM 0 H ILE A 46 3.610 3.917 -15.784 1.00 0.00 H new ATOM 0 HA ILE A 46 2.817 3.688 -18.529 1.00 0.00 H new ATOM 0 HB ILE A 46 4.166 2.060 -17.147 1.00 0.00 H new ATOM 0 HG12 ILE A 46 1.713 0.926 -18.606 1.00 0.00 H new ATOM 0 HG13 ILE A 46 3.102 1.604 -19.432 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.957 0.302 -15.914 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.745 1.901 -15.163 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.434 1.195 -16.137 1.00 0.00 H new ATOM 0 HD11 ILE A 46 3.295 -0.862 -19.273 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.588 -0.074 -18.338 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.178 -0.763 -17.500 1.00 0.00 H new ATOM 273 N LEU A 47 0.406 3.626 -16.322 1.00 0.00 N ATOM 274 CA LEU A 47 -1.074 3.665 -16.199 1.00 0.00 C ATOM 275 C LEU A 47 -1.588 4.881 -16.969 1.00 0.00 C ATOM 276 O LEU A 47 -2.492 4.782 -17.780 1.00 0.00 O ATOM 277 CB LEU A 47 -1.463 3.788 -14.725 1.00 0.00 C ATOM 278 CG LEU A 47 -1.392 2.413 -14.058 1.00 0.00 C ATOM 279 CD1 LEU A 47 -1.012 2.579 -12.585 1.00 0.00 C ATOM 280 CD2 LEU A 47 -2.756 1.729 -14.157 1.00 0.00 C ATOM 0 H LEU A 47 0.915 3.812 -15.458 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.510 2.752 -16.604 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.794 4.484 -14.219 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.471 4.194 -14.637 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.641 1.804 -14.561 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -0.961 1.599 -12.110 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.041 3.068 -12.513 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -1.763 3.188 -12.082 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.707 0.749 -13.682 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.506 2.339 -13.654 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.028 1.611 -15.206 1.00 0.00 H new ATOM 292 N GLU A 48 -0.994 6.025 -16.735 1.00 0.00 N ATOM 293 CA GLU A 48 -1.417 7.253 -17.463 1.00 0.00 C ATOM 294 C GLU A 48 -1.067 7.078 -18.926 1.00 0.00 C ATOM 295 O GLU A 48 -1.796 7.494 -19.808 1.00 0.00 O ATOM 296 CB GLU A 48 -0.668 8.477 -16.938 1.00 0.00 C ATOM 297 CG GLU A 48 -0.781 8.553 -15.422 1.00 0.00 C ATOM 298 CD GLU A 48 -2.241 8.774 -15.021 1.00 0.00 C ATOM 299 OE1 GLU A 48 -2.927 9.492 -15.729 1.00 0.00 O ATOM 300 OE2 GLU A 48 -2.648 8.221 -14.013 1.00 0.00 O ATOM 0 H GLU A 48 -0.233 6.158 -16.069 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.487 7.401 -17.321 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.381 8.423 -17.229 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.077 9.382 -17.386 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.407 7.633 -14.974 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -0.163 9.367 -15.043 1.00 0.00 H new ATOM 307 N VAL A 49 0.055 6.457 -19.189 1.00 0.00 N ATOM 308 CA VAL A 49 0.476 6.239 -20.594 1.00 0.00 C ATOM 309 C VAL A 49 -0.599 5.395 -21.289 1.00 0.00 C ATOM 310 O VAL A 49 -1.157 5.797 -22.287 1.00 0.00 O ATOM 311 CB VAL A 49 1.841 5.529 -20.631 1.00 0.00 C ATOM 312 CG1 VAL A 49 2.230 5.195 -22.081 1.00 0.00 C ATOM 313 CG2 VAL A 49 2.905 6.450 -20.022 1.00 0.00 C ATOM 0 H VAL A 49 0.696 6.093 -18.484 1.00 0.00 H new ATOM 0 HA VAL A 49 0.584 7.192 -21.112 1.00 0.00 H new ATOM 0 HB VAL A 49 1.775 4.603 -20.059 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.198 4.693 -22.092 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.477 4.540 -22.518 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.292 6.115 -22.662 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.874 5.952 -20.046 1.00 0.00 H new ATOM 0 HG22 VAL A 49 2.958 7.375 -20.597 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.640 6.679 -18.990 1.00 0.00 H new ATOM 323 N ILE A 50 -0.929 4.247 -20.740 1.00 0.00 N ATOM 324 CA ILE A 50 -2.006 3.405 -21.352 1.00 0.00 C ATOM 325 C ILE A 50 -3.287 4.244 -21.470 1.00 0.00 C ATOM 326 O ILE A 50 -4.135 3.978 -22.297 1.00 0.00 O ATOM 327 CB ILE A 50 -2.264 2.169 -20.479 1.00 0.00 C ATOM 328 CG1 ILE A 50 -0.965 1.373 -20.328 1.00 0.00 C ATOM 329 CG2 ILE A 50 -3.322 1.283 -21.141 1.00 0.00 C ATOM 330 CD1 ILE A 50 -0.966 0.648 -18.981 1.00 0.00 C ATOM 0 H ILE A 50 -0.501 3.860 -19.899 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.695 3.072 -22.342 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.617 2.488 -19.498 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.870 0.653 -21.141 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.106 2.041 -20.393 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.503 0.406 -20.519 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.249 1.846 -21.254 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.969 0.965 -22.122 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.042 0.081 -18.872 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.041 1.378 -18.175 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.816 -0.032 -18.935 1.00 0.00 H new ATOM 342 N CYS A 51 -3.417 5.269 -20.656 1.00 0.00 N ATOM 343 CA CYS A 51 -4.616 6.141 -20.729 1.00 0.00 C ATOM 344 C CYS A 51 -4.506 7.043 -21.965 1.00 0.00 C ATOM 345 O CYS A 51 -5.444 7.198 -22.717 1.00 0.00 O ATOM 346 CB CYS A 51 -4.693 7.007 -19.466 1.00 0.00 C ATOM 347 SG CYS A 51 -6.376 7.644 -19.277 1.00 0.00 S ATOM 0 H CYS A 51 -2.736 5.532 -19.944 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.515 5.528 -20.802 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.414 6.420 -18.591 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -3.985 7.833 -19.534 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.445 8.377 -18.206 1.00 0.00 H new ATOM 353 N LYS A 52 -3.357 7.634 -22.179 1.00 0.00 N ATOM 354 CA LYS A 52 -3.173 8.534 -23.364 1.00 0.00 C ATOM 355 C LYS A 52 -3.477 7.770 -24.656 1.00 0.00 C ATOM 356 O LYS A 52 -3.940 8.336 -25.629 1.00 0.00 O ATOM 357 CB LYS A 52 -1.725 9.029 -23.429 1.00 0.00 C ATOM 358 CG LYS A 52 -1.345 9.747 -22.134 1.00 0.00 C ATOM 359 CD LYS A 52 0.177 9.702 -21.967 1.00 0.00 C ATOM 360 CE LYS A 52 0.791 10.990 -22.517 1.00 0.00 C ATOM 361 NZ LYS A 52 0.533 12.109 -21.567 1.00 0.00 N ATOM 0 H LYS A 52 -2.535 7.533 -21.584 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.853 9.379 -23.260 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.054 8.186 -23.595 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.603 9.705 -24.275 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.690 10.780 -22.161 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.831 9.271 -21.283 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.434 9.585 -20.914 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.585 8.839 -22.493 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.864 10.861 -22.661 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.364 11.221 -23.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.220 12.872 -21.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.431 12.472 -21.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.630 11.765 -20.590 1.00 0.00 H new ATOM 375 N TYR A 53 -3.199 6.495 -24.673 1.00 0.00 N ATOM 376 CA TYR A 53 -3.438 5.681 -25.890 1.00 0.00 C ATOM 377 C TYR A 53 -4.715 4.838 -25.724 1.00 0.00 C ATOM 378 O TYR A 53 -5.235 4.300 -26.682 1.00 0.00 O ATOM 379 CB TYR A 53 -2.247 4.738 -26.095 1.00 0.00 C ATOM 380 CG TYR A 53 -0.959 5.514 -26.308 1.00 0.00 C ATOM 381 CD1 TYR A 53 -0.424 6.298 -25.276 1.00 0.00 C ATOM 382 CD2 TYR A 53 -0.282 5.424 -27.530 1.00 0.00 C ATOM 383 CE1 TYR A 53 0.775 6.990 -25.463 1.00 0.00 C ATOM 384 CE2 TYR A 53 0.923 6.116 -27.716 1.00 0.00 C ATOM 385 CZ TYR A 53 1.451 6.899 -26.680 1.00 0.00 C ATOM 386 OH TYR A 53 2.637 7.580 -26.863 1.00 0.00 O ATOM 0 H TYR A 53 -2.811 5.980 -23.883 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.555 6.344 -26.747 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.142 4.087 -25.227 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.433 4.095 -26.955 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -0.942 6.367 -24.331 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.688 4.822 -28.329 1.00 0.00 H new ATOM 0 HE1 TYR A 53 1.179 7.596 -24.665 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.445 6.046 -28.659 1.00 0.00 H new ATOM 0 HH TYR A 53 2.977 7.408 -27.766 1.00 0.00 H new ATOM 396 N VAL A 54 -5.216 4.699 -24.513 1.00 0.00 N ATOM 397 CA VAL A 54 -6.448 3.869 -24.285 1.00 0.00 C ATOM 398 C VAL A 54 -7.189 4.434 -23.050 1.00 0.00 C ATOM 399 O VAL A 54 -7.295 5.634 -22.904 1.00 0.00 O ATOM 400 CB VAL A 54 -6.064 2.383 -24.070 1.00 0.00 C ATOM 401 CG1 VAL A 54 -7.260 1.497 -24.425 1.00 0.00 C ATOM 402 CG2 VAL A 54 -4.881 1.981 -24.961 1.00 0.00 C ATOM 0 H VAL A 54 -4.824 5.125 -23.673 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.101 3.915 -25.156 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.780 2.254 -23.026 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.995 0.450 -24.275 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -8.105 1.752 -23.785 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.534 1.656 -25.468 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.635 0.933 -24.788 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.149 2.123 -26.008 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.017 2.601 -24.721 1.00 0.00 H new ATOM 412 N GLN A 55 -7.709 3.605 -22.161 1.00 0.00 N ATOM 413 CA GLN A 55 -8.422 4.146 -20.965 1.00 0.00 C ATOM 414 C GLN A 55 -8.691 3.016 -19.969 1.00 0.00 C ATOM 415 O GLN A 55 -9.542 2.174 -20.181 1.00 0.00 O ATOM 416 CB GLN A 55 -9.745 4.782 -21.404 1.00 0.00 C ATOM 417 CG GLN A 55 -9.760 6.266 -21.028 1.00 0.00 C ATOM 418 CD GLN A 55 -11.125 6.868 -21.366 1.00 0.00 C ATOM 419 OE1 GLN A 55 -11.595 6.748 -22.480 1.00 0.00 O ATOM 420 NE2 GLN A 55 -11.787 7.512 -20.445 1.00 0.00 N ATOM 0 H GLN A 55 -7.667 2.588 -22.219 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.802 4.902 -20.484 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.873 4.669 -22.481 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.581 4.269 -20.928 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.553 6.384 -19.964 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -8.974 6.796 -21.567 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -11.393 7.613 -19.510 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.699 7.915 -20.660 1.00 0.00 H new ATOM 429 N ILE A 56 -7.966 3.002 -18.885 1.00 0.00 N ATOM 430 CA ILE A 56 -8.155 1.941 -17.851 1.00 0.00 C ATOM 431 C ILE A 56 -8.032 