USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 693 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 141 CYS SG : rot 99:sc= -0.0883 USER MOD Set 1.2: A 145 GLN : amide:sc= 0.915 X(o=0.83,f=0.44) USER MOD Set 2.1: A 130 HIS : no HD1:sc= -3.53! K(o=-3.5!,f=-2.6) USER MOD Set 2.2: A 131 THR OG1 : rot 160:sc= 0 USER MOD Set 3.1: A 80 LYS NZ :NH3+ -175:sc= 1.16 (180deg=0) USER MOD Set 3.2: A 83 GLN : amide:sc= 0.899 K(o=2.1,f=-8.9!) USER MOD Single : A 59 MET CE :methyl 173:sc= -0.177 (180deg=-0.247) USER MOD Single : A 69 CYS SG : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot -13:sc= 0.275 USER MOD Single : A 75 LYS NZ :NH3+ -135:sc= -0.199 (180deg=-1.2) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -0.0595 K(o=-0.06,f=-1.1) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS : no HD1:sc= -0.729 X(o=-0.73,f=-0.97) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.0285 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.0581 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 175:sc= 0 (180deg=-0.0453) USER MOD Single : A 113 SER OG : rot 18:sc= 0.384 USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= -0.0399 K(o=-0.04,f=-1.4!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 134 GLN : amide:sc= -0.0264 X(o=-0.026,f=-0.4) USER MOD Single : A 135 MET CE :methyl -153:sc= -1.49 (180deg=-3.51!) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.137 X(o=-0.14,f=-0.21) USER MOD Single : A 150 HIS : no HD1:sc= -0.0788 X(o=-0.079,f=0) USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 59 -0.965 11.570 0.987 1.00 0.00 N ATOM 2 CA MET A 59 -1.854 10.886 0.046 1.00 0.00 C ATOM 3 C MET A 59 -2.716 9.882 0.804 1.00 0.00 C ATOM 4 O MET A 59 -2.407 9.538 1.948 1.00 0.00 O ATOM 5 CB MET A 59 -1.055 10.108 -1.003 1.00 0.00 C ATOM 6 CG MET A 59 -0.486 10.973 -2.122 1.00 0.00 C ATOM 7 SD MET A 59 0.601 10.100 -3.295 1.00 0.00 S ATOM 8 CE MET A 59 -0.131 8.444 -3.371 1.00 0.00 C ATOM 0 HA MET A 59 -2.464 11.643 -0.446 1.00 0.00 H new ATOM 0 HB2 MET A 59 -0.235 9.589 -0.507 1.00 0.00 H new ATOM 0 HB3 MET A 59 -1.698 9.344 -1.440 1.00 0.00 H new ATOM 0 HG2 MET A 59 -1.314 11.414 -2.677 1.00 0.00 H new ATOM 0 HG3 MET A 59 0.073 11.796 -1.676 1.00 0.00 H new ATOM 0 HE1 MET A 59 0.368 7.861 -4.145 1.00 0.00 H new ATOM 0 HE2 MET A 59 -0.010 7.948 -2.408 1.00 0.00 H new ATOM 0 HE3 MET A 59 -1.192 8.526 -3.606 1.00 0.00 H new ATOM 18 N ALA A 60 -3.759 9.385 0.138 1.00 0.00 N ATOM 19 CA ALA A 60 -4.611 8.326 0.646 1.00 0.00 C ATOM 20 C ALA A 60 -3.978 6.957 0.425 1.00 0.00 C ATOM 21 O ALA A 60 -3.208 6.752 -0.518 1.00 0.00 O ATOM 22 CB ALA A 60 -5.951 8.375 -0.084 1.00 0.00 C ATOM 0 H ALA A 60 -4.035 9.718 -0.786 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.748 8.476 1.717 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -6.599 7.583 0.291 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -6.424 9.342 0.088 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -5.788 8.236 -1.153 1.00 0.00 H new ATOM 28 N GLY A 61 -4.422 5.988 1.214 1.00 0.00 N ATOM 29 CA GLY A 61 -3.957 4.621 1.250 1.00 0.00 C ATOM 30 C GLY A 61 -3.813 4.246 2.722 1.00 0.00 C ATOM 31 O GLY A 61 -4.327 4.940 3.608 1.00 0.00 O ATOM 0 H GLY A 61 -5.168 6.155 1.890 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -4.663 3.959 0.749 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -3.004 4.523 0.730 1.00 0.00 H new ATOM 35 N GLY A 62 -3.135 3.136 2.991 1.00 0.00 N ATOM 36 CA GLY A 62 -3.040 2.586 4.329 1.00 0.00 C ATOM 37 C GLY A 62 -2.332 3.482 5.344 1.00 0.00 C ATOM 38 O GLY A 62 -2.727 3.426 6.510 1.00 0.00 O ATOM 0 H GLY A 62 -2.637 2.595 2.284 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -4.046 2.375 4.692 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -2.513 1.633 4.278 1.00 0.00 H new ATOM 42 N ALA A 63 -1.328 4.274 4.924 1.00 0.00 N ATOM 43 CA ALA A 63 -0.344 5.007 5.752 1.00 0.00 C ATOM 44 C ALA A 63 0.957 5.264 4.964 1.00 0.00 C ATOM 45 O ALA A 63 2.054 4.938 5.424 1.00 0.00 O ATOM 46 CB ALA A 63 -0.041 4.291 7.088 1.00 0.00 C ATOM 0 H ALA A 63 -1.169 4.432 3.929 1.00 0.00 H new ATOM 0 HA ALA A 63 -0.798 5.966 6.001 1.00 0.00 H new ATOM 0 HB1 ALA A 63 0.686 4.872 7.655 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -0.960 4.196 7.666 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.365 3.300 6.886 1.00 0.00 H new ATOM 52 N TRP A 64 0.851 5.797 3.750 1.00 0.00 N ATOM 53 CA TRP A 64 1.954 6.150 2.875 1.00 0.00 C ATOM 54 C TRP A 64 1.511 7.273 1.949 1.00 0.00 C ATOM 55 O TRP A 64 0.386 7.278 1.446 1.00 0.00 O ATOM 56 CB TRP A 64 2.447 4.929 2.076 1.00 0.00 C ATOM 57 CG TRP A 64 1.446 4.129 1.297 1.00 0.00 C ATOM 58 CD1 TRP A 64 0.831 3.011 1.744 1.00 0.00 C ATOM 59 CD2 TRP A 64 0.983 4.319 -0.076 1.00 0.00 C ATOM 60 NE1 TRP A 64 0.042 2.488 0.744 1.00 0.00 N ATOM 61 CE2 TRP A 64 0.068 3.272 -0.390 1.00 0.00 C ATOM 62 CE3 TRP A 64 1.237 5.269 -1.086 1.00 0.00 C ATOM 63 CZ2 TRP A 64 -0.577 3.187 -1.632 1.00 0.00 C ATOM 64 CZ3 TRP A 64 0.627 5.168 -2.351 1.00 0.00 C ATOM 65 CH2 TRP A 64 -0.292 4.140 -2.621 1.00 0.00 C ATOM 0 H TRP A 64 -0.056 6.003 3.332 1.00 0.00 H new ATOM 0 HA TRP A 64 2.795 6.493 3.478 1.00 0.00 H new ATOM 0 HB2 TRP A 64 3.209 5.276 1.378 1.00 0.00 H new ATOM 0 HB3 TRP A 64 2.939 4.253 2.775 1.00 0.00 H new ATOM 0 HD1 TRP A 64 0.942 2.592 2.733 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -0.496 1.626 0.831 1.00 0.00 H new ATOM 0 HE3 TRP A 64 1.911 6.089 -0.886 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -1.286 2.396 -1.825 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 0.868 5.887 -3.120 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -0.776 4.084 -3.585 1.00 0.00 H new ATOM 76 N GLY A 65 2.418 8.195 1.655 1.00 0.00 N ATOM 77 CA GLY A 65 2.261 9.100 0.538 1.00 0.00 C ATOM 78 C GLY A 65 3.582 9.199 -0.186 1.00 0.00 C ATOM 79 O GLY A 65 3.873 8.365 -1.047 1.00 0.00 O ATOM 0 H GLY A 65 3.278 8.332 2.186 1.00 0.00 H new ATOM 0 HA2 GLY A 65 1.485 8.738 -0.137 1.00 0.00 H new ATOM 0 HA3 GLY A 65 1.946 10.083 0.888 1.00 0.00 H new ATOM 83 N ARG A 66 4.423 10.161 0.201 1.00 0.00 N ATOM 84 CA ARG A 66 5.705 10.374 -0.464 1.00 0.00 C ATOM 85 C ARG A 66 6.662 9.197 -0.312 1.00 0.00 C ATOM 86 O ARG A 66 7.610 9.132 -1.084 1.00 0.00 O ATOM 87 CB ARG A 66 6.350 11.714 -0.070 1.00 0.00 C ATOM 88 CG ARG A 66 5.518 12.879 -0.632 1.00 0.00 C ATOM 89 CD ARG A 66 6.277 14.200 -0.746 1.00 0.00 C ATOM 90 NE ARG A 66 6.599 14.798 0.557 1.00 0.00 N ATOM 91 CZ ARG A 66 7.814 15.115 1.021 1.00 0.00 C ATOM 92 NH1 ARG A 66 8.930 14.718 0.412 1.00 0.00 N ATOM 93 NH2 ARG A 66 7.905 15.869 2.109 1.00 0.00 N ATOM 0 H ARG A 66 4.237 10.803 0.971 1.00 0.00 H new ATOM 0 HA ARG A 66 5.483 10.436 -1.529 1.00 0.00 H new ATOM 0 HB2 ARG A 66 6.414 11.792 1.015 1.00 0.00 H new ATOM 0 HB3 ARG A 66 7.369 11.764 -0.454 1.00 0.00 H new ATOM 0 HG2 ARG A 66 5.146 12.601 -1.618 1.00 0.00 H new ATOM 0 HG3 ARG A 66 4.647 13.028 0.006 1.00 0.00 H new ATOM 0 HD2 ARG A 66 7.201 14.034 -1.300 1.00 0.00 H new ATOM 0 HD3 ARG A 66 5.680 14.905 -1.325 1.00 0.00 H new ATOM 0 HE ARG A 66 5.811 14.993 1.175 1.00 0.00 H new ATOM 0 HH11 ARG A 66 8.875 14.154 -0.436 1.00 0.00 H new ATOM 0 HH12 ARG A 66 9.839 14.978 0.794 1.00 0.00 H new ATOM 0 HH21 ARG A 66 7.059 16.196 2.575 1.00 0.00 H new ATOM 0 HH22 ARG A 66 8.821 16.122 2.479 1.00 0.00 H new ATOM 107 N LEU A 67 6.384 8.210 0.549 1.00 0.00 N ATOM 108 CA LEU A 67 7.061 6.916 0.489 1.00 0.00 C ATOM 109 C LEU A 67 7.011 6.361 -0.944 1.00 0.00 C ATOM 110 O LEU A 67 8.048 6.001 -1.493 1.00 0.00 O ATOM 111 CB LEU A 67 6.455 5.919 1.499 1.00 0.00 C ATOM 112 CG LEU A 67 7.533 4.946 2.020 1.00 0.00 C ATOM 113 CD1 LEU A 67 8.329 5.579 3.163 1.00 0.00 C ATOM 114 CD2 LEU A 67 6.948 3.619 2.505 1.00 0.00 C ATOM 0 H LEU A 67 5.693 8.287 1.295 1.00 0.00 H new ATOM 0 HA LEU A 67 8.105 7.059 0.767 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.015 6.463 2.335 1.00 0.00 H new ATOM 0 HB3 LEU A 67 5.650 5.357 1.025 1.00 0.00 H new ATOM 0 HG LEU A 67 8.187 4.740 1.173 1.00 0.00 H new ATOM 0 HD11 LEU A 67 9.083 4.875 3.515 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.817 6.486 2.808 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.654 5.827 3.982 1.00 0.00 H new ATOM 0 HD21 LEU A 67 7.752 2.975 2.860 1.00 0.00 H new ATOM 0 HD22 LEU A 67 6.247 3.806 3.319 1.00 0.00 H new ATOM 0 HD23 LEU A 67 6.427 3.129 1.683 1.00 0.00 H new ATOM 126 N ALA A 68 5.839 6.335 -1.589 1.00 0.00 N ATOM 127 CA ALA A 68 5.710 5.866 -2.970 1.00 0.00 C ATOM 128 C ALA A 68 6.428 6.790 -3.966 1.00 0.00 C ATOM 129 O ALA A 68 6.805 6.348 -5.046 1.00 0.00 O ATOM 130 CB ALA A 68 4.226 5.753 -3.346 1.00 0.00 C ATOM 0 H ALA A 68 4.959 6.637 -1.170 1.00 0.00 H new ATOM 0 HA ALA A 68 6.185 4.887 -3.028 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.137 5.404 -4.375 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.734 5.045 -2.678 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.751 6.730 -3.252 1.00 0.00 H new ATOM 136 N CYS A 69 6.617 8.071 -3.632 1.00 0.00 N ATOM 137 CA CYS A 69 7.184 9.064 -4.536 1.00 0.00 C ATOM 138 C CYS A 69 8.609 8.696 -4.937 1.00 0.00 C ATOM 139 O CYS A 69 8.941 8.855 -6.106 1.00 0.00 O ATOM 140 CB CYS A 69 7.115 10.457 -3.894 1.00 0.00 C ATOM 141 SG CYS A 69 7.618 11.753 -5.052 1.00 0.00 S ATOM 0 H CYS A 69 6.376 8.447 -2.715 1.00 0.00 H new ATOM 0 HA CYS A 69 6.593 9.082 -5.452 1.00 0.00 H new ATOM 0 HB2 CYS A 69 6.098 10.650 -3.551 1.00 0.00 H new ATOM 0 HB3 CYS A 69 7.759 10.485 -3.015 1.00 0.00 H new ATOM 0 HG CYS A 69 7.542 12.911 -4.467 1.00 0.00 H new ATOM 147 N TYR A 70 9.439 8.176 -4.023 1.00 0.00 N ATOM 148 CA TYR A 70 10.823 7.748 -4.290 1.00 0.00 C ATOM 149 C TYR A 70 10.911 6.448 -5.107 1.00 0.00 C ATOM 150 O TYR A 70 12.022 5.968 -5.349 1.00 0.00 O ATOM 151 CB TYR A 70 11.568 7.523 -2.958 1.00 0.00 C ATOM 152 CG TYR A 70 11.618 8.682 -1.976 1.00 0.00 C ATOM 153 CD1 TYR A 70 12.699 9.584 -1.991 1.00 0.00 C ATOM 154 CD2 TYR A 70 10.641 8.793 -0.969 1.00 0.00 C ATOM 155 CE1 TYR A 70 12.804 10.576 -0.998 1.00 0.00 C ATOM 156 CE2 TYR A 70 10.725 9.803 0.006 