USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=20 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 180:sc= -0.112 USER MOD Set 1.2: A 145 GLN : amide:sc= 0 X(o=-0.11,f=-0.11) USER MOD Set 2.1: A 91 HIS : no HD1:sc= -0.492 X(o=-0.49,f=-0.097) USER MOD Set 2.2: A 119 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 83 GLN : amide:sc= 0.0403 K(o=0.11,f=-1.8!) USER MOD Set 3.2: A 114 TYR OH : rot 30:sc= 0.0726 USER MOD Single : A 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 69 CYS SG : rot -140:sc= 0 USER MOD Single : A 70 TYR OH : rot -29:sc= 0.846 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 89 LYS NZ :NH3+ 164:sc= -0.0496 (180deg=-0.27) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 49:sc= 0.314 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 USER MOD Single : A 102 GLN : amide:sc= -0.018 X(o=-0.018,f=-0.23) USER MOD Single : A 105 LYS NZ :NH3+ -129:sc= 0.756 (180deg=-0.126) USER MOD Single : A 106 THR OG1 : rot -42:sc= 0.0143 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 173:sc= 0 (180deg=-0.0219) USER MOD Single : A 113 SER OG : rot 180:sc= 0.0341 USER MOD Single : A 118 GLN : amide:sc= -0.223 X(o=-0.22,f=-0.71) USER MOD Single : A 122 GLN : amide:sc= -0.106 X(o=-0.11,f=-0.11) USER MOD Single : A 130 HIS : no HD1:sc= -2.02! X(o=-2!,f=-1.6) USER MOD Single : A 131 THR OG1 : rot 86:sc= 1.12 USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 135 MET CE :methyl 155:sc= -0.0747 (180deg=-0.787) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.463! X(o=-0.46!,f=-0.11) USER MOD Single : A 150 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 59 -1.991 10.407 -3.385 1.00 0.00 N ATOM 2 CA MET A 59 -3.003 9.382 -3.227 1.00 0.00 C ATOM 3 C MET A 59 -3.501 9.412 -1.781 1.00 0.00 C ATOM 4 O MET A 59 -3.430 10.431 -1.094 1.00 0.00 O ATOM 5 CB MET A 59 -2.499 8.012 -3.741 1.00 0.00 C ATOM 6 CG MET A 59 -2.237 8.050 -5.247 1.00 0.00 C ATOM 7 SD MET A 59 -3.762 7.896 -6.205 1.00 0.00 S ATOM 8 CE MET A 59 -3.859 6.087 -6.255 1.00 0.00 C ATOM 0 HA MET A 59 -3.872 9.579 -3.854 1.00 0.00 H new ATOM 0 HB2 MET A 59 -1.584 7.738 -3.217 1.00 0.00 H new ATOM 0 HB3 MET A 59 -3.237 7.242 -3.517 1.00 0.00 H new ATOM 0 HG2 MET A 59 -1.740 8.985 -5.505 1.00 0.00 H new ATOM 0 HG3 MET A 59 -1.556 7.242 -5.517 1.00 0.00 H new ATOM 0 HE1 MET A 59 -4.747 5.785 -6.811 1.00 0.00 H new ATOM 0 HE2 MET A 59 -2.971 5.688 -6.745 1.00 0.00 H new ATOM 0 HE3 MET A 59 -3.918 5.698 -5.239 1.00 0.00 H new ATOM 18 N ALA A 60 -4.116 8.316 -1.374 1.00 0.00 N ATOM 19 CA ALA A 60 -4.529 7.982 -0.022 1.00 0.00 C ATOM 20 C ALA A 60 -4.281 6.482 0.118 1.00 0.00 C ATOM 21 O ALA A 60 -4.933 5.699 -0.578 1.00 0.00 O ATOM 22 CB ALA A 60 -6.009 8.330 0.168 1.00 0.00 C ATOM 0 H ALA A 60 -4.359 7.577 -2.034 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.979 8.539 0.736 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -6.315 8.078 1.183 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -6.157 9.397 -0.001 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -6.610 7.763 -0.543 1.00 0.00 H new ATOM 28 N GLY A 61 -3.292 6.079 0.913 1.00 0.00 N ATOM 29 CA GLY A 61 -2.819 4.698 0.965 1.00 0.00 C ATOM 30 C GLY A 61 -2.701 4.129 2.377 1.00 0.00 C ATOM 31 O GLY A 61 -2.473 2.932 2.527 1.00 0.00 O ATOM 0 H GLY A 61 -2.793 6.706 1.544 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.499 4.071 0.388 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -1.845 4.641 0.480 1.00 0.00 H new ATOM 35 N GLY A 62 -2.825 4.963 3.409 1.00 0.00 N ATOM 36 CA GLY A 62 -2.712 4.574 4.806 1.00 0.00 C ATOM 37 C GLY A 62 -1.518 5.275 5.438 1.00 0.00 C ATOM 38 O GLY A 62 -1.671 5.896 6.491 1.00 0.00 O ATOM 0 H GLY A 62 -3.013 5.958 3.287 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -3.625 4.835 5.341 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -2.595 3.493 4.884 1.00 0.00 H new ATOM 42 N ALA A 63 -0.342 5.217 4.803 1.00 0.00 N ATOM 43 CA ALA A 63 0.850 5.925 5.279 1.00 0.00 C ATOM 44 C ALA A 63 1.831 6.343 4.194 1.00 0.00 C ATOM 45 O ALA A 63 2.799 7.037 4.503 1.00 0.00 O ATOM 46 CB ALA A 63 1.568 5.069 6.330 1.00 0.00 C ATOM 0 H ALA A 63 -0.191 4.680 3.949 1.00 0.00 H new ATOM 0 HA ALA A 63 0.485 6.858 5.708 1.00 0.00 H new ATOM 0 HB1 ALA A 63 2.454 5.595 6.684 1.00 0.00 H new ATOM 0 HB2 ALA A 63 0.897 4.884 7.169 1.00 0.00 H new ATOM 0 HB3 ALA A 63 1.864 4.119 5.885 1.00 0.00 H new ATOM 52 N TRP A 64 1.655 5.921 2.940 1.00 0.00 N ATOM 53 CA TRP A 64 2.817 5.750 2.082 1.00 0.00 C ATOM 54 C TRP A 64 2.930 6.768 0.945 1.00 0.00 C ATOM 55 O TRP A 64 3.748 6.575 0.043 1.00 0.00 O ATOM 56 CB TRP A 64 2.921 4.294 1.621 1.00 0.00 C ATOM 57 CG TRP A 64 1.684 3.671 1.053 1.00 0.00 C ATOM 58 CD1 TRP A 64 0.876 2.820 1.723 1.00 0.00 C ATOM 59 CD2 TRP A 64 1.091 3.823 -0.276 1.00 0.00 C ATOM 60 NE1 TRP A 64 -0.156 2.429 0.902 1.00 0.00 N ATOM 61 CE2 TRP A 64 -0.061 2.990 -0.351 1.00 0.00 C ATOM 62 CE3 TRP A 64 1.391 4.588 -1.423 1.00 0.00 C ATOM 63 CZ2 TRP A 64 -0.861 2.906 -1.500 1.00 0.00 C ATOM 64 CZ3 TRP A 64 0.598 4.519 -2.584 1.00 0.00 C ATOM 65 CH2 TRP A 64 -0.525 3.674 -2.626 1.00 0.00 C ATOM 0 H TRP A 64 0.755 5.700 2.513 1.00 0.00 H new ATOM 0 HA TRP A 64 3.694 5.975 2.689 1.00 0.00 H new ATOM 0 HB2 TRP A 64 3.707 4.232 0.869 1.00 0.00 H new ATOM 0 HB3 TRP A 64 3.244 3.692 2.470 1.00 0.00 H new ATOM 0 HD1 TRP A 64 1.018 2.497 2.744 