2.564 -16.462 1.00 0.00 C ATOM 432 O ILE A 56 -7.591 3.688 -16.314 1.00 0.00 O ATOM 433 CB ILE A 56 -7.093 0.844 -18.009 1.00 0.00 C ATOM 434 CG1 ILE A 56 -5.734 1.468 -18.364 1.00 0.00 C ATOM 435 CG2 ILE A 56 -7.517 -0.123 -19.114 1.00 0.00 C ATOM 436 CD1 ILE A 56 -4.623 0.753 -17.593 1.00 0.00 C ATOM 0 H ILE A 56 -7.242 3.687 -18.668 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.143 1.497 -17.976 1.00 0.00 H new ATOM 0 HB ILE A 56 -6.999 0.304 -17.067 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.555 1.389 -19.436 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -5.735 2.530 -18.119 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.762 -0.902 -19.225 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -8.472 -0.578 -18.852 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.619 0.420 -20.053 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.660 1.197 -17.846 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -4.799 0.855 -16.522 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.617 -0.304 -17.860 1.00 0.00 H new ATOM 448 N ASP A 57 -8.410 1.837 -15.445 1.00 0.00 N ATOM 449 CA ASP A 57 -8.312 2.373 -14.058 1.00 0.00 C ATOM 450 C ASP A 57 -7.133 1.695 -13.347 1.00 0.00 C ATOM 451 O ASP A 57 -6.646 0.684 -13.812 1.00 0.00 O ATOM 452 CB ASP A 57 -9.607 2.067 -13.303 1.00 0.00 C ATOM 453 CG ASP A 57 -10.614 3.194 -13.536 1.00 0.00 C ATOM 454 OD1 ASP A 57 -10.364 4.293 -13.067 1.00 0.00 O ATOM 455 OD2 ASP A 57 -11.618 2.941 -14.182 1.00 0.00 O ATOM 0 H ASP A 57 -8.784 0.891 -15.516 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.157 3.452 -14.086 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.022 1.118 -13.643 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.403 1.962 -12.237 1.00 0.00 H new ATOM 460 N PRO A 58 -6.701 2.253 -12.233 1.00 0.00 N ATOM 461 CA PRO A 58 -5.564 1.691 -11.439 1.00 0.00 C ATOM 462 C PRO A 58 -6.019 0.432 -10.709 1.00 0.00 C ATOM 463 O PRO A 58 -5.243 -0.479 -10.487 1.00 0.00 O ATOM 464 CB PRO A 58 -5.197 2.810 -10.475 1.00 0.00 C ATOM 465 CG PRO A 58 -6.428 3.682 -10.327 1.00 0.00 C ATOM 466 CD PRO A 58 -7.266 3.499 -11.593 1.00 0.00 C ATOM 0 HA PRO A 58 -4.710 1.393 -12.047 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -4.892 2.405 -9.510 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -4.357 3.389 -10.857 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -6.998 3.396 -9.443 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.146 4.727 -10.200 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.324 3.381 -11.357 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -7.181 4.361 -12.255 1.00 0.00 H new ATOM 474 N GLU A 59 -7.280 0.358 -10.373 1.00 0.00 N ATOM 475 CA GLU A 59 -7.801 -0.862 -9.701 1.00 0.00 C ATOM 476 C GLU A 59 -7.722 -2.044 -10.681 1.00 0.00 C ATOM 477 O GLU A 59 -7.816 -3.190 -10.285 1.00 0.00 O ATOM 478 CB GLU A 59 -9.257 -0.636 -9.286 1.00 0.00 C ATOM 479 CG GLU A 59 -9.299 0.214 -8.015 1.00 0.00 C ATOM 480 CD GLU A 59 -10.683 0.101 -7.371 1.00 0.00 C ATOM 481 OE1 GLU A 59 -11.654 0.398 -8.047 1.00 0.00 O ATOM 482 OE2 GLU A 59 -10.746 -0.278 -6.214 1.00 0.00 O ATOM 0 H GLU A 59 -7.970 1.092 -10.536 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.205 -1.078 -8.814 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.802 -0.137 -10.088 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.750 -1.593 -9.113 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.532 -0.120 -7.316 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.081 1.255 -8.254 1.00 0.00 H new ATOM 489 N MET A 60 -7.544 -1.775 -11.961 1.00 0.00 N ATOM 490 CA MET A 60 -7.454 -2.875 -12.960 1.00 0.00 C ATOM 491 C MET A 60 -5.982 -3.230 -13.229 1.00 0.00 C ATOM 492 O MET A 60 -5.687 -4.028 -14.099 1.00 0.00 O ATOM 493 CB MET A 60 -8.111 -2.413 -14.265 1.00 0.00 C ATOM 494 CG MET A 60 -9.639 -2.547 -14.158 1.00 0.00 C ATOM 495 SD MET A 60 -10.238 -3.825 -15.297 1.00 0.00 S ATOM 496 CE MET A 60 -10.039 -2.875 -16.825 1.00 0.00 C ATOM 0 H MET A 60 -7.458 -0.835 -12.348 1.00 0.00 H new ATOM 0 HA MET A 60 -7.964 -3.757 -12.573 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.842 -1.377 -14.471 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.742 -3.010 -15.099 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.918 -2.801 -13.136 1.00 0.00 H new ATOM 0 HG3 MET A 60 -10.112 -1.593 -14.390 1.00 0.00 H new ATOM 0 HE1 MET A 60 -9.971 -3.558 -17.672 1.00 0.00 H new ATOM 0 HE2 MET A 60 -10.897 -2.216 -16.958 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.129 -2.278 -16.766 1.00 0.00 H new ATOM 506 N VAL A 61 -5.054 -2.647 -12.499 1.00 0.00 N ATOM 507 CA VAL A 61 -3.613 -2.960 -12.730 1.00 0.00 C ATOM 508 C VAL A 61 -2.974 -3.446 -11.424 1.00 0.00 C ATOM 509 O VAL A 61 -2.987 -2.753 -10.423 1.00 0.00 O ATOM 510 CB VAL A 61 -2.894 -1.698 -13.216 1.00 0.00 C ATOM 511 CG1 VAL A 61 -1.444 -2.033 -13.575 1.00 0.00 C ATOM 512 CG2 VAL A 61 -3.611 -1.150 -14.454 1.00 0.00 C ATOM 0 H VAL A 61 -5.237 -1.971 -11.757 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.526 -3.743 -13.483 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.905 -0.950 -12.424 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.937 -1.132 -13.920 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -0.932 -2.423 -12.695 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.429 -2.783 -14.366 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.101 -0.252 -14.802 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.600 -1.902 -15.243 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.642 -0.906 -14.199 1.00 0.00 H new ATOM 522 N THR A 62 -2.417 -4.633 -11.428 1.00 0.00 N ATOM 523 CA THR A 62 -1.777 -5.171 -10.196 1.00 0.00 C ATOM 524 C THR A 62 -0.289 -4.813 -10.192 1.00 0.00 C ATOM 525 O THR A 62 0.288 -4.513 -11.220 1.00 0.00 O ATOM 526 CB THR A 62 -1.929 -6.695 -10.159 1.00 0.00 C ATOM 527 OG1 THR A 62 -3.224 -7.050 -10.625 1.00 0.00 O ATOM 528 CG2 THR A 62 -1.750 -7.191 -8.723 1.00 0.00 C ATOM 0 H THR A 62 -2.380 -5.252 -12.238 1.00 0.00 H new ATOM 0 HA THR A 62 -2.261 -4.735 -9.322 1.00 0.00 H new ATOM 0 HB THR A 62 -1.173 -7.153 -10.797 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.323 -8.025 -10.604 1.00 0.00 H new ATOM 0 HG21 THR A 62 -1.858 -8.275 -8.696 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.758 -6.916 -8.364 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.506 -6.735 -8.084 1.00 0.00 H new ATOM 536 N VAL A 63 0.332 -4.845 -9.041 1.00 0.00 N ATOM 537 CA VAL A 63 1.783 -4.511 -8.957 1.00 0.00 C ATOM 538 C VAL A 63 2.443 -5.400 -7.906 1.00 0.00 C ATOM 539 O VAL A 63 2.243 -5.219 -6.719 1.00 0.00 O ATOM 540 CB VAL A 63 1.943 -3.049 -8.552 1.00 0.00 C ATOM 541 CG1 VAL A 63 3.421 -2.657 -8.611 1.00 0.00 C ATOM 542 CG2 VAL A 63 1.146 -2.168 -9.511 1.00 0.00 C ATOM 0 H VAL A 63 -0.106 -5.089 -8.153 1.00 0.00 H new ATOM 0 HA VAL A 63 2.254 -4.675 -9.926 1.00 0.00 H new ATOM 0 HB VAL A 63 1.573 -2.913 -7.536 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.532 -1.612 -8.321 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.992 -3.286 -7.928 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.793 -2.793 -9.626 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.259 -1.123 -9.224 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.517 -2.307 -10.526 1.00 0.00 H new ATOM 0 HG23 VAL A 63 0.092 -2.444 -9.469 1.00 0.00 H new ATOM 552 N GLN A 64 3.227 -6.358 -8.330 1.00 0.00 N ATOM 553 CA GLN A 64 3.900 -7.258 -7.352 1.00 0.00 C ATOM 554 C GLN A 64 5.419 -7.112 -7.480 1.00 0.00 C ATOM 555 O GLN A 64 5.973 -7.224 -8.557 1.00 0.00 O ATOM 556 CB GLN A 64 3.490 -8.712 -7.621 1.00 0.00 C ATOM 557 CG GLN A 64 3.693 -9.052 -9.104 1.00 0.00 C ATOM 558 CD GLN A 64 2.341 -9.053 -9.821 1.00 0.00 C ATOM 559 OE1 GLN A 64 1.577 -8.115 -9.703 1.00 0.00 O ATOM 560 NE2 GLN A 64 2.010 -10.073 -10.565 1.00 0.00 N ATOM 0 H GLN A 64 3.429 -6.554 -9.310 1.00 0.00 H new ATOM 0 HA GLN A 64 3.598 -6.984 -6.341 1.00 0.00 H new ATOM 0 HB2 GLN A 64 4.082 -9.385 -7.001 1.00 0.00 H new ATOM 0 HB3 GLN A 64 2.446 -8.860 -7.346 1.00 0.00 H new ATOM 0 HG2 GLN A 64 4.360 -8.325 -9.566 1.00 0.00 H new ATOM 0 HG3 GLN A 64 4.168 -10.028 -9.202 1.00 0.00 H new ATOM 0 HE21 GLN A 64 2.650 -10.861 -10.665 1.00 0.00 H new ATOM 0 HE22 GLN A 64 1.111 -10.082 -11.047 1.00 0.00 H new ATOM 569 N LEU A 65 6.096 -6.850 -6.390 1.00 0.00 N ATOM 570 CA LEU A 65 7.572 -6.684 -6.445 1.00 0.00 C ATOM 571 C LEU A 65 8.268 -7.931 -5.898 1.00 0.00 C ATOM 572 O LEU A 65 8.075 -8.319 -4.761 1.00 0.00 O ATOM 573 CB LEU A 65 7.973 -5.468 -5.614 1.00 0.00 C ATOM 574 CG LEU A 65 7.415 -5.591 -4.184 1.00 0.00 C ATOM 575 CD1 LEU A 65 8.561 -5.485 -3.173 1.00 0.00 C ATOM 576 CD2 LEU A 65 6.409 -4.468 -3.927 1.00 0.00 C ATOM 0 H LEU A 65 5.684 -6.744 -5.463 1.00 0.00 H new ATOM 0 HA LEU A 65 7.876 -6.540 -7.482 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.059 -5.383 -5.582 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.596 -4.559 -6.082 1.00 0.00 H new ATOM 0 HG LEU A 65 6.920 -6.556 -4.074 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.163 -5.572 -2.162 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.279 -6.286 -3.351 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.058 -4.521 -3.286 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.015 -4.557 -2.914 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.904 -3.503 -4.041 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.590 -4.542 -4.643 1.00 0.00 H new ATOM 588 N GLU A 66 9.089 -8.552 -6.704 1.00 0.00 N ATOM 589 CA GLU A 66 9.823 -9.766 -6.250 1.00 0.00 C ATOM 590 C GLU A 66 11.306 -9.418 -6.118 1.00 0.00 C ATOM 591 O GLU A 66 11.716 -8.315 -6.424 1.00 0.00 O ATOM 592 CB GLU A 66 9.643 -10.894 -7.277 1.00 0.00 C ATOM 593 CG GLU A 66 8.255 -11.527 -7.141 1.00 0.00 C ATOM 594 CD GLU A 66 8.070 -12.103 -5.734 1.00 0.00 C ATOM 595 OE1 GLU A 66 8.833 -12.983 -5.369 1.00 0.00 O ATOM 596 OE2 GLU A 66 7.168 -11.654 -5.044 1.00 0.00 O ATOM 0 H GLU A 66 9.283 -8.267 -7.664 1.00 0.00 H new ATOM 0 HA GLU A 66 9.433 -10.100 -5.289 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.772 -10.500 -8.285 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.411 -11.653 -7.131 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.486 -10.780 -7.340 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.133 -12.316 -7.883 1.00 0.00 H new ATOM 603 N GLN A 67 12.112 -10.340 -5.661 1.00 0.00 N ATOM 604 CA GLN A 67 13.571 -10.056 -5.507 1.00 0.00 C ATOM 