1.00 0.00 C ATOM 157 CZ TYR A 70 11.820 10.695 0.010 1.00 0.00 C ATOM 158 OH TYR A 70 11.940 11.620 1.005 1.00 0.00 O ATOM 0 H TYR A 70 9.161 8.037 -3.051 1.00 0.00 H new ATOM 0 HA TYR A 70 11.278 8.547 -4.875 1.00 0.00 H new ATOM 0 HB2 TYR A 70 11.106 6.675 -2.453 1.00 0.00 H new ATOM 0 HB3 TYR A 70 12.593 7.235 -3.191 1.00 0.00 H new ATOM 0 HD1 TYR A 70 13.449 9.515 -2.765 1.00 0.00 H new ATOM 0 HD2 TYR A 70 9.818 8.095 -0.945 1.00 0.00 H new ATOM 0 HE1 TYR A 70 13.645 11.253 -1.006 1.00 0.00 H new ATOM 0 HE2 TYR A 70 9.951 9.897 0.753 1.00 0.00 H new ATOM 0 HH TYR A 70 12.851 11.981 1.008 1.00 0.00 H new ATOM 168 N LEU A 71 9.781 5.848 -5.497 1.00 0.00 N ATOM 169 CA LEU A 71 9.741 4.524 -6.112 1.00 0.00 C ATOM 170 C LEU A 71 9.187 4.579 -7.537 1.00 0.00 C ATOM 171 O LEU A 71 8.807 3.546 -8.082 1.00 0.00 O ATOM 172 CB LEU A 71 8.959 3.537 -5.221 1.00 0.00 C ATOM 173 CG LEU A 71 9.357 3.514 -3.729 1.00 0.00 C ATOM 174 CD1 LEU A 71 8.422 2.534 -3.003 1.00 0.00 C ATOM 175 CD2 LEU A 71 10.828 3.142 -3.479 1.00 0.00 C ATOM 0 H LEU A 71 8.861 6.275 -5.392 1.00 0.00 H new ATOM 0 HA LEU A 71 10.764 4.156 -6.194 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.898 3.777 -5.290 1.00 0.00 H new ATOM 0 HB3 LEU A 71 9.086 2.533 -5.626 1.00 0.00 H new ATOM 0 HG LEU A 71 9.251 4.527 -3.341 1.00 0.00 H new ATOM 0 HD11 LEU A 71 8.682 2.499 -1.945 1.00 0.00 H new ATOM 0 HD12 LEU A 71 7.390 2.867 -3.112 1.00 0.00 H new ATOM 0 HD13 LEU A 71 8.530 1.540 -3.436 1.00 0.00 H new ATOM 0 HD21 LEU A 71 11.028 3.148 -2.407 1.00 0.00 H new ATOM 0 HD22 LEU A 71 11.025 2.147 -3.879 1.00 0.00 H new ATOM 0 HD23 LEU A 71 11.476 3.867 -3.973 1.00 0.00 H new ATOM 187 N GLU A 72 9.131 5.766 -8.146 1.00 0.00 N ATOM 188 CA GLU A 72 8.601 5.965 -9.493 1.00 0.00 C ATOM 189 C GLU A 72 9.666 6.483 -10.464 1.00 0.00 C ATOM 190 O GLU A 72 9.477 6.336 -11.673 1.00 0.00 O ATOM 191 CB GLU A 72 7.375 6.899 -9.435 1.00 0.00 C ATOM 192 CG GLU A 72 6.055 6.150 -9.178 1.00 0.00 C ATOM 193 CD GLU A 72 5.519 5.482 -10.451 1.00 0.00 C ATOM 194 OE1 GLU A 72 6.002 4.383 -10.821 1.00 0.00 O ATOM 195 OE2 GLU A 72 4.643 6.076 -11.122 1.00 0.00 O ATOM 0 H GLU A 72 9.458 6.628 -7.709 1.00 0.00 H new ATOM 0 HA GLU A 72 8.286 4.997 -9.883 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.526 7.638 -8.648 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.298 7.446 -10.375 1.00 0.00 H new ATOM 0 HG2 GLU A 72 6.211 5.393 -8.409 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.311 6.847 -8.793 1.00 0.00 H new ATOM 202 N PHE A 73 10.783 7.044 -9.982 1.00 0.00 N ATOM 203 CA PHE A 73 11.927 7.381 -10.824 1.00 0.00 C ATOM 204 C PHE A 73 12.560 6.070 -11.314 1.00 0.00 C ATOM 205 O PHE A 73 12.868 5.927 -12.500 1.00 0.00 O ATOM 206 CB PHE A 73 12.923 8.310 -10.076 1.00 0.00 C ATOM 207 CG PHE A 73 14.184 7.639 -9.585 1.00 0.00 C ATOM 208 CD1 PHE A 73 14.134 6.863 -8.417 1.00 0.00 C ATOM 209 CD2 PHE A 73 15.358 7.670 -10.361 1.00 0.00 C ATOM 210 CE1 PHE A 73 15.217 6.039 -8.096 1.00 0.00 C ATOM 211 CE2 PHE A 73 16.468 6.895 -9.987 1.00 0.00 C ATOM 212 CZ PHE A 73 16.386 6.047 -8.874 1.00 0.00 C ATOM 0 H PHE A 73 10.914 7.275 -8.997 1.00 0.00 H new ATOM 0 HA PHE A 73 11.609 7.954 -11.695 1.00 0.00 H new ATOM 0 HB2 PHE A 73 13.201 9.128 -10.741 1.00 0.00 H new ATOM 0 HB3 PHE A 73 12.410 8.753 -9.222 1.00 0.00 H new ATOM 0 HD1 PHE A 73 13.268 6.902 -7.773 1.00 0.00 H new ATOM 0 HD2 PHE A 73 15.405 8.290 -11.244 1.00 0.00 H new ATOM 0 HE1 PHE A 73 15.154 5.387 -7.237 1.00 0.00 H new ATOM 0 HE2 PHE A 73 17.384 6.952 -10.556 1.00 0.00 H new ATOM 0 HZ PHE A 73 17.215 5.405 -8.617 1.00 0.00 H new ATOM 222 N LEU A 74 12.733 5.106 -10.401 1.00 0.00 N ATOM 223 CA LEU A 74 13.281 3.807 -10.730 1.00 0.00 C ATOM 224 C LEU A 74 12.206 2.910 -11.327 1.00 0.00 C ATOM 225 O LEU A 74 11.001 3.072 -11.116 1.00 0.00 O ATOM 226 CB LEU A 74 14.070 3.145 -9.585 1.00 0.00 C ATOM 227 CG LEU A 74 13.530 3.118 -8.144 1.00 0.00 C ATOM 228 CD1 LEU A 74 12.171 2.453 -8.008 1.00 0.00 C ATOM 229 CD2 LEU A 74 14.514 2.347 -7.244 1.00 0.00 C ATOM 0 H LEU A 74 12.493 5.216 -9.416 1.00 0.00 H new ATOM 0 HA LEU A 74 14.039 3.968 -11.496 1.00 0.00 H new ATOM 0 HB2 LEU A 74 14.243 2.109 -9.877 1.00 0.00 H new ATOM 0 HB3 LEU A 74 15.044 3.633 -9.549 1.00 0.00 H new ATOM 0 HG LEU A 74 13.422 4.161 -7.847 1.00 0.00 H new ATOM 0 HD11 LEU A 74 11.859 2.473 -6.964 1.00 0.00 H new ATOM 0 HD12 LEU A 74 11.441 2.989 -8.615 1.00 0.00 H new ATOM 0 HD13 LEU A 74 12.236 1.419 -8.347 1.00 0.00 H new ATOM 0 HD21 LEU A 74 14.134 2.327 -6.223 1.00 0.00 H new ATOM 0 HD22 LEU A 74 14.621 1.327 -7.612 1.00 0.00 H new ATOM 0 HD23 LEU A 74 15.485 2.842 -7.260 1.00 0.00 H new ATOM 241 N LYS A 75 12.680 1.936 -12.089 1.00 0.00 N ATOM 242 CA LYS A 75 11.894 0.961 -12.821 1.00 0.00 C ATOM 243 C LYS A 75 12.388 -0.420 -12.424 1.00 0.00 C ATOM 244 O LYS A 75 13.210 -0.540 -11.518 1.00 0.00 O ATOM 245 CB LYS A 75 12.005 1.256 -14.319 1.00 0.00 C ATOM 246 CG LYS A 75 11.279 2.555 -14.708 1.00 0.00 C ATOM 247 CD LYS A 75 11.473 2.959 -16.175 1.00 0.00 C ATOM 248 CE LYS A 75 11.255 1.835 -17.198 1.00 0.00 C ATOM 249 NZ LYS A 75 12.446 0.970 -17.372 1.00 0.00 N ATOM 0 H LYS A 75 13.682 1.799 -12.219 1.00 0.00 H new ATOM 0 HA LYS A 75 10.832 1.011 -12.581 1.00 0.00 H new ATOM 0 HB2 LYS A 75 13.056 1.332 -14.596 1.00 0.00 H new ATOM 0 HB3 LYS A 75 11.586 0.424 -14.884 1.00 0.00 H new ATOM 0 HG2 LYS A 75 10.213 2.437 -14.512 1.00 0.00 H new ATOM 0 HG3 LYS A 75 11.633 3.363 -14.069 1.00 0.00 H new ATOM 0 HD2 LYS A 75 10.787 3.775 -16.404 1.00 0.00 H new ATOM 0 HD3 LYS A 75 12.484 3.348 -16.297 1.00 0.00 H new ATOM 0 HE2 LYS A 75 10.411 1.222 -16.882 1.00 0.00 H new ATOM 0 HE3 LYS A 75 10.988 2.273 -18.160 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 12.609 0.804 -18.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 13.278 1.438 -16.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 12.287 0.060 -16.893 1.00 0.00 H new ATOM 263 N LYS A 76 11.840 -1.483 -13.016 1.00 0.00 N ATOM 264 CA LYS A 76 12.002 -2.853 -12.515 1.00 0.00 C ATOM 265 C LYS A 76 13.458 -3.317 -12.433 1.00 0.00 C ATOM 266 O LYS A 76 13.707 -4.265 -11.693 1.00 0.00 O ATOM 267 CB LYS A 76 11.118 -3.840 -13.294 1.00 0.00 C ATOM 268 CG LYS A 76 9.647 -3.839 -12.841 1.00 0.00 C ATOM 269 CD LYS A 76 8.932 -2.530 -13.196 1.00 0.00 C ATOM 270 CE LYS A 76 7.413 -2.684 -13.304 1.00 0.00 C ATOM 271 NZ LYS A 76 6.998 -3.251 -14.599 1.00 0.00 N ATOM 0 H LYS A 76 11.269 -1.420 -13.859 1.00 0.00 H new ATOM 0 HA LYS A 76 11.656 -2.838 -11.481 1.00 0.00 H new ATOM 0 HB2 LYS A 76 11.163 -3.595 -14.355 1.00 0.00 H new ATOM 0 HB3 LYS A 76 11.524 -4.845 -13.181 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.125 -4.674 -13.307 1.00 0.00 H new ATOM 0 HG3 LYS A 76 9.600 -3.996 -11.763 1.00 0.00 H new ATOM 0 HD2 LYS A 76 9.162 -1.781 -12.439 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.321 -2.156 -14.143 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.057 -3.326 -12.498 1.00 0.00 H new ATOM 0 HE3 LYS A 76 6.941 -1.711 -13.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 5.962 -3.336 -14.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.313 -2.626 -15.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.426 -4.191 -14.719 1.00 0.00 H new ATOM 285 N GLU A 77 14.403 -2.642 -13.091 1.00 0.00 N ATOM 286 CA GLU A 77 15.833 -2.803 -12.859 1.00 0.00 C ATOM 287 C GLU A 77 16.123 -2.727 -11.357 1.00 0.00 C ATOM 288 O GLU A 77 16.558 -3.726 -10.777 1.00 0.00 O ATOM 289 CB GLU A 77 16.621 -1.782 -13.705 1.00 0.00 C ATOM 290 CG GLU A 77 16.940 -2.393 -15.079 1.00 0.00 C ATOM 291 CD GLU A 77 17.025 -1.380 -16.219 1.00 0.00 C ATOM 292 OE1 GLU A 77 15.949 -0.972 -16.722 1.00 0.00 O ATOM 293 OE2 GLU A 77 18.126 -1.130 -16.763 1.00 0.00 O ATOM 0 H GLU A 77 14.187 -1.955 -13.814 1.00 0.00 H new ATOM 0 HA GLU A 77 16.169 -3.787 -13.186 1.00 0.00 H new ATOM 0 HB2 GLU A 77 16.039 -0.869 -13.828 1.00 0.00 H new ATOM 0 HB3 GLU A 77 17.544 -1.506 -13.195 1.00 0.00 H new ATOM 0 HG2 GLU A 77 17.888 -2.927 -15.014 1.00 0.00 H new ATOM 0 HG3 GLU A 77 16.174 -3.130 -15.321 1.00 0.00 H new ATOM 300 N GLU A 78 15.818 -1.602 -10.705 1.00 0.00 N ATOM 301 CA GLU A 78 16.160 -1.360 -9.324 1.00 0.00 C ATOM 302 C GLU A 78 14.945 -1.579 -8.426 1.00 0.00 C ATOM 303 O GLU A 78 15.097 -2.015 -7.297 1.00 0.00 O ATOM 304 CB GLU A 78 16.557 0.105 -9.183 1.00 0.00 C ATOM 305 CG GLU A 78 17.668 0.685 -10.051 1.00 0.00 C ATOM 306 CD GLU A 78 17.621 2.205 -9.911 1.00 0.00 C ATOM 307 OE1 GLU A 78 17.844 2.698 -8.788 1.00 0.00 O ATOM 308 OE2 GLU A 78 17.240 2.867 -10.907 1.00 0.00 O ATOM 0 H GLU A 78 15.317 -0.827 -11.141 1.00 0.00 H new ATOM 0 HA GLU A 78 16.964 -2.037 -9.036 1.00 0.00 H new ATOM 0 HB2 GLU A 78 15.662 0.701 -9.362 1.00 0.00 H new ATOM 0 HB3 GLU A 78 16.843 0.264 -8.143 1.00 0.00 H new ATOM 0 HG2 GLU A 78 18.639 0.302 -9.736 1.00 0.00 H new ATOM 0 HG3 GLU A 78 17.532 0.392 -11.092 1.00 0.00 H new ATOM 315 N LEU A 79 13.722 -1.315 -8.900 1.00 0.00 N ATOM 316 CA LEU A 79 12.491 -1.476 -8.131 1.00 0.00 C ATOM 317 C LEU A 79 12.378 -2.922 -7.661 1.00 0.00 C ATOM 318 O LEU A 79 11.995 -3.193 -6.525 1.00 0.00 O ATOM 319 CB LEU A 79 11.292 -1.069 -9.018 1.00 0.00 C ATOM 320 CG LEU A 79 9.896 -0.953 -8.365 1.00 0.00 C ATOM 321 CD1 LEU A 79 9.256 -2.325 -8.163 1.00 0.00 C ATOM 322 CD2 LEU A 79 9.867 -0.186 -7.044 1.00 0.00 C ATOM 0 H LEU A 79 13.561 -0.977 -9.849 1.00 0.00 H new ATOM 0 HA LEU A 79 12.499 -0.836 -7.249 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.527 -0.106 -9.471 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.219 -1.793 -9.829 1.00 0.00 H new ATOM 0 HG LEU A 79 9.318 -0.367 -9.079 1.00 0.00 H new ATOM 0 HD11 LEU A 79 8.276 -2.205 -7.702 1.00 0.00 H new ATOM 0 HD12 LEU A 79 9.145 -2.820 -9.128 1.00 0.00 H new ATOM 0 HD13 LEU A 79 9.890 -2.930 -7.515 1.00 0.00 H new ATOM 0 HD21 LEU A 79 8.846 -0.157 -6.662 1.00 0.00 H new ATOM 0 HD22 LEU A 79 10.511 -0.684 -6.320 1.00 0.00 H new ATOM 0 HD23 LEU A 79 10.223 0.832 -7.206 1.00 0.00 H new ATOM 334 N LYS A 80 12.730 -3.871 -8.538 1.00 0.00 N ATOM 335 CA LYS A 80 12.719 -5.271 -8.135 1.00 0.00 C ATOM 336 C LYS A 80 13.854 -5.481 -7.144 1.00 0.00 C ATOM 337 O LYS A 80 13.600 -6.028 -6.077 1.00 0.00 O ATOM 338 CB LYS A 80 12.766 -6.245 -9.331 1.00 0.00 C ATOM 339 CG LYS A 80 12.034 -7.577 -9.083 1.00 0.00 C ATOM 340 CD LYS A 80 12.363 -8.212 -7.731 1.00 0.00 C ATOM 341 CE LYS A 80 11.747 -9.580 -7.502 1.00 0.00 C ATOM 342 NZ LYS A 80 10.287 -9.495 -7.275 1.00 0.00 N ATOM 0 H LYS A 80 13.017 -3.697 -9.501 1.00 0.00 H new ATOM 0 HA LYS A 80 11.770 -5.503 -7.651 1.00 0.00 H new ATOM 0 HB2 LYS A 80 12.327 -5.757 -10.201 1.00 0.00 H new ATOM 0 HB3 LYS A 80 13.807 -6.454 -9.575 1.00 0.00 H new ATOM 0 HG2 LYS A 80 10.959 -7.408 -9.144 1.00 0.00 H new ATOM 0 HG3 LYS A 80 12.292 -8.278 -9.877 1.00 0.00 H new ATOM 0 HD2 LYS A 80 13.446 -8.297 -7.640 1.00 0.00 H new ATOM 0 HD3 LYS A 80 12.028 -7.541 -6.940 1.00 0.00 H new ATOM 0 HE2 LYS A 80 11.944 -10.216 -8.365 1.00 0.00 H new ATOM 0 HE3 LYS A 80 12.222 -10.053 -6.