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -0.904 1.797 1.188 1.00 0.00 H new ATOM 0 HE3 TRP A 64 2.250 5.242 -1.410 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -1.725 2.258 -1.518 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 0.853 5.118 -3.446 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -1.127 3.616 -3.521 1.00 0.00 H new ATOM 76 N GLY A 65 2.139 7.844 0.961 1.00 0.00 N ATOM 77 CA GLY A 65 2.059 8.771 -0.156 1.00 0.00 C ATOM 78 C GLY A 65 3.366 9.501 -0.493 1.00 0.00 C ATOM 79 O GLY A 65 3.469 10.040 -1.594 1.00 0.00 O ATOM 0 H GLY A 65 1.540 8.091 1.749 1.00 0.00 H new ATOM 0 HA2 GLY A 65 1.729 8.224 -1.039 1.00 0.00 H new ATOM 0 HA3 GLY A 65 1.292 9.514 0.063 1.00 0.00 H new ATOM 83 N ARG A 66 4.358 9.552 0.406 1.00 0.00 N ATOM 84 CA ARG A 66 5.724 9.974 0.083 1.00 0.00 C ATOM 85 C ARG A 66 6.625 8.770 -0.121 1.00 0.00 C ATOM 86 O ARG A 66 7.470 8.837 -1.007 1.00 0.00 O ATOM 87 CB ARG A 66 6.328 10.832 1.199 1.00 0.00 C ATOM 88 CG ARG A 66 6.016 12.327 1.088 1.00 0.00 C ATOM 89 CD ARG A 66 6.961 13.078 0.147 1.00 0.00 C ATOM 90 NE ARG A 66 6.351 13.422 -1.145 1.00 0.00 N ATOM 91 CZ ARG A 66 6.908 14.252 -2.033 1.00 0.00 C ATOM 92 NH1 ARG A 66 8.107 14.789 -1.839 1.00 0.00 N ATOM 93 NH2 ARG A 66 6.258 14.536 -3.145 1.00 0.00 N ATOM 0 H ARG A 66 4.232 9.299 1.386 1.00 0.00 H new ATOM 0 HA ARG A 66 5.661 10.560 -0.834 1.00 0.00 H new ATOM 0 HB2 ARG A 66 5.962 10.467 2.159 1.00 0.00 H new ATOM 0 HB3 ARG A 66 7.410 10.698 1.198 1.00 0.00 H new ATOM 0 HG2 ARG A 66 4.992 12.452 0.737 1.00 0.00 H new ATOM 0 HG3 ARG A 66 6.070 12.776 2.080 1.00 0.00 H new ATOM 0 HD2 ARG A 66 7.297 13.992 0.636 1.00 0.00 H new ATOM 0 HD3 ARG A 66 7.846 12.467 -0.029 1.00 0.00 H new ATOM 0 HE ARG A 66 5.451 13.003 -1.378 1.00 0.00 H new ATOM 0 HH11 ARG A 66 8.632 14.572 -0.992 1.00 0.00 H new ATOM 0 HH12 ARG A 66 8.503 15.419 -2.537 1.00 0.00 H new ATOM 0 HH21 ARG A 66 5.341 14.124 -3.319 1.00 0.00 H new ATOM 0 HH22 ARG A 66 6.672 15.168 -3.831 1.00 0.00 H new ATOM 107 N LEU A 67 6.466 7.676 0.635 1.00 0.00 N ATOM 108 CA LEU A 67 7.317 6.495 0.456 1.00 0.00 C ATOM 109 C LEU A 67 7.269 6.037 -1.009 1.00 0.00 C ATOM 110 O LEU A 67 8.314 5.802 -1.619 1.00 0.00 O ATOM 111 CB LEU A 67 6.972 5.324 1.390 1.00 0.00 C ATOM 112 CG LEU A 67 6.737 5.597 2.887 1.00 0.00 C ATOM 113 CD1 LEU A 67 6.685 4.262 3.644 1.00 0.00 C ATOM 114 CD2 LEU A 67 7.796 6.502 3.519 1.00 0.00 C ATOM 0 H LEU A 67 5.763 7.585 1.369 1.00 0.00 H new ATOM 0 HA LEU A 67 8.327 6.803 0.727 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.073 4.847 0.999 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.779 4.595 1.313 1.00 0.00 H new ATOM 0 HG LEU A 67 5.789 6.129 2.964 1.00 0.00 H new ATOM 0 HD11 LEU A 67 6.519 4.451 4.704 1.00 0.00 H new ATOM 0 HD12 LEU A 67 5.870 3.653 3.252 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.629 3.733 3.514 1.00 0.00 H new ATOM 0 HD21 LEU A 67 7.565 6.650 4.574 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.777 6.036 3.424 1.00 0.00 H new ATOM 0 HD23 LEU A 67 7.802 7.466 3.010 1.00 0.00 H new ATOM 126 N ALA A 68 6.066 5.974 -1.590 1.00 0.00 N ATOM 127 CA ALA A 68 5.866 5.644 -2.993 1.00 0.00 C ATOM 128 C ALA A 68 6.461 6.703 -3.934 1.00 0.00 C ATOM 129 O ALA A 68 6.888 6.333 -5.022 1.00 0.00 O ATOM 130 CB ALA A 68 4.371 5.480 -3.289 1.00 0.00 C ATOM 0 H ALA A 68 5.197 6.154 -1.087 1.00 0.00 H new ATOM 0 HA ALA A 68 6.389 4.705 -3.177 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.233 5.233 -4.342 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.964 4.679 -2.672 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.851 6.411 -3.064 1.00 0.00 H new ATOM 136 N CYS A 69 6.538 7.981 -3.542 1.00 0.00 N ATOM 137 CA CYS A 69 7.029 9.065 -4.396 1.00 0.00 C ATOM 138 C CYS A 69 8.506 8.849 -4.731 1.00 0.00 C ATOM 139 O CYS A 69 8.928 9.043 -5.872 1.00 0.00 O ATOM 140 CB CYS A 69 6.824 10.414 -3.687 1.00 0.00 C ATOM 141 SG CYS A 69 7.399 11.799 -4.708 1.00 0.00 S ATOM 0 H CYS A 69 6.258 8.293 -2.612 1.00 0.00 H new ATOM 0 HA CYS A 69 6.467 9.069 -5.330 1.00 0.00 H new ATOM 0 HB2 CYS A 69 5.767 10.547 -3.455 1.00 0.00 H new ATOM 0 HB3 CYS A 69 7.361 10.413 -2.739 1.00 0.00 H new ATOM 0 HG CYS A 69 7.999 12.673 -3.956 1.00 0.00 H new ATOM 147 N TYR A 70 9.313 8.431 -3.751 1.00 0.00 N ATOM 148 CA TYR A 70 10.681 7.996 -4.015 1.00 0.00 C ATOM 149 C TYR A 70 10.639 6.841 -5.007 1.00 0.00 C ATOM 150 O TYR A 70 11.253 6.913 -6.073 1.00 0.00 O ATOM 151 CB TYR A 70 11.376 7.590 -2.711 1.00 0.00 C ATOM 152 CG TYR A 70 11.340 8.646 -1.628 1.00 0.00 C ATOM 153 CD1 TYR A 70 12.166 9.776 -1.711 1.00 0.00 C ATOM 154 CD2 TYR A 70 10.459 8.505 -0.542 1.00 0.00 C ATOM 155 CE1 TYR A 70 12.098 10.749 -0.703 1.00 0.00 C ATOM 156 CE2 TYR A 70 10.400 9.471 0.478 1.00 0.00 C ATOM 157 CZ TYR A 70 11.243 10.600 0.408 1.00 0.00 C ATOM 158 OH TYR A 70 11.235 11.557 1.381 1.00 0.00 O ATOM 0 H TYR A 70 9.039 8.386 -2.769 1.00 0.00 H new ATOM 0 HA TYR A 70 11.258 8.815 -4.445 1.00 0.00 H new ATOM 0 HB2 TYR A 70 10.908 6.682 -2.332 1.00 0.00 H new ATOM 0 HB3 TYR A 70 12.416 7.346 -2.929 1.00 0.00 H new ATOM 0 HD1 TYR A 70 12.846 9.896 -2.541 1.00 0.00 H new ATOM 0 HD2 TYR A 70 9.816 7.639 -0.490 1.00 0.00 H new ATOM 0 HE1 TYR A 70 12.715 11.632 -0.780 1.00 0.00 H new ATOM 0 HE2 TYR A 70 9.717 9.350 1.306 1.00 0.00 H new ATOM 0 HH TYR A 70 12.119 11.978 1.433 