605 C GLN A 67 14.370 -11.346 -5.704 1.00 0.00 C ATOM 606 O GLN A 67 13.882 -12.431 -5.450 1.00 0.00 O ATOM 607 CB GLN A 67 13.841 -9.508 -4.101 1.00 0.00 C ATOM 608 CG GLN A 67 13.456 -8.024 -4.031 1.00 0.00 C ATOM 609 CD GLN A 67 12.151 -7.865 -3.244 1.00 0.00 C ATOM 610 OE1 GLN A 67 11.170 -8.522 -3.531 1.00 0.00 O ATOM 611 NE2 GLN A 67 12.100 -7.014 -2.256 1.00 0.00 N ATOM 0 H GLN A 67 11.823 -11.279 -5.387 1.00 0.00 H new ATOM 0 HA GLN A 67 13.874 -9.321 -6.253 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.270 -10.075 -3.365 1.00 0.00 H new ATOM 0 HB3 GLN A 67 14.895 -9.631 -3.850 1.00 0.00 H new ATOM 0 HG2 GLN A 67 14.252 -7.454 -3.552 1.00 0.00 H new ATOM 0 HG3 GLN A 67 13.337 -7.622 -5.037 1.00 0.00 H new ATOM 0 HE21 GLN A 67 12.923 -6.462 -2.015 1.00 0.00 H new ATOM 0 HE22 GLN A 67 11.237 -6.900 -1.725 1.00 0.00 H new ATOM 620 N LYS A 68 15.597 -11.232 -6.148 1.00 0.00 N ATOM 621 CA LYS A 68 16.439 -12.449 -6.355 1.00 0.00 C ATOM 622 C LYS A 68 17.517 -12.513 -5.272 1.00 0.00 C ATOM 623 O LYS A 68 17.731 -11.565 -4.541 1.00 0.00 O ATOM 624 CB LYS A 68 17.106 -12.391 -7.730 1.00 0.00 C ATOM 625 CG LYS A 68 16.082 -12.730 -8.824 1.00 0.00 C ATOM 626 CD LYS A 68 16.195 -11.723 -9.974 1.00 0.00 C ATOM 627 CE LYS A 68 17.575 -11.833 -10.626 1.00 0.00 C ATOM 628 NZ LYS A 68 17.642 -13.081 -11.438 1.00 0.00 N ATOM 0 H LYS A 68 16.052 -10.348 -6.376 1.00 0.00 H new ATOM 0 HA LYS A 68 15.807 -13.335 -6.298 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.519 -11.397 -7.902 1.00 0.00 H new ATOM 0 HB3 LYS A 68 17.939 -13.093 -7.769 1.00 0.00 H new ATOM 0 HG2 LYS A 68 16.254 -13.740 -9.195 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.074 -12.710 -8.410 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.417 -11.913 -10.714 1.00 0.00 H new ATOM 0 HD3 LYS A 68 16.039 -10.711 -9.600 1.00 0.00 H new ATOM 0 HE2 LYS A 68 17.761 -10.965 -11.258 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.351 -11.842 -9.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.482 -13.052 -12.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.704 -13.904 -10.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.787 -13.159 -12.025 1.00 0.00 H new ATOM 642 N ASP A 69 18.196 -13.628 -5.165 1.00 0.00 N ATOM 643 CA ASP A 69 19.261 -13.767 -4.132 1.00 0.00 C ATOM 644 C ASP A 69 20.512 -12.968 -4.531 1.00 0.00 C ATOM 645 O ASP A 69 21.451 -12.866 -3.764 1.00 0.00 O ATOM 646 CB ASP A 69 19.633 -15.245 -3.987 1.00 0.00 C ATOM 647 CG ASP A 69 18.379 -16.055 -3.655 1.00 0.00 C ATOM 648 OD1 ASP A 69 17.551 -15.552 -2.915 1.00 0.00 O ATOM 649 OD2 ASP A 69 18.269 -17.166 -4.147 1.00 0.00 O ATOM 0 H ASP A 69 18.056 -14.450 -5.753 1.00 0.00 H new ATOM 0 HA ASP A 69 18.884 -13.379 -3.186 1.00 0.00 H new ATOM 0 HB2 ASP A 69 20.081 -15.611 -4.911 1.00 0.00 H new ATOM 0 HB3 ASP A 69 20.378 -15.368 -3.201 1.00 0.00 H new ATOM 654 N GLY A 70 20.542 -12.405 -5.719 1.00 0.00 N ATOM 655 CA GLY A 70 21.740 -11.623 -6.150 1.00 0.00 C ATOM 656 C GLY A 70 21.506 -10.130 -5.906 1.00 0.00 C ATOM 657 O GLY A 70 22.006 -9.291 -6.630 1.00 0.00 O ATOM 0 H GLY A 70 19.788 -12.455 -6.405 1.00 0.00 H new ATOM 0 HA2 GLY A 70 22.620 -11.956 -5.599 1.00 0.00 H new ATOM 0 HA3 GLY A 70 21.939 -11.800 -7.207 1.00 0.00 H new ATOM 661 N ASP A 71 20.741 -9.796 -4.895 1.00 0.00 N ATOM 662 CA ASP A 71 20.460 -8.358 -4.591 1.00 0.00 C ATOM 663 C ASP A 71 19.784 -7.707 -5.798 1.00 0.00 C ATOM 664 O ASP A 71 20.182 -6.651 -6.257 1.00 0.00 O ATOM 665 CB ASP A 71 21.770 -7.631 -4.269 1.00 0.00 C ATOM 666 CG ASP A 71 22.170 -7.918 -2.821 1.00 0.00 C ATOM 667 OD1 ASP A 71 21.381 -7.619 -1.939 1.00 0.00 O ATOM 668 OD2 ASP A 71 23.259 -8.431 -2.618 1.00 0.00 O ATOM 0 H ASP A 71 20.297 -10.462 -4.264 1.00 0.00 H new ATOM 0 HA ASP A 71 19.798 -8.291 -3.728 1.00 0.00 H new ATOM 0 HB2 ASP A 71 22.557 -7.960 -4.947 1.00 0.00 H new ATOM 0 HB3 ASP A 71 21.649 -6.558 -4.418 1.00 0.00 H new ATOM 673 N ILE A 72 18.772 -8.344 -6.319 1.00 0.00 N ATOM 674 CA ILE A 72 18.062 -7.793 -7.507 1.00 0.00 C ATOM 675 C ILE A 72 16.561 -7.725 -7.216 1.00 0.00 C ATOM 676 O ILE A 72 16.052 -8.444 -6.376 1.00 0.00 O ATOM 677 CB ILE A 72 18.321 -8.700 -8.713 1.00 0.00 C ATOM 678 CG1 ILE A 72 19.832 -9.011 -8.797 1.00 0.00 C ATOM 679 CG2 ILE A 72 17.844 -7.988 -9.983 1.00 0.00 C ATOM 680 CD1 ILE A 72 20.180 -9.739 -10.103 1.00 0.00 C ATOM 0 H ILE A 72 18.404 -9.229 -5.970 1.00 0.00 H new ATOM 0 HA ILE A 72 18.428 -6.790 -7.726 1.00 0.00 H new ATOM 0 HB ILE A 72 17.776 -9.638 -8.608 1.00 0.00 H new ATOM 0 HG12 ILE A 72 20.401 -8.083 -8.733 1.00 0.00 H new ATOM 0 HG13 ILE A 72 20.127 -9.625 -7.946 1.00 0.00 H new ATOM 0 HG21 ILE A 72 18.024 -8.627 -10.848 1.00 0.00 H new ATOM 0 HG22 ILE A 72 16.777 -7.778 -9.903 1.00 0.00 H new ATOM 0 HG23 ILE A 72 18.390 -7.052 -10.103 1.00 0.00 H new ATOM 0 HD11 ILE A 72 21.250 -9.943 -10.132 1.00 0.00 H new ATOM 0 HD12 ILE A 72 19.630 -10.678 -10.154 1.00 0.00 H new ATOM 0 HD13 ILE A 72 19.908 -9.113 -10.952 1.00 0.00 H new ATOM 692 N SER A 73 15.851 -6.864 -7.903 1.00 0.00 N ATOM 693 CA SER A 73 14.382 -6.743 -7.669 1.00 0.00 C ATOM 694 C SER A 73 13.633 -7.143 -8.938 1.00 0.00 C ATOM 695 O SER A 73 14.206 -7.228 -10.007 1.00 0.00 O ATOM 696 CB SER A 73 14.039 -5.300 -7.304 1.00 0.00 C ATOM 697 OG SER A 73 15.030 -4.789 -6.423 1.00 0.00 O ATOM 0 H SER A 73 16.228 -6.240 -8.616 1.00 0.00 H new ATOM 0 HA SER A 73 14.088 -7.400 -6.851 1.00 0.00 H new ATOM 0 HB2 SER A 73 13.986 -4.688 -8.204 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.058 -5.256 -6.831 1.00 0.00 H new ATOM 0 HG SER A 73 14.813 -3.862 -6.189 1.00 0.00 H new ATOM 703 N ILE A 74 12.358 -7.407 -8.821 1.00 0.00 N ATOM 704 CA ILE A 74 11.556 -7.826 -10.005 1.00 0.00 C ATOM 705 C ILE A 74 10.117 -7.306 -9.853 1.00 0.00 C ATOM 706 O ILE A 74 9.264 -7.983 -9.313 1.00 0.00 O ATOM 707 CB ILE A 74 11.560 -9.363 -10.071 1.00 0.00 C ATOM 708 CG1 ILE A 74 12.994 -9.856 -10.331 1.00 0.00 C ATOM 709 CG2 ILE A 74 10.621 -9.857 -11.184 1.00 0.00 C ATOM 710 CD1 ILE A 74 13.024 -11.388 -10.436 1.00 0.00 C ATOM 0 H ILE A 74 11.835 -7.349 -7.947 1.00 0.00 H new ATOM 0 HA ILE A 74 11.982 -7.417 -10.921 1.00 0.00 H new ATOM 0 HB ILE A 74 11.204 -9.762 -9.121 1.00 0.00 H new ATOM 0 HG12 ILE A 74 13.375 -9.415 -11.252 1.00 0.00 H new ATOM 0 HG13 ILE A 74 13.650 -9.528 -9.525 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.636 -10.946 -11.216 1.00 0.00 H new ATOM 0 HG22 ILE A 74 9.606 -9.514 -10.983 1.00 0.00 H new ATOM 0 HG23 ILE A 74 10.954 -9.461 -12.143 1.00 0.00 H new ATOM 0 HD11 ILE A 74 14.046 -11.720 -10.620 1.00 0.00 H new ATOM 0 HD12 ILE A 74 12.663 -11.824 -9.504 1.00 0.00 H new ATOM 0 HD13 ILE A 74 12.385 -11.709 -11.258 1.00 0.00 H new ATOM 722 N LEU A 75 9.845 -6.115 -10.329 1.00 0.00 N ATOM 723 CA LEU A 75 8.468 -5.559 -10.214 1.00 0.00 C ATOM 724 C LEU A 75 7.617 -6.027 -11.396 1.00 0.00 C ATOM 725 O LEU A 75 7.838 -5.638 -12.527 1.00 0.00 O ATOM 726 CB LEU A 75 8.527 -4.030 -10.192 1.00 0.00 C ATOM 727 CG LEU A 75 7.128 -3.467 -9.925 1.00 0.00 C ATOM 728 CD1 LEU A 75 7.234 -2.215 -9.052 1.00 0.00 C ATOM 729 CD2 LEU A 75 6.460 -3.106 -11.256 1.00 0.00 C ATOM 0 H LEU A 75 10.520 -5.506 -10.792 1.00 0.00 H new ATOM 0 HA LEU A 75 8.017 -5.914 -9.287 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.219 -3.694 -9.420 1.00 0.00 H new ATOM 0 HB3 LEU A 75 8.905 -3.657 -11.144 1.00 0.00 H new ATOM 0 HG LEU A 75 6.530 -4.218 -9.408 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.237 -1.817 -8.864 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.707 -2.471 -8.104 1.00 0.00 H new ATOM 0 HD13 LEU A 75 7.834 -1.463 -9.565 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.464 -2.705 -11.066 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.060 -2.357 -11.773 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.380 -3.998 -11.877 1.00 0.00 H new ATOM 741 N GLU A 76 6.641 -6.859 -11.135 1.00 0.00 N ATOM 742 CA GLU A 76 5.758 -7.364 -12.228 1.00 0.00 C ATOM 743 C GLU A 76 4.380 -6.716 -12.092 1.00 0.00 C ATOM 744 O GLU A 76 3.606 -7.075 -11.226 1.00 0.00 O ATOM 745 CB GLU A 76 5.609 -8.888 -12.116 1.00 0.00 C ATOM 746 CG GLU A 76 6.983 -9.542 -11.942 1.00 0.00 C ATOM 747 CD GLU A 76 6.802 -10.990 -11.487 1.00 0.00 C ATOM 748 OE1 GLU A 76 5.861 -11.620 -11.940 1.00 0.00 O ATOM 749 OE2 GLU A 76 7.608 -11.445 -10.691 1.00 0.00 O ATOM 0 H GLU A 76 6.417 -7.212 -10.205 1.00 0.00 H new ATOM 0 HA GLU A 76 6.198 -7.115 -13.194 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.970 -9.137 -11.269 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.122 -9.280 -13.009 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.535 -9.511 -12.882 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.571 -8.990 -11.209 1.00 0.00 H new ATOM 756 N LEU A 77 4.061 -5.762 -12.931 1.00 0.00 N ATOM 757 CA LEU A 77 2.727 -5.102 -12.823 1.00 0.00 C ATOM 758 C LEU A 77 1.749 -5.733 -13.818 1.00 0.00 C ATOM 759 O LEU A 77 2.025 -5.857 -14.996 1.00 0.00 O ATOM 760 CB LEU A 77 2.859 -3.592 -13.082 1.00 0.00 C ATOM 761 CG LEU A 77 3.343 -3.325 -14.521 1.00 0.00 C ATOM 762 CD1 LEU A 77 2.294 -2.497 -15.271 1.00 0.00 C ATOM 763 CD2 LEU A 77 4.666 -2.551 -14.486 1.00 0.00 C ATOM 0 H LEU A 77 4.662 -5.415 -13.679 1.00 0.00 H new ATOM 0 HA LEU A 77 2.341 -5.247 -11.814 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.897 -3.105 -12.921 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.560 -3.156 -12.371 1.00 0.00 H new ATOM 0 HG LEU A 77 3.491 -4.277 -15.031 1.00 0.00 H new ATOM 0 HD11 LEU A 77 2.638 -2.309 -16.288 1.00 0.00 H new ATOM 0 HD12 LEU A 77 1.352 -3.045 -15.302 1.00 0.00 H new ATOM 0 HD13 LEU A 77 2.145 -1.547 -14.757 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.005 -2.364 -15.505 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.518 -1.601 -13.973 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.416 -3.137 -13.956 1.00 0.00 H new ATOM 775 N ASN A 78 0.601 -6.133 -13.341 1.00 0.00 N ATOM 776 CA ASN A 78 -0.415 -6.749 -14.228 1.00 0.00 C ATOM 777 C ASN A 78 -1.302 -5.648 -14.786 1.00 0.00 C ATOM 778 O ASN A 78 -1.645 -4.715 -14.086 1.00 0.00 O ATOM 779 CB ASN A 78 -1.271 -7.701 -13.410 1.00 0.00 C ATOM 780 CG ASN A 78 -0.375 -8.728 -12.718 1.00 0.00 C ATOM 781 OD1 ASN A 78 0.468 -8.375 -11.917 1.00 0.00 O ATOM 782 ND2 ASN A 78 -0.523 -9.992 -12.996 1.00 0.00 N ATOM 0 H ASN A 78 0.325 -6.056 -12.362 1.00 0.00 H new ATOM 0 HA ASN A 78 0.072 -7.290 -15.039 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -1.844 -7.145 -12.668 