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 9.917 -10.438 -7.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 10.095 -8.841 -6.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 9.821 -9.146 -8.137 1.00 0.00 H new ATOM 356 N GLU A 81 15.080 -5.067 -7.469 1.00 0.00 N ATOM 357 CA GLU A 81 16.221 -5.295 -6.589 1.00 0.00 C ATOM 358 C GLU A 81 15.940 -4.776 -5.192 1.00 0.00 C ATOM 359 O GLU A 81 16.104 -5.527 -4.249 1.00 0.00 O ATOM 360 CB GLU A 81 17.518 -4.723 -7.174 1.00 0.00 C ATOM 361 CG GLU A 81 17.962 -5.699 -8.261 1.00 0.00 C ATOM 362 CD GLU A 81 19.277 -5.382 -8.961 1.00 0.00 C ATOM 363 OE1 GLU A 81 20.052 -4.512 -8.506 1.00 0.00 O ATOM 364 OE2 GLU A 81 19.537 -6.094 -9.959 1.00 0.00 O ATOM 0 H GLU A 81 15.305 -4.574 -8.333 1.00 0.00 H new ATOM 0 HA GLU A 81 16.371 -6.372 -6.511 1.00 0.00 H new ATOM 0 HB2 GLU A 81 17.353 -3.728 -7.588 1.00 0.00 H new ATOM 0 HB3 GLU A 81 18.282 -4.625 -6.403 1.00 0.00 H new ATOM 0 HG2 GLU A 81 18.042 -6.691 -7.817 1.00 0.00 H new ATOM 0 HG3 GLU A 81 17.177 -5.750 -9.016 1.00 0.00 H new ATOM 371 N PHE A 82 15.404 -3.574 -5.036 1.00 0.00 N ATOM 372 CA PHE A 82 15.082 -3.021 -3.738 1.00 0.00 C ATOM 373 C PHE A 82 14.185 -3.968 -2.930 1.00 0.00 C ATOM 374 O PHE A 82 14.554 -4.368 -1.830 1.00 0.00 O ATOM 375 CB PHE A 82 14.451 -1.647 -3.936 1.00 0.00 C ATOM 376 CG PHE A 82 14.424 -0.840 -2.662 1.00 0.00 C ATOM 377 CD1 PHE A 82 13.333 -0.942 -1.783 1.00 0.00 C ATOM 378 CD2 PHE A 82 15.520 -0.025 -2.332 1.00 0.00 C ATOM 379 CE1 PHE A 82 13.331 -0.217 -0.580 1.00 0.00 C ATOM 380 CE2 PHE A 82 15.511 0.705 -1.135 1.00 0.00 C ATOM 381 CZ PHE A 82 14.414 0.624 -0.268 1.00 0.00 C ATOM 0 H PHE A 82 15.181 -2.955 -5.815 1.00 0.00 H new ATOM 0 HA PHE A 82 15.993 -2.906 -3.151 1.00 0.00 H new ATOM 0 HB2 PHE A 82 15.007 -1.101 -4.698 1.00 0.00 H new ATOM 0 HB3 PHE A 82 13.434 -1.767 -4.309 1.00 0.00 H new ATOM 0 HD1 PHE A 82 12.496 -1.578 -2.032 1.00 0.00 H new ATOM 0 HD2 PHE A 82 16.367 0.039 -2.999 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.500 -0.305 0.104 1.00 0.00 H new ATOM 0 HE2 PHE A 82 16.353 1.332 -0.881 1.00 0.00 H new ATOM 0 HZ PHE A 82 14.400 1.208 0.641 1.00 0.00 H new ATOM 391 N GLN A 83 13.029 -4.364 -3.467 1.00 0.00 N ATOM 392 CA GLN A 83 12.104 -5.282 -2.801 1.00 0.00 C ATOM 393 C GLN A 83 12.728 -6.673 -2.573 1.00 0.00 C ATOM 394 O GLN A 83 12.402 -7.365 -1.606 1.00 0.00 O ATOM 395 CB GLN A 83 10.811 -5.321 -3.640 1.00 0.00 C ATOM 396 CG GLN A 83 9.780 -6.388 -3.232 1.00 0.00 C ATOM 397 CD GLN A 83 9.947 -7.666 -4.057 1.00 0.00 C ATOM 398 OE1 GLN A 83 9.552 -7.714 -5.225 1.00 0.00 O ATOM 399 NE2 GLN A 83 10.564 -8.696 -3.504 1.00 0.00 N ATOM 0 H GLN A 83 12.706 -4.054 -4.384 1.00 0.00 H new ATOM 0 HA GLN A 83 11.870 -4.928 -1.797 1.00 0.00 H new ATOM 0 HB2 GLN A 83 10.334 -4.342 -3.584 1.00 0.00 H new ATOM 0 HB3 GLN A 83 11.082 -5.485 -4.683 1.00 0.00 H new ATOM 0 HG2 GLN A 83 9.892 -6.619 -2.173 1.00 0.00 H new ATOM 0 HG3 GLN A 83 8.773 -5.994 -3.367 1.00 0.00 H new ATOM 0 HE21 GLN A 83 10.884 -8.640 -2.537 1.00 0.00 H new ATOM 0 HE22 GLN A 83 10.720 -9.547 -4.044 1.00 0.00 H new ATOM 408 N LEU A 84 13.587 -7.145 -3.472 1.00 0.00 N ATOM 409 CA LEU A 84 14.249 -8.420 -3.393 1.00 0.00 C ATOM 410 C LEU A 84 15.266 -8.374 -2.252 1.00 0.00 C ATOM 411 O LEU A 84 15.147 -9.133 -1.288 1.00 0.00 O ATOM 412 CB LEU A 84 14.848 -8.673 -4.786 1.00 0.00 C ATOM 413 CG LEU A 84 15.268 -10.117 -5.002 1.00 0.00 C ATOM 414 CD1 LEU A 84 15.557 -10.357 -6.490 1.00 0.00 C ATOM 415 CD2 LEU A 84 16.481 -10.534 -4.168 1.00 0.00 C ATOM 0 H LEU A 84 13.844 -6.618 -4.307 1.00 0.00 H new ATOM 0 HA LEU A 84 13.589 -9.254 -3.155 1.00 0.00 H new ATOM 0 HB2 LEU A 84 14.116 -8.397 -5.545 1.00 0.00 H new ATOM 0 HB3 LEU A 84 15.713 -8.025 -4.926 1.00 0.00 H new ATOM 0 HG LEU A 84 14.434 -10.734 -4.668 1.00 0.00 H new ATOM 0 HD11 LEU A 84 15.858 -11.394 -6.640 1.00 0.00 H new ATOM 0 HD12 LEU A 84 14.659 -10.152 -7.073 1.00 0.00 H new ATOM 0 HD13 LEU A 84 16.360 -9.696 -6.816 1.00 0.00 H new ATOM 0 HD21 LEU A 84 16.723 -11.577 -4.374 1.00 0.00 H new ATOM 0 HD22 LEU A 84 17.333 -9.906 -4.426 1.00 0.00 H new ATOM 0 HD23 LEU A 84 16.252 -10.417 -3.109 1.00 0.00 H new ATOM 427 N LEU A 85 16.242 -7.480 -2.357 1.00 0.00 N ATOM 428 CA LEU A 85 17.337 -7.269 -1.428 1.00 0.00 C ATOM 429 C LEU A 85 16.788 -6.964 -0.039 1.00 0.00 C ATOM 430 O LEU A 85 17.174 -7.653 0.895 1.00 0.00 O ATOM 431 CB LEU A 85 18.270 -6.152 -1.935 1.00 0.00 C ATOM 432 CG LEU A 85 18.933 -6.434 -3.305 1.00 0.00 C ATOM 433 CD1 LEU A 85 19.704 -5.204 -3.790 1.00 0.00 C ATOM 434 CD2 LEU A 85 19.838 -7.660 -3.288 1.00 0.00 C ATOM 0 H LEU A 85 16.289 -6.841 -3.150 1.00 0.00 H new ATOM 0 HA LEU A 85 17.932 -8.180 -1.360 1.00 0.00 H new ATOM 0 HB2 LEU A 85 17.700 -5.226 -2.007 1.00 0.00 H new ATOM 0 HB3 LEU A 85 19.053 -5.988 -1.195 1.00 0.00 H new ATOM 0 HG LEU A 85 18.126 -6.653 -4.004 1.00 0.00 H new ATOM 0 HD11 LEU A 85 20.164 -5.420 -4.754 1.00 0.00 H new ATOM 0 HD12 LEU A 85 19.019 -4.363 -3.895 1.00 0.00 H new ATOM 0 HD13 LEU A 85 20.479 -4.952 -3.067 1.00 0.00 H new ATOM 0 HD21 LEU A 85 20.273 -7.805 -4.277 1.00 0.00 H new ATOM 0 HD22 LEU A 85 20.635 -7.514 -2.559 1.00 0.00 H new ATOM 0 HD23 LEU A 85 19.254 -8.539 -3.016 1.00 0.00 H new ATOM 446 N LEU A 86 15.834 -6.039 0.116 1.00 0.00 N ATOM 447 CA LEU A 86 15.291 -5.645 1.415 1.00 0.00 C ATOM 448 C LEU A 86 14.670 -6.856 2.108 1.00 0.00 C ATOM 449 O LEU A 86 14.975 -7.137 3.269 1.00 0.00 O ATOM 450 CB LEU A 86 14.284 -4.499 1.209 1.00 0.00 C ATOM 451 CG LEU A 86 13.718 -3.832 2.477 1.00 0.00 C ATOM 452 CD1 LEU A 86 12.935 -2.585 2.051 1.00 0.00 C ATOM 453 CD2 LEU A 86 12.774 -4.746 3.265 1.00 0.00 C ATOM 0 H LEU A 86 15.414 -5.539 -0.668 1.00 0.00 H new ATOM 0 HA LEU A 86 16.083 -5.280 2.068 1.00 0.00 H new ATOM 0 HB2 LEU A 86 14.765 -3.729 0.607 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.447 -4.883 0.626 1.00 0.00 H new ATOM 0 HG LEU A 86 14.560 -3.593 3.127 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.524 -2.095 2.933 1.00 0.00 H new ATOM 0 HD12 LEU A 86 13.601 -1.897 1.531 1.00 0.00 H new ATOM 0 HD13 LEU A 86 12.122 -2.876 1.385 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.409 -4.219 4.146 1.00 0.00 H new ATOM 0 HD22 LEU A 86 11.930 -5.028 2.635 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.310 -5.643 3.575 1.00 0.00 H new ATOM 465 N ALA A 87 13.794 -7.595 1.420 1.00 0.00 N ATOM 466 CA ALA A 87 13.179 -8.771 2.022 1.00 0.00 C ATOM 467 C ALA A 87 14.213 -9.868 2.316 1.00 0.00 C ATOM 468 O ALA A 87 14.016 -10.622 3.270 1.00 0.00 O ATOM 469 CB ALA A 87 12.035 -9.284 1.147 1.00 0.00 C ATOM 0 H ALA A 87 13.502 -7.401 0.462 1.00 0.00 H new ATOM 0 HA ALA A 87 12.759 -8.477 2.984 1.00 0.00 H new ATOM 0 HB1 ALA A 87 11.587 -10.162 1.612 1.00 0.00 H new ATOM 0 HB2 ALA A 87 11.280 -8.505 1.041 1.00 0.00 H new ATOM 0 HB3 ALA A 87 12.421 -9.551 0.163 1.00 0.00 H new ATOM 475 N ASN A 88 15.309 -9.961 1.553 1.00 0.00 N ATOM 476 CA ASN A 88 16.432 -10.840 1.887 1.00 0.00 C ATOM 477 C ASN A 88 17.118 -10.346 3.169 1.00 0.00 C ATOM 478 O ASN A 88 17.325 -11.122 4.098 1.00 0.00 O ATOM 479 CB ASN A 88 17.423 -10.954 0.709 1.00 0.00 C ATOM 480 CG ASN A 88 18.547 -11.950 0.983 1.00 0.00 C ATOM 481 OD1 ASN A 88 18.536 -12.692 1.958 1.00 0.00 O ATOM 482 ND2 ASN A 88 19.583 -11.995 0.166 1.00 0.00 N ATOM 0 H ASN A 88 15.440 -9.431 0.691 1.00 0.00 H new ATOM 0 HA ASN A 88 16.051 -11.844 2.072 1.00 0.00 H new ATOM 0 HB2 ASN A 88 16.883 -11.259 -0.187 1.00 0.00 H new ATOM 0 HB3 ASN A 88 17.853 -9.974 0.504 1.00 0.00 H new ATOM 0 HD21 ASN A 88 20.352 -12.638 0.353 1.00 0.00 H new ATOM 0 HD22 ASN A 88 19.614 -11.387 -0.652 1.00 0.00 H new ATOM 489 N LYS A 89 17.409 -9.045 3.260 1.00 0.00 N ATOM 490 CA LYS A 89 18.024 -8.360 4.394 1.00 0.00 C ATOM 491 C LYS A 89 17.286 -8.705 5.678 1.00 0.00 C ATOM 492 O LYS A 89 17.888 -9.224 6.620 1.00 0.00 O ATOM 493 CB LYS A 89 18.022 -6.844 4.127 1.00 0.00 C ATOM 494 CG LYS A 89 19.187 -6.079 4.748 1.00 0.00 C ATOM 495 CD LYS A 89 19.223 -5.956 6.274 1.00 0.00 C ATOM 496 CE LYS A 89 20.450 -5.099 6.603 1.00 0.00 C ATOM 497 NZ LYS A 89 20.543 -4.716 8.024 1.00 0.00 N ATOM 0 H LYS A 89 17.207 -8.404 2.493 1.00 0.00 H new ATOM 0 HA LYS A 89 19.056 -8.689 4.514 1.00 0.00 H new ATOM 0 HB2 LYS A 89 18.032 -6.680 3.049 1.00 0.00 H new ATOM 0 HB3 LYS A 89 17.089 -6.425 4.504 1.00 0.00 H new ATOM 0 HG2 LYS A 89 20.112 -6.558 4.428 1.00 0.00 H new ATOM 0 HG3 LYS A 89 19.189 -5.072 4.330 1.00 0.00 H new ATOM 0 HD2 LYS A 89 18.311 -5.491 6.649 1.00 0.00 H new ATOM 0 HD3 LYS A 89 19.296 -6.937 6.742 1.00 0.00 H new ATOM 0 HE2 LYS A 89 21.350 -5.647 6.324 1.00 0.00 H new ATOM 0 HE3 LYS A 89 20.425 -4.196 5.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 21.395 -4.139 8.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 19.702 -4.166 8.