1.00 0.00 H new ATOM 168 N LEU A 71 9.858 5.818 -4.665 1.00 0.00 N ATOM 169 CA LEU A 71 9.707 4.555 -5.370 1.00 0.00 C ATOM 170 C LEU A 71 9.083 4.700 -6.770 1.00 0.00 C ATOM 171 O LEU A 71 8.992 3.709 -7.493 1.00 0.00 O ATOM 172 CB LEU A 71 8.900 3.599 -4.465 1.00 0.00 C ATOM 173 CG LEU A 71 9.685 2.821 -3.386 1.00 0.00 C ATOM 174 CD1 LEU A 71 10.865 3.569 -2.772 1.00 0.00 C ATOM 175 CD2 LEU A 71 8.753 2.270 -2.297 1.00 0.00 C ATOM 0 H LEU A 71 9.275 5.857 -3.829 1.00 0.00 H new ATOM 0 HA LEU A 71 10.697 4.142 -5.564 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.124 4.180 -3.966 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.395 2.875 -5.104 1.00 0.00 H new ATOM 0 HG LEU A 71 10.133 1.988 -3.928 1.00 0.00 H new ATOM 0 HD11 LEU A 71 11.349 2.937 -2.027 1.00 0.00 H new ATOM 0 HD12 LEU A 71 11.582 3.822 -3.553 1.00 0.00 H new ATOM 0 HD13 LEU A 71 10.509 4.483 -2.296 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.340 1.729 -1.555 1.00 0.00 H new ATOM 0 HD22 LEU A 71 8.230 3.095 -1.814 1.00 0.00 H new ATOM 0 HD23 LEU A 71 8.026 1.594 -2.748 1.00 0.00 H new ATOM 187 N GLU A 72 8.662 5.894 -7.189 1.00 0.00 N ATOM 188 CA GLU A 72 7.992 6.153 -8.445 1.00 0.00 C ATOM 189 C GLU A 72 9.003 6.514 -9.547 1.00 0.00 C ATOM 190 O GLU A 72 8.640 6.442 -10.721 1.00 0.00 O ATOM 191 CB GLU A 72 6.968 7.269 -8.162 1.00 0.00 C ATOM 192 CG GLU A 72 6.184 7.761 -9.375 1.00 0.00 C ATOM 193 CD GLU A 72 5.326 8.975 -9.023 1.00 0.00 C ATOM 194 OE1 GLU A 72 5.895 10.086 -8.906 1.00 0.00 O ATOM 195 OE2 GLU A 72 4.099 8.816 -8.829 1.00 0.00 O ATOM 0 H GLU A 72 8.789 6.738 -6.631 1.00 0.00 H new ATOM 0 HA GLU A 72 7.477 5.271 -8.824 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.261 6.909 -7.415 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.493 8.117 -7.721 1.00 0.00 H new ATOM 0 HG2 GLU A 72 6.875 8.021 -10.177 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.548 6.959 -9.750 1.00 0.00 H new ATOM 202 N PHE A 73 10.252 6.892 -9.231 1.00 0.00 N ATOM 203 CA PHE A 73 11.226 7.260 -10.271 1.00 0.00 C ATOM 204 C PHE A 73 11.788 5.996 -10.945 1.00 0.00 C ATOM 205 O PHE A 73 11.677 5.856 -12.163 1.00 0.00 O ATOM 206 CB PHE A 73 12.288 8.261 -9.758 1.00 0.00 C ATOM 207 CG PHE A 73 13.656 7.689 -9.493 1.00 0.00 C ATOM 208 CD1 PHE A 73 13.855 6.957 -8.316 1.00 0.00 C ATOM 209 CD2 PHE A 73 14.674 7.759 -10.465 1.00 0.00 C ATOM 210 CE1 PHE A 73 15.008 6.177 -8.188 1.00 0.00 C ATOM 211 CE2 PHE A 73 15.872 7.046 -10.278 1.00 0.00 C ATOM 212 CZ PHE A 73 16.026 6.220 -9.152 1.00 0.00 C ATOM 0 H PHE A 73 10.608 6.951 -8.277 1.00 0.00 H new ATOM 0 HA PHE A 73 10.715 7.816 -11.057 1.00 0.00 H new ATOM 0 HB2 PHE A 73 12.386 9.064 -10.489 1.00 0.00 H new ATOM 0 HB3 PHE A 73 11.919 8.712 -8.837 1.00 0.00 H new ATOM 0 HD1 PHE A 73 13.128 6.995 -7.518 1.00 0.00 H new ATOM 0 HD2 PHE A 73 14.535 8.359 -11.352 1.00 0.00 H new ATOM 0 HE1 PHE A 73 15.117 5.529 -7.331 1.00 0.00 H new ATOM 0 HE2 PHE A 73 16.672 7.133 -10.998 1.00 0.00 H new ATOM 0 HZ PHE A 73 16.919 5.624 -9.030 1.00 0.00 H new ATOM 222 N LEU A 74 12.350 5.067 -10.163 1.00 0.00 N ATOM 223 CA LEU A 74 12.874 3.787 -10.632 1.00 0.00 C ATOM 224 C LEU A 74 11.745 2.889 -11.124 1.00 0.00 C ATOM 225 O LEU A 74 10.583 3.054 -10.737 1.00 0.00 O ATOM 226 CB LEU A 74 13.789 3.114 -9.584 1.00 0.00 C ATOM 227 CG LEU A 74 13.221 2.623 -8.234 1.00 0.00 C ATOM 228 CD1 LEU A 74 14.356 2.039 -7.385 1.00 0.00 C ATOM 229 CD2 LEU A 74 12.481 3.641 -7.388 1.00 0.00 C ATOM 0 H LEU A 74 12.454 5.193 -9.156 1.00 0.00 H new ATOM 0 HA LEU A 74 13.518 3.975 -11.491 1.00 0.00 H new ATOM 0 HB2 LEU A 74 14.251 2.254 -10.068 1.00 0.00 H new ATOM 0 HB3 LEU A 74 14.588 3.820 -9.357 1.00 0.00 H new ATOM 0 HG LEU A 74 12.470 1.887 -8.522 1.00 0.00 H new ATOM 0 HD11 LEU A 74 13.956 1.692 -6.432 1.00 0.00 H new ATOM 0 HD12 LEU A 74 14.812 1.202 -7.913 1.00 0.00 H new ATOM 0 HD13 LEU A 74 15.108 2.807 -7.205 1.00 0.00 H new ATOM 0 HD21 LEU A 74 12.135 3.168 -6.469 1.00 0.00 H new ATOM 0 HD22 LEU A 74 13.151 4.465 -7.142 1.00 0.00 H new ATOM 0 HD23 LEU A 74 11.625 4.023 -7.944 1.00 0.00 H new ATOM 241 N LYS A 75 12.084 1.928 -11.975 1.00 0.00 N ATOM 242 CA LYS A 75 11.224 0.832 -12.411 1.00 0.00 C ATOM 243 C LYS A 75 11.907 -0.468 -12.011 1.00 0.00 C ATOM 244 O LYS A 75 12.919 -0.460 -11.313 1.00 0.00 O ATOM 245 CB LYS A 75 10.939 0.872 -13.926 1.00 0.00 C ATOM 246 CG LYS A 75 10.383 2.197 -14.459 1.00 0.00 C ATOM 247 CD LYS A 75 9.936 2.018 -15.917 1.00 0.00 C ATOM 248 CE LYS A 75 9.468 3.330 -16.552 1.00 0.00 C ATOM 249 NZ LYS A 75 10.603 4.186 -16.950 1.00 0.00 N ATOM 0 H LYS A 75 13.010 1.889 -12.401 1.00 0.00 H new ATOM 0 HA LYS A 75 10.250 0.920 -11.930 1.00 0.00 H new ATOM 0 HB2 LYS A 75 11.863 0.646 -14.458 1.00 0.00 H new ATOM 0 HB3 LYS A 75 10.231 0.079 -14.166 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.542 2.522 -13.847 1.00 0.00 H new ATOM 0 HG3 LYS A 75 11.144 2.975 -14.394 1.00 0.00 H new ATOM 0 HD2 LYS A 75 10.762 1.611 -16.500 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.127 1.289 -15.959 1.00 0.00 H new ATOM 0 HE2 LYS A 75 8.854 3.111 -17.426 1.00 0.00 H new ATOM 0 HE3 LYS A 75 8.837 3.870 -15.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 10.243 5.064 -17.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 11.175 4.416 -16.