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -1.990 -8.206 -14.055 1.00 0.00 H new ATOM 0 HD21 ASN A 78 0.069 -10.687 -12.541 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -1.231 -10.287 -13.668 1.00 0.00 H new ATOM 789 N VAL A 79 -1.675 -5.740 -16.030 1.00 0.00 N ATOM 790 CA VAL A 79 -2.543 -4.685 -16.624 1.00 0.00 C ATOM 791 C VAL A 79 -3.812 -5.319 -17.194 1.00 0.00 C ATOM 792 O VAL A 79 -3.855 -5.726 -18.340 1.00 0.00 O ATOM 793 CB VAL A 79 -1.783 -3.960 -17.732 1.00 0.00 C ATOM 794 CG1 VAL A 79 -2.585 -2.735 -18.167 1.00 0.00 C ATOM 795 CG2 VAL A 79 -0.415 -3.514 -17.203 1.00 0.00 C ATOM 0 H VAL A 79 -1.418 -6.498 -16.662 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.820 -3.969 -15.850 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.642 -4.628 -18.582 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -2.049 -2.211 -18.958 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.560 -3.051 -18.537 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.719 -2.067 -17.316 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.129 -2.996 -17.993 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.554 -2.841 -16.357 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.154 -4.387 -16.883 1.00 0.00 H new ATOM 805 N THR A 80 -4.848 -5.398 -16.397 1.00 0.00 N ATOM 806 CA THR A 80 -6.126 -5.998 -16.877 1.00 0.00 C ATOM 807 C THR A 80 -6.879 -4.968 -17.721 1.00 0.00 C ATOM 808 O THR A 80 -7.667 -4.195 -17.211 1.00 0.00 O ATOM 809 CB THR A 80 -6.985 -6.402 -15.673 1.00 0.00 C ATOM 810 OG1 THR A 80 -6.249 -7.296 -14.849 1.00 0.00 O ATOM 811 CG2 THR A 80 -8.266 -7.089 -16.157 1.00 0.00 C ATOM 0 H THR A 80 -4.862 -5.071 -15.431 1.00 0.00 H new ATOM 0 HA THR A 80 -5.914 -6.880 -17.481 1.00 0.00 H new ATOM 0 HB THR A 80 -7.250 -5.512 -15.103 1.00 0.00 H new ATOM 0 HG1 THR A 80 -6.795 -7.555 -14.077 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.873 -7.374 -15.298 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.831 -6.403 -16.788 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.007 -7.979 -16.730 1.00 0.00 H new ATOM 819 N LEU A 81 -6.643 -4.955 -19.008 1.00 0.00 N ATOM 820 CA LEU A 81 -7.339 -3.982 -19.891 1.00 0.00 C ATOM 821 C LEU A 81 -8.732 -4.531 -20.250 1.00 0.00 C ATOM 822 O LEU A 81 -8.865 -5.711 -20.501 1.00 0.00 O ATOM 823 CB LEU A 81 -6.519 -3.799 -21.166 1.00 0.00 C ATOM 824 CG LEU A 81 -5.108 -3.335 -20.803 1.00 0.00 C ATOM 825 CD1 LEU A 81 -4.159 -3.619 -21.969 1.00 0.00 C ATOM 826 CD2 LEU A 81 -5.126 -1.832 -20.517 1.00 0.00 C ATOM 0 H LEU A 81 -5.994 -5.581 -19.484 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.447 -3.025 -19.381 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.474 -4.737 -21.720 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -6.998 -3.067 -21.817 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.766 -3.872 -19.918 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.154 -3.288 -21.709 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.146 -4.689 -22.175 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.500 -3.083 -22.855 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.121 -1.499 -20.258 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.469 -1.297 -21.403 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -5.801 -1.628 -19.686 1.00 0.00 H new ATOM 838 N PRO A 82 -9.738 -3.673 -20.268 1.00 0.00 N ATOM 839 CA PRO A 82 -11.144 -4.069 -20.598 1.00 0.00 C ATOM 840 C PRO A 82 -11.348 -4.109 -22.114 1.00 0.00 C ATOM 841 O PRO A 82 -10.430 -3.881 -22.879 1.00 0.00 O ATOM 842 CB PRO A 82 -11.982 -2.970 -19.962 1.00 0.00 C ATOM 843 CG PRO A 82 -11.098 -1.742 -19.839 1.00 0.00 C ATOM 844 CD PRO A 82 -9.644 -2.198 -19.973 1.00 0.00 C ATOM 0 HA PRO A 82 -11.407 -5.062 -20.234 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.858 -2.753 -20.573 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.345 -3.282 -18.983 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.343 -1.015 -20.613 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.258 -1.251 -18.879 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -9.133 -1.665 -20.774 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -9.083 -2.011 -19.057 1.00 0.00 H new ATOM 976 N SER B 32 2.171 -10.818 -31.255 1.00 0.00 N ATOM 977 CA SER B 32 0.722 -10.731 -30.909 1.00 0.00 C ATOM 978 C SER B 32 0.379 -9.321 -30.412 1.00 0.00 C ATOM 979 O SER B 32 -0.773 -8.929 -30.404 1.00 0.00 O ATOM 980 CB SER B 32 0.397 -11.743 -29.813 1.00 0.00 C ATOM 981 OG SER B 32 1.102 -12.952 -30.065 1.00 0.00 O ATOM 0 HA SER B 32 0.134 -10.949 -31.800 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.676 -11.343 -28.838 1.00 0.00 H new ATOM 0 HB3 SER B 32 -0.676 -11.933 -29.785 1.00 0.00 H new ATOM 0 HG SER B 32 1.929 -12.753 -30.552 1.00 0.00 H new ATOM 987 N ASP B 33 1.363 -8.558 -29.996 1.00 0.00 N ATOM 988 CA ASP B 33 1.085 -7.181 -29.500 1.00 0.00 C ATOM 989 C ASP B 33 1.066 -6.181 -30.665 1.00 0.00 C ATOM 990 O ASP B 33 1.088 -4.986 -30.451 1.00 0.00 O ATOM 991 CB ASP B 33 2.162 -6.766 -28.498 1.00 0.00 C ATOM 992 CG ASP B 33 2.299 -7.838 -27.414 1.00 0.00 C ATOM 993 OD1 ASP B 33 1.584 -7.751 -26.430 1.00 0.00 O ATOM 994 OD2 ASP B 33 3.117 -8.727 -27.588 1.00 0.00 O ATOM 0 H ASP B 33 2.345 -8.834 -29.980 1.00 0.00 H new ATOM 0 HA ASP B 33 0.109 -7.179 -29.015 1.00 0.00 H new ATOM 0 HB2 ASP B 33 3.115 -6.629 -29.010 1.00 0.00 H new ATOM 0 HB3 ASP B 33 1.902 -5.809 -28.046 1.00 0.00 H new ATOM 999 N ALA B 34 1.021 -6.648 -31.891 1.00 0.00 N ATOM 1000 CA ALA B 34 0.988 -5.717 -33.050 1.00 0.00 C ATOM 1001 C ALA B 34 -0.470 -5.389 -33.416 1.00 0.00 C ATOM 1002 O ALA B 34 -0.734 -4.471 -34.167 1.00 0.00 O ATOM 1003 CB ALA B 34 1.679 -6.374 -34.246 1.00 0.00 C ATOM 0 H ALA B 34 1.006 -7.639 -32.133 1.00 0.00 H new ATOM 0 HA ALA B 34 1.506 -4.795 -32.787 1.00 0.00 H new ATOM 0 HB1 ALA B 34 1.657 -5.694 -35.098 1.00 0.00 H new ATOM 0 HB2 ALA B 34 2.714 -6.600 -33.989 1.00 0.00 H new ATOM 0 HB3 ALA B 34 1.160 -7.297 -34.505 1.00 0.00 H new ATOM 1009 N GLU B 35 -1.416 -6.141 -32.898 1.00 0.00 N ATOM 1010 CA GLU B 35 -2.852 -5.888 -33.218 1.00 0.00 C ATOM 1011 C GLU B 35 -3.295 -4.488 -32.738 1.00 0.00 C ATOM 1012 O GLU B 35 -3.977 -3.798 -33.471 1.00 0.00 O ATOM 1013 CB GLU B 35 -3.730 -6.963 -32.559 1.00 0.00 C ATOM 1014 CG GLU B 35 -3.191 -8.363 -32.894 1.00 0.00 C ATOM 1015 CD GLU B 35 -4.106 -9.041 -33.917 1.00 0.00 C ATOM 1016 OE1 GLU B 35 -4.161 -8.565 -35.040 1.00 0.00 O ATOM 1017 OE2 GLU B 35 -4.735 -10.024 -33.561 1.00 0.00 O ATOM 0 H GLU B 35 -1.249 -6.923 -32.264 1.00 0.00 H new ATOM 0 HA GLU B 35 -2.970 -5.930 -34.301 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -3.745 -6.819 -31.479 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -4.758 -6.868 -32.907 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -2.179 -8.287 -33.292 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -3.133 -8.967 -31.988 1.00 0.00 H new ATOM 1024 N PRO B 36 -2.923 -4.087 -31.531 1.00 0.00 N ATOM 1025 CA PRO B 36 -3.307 -2.754 -30.964 1.00 0.00 C ATOM 1026 C PRO B 36 -2.320 -1.664 -31.400 1.00 0.00 C ATOM 1027 O PRO B 36 -2.712 -0.571 -31.760 1.00 0.00 O ATOM 1028 CB PRO B 36 -3.240 -2.980 -29.459 1.00 0.00 C ATOM 1029 CG PRO B 36 -2.290 -4.138 -29.216 1.00 0.00 C ATOM 1030 CD PRO B 36 -2.079 -4.859 -30.549 1.00 0.00 C ATOM 0 HA PRO B 36 -4.286 -2.415 -31.302 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -2.888 -2.082 -28.951 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -4.229 -3.205 -29.060 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -1.340 -3.776 -28.823 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -2.703 -4.821 -28.474 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -1.029 -4.857 -30.840 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.391 -5.902 -30.490 1.00 0.00 H new ATOM 1038 N HIS B 37 -1.037 -1.954 -31.359 1.00 0.00 N ATOM 1039 CA HIS B 37 0.013 -0.953 -31.757 1.00 0.00 C ATOM 1040 C HIS B 37 0.216 0.103 -30.655 1.00 0.00 C ATOM 1041 O HIS B 37 1.072 0.961 -30.774 1.00 0.00 O ATOM 1042 CB HIS B 37 -0.365 -0.256 -33.074 1.00 0.00 C ATOM 1043 CG HIS B 37 0.877 0.012 -33.882 1.00 0.00 C ATOM 1044 ND1 HIS B 37 1.790 0.994 -33.530 1.00 0.00 N ATOM 1045 CD2 HIS B 37 1.371 -0.567 -35.024 1.00 0.00 C ATOM 1046 CE1 HIS B 37 2.777 0.977 -34.445 1.00 0.00 C ATOM 1047 NE2 HIS B 37 2.570 0.044 -35.378 1.00 0.00 N ATOM 0 H HIS B 37 -0.667 -2.857 -31.062 1.00 0.00 H new ATOM 0 HA HIS B 37 0.946 -1.498 -31.899 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.053 -0.882 -33.643 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -0.884 0.680 -32.865 1.00 0.00 H new ATOM 0 HD1 HIS B 37 1.726 1.616 -32.724 1.00 0.00 H new ATOM 0 HD2 HIS B 37 0.901 -1.374 -35.566 1.00 0.00 H new ATOM 0 HE1 HIS B 37 3.632 1.637 -34.427 1.00 0.00 H new ATOM 1055 N TYR B 38 -0.539 0.046 -29.581 1.00 0.00 N ATOM 1056 CA TYR B 38 -0.361 1.040 -28.480 1.00 0.00 C ATOM 1057 C TYR B 38 0.048 0.299 -27.203 1.00 0.00 C ATOM 1058 O TYR B 38 0.824 0.792 -26.409 1.00 0.00 O ATOM 1059 CB TYR B 38 -1.668 1.808 -28.237 1.00 0.00 C ATOM 1060 CG TYR B 38 -2.832 0.847 -28.148 1.00 0.00 C ATOM 1061 CD1 TYR B 38 -3.180 0.278 -26.917 1.00 0.00 C ATOM 1062 CD2 TYR B 38 -3.569 0.535 -29.296 1.00 0.00 C ATOM 1063 CE1 TYR B 38 -4.263 -0.606 -26.835 1.00 0.00 C ATOM 1064 CE2 TYR B 38 -4.651 -0.350 -29.216 1.00 0.00 C ATOM 1065 CZ TYR B 38 -4.999 -0.920 -27.985 1.00 0.00 C ATOM 1066 OH TYR B 38 -6.066 -1.790 -27.905 1.00 0.00 O ATOM 0 H TYR B 38 -1.270 -0.647 -29.423 1.00 0.00 H new ATOM 0 HA TYR B 38 0.413 1.754 -28.760 1.00 0.00 H new ATOM 0 HB2 TYR B 38 -1.593 2.385 -27.315 1.00 0.00 H new ATOM 0 HB3 TYR B 38 -1.836 2.519 -29.046 1.00 0.00 H new ATOM 0 HD1 TYR B 38 -2.613 0.521 -26.030 1.00 0.00 H new ATOM 0 HD2 TYR B 38 -3.303 0.977 -30.245 1.00 0.00 H new ATOM 0 HE1 TYR B 38 -4.531 -1.046 -25.886 1.00 0.00 H new ATOM 0 HE2 TYR B 38 -5.217 -0.593 -30.103 1.00 0.00 H new ATOM 0 HH TYR B 38 -6.467 -1.898 -28.793 1.00 0.00 H new ATOM 1076 N LEU B 39 -0.462 -0.893 -27.012 1.00 0.00 N ATOM 1077 CA LEU B 39 -0.109 -1.696 -25.803 1.00 0.00 C ATOM 1078 C LEU B 39 1.426 -1.808 -25.646 1.00 0.00 C ATOM 1079 O LEU B 39 1.942 -1.544 -24.575 1.00 0.00 O ATOM 1080 CB LEU B 39 -0.725 -3.099 -25.939 1.00 0.00 C ATOM 1081 CG LEU B 39 -1.635 -3.405 -24.737 1.00 0.00 C ATOM 1082 CD1 LEU B 39 -0.849 -3.274 -23.425 1.00 0.00 C ATOM 1083 CD2 LEU B 39 -2.810 -2.421 -24.722 1.00 0.00 C ATOM 0 H LEU B 39 -1.115 -1.348 -27.650 1.00 0.00 H new ATOM 0 HA LEU B 39 -0.504 -1.199 -24.917 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -1.299 -3.163 -26.863 1.00 0.00 H new ATOM 0 HB3 LEU B 39 0.066 -3.846 -26.003 1.00 0.00 H new ATOM 0 HG LEU B 39 -2.006 -4.426 -24.829 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -1.506 -3.493 -22.584 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -0.016 -3.977 -23.428 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -0.466 -2.258 -23.330 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -3.455 -2.638 -23.870 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -2.431 -1.402 -24.640 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -3.381 -2.522 -25.645 1.00 0.00 H new ATOM 1095 N PRO B 40 2.127 -2.188 -26.704 1.00 0.00 N ATOM 1096 CA PRO B 40 3.621 -2.327 -26.672 1.00 0.00 C ATOM 1097 C PRO B 40 4.291 -0.947 -26.646 1.00 0.00 C ATOM 1098 O PRO B 40 5.451 -0.816 -26.294 1.00 0.00 O ATOM 1099 CB PRO B 40 3.949 -3.098 -27.942 1.00 0.00 C ATOM 1100 CG PRO B 40 2.801 -2.879 -28.903 1.00 0.00 C ATOM 1101 CD PRO B 40 1.570 -2.521 -28.070 1.00 0.00 C ATOM 0 HA PRO B 40 3.985 -2.841 -25.783 1.00 0.00 H new ATOM 0 HB2 PRO B 40 4.886 -2.747 -28.375 1.00 0.00 H new ATOM 0 HB3 PRO B 40 4.075 -4.159 -27.727 1.00 0.00 H new ATOM 0 HG2 PRO B 40 3.035 -2.079 -29.605 1.00 0.00 H new ATOM 0 HG3 PRO B 40 2.617 -3.777 -29.493 1.00 0.00 H new ATOM 0 HD2 PRO B 40 1.033 -1.674 -28.498 1.00 0.00 H new ATOM 0 HD3 PRO B 40 0.867 -3.353 -28.021 1.00 0.00 H new ATOM 1109 N GLN B 41 3.564 0.086 -26.990 1.00 0.00 N ATOM 1110 CA GLN B 41 4.140 1.457 -26.953 1.00 0.00 C ATOM 1111 C GLN B 41 4.183 1.912 -25.490 1.00 0.00 C ATOM 1112 O GLN B 41 5.065 2.643 -25.077 1.00 0.00 O ATOM 1113 CB GLN B 41 3.245 2.398 -27.772 1.00 0.00 C ATOM 1114 CG GLN B 41 3.779 3.833 -27.704 1.00 0.00 C ATOM 1115 CD GLN B 41 5.117 3.918 -28.440 1.00 0.00 C ATOM 1116 OE1 GLN B 41 5.313 3.263 -29.444 1.00 0.00 O ATOM 1117 NE2 GLN B 41 6.052 4.703 -27.980 1.00 0.00 N ATOM 0 H GLN B 41 2.592 0.034 -27.296 1.00 0.00 H new ATOM 0 HA GLN B 41 5.145 1.470 -27.376 1.00 0.00 H new ATOM 0 HB2 GLN B 41 3.209 2.065 -28.809 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.225 2.364 -27.390 1.00 0.00 H new ATOM 0 HG2 GLN B 41 3.062 4.520 -28.152 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.904 4.136 -26.665 1.00 0.00 H new ATOM 0 HE21 GLN B 41 5.887 5.253 -27.137 1.00 0.00 H new ATOM 0 HE22 GLN B 41 6.948 4.767 -28.463 1.00 0.00 H new ATOM 1126 N LEU B 42 3.223 1.484 -24.711 1.00 0.00 N ATOM 1127 CA LEU B 42 3.172 1.879 -23.283 1.00 0.00 C ATOM 1128 C LEU B 42 4.221 1.096 -22.492 1.00 0.00 C ATOM 1129 O LEU B 42 4.918 1.646 -21.663 1.00 0.00 O ATOM 1130 CB LEU B 42 1.780 1.559 -22.714 1.00 0.00 C ATOM 1131 CG LEU B 42 0.636 2.430 -23.325 1.00 0.00 C ATOM 1132 CD1 LEU B 42 1.090 3.311 -24.505 1.00 0.00 C ATOM 1133 CD2 LEU B 42 -0.486 1.509 -23.814 1.00 0.00 C ATOM 0 H LEU B 42 2.466 0.871 -25.013 1.00 0.00 H new ATOM 0 HA LEU B 42 3.372 2.947 -23.201 1.00 0.00 H new ATOM 0 HB2 LEU B 42 1.558 0.507 -22.892 1.00 0.00 H new ATOM 0 HB3 LEU B 42 1.797 1.703 -21.634 1.00 0.00 H new ATOM 0 HG LEU B 42 0.300 3.100 -22.533 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.242 3.886 -24.877 1.00 0.00 H new ATOM 0 HD12 LEU B 42 1.872 3.992 -24.171 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.477 2.678 -25.304 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.289 2.109 -24.242 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -0.095 0.831 -24.573 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.873 0.930 -22.975 1.00 0.00 H new ATOM 1145 N ARG B 43 4.336 -0.189 -22.736 1.00 0.00 N ATOM 1146 CA ARG B 43 5.341 -1.001 -21.990 1.00 0.00 C ATOM 1147 C ARG B 43 6.738 -0.445 -22.266 1.00 0.00 C ATOM 1148 O ARG B 43 7.551 -0.318 -21.367 1.00 0.00 O ATOM 1149 CB ARG B 43 5.254 -2.472 -22.421 1.00 0.00 C ATOM 1150 CG ARG B 43 5.662 -2.634 -23.887 1.00 0.00 C ATOM 1151 CD ARG B 43 5.481 -4.095 -24.309 1.00 0.00 C ATOM 1152 NE ARG B 43 6.231 -4.341 -25.579 1.00 0.00 N ATOM 1153 CZ ARG B 43 5.966 -5.380 -26.348 1.00 0.00 C ATOM 1154 NH1 ARG B 43 5.028 -6.246 -26.036 1.00 0.00 N ATOM 1155 NH2 ARG B 43 6.650 -5.552 -27.445 1.00 0.00 N ATOM 0 H ARG B 43 3.779 -0.705 -23.417 1.00 0.00 H new ATOM 0 HA ARG B 43 5.137 -0.945 -20.921 1.00 0.00 H new ATOM 0 HB2 ARG B 43 5.902 -3.080 -21.789 1.00 0.00 H new ATOM 0 HB3 ARG B 43 4.237 -2.838 -22.279 1.00 0.00 H new ATOM 0 HG2 ARG B 43 5.056 -1.984 -24.518 1.00 0.00 H new ATOM 0 HG3 ARG B 43 6.700 -2.331 -24.022 1.00 0.00 H new ATOM 0 HD2 ARG B 43 5.844 -4.759 -23.525 1.00 0.00 H new ATOM 0 HD3 ARG B 43 4.423 -4.316 -24.450 1.00 0.00 H new ATOM 0 HE ARG B 43 6.965 -3.690 -25.858 1.00 0.00 H new ATOM 0 HH11 ARG B 43 4.485 -6.123 -25.182 1.00 0.00 H new ATOM 0 HH12 ARG B 43 4.843 -7.041 -26.648 1.00 0.00 H new ATOM 0 HH21 ARG B 43 7.380 -4.887 -27.700 1.00 0.00 H new ATOM 0 HH22 ARG B 43 6.455 -6.351 -28.048 1.00 0.00 H new ATOM 1169 N LYS B 44 7.022 -0.098 -23.499 1.00 0.00 N ATOM 1170 CA LYS B 44 8.355 0.461 -23.805 1.00 0.00 C ATOM 1171 C LYS B 44 8.485 1.810 -23.092 1.00 0.00 C ATOM 1172 O LYS B 44 9.554 2.195 -22.665 1.00 0.00 O ATOM 1173 CB LYS B 44 8.536 0.616 -25.325 1.00 0.00 C ATOM 1174 CG LYS B 44 7.599 1.690 -25.898 1.00 0.00 C ATOM 1175 CD LYS B 44 8.095 2.106 -27.285 1.00 0.00 C ATOM 1176 CE LYS B 44 8.997 3.334 -27.157 1.00 0.00 C ATOM 1177 NZ LYS B 44 9.996 3.334 -28.263 1.00 0.00 N ATOM 0 H LYS B 44 6.387 -0.181 -24.293 1.00 0.00 H new ATOM 0 HA LYS B 44 9.136 -0.213 -23.453 1.00 0.00 H new ATOM 0 HB2 LYS B 44 9.571 0.880 -25.544 1.00 0.00 H new ATOM 0 HB3 LYS B 44 8.340 -0.338 -25.815 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.582 1.304 -25.964 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.570 2.555 -25.235 1.00 0.00 H new ATOM 0 HD2 LYS B 44 8.643 1.286 -27.748 1.00 0.00 H new ATOM 0 HD3 LYS B 44 7.248 2.330 -27.934 1.00 0.00 H new ATOM 0 HE2 LYS B 44 8.398 4.244 -27.194 1.00 0.00 H new ATOM 0 HE3 LYS B 44 9.506 3.326 -26.193 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 10.610 4.169 -28.176 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 10.575 2.472 -28.208 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 9.501 3.361 -29.177 1.00 0.00 H new ATOM 1191 N ASP B 45 7.387 2.519 -22.950 1.00 0.00 N ATOM 1192 CA ASP B 45 7.428 3.830 -22.258 1.00 0.00 C ATOM 1193 C ASP B 45 7.835 3.612 -20.801 1.00 0.00 C ATOM 1194 O ASP B 45 8.675 4.315 -20.283 1.00 0.00 O ATOM 1195 CB ASP B 45 6.050 4.490 -22.316 1.00 0.00 C ATOM 1196 CG ASP B 45 5.756 4.942 -23.747 1.00 0.00 C ATOM 1197 OD1 ASP B 45 6.690 5.325 -24.432 1.00 0.00 O ATOM 1198 OD2 ASP B 45 4.598 4.900 -24.134 1.00 0.00 O ATOM 0 H ASP B 45 6.467 2.237 -23.288 1.00 0.00 H new ATOM 0 HA ASP B 45 8.152 4.480 -22.748 1.00 0.00 H new ATOM 0 HB2 ASP B 45 5.286 3.789 -21.981 1.00 0.00 H new ATOM 0 HB3 ASP B 45 6.016 5.344 -21.640 1.00 0.00 H new ATOM 1203 N ILE B 46 7.258 2.631 -20.139 1.00 0.00 N ATOM 1204 CA ILE B 46 7.634 2.373 -18.714 1.00 0.00 C ATOM 1205 C ILE B 46 9.125 2.011 -18.648 1.00 0.00 C ATOM 1206 O ILE B 46 9.795 2.289 -17.671 1.00 0.00 O ATOM 1207 CB ILE B 46 6.747 1.255 -18.116 1.00 0.00 C ATOM 1208 CG1 ILE B 46 6.945 1.231 -16.597 1.00 0.00 C ATOM 1209 CG2 ILE B 46 7.078 -0.130 -18.700 1.00 0.00 C ATOM 1210 CD1 ILE B 46 5.943 0.267 -15.959 1.00 0.00 C ATOM 0 H ILE B 46 6.550 2.005 -20.523 1.00 0.00 H new ATOM 0 HA ILE B 46 7.467 3.270 -18.117 1.00 0.00 H new ATOM 0 HB ILE B 46 5.710 1.473 -18.371 1.00 0.00 H new ATOM 0 HG12 ILE B 46 7.963 0.922 -16.359 1.00 0.00 H new ATOM 0 HG13 ILE B 46 6.811 2.232 -16.188 1.00 0.00 H new ATOM 0 HG21 ILE B 46 6.429 -0.880 -18.248 1.00 0.00 H new ATOM 0 HG22 ILE B 46 6.922 -0.117 -19.779 1.00 0.00 H new ATOM 0 HG23 ILE B 46 8.118 -0.375 -18.487 1.00 0.00 H new ATOM 0 HD11 ILE B 46 6.088 0.254 -14.879 1.00 0.00 H new ATOM 0 HD12 ILE B 46 4.928 0.595 -16.185 1.00 0.00 H new ATOM 0 HD13 ILE B 46 6.098 -0.735 -16.358 1.00 0.00 H new ATOM 1222 N LEU B 47 9.649 1.416 -19.694 1.00 0.00 N ATOM 1223 CA LEU B 47 11.091 1.060 -19.712 1.00 0.00 C ATOM 1224 C LEU B 47 11.904 2.352 -19.770 1.00 0.00 C ATOM 1225 O LEU B 47 12.820 2.560 -18.994 1.00 0.00 O ATOM 1226 CB LEU B 47 11.394 0.207 -20.946 1.00 0.00 C ATOM 1227 CG LEU B 47 10.986 -1.243 -20.682 1.00 0.00 C ATOM 1228 CD1 LEU B 47 10.548 -1.897 -21.993 1.00 0.00 C ATOM 1229 CD2 LEU B 47 12.178 -2.009 -20.105 1.00 0.00 C ATOM 0 H LEU B 47 9.132 1.164 -20.536 1.00 0.00 H new ATOM 0 HA LEU B 47 11.349 0.493 -18.818 1.00 0.00 H new ATOM 0 HB2 LEU B 47 10.855 0.595 -21.810 1.00 0.00 H new ATOM 0 HB3 LEU B 47 12.456 0.259 -21.184 1.00 0.00 H new ATOM 0 HG LEU B 47 10.160 -1.265 -19.972 1.00 0.00 H new ATOM 0 HD11 LEU B 47 10.257 -2.930 -21.805 1.00 0.00 H new ATOM 0 HD12 LEU B 47 9.700 -1.351 -22.406 1.00 0.00 H new ATOM 0 HD13 LEU B 47 11.374 -1.876 -22.704 1.00 0.00 H new ATOM 0 HD21 LEU B 47 11.889 -3.043 -19.916 1.00 0.00 H new ATOM 0 HD22 LEU B 47 13.003 -1.987 -20.816 1.00 0.00 H new ATOM 0 HD23 LEU B 47 12.492 -1.544 -19.171 1.00 0.00 H new ATOM 1241 N GLU B 48 11.551 3.236 -20.672 1.00 0.00 N ATOM 1242 CA GLU B 48 12.275 4.533 -20.777 1.00 0.00 C ATOM 1243 C GLU B 48 11.999 5.329 -19.517 1.00 0.00 C ATOM 1244 O GLU B 48 12.859 6.017 -18.999 1.00 0.00 O ATOM 1245 CB GLU B 48 11.768 5.339 -21.971 1.00 0.00 C ATOM 1246 CG GLU B 48 11.787 4.484 -23.230 1.00 0.00 C ATOM 1247 CD GLU B 48 13.229 4.112 -23.581 1.00 0.00 C ATOM 1248 OE1 GLU B 48 14.100 4.944 -23.384 1.00 0.00 O ATOM 1249 OE2 GLU B 48 13.438 3.001 -24.040 1.00 0.00 O ATOM 0 H GLU B 48 10.790 3.111 -21.340 1.00 0.00 H new ATOM 0 HA GLU B 48 13.340 4.339 -20.905 1.00 0.00 H new ATOM 0 HB2 GLU B 48 10.755 5.691 -21.777 1.00 0.00 H new ATOM 0 HB3 GLU B 48 12.391 6.222 -22.113 1.00 0.00 H new ATOM 0 HG2 GLU B 48 11.196 3.581 -23.077 1.00 0.00 H new ATOM 0 HG3 GLU B 48 11.330 5.028 -24.057 1.00 0.00 H new ATOM 1256 N VAL B 49 10.791 5.235 -19.019 1.00 0.00 N ATOM 1257 CA VAL B 49 10.434 5.980 -17.787 1.00 0.00 C ATOM 1258 C VAL B 49 11.351 5.500 -16.656 1.00 0.00 C ATOM 1259 O VAL B 49 12.051 6.281 -16.049 1.00 0.00 O ATOM 1260 CB VAL B 49 8.955 5.736 -17.436 1.00 0.00 C ATOM 1261 CG1 VAL B 49 8.607 6.409 -16.098 1.00 0.00 C ATOM 1262 CG2 VAL B 49 8.070 6.323 -18.542 1.00 0.00 C ATOM 0 H VAL B 49 10.040 4.672 -19.418 1.00 0.00 H new ATOM 0 HA VAL B 49 10.568 7.051 -17.936 1.00 0.00 H new ATOM 0 HB VAL B 49 8.783 4.663 -17.349 1.00 0.00 H new ATOM 0 HG11 VAL B 49 7.558 6.229 -15.862 1.00 0.00 H new ATOM 0 HG12 VAL B 49 9.233 5.994 -15.308 1.00 0.00 H new