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 20.598 -5.572 8.611 1.00 0.00 H new ATOM 511 N ALA A 90 15.983 -8.424 5.698 1.00 0.00 N ATOM 512 CA ALA A 90 15.108 -8.656 6.835 1.00 0.00 C ATOM 513 C ALA A 90 14.852 -10.145 7.086 1.00 0.00 C ATOM 514 O ALA A 90 14.456 -10.496 8.200 1.00 0.00 O ATOM 515 CB ALA A 90 13.781 -7.932 6.583 1.00 0.00 C ATOM 0 H ALA A 90 15.498 -8.017 4.898 1.00 0.00 H new ATOM 0 HA ALA A 90 15.599 -8.268 7.727 1.00 0.00 H new ATOM 0 HB1 ALA A 90 13.111 -8.095 7.427 1.00 0.00 H new ATOM 0 HB2 ALA A 90 13.965 -6.864 6.468 1.00 0.00 H new ATOM 0 HB3 ALA A 90 13.321 -8.321 5.675 1.00 0.00 H new ATOM 521 N HIS A 91 15.065 -10.994 6.071 1.00 0.00 N ATOM 522 CA HIS A 91 14.665 -12.394 5.969 1.00 0.00 C ATOM 523 C HIS A 91 13.406 -12.680 6.803 1.00 0.00 C ATOM 524 O HIS A 91 12.392 -12.006 6.626 1.00 0.00 O ATOM 525 CB HIS A 91 15.865 -13.350 6.166 1.00 0.00 C ATOM 526 CG HIS A 91 16.466 -13.458 7.549 1.00 0.00 C ATOM 527 ND1 HIS A 91 16.601 -14.628 8.266 1.00 0.00 N ATOM 528 CD2 HIS A 91 17.018 -12.449 8.293 1.00 0.00 C ATOM 529 CE1 HIS A 91 17.207 -14.324 9.428 1.00 0.00 C ATOM 530 NE2 HIS A 91 17.473 -13.010 9.490 1.00 0.00 N ATOM 0 H HIS A 91 15.563 -10.689 5.235 1.00 0.00 H new ATOM 0 HA HIS A 91 14.347 -12.608 4.949 1.00 0.00 H new ATOM 0 HB2 HIS A 91 15.551 -14.348 5.859 1.00 0.00 H new ATOM 0 HB3 HIS A 91 16.655 -13.040 5.482 1.00 0.00 H new ATOM 0 HD2 HIS A 91 17.089 -11.410 8.007 1.00 0.00 H new ATOM 0 HE1 HIS A 91 17.446 -15.038 10.203 1.00 0.00 H new ATOM 0 HE2 HIS A 91 17.921 -12.516 10.262 1.00 0.00 H new ATOM 538 N SER A 92 13.476 -13.681 7.678 1.00 0.00 N ATOM 539 CA SER A 92 12.651 -13.953 8.841 1.00 0.00 C ATOM 540 C SER A 92 11.246 -13.345 8.791 1.00 0.00 C ATOM 541 O SER A 92 10.944 -12.354 9.471 1.00 0.00 O ATOM 542 CB SER A 92 13.448 -13.637 10.120 1.00 0.00 C ATOM 543 OG SER A 92 13.423 -14.786 10.944 1.00 0.00 O ATOM 0 H SER A 92 14.194 -14.398 7.572 1.00 0.00 H new ATOM 0 HA SER A 92 12.423 -15.019 8.845 1.00 0.00 H new ATOM 0 HB2 SER A 92 14.475 -13.367 9.873 1.00 0.00 H new ATOM 0 HB3 SER A 92 13.011 -12.785 10.641 1.00 0.00 H new ATOM 0 HG SER A 92 13.927 -14.610 11.766 1.00 0.00 H new ATOM 549 N ARG A 93 10.353 -13.982 8.034 1.00 0.00 N ATOM 550 CA ARG A 93 8.918 -13.851 8.252 1.00 0.00 C ATOM 551 C ARG A 93 8.302 -15.241 8.160 1.00 0.00 C ATOM 552 O ARG A 93 7.443 -15.464 7.302 1.00 0.00 O ATOM 553 CB ARG A 93 8.280 -12.809 7.313 1.00 0.00 C ATOM 554 CG ARG A 93 6.820 -12.516 7.735 1.00 0.00 C ATOM 555 CD ARG A 93 5.871 -12.404 6.537 1.00 0.00 C ATOM 556 NE ARG A 93 4.496 -12.810 6.882 1.00 0.00 N ATOM 557 CZ ARG A 93 3.993 -14.044 6.732 1.00 0.00 C ATOM 558 NH1 ARG A 93 4.770 -15.067 6.403 1.00 0.00 N ATOM 559 NH2 ARG A 93 2.709 -14.285 6.927 1.00 0.00 N ATOM 0 H ARG A 93 10.603 -14.597 7.260 1.00 0.00 H new ATOM 0 HA ARG A 93 8.716 -13.455 9.247 1.00 0.00 H new ATOM 0 HB2 ARG A 93 8.862 -11.888 7.334 1.00 0.00 H new ATOM 0 HB3 ARG A 93 8.301 -13.175 6.287 1.00 0.00 H new ATOM 0 HG2 ARG A 93 6.471 -13.308 8.397 1.00 0.00 H new ATOM 0 HG3 ARG A 93 6.790 -11.588 8.305 1.00 0.00 H new ATOM 0 HD2 ARG A 93 5.865 -11.376 6.174 1.00 0.00 H new ATOM 0 HD3 ARG A 93 6.240 -13.028 5.723 1.00 0.00 H new ATOM 0 HE ARG A 93 3.878 -12.095 7.265 1.00 0.00 H new ATOM 0 HH11 ARG A 93 5.769 -14.923 6.259 1.00 0.00 H new ATOM 0 HH12 ARG A 93 4.368 -15.998 6.294 1.00 0.00 H new ATOM 0 HH21 ARG A 93 2.083 -13.526 7.196 1.00 0.00 H new ATOM 0 HH22 ARG A 93 2.344 -15.230 6.808 1.00 0.00 H new ATOM 573 N SER A 94 8.747 -16.146 9.035 1.00 0.00 N ATOM 574 CA SER A 94 8.146 -17.453 9.280 1.00 0.00 C ATOM 575 C SER A 94 7.869 -18.242 7.981 1.00 0.00 C ATOM 576 O SER A 94 8.530 -18.044 6.952 1.00 0.00 O ATOM 577 CB SER A 94 6.904 -17.223 10.165 1.00 0.00 C ATOM 578 OG SER A 94 7.234 -16.464 11.320 1.00 0.00 O ATOM 0 H SER A 94 9.570 -15.978 9.614 1.00 0.00 H new ATOM 0 HA SER A 94 8.843 -18.103 9.809 1.00 0.00 H new ATOM 0 HB2 SER A 94 6.136 -16.704 9.592 1.00 0.00 H new ATOM 0 HB3 SER A 94 6.484 -18.183 10.464 1.00 0.00 H new ATOM 0 HG SER A 94 6.430 -16.330 11.864 1.00 0.00 H new ATOM 584 N SER A 95 6.936 -19.192 8.037 1.00 0.00 N ATOM 585 CA SER A 95 6.400 -19.883 6.876 1.00 0.00 C ATOM 586 C SER A 95 5.847 -18.872 5.869 1.00 0.00 C ATOM 587 O SER A 95 5.377 -17.798 6.254 1.00 0.00 O ATOM 588 CB SER A 95 5.286 -20.816 7.349 1.00 0.00 C ATOM 589 OG SER A 95 5.799 -21.798 8.229 1.00 0.00 O ATOM 0 H SER A 95 6.525 -19.507 8.916 1.00 0.00 H new ATOM 0 HA SER A 95 7.187 -20.456 6.385 1.00 0.00 H new ATOM 0 HB2 SER A 95 4.510 -20.239 7.852 1.00 0.00 H new ATOM 0 HB3 SER A 95 4.819 -21.298 6.490 1.00 0.00 H new ATOM 0 HG SER A 95 5.072 -22.385 8.523 1.00 0.00 H new ATOM 595 N SER A 96 5.888 -19.222 4.589 1.00 0.00 N ATOM 596 CA SER A 96 5.299 -18.462 3.498 1.00 0.00 C ATOM 597 C SER A 96 3.766 -18.549 3.541 1.00 0.00 C ATOM 598 O SER A 96 3.193 -19.138 4.465 1.00 0.00 O ATOM 599 CB SER A 96 5.920 -18.972 2.189 1.00 0.00 C ATOM 600 OG SER A 96 7.330 -18.760 2.286 1.00 0.00 O ATOM 0 H SER A 96 6.350 -20.075 4.273 1.00 0.00 H new ATOM 0 HA SER A 96 5.519 -17.398 3.584 1.00 0.00 H new ATOM 0 HB2 SER A 96 5.698 -20.029 2.043 1.00 0.00 H new ATOM 0 HB3 SER A 96 5.508 -18.438 1.333 1.00 0.00 H new ATOM 0 HG SER A 96 7.765 -19.076 1.467 1.00 0.00 H new ATOM 606 N GLY A 97 3.084 -17.886 2.607 1.00 0.00 N ATOM 607 CA GLY A 97 1.631 -17.893 2.566 1.00 0.00 C ATOM 608 C GLY A 97 1.049 -17.180 1.351 1.00 0.00 C ATOM 609 O GLY A 97 -0.025 -17.592 0.922 1.00 0.00 O ATOM 0 H GLY A 97 3.522 -17.336 1.868 1.00 0.00 H new ATOM 0 HA2 GLY A 97 1.281 -18.925 2.573 1.00 0.00 H new ATOM 0 HA3 GLY A 97 1.248 -17.421 3.471 1.00 0.00 H new ATOM 613 N GLU A 98 1.736 -16.173 0.798 1.00 0.00 N ATOM 614 CA GLU A 98 1.489 -15.513 -0.485 1.00 0.00 C ATOM 615 C GLU A 98 0.009 -15.201 -0.776 1.00 0.00 C ATOM 616 O GLU A 98 -0.738 -16.027 -1.296 1.00 0.00 O ATOM 617 CB GLU A 98 2.230 -16.248 -1.607 1.00 0.00 C ATOM 618 CG GLU A 98 1.821 -17.714 -1.837 1.00 0.00 C ATOM 619 CD GLU A 98 2.686 -18.411 -2.882 1.00 0.00 C ATOM 620 OE1 GLU A 98 2.877 -17.826 -3.974 1.00 0.00 O ATOM 621 OE2 GLU A 98 3.134 -19.546 -2.595 1.00 0.00 O ATOM 0 H GLU A 98 2.542 -15.769 1.275 1.00 0.00 H new ATOM 0 HA GLU A 98 1.914 -14.511 -0.424 1.00 0.00 H new ATOM 0 HB2 GLU A 98 2.078 -15.699 -2.536 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.298 -16.219 -1.390 1.00 0.00 H new ATOM 0 HG2 GLU A 98 1.889 -18.258 -0.895 1.00 0.00 H new ATOM 0 HG3 GLU A 98 0.778 -17.751 -2.152 1.00 0.00 H new ATOM 628 N THR A 99 -0.437 -13.984 -0.452 1.00 0.00 N ATOM 629 CA THR A 99 -1.852 -13.644 -0.432 1.00 0.00 C ATOM 630 C THR A 99 -2.497 -13.613 -1.834 1.00 0.00 C ATOM 631 O THR A 99 -1.777 -13.526 -2.834 1.00 0.00 O ATOM 632 CB THR A 99 -2.018 -12.335 0.358 1.00 0.00 C ATOM 633 OG1 THR A 99 -1.061 -11.317 0.085 1.00 0.00 O ATOM 634 CG2 THR A 99 -1.941 -12.637 1.858 1.00 0.00 C ATOM 0 H THR A 99 0.177 -13.211 -0.197 1.00 0.00 H new ATOM 0 HA THR A 99 -2.406 -14.435 0.074 1.00 0.00 H new ATOM 0 HB THR A 99 -2.985 -11.947 0.039 1.00 0.00 H new ATOM 0 HG1 THR A 99 -1.255 -10.529 0.635 1.00 0.00 H new ATOM 0 HG21 THR A 99 -2.058 -11.712 2.422 1.00 0.00 H new ATOM 0 HG22 THR A 99 -2.736 -13.331 2.131 1.00 0.00 H new ATOM 0 HG23 THR A 99 -0.974 -13.083 2.090 1.00 0.00 H new ATOM 642 N PRO A 100 -3.840 -13.676 -1.936 1.00 0.00 N ATOM 643 CA PRO A 100 -4.560 -13.627 -3.208 1.00 0.00 C ATOM 644 C PRO A 100 -4.592 -12.198 -3.764 1.00 0.00 C ATOM 645 O PRO A 100 -3.888 -11.318 -3.266 1.00 0.00 O ATOM 646 CB PRO A 100 -5.936 -14.227 -2.893 1.00 0.00 C ATOM 647 CG PRO A 100 -6.186 -13.761 -1.465 1.00 0.00 C ATOM 648 CD PRO A 100 -4.792 -13.871 -0.847 1.00 0.00 C ATOM 0 HA PRO A 100 -4.083 -14.195 -4.007 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -6.702 -13.864 -3.577 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -5.931 -15.314 -2.969 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -6.569 -12.741 -1.430 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -6.911 -14.392 -0.951 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -4.652 -13.120 -0.070 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -4.651 -14.845 -0.378 1.00 0.00 H new ATOM 656 N ALA A 101 -5.385 -11.994 -4.819 1.00 0.00 N ATOM 657 CA ALA A 101 -5.421 -10.826 -5.699 1.00 0.00 C ATOM 658 C ALA A 101 -4.122 -10.683 -6.498 1.00 0.00 C ATOM 659 O ALA A 101 -3.185 -11.469 -6.309 1.00 0.00 O ATOM 660 CB ALA A 101 -5.792 -9.556 -4.927 1.00 0.00 C ATOM 0 H ALA A 101 -6.070 -12.695 -5.100 1.00 0.00 H new ATOM 0 HA ALA A 101 -6.213 -10.982 -6.432 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -5.810 -8.707 -5.610 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -6.776 -9.679 -4.476 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -5.054 -9.377 -4.145 1.00 0.00 H new ATOM 666 N GLN A 102 -4.079 -9.736 -7.440 1.00 0.00 N ATOM 667 CA GLN A 102 -2.862 -9.451 -8.187 1.00 0.00 C ATOM 668 C GLN A 102 -1.856 -8.834 -7.201 1.00 0.00 C ATOM 669 O GLN A 102 -2.240 -7.949 -6.429 1.00 0.00 O ATOM 670 CB GLN A 102 -3.130 -8.616 -9.455 1.00 0.00 C ATOM 671 CG GLN A 102 -3.811 -7.253 -9.257 1.00 0.00 C ATOM 672 CD GLN A 102 -3.878 -6.412 -10.544 1.00 0.00 C ATOM 673 OE1 GLN A 102 -3.243 -6.683 -11.560 1.00 0.00 O ATOM 674 NE2 GLN A 102 -4.692 -5.369 -10.552 1.00 0.00 N ATOM 0 H GLN A 102 -4.877 -9.156 -7.700 1.00 0.00 H new ATOM 0 HA GLN A 102 -2.427 -10.365 -8.593 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -2.178 -8.450 -9.960 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -3.748 -9.210 -10.128 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -4.822 -7.411 -8.882 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -3.272 -6.693 -8.493 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -5.226 -5.132 -9.716 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -4.786 -4.802 -11.395 1.00 0.00 H new ATOM 683 N PRO A 103 -0.620 -9.354 -7.129 1.00 0.00 N ATOM 684 CA PRO A 103 0.282 -9.067 -6.023 1.00 0.00 C ATOM 685 C PRO A 103 0.804 -7.634 -6.107 1.00 0.00 C ATOM 686 O PRO A 103 1.122 -7.131 -7.187 1.00 0.00 O ATOM 687 CB PRO A 103 1.390 -10.120 -6.123 1.00 0.00 C ATOM 688 CG PRO A 103 1.405 -10.479 -7.608 1.00 0.00 C ATOM 689 CD PRO A 103 -0.067 -10.383 -7.991 1.00 0.00 C ATOM 0 HA PRO A 103 -0.210 -9.126 -5.052 1.00 0.00 H new ATOM 0 HB2 PRO A 103 2.351 -9.724 -5.796 