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 11.192 3.682 -17.643 1.00 0.00 H new ATOM 263 N LYS A 76 11.360 -1.601 -12.455 1.00 0.00 N ATOM 264 CA LYS A 76 11.802 -2.951 -12.108 1.00 0.00 C ATOM 265 C LYS A 76 13.297 -3.228 -12.337 1.00 0.00 C ATOM 266 O LYS A 76 13.779 -4.232 -11.828 1.00 0.00 O ATOM 267 CB LYS A 76 10.985 -3.980 -12.896 1.00 0.00 C ATOM 268 CG LYS A 76 9.470 -4.013 -12.622 1.00 0.00 C ATOM 269 CD LYS A 76 8.654 -3.137 -13.587 1.00 0.00 C ATOM 270 CE LYS A 76 7.209 -3.641 -13.670 1.00 0.00 C ATOM 271 NZ LYS A 76 6.532 -3.181 -14.897 1.00 0.00 N ATOM 0 H LYS A 76 10.564 -1.602 -13.093 1.00 0.00 H new ATOM 0 HA LYS A 76 11.639 -3.036 -11.034 1.00 0.00 H new ATOM 0 HB2 LYS A 76 11.135 -3.792 -13.959 1.00 0.00 H new ATOM 0 HB3 LYS A 76 11.391 -4.970 -12.687 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.118 -5.042 -12.692 1.00 0.00 H new ATOM 0 HG3 LYS A 76 9.286 -3.682 -11.600 1.00 0.00 H new ATOM 0 HD2 LYS A 76 8.666 -2.101 -13.247 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.109 -3.153 -14.577 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.203 -4.731 -13.640 1.00 0.00 H new ATOM 0 HE3 LYS A 76 6.654 -3.295 -12.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 5.558 -3.544 -14.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 6.514 -2.141 -14.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.046 -3.533 -15.730 1.00 0.00 H new ATOM 285 N GLU A 77 13.993 -2.387 -13.097 1.00 0.00 N ATOM 286 CA GLU A 77 15.438 -2.404 -13.336 1.00 0.00 C ATOM 287 C GLU A 77 16.242 -2.493 -12.028 1.00 0.00 C ATOM 288 O GLU A 77 17.267 -3.175 -11.984 1.00 0.00 O ATOM 289 CB GLU A 77 15.818 -1.121 -14.095 1.00 0.00 C ATOM 290 CG GLU A 77 15.255 -1.034 -15.527 1.00 0.00 C ATOM 291 CD GLU A 77 15.013 0.422 -15.932 1.00 0.00 C ATOM 292 OE1 GLU A 77 14.111 1.040 -15.332 1.00 0.00 O ATOM 293 OE2 GLU A 77 15.682 0.943 -16.857 1.00 0.00 O ATOM 0 H GLU A 77 13.535 -1.625 -13.596 1.00 0.00 H new ATOM 0 HA GLU A 77 15.682 -3.290 -13.921 1.00 0.00 H new ATOM 0 HB2 GLU A 77 15.465 -0.260 -13.527 1.00 0.00 H new ATOM 0 HB3 GLU A 77 16.905 -1.050 -14.141 1.00 0.00 H new ATOM 0 HG2 GLU A 77 15.952 -1.499 -16.225 1.00 0.00 H new ATOM 0 HG3 GLU A 77 14.321 -1.593 -15.589 1.00 0.00 H new ATOM 300 N GLU A 78 15.789 -1.820 -10.964 1.00 0.00 N ATOM 301 CA GLU A 78 16.323 -1.992 -9.619 1.00 0.00 C ATOM 302 C GLU A 78 15.239 -1.797 -8.540 1.00 0.00 C ATOM 303 O GLU A 78 15.500 -2.071 -7.372 1.00 0.00 O ATOM 304 CB GLU A 78 17.554 -1.088 -9.403 1.00 0.00 C ATOM 305 CG GLU A 78 17.307 0.424 -9.516 1.00 0.00 C ATOM 306 CD GLU A 78 17.204 0.928 -10.958 1.00 0.00 C ATOM 307 OE1 GLU A 78 18.275 1.179 -11.560 1.00 0.00 O ATOM 308 OE2 GLU A 78 16.075 1.136 -11.458 1.00 0.00 O ATOM 0 H GLU A 78 15.035 -1.136 -11.019 1.00 0.00 H new ATOM 0 HA GLU A 78 16.660 -3.023 -9.516 1.00 0.00 H new ATOM 0 HB2 GLU A 78 17.964 -1.296 -8.415 1.00 0.00 H new ATOM 0 HB3 GLU A 78 18.317 -1.367 -10.130 1.00 0.00 H new ATOM 0 HG2 GLU A 78 16.387 0.673 -8.988 1.00 0.00 H new ATOM 0 HG3 GLU A 78 18.116 0.953 -9.013 1.00 0.00 H new ATOM 315 N LEU A 79 13.997 -1.384 -8.863 1.00 0.00 N ATOM 316 CA LEU A 79 12.874 -1.487 -7.928 1.00 0.00 C ATOM 317 C LEU A 79 12.669 -2.934 -7.465 1.00 0.00 C ATOM 318 O LEU A 79 12.393 -3.158 -6.283 1.00 0.00 O ATOM 319 CB LEU A 79 11.595 -0.928 -8.584 1.00 0.00 C ATOM 320 CG LEU A 79 10.355 -0.727 -7.690 1.00 0.00 C ATOM 321 CD1 LEU A 79 9.521 -2.007 -7.604 1.00 0.00 C ATOM 322 CD2 LEU A 79 10.690 -0.166 -6.302 1.00 0.00 C ATOM 0 H LEU A 79 13.753 -0.977 -9.766 1.00 0.00 H new ATOM 0 HA LEU A 79 13.102 -0.893 -7.043 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.843 0.034 -9.034 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.316 -1.598 -9.397 1.00 0.00 H new ATOM 0 HG LEU A 79 9.748 0.037 -8.175 1.00 0.00 H new ATOM 0 HD11 LEU A 79 8.654 -1.834 -6.967 1.00 0.00 H new ATOM 0 HD12 LEU A 79 9.187 -2.292 -8.602 1.00 0.00 H new ATOM 0 HD13 LEU A 79 10.127 -2.809 -7.182 1.00 0.00 H new ATOM 0 HD21 LEU A 79 9.772 -0.049 -5.726 1.00 0.00 H new ATOM 0 HD22 LEU A 79 11.359 -0.853 -5.784 1.00 0.00 H new ATOM 0 HD23 LEU A 79 11.177 0.803 -6.409 1.00 0.00 H new ATOM 334 N LYS A 80 12.807 -3.915 -8.373 1.00 0.00 N ATOM 335 CA LYS A 80 12.771 -5.327 -7.997 1.00 0.00 C ATOM 336 C LYS A 80 13.862 -5.555 -6.978 1.00 0.00 C ATOM 337 O LYS A 80 13.544 -6.024 -5.893 1.00 0.00 O ATOM 338 CB LYS A 80 12.914 -6.253 -9.218 1.00 0.00 C ATOM 339 CG LYS A 80 12.931 -7.743 -8.819 1.00 0.00 C ATOM 340 CD LYS A 80 11.539 -8.263 -8.435 1.00 0.00 C ATOM 341 CE LYS A 80 11.633 -9.638 -7.772 1.00 0.00 C ATOM 342 NZ LYS A 80 10.298 -10.201 -7.478 1.00 0.00 N ATOM 0 H LYS A 80 12.944 -3.750 -9.370 1.00 0.00 H new ATOM 0 HA LYS A 80 11.802 -5.573 -7.563 1.00 0.00 H new ATOM 0 HB2 LYS A 80 12.089 -6.072 -9.908 1.00 0.00 H new ATOM 0 HB3 LYS A 80 13.834 -6.010 -9.750 1.00 0.00 H new ATOM 0 HG2 LYS A 80 13.320 -8.334 -9.648 1.00 0.00 H new ATOM 0 HG3 LYS A 80 13.612 -7.884 -7.980 1.00 0.00 H new ATOM 0 HD2 LYS A 80 11.058 -7.559 -7.755 1.00 0.00 H new ATOM 0 HD3 LYS A 80 10.912 -8.326 -9.324 1.00 0.00 H new ATOM 0 HE2 LYS A 80 12.178 -10.319 -8.425 1.00 0.00 H new ATOM 0 HE3 LYS A 80 12.204 -9.557 -6.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 10.405 -11.133 -7.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 9.787 -9.564 -6.