ATOM 0 HG13 VAL B 49 8.782 7.482 -16.174 1.00 0.00 H new ATOM 0 HG21 VAL B 49 7.021 6.153 -18.298 1.00 0.00 H new ATOM 0 HG22 VAL B 49 8.254 7.394 -18.625 1.00 0.00 H new ATOM 0 HG23 VAL B 49 8.305 5.840 -19.491 1.00 0.00 H new ATOM 1272 N ILE B 50 11.391 4.210 -16.403 1.00 0.00 N ATOM 1273 CA ILE B 50 12.306 3.683 -15.339 1.00 0.00 C ATOM 1274 C ILE B 50 13.741 4.138 -15.648 1.00 0.00 C ATOM 1275 O ILE B 50 14.569 4.235 -14.765 1.00 0.00 O ATOM 1276 CB ILE B 50 12.234 2.152 -15.299 1.00 0.00 C ATOM 1277 CG1 ILE B 50 10.790 1.717 -15.045 1.00 0.00 C ATOM 1278 CG2 ILE B 50 13.124 1.623 -14.172 1.00 0.00 C ATOM 1279 CD1 ILE B 50 10.542 0.358 -15.705 1.00 0.00 C ATOM 0 H ILE B 50 10.833 3.505 -16.884 1.00 0.00 H new ATOM 0 HA ILE B 50 12.002 4.069 -14.366 1.00 0.00 H new ATOM 0 HB ILE B 50 12.577 1.751 -16.253 1.00 0.00 H new ATOM 0 HG12 ILE B 50 10.602 1.652 -13.973 1.00 0.00 H new ATOM 0 HG13 ILE B 50 10.100 2.459 -15.446 1.00 0.00 H new ATOM 0 HG21 ILE B 50 13.070 0.535 -14.146 1.00 0.00 H new ATOM 0 HG22 ILE B 50 14.155 1.932 -14.347 1.00 0.00 H new ATOM 0 HG23 ILE B 50 12.782 2.026 -13.219 1.00 0.00 H new ATOM 0 HD11 ILE B 50 9.513 0.048 -15.524 1.00 0.00 H new ATOM 0 HD12 ILE B 50 10.713 0.438 -16.778 1.00 0.00 H new ATOM 0 HD13 ILE B 50 11.223 -0.381 -15.283 1.00 0.00 H new ATOM 1291 N CYS B 51 14.027 4.433 -16.896 1.00 0.00 N ATOM 1292 CA CYS B 51 15.386 4.903 -17.265 1.00 0.00 C ATOM 1293 C CYS B 51 15.555 6.356 -16.807 1.00 0.00 C ATOM 1294 O CYS B 51 16.555 6.721 -16.225 1.00 0.00 O ATOM 1295 CB CYS B 51 15.556 4.821 -18.787 1.00 0.00 C ATOM 1296 SG CYS B 51 17.319 4.851 -19.198 1.00 0.00 S ATOM 0 H CYS B 51 13.369 4.365 -17.672 1.00 0.00 H new ATOM 0 HA CYS B 51 16.138 4.278 -16.783 1.00 0.00 H new ATOM 0 HB2 CYS B 51 15.098 3.907 -19.166 1.00 0.00 H new ATOM 0 HB3 CYS B 51 15.045 5.656 -19.267 1.00 0.00 H new ATOM 0 HG CYS B 51 17.465 4.780 -20.488 1.00 0.00 H new ATOM 1302 N LYS B 52 14.577 7.188 -17.062 1.00 0.00 N ATOM 1303 CA LYS B 52 14.670 8.625 -16.646 1.00 0.00 C ATOM 1304 C LYS B 52 14.895 8.723 -15.136 1.00 0.00 C ATOM 1305 O LYS B 52 15.534 9.638 -14.651 1.00 0.00 O ATOM 1306 CB LYS B 52 13.369 9.357 -16.986 1.00 0.00 C ATOM 1307 CG LYS B 52 13.060 9.239 -18.479 1.00 0.00 C ATOM 1308 CD LYS B 52 11.554 9.428 -18.693 1.00 0.00 C ATOM 1309 CE LYS B 52 11.268 10.888 -19.049 1.00 0.00 C ATOM 1310 NZ LYS B 52 11.690 11.149 -20.453 1.00 0.00 N ATOM 0 H LYS B 52 13.714 6.935 -17.542 1.00 0.00 H new ATOM 0 HA LYS B 52 15.505 9.080 -17.178 1.00 0.00 H new ATOM 0 HB2 LYS B 52 12.547 8.939 -16.405 1.00 0.00 H new ATOM 0 HB3 LYS B 52 13.453 10.408 -16.708 1.00 0.00 H new ATOM 0 HG2 LYS B 52 13.617 9.990 -19.039 1.00 0.00 H new ATOM 0 HG3 LYS B 52 13.374 8.264 -18.853 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.204 8.773 -19.491 1.00 0.00 H new ATOM 0 HD3 LYS B 52 11.010 9.149 -17.790 1.00 0.00 H new ATOM 0 HE2 LYS B 52 10.205 11.100 -18.932 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.802 11.551 -18.368 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 11.182 11.979 -20.819 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 12.714 11.330 -20.480 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 11.469 10.321 -21.042 1.00 0.00 H new ATOM 1324 N TYR B 53 14.355 7.795 -14.392 1.00 0.00 N ATOM 1325 CA TYR B 53 14.502 7.824 -12.916 1.00 0.00 C ATOM 1326 C TYR B 53 15.557 6.797 -12.466 1.00 0.00 C ATOM 1327 O TYR B 53 16.016 6.829 -11.340 1.00 0.00 O ATOM 1328 CB TYR B 53 13.155 7.460 -12.280 1.00 0.00 C ATOM 1329 CG TYR B 53 12.078 8.464 -12.654 1.00 0.00 C ATOM 1330 CD1 TYR B 53 11.651 8.584 -13.983 1.00 0.00 C ATOM 1331 CD2 TYR B 53 11.485 9.254 -11.662 1.00 0.00 C ATOM 1332 CE1 TYR B 53 10.642 9.489 -14.323 1.00 0.00 C ATOM 1333 CE2 TYR B 53 10.470 10.159 -12.003 1.00 0.00 C ATOM 1334 CZ TYR B 53 10.049 10.275 -13.335 1.00 0.00 C ATOM 1335 OH TYR B 53 9.050 11.166 -13.669 1.00 0.00 O ATOM 0 H TYR B 53 13.812 7.010 -14.753 1.00 0.00 H new ATOM 0 HA TYR B 53 14.817 8.820 -12.606 1.00 0.00 H new ATOM 0 HB2 TYR B 53 12.855 6.464 -12.605 1.00 0.00 H new ATOM 0 HB3 TYR B 53 13.260 7.424 -11.196 1.00 0.00 H new ATOM 0 HD1 TYR B 53 12.105 7.973 -14.750 1.00 0.00 H new ATOM 0 HD2 TYR B 53 11.809 9.166 -10.635 1.00 0.00 H new ATOM 0 HE1 TYR B 53 10.321 9.580 -15.350 1.00 0.00 H new ATOM 0 HE2 TYR B 53 10.012 10.768 -11.238 1.00 0.00 H new ATOM 0 HH TYR B 53 8.745 11.633 -12.863 1.00 0.00 H new ATOM 1345 N VAL B 54 15.931 5.871 -13.326 1.00 0.00 N ATOM 1346 CA VAL B 54 16.939 4.828 -12.936 1.00 0.00 C ATOM 1347 C VAL B 54 17.695 4.386 -14.213 1.00 0.00 C ATOM 1348 O VAL B 54 18.043 5.216 -15.028 1.00 0.00 O ATOM 1349 CB VAL B 54 16.235 3.622 -12.264 1.00 0.00 C ATOM 1350 CG1 VAL B 54 17.238 2.884 -11.374 1.00 0.00 C ATOM 1351 CG2 VAL B 54 15.059 4.083 -11.392 1.00 0.00 C ATOM 0 H VAL B 54 15.581 5.794 -14.281 1.00 0.00 H new ATOM 0 HA VAL B 54 17.646 5.238 -12.214 1.00 0.00 H new ATOM 0 HB VAL B 54 15.858 2.967 -13.050 1.00 0.00 H new ATOM 0 HG11 VAL B 54 16.747 2.035 -10.899 1.00 0.00 H new ATOM 0 HG12 VAL B 54 18.071 2.529 -11.981 1.00 0.00 H new ATOM 0 HG13 VAL B 54 17.612 3.562 -10.607 1.00 0.00 H new ATOM 0 HG21 VAL B 54 14.584 3.216 -10.933 1.00 0.00 H new ATOM 0 HG22 VAL B 54 15.424 4.751 -10.612 1.00 0.00 H new ATOM 0 HG23 VAL B 54 14.332 4.610 -12.010 1.00 0.00 H new ATOM 1361 N GLN B 55 17.964 3.107 -14.406 1.00 0.00 N ATOM 1362 CA GLN B 55 18.690 2.676 -15.639 1.00 0.00 C ATOM 1363 C GLN B 55 18.643 1.151 -15.760 1.00 0.00 C ATOM 1364 O GLN B 55 19.309 0.438 -15.035 1.00 0.00 O ATOM 1365 CB GLN B 55 20.145 3.150 -15.567 1.00 0.00 C ATOM 1366 CG GLN B 55 20.447 4.086 -16.739 1.00 0.00 C ATOM 1367 CD GLN B 55 21.929 4.465 -16.724 1.00 0.00 C ATOM 1368 OE1 GLN B 55 22.440 4.926 -15.723 1.00 0.00 O ATOM 1369 NE2 GLN B 55 22.646 4.288 -17.801 1.00 0.00 N ATOM 0 H GLN B 55 17.712 2.355 -13.765 1.00 0.00 H new ATOM 0 HA GLN B 55 18.212 3.116 -16.514 1.00 0.00 H new ATOM 0 HB2 GLN B 55 20.322 3.666 -14.623 1.00 0.00 H new ATOM 0 HB3 GLN B 55 20.818 2.293 -15.593 1.00 0.00 H new ATOM 0 HG2 GLN B 55 20.195 3.599 -17.681 1.00 0.00 H new ATOM 0 HG3 GLN B 55 19.831 4.983 -16.670 1.00 0.00 H new ATOM 0 HE21 GLN B 55 22.217 3.901 -18.641 1.00 0.00 H new ATOM 0 HE22 GLN B 55 23.635 4.537 -17.802 1.00 0.00 H new ATOM 1378 N ILE B 56 17.857 0.658 -16.676 1.00 0.00 N ATOM 1379 CA ILE B 56 17.744 -0.818 -16.874 1.00 0.00 C ATOM 1380 C ILE B 56 17.659 -1.120 -18.369 1.00 0.00 C ATOM 1381 O ILE B 56 17.457 -0.236 -19.178 1.00 0.00 O ATOM 1382 CB ILE B 56 16.488 -1.357 -16.176 1.00 0.00 C ATOM 1383 CG1 ILE B 56 15.320 -0.373 -16.353 1.00 0.00 C ATOM 1384 CG2 ILE B 56 16.774 -1.553 -14.688 1.00 0.00 C ATOM 1385 CD1 ILE B 56 14.032 -1.149 -16.631 1.00 0.00 C ATOM 0 H ILE B 56 17.281 1.219 -17.304 1.00 0.00 H new ATOM 0 HA ILE B 56 18.621 -1.301 -16.444 1.00 0.00 H new ATOM 0 HB ILE B 56 16.216 -2.313 -16.623 1.00 0.00 H new ATOM 0 HG12 ILE B 56 15.204 0.234 -15.455 1.00 0.00 H new ATOM 0 HG13 ILE B 56 15.529 0.311 -17.176 1.00 0.00 H new ATOM 0 HG21 ILE B 56 15.881 -1.936 -14.193 1.00 0.00 H new ATOM 0 HG22 ILE B 56 17.590 -2.265 -14.565 1.00 0.00 H new ATOM 0 HG23 ILE B 56 17.055 -0.599 -14.243 1.00 0.00 H new ATOM 0 HD11 ILE B 56 13.206 -0.449 -16.756 1.00 0.00 H new ATOM 0 HD12 ILE B 56 14.151 -1.737 -17.541 1.00 0.00 H new ATOM 0 HD13 ILE B 56 13.820 -1.815 -15.794 1.00 0.00 H new ATOM 1397 N ASP B 57 17.803 -2.366 -18.736 1.00 0.00 N ATOM 1398 CA ASP B 57 17.723 -2.742 -20.175 1.00 0.00 C ATOM 1399 C ASP B 57 16.381 -3.438 -20.434 1.00 0.00 C ATOM 1400 O ASP B 57 15.724 -3.851 -19.498 1.00 0.00 O ATOM 1401 CB ASP B 57 18.868 -3.698 -20.514 1.00 0.00 C ATOM 1402 CG ASP B 57 20.105 -2.893 -20.918 1.00 0.00 C ATOM 1403 OD1 ASP B 57 20.060 -2.259 -21.959 1.00 0.00 O ATOM 1404 OD2 ASP B 57 21.075 -2.925 -20.179 1.00 0.00 O ATOM 0 H ASP B 57 17.973 -3.142 -18.096 1.00 0.00 H new ATOM 0 HA ASP B 57 17.802 -1.850 -20.796 1.00 0.00 H new ATOM 0 HB2 ASP B 57 19.096 -4.328 -19.654 1.00 0.00 H new ATOM 0 HB3 ASP B 57 18.572 -4.362 -21.326 1.00 0.00 H new ATOM 1409 N PRO B 58 16.000 -3.565 -21.689 1.00 0.00 N ATOM 1410 CA PRO B 58 14.717 -4.229 -22.079 1.00 0.00 C ATOM 1411 C PRO B 58 14.842 -5.737 -21.896 1.00 0.00 C ATOM 1412 O PRO B 58 13.878 -6.417 -21.595 1.00 0.00 O ATOM 1413 CB PRO B 58 14.530 -3.844 -23.539 1.00 0.00 C ATOM 1414 CG PRO B 58 15.903 -3.510 -24.085 1.00 0.00 C ATOM 1415 CD PRO B 58 16.770 -3.088 -22.898 1.00 0.00 C ATOM 0 HA PRO B 58 13.864 -3.923 -21.474 1.00 0.00 H new ATOM 0 HB2 PRO B 58 14.080 -4.663 -24.100 1.00 0.00 H new ATOM 0 HB3 PRO B 58 13.860 -2.989 -23.630 1.00 0.00 H new ATOM 0 HG2 PRO B 58 16.336 -4.373 -24.591 1.00 0.00 H new ATOM 0 HG3 PRO B 58 15.840 -2.708 -24.820 1.00 0.00 H new ATOM 0 HD2 PRO B 58 17.759 -3.543 -22.945 1.00 0.00 H new ATOM 0 HD3 PRO B 58 16.917 -2.008 -22.876 1.00 0.00 H new ATOM 1423 N GLU B 59 16.033 -6.259 -22.036 1.00 0.00 N ATOM 1424 CA GLU B 59 16.236 -7.719 -21.825 1.00 0.00 C ATOM 1425 C GLU B 59 15.976 -8.050 -20.345 1.00 0.00 C ATOM 1426 O GLU B 59 15.798 -9.198 -19.986 1.00 0.00 O ATOM 1427 CB GLU B 59 17.673 -8.095 -22.191 1.00 0.00 C ATOM 1428 CG GLU B 59 17.806 -8.185 -23.713 1.00 0.00 C ATOM 1429 CD GLU B 59 19.086 -8.944 -24.069 1.00 0.00 C ATOM 1430 OE1 GLU B 59 20.143 -8.522 -23.630 1.00 0.00 O ATOM 1431 OE2 GLU B 59 18.986 -9.934 -24.775 1.00 0.00 O ATOM 0 H GLU B 59 16.872 -5.736 -22.287 1.00 0.00 H new ATOM 0 HA GLU B 59 15.548 -8.283 -22.455 1.00 0.00 H new ATOM 0 HB2 GLU B 59 18.366 -7.351 -21.798 1.00 0.00 H new ATOM 0 HB3 GLU B 59 17.938 -9.049 -21.735 1.00 0.00 H new ATOM 0 HG2 GLU B 59 16.939 -8.694 -24.135 1.00 0.00 H new ATOM 0 HG3 GLU B 59 17.831 -7.185 -24.146 1.00 0.00 H new ATOM 1438 N MET B 60 15.949 -7.050 -19.485 1.00 0.00 N ATOM 1439 CA MET B 60 15.698 -7.304 -18.040 1.00 0.00 C ATOM 1440 C MET B 60 14.207 -7.111 -17.717 1.00 0.00 C ATOM 1441 O MET B 60 13.813 -7.161 -16.566 1.00 0.00 O ATOM 1442 CB MET B 60 16.527 -6.315 -17.212 1.00 0.00 C ATOM 1443 CG MET B 60 17.982 -6.807 -17.113 1.00 0.00 C ATOM 1444 SD MET B 60 18.374 -7.264 -15.403 1.00 0.00 S ATOM 1445 CE MET B 60 18.489 -5.583 -14.742 1.00 0.00 C ATOM 0 H MET B 60 16.091 -6.071 -19.732 1.00 0.00 H new ATOM 0 HA MET B 60 15.981 -8.329 -17.800 1.00 0.00 H new ATOM 0 HB2 MET B 60 16.498 -5.328 -17.673 1.00 0.00 H new ATOM 0 HB3 MET B 60 16.099 -6.214 -16.215 1.00 0.00 H new ATOM 0 HG2 MET B 60 18.129 -7.665 -17.769 1.00 0.00 H new ATOM 0 HG3 MET B 60 18.662 -6.026 -17.453 1.00 0.00 H new ATOM 0 HE1 MET B 60 