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.175 -10.989 -5.502 1.00 0.00 H new ATOM 0 HG2 PRO A 103 2.019 -9.788 -8.185 1.00 0.00 H new ATOM 0 HG3 PRO A 103 1.803 -11.479 -7.779 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -0.184 -10.120 -9.042 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -0.575 -11.336 -7.842 1.00 0.00 H new ATOM 697 N GLU A 104 0.920 -6.989 -4.952 1.00 0.00 N ATOM 698 CA GLU A 104 1.330 -5.609 -4.739 1.00 0.00 C ATOM 699 C GLU A 104 2.852 -5.444 -4.919 1.00 0.00 C ATOM 700 O GLU A 104 3.591 -5.004 -4.034 1.00 0.00 O ATOM 701 CB GLU A 104 0.761 -5.077 -3.412 1.00 0.00 C ATOM 702 CG GLU A 104 1.214 -5.778 -2.128 1.00 0.00 C ATOM 703 CD GLU A 104 0.518 -7.106 -1.818 1.00 0.00 C ATOM 704 OE1 GLU A 104 0.852 -8.131 -2.453 1.00 0.00 O ATOM 705 OE2 GLU A 104 -0.296 -7.160 -0.862 1.00 0.00 O ATOM 0 H GLU A 104 0.713 -7.457 -4.070 1.00 0.00 H new ATOM 0 HA GLU A 104 0.898 -4.971 -5.510 1.00 0.00 H new ATOM 0 HB2 GLU A 104 1.021 -4.022 -3.331 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -0.326 -5.134 -3.463 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.287 -5.957 -2.193 1.00 0.00 H new ATOM 0 HG3 GLU A 104 1.054 -5.100 -1.290 1.00 0.00 H new ATOM 712 N LYS A 105 3.340 -5.783 -6.109 1.00 0.00 N ATOM 713 CA LYS A 105 4.731 -5.647 -6.527 1.00 0.00 C ATOM 714 C LYS A 105 4.815 -5.031 -7.910 1.00 0.00 C ATOM 715 O LYS A 105 3.810 -4.879 -8.602 1.00 0.00 O ATOM 716 CB LYS A 105 5.453 -7.003 -6.504 1.00 0.00 C ATOM 717 CG LYS A 105 4.672 -8.139 -7.173 1.00 0.00 C ATOM 718 CD LYS A 105 5.565 -9.356 -7.433 1.00 0.00 C ATOM 719 CE LYS A 105 4.664 -10.516 -7.854 1.00 0.00 C ATOM 720 NZ LYS A 105 5.402 -11.737 -8.219 1.00 0.00 N ATOM 0 H LYS A 105 2.749 -6.178 -6.841 1.00 0.00 H new ATOM 0 HA LYS A 105 5.228 -4.985 -5.818 1.00 0.00 H new ATOM 0 HB2 LYS A 105 6.417 -6.898 -7.001 1.00 0.00 H new ATOM 0 HB3 LYS A 105 5.656 -7.277 -5.469 1.00 0.00 H new ATOM 0 HG2 LYS A 105 3.835 -8.430 -6.538 1.00 0.00 H new ATOM 0 HG3 LYS A 105 4.251 -7.787 -8.115 1.00 0.00 H new ATOM 0 HD2 LYS A 105 6.293 -9.135 -8.213 1.00 0.00 H new ATOM 0 HD3 LYS A 105 6.128 -9.615 -6.536 1.00 0.00 H new ATOM 0 HE2 LYS A 105 3.979 -10.747 -7.038 1.00 0.00 H new ATOM 0 HE3 LYS A 105 4.056 -10.203 -8.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 4.729 -12.481 -8.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 6.037 -11.533 -9.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 5.962 -12.061 -7.405 1.00 0.00 H new ATOM 734 N THR A 106 6.048 -4.753 -8.322 1.00 0.00 N ATOM 735 CA THR A 106 6.512 -4.222 -9.599 1.00 0.00 C ATOM 736 C THR A 106 6.054 -2.803 -9.885 1.00 0.00 C ATOM 737 O THR A 106 6.807 -2.069 -10.523 1.00 0.00 O ATOM 738 CB THR A 106 6.449 -5.230 -10.779 1.00 0.00 C ATOM 739 OG1 THR A 106 5.408 -5.014 -11.708 1.00 0.00 O ATOM 740 CG2 THR A 106 6.360 -6.702 -10.362 1.00 0.00 C ATOM 0 H THR A 106 6.837 -4.913 -7.696 1.00 0.00 H new ATOM 0 HA THR A 106 7.588 -4.094 -9.481 1.00 0.00 H new ATOM 0 HB THR A 106 7.409 -5.028 -11.254 1.00 0.00 H new ATOM 0 HG1 THR A 106 5.451 -5.695 -12.412 1.00 0.00 H new ATOM 0 HG21 THR A 106 6.320 -7.330 -11.252 1.00 0.00 H new ATOM 0 HG22 THR A 106 7.236 -6.966 -9.770 1.00 0.00 H new ATOM 0 HG23 THR A 106 5.460 -6.858 -9.767 1.00 0.00 H new ATOM 748 N SER A 107 4.925 -2.370 -9.331 1.00 0.00 N ATOM 749 CA SER A 107 4.557 -0.968 -9.381 1.00 0.00 C ATOM 750 C SER A 107 5.104 -0.277 -8.131 1.00 0.00 C ATOM 751 O SER A 107 4.994 -0.826 -7.034 1.00 0.00 O ATOM 752 CB SER A 107 3.037 -0.785 -9.503 1.00 0.00 C ATOM 753 OG SER A 107 2.388 -1.868 -10.157 1.00 0.00 O ATOM 0 H SER A 107 4.257 -2.969 -8.847 1.00 0.00 H new ATOM 0 HA SER A 107 4.993 -0.512 -10.270 1.00 0.00 H new ATOM 0 HB2 SER A 107 2.612 -0.665 -8.507 1.00 0.00 H new ATOM 0 HB3 SER A 107 2.832 0.135 -10.050 1.00 0.00 H new ATOM 0 HG SER A 107 1.425 -1.693 -10.202 1.00 0.00 H new ATOM 759 N GLY A 108 5.667 0.923 -8.288 1.00 0.00 N ATOM 760 CA GLY A 108 6.350 1.665 -7.231 1.00 0.00 C ATOM 761 C GLY A 108 5.499 1.810 -5.976 1.00 0.00 C ATOM 762 O GLY A 108 5.890 1.397 -4.885 1.00 0.00 O ATOM 0 H GLY A 108 5.659 1.418 -9.180 1.00 0.00 H new ATOM 0 HA2 GLY A 108 7.281 1.157 -6.978 1.00 0.00 H new ATOM 0 HA3 GLY A 108 6.617 2.655 -7.601 1.00 0.00 H new ATOM 766 N MET A 109 4.310 2.391 -6.144 1.00 0.00 N ATOM 767 CA MET A 109 3.385 2.647 -5.045 1.00 0.00 C ATOM 768 C MET A 109 2.946 1.370 -4.326 1.00 0.00 C ATOM 769 O MET A 109 2.708 1.413 -3.124 1.00 0.00 O ATOM 770 CB MET A 109 2.170 3.453 -5.539 1.00 0.00 C ATOM 771 CG MET A 109 1.428 2.752 -6.685 1.00 0.00 C ATOM 772 SD MET A 109 -0.158 3.466 -7.197 1.00 0.00 S ATOM 773 CE MET A 109 0.380 5.116 -7.700 1.00 0.00 C ATOM 0 H MET A 109 3.962 2.698 -7.052 1.00 0.00 H new ATOM 0 HA MET A 109 3.925 3.241 -4.308 1.00 0.00 H new ATOM 0 HB2 MET A 109 1.482 3.613 -4.709 1.00 0.00 H new ATOM 0 HB3 MET A 109 2.501 4.436 -5.872 1.00 0.00 H new ATOM 0 HG2 MET A 109 2.087 2.732 -7.553 1.00 0.00 H new ATOM 0 HG3 MET A 109 1.255 1.716 -6.393 1.00 0.00 H new ATOM 0 HE1 MET A 109 -0.463 5.659 -8.127 1.00 0.00 H new ATOM 0 HE2 MET A 109 0.757 5.656 -6.832 1.00 0.00 H new ATOM 0 HE3 MET A 109 1.171 5.029 -8.445 1.00 0.00 H new ATOM 783 N GLU A 110 2.866 0.232 -5.015 1.00 0.00 N ATOM 784 CA GLU A 110 2.308 -0.965 -4.407 1.00 0.00 C ATOM 785 C GLU A 110 3.266 -1.544 -3.363 1.00 0.00 C ATOM 786 O GLU A 110 2.821 -2.109 -2.362 1.00 0.00 O ATOM 787 CB GLU A 110 1.985 -1.998 -5.504 1.00 0.00 C ATOM 788 CG GLU A 110 0.493 -2.133 -5.825 1.00 0.00 C ATOM 789 CD GLU A 110 -0.071 -0.890 -6.508 1.00 0.00 C ATOM 790 OE1 GLU A 110 -0.484 0.040 -5.787 1.00 0.00 O ATOM 791 OE2 GLU A 110 -0.104 -0.875 -7.763 1.00 0.00 O ATOM 0 H GLU A 110 3.177 0.118 -5.980 1.00 0.00 H new ATOM 0 HA GLU A 110 1.384 -0.705 -3.890 1.00 0.00 H new ATOM 0 HB2 GLU A 110 2.517 -1.722 -6.414 1.00 0.00 H new ATOM 0 HB3 GLU A 110 2.367 -2.971 -5.194 1.00 0.00 H new ATOM 0 HG2 GLU A 110 0.340 -2.999 -6.469 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -0.059 -2.320 -4.904 1.00 0.00 H new ATOM 798 N VAL A 111 4.578 -1.349 -3.531 1.00 0.00 N ATOM 799 CA VAL A 111 5.541 -1.791 -2.531 1.00 0.00 C ATOM 800 C VAL A 111 5.350 -0.986 -1.231 1.00 0.00 C ATOM 801 O VAL A 111 5.631 -1.514 -0.156 1.00 0.00 O ATOM 802 CB VAL A 111 6.987 -1.746 -3.081 1.00 0.00 C ATOM 803 CG1 VAL A 111 7.922 -2.571 -2.181 1.00 0.00 C ATOM 804 CG2 VAL A 111 7.097 -2.335 -4.500 1.00 0.00 C ATOM 0 H VAL A 111 4.990 -0.892 -4.344 1.00 0.00 H new ATOM 0 HA VAL A 111 5.358 -2.838 -2.288 1.00 0.00 H new ATOM 0 HB VAL A 111 7.270 -0.694 -3.103 1.00 0.00 H new ATOM 0 HG11 VAL A 111 8.937 -2.532 -2.578 1.00 0.00 H new ATOM 0 HG12 VAL A 111 7.911 -2.160 -1.171 1.00 0.00 H new ATOM 0 HG13 VAL A 111 7.582 -3.606 -2.155 1.00 0.00 H new ATOM 0 HG21 VAL A 111 8.132 -2.279 -4.838 1.00 0.00 H new ATOM 0 HG22 VAL A 111 6.775 -3.376 -4.488 1.00 0.00 H new ATOM 0 HG23 VAL A 111 6.462 -1.767 -5.180 1.00 0.00 H new ATOM 814 N ALA A 112 4.799 0.238 -1.279 1.00 0.00 N ATOM 815 CA ALA A 112 4.434 0.983 -0.076 1.00 0.00 C ATOM 816 C ALA A 112 3.307 0.261 0.669 1.00 0.00 C ATOM 817 O ALA A 112 3.411 0.021 1.878 1.00 0.00 O ATOM 818 CB ALA A 112 4.021 2.417 -0.429 1.00 0.00 C ATOM 0 H ALA A 112 4.598 0.731 -2.149 1.00 0.00 H new ATOM 0 HA ALA A 112 5.305 1.036 0.578 1.00 0.00 H new ATOM 0 HB1 ALA A 112 3.753 2.953 0.482 1.00 0.00 H new ATOM 0 HB2 ALA A 112 4.852 2.925 -0.918 1.00 0.00 H new ATOM 0 HB3 ALA A 112 3.164 2.394 -1.101 1.00 0.00 H new ATOM 824 N SER A 113 2.248 -0.125 -0.053 1.00 0.00 N ATOM 825 CA SER A 113 1.144 -0.908 0.489 1.00 0.00 C ATOM 826 C SER A 113 1.633 -2.215 1.125 1.00 0.00 C ATOM 827 O SER A 113 1.032 -2.668 2.100 1.00 0.00 O ATOM 828 CB SER A 113 0.098 -1.169 -0.607 1.00 0.00 C ATOM 829 OG SER A 113 -0.488 0.061 -0.984 1.00 0.00 O ATOM 0 H SER A 113 2.138 0.103 -1.041 1.00 0.00 H new ATOM 0 HA SER A 113 0.674 -0.331 1.285 1.00 0.00 H new ATOM 0 HB2 SER A 113 0.566 -1.643 -1.469 1.00 0.00 H new ATOM 0 HB3 SER A 113 -0.667 -1.855 -0.242 1.00 0.00 H new ATOM 0 HG SER A 113 0.085 0.800 -0.690 1.00 0.00 H new ATOM 835 N TYR A 114 2.717 -2.814 0.633 1.00 0.00 N ATOM 836 CA TYR A 114 3.279 -4.026 1.216 1.00 0.00 C ATOM 837 C TYR A 114 4.173 -3.714 2.426 1.00 0.00 C ATOM 838 O TYR A 114 4.036 -4.368 3.459 1.00 0.00 O ATOM 839 CB TYR A 114 3.970 -4.843 0.112 1.00 0.00 C ATOM 840 CG TYR A 114 5.225 -5.581 0.515 1.00 0.00 C ATOM 841 CD1 TYR A 114 5.175 -6.884 1.043 1.00 0.00 C ATOM 842 CD2 TYR A 114 6.459 -4.940 0.350 1.00 0.00 C ATOM 843 CE1 TYR A 114 6.360 -7.539 1.416 1.00 0.00 C ATOM 844 CE2 TYR A 114 7.646 -5.588 0.709 1.00 0.00 C ATOM 845 CZ TYR A 114 7.607 -6.889 1.259 1.00 0.00 C ATOM 846 OH TYR A 114 8.762 -7.521 1.600 1.00 0.00 O ATOM 0 H TYR A 114 3.228 -2.471 -0.180 1.00 0.00 H new ATOM 0 HA TYR A 114 2.482 -4.647 1.624 1.00 0.00 H new ATOM 0 HB2 TYR A 114 3.255 -5.569 -0.275 1.00 0.00 H new ATOM 0 HB3 TYR A 114 4.217 -4.170 -0.709 1.00 0.00 H new ATOM 0 HD1 TYR A 114 4.224 -7.381 1.162 1.00 0.00 H new ATOM 0 HD2 TYR A 114 6.495 -3.940 -0.057 1.00 0.00 H new ATOM 0 HE1 TYR A 114 6.319 -8.539 1.823 1.00 0.00 H new ATOM 0 HE2 TYR A 114 8.595 -5.092 0.565 1.00 0.00 H new ATOM 0 HH TYR A 114 9.523 -6.928 1.426 1.00 0.00 H new ATOM 856 N LEU A 115 5.081 -2.737 2.344 1.00 0.00 N ATOM 857 CA LEU A 115 6.081 -2.502 3.385 1.00 0.00 C ATOM 858 C LEU A 115 5.439 -1.989 4.666 1.00 0.00 C ATOM 859 O LEU A 115 5.773 -2.483 5.743 1.00 0.00 O ATOM 860 CB LEU A 115 7.168 -1.527 2.902 1.00 0.00 C ATOM 861 CG LEU A 115 8.253 -2.184 2.034 1.00 0.00 C ATOM 862 CD1 LEU A 115 9.202 -1.114 1.495 1.00 0.00 C ATOM 863 CD2 LEU A 115 9.077 -3.245 2.779 1.00 0.00 C ATOM 0 H LEU A 115 5.142 -2.091 1.557 1.00 0.00 H new ATOM 0 HA LEU A 115 6.553 -3.460 3.603 1.00 0.00 H new ATOM 0 HB2 LEU A 115 6.697 -0.726 2.333 1.00 0.00 H new ATOM 0 HB3 LEU A 115 7.640 -1.066 3.770 1.00 0.00 H new ATOM 0 HG LEU A 115 7.729 -2.691 1.224 1.00 0.00 H new ATOM 0 HD11 LEU A 115 9.969 -1.585 0.880 1.00 0.00 H new ATOM 0 HD12 LEU A 115 8.641 -0.400 0.892 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.674 -0.593 2.328 1.00 0.00 