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 9.762 -10.303 -8.363 1.00 0.00 H new ATOM 356 N GLU A 81 15.103 -5.213 -7.301 1.00 0.00 N ATOM 357 CA GLU A 81 16.254 -5.414 -6.445 1.00 0.00 C ATOM 358 C GLU A 81 16.036 -4.784 -5.084 1.00 0.00 C ATOM 359 O GLU A 81 16.354 -5.425 -4.093 1.00 0.00 O ATOM 360 CB GLU A 81 17.551 -4.930 -7.091 1.00 0.00 C ATOM 361 CG GLU A 81 18.107 -5.980 -8.057 1.00 0.00 C ATOM 362 CD GLU A 81 17.383 -6.183 -9.394 1.00 0.00 C ATOM 363 OE1 GLU A 81 16.324 -5.577 -9.648 1.00 0.00 O ATOM 364 OE2 GLU A 81 17.905 -7.023 -10.166 1.00 0.00 O ATOM 0 H GLU A 81 15.338 -4.776 -8.192 1.00 0.00 H new ATOM 0 HA GLU A 81 16.364 -6.489 -6.302 1.00 0.00 H new ATOM 0 HB2 GLU A 81 17.369 -3.998 -7.626 1.00 0.00 H new ATOM 0 HB3 GLU A 81 18.289 -4.715 -6.318 1.00 0.00 H new ATOM 0 HG2 GLU A 81 19.143 -5.719 -8.274 1.00 0.00 H new ATOM 0 HG3 GLU A 81 18.122 -6.938 -7.537 1.00 0.00 H new ATOM 371 N PHE A 82 15.411 -3.611 -4.996 1.00 0.00 N ATOM 372 CA PHE A 82 15.044 -3.069 -3.704 1.00 0.00 C ATOM 373 C PHE A 82 14.173 -4.068 -2.946 1.00 0.00 C ATOM 374 O PHE A 82 14.562 -4.514 -1.874 1.00 0.00 O ATOM 375 CB PHE A 82 14.369 -1.702 -3.828 1.00 0.00 C ATOM 376 CG PHE A 82 14.212 -1.012 -2.487 1.00 0.00 C ATOM 377 CD1 PHE A 82 13.164 -1.356 -1.612 1.00 0.00 C ATOM 378 CD2 PHE A 82 15.124 -0.016 -2.107 1.00 0.00 C ATOM 379 CE1 PHE A 82 13.000 -0.667 -0.398 1.00 0.00 C ATOM 380 CE2 PHE A 82 14.945 0.688 -0.908 1.00 0.00 C ATOM 381 CZ PHE A 82 13.869 0.386 -0.068 1.00 0.00 C ATOM 0 H PHE A 82 15.155 -3.031 -5.795 1.00 0.00 H new ATOM 0 HA PHE A 82 15.957 -2.907 -3.130 1.00 0.00 H new ATOM 0 HB2 PHE A 82 14.956 -1.069 -4.493 1.00 0.00 H new ATOM 0 HB3 PHE A 82 13.388 -1.824 -4.288 1.00 0.00 H new ATOM 0 HD1 PHE A 82 12.483 -2.152 -1.875 1.00 0.00 H new ATOM 0 HD2 PHE A 82 15.968 0.210 -2.741 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.207 -0.947 0.280 1.00 0.00 H new ATOM 0 HE2 PHE A 82 15.641 1.467 -0.632 1.00 0.00 H new ATOM 0 HZ PHE A 82 13.706 0.961 0.832 1.00 0.00 H new ATOM 391 N GLN A 83 12.997 -4.435 -3.465 1.00 0.00 N ATOM 392 CA GLN A 83 12.055 -5.266 -2.713 1.00 0.00 C ATOM 393 C GLN A 83 12.575 -6.696 -2.480 1.00 0.00 C ATOM 394 O GLN A 83 12.200 -7.345 -1.501 1.00 0.00 O ATOM 395 CB GLN A 83 10.689 -5.260 -3.418 1.00 0.00 C ATOM 396 CG GLN A 83 9.547 -5.600 -2.442 1.00 0.00 C ATOM 397 CD GLN A 83 8.935 -6.984 -2.628 1.00 0.00 C ATOM 398 OE1 GLN A 83 8.365 -7.296 -3.671 1.00 0.00 O ATOM 399 NE2 GLN A 83 8.986 -7.814 -1.601 1.00 0.00 N ATOM 0 H GLN A 83 12.677 -4.171 -4.397 1.00 0.00 H new ATOM 0 HA GLN A 83 11.943 -4.833 -1.719 1.00 0.00 H new ATOM 0 HB2 GLN A 83 10.511 -4.280 -3.860 1.00 0.00 H new ATOM 0 HB3 GLN A 83 10.697 -5.981 -4.235 1.00 0.00 H new ATOM 0 HG2 GLN A 83 9.924 -5.519 -1.422 1.00 0.00 H new ATOM 0 HG3 GLN A 83 8.761 -4.853 -2.551 1.00 0.00 H new ATOM 0 HE21 GLN A 83 9.464 -7.536 -0.744 1.00 0.00 H new ATOM 0 HE22 GLN A 83 8.547 -8.733 -1.665 1.00 0.00 H new ATOM 408 N LEU A 84 13.430 -7.186 -3.374 1.00 0.00 N ATOM 409 CA LEU A 84 14.183 -8.423 -3.346 1.00 0.00 C ATOM 410 C LEU A 84 15.145 -8.386 -2.158 1.00 0.00 C ATOM 411 O LEU A 84 14.955 -9.117 -1.188 1.00 0.00 O ATOM 412 CB LEU A 84 14.878 -8.505 -4.721 1.00 0.00 C ATOM 413 CG LEU A 84 16.043 -9.491 -4.890 1.00 0.00 C ATOM 414 CD1 LEU A 84 15.703 -10.880 -4.384 1.00 0.00 C ATOM 415 CD2 LEU A 84 16.436 -9.589 -6.368 1.00 0.00 C ATOM 0 H LEU A 84 13.629 -6.663 -4.227 1.00 0.00 H new ATOM 0 HA LEU A 84 13.576 -9.317 -3.201 1.00 0.00 H new ATOM 0 HB2 LEU A 84 14.120 -8.756 -5.462 1.00 0.00 H new ATOM 0 HB3 LEU A 84 15.247 -7.509 -4.967 1.00 0.00 H new ATOM 0 HG LEU A 84 16.872 -9.106 -4.296 1.00 0.00 H new ATOM 0 HD11 LEU A 84 16.560 -11.539 -4.526 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.455 -10.830 -3.324 1.00 0.00 H new ATOM 0 HD13 LEU A 84 14.849 -11.270 -4.938 1.00 0.00 H new ATOM 0 HD21 LEU A 84 17.263 -10.290 -6.479 1.00 0.00 H new ATOM 0 HD22 LEU A 84 15.583 -9.939 -6.949 1.00 0.00 H new ATOM 0 HD23 LEU A 84 16.742 -8.607 -6.729 1.00 0.00 H new ATOM 427 N LEU A 85 16.149 -7.512 -2.222 1.00 0.00 N ATOM 428 CA LEU A 85 17.215 -7.380 -1.238 1.00 0.00 C ATOM 429 C LEU A 85 16.610 -7.052 0.122 1.00 0.00 C ATOM 430 O LEU A 85 16.928 -7.714 1.103 1.00 0.00 O ATOM 431 CB LEU A 85 18.211 -6.293 -1.683 1.00 0.00 C ATOM 432 CG LEU A 85 18.958 -6.599 -3.001 1.00 0.00 C ATOM 433 CD1 LEU A 85 19.686 -5.343 -3.489 1.00 0.00 C ATOM 434 CD2 LEU A 85 19.963 -7.739 -2.866 1.00 0.00 C ATOM 0 H LEU A 85 16.243 -6.851 -2.993 1.00 0.00 H new ATOM 0 HA LEU A 85 17.761 -8.320 -1.156 1.00 0.00 H new ATOM 0 HB2 LEU A 85 17.673 -5.352 -1.797 1.00 0.00 H new ATOM 0 HB3 LEU A 85 18.945 -6.147 -0.891 1.00 0.00 H new ATOM 0 HG LEU A 85 18.204 -6.913 -3.723 1.00 0.00 H new ATOM 0 HD11 LEU A 85 20.211 -5.565 -4.418 1.00 0.00 H new ATOM 0 HD12 LEU A 85 18.962 -4.547 -3.662 1.00 0.00 H new ATOM 0 HD13 LEU A 85 20.404 -5.022 -2.734 1.00 0.00 H new ATOM 0 HD21 LEU A 85 20.455 -7.906 -3.824 1.00 0.00 H new ATOM 0 HD22 LEU A 85 20.709 -7.479 -2.115 1.00 0.00 H new ATOM 0 HD23 LEU A 85 19.444 -8.648 -2.562 1.00 0.00 H new ATOM 446 N LEU A 86 15.686 -6.092 0.188 1.00 0.00 N ATOM 447 CA LEU A 86 14.973 -5.686 1.399 1.00 0.00 C ATOM 448 C LEU A 86 14.372 -6.892 2.114 1.00 0.00 C ATOM 449 O LEU A 86 14.582 -7.089 3.314 1.00 0.00 O ATOM 450 CB LEU A 86 13.897 -4.652 1.010 1.00 0.00 C ATOM 451 CG LEU A 86 12.943 -4.145 2.103 1.00 0.00 C ATOM 452 CD1 LEU A 86 11.697 -5.024 