18.533 -5.622 -13.654 1.00 0.00 H new ATOM 0 HE2 MET B 60 19.390 -5.103 -15.124 1.00 0.00 H new ATOM 0 HE3 MET B 60 17.614 -5.010 -15.050 1.00 0.00 H new ATOM 1455 N VAL B 61 13.374 -6.888 -18.712 1.00 0.00 N ATOM 1456 CA VAL B 61 11.920 -6.691 -18.443 1.00 0.00 C ATOM 1457 C VAL B 61 11.103 -7.702 -19.256 1.00 0.00 C ATOM 1458 O VAL B 61 11.192 -7.751 -20.468 1.00 0.00 O ATOM 1459 CB VAL B 61 11.521 -5.268 -18.842 1.00 0.00 C ATOM 1460 CG1 VAL B 61 10.062 -5.012 -18.457 1.00 0.00 C ATOM 1461 CG2 VAL B 61 12.422 -4.264 -18.116 1.00 0.00 C ATOM 0 H VAL B 61 13.644 -6.835 -19.694 1.00 0.00 H new ATOM 0 HA VAL B 61 11.722 -6.842 -17.382 1.00 0.00 H new ATOM 0 HB VAL B 61 11.635 -5.151 -19.920 1.00 0.00 H new ATOM 0 HG11 VAL B 61 9.783 -3.998 -18.743 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.419 -5.725 -18.973 1.00 0.00 H new ATOM 0 HG13 VAL B 61 9.944 -5.131 -17.380 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.139 -3.250 -18.399 1.00 0.00 H new ATOM 0 HG22 VAL B 61 12.308 -4.385 -17.039 1.00 0.00 H new ATOM 0 HG23 VAL B 61 13.461 -4.441 -18.393 1.00 0.00 H new ATOM 1471 N THR B 62 10.309 -8.509 -18.594 1.00 0.00 N ATOM 1472 CA THR B 62 9.485 -9.518 -19.315 1.00 0.00 C ATOM 1473 C THR B 62 8.111 -8.925 -19.633 1.00 0.00 C ATOM 1474 O THR B 62 7.683 -7.965 -19.020 1.00 0.00 O ATOM 1475 CB THR B 62 9.308 -10.762 -18.440 1.00 0.00 C ATOM 1476 OG1 THR B 62 10.528 -11.041 -17.765 1.00 0.00 O ATOM 1477 CG2 THR B 62 8.927 -11.954 -19.319 1.00 0.00 C ATOM 0 H THR B 62 10.199 -8.509 -17.580 1.00 0.00 H new ATOM 0 HA THR B 62 9.988 -9.794 -20.242 1.00 0.00 H new ATOM 0 HB THR B 62 8.519 -10.584 -17.709 1.00 0.00 H new ATOM 0 HG1 THR B 62 10.416 -11.836 -17.203 1.00 0.00 H new ATOM 0 HG21 THR B 62 8.801 -12.840 -18.696 1.00 0.00 H new ATOM 0 HG22 THR B 62 7.993 -11.739 -19.838 1.00 0.00 H new ATOM 0 HG23 THR B 62 9.715 -12.134 -20.050 1.00 0.00 H new ATOM 1485 N VAL B 63 7.417 -9.494 -20.586 1.00 0.00 N ATOM 1486 CA VAL B 63 6.068 -8.974 -20.951 1.00 0.00 C ATOM 1487 C VAL B 63 5.163 -10.146 -21.322 1.00 0.00 C ATOM 1488 O VAL B 63 5.313 -10.744 -22.371 1.00 0.00 O ATOM 1489 CB VAL B 63 6.194 -8.037 -22.148 1.00 0.00 C ATOM 1490 CG1 VAL B 63 4.840 -7.381 -22.433 1.00 0.00 C ATOM 1491 CG2 VAL B 63 7.224 -6.954 -21.836 1.00 0.00 C ATOM 0 H VAL B 63 7.730 -10.300 -21.128 1.00 0.00 H new ATOM 0 HA VAL B 63 5.642 -8.432 -20.106 1.00 0.00 H new ATOM 0 HB VAL B 63 6.512 -8.606 -23.021 1.00 0.00 H new ATOM 0 HG11 VAL B 63 4.933 -6.712 -23.289 1.00 0.00 H new ATOM 0 HG12 VAL B 63 4.101 -8.152 -22.653 1.00 0.00 H new ATOM 0 HG13 VAL B 63 4.521 -6.812 -21.560 1.00 0.00 H new ATOM 0 HG21 VAL B 63 7.316 -6.283 -22.690 1.00 0.00 H new ATOM 0 HG22 VAL B 63 6.903 -6.387 -20.962 1.00 0.00 H new ATOM 0 HG23 VAL B 63 8.189 -7.418 -21.633 1.00 0.00 H new ATOM 1501 N GLN B 64 4.225 -10.479 -20.473 1.00 0.00 N ATOM 1502 CA GLN B 64 3.310 -11.615 -20.780 1.00 0.00 C ATOM 1503 C GLN B 64 1.869 -11.104 -20.868 1.00 0.00 C ATOM 1504 O GLN B 64 1.380 -10.442 -19.972 1.00 0.00 O ATOM 1505 CB GLN B 64 3.420 -12.679 -19.681 1.00 0.00 C ATOM 1506 CG GLN B 64 3.254 -12.032 -18.299 1.00 0.00 C ATOM 1507 CD GLN B 64 4.622 -11.897 -17.626 1.00 0.00 C ATOM 1508 OE1 GLN B 64 5.556 -11.395 -18.219 1.00 0.00 O ATOM 1509 NE2 GLN B 64 4.781 -12.327 -16.404 1.00 0.00 N ATOM 0 H GLN B 64 4.055 -10.013 -19.582 1.00 0.00 H new ATOM 0 HA GLN B 64 3.592 -12.059 -21.735 1.00 0.00 H new ATOM 0 HB2 GLN B 64 2.657 -13.443 -19.827 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.387 -13.178 -19.743 1.00 0.00 H new ATOM 0 HG2 GLN B 64 2.789 -11.051 -18.399 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.592 -12.637 -17.680 1.00 0.00 H new ATOM 0 HE21 GLN B 64 3.997 -12.749 -15.906 1.00 0.00 H new ATOM 0 HE22 GLN B 64 5.689 -12.241 -15.947 1.00 0.00 H new ATOM 1518 N LEU B 65 1.189 -11.396 -21.949 1.00 0.00 N ATOM 1519 CA LEU B 65 -0.211 -10.921 -22.104 1.00 0.00 C ATOM 1520 C LEU B 65 -1.192 -12.068 -21.862 1.00 0.00 C ATOM 1521 O LEU B 65 -1.166 -13.079 -22.538 1.00 0.00 O ATOM 1522 CB LEU B 65 -0.403 -10.373 -23.517 1.00 0.00 C ATOM 1523 CG LEU B 65 0.014 -11.427 -24.558 1.00 0.00 C ATOM 1524 CD1 LEU B 65 -1.150 -11.695 -25.517 1.00 0.00 C ATOM 1525 CD2 LEU B 65 1.216 -10.914 -25.356 1.00 0.00 C ATOM 0 H LEU B 65 1.548 -11.945 -22.730 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.403 -10.136 -21.373 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -1.446 -10.095 -23.668 1.00 0.00 H new ATOM 0 HB3 LEU B 65 0.190 -9.468 -23.647 1.00 0.00 H new ATOM 0 HG LEU B 65 0.283 -12.350 -24.044 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.851 -12.442 -26.253 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -2.008 -12.063 -24.954 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.421 -10.771 -26.028 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.510 -11.662 -26.093 1.00 0.00 H new ATOM 0 HD22 LEU B 65 0.946 -9.989 -25.866 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.049 -10.725 -24.679 1.00 0.00 H new ATOM 1537 N GLU B 66 -2.068 -11.906 -20.905 1.00 0.00 N ATOM 1538 CA GLU B 66 -3.074 -12.965 -20.609 1.00 0.00 C ATOM 1539 C GLU B 66 -4.454 -12.455 -21.023 1.00 0.00 C ATOM 1540 O GLU B 66 -4.598 -11.327 -21.453 1.00 0.00 O ATOM 1541 CB GLU B 66 -3.065 -13.281 -19.106 1.00 0.00 C ATOM 1542 CG GLU B 66 -1.855 -14.149 -18.747 1.00 0.00 C ATOM 1543 CD GLU B 66 -1.895 -15.466 -19.532 1.00 0.00 C ATOM 1544 OE1 GLU B 66 -2.851 -16.204 -19.362 1.00 0.00 O ATOM 1545 OE2 GLU B 66 -0.969 -15.711 -20.287 1.00 0.00 O ATOM 0 H GLU B 66 -2.129 -11.078 -20.312 1.00 0.00 H new ATOM 0 HA GLU B 66 -2.833 -13.874 -21.161 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -3.037 -12.354 -18.534 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -3.985 -13.798 -18.832 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -0.934 -13.612 -18.971 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -1.851 -14.355 -17.677 1.00 0.00 H new ATOM 1552 N GLN B 67 -5.467 -13.275 -20.906 1.00 0.00 N ATOM 1553 CA GLN B 67 -6.840 -12.834 -21.299 1.00 0.00 C ATOM 1554 C GLN B 67 -7.878 -13.557 -20.438 1.00 0.00 C ATOM 1555 O GLN B 67 -7.649 -14.657 -19.971 1.00 0.00 O ATOM 1556 CB GLN B 67 -7.085 -13.174 -22.773 1.00 0.00 C ATOM 1557 CG GLN B 67 -6.400 -12.138 -23.674 1.00 0.00 C ATOM 1558 CD GLN B 67 -5.150 -12.752 -24.312 1.00 0.00 C ATOM 1559 OE1 GLN B 67 -4.312 -13.305 -23.626 1.00 0.00 O ATOM 1560 NE2 GLN B 67 -4.988 -12.678 -25.605 1.00 0.00 N ATOM 0 H GLN B 67 -5.403 -14.231 -20.555 1.00 0.00 H new ATOM 0 HA GLN B 67 -6.927 -11.758 -21.151 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -6.701 -14.170 -22.993 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -8.156 -13.193 -22.977 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -7.089 -11.805 -24.450 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -6.127 -11.259 -23.091 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -5.690 -12.214 -26.181 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -4.159 -13.084 -26.039 1.00 0.00 H new ATOM 1569 N LYS B 68 -9.019 -12.947 -20.233 1.00 0.00 N ATOM 1570 CA LYS B 68 -10.082 -13.598 -19.410 1.00 0.00 C ATOM 1571 C LYS B 68 -11.223 -14.056 -20.321 1.00 0.00 C ATOM 1572 O LYS B 68 -11.281 -13.699 -21.483 1.00 0.00 O ATOM 1573 CB LYS B 68 -10.625 -12.603 -18.380 1.00 0.00 C ATOM 1574 CG LYS B 68 -9.622 -12.443 -17.229 1.00 0.00 C ATOM 1575 CD LYS B 68 -9.438 -10.957 -16.901 1.00 0.00 C ATOM 1576 CE LYS B 68 -10.761 -10.368 -16.407 1.00 0.00 C ATOM 1577 NZ LYS B 68 -11.034 -10.853 -15.024 1.00 0.00 N ATOM 0 H LYS B 68 -9.259 -12.026 -20.600 1.00 0.00 H new ATOM 0 HA LYS B 68 -9.657 -14.458 -18.892 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -10.805 -11.638 -18.854 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -11.583 -12.952 -17.994 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -9.978 -12.978 -16.348 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -8.665 -12.885 -17.505 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -8.668 -10.836 -16.139 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -9.098 -10.419 -17.786 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -10.714 -9.279 -16.420 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -11.573 -10.660 -17.073 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -11.826 -10.315 -14.618 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -11.280 -11.863 -15.053 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -10.187 -10.719 -14.436 1.00 0.00 H new ATOM 1591 N ASP B 69 -12.128 -14.845 -19.801 1.00 0.00 N ATOM 1592 CA ASP B 69 -13.269 -15.334 -20.625 1.00 0.00 C ATOM 1593 C ASP B 69 -14.291 -14.210 -20.860 1.00 0.00 C ATOM 1594 O ASP B 69 -15.238 -14.382 -21.604 1.00 0.00 O ATOM 1595 CB ASP B 69 -13.954 -16.496 -19.901 1.00 0.00 C ATOM 1596 CG ASP B 69 -12.927 -17.590 -19.605 1.00 0.00 C ATOM 1597 OD1 ASP B 69 -12.065 -17.807 -20.440 1.00 0.00 O ATOM 1598 OD2 ASP B 69 -13.020 -18.191 -18.548 1.00 0.00 O ATOM 0 H ASP B 69 -12.124 -15.172 -18.835 1.00 0.00 H new ATOM 0 HA ASP B 69 -12.886 -15.666 -21.590 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -14.405 -16.145 -18.973 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -14.760 -16.896 -20.515 1.00 0.00 H new ATOM 1603 N GLY B 70 -14.118 -13.067 -20.234 1.00 0.00 N ATOM 1604 CA GLY B 70 -15.090 -11.949 -20.430 1.00 0.00 C ATOM 1605 C GLY B 70 -14.562 -10.976 -21.486 1.00 0.00 C ATOM 1606 O GLY B 70 -14.821 -9.790 -21.430 1.00 0.00 O ATOM 0 H GLY B 70 -13.347 -12.864 -19.598 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -16.056 -12.346 -20.741 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -15.249 -11.425 -19.488 1.00 0.00 H new ATOM 1610 N ASP B 71 -13.816 -11.470 -22.445 1.00 0.00 N ATOM 1611 CA ASP B 71 -13.260 -10.585 -23.515 1.00 0.00 C ATOM 1612 C ASP B 71 -12.378 -9.510 -22.877 1.00 0.00 C ATOM 1613 O ASP B 71 -12.509 -8.333 -23.154 1.00 0.00 O ATOM 1614 CB ASP B 71 -14.405 -9.928 -24.293 1.00 0.00 C ATOM 1615 CG ASP B 71 -14.957 -10.918 -25.320 1.00 0.00 C ATOM 1616 OD1 ASP B 71 -14.186 -11.370 -26.152 1.00 0.00 O ATOM 1617 OD2 ASP B 71 -16.140 -11.207 -25.258 1.00 0.00 O ATOM 0 H ASP B 71 -13.567 -12.455 -22.532 1.00 0.00 H new ATOM 0 HA ASP B 71 -12.661 -11.181 -24.204 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -15.195 -9.620 -23.608 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -14.049 -9.028 -24.794 1.00 0.00 H new ATOM 1622 N ILE B 72 -11.489 -9.918 -22.012 1.00 0.00 N ATOM 1623 CA ILE B 72 -10.598 -8.940 -21.328 1.00 0.00 C ATOM 1624 C ILE B 72 -9.140 -9.377 -21.498 1.00 0.00 C ATOM 1625 O ILE B 72 -8.856 -10.539 -21.718 1.00 0.00 O ATOM 1626 CB ILE B 72 -10.958 -8.885 -19.840 1.00 0.00 C ATOM 1627 CG1 ILE B 72 -12.490 -8.759 -19.696 1.00 0.00 C ATOM 1628 CG2 ILE B 72 -10.253 -7.685 -19.202 1.00 0.00 C ATOM 1629 CD1 ILE B 72 -12.893 -8.486 -18.239 1.00 0.00 C ATOM 0 H ILE B 72 -11.342 -10.892 -21.749 1.00 0.00 H new ATOM 0 HA ILE B 72 -10.728 -7.950 -21.766 1.00 0.00 H new ATOM 0 HB ILE B 72 -10.633 -9.794 -19.334 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -12.852 -7.952 -20.333 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -12.967 -9.676 -20.042 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -10.503 -7.637 -18.142 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -9.174 -7.794 -19.316 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -10.579 -6.768 -19.693 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -13.978 -8.403 -18.171 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -12.552 -9.306 -17.607 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -12.436 -7.555 -17.903 1.00 0.00 H new ATOM 1641 N SER B 73 -8.218 -8.452 -21.400 1.00 0.00 N ATOM 1642 CA SER B 73 -6.776 -8.806 -21.558 1.00 0.00 C ATOM 1643 C SER B 73 -6.042 -8.532 -20.246 1.00 0.00 C ATOM 1644 O SER B 73 -6.545 -7.848 -19.375 1.00 0.00 O ATOM 1645 CB SER B 73 -6.162 -7.964 -22.675 1.00 0.00 C ATOM 1646 OG SER B 73 -7.082 -7.872 -23.754 1.00 0.00 O ATOM 0 H SER B 73 -8.403 -7.466 -21.217 1.00 0.00 H new ATOM 0 HA SER B 73 -6.685 -9.862 -21.812 1.00 0.00 H new ATOM 0 HB2 SER B 73 -5.919 -6.968 -22.304 1.00 0.00 H new ATOM 0 HB3 SER B 73 -5.229 -8.414 -23.015 1.00 0.00 H new ATOM 0 HG SER B 73 -6.691 -7.331 -24.472 1.00 0.00 H new ATOM 1652 N ILE B 74 -4.864 -9.076 -20.098 1.00 0.00 N ATOM 1653 CA ILE B 74 -4.088 -8.878 -18.841 1.00 0.00 C ATOM 1654 C ILE B 74 -2.586 -8.865 -19.168 1.00 0.00 C ATOM 1655 O ILE B 74 -1.934 -9.893 -19.147 1.00 0.00 O ATOM 1656 CB ILE B 74 -4.413 -10.039 -17.885 1.00 0.00 C ATOM 1657 CG1 ILE B 74 -5.897 -9.967 -17.486 1.00 0.00 C ATOM 1658 CG2 ILE B 74 -3.525 -9.971 -16.632 1.00 0.00 C ATOM 1659 CD1 ILE B 74 -6.243 -11.097 -16.504 1.00 0.00 C ATOM 0 H ILE B 74 -4.403 -9.654 -20.801 1.00 0.00 H new ATOM 0 HA ILE B 74 -4.352 -7.930 -18.372 1.00 0.00 H new ATOM 0 HB ILE B 74 -4.217 -10.984 -18.391 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -6.111 -9.001 -17.029 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -6.523 -10.044 -18.375 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -3.769 -10.800 -15.968 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.477 -10.037 -16.925 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.698 -9.028 -16.114 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -7.296 -11.032 -16.231 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -6.049 -12.061 -16.975 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -5.630 -11.001 -15.608 1.00 0.00 H new ATOM 1671 N LEU B 75 -2.035 -7.714 -19.464 1.00 0.00 N ATOM 1672 CA LEU B 75 -0.583 -7.638 -19.788 1.00 0.00 C ATOM 1673 C LEU B 75 0.231 -7.490 -18.500 1.00 0.00 C ATOM 1674 O LEU B 75 0.176 -6.476 -17.832 1.00 0.00 O ATOM 1675 CB LEU B 75 -0.318 -6.444 -20.708 1.00 0.00 C ATOM 1676 CG LEU B 75 1.147 -6.458 -21.156 1.00 0.00 C ATOM 1677 CD1 LEU B 75 1.248 -5.969 -22.603 1.00 0.00 C ATOM 1678 CD2 LEU B 75 1.966 -5.536 -20.248 1.00 0.00 C ATOM 0 H LEU B 75 -2.532 -6.824 -19.494 1.00 0.00 H new ATOM 0 HA LEU B 75 -0.283 -8.555 -20.296 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -0.975 -6.488 -21.577 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -0.541 -5.513 -20.186 1.00 0.00 H new ATOM 0 HG LEU B 75 1.535 -7.474 -21.090 1.00 0.00 H new ATOM 0 HD11 LEU B 75 2.291 -5.980 -22.919 1.00 0.00 H new ATOM 0 HD12 LEU B 75 0.666 -6.625 -23.250 1.00 0.00 H new ATOM 0 HD13 LEU B 75 0.859 -4.953 -22.672 1.00 0.00 H new ATOM 0 HD21 LEU B 75 3.009 -5.545 -20.566 1.00 0.00 H new ATOM 0 HD22 LEU B 75 1.576 -4.520 -20.313 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.898 -5.885 -19.218 1.00 0.00 H new ATOM 1690 N GLU B 76 0.988 -8.501 -18.155 1.00 0.00 N ATOM 1691 CA GLU B 76 1.818 -8.440 -16.914 1.00 0.00 C ATOM 1692 C GLU B 76 3.289 -8.306 -17.309 1.00 0.00 C ATOM 1693 O GLU B 76 3.905 -9.260 -17.742 1.00 0.00 O ATOM 1694 CB GLU B 76 1.633 -9.729 -16.101 1.00 0.00 C ATOM 1695 CG GLU B 76 0.142 -10.049 -15.952 1.00 0.00 C ATOM 1696 CD GLU B 76 -0.021 -11.487 -15.456 1.00 0.00 C ATOM 1697 OE1 GLU B 76 0.795 -11.913 -14.655 1.00 0.00 O ATOM 1698 OE2 GLU B 76 -0.958 -12.139 -15.887 1.00 0.00 O ATOM 0 H GLU B 76 1.067 -9.370 -18.683 1.00 0.00 H new ATOM 0 HA GLU B 76 1.510 -7.586 -16.311 1.00 0.00 H new ATOM 0 HB2 GLU B 76 2.143 -10.556 -16.595 1.00 0.00 H new ATOM 0 HB3 GLU B 76 2.089 -9.616 -15.117 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.322 -9.356 -15.250 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -0.366 -9.922 -16.908 1.00 0.00 H new ATOM 1705 N LEU B 77 3.860 -7.136 -17.170 1.00 0.00 N ATOM 1706 CA LEU B 77 5.292 -6.967 -17.551 1.00 0.00 C ATOM 1707 C LEU B 77 6.183 -7.083 -16.311 1.00 0.00 C ATOM 1708 O LEU B 77 5.969 -6.429 -15.308 1.00 0.00 O ATOM 1709 CB LEU B 77 5.501 -5.607 -18.239 1.00 0.00 C ATOM 1710 CG LEU B 77 5.188 -4.451 -17.269 1.00 0.00 C ATOM 1711 CD1 LEU B 77 6.438 -3.586 -17.078 1.00 0.00 C ATOM 1712 CD2 LEU B 77 4.060 -3.585 -17.844 1.00 0.00 C ATOM 0 H LEU B 77 3.400 -6.299 -16.812 1.00 0.00 H new ATOM 0 HA LEU B 77 5.567 -7.755 -18.252 1.00 0.00 H new ATOM 0 HB2 LEU B 77 6.530 -5.526 -18.589 1.00 0.00 H new ATOM 0 HB3 LEU B 77 4.859 -5.536 -19.117 1.00 0.00 H new ATOM 0 HG LEU B 77 4.879 -4.865 -16.309 1.00 0.00 H new ATOM 0 HD11 LEU B 77 6.214 -2.769 -16.392 1.00 0.00 H new ATOM 0 HD12 LEU B 77 7.243 -4.195 -16.667 1.00 0.00 H new ATOM 0 HD13 LEU B 77 6.748 -3.177 -18.040 1.00 0.00 H new ATOM 0 HD21 LEU B 77 3.841 -2.769 -17.156 1.00 0.00 H new ATOM 0 HD22 LEU B 77 4.370 -3.176 -18.806 1.00 0.00 H new ATOM 0 HD23 LEU B 77 3.167 -4.194 -17.980 1.00 0.00 H new ATOM 1724 N ASN B 78 7.183 -7.918 -16.381 1.00 0.00 N ATOM 1725 CA ASN B 78 8.104 -8.094 -15.233 1.00 0.00 C ATOM 1726 C ASN B 78 9.243 -7.094 -15.368 1.00 0.00 C ATOM 1727 O ASN B 78 9.725 -6.849 -16.456 1.00 0.00 O ATOM 1728 CB ASN B 78 8.681 -9.498 -15.273 1.00 0.00 C ATOM 1729 CG ASN B 78 7.541 -10.518 -15.291 1.00 0.00 C ATOM 1730 OD1 ASN B 78 6.738 -10.534 -16.203 1.00 0.00 O ATOM 1731 ND2 ASN B 78 7.438 -11.374 -14.314 1.00 0.00 N ATOM 0 H ASN B 78 7.400 -8.491 -17.197 1.00 0.00 H new ATOM 0 HA ASN B 78 7.570 -7.937 -14.296 1.00 0.00 H new ATOM 0 HB2 ASN B 78 9.307 -9.620 -16.157 1.00 0.00 H new ATOM 0 HB3 ASN B 78 9.319 -9.665 -14.405 1.00 0.00 H new ATOM 0 HD21 ASN B 78 6.682 -12.059 -14.314 1.00 0.00 H new ATOM 0 HD22 ASN B 78 8.113 -11.359 -13.549 1.00 0.00 H new ATOM 1738 N VAL B 79 9.673 -6.514 -14.283 1.00 0.00 N ATOM 1739 CA VAL B 79 10.785 -5.525 -14.364 1.00 0.00 C ATOM 1740 C VAL B 79 11.928 -5.955 -13.444 1.00 0.00 C ATOM 1741 O VAL B 79 11.962 -5.609 -12.278 1.00 0.00 O ATOM 1742 CB VAL B 79 10.275 -4.148 -13.949 1.00 0.00 C ATOM 1743 CG1 VAL B 79 11.346 -3.105 -14.262 1.00 0.00 C ATOM 1744 CG2 VAL B 79 8.999 -3.820 -14.733 1.00 0.00 C ATOM 0 H VAL B 79 9.305 -6.681 -13.346 1.00 0.00 H new ATOM 0 HA VAL B 79 11.153 -5.478 -15.389 1.00 0.00 H new ATOM 0 HB VAL B 79 10.056 -4.142 -12.881 1.00 0.00 H new ATOM 0 HG11 VAL B 79 10.989 -2.118 -13.968 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.256 -3.341 -13.710 1.00 0.00 H new ATOM 0 HG13 VAL B 79 11.558 -3.111 -15.331 1.00 0.00 H new ATOM 0 HG21 VAL B 79 8.633 -2.837 -14.438 1.00 0.00 H new ATOM 0 HG22 VAL B 79 9.218 -3.820 -15.801 1.00 0.00 H new ATOM 0 HG23 VAL B 79 8.237 -4.570 -14.519 1.00 0.00 H new ATOM 1754 N THR B 80 12.865 -6.705 -13.967 1.00 0.00 N ATOM 1755 CA THR B 80 14.016 -7.163 -13.139 1.00 0.00 C ATOM 1756 C THR B 80 15.028 -6.022 -13.010 1.00 0.00 C ATOM 1757 O THR B 80 15.925 -5.884 -13.821 1.00 0.00 O ATOM 1758 CB THR B 80 14.684 -8.367 -13.812 1.00 0.00 C ATOM 1759 OG1 THR B 80 13.720 -9.393 -14.004 1.00 0.00 O ATOM 1760 CG2 THR B 80 15.820 -8.891 -12.930 1.00 0.00 C ATOM 0 H THR B 80 12.880 -7.020 -14.937 1.00 0.00 H new ATOM 0 HA THR B 80 13.663 -7.453 -12.149 1.00 0.00 H new ATOM 0 HB THR B 80 15.092 -8.062 -14.776 1.00 0.00 H new ATOM 0 HG1 THR B 80 14.144 -10.164 -14.436 1.00 0.00 H new ATOM 0 HG21 THR B 80 16.291 -9.747 -13.414 1.00 0.00 H new ATOM 0 HG22 THR B 80 16.560 -8.104 -12.784 1.00 0.00 H new ATOM 0 HG23 THR B 80 15.419 -9.196 -11.963 1.00 0.00 H new ATOM 1768 N LEU B 81 14.891 -5.206 -11.997 1.00 0.00 N ATOM 1769 CA LEU B 81 15.837 -4.074 -11.809 1.00 0.00 C ATOM 1770 C LEU B 81 17.103 -4.588 -11.100 1.00 0.00 C ATOM 1771 O LEU B 81 17.000 -5.390 -10.194 1.00 0.00 O ATOM 1772 CB LEU B 81 15.165 -3.009 -10.945 1.00 0.00 C ATOM 1773 CG LEU B 81 13.863 -2.561 -11.608 1.00 0.00 C ATOM 1774 CD1 LEU B 81 12.961 -1.898 -10.567 1.00 0.00 C ATOM 1775 CD2 LEU B 81 14.178 -1.558 -12.720 1.00 0.00 C ATOM 0 H LEU B 81 14.159 -5.278 -11.290 1.00 0.00 H new ATOM 0 HA LEU B 81 16.109 -3.647 -12.774 1.00 0.00 H new ATOM 0 HB2 LEU B 81 14.961 -3.407 -9.951 1.00 0.00 H new ATOM 0 HB3 LEU B 81 15.832 -2.156 -10.816 1.00 0.00 H new ATOM 0 HG LEU B 81 13.354 -3.427 -12.030 1.00 0.00 H new ATOM 0 HD11 LEU B 81 12.033 -1.579 -11.041 1.00 0.00 H new ATOM 0 HD12 LEU B 81 12.737 -2.610 -9.773 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.469 -1.031 -10.144 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.250 -1.237 -13.194 1.00 0.00 H new ATOM 0 HD22 LEU B 81 14.687 -0.692 -12.296 1.00 0.00 H new ATOM 0 HD23 LEU B 81 14.821 -2.029 -13.463 1.00 0.00 H new ATOM 1787 N PRO B 82 18.267 -4.120 -11.518 1.00 0.00 N ATOM 1788 CA PRO B 82 19.577 -4.534 -10.921 1.00 0.00 C ATOM 1789 C PRO B 82 19.873 -3.719 -9.660 1.00 0.00 C ATOM 1790 O PRO B 82 19.081 -2.896 -9.241 1.00 0.00 O ATOM 1791 CB PRO B 82 20.582 -4.227 -12.021 1.00 0.00 C ATOM 1792 CG PRO B 82 19.971 -3.152 -12.903 1.00 0.00 C ATOM 1793 CD PRO B 82 18.468 -3.122 -12.629 1.00 0.00 C ATOM 0 HA PRO B 82 19.598 -5.579 -10.613 1.00 0.00 H new ATOM 0 HB2 PRO B 82 21.525 -3.885 -11.595 1.00 0.00 H new ATOM 0 HB3 PRO B 82 20.801 -5.123 -12.602 1.00 0.00 H new ATOM 0 HG2 PRO B 82 20.418 -2.181 -12.688 1.00 0.00 H new ATOM 0 HG3 PRO B 82 20.164 -3.365 -13.954 1.00 0.00 H new ATOM 0 HD2 PRO B 82 18.138 -2.126 -12.332 1.00 0.00 H new ATOM 0 HD3 PRO B 82 17.897 -3.396 -13.516 1.00 0.00 H new