H new ATOM 0 HD21 LEU A 115 9.823 -3.666 2.105 1.00 0.00 H new ATOM 0 HD22 LEU A 115 9.577 -2.785 3.632 1.00 0.00 H new ATOM 0 HD23 LEU A 115 8.417 -4.038 3.130 1.00 0.00 H new ATOM 875 N VAL A 116 4.503 -1.042 4.579 1.00 0.00 N ATOM 876 CA VAL A 116 3.795 -0.556 5.767 1.00 0.00 C ATOM 877 C VAL A 116 2.952 -1.698 6.376 1.00 0.00 C ATOM 878 O VAL A 116 2.794 -1.743 7.598 1.00 0.00 O ATOM 879 CB VAL A 116 3.013 0.743 5.447 1.00 0.00 C ATOM 880 CG1 VAL A 116 2.428 1.350 6.728 1.00 0.00 C ATOM 881 CG2 VAL A 116 3.939 1.811 4.837 1.00 0.00 C ATOM 0 H VAL A 116 4.218 -0.598 3.706 1.00 0.00 H new ATOM 0 HA VAL A 116 4.503 -0.266 6.544 1.00 0.00 H new ATOM 0 HB VAL A 116 2.225 0.470 4.745 1.00 0.00 H new ATOM 0 HG11 VAL A 116 1.883 2.261 6.483 1.00 0.00 H new ATOM 0 HG12 VAL A 116 1.749 0.635 7.192 1.00 0.00 H new ATOM 0 HG13 VAL A 116 3.236 1.586 7.421 1.00 0.00 H new ATOM 0 HG21 VAL A 116 3.364 2.712 4.622 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.735 2.048 5.543 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.375 1.430 3.913 1.00 0.00 H new ATOM 891 N ALA A 117 2.490 -2.671 5.575 1.00 0.00 N ATOM 892 CA ALA A 117 1.774 -3.853 6.060 1.00 0.00 C ATOM 893 C ALA A 117 2.694 -4.922 6.671 1.00 0.00 C ATOM 894 O ALA A 117 2.191 -5.861 7.291 1.00 0.00 O ATOM 895 CB ALA A 117 0.957 -4.469 4.922 1.00 0.00 C ATOM 0 H ALA A 117 2.606 -2.655 4.562 1.00 0.00 H new ATOM 0 HA ALA A 117 1.119 -3.509 6.861 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.427 -5.348 5.289 1.00 0.00 H new ATOM 0 HB2 ALA A 117 0.237 -3.738 4.554 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.625 -4.760 4.111 1.00 0.00 H new ATOM 901 N GLN A 118 4.015 -4.834 6.492 1.00 0.00 N ATOM 902 CA GLN A 118 4.982 -5.638 7.230 1.00 0.00 C ATOM 903 C GLN A 118 5.411 -4.916 8.508 1.00 0.00 C ATOM 904 O GLN A 118 5.517 -5.537 9.567 1.00 0.00 O ATOM 905 CB GLN A 118 6.216 -5.880 6.351 1.00 0.00 C ATOM 906 CG GLN A 118 5.968 -6.835 5.181 1.00 0.00 C ATOM 907 CD GLN A 118 5.718 -8.263 5.659 1.00 0.00 C ATOM 908 OE1 GLN A 118 6.447 -8.815 6.482 1.00 0.00 O ATOM 909 NE2 GLN A 118 4.670 -8.890 5.167 1.00 0.00 N ATOM 0 H GLN A 118 4.443 -4.195 5.823 1.00 0.00 H new ATOM 0 HA GLN A 118 4.519 -6.588 7.497 1.00 0.00 H new ATOM 0 HB2 GLN A 118 6.564 -4.924 5.959 1.00 0.00 H new ATOM 0 HB3 GLN A 118 7.018 -6.281 6.971 1.00 0.00 H new ATOM 0 HG2 GLN A 118 5.110 -6.489 4.605 1.00 0.00 H new ATOM 0 HG3 GLN A 118 6.828 -6.821 4.512 1.00 0.00 H new ATOM 0 HE21 GLN A 118 4.071 -8.425 4.485 1.00 0.00 H new ATOM 0 HE22 GLN A 118 4.457 -9.841 5.468 1.00 0.00 H new ATOM 918 N TYR A 119 5.727 -3.624 8.406 1.00 0.00 N ATOM 919 CA TYR A 119 6.594 -2.953 9.371 1.00 0.00 C ATOM 920 C TYR A 119 5.972 -1.775 10.108 1.00 0.00 C ATOM 921 O TYR A 119 6.533 -1.339 11.117 1.00 0.00 O ATOM 922 CB TYR A 119 7.834 -2.476 8.612 1.00 0.00 C ATOM 923 CG TYR A 119 8.691 -3.616 8.113 1.00 0.00 C ATOM 924 CD1 TYR A 119 9.179 -4.569 9.027 1.00 0.00 C ATOM 925 CD2 TYR A 119 8.875 -3.802 6.732 1.00 0.00 C ATOM 926 CE1 TYR A 119 9.768 -5.752 8.559 1.00 0.00 C ATOM 927 CE2 TYR A 119 9.472 -4.982 6.258 1.00 0.00 C ATOM 928 CZ TYR A 119 9.890 -5.979 7.171 1.00 0.00 C ATOM 929 OH TYR A 119 10.317 -7.190 6.726 1.00 0.00 O ATOM 0 H TYR A 119 5.391 -3.018 7.657 1.00 0.00 H new ATOM 0 HA TYR A 119 6.817 -3.680 10.152 1.00 0.00 H new ATOM 0 HB2 TYR A 119 7.523 -1.864 7.765 1.00 0.00 H new ATOM 0 HB3 TYR A 119 8.430 -1.838 9.264 1.00 0.00 H new ATOM 0 HD1 TYR A 119 9.100 -4.389 10.089 1.00 0.00 H new ATOM 0 HD2 TYR A 119 8.558 -3.039 6.036 1.00 0.00 H new ATOM 0 HE1 TYR A 119 10.128 -6.490 9.260 1.00 0.00 H new ATOM 0 HE2 TYR A 119 9.612 -5.128 5.197 1.00 0.00 H new ATOM 0 HH TYR A 119 10.346 -7.187 5.746 1.00 0.00 H new ATOM 939 N GLY A 120 4.863 -1.231 9.612 1.00 0.00 N ATOM 940 CA GLY A 120 4.381 0.058 10.039 1.00 0.00 C ATOM 941 C GLY A 120 5.365 1.166 9.660 1.00 0.00 C ATOM 942 O GLY A 120 6.487 0.946 9.201 1.00 0.00 O ATOM 0 H GLY A 120 4.282 -1.680 8.904 1.00 0.00 H new ATOM 0 HA2 GLY A 120 3.411 0.257 9.583 1.00 0.00 H new ATOM 0 HA3 GLY A 120 4.231 0.054 11.119 1.00 0.00 H new ATOM 946 N GLU A 121 4.909 2.387 9.889 1.00 0.00 N ATOM 947 CA GLU A 121 5.582 3.660 9.613 1.00 0.00 C ATOM 948 C GLU A 121 6.979 3.796 10.260 1.00 0.00 C ATOM 949 O GLU A 121 7.737 4.682 9.862 1.00 0.00 O ATOM 950 CB GLU A 121 4.645 4.818 10.033 1.00 0.00 C ATOM 951 CG GLU A 121 4.090 5.664 8.873 1.00 0.00 C ATOM 952 CD GLU A 121 4.843 6.983 8.660 1.00 0.00 C ATOM 953 OE1 GLU A 121 6.096 6.973 8.580 1.00 0.00 O ATOM 954 OE2 GLU A 121 4.188 8.040 8.494 1.00 0.00 O ATOM 0 H GLU A 121 3.989 2.532 10.304 1.00 0.00 H new ATOM 0 HA GLU A 121 5.778 3.699 8.541 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.807 4.402 10.592 1.00 0.00 H new ATOM 0 HB3 GLU A 121 5.187 5.474 10.714 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.133 5.079 7.955 1.00 0.00 H new ATOM 0 HG3 GLU A 121 3.039 5.882 9.064 1.00 0.00 H new ATOM 961 N GLN A 122 7.376 2.930 11.200 1.00 0.00 N ATOM 962 CA GLN A 122 8.756 2.842 11.655 1.00 0.00 C ATOM 963 C GLN A 122 9.614 2.131 10.603 1.00 0.00 C ATOM 964 O GLN A 122 10.227 2.790 9.758 1.00 0.00 O ATOM 965 CB GLN A 122 8.806 2.130 13.017 1.00 0.00 C ATOM 966 CG GLN A 122 8.296 2.973 14.199 1.00 0.00 C ATOM 967 CD GLN A 122 6.931 2.515 14.711 1.00 0.00 C ATOM 968 OE1 GLN A 122 6.783 1.389 15.183 1.00 0.00 O ATOM 969 NE2 GLN A 122 5.910 3.352 14.634 1.00 0.00 N ATOM 0 H GLN A 122 6.746 2.274 11.662 1.00 0.00 H new ATOM 0 HA GLN A 122 9.167 3.843 11.786 1.00 0.00 H new ATOM 0 HB2 GLN A 122 8.214 1.217 12.957 1.00 0.00 H new ATOM 0 HB3 GLN A 122 9.835 1.831 13.218 1.00 0.00 H new ATOM 0 HG2 GLN A 122 9.019 2.923 15.013 1.00 0.00 H new ATOM 0 HG3 GLN A 122 8.232 4.017 13.893 1.00 0.00 H new ATOM 0 HE21 GLN A 122 6.043 4.284 14.241 1.00 0.00 H new ATOM 0 HE22 GLN A 122 4.990 3.066 14.968 1.00 0.00 H new ATOM 978 N ARG A 123 9.702 0.794 10.653 1.00 0.00 N ATOM 979 CA ARG A 123 10.667 0.056 9.835 1.00 0.00 C ATOM 980 C ARG A 123 10.347 0.135 8.344 1.00 0.00 C ATOM 981 O ARG A 123 11.245 -0.151 7.552 1.00 0.00 O ATOM 982 CB ARG A 123 10.815 -1.409 10.298 1.00 0.00 C ATOM 983 CG ARG A 123 11.906 -1.637 11.344 1.00 0.00 C ATOM 984 CD ARG A 123 11.521 -1.031 12.694 1.00 0.00 C ATOM 985 NE ARG A 123 12.246 -1.693 13.783 1.00 0.00 N ATOM 986 CZ ARG A 123 13.271 -1.224 14.493 1.00 0.00 C ATOM 987 NH1 ARG A 123 13.664 0.037 14.388 1.00 0.00 N ATOM 988 NH2 ARG A 123 13.911 -2.055 15.301 1.00 0.00 N ATOM 0 H ARG A 123 9.119 0.207 11.249 1.00 0.00 H new ATOM 0 HA ARG A 123 11.629 0.546 9.982 1.00 0.00 H new ATOM 0 HB2 ARG A 123 9.862 -1.746 10.706 1.00 0.00 H new ATOM 0 HB3 ARG A 123 11.027 -2.032 9.429 1.00 0.00 H new ATOM 0 HG2 ARG A 123 12.082 -2.706 11.461 1.00 0.00 H new ATOM 0 HG3 ARG A 123 12.841 -1.196 10.999 1.00 0.00 H new ATOM 0 HD2 ARG A 123 11.745 0.036 12.697 1.00 0.00 H new ATOM 0 HD3 ARG A 123 10.447 -1.132 12.851 1.00 0.00 H new ATOM 0 HE ARG A 123 11.925 -2.630 14.028 1.00 0.00 H new ATOM 0 HH11 ARG A 123 13.179 0.671 13.753 1.00 0.00 H new ATOM 0 HH12 ARG A 123 14.452 0.374 14.942 1.00 0.00 H new ATOM 0 HH21 ARG A 123 13.616 -3.029 15.369 1.00 0.00 H new ATOM 0 HH22 ARG A 123 14.699 -1.721 15.856 1.00 0.00 H new ATOM 1002 N ALA A 124 9.144 0.537 7.916 1.00 0.00 N ATOM 1003 CA ALA A 124 8.876 0.723 6.488 1.00 0.00 C ATOM 1004 C ALA A 124 9.751 1.821 5.862 1.00 0.00 C ATOM 1005 O ALA A 124 9.827 1.896 4.635 1.00 0.00 O ATOM 1006 CB ALA A 124 7.387 0.975 6.226 1.00 0.00 C ATOM 0 H ALA A 124 8.353 0.737 8.528 1.00 0.00 H new ATOM 0 HA ALA A 124 9.148 -0.210 5.995 1.00 0.00 H new ATOM 0 HB1 ALA A 124 7.223 1.109 5.157 1.00 0.00 H new ATOM 0 HB2 ALA A 124 6.806 0.123 6.578 1.00 0.00 H new ATOM 0 HB3 ALA A 124 7.071 1.873 6.757 1.00 0.00 H new ATOM 1012 N TRP A 125 10.458 2.614 6.680 1.00 0.00 N ATOM 1013 CA TRP A 125 11.557 3.450 6.229 1.00 0.00 C ATOM 1014 C TRP A 125 12.864 2.987 6.837 1.00 0.00 C ATOM 1015 O TRP A 125 13.800 2.717 6.098 1.00 0.00 O ATOM 1016 CB TRP A 125 11.257 4.929 6.492 1.00 0.00 C ATOM 1017 CG TRP A 125 11.757 5.918 5.479 1.00 0.00 C ATOM 1018 CD1 TRP A 125 12.203 7.157 5.781 1.00 0.00 C ATOM 1019 CD2 TRP A 125 11.795 5.833 4.015 1.00 0.00 C ATOM 1020 NE1 TRP A 125 12.399 7.878 4.619 1.00 0.00 N ATOM 1021 CE2 TRP A 125 12.110 7.129 3.497 1.00 0.00 C ATOM 1022 CE3 TRP A 125 11.588 4.818 3.053 1.00 0.00 C ATOM 1023 CZ2 TRP A 125 12.101 7.413 2.117 1.00 0.00 C ATOM 1024 CZ3 TRP A 125 11.644 5.084 1.687 1.00 0.00 C ATOM 1025 CH2 TRP A 125 11.834 6.377 1.202 1.00 0.00 C ATOM 0 H TRP A 125 10.274 2.687 7.681 1.00 0.00 H new ATOM 0 HA TRP A 125 11.666 3.347 5.149 1.00 0.00 H new ATOM 0 HB2 TRP A 125 10.176 5.046 6.574 1.00 0.00 H new ATOM 0 HB3 TRP A 125 11.681 5.193 7.461 1.00 0.00 H new ATOM 0 HD1 TRP A 125 12.380 7.528 6.780 1.00 0.00 H new ATOM 0 HE1 TRP A 125 12.719 8.846 4.594 1.00 0.00 H new ATOM 0 HE3 TRP A 125 11.381 3.811 3.386 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 12.297 8.415 1.765 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 11.538 4.269 0.987 1.00 0.00 H new ATOM 0 HH2 TRP A 125 11.777 6.580 0.143 1.00 0.00 H new ATOM 1036 N ASP A 126 12.919 2.830 8.156 1.00 0.00 N ATOM 1037 CA ASP A 126 14.162 2.609 8.895 1.00 0.00 C ATOM 1038 C ASP A 126 14.984 1.424 8.373 1.00 0.00 C ATOM 1039 O ASP A 126 16.211 1.480 8.355 1.00 0.00 O ATOM 1040 CB ASP A 126 13.820 2.404 10.385 1.00 0.00 C ATOM 1041 CG ASP A 126 14.736 3.159 11.344 1.00 0.00 C ATOM 1042 OD1 ASP A 126 15.222 4.255 11.005 1.00 0.00 O ATOM 1043 OD2 ASP A 126 14.832 2.740 12.525 1.00 0.00 O ATOM 0 H ASP A 126 12.091 2.853 8.752 1.00 0.00 H new ATOM 0 HA ASP A 126 14.788 3.490 8.754 1.00 0.00 H new ATOM 0 HB2 ASP A 126 12.791 2.720 10.557 1.00 0.00 H new ATOM 0 HB3 ASP A 126 13.869 1.340 10.615 1.00 0.00 H new ATOM 1048 N LEU A 127 14.333 0.345 7.920 1.00 0.00 N ATOM 1049 CA LEU A 127 14.986 -0.817 7.330 1.00 0.00 C ATOM 1050 C LEU A 127 15.306 -0.498 5.870 1.00 0.00 C ATOM 1051 O LEU A 127 16.433 -0.688 5.414 1.00 0.00 O ATOM 1052 CB LEU A 127 14.058 -2.030 7.553 1.00 0.00 C ATOM 1053 CG LEU A 127 13.924 -3.103 6.462 1.00 