2.279 1.00 0.00 C ATOM 453 CD2 LEU A 86 13.643 -3.945 3.441 1.00 0.00 C ATOM 0 H LEU A 86 15.403 -5.556 -0.632 1.00 0.00 H new ATOM 0 HA LEU A 86 15.668 -5.228 2.103 1.00 0.00 H new ATOM 0 HB2 LEU A 86 14.406 -3.787 0.586 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.291 -5.086 0.215 1.00 0.00 H new ATOM 0 HG LEU A 86 12.604 -3.172 1.747 1.00 0.00 H new ATOM 0 HD11 LEU A 86 11.067 -4.609 3.066 1.00 0.00 H new ATOM 0 HD12 LEU A 86 11.138 -5.053 1.344 1.00 0.00 H new ATOM 0 HD13 LEU A 86 12.000 -6.035 2.552 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.924 -3.586 4.178 1.00 0.00 H new ATOM 0 HD22 LEU A 86 14.064 -4.893 3.777 1.00 0.00 H new ATOM 0 HD23 LEU A 86 14.442 -3.213 3.328 1.00 0.00 H new ATOM 465 N ALA A 87 13.608 -7.716 1.396 1.00 0.00 N ATOM 466 CA ALA A 87 12.929 -8.851 2.007 1.00 0.00 C ATOM 467 C ALA A 87 13.912 -9.920 2.493 1.00 0.00 C ATOM 468 O ALA A 87 13.568 -10.733 3.355 1.00 0.00 O ATOM 469 CB ALA A 87 11.978 -9.466 0.988 1.00 0.00 C ATOM 0 H ALA A 87 13.446 -7.616 0.394 1.00 0.00 H new ATOM 0 HA ALA A 87 12.383 -8.487 2.877 1.00 0.00 H new ATOM 0 HB1 ALA A 87 11.465 -10.317 1.436 1.00 0.00 H new ATOM 0 HB2 ALA A 87 11.244 -8.721 0.679 1.00 0.00 H new ATOM 0 HB3 ALA A 87 12.543 -9.801 0.118 1.00 0.00 H new ATOM 475 N ASN A 88 15.122 -9.924 1.936 1.00 0.00 N ATOM 476 CA ASN A 88 16.150 -10.912 2.224 1.00 0.00 C ATOM 477 C ASN A 88 16.986 -10.462 3.420 1.00 0.00 C ATOM 478 O ASN A 88 17.224 -11.241 4.338 1.00 0.00 O ATOM 479 CB ASN A 88 17.008 -11.137 0.972 1.00 0.00 C ATOM 480 CG ASN A 88 18.028 -12.246 1.180 1.00 0.00 C ATOM 481 OD1 ASN A 88 17.728 -13.291 1.757 1.00 0.00 O ATOM 482 ND2 ASN A 88 19.236 -12.060 0.680 1.00 0.00 N ATOM 0 H ASN A 88 15.418 -9.223 1.257 1.00 0.00 H new ATOM 0 HA ASN A 88 15.690 -11.864 2.489 1.00 0.00 H new ATOM 0 HB2 ASN A 88 16.364 -11.389 0.130 1.00 0.00 H new ATOM 0 HB3 ASN A 88 17.524 -10.212 0.713 1.00 0.00 H new ATOM 0 HD21 ASN A 88 19.942 -12.790 0.768 1.00 0.00 H new ATOM 0 HD22 ASN A 88 19.463 -11.186 0.206 1.00 0.00 H new ATOM 489 N LYS A 89 17.391 -9.189 3.442 1.00 0.00 N ATOM 490 CA LYS A 89 18.015 -8.495 4.553 1.00 0.00 C ATOM 491 C LYS A 89 17.136 -8.611 5.791 1.00 0.00 C ATOM 492 O LYS A 89 17.546 -9.208 6.781 1.00 0.00 O ATOM 493 CB LYS A 89 18.231 -7.053 4.073 1.00 0.00 C ATOM 494 CG LYS A 89 19.468 -6.365 4.620 1.00 0.00 C ATOM 495 CD LYS A 89 19.316 -5.661 5.974 1.00 0.00 C ATOM 496 CE LYS A 89 19.541 -6.544 7.203 1.00 0.00 C ATOM 497 NZ LYS A 89 20.883 -7.155 7.260 1.00 0.00 N ATOM 0 H LYS A 89 17.281 -8.584 2.628 1.00 0.00 H new ATOM 0 HA LYS A 89 18.974 -8.921 4.847 1.00 0.00 H new ATOM 0 HB2 LYS A 89 18.288 -7.055 2.984 1.00 0.00 H new ATOM 0 HB3 LYS A 89 17.356 -6.462 4.345 1.00 0.00 H new ATOM 0 HG2 LYS A 89 20.261 -7.108 4.709 1.00 0.00 H new ATOM 0 HG3 LYS A 89 19.801 -5.629 3.888 1.00 0.00 H new ATOM 0 HD2 LYS A 89 20.019 -4.829 6.012 1.00 0.00 H new ATOM 0 HD3 LYS A 89 18.314 -5.235 6.032 1.00 0.00 H new ATOM 0 HE2 LYS A 89 19.386 -5.947 8.101 1.00 0.00 H new ATOM 0 HE3 LYS A 89 18.791 -7.335 7.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 21.064 -7.507 8.222 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 20.933 -7.946 6.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 21.599 -6.443 7.012 1.00 0.00 H new ATOM 511 N ALA A 90 15.921 -8.067 5.697 1.00 0.00 N ATOM 512 CA ALA A 90 14.906 -7.996 6.736 1.00 0.00 C ATOM 513 C ALA A 90 15.446 -7.519 8.094 1.00 0.00 C ATOM 514 O ALA A 90 16.574 -7.033 8.239 1.00 0.00 O ATOM 515 CB ALA A 90 14.159 -9.340 6.807 1.00 0.00 C ATOM 0 H ALA A 90 15.604 -7.635 4.829 1.00 0.00 H new ATOM 0 HA ALA A 90 14.191 -7.220 6.463 1.00 0.00 H new ATOM 0 HB1 ALA A 90 13.397 -9.292 7.585 1.00 0.00 H new ATOM 0 HB2 ALA A 90 13.685 -9.544 5.847 1.00 0.00 H new ATOM 0 HB3 ALA A 90 14.865 -10.137 7.040 1.00 0.00 H new ATOM 521 N HIS A 91 14.603 -7.621 9.118 1.00 0.00 N ATOM 522 CA HIS A 91 14.972 -7.394 10.508 1.00 0.00 C ATOM 523 C HIS A 91 15.433 -8.719 11.144 1.00 0.00 C ATOM 524 O HIS A 91 15.017 -9.068 12.252 1.00 0.00 O ATOM 525 CB HIS A 91 13.828 -6.673 11.242 1.00 0.00 C ATOM 526 CG HIS A 91 12.611 -7.493 11.597 1.00 0.00 C ATOM 527 ND1 HIS A 91 12.009 -7.479 12.833 1.00 0.00 N ATOM 528 CD2 HIS A 91 11.934 -8.393 10.814 1.00 0.00 C ATOM 529 CE1 HIS A 91 11.021 -8.382 12.812 1.00 0.00 C ATOM 530 NE2 HIS A 91 10.915 -8.940 11.598 1.00 0.00 N ATOM 0 H HIS A 91 13.621 -7.870 8.999 1.00 0.00 H new ATOM 0 HA HIS A 91 15.827 -6.723 10.587 1.00 0.00 H new ATOM 0 HB2 HIS A 91 14.231 -6.250 12.162 1.00 0.00 H new ATOM 0 HB3 HIS A 91 13.503 -5.837 10.623 1.00 0.00 H new ATOM 0 HD2 HIS A 91 12.149 -8.634 9.783 1.00 0.00 H new ATOM 0 HE1 HIS A 91 10.395 -8.627 13.657 1.00 0.00 H new ATOM 0 HE2 HIS A 91 10.224 -9.630 11.303 1.00 0.00 H new ATOM 538 N SER A 92 16.285 -9.485 10.451 1.00 0.00 N ATOM 539 CA SER A 92 16.695 -10.827 10.855 1.00 0.00 C ATOM 540 C SER A 92 18.174 -11.042 10.519 1.00 0.00 C ATOM 541 O SER A 92 18.696 -10.430 9.584 1.00 0.00 O ATOM 542 CB SER A 92 15.795 -11.813 10.102 1.00 0.00 C ATOM 543 OG SER A 92 15.859 -13.116 10.632 1.00 0.00 O ATOM 0 H SER A 92 16.714 -9.179 9.578 1.00 0.00 H new ATOM 0 HA SER A 92 16.589 -10.974 11.930 1.00 0.00 H new ATOM 0 HB2 SER A 92 14.764 -11.460 10.139 1.00 0.00 H new ATOM 0 HB3 SER A 92 16.087 -11.837 9.052 1.00 0.00 H new ATOM 0 HG SER A 92 15.268 -13.707 10.120 1.00 0.00 H new ATOM 549 N ARG A 93 18.863 -11.896 11.282 1.00 0.00 N ATOM 550 CA ARG A 93 20.258 -12.286 11.046 1.00 0.00 C ATOM 551 C ARG A 93 20.527 -13.740 11.448 1.00 0.00 C ATOM 552 O ARG A 93 21.503 -14.328 10.973 1.00 0.00 O ATOM 553 CB ARG A 93 21.184 -11.321 11.806 1.00 0.00 C ATOM 554 CG ARG A 93 22.624 -11.309 11.267 1.00 0.00 C ATOM 555 CD ARG A 93 23.426 -10.244 12.019 1.00 0.00 C ATOM 556 NE ARG A 93 24.833 -10.169 11.585 1.00 0.00 N ATOM 557 CZ ARG A 93 25.745 -9.339 12.108 1.00 0.00 C ATOM 558 NH1 ARG A 93 25.410 -8.461 13.044 1.00 0.00 N ATOM 559 NH2 ARG A 93 26.992 -9.381 11.667 1.00 0.00 N ATOM 0 H ARG A 93 18.457 -12.347 12.102 1.00 0.00 H new ATOM 0 HA ARG A 93 20.460 -12.221 9.977 1.00 0.00 H new ATOM 0 HB2 ARG A 93 20.773 -10.313 11.748 1.00 0.00 H new ATOM 0 HB3 ARG A 93 21.200 -11.598 12.860 1.00 0.00 H new ATOM 0 HG2 ARG A 93 23.083 -12.289 11.397 1.00 0.00 H new ATOM 0 HG3 ARG A 93 22.625 -11.096 10.198 1.00 0.00 H new ATOM 0 HD2 ARG A 93 22.954 -9.272 11.874 1.00 0.00 H new ATOM 0 HD3 ARG A 93 23.392 -10.458 13.087 1.00 0.00 H new ATOM 0 HE ARG A 93 25.133 -10.792 10.835 1.00 0.00 H new ATOM 0 HH11 ARG A 93 24.447 -8.411 13.375 1.00 0.00 H new ATOM 0 HH12 ARG A 93 26.116 -7.836 13.433 1.00 0.00 H new ATOM 0 HH21 ARG A 93 27.252 -10.042 10.935 1.00 0.00 H new ATOM 0 HH22 ARG A 93 27.693 -8.753 12.059 1.00 0.00 H new ATOM 573 N SER A 94 19.686 -14.329 12.300 1.00 0.00 N ATOM 574 CA SER A 94 19.704 -15.748 12.624 1.00 0.00 C ATOM 575 C SER A 94 18.259 -16.209 12.824 1.00 0.00 C ATOM 576 O SER A 94 17.821 -16.360 13.964 1.00 0.00 O ATOM 577 CB SER A 94 20.598 -15.989 13.850 1.00 0.00 C ATOM 578 OG SER A 94 20.187 -15.179 14.938 1.00 0.00 O ATOM 0 H SER A 94 18.957 -13.815 12.794 1.00 0.00 H new ATOM 0 HA SER A 94 20.133 -16.340 11.815 1.00 0.00 H new ATOM 0 HB2 SER A 94 20.555 -17.040 14.136 1.00 0.00 H new ATOM 0 HB3 SER A 94 21.636 -15.769 13.598 1.00 0.00 H new ATOM 0 HG SER A 94 19.218 -15.261 15.059 1.00 0.00 H new ATOM 584 N SER A 95 17.517 -16.368 11.725 1.00 0.00 N ATOM 585 CA SER A 95 16.130 -16.831 11.617 1.00 0.00 C ATOM 586 C SER A 95 15.078 -15.887 12.220 1.00 0.00 C ATOM 587 O SER A 95 14.054 -15.628 11.579 1.00 0.00 O ATOM 588 CB SER A 95 16.006 -18.250 12.191 1.00 0.00 C ATOM 589 OG SER A 95 16.877 -19.136 11.506 1.00 0.00 O ATOM 0 H SER A 95 17.906 -16.157 10.806 1.00 0.00 H new ATOM 0 HA SER A 95 15.901 -16.839 10.551 1.00 0.00 H new ATOM 0 HB2 SER A 95 16.247 -18.242 13.254 1.00 0.00 H new ATOM 0 HB3 SER A 95 14.977 -18.598 12.100 1.00 0.00 H new ATOM 0 HG SER A 95 16.790 -20.037 11.882 1.00 0.00 H new ATOM 595 N SER A 96 15.316 -15.361 13.422 1.00 0.00 N ATOM 596 CA SER A 96 14.349 -14.733 14.304 1.00 0.00 C ATOM 597 C SER A 96 13.219 -15.721 14.596 1.00 0.00 C ATOM 598 O SER A 96 13.306 -16.461 15.575 1.00 0.00 O ATOM 599 CB SER A 96 13.937 -13.348 13.771 1.00 0.00 C ATOM 600 OG SER A 96 13.791 -12.433 14.839 1.00 0.00 O ATOM 0 H SER A 96 16.253 -15.366 13.826 1.00 0.00 H new ATOM 0 HA SER A 96 14.783 -14.504 15.277 1.00 0.00 H new ATOM 0 HB2 SER A 96 14.688 -12.983 13.071 1.00 0.00 H new ATOM 0 HB3 SER A 96 13.000 -13.427 13.221 1.00 0.00 H new ATOM 0 HG SER A 96 13.531 -11.557 14.486 1.00 0.00 H new ATOM 606 N GLY A 97 12.202 -15.785 13.748 1.00 0.00 N ATOM 607 CA GLY A 97 11.091 -16.716 13.861 1.00 0.00 C ATOM 608 C GLY A 97 10.065 -16.553 12.741 1.00 0.00 C ATOM 609 O GLY A 97 8.969 -17.110 12.848 1.00 0.00 O ATOM 0 H GLY A 97 12.126 -15.171 12.937 1.00 0.00 H new ATOM 0 HA2 GLY A 97 11.475 -17.736 13.850 1.00 0.00 H new ATOM 0 HA3 GLY A 97 10.598 -16.572 14.823 1.00 0.00 H new ATOM 613 N GLU A 98 10.364 -15.764 11.703 1.00 0.00 N ATOM 614 CA GLU A 98 9.414 -15.503 10.630 1.00 0.00 C ATOM 615 C GLU A 98 9.210 -16.761 9.779 1.00 0.00 C ATOM 616 O GLU A 98 10.009 -17.700 9.819 1.00 0.00 O ATOM 617 CB GLU A 98 9.877 -14.320 9.764 1.00 0.00 C ATOM 618 CG GLU A 98 9.948 -12.992 10.542 1.00 0.00 C ATOM 619 CD GLU A 98 9.484 -11.810 9.679 1.00 0.00 C ATOM 620 OE1 GLU A 98 10.102 -11.580 8.611 1.00 0.00 O ATOM 621 OE2 GLU A 98 8.475 -11.161 10.041 1.00 0.00 O ATOM 0 H GLU A 98 11.263 -15.296 11.589 1.00 0.00 H new ATOM 0 HA GLU A 98 8.457 -15.234 11.076 1.00 0.00 H new ATOM 0 HB2 GLU A 98 10.860 -14.544 9.349 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.194 -14.205 8.922 1.00 0.00 H new ATOM 0 HG2 GLU A 98 9.326 -13.058 11.435 1.00 0.00 H new ATOM 0 HG3 GLU A 98 10.971 -12.820 10.878 1.00 0.00 H new ATOM 628 N THR A 99 8.144 -16.749 8.987 1.00 0.00 N ATOM 629 CA THR A 99 7.719 -17.829 8.106 1.00 0.00 C ATOM 630 C THR A 99 7.939 -17.307 6.674 1.00 0.00 C ATOM 631 O THR A 99 7.819 -16.093 6.443 1.00 0.00 O ATOM 632 CB THR A 99 6.224 -18.148 8.366 1.00 0.00 C ATOM 633 OG1 THR A 99 5.761 -17.565 9.575 1.00 0.00 O ATOM 634 CG2 THR A 99 5.918 -19.642 8.501 1.00 0.00 C ATOM 0 H THR A 99 7.521 -15.943 8.940 1.00 0.00 H new ATOM 0 HA THR A 99 8.277 -18.750 8.272 1.00 0.00 H new ATOM 0 HB THR A 99 5.725 -17.739 7.487 1.00 0.00 H new ATOM 0 HG1 THR A 99 4.815 -17.786 9.704 1.00 0.00 H new ATOM 0 HG21 THR A 99 4.852 -19.780 8.681 1.00 0.00 H new ATOM 0 HG22 THR A 99 6.200 -20.156 7.582 1.00 0.00 H new ATOM 0 HG23 THR A 99 6.484 -20.055 9.336 1.00 0.00 H new ATOM 642 N PRO A 100 8.266 -18.162 5.691 1.00 0.00 N ATOM 643 CA PRO A 100 8.453 -17.703 4.327 1.00 0.00 C ATOM 644 C PRO A 100 7.124 -17.249 3.717 1.00 0.00 C