0.00 C ATOM 1054 CD1 LEU A 127 15.261 -3.734 6.103 1.00 0.00 C ATOM 1055 CD2 LEU A 127 12.945 -4.165 6.985 1.00 0.00 C ATOM 0 H LEU A 127 13.317 0.260 7.957 1.00 0.00 H new ATOM 0 HA LEU A 127 15.941 -1.067 7.792 1.00 0.00 H new ATOM 0 HB2 LEU A 127 14.392 -2.531 8.462 1.00 0.00 H new ATOM 0 HB3 LEU A 127 13.059 -1.642 7.751 1.00 0.00 H new ATOM 0 HG LEU A 127 13.554 -2.644 5.545 1.00 0.00 H new ATOM 0 HD11 LEU A 127 15.112 -4.486 5.328 1.00 0.00 H new ATOM 0 HD12 LEU A 127 15.940 -2.964 5.736 1.00 0.00 H new ATOM 0 HD13 LEU A 127 15.690 -4.205 6.987 1.00 0.00 H new ATOM 0 HD21 LEU A 127 12.823 -4.947 6.236 1.00 0.00 H new ATOM 0 HD22 LEU A 127 13.337 -4.601 7.904 1.00 0.00 H new ATOM 0 HD23 LEU A 127 11.979 -3.702 7.187 1.00 0.00 H new ATOM 1067 N ALA A 128 14.313 0.013 5.146 1.00 0.00 N ATOM 1068 CA ALA A 128 14.402 0.359 3.740 1.00 0.00 C ATOM 1069 C ALA A 128 15.596 1.280 3.439 1.00 0.00 C ATOM 1070 O ALA A 128 16.272 1.041 2.441 1.00 0.00 O ATOM 1071 CB ALA A 128 13.057 0.952 3.313 1.00 0.00 C ATOM 0 H ALA A 128 13.392 0.202 5.542 1.00 0.00 H new ATOM 0 HA ALA A 128 14.598 -0.535 3.149 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.097 1.221 2.258 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.269 0.216 3.470 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.847 1.842 3.907 1.00 0.00 H new ATOM 1077 N LEU A 129 15.916 2.238 4.318 1.00 0.00 N ATOM 1078 CA LEU A 129 17.037 3.171 4.225 1.00 0.00 C ATOM 1079 C LEU A 129 18.344 2.460 3.859 1.00 0.00 C ATOM 1080 O LEU A 129 19.033 2.870 2.924 1.00 0.00 O ATOM 1081 CB LEU A 129 17.192 3.930 5.568 1.00 0.00 C ATOM 1082 CG LEU A 129 16.701 5.389 5.601 1.00 0.00 C ATOM 1083 CD1 LEU A 129 17.369 6.280 4.555 1.00 0.00 C ATOM 1084 CD2 LEU A 129 15.190 5.524 5.489 1.00 0.00 C ATOM 0 H LEU A 129 15.364 2.388 5.162 1.00 0.00 H new ATOM 0 HA LEU A 129 16.822 3.880 3.426 1.00 0.00 H new ATOM 0 HB2 LEU A 129 16.656 3.374 6.337 1.00 0.00 H new ATOM 0 HB3 LEU A 129 18.246 3.920 5.844 1.00 0.00 H new ATOM 0 HG LEU A 129 17.002 5.738 6.589 1.00 0.00 H new ATOM 0 HD11 LEU A 129 16.976 7.293 4.636 1.00 0.00 H new ATOM 0 HD12 LEU A 129 18.446 6.294 4.723 1.00 0.00 H new ATOM 0 HD13 LEU A 129 17.163 5.889 3.559 1.00 0.00 H new ATOM 0 HD21 LEU A 129 14.916 6.578 5.519 1.00 0.00 H new ATOM 0 HD22 LEU A 129 14.855 5.089 4.548 1.00 0.00 H new ATOM 0 HD23 LEU A 129 14.715 5.002 6.320 1.00 0.00 H new ATOM 1096 N HIS A 130 18.678 1.368 4.559 1.00 0.00 N ATOM 1097 CA HIS A 130 19.900 0.603 4.297 1.00 0.00 C ATOM 1098 C HIS A 130 19.942 0.122 2.839 1.00 0.00 C ATOM 1099 O HIS A 130 21.017 0.046 2.249 1.00 0.00 O ATOM 1100 CB HIS A 130 20.036 -0.573 5.298 1.00 0.00 C ATOM 1101 CG HIS A 130 20.610 -1.840 4.698 1.00 0.00 C ATOM 1102 ND1 HIS A 130 21.906 -2.307 4.769 1.00 0.00 N ATOM 1103 CD2 HIS A 130 19.951 -2.625 3.795 1.00 0.00 C ATOM 1104 CE1 HIS A 130 22.026 -3.320 3.892 1.00 0.00 C ATOM 1105 NE2 HIS A 130 20.856 -3.550 3.274 1.00 0.00 N ATOM 0 H HIS A 130 18.110 0.993 5.319 1.00 0.00 H new ATOM 0 HA HIS A 130 20.758 1.259 4.446 1.00 0.00 H new ATOM 0 HB2 HIS A 130 20.670 -0.258 6.127 1.00 0.00 H new ATOM 0 HB3 HIS A 130 19.054 -0.795 5.715 1.00 0.00 H new ATOM 0 HD2 HIS A 130 18.907 -2.543 3.530 1.00 0.00 H new ATOM 0 HE1 HIS A 130 22.937 -3.872 3.710 1.00 0.00 H new ATOM 0 HE2 HIS A 130 20.667 -4.259 2.566 1.00 0.00 H new ATOM 1113 N THR A 131 18.800 -0.243 2.248 1.00 0.00 N ATOM 1114 CA THR A 131 18.779 -0.946 0.966 1.00 0.00 C ATOM 1115 C THR A 131 19.260 -0.024 -0.156 1.00 0.00 C ATOM 1116 O THR A 131 19.769 -0.495 -1.170 1.00 0.00 O ATOM 1117 CB THR A 131 17.380 -1.532 0.715 1.00 0.00 C ATOM 1118 OG1 THR A 131 17.001 -2.310 1.840 1.00 0.00 O ATOM 1119 CG2 THR A 131 17.311 -2.407 -0.542 1.00 0.00 C ATOM 0 H THR A 131 17.876 -0.061 2.640 1.00 0.00 H new ATOM 0 HA THR A 131 19.474 -1.786 0.990 1.00 0.00 H new ATOM 0 HB THR A 131 16.701 -0.694 0.560 1.00 0.00 H new ATOM 0 HG1 THR A 131 16.027 -2.420 1.848 1.00 0.00 H new ATOM 0 HG21 THR A 131 16.298 -2.790 -0.663 1.00 0.00 H new ATOM 0 HG22 THR A 131 17.581 -1.812 -1.415 1.00 0.00 H new ATOM 0 HG23 THR A 131 18.005 -3.242 -0.443 1.00 0.00 H new ATOM 1127 N TRP A 132 19.195 1.290 0.050 1.00 0.00 N ATOM 1128 CA TRP A 132 19.807 2.232 -0.879 1.00 0.00 C ATOM 1129 C TRP A 132 21.327 2.116 -0.862 1.00 0.00 C ATOM 1130 O TRP A 132 21.949 2.257 -1.909 1.00 0.00 O ATOM 1131 CB TRP A 132 19.424 3.665 -0.540 1.00 0.00 C ATOM 1132 CG TRP A 132 17.970 3.999 -0.547 1.00 0.00 C ATOM 1133 CD1 TRP A 132 17.332 4.623 0.461 1.00 0.00 C ATOM 1134 CD2 TRP A 132 16.961 3.762 -1.576 1.00 0.00 C ATOM 1135 NE1 TRP A 132 16.014 4.811 0.119 1.00 0.00 N ATOM 1136 CE2 TRP A 132 15.720 4.296 -1.121 1.00 0.00 C ATOM 1137 CE3 TRP A 132 16.953 3.125 -2.834 1.00 0.00 C ATOM 1138 CZ2 TRP A 132 14.541 4.231 -1.880 1.00 0.00 C ATOM 1139 CZ3 TRP A 132 15.774 3.032 -3.596 1.00 0.00 C ATOM 1140 CH2 TRP A 132 14.574 3.596 -3.131 1.00 0.00 C ATOM 0 H TRP A 132 18.728 1.722 0.847 1.00 0.00 H new ATOM 0 HA TRP A 132 19.436 1.982 -1.873 1.00 0.00 H new ATOM 0 HB2 TRP A 132 19.820 3.896 0.449 1.00 0.00 H new ATOM 0 HB3 TRP A 132 19.926 4.326 -1.246 1.00 0.00 H new ATOM 0 HD1 TRP A 132 17.785 4.928 1.393 1.00 0.00 H new ATOM 0 HE1 TRP A 132 15.333 5.279 0.717 1.00 0.00 H new ATOM 0 HE3 TRP A 132 17.868 2.701 -3.219 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 13.624 4.663 -1.507 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 15.791 2.522 -4.548 1.00 0.00 H new ATOM 0 HH2 TRP A 132 13.680 3.541 -3.734 1.00 0.00 H new ATOM 1151 N GLU A 133 21.930 1.845 0.302 1.00 0.00 N ATOM 1152 CA GLU A 133 23.364 1.607 0.415 1.00 0.00 C ATOM 1153 C GLU A 133 23.715 0.356 -0.392 1.00 0.00 C ATOM 1154 O GLU A 133 24.671 0.380 -1.166 1.00 0.00 O ATOM 1155 CB GLU A 133 23.783 1.473 1.893 1.00 0.00 C ATOM 1156 CG GLU A 133 25.248 1.884 2.101 1.00 0.00 C ATOM 1157 CD GLU A 133 25.788 1.513 3.489 1.00 0.00 C ATOM 1158 OE1 GLU A 133 25.052 1.630 4.497 1.00 0.00 O ATOM 1159 OE2 GLU A 133 26.963 1.076 3.556 1.00 0.00 O ATOM 0 H GLU A 133 21.432 1.786 1.190 1.00 0.00 H new ATOM 0 HA GLU A 133 23.916 2.456 0.011 1.00 0.00 H new ATOM 0 HB2 GLU A 133 23.138 2.095 2.513 1.00 0.00 H new ATOM 0 HB3 GLU A 133 23.643 0.443 2.220 1.00 0.00 H new ATOM 0 HG2 GLU A 133 25.864 1.407 1.339 1.00 0.00 H new ATOM 0 HG3 GLU A 133 25.341 2.961 1.958 1.00 0.00 H new ATOM 1166 N GLN A 134 22.897 -0.695 -0.265 1.00 0.00 N ATOM 1167 CA GLN A 134 23.021 -1.954 -0.990 1.00 0.00 C ATOM 1168 C GLN A 134 22.921 -1.744 -2.510 1.00 0.00 C ATOM 1169 O GLN A 134 23.775 -2.253 -3.232 1.00 0.00 O ATOM 1170 CB GLN A 134 21.976 -2.959 -0.453 1.00 0.00 C ATOM 1171 CG GLN A 134 22.601 -4.229 0.145 1.00 0.00 C ATOM 1172 CD GLN A 134 23.075 -5.202 -0.932 1.00 0.00 C ATOM 1173 OE1 GLN A 134 22.301 -6.018 -1.418 1.00 0.00 O ATOM 1174 NE2 GLN A 134 24.335 -5.157 -1.324 1.00 0.00 N ATOM 0 H GLN A 134 22.101 -0.686 0.372 1.00 0.00 H new ATOM 0 HA GLN A 134 24.012 -2.374 -0.817 1.00 0.00 H new ATOM 0 HB2 GLN A 134 21.369 -2.469 0.308 1.00 0.00 H new ATOM 0 HB3 GLN A 134 21.304 -3.241 -1.264 1.00 0.00 H new ATOM 0 HG2 GLN A 134 23.444 -3.953 0.779 1.00 0.00 H new ATOM 0 HG3 GLN A 134 21.870 -4.725 0.784 1.00 0.00 H new ATOM 0 HE21 GLN A 134 24.973 -4.474 -0.914 1.00 0.00 H new ATOM 0 HE22 GLN A 134 24.671 -5.805 -2.037 1.00 0.00 H new ATOM 1183 N MET A 135 21.922 -0.994 -3.001 1.00 0.00 N ATOM 1184 CA MET A 135 21.779 -0.695 -4.431 1.00 0.00 C ATOM 1185 C MET A 135 22.771 0.374 -4.924 1.00 0.00 C ATOM 1186 O MET A 135 22.845 0.631 -6.125 1.00 0.00 O ATOM 1187 CB MET A 135 20.352 -0.221 -4.761 1.00 0.00 C ATOM 1188 CG MET A 135 19.246 -1.239 -4.490 1.00 0.00 C ATOM 1189 SD MET A 135 17.881 -1.212 -5.683 1.00 0.00 S ATOM 1190 CE MET A 135 17.476 0.559 -5.768 1.00 0.00 C ATOM 0 H MET A 135 21.194 -0.580 -2.419 1.00 0.00 H new ATOM 0 HA MET A 135 21.996 -1.631 -4.946 1.00 0.00 H new ATOM 0 HB2 MET A 135 20.143 0.680 -4.183 1.00 0.00 H new ATOM 0 HB3 MET A 135 20.315 0.060 -5.814 1.00 0.00 H new ATOM 0 HG2 MET A 135 19.684 -2.237 -4.482 1.00 0.00 H new ATOM 0 HG3 MET A 135 18.843 -1.060 -3.493 1.00 0.00 H new ATOM 0 HE1 MET A 135 16.428 0.680 -6.044 1.00 0.00 H new ATOM 0 HE2 MET A 135 17.651 1.019 -4.796 1.00 0.00 H new ATOM 0 HE3 MET A 135 18.106 1.041 -6.516 1.00 0.00 H new ATOM 1200 N GLY A 136 23.489 1.061 -4.033 1.00 0.00 N ATOM 1201 CA GLY A 136 24.425 2.118 -4.391 1.00 0.00 C ATOM 1202 C GLY A 136 23.788 3.503 -4.581 1.00 0.00 C ATOM 1203 O GLY A 136 24.530 4.462 -4.830 1.00 0.00 O ATOM 0 H GLY A 136 23.432 0.893 -3.029 1.00 0.00 H new ATOM 0 HA2 GLY A 136 25.188 2.187 -3.615 1.00 0.00 H new ATOM 0 HA3 GLY A 136 24.933 1.837 -5.313 1.00 0.00 H new ATOM 1207 N LEU A 137 22.463 3.653 -4.443 1.00 0.00 N ATOM 1208 CA LEU A 137 21.700 4.857 -4.790 1.00 0.00 C ATOM 1209 C LEU A 137 21.856 5.900 -3.687 1.00 0.00 C ATOM 1210 O LEU A 137 21.014 6.041 -2.794 1.00 0.00 O ATOM 1211 CB LEU A 137 20.200 4.544 -4.990 1.00 0.00 C ATOM 1212 CG LEU A 137 19.763 3.990 -6.357 1.00 0.00 C ATOM 1213 CD1 LEU A 137 19.942 5.003 -7.479 1.00 0.00 C ATOM 1214 CD2 LEU A 137 20.522 2.733 -6.732 1.00 0.00 C ATOM 0 H LEU A 137 21.872 2.909 -4.072 1.00 0.00 H new ATOM 0 HA LEU A 137 22.095 5.242 -5.730 1.00 0.00 H new ATOM 0 HB2 LEU A 137 19.902 3.826 -4.226 1.00 0.00 H new ATOM 0 HB3 LEU A 137 19.638 5.459 -4.804 1.00 0.00 H new ATOM 0 HG LEU A 137 18.704 3.760 -6.244 1.00 0.00 H new ATOM 0 HD11 LEU A 137 19.619 4.562 -8.422 1.00 0.00 H new ATOM 0 HD12 LEU A 137 19.343 5.889 -7.268 1.00 0.00 H new ATOM 0 HD13 LEU A 137 20.993 5.284 -7.551 1.00 0.00 H new ATOM 0 HD21 LEU A 137 20.180 2.378 -7.704 1.00 0.00 H new ATOM 0 HD22 LEU A 137 21.589 2.953 -6.780 1.00 0.00 H new ATOM 0 HD23 LEU A 137 20.344 1.963 -5.981 1.00 0.00 H new ATOM 1226 N ARG A 138 22.953 6.651 -3.752 1.00 0.00 N ATOM 1227 CA ARG A 138 23.296 7.608 -2.712 1.00 0.00 C ATOM 1228 C ARG A 138 22.245 8.695 -2.622 1.00 0.00 C ATOM 1229 O ARG A 138 21.799 9.004 -1.515 1.00 0.00 O ATOM 1230 CB ARG A 138 24.690 8.209 -2.959 1.00 0.00 C ATOM 1231 CG ARG A 138 25.471 8.257 -1.644 1.00 0.00 C ATOM 1232 CD ARG A 138 26.962 8.463 -1.899 1.00 0.00 C ATOM 1233 NE ARG A 138 27.736 8.382 -0.652 1.00 0.00 N ATOM 1234 CZ ARG A 138 28.065 7.251 -0.015 1.00 0.00 C ATOM 1235 NH1 ARG A 138 27.728 6.066 -0.514 1.00 0.00 N ATOM 1236 NH2 ARG A 138 28.718 7.286 1.139 1.00 0.00 N ATOM 0 H ARG A 138 23.622 6.612 -4.521 1.00 0.00 H new ATOM 0 HA ARG A 138 23.323 7.082 -1.758 1.00 0.00 H new ATOM 0 HB2 ARG A 138 25.230 7.610 -3.692 1.00 0.00 H new ATOM 0 HB3 ARG A 138 24.596 9.212 -3.374 1.00 0.00 H new ATOM 0 HG2 ARG A 138 25.090 9.066 -1.020 1.00 0.00 H new ATOM 0 HG3 ARG A 138 25.318 7.330 -1.092 1.00 0.00 H new ATOM 0 HD2 ARG A 138 27.320 7.710 -2.601 1.00 0.00 H new ATOM 0 HD3 ARG A 138 27.122 9.435 -2.366 1.00 0.00 H new ATOM 0 HE ARG A 138 28.048 9.260 -0.238 1.00 0.00 H new ATOM 0 HH11 ARG A 138 27.213 6.010 -1.392 1.00 0.00 H new ATOM 0 HH12 ARG A 138 27.985 5.212 -0.019 1.00 0.00 H new ATOM 0 HH21 ARG A 138 28.976 8.182 1.552 1.00 0.00 H new ATOM 0 HH22 ARG A 138 28.962 6.417 1.613 1.00 0.00 H new ATOM 1250 N SER A 139 21.860 9.278 -3.756 1.00 0.00 N ATOM 1251 CA SER A 139 21.020 10.458 -3.748 1.00 0.00 C ATOM 1252 C SER A 139 19.605 10.135 -3.258 1.00 0.00 C ATOM 1253 O SER A 139 19.031 10.966 -2.568 1.00 0.00 O ATOM 1254 CB SER A 139 21.036 11.152 -5.112 1.00 0.00 C ATOM 1255 OG SER A 139 22.361 11.289 -5.602 1.00 0.00 O ATOM 0 H SER A 139 22.119 8.948 -4.686 1.00 0.00 H new ATOM 0 HA SER A 139 21.434 11.168 -3.032 1.00 0.00 H new ATOM 0 HB2 SER A 139 20.440 10.578 -5.822 1.00 0.00 H new ATOM 0 HB3 SER A 139 20.573 12.135 -5.028 1.00 0.00 H new ATOM 0 HG SER A 139 22.343 11.734 -6.475 1.00 0.00 H new ATOM 1261 N LEU A 140 19.053 8.939 -3.503 1.00 0.00 N ATOM 1262 CA LEU A 140 17.762 8.552 -2.925 1.00 0.00 C ATOM 1263 C LEU A 140 17.848 8.523 -1.402 1.00 0.00 C ATOM 1264 O LEU A 140 17.006 9.102 -0.715 1.00 0.00 O ATOM 1265 CB LEU A 140 17.312 7.170 -3.419 1.00 0.00 C ATOM 1266 CG LEU A 140 17.141 7.030 -4.939 1.00 0.00 C ATOM 1267 CD1 LEU A 140 16.773 5.587 -5.239 1.00 0.00 C ATOM 1268 CD2 LEU A 140 16.099 8.000 -5.525 1.00 0.00 C ATOM 0 H LEU A 140 19.479 8.226 -4.095 1.00 0.00 H new ATOM 0 HA LEU A 140 17.032 9.295 -3.245 1.00 0.00 H new ATOM 0 HB2 LEU A 140 18.039 6.430 -3.084 1.00 0.00 H new ATOM 0 HB3 LEU A 140 16.364 6.924 -2.941 1.00 0.00 H new ATOM 0 HG LEU A 140 18.083 7.297 -5.419 1.00 0.00 H new ATOM 0 HD11 LEU A 140 16.645 5.460 -6.314 1.00 0.00 H new ATOM 0 HD12 LEU A 140 17.567 4.928 -4.888 1.00 0.00 H new ATOM 0 HD13 LEU A 140 15.842 5.336 -4.731 1.00 0.00 H new ATOM 0 HD21 LEU A 140 16.027 7.849 -6.602 1.00 0.00 H new ATOM 0 HD22 LEU A 140 15.128 7.812 -5.066 1.00 0.00 H new ATOM 0 HD23 LEU A 140 16.403 9.027 -5.322 1.00 0.00 H new ATOM 1280 N CYS A 141 18.882 7.870 -0.866 1.00 0.00 N ATOM 1281 CA CYS A 141 19.103 7.797 0.571 1.00 0.00 C ATOM 1282 C CYS A 141 19.315 9.197 1.159 1.00 0.00 C ATOM 1283 O CYS A 141 18.894 9.464 2.285 1.00 0.00 O ATOM 1284 CB CYS A 141 20.312 6.891 0.825 1.00 0.00 C ATOM 1285 SG CYS A 141 20.252 6.207 2.501 1.00 0.00 S ATOM 0 H CYS A 141 19.585 7.380 -1.419 1.00 0.00 H new ATOM 0 HA CYS A 141 18.227 7.377 1.065 1.00 0.00 H new ATOM 0 HB2 CYS A 141 20.326 6.081 0.096 1.00 0.00 H new ATOM 0 HB3 CYS A 141 21.233 7.458 0.690 1.00 0.00 H new ATOM 0 HG CYS A 141 19.764 5.003 2.461 1.00 0.00 H new ATOM 1291 N ALA A 142 19.954 10.089 0.397 1.00 0.00 N ATOM 1292 CA ALA A 142 20.150 11.483 0.751 1.00 0.00 C ATOM 1293 C ALA A 142 18.787 12.172 0.825 1.00 0.00 C ATOM 1294 O ALA A 142 18.436 12.727 1.862 1.00 0.00 O ATOM 1295 CB ALA A 142 21.113 12.140 -0.250 1.00 0.00 C ATOM 0 H ALA A 142 20.358 9.846 -0.508 1.00 0.00 H new ATOM 0 HA ALA A 142 20.613 11.578 1.733 1.00 0.00 H new ATOM 0 HB1 ALA A 142 21.258 13.186 0.018 1.00 0.00 H new ATOM 0 HB2 ALA A 142 22.072 11.623 -0.225 1.00 0.00 H new ATOM 0 HB3 ALA A 142 20.693 12.078 -1.254 1.00 0.00 H new ATOM 1301 N GLN A 143 17.971 12.077 -0.224 1.00 0.00 N ATOM 1302 CA GLN A 143 16.637 12.669 -0.307 1.00 0.00 C ATOM 1303 C GLN A 143 15.705 12.137 0.789 1.00 0.00 C ATOM 1304 O GLN A 143 14.776 12.838 1.192 1.00 0.00 O ATOM 1305 CB GLN A 143 16.058 12.418 -1.710 1.00 0.00 C ATOM 1306 CG GLN A 143 16.796 13.220 -2.792 1.00 0.00 C ATOM 1307 CD GLN A 143 16.957 12.489 -4.121 1.00 0.00 C ATOM 1308 OE1 GLN A 143 16.147 11.658 -4.517 1.00 0.00 O ATOM 1309 NE2 GLN A 143 18.009 12.808 -4.862 1.00 0.00 N ATOM 0 H GLN A 143 18.230 11.568 -1.069 1.00 0.00 H new ATOM 0 HA GLN A 143 16.721 13.743 -0.142 1.00 0.00 H new ATOM 0 HB2 GLN A 143 16.120 11.355 -1.942 1.00 0.00 H new ATOM 0 HB3 GLN A 143 15.001 12.685 -1.719 1.00 0.00 H new ATOM 0 HG2 GLN A 143 16.257 14.151 -2.967 1.00 0.00 H new ATOM 0 HG3 GLN A 143 17.784 13.488 -2.417 1.00 0.00 H new ATOM 0 HE21 GLN A 143 18.679 13.500 -4.526 1.00 0.00 H new ATOM 0 HE22 GLN A 143 18.149 12.361 -5.768 1.00 0.00 H new ATOM 1318 N ALA A 144 15.956 10.932 1.306 1.00 0.00 N ATOM 1319 CA ALA A 144 15.257 10.364 2.449 1.00 0.00 C ATOM 1320 C ALA A 144 15.646 11.010 3.791 1.00 0.00 C ATOM 1321 O ALA A 144 14.954 10.750 4.776 1.00 0.00 O ATOM 1322 CB ALA A 144 15.495 8.852 2.482 1.00 0.00 C ATOM 0 H ALA A 144 16.672 10.312 0.927 1.00 0.00 H new ATOM 0 HA ALA A 144 14.196 10.576 2.320 1.00 0.00 H new ATOM 0 HB1 ALA A 144 14.974 8.420 3.336 1.00 0.00 H new ATOM 0 HB2 ALA A 144 15.118 8.404 1.563 1.00 0.00 H new ATOM 0 HB3 ALA A 144 16.563 8.654 2.571 1.00 0.00 H new ATOM 1328 N GLN A 145 16.705 11.827 3.873 1.00 0.00 N ATOM 1329 CA GLN A 145 17.306 12.317 5.120 1.00 0.00 C ATOM 1330 C GLN A 145 17.666 13.812 5.047 1.00 0.00 C ATOM 1331 O GLN A 145 18.255 14.353 5.984 1.00 0.00 O ATOM 1332 CB GLN A 145 18.554 11.462 5.424 1.00 0.00 C ATOM 1333 CG GLN A 145 18.182 10.079 5.979 1.00 0.00 C ATOM 1334 CD GLN A 145 19.375 9.132 6.008 1.00 0.00 C ATOM 1335 OE1 GLN A 145 19.956 8.839 7.050 1.00 0.00 O ATOM 1336 NE2 GLN A 145 19.769 8.608 4.864 1.00 0.00 N ATOM 0 H GLN A 145 17.183 12.177 3.043 1.00 0.00 H new ATOM 0 HA GLN A 145 16.577 12.221 5.925 1.00 0.00 H new ATOM 0 HB2 GLN A 145 19.141 11.341 4.514 1.00 0.00 H new ATOM 0 HB3 GLN A 145 19.185 11.984 6.144 1.00 0.00 H new ATOM 0 HG2 GLN A 145 17.783 10.189 6.987 1.00 0.00 H new ATOM 0 HG3 GLN A 145 17.390 9.645 5.368 1.00 0.00 H new ATOM 0 HE21 GLN A 145 19.287 8.851 3.999 1.00 0.00 H new ATOM 0 HE22 GLN A 145 20.556 7.959 4.844 1.00 0.00 H new ATOM 1345 N GLU A 146 17.354 14.503 3.946 1.00 0.00 N ATOM 1346 CA GLU A 146 17.888 15.843 3.679 1.00 0.00 C ATOM 1347 C GLU A 146 16.827 16.853 3.232 1.00 0.00 C ATOM 1348 O GLU A 146 17.144 18.009 2.931 1.00 0.00 O ATOM 1349 CB GLU A 146 19.058 15.712 2.700 1.00 0.00 C ATOM 1350 CG GLU A 146 18.619 15.757 1.232 1.00 0.00 C ATOM 1351 CD GLU A 146 19.727 15.356 0.256 1.00 0.00 C ATOM 1352 OE1 GLU A 146 20.915 15.481 0.625 1.00 0.00 O ATOM 1353 OE2 GLU A 146 19.414 14.992 -0.902 1.00 0.00 O ATOM 0 H GLU A 146 16.729 14.153 3.220 1.00 0.00 H new ATOM 0 HA GLU A 146 18.253 16.267 4.614 1.00 0.00 H new ATOM 0 HB2 GLU A 146 19.771 16.515 2.885 1.00 0.00 H new ATOM 0 HB3 GLU A 146 19.579 14.774 2.889 1.00 0.00 H new ATOM 0 HG2 GLU A 146 17.766 15.093 1.095 1.00 0.00 H new ATOM 0 HG3 GLU A 146 18.280 16.765 0.992 1.00 0.00 H new ATOM 1360 N GLY A 147 15.575 16.414 3.133 1.00 0.00 N ATOM 1361 CA GLY A 147 14.459 17.235 2.684 1.00 0.00 C ATOM 1362 C GLY A 147 14.682 17.813 1.289 1.00 0.00 C ATOM 1363 O GLY A 147 14.268 18.944 1.021 1.00 0.00 O ATOM 0 H GLY A 147 15.305 15.459 3.368 1.00 0.00 H new ATOM 0 HA2 GLY A 147 13.548 16.636 2.684 1.00 0.00 H new ATOM 0 HA3 GLY A 147 14.304 18.050 3.391 1.00 0.00 H new ATOM 1367 N ALA A 148 15.378 17.085 0.409 1.00 0.00 N ATOM 1368 CA ALA A 148 15.476 17.421 -1.005 1.00 0.00 C ATOM 1369 C ALA A 148 14.156 17.028 -1.675 1.00 0.00 C ATOM 1370 O ALA A 148 14.056 16.018 -2.375 1.00 0.00 O ATOM 1371 CB ALA A 148 16.702 16.758 -1.638 1.00 0.00 C ATOM 0 H ALA A 148 15.891 16.241 0.665 1.00 0.00 H new ATOM 0 HA ALA A 148 15.625 18.492 -1.144 1.00 0.00 H new ATOM 0 HB1 ALA A 148 16.754 17.023 -2.694 1.00 0.00 H new ATOM 0 HB2 ALA A 148 17.604 17.103 -1.132 1.00 0.00 H new ATOM 0 HB3 ALA A 148 16.622 15.675 -1.539 1.00 0.00 H new ATOM 1377 N GLY A 149 13.125 17.823 -1.402 1.00 0.00 N ATOM 1378 CA GLY A 149 11.847 17.814 -2.088 1.00 0.00 C ATOM 1379 C GLY A 149 11.771 19.022 -3.014 1.00 0.00 C ATOM 1380 O GLY A 149 12.696 19.843 -3.060 1.00 0.00 O ATOM 0 H GLY A 149 13.165 18.522 -0.660 1.00 0.00 H new ATOM 0 HA2 GLY A 149 11.734 16.893 -2.660 1.00 0.00 H new ATOM 0 HA3 GLY A 149 11.032 17.842 -1.365 1.00 0.00 H new ATOM 1384 N HIS A 150 10.677 19.136 -3.759 1.00 0.00 N ATOM 1385 CA HIS A 150 10.330 20.355 -4.480 1.00 0.00 C ATOM 1386 C HIS A 150 9.472 21.241 -3.568 1.00 0.00 C ATOM 1387 O HIS A 150 9.242 20.920 -2.395 1.00 0.00 O ATOM 1388 CB HIS A 150 9.634 19.981 -5.806 1.00 0.00 C ATOM 1389 CG HIS A 150 10.593 19.466 -6.852 1.00 0.00 C ATOM 1390 ND1 HIS A 150 10.486 18.302 -7.587 1.00 0.00 N ATOM 1391 CD2 HIS A 150 11.711 20.125 -7.287 1.00 0.00 C ATOM 1392 CE1 HIS A 150 11.528 18.263 -8.436 1.00 0.00 C ATOM 1393 NE2 HIS A 150 12.305 19.350 -8.288 1.00 0.00 N ATOM 0 H HIS A 150 10.002 18.381 -3.880 1.00 0.00 H new ATOM 0 HA HIS A 150 11.217 20.930 -4.744 1.00 0.00 H new ATOM 0 HB2 HIS A 150 8.877 19.222 -5.611 1.00 0.00 H new ATOM 0 HB3 HIS A 150 9.115 20.856 -6.197 1.00 0.00 H new ATOM 0 HD2 HIS A 150 12.071 21.076 -6.922 1.00 0.00 H new ATOM 0 HE1 HIS A 150 11.715 17.467 -9.141 1.00 0.00 H new ATOM 0 HE2 HIS A 150 13.158 19.566 -8.803 1.00 0.00 H new ATOM 1401 N SER A 151 9.001 22.356 -4.108 1.00 0.00 N ATOM 1402 CA SER A 151 7.835 23.075 -3.641 1.00 0.00 C ATOM 1403 C SER A 151 6.967 23.280 -4.873 1.00 0.00 C ATOM 1404 O SER A 151 7.478 23.628 -5.942 1.00 0.00 O ATOM 1405 CB SER A 151 8.242 24.419 -3.041 1.00 0.00 C ATOM 1406 OG SER A 151 9.181 24.245 -1.995 1.00 0.00 O ATOM 0 H SER A 151 9.441 22.798 -4.915 1.00 0.00 H new ATOM 0 HA SER A 151 7.306 22.528 -2.860 1.00 0.00 H new ATOM 0 HB2 SER A 151 8.671 25.053 -3.817 1.00 0.00 H new ATOM 0 HB3 SER A 151 7.360 24.933 -2.660 1.00 0.00 H new ATOM 0 HG SER A 151 9.428 25.120 -1.628 1.00 0.00 H new TER 1412 SER A 151