ATOM 645 O PRO A 100 6.035 -17.686 4.112 1.00 0.00 O ATOM 646 CB PRO A 100 9.075 -18.879 3.573 1.00 0.00 C ATOM 647 CG PRO A 100 8.581 -20.097 4.346 1.00 0.00 C ATOM 648 CD PRO A 100 8.528 -19.589 5.788 1.00 0.00 C ATOM 0 HA PRO A 100 9.105 -16.831 4.274 1.00 0.00 H new ATOM 0 HB2 PRO A 100 8.751 -18.905 2.533 1.00 0.00 H new ATOM 0 HB3 PRO A 100 10.163 -18.822 3.567 1.00 0.00 H new ATOM 0 HG2 PRO A 100 7.602 -20.427 3.998 1.00 0.00 H new ATOM 0 HG3 PRO A 100 9.259 -20.944 4.241 1.00 0.00 H new ATOM 0 HD2 PRO A 100 7.744 -20.094 6.353 1.00 0.00 H new ATOM 0 HD3 PRO A 100 9.468 -19.781 6.306 1.00 0.00 H new ATOM 656 N ALA A 101 7.240 -16.378 2.720 1.00 0.00 N ATOM 657 CA ALA A 101 6.185 -15.869 1.859 1.00 0.00 C ATOM 658 C ALA A 101 6.852 -15.329 0.589 1.00 0.00 C ATOM 659 O ALA A 101 8.077 -15.165 0.564 1.00 0.00 O ATOM 660 CB ALA A 101 5.441 -14.747 2.590 1.00 0.00 C ATOM 0 H ALA A 101 8.147 -15.980 2.476 1.00 0.00 H new ATOM 0 HA ALA A 101 5.468 -16.649 1.603 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.648 -14.360 1.951 1.00 0.00 H new ATOM 0 HB2 ALA A 101 5.007 -15.138 3.510 1.00 0.00 H new ATOM 0 HB3 ALA A 101 6.138 -13.944 2.830 1.00 0.00 H new ATOM 666 N GLN A 102 6.082 -15.025 -0.458 1.00 0.00 N ATOM 667 CA GLN A 102 6.587 -14.447 -1.691 1.00 0.00 C ATOM 668 C GLN A 102 5.686 -13.291 -2.152 1.00 0.00 C ATOM 669 O GLN A 102 4.470 -13.346 -1.933 1.00 0.00 O ATOM 670 CB GLN A 102 6.639 -15.532 -2.768 1.00 0.00 C ATOM 671 CG GLN A 102 7.534 -16.730 -2.421 1.00 0.00 C ATOM 672 CD GLN A 102 6.740 -17.908 -1.865 1.00 0.00 C ATOM 673 OE1 GLN A 102 5.752 -18.336 -2.458 1.00 0.00 O ATOM 674 NE2 GLN A 102 7.151 -18.487 -0.751 1.00 0.00 N ATOM 0 H GLN A 102 5.074 -15.179 -0.466 1.00 0.00 H new ATOM 0 HA GLN A 102 7.588 -14.052 -1.518 1.00 0.00 H new ATOM 0 HB2 GLN A 102 5.627 -15.892 -2.953 1.00 0.00 H new ATOM 0 HB3 GLN A 102 6.993 -15.087 -3.698 1.00 0.00 H new ATOM 0 HG2 GLN A 102 8.073 -17.048 -3.313 1.00 0.00 H new ATOM 0 HG3 GLN A 102 8.281 -16.422 -1.690 1.00 0.00 H new ATOM 0 HE21 GLN A 102 7.971 -18.128 -0.262 1.00 0.00 H new ATOM 0 HE22 GLN A 102 6.648 -19.293 -0.379 1.00 0.00 H new ATOM 683 N PRO A 103 6.238 -12.266 -2.821 1.00 0.00 N ATOM 684 CA PRO A 103 5.507 -11.063 -3.212 1.00 0.00 C ATOM 685 C PRO A 103 4.549 -11.284 -4.377 1.00 0.00 C ATOM 686 O PRO A 103 4.700 -12.216 -5.168 1.00 0.00 O ATOM 687 CB PRO A 103 6.595 -10.047 -3.578 1.00 0.00 C ATOM 688 CG PRO A 103 7.753 -10.916 -4.065 1.00 0.00 C ATOM 689 CD PRO A 103 7.647 -12.143 -3.168 1.00 0.00 C ATOM 0 HA PRO A 103 4.864 -10.725 -2.399 1.00 0.00 H new ATOM 0 HB2 PRO A 103 6.257 -9.360 -4.353 1.00 0.00 H new ATOM 0 HB3 PRO A 103 6.883 -9.441 -2.719 1.00 0.00 H new ATOM 0 HG2 PRO A 103 7.651 -11.174 -5.119 1.00 0.00 H new ATOM 0 HG3 PRO A 103 8.713 -10.413 -3.952 1.00 0.00 H new ATOM 0 HD2 PRO A 103 8.001 -13.035 -3.684 1.00 0.00 H new ATOM 0 HD3 PRO A 103 8.260 -12.027 -2.274 1.00 0.00 H new ATOM 697 N GLU A 104 3.591 -10.370 -4.504 1.00 0.00 N ATOM 698 CA GLU A 104 2.773 -10.157 -5.683 1.00 0.00 C ATOM 699 C GLU A 104 2.618 -8.639 -5.862 1.00 0.00 C ATOM 700 O GLU A 104 1.575 -8.080 -5.513 1.00 0.00 O ATOM 701 CB GLU A 104 1.398 -10.831 -5.520 1.00 0.00 C ATOM 702 CG GLU A 104 1.369 -12.353 -5.628 1.00 0.00 C ATOM 703 CD GLU A 104 -0.058 -12.809 -5.967 1.00 0.00 C ATOM 704 OE1 GLU A 104 -0.946 -12.839 -5.085 1.00 0.00 O ATOM 705 OE2 GLU A 104 -0.323 -13.023 -7.176 1.00 0.00 O ATOM 0 H GLU A 104 3.357 -9.728 -3.747 1.00 0.00 H new ATOM 0 HA GLU A 104 3.244 -10.599 -6.561 1.00 0.00 H new ATOM 0 HB2 GLU A 104 0.993 -10.550 -4.548 1.00 0.00 H new ATOM 0 HB3 GLU A 104 0.726 -10.422 -6.275 1.00 0.00 H new ATOM 0 HG2 GLU A 104 2.063 -12.688 -6.399 1.00 0.00 H new ATOM 0 HG3 GLU A 104 1.694 -12.802 -4.689 1.00 0.00 H new ATOM 712 N LYS A 105 3.673 -7.933 -6.288 1.00 0.00 N ATOM 713 CA LYS A 105 3.635 -6.478 -6.513 1.00 0.00 C ATOM 714 C LYS A 105 4.812 -6.040 -7.383 1.00 0.00 C ATOM 715 O LYS A 105 5.956 -6.323 -7.027 1.00 0.00 O ATOM 716 CB LYS A 105 3.625 -5.677 -5.186 1.00 0.00 C ATOM 717 CG LYS A 105 4.538 -6.173 -4.044 1.00 0.00 C ATOM 718 CD LYS A 105 3.739 -6.889 -2.944 1.00 0.00 C ATOM 719 CE LYS A 105 4.670 -7.482 -1.882 1.00 0.00 C ATOM 720 NZ LYS A 105 3.914 -8.212 -0.842 1.00 0.00 N ATOM 0 H LYS A 105 4.581 -8.354 -6.488 1.00 0.00 H new ATOM 0 HA LYS A 105 2.702 -6.260 -7.032 1.00 0.00 H new ATOM 0 HB2 LYS A 105 3.901 -4.647 -5.413 1.00 0.00 H new ATOM 0 HB3 LYS A 105 2.601 -5.658 -4.813 1.00 0.00 H new ATOM 0 HG2 LYS A 105 5.289 -6.852 -4.448 1.00 0.00 H new ATOM 0 HG3 LYS A 105 5.073 -5.327 -3.612 1.00 0.00 H new ATOM 0 HD2 LYS A 105 3.049 -6.187 -2.476 1.00 0.00 H new ATOM 0 HD3 LYS A 105 3.136 -7.682 -3.386 1.00 0.00 H new ATOM 0 HE2 LYS A 105 5.381 -8.158 -2.357 1.00 0.00 H new ATOM 0 HE3 LYS A 105 5.249 -6.684 -1.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 4.207 -7.879 0.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 2.896 -8.041 -0.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 4.106 -9.231 -0.924 1.00 0.00 H new ATOM 734 N THR A 106 4.569 -5.312 -8.481 1.00 0.00 N ATOM 735 CA THR A 106 5.629 -4.889 -9.407 1.00 0.00 C ATOM 736 C THR A 106 5.551 -3.396 -9.803 1.00 0.00 C ATOM 737 O THR A 106 6.225 -2.963 -10.741 1.00 0.00 O ATOM 738 CB THR A 106 5.722 -5.928 -10.553 1.00 0.00 C ATOM 739 OG1 THR A 106 6.988 -5.900 -11.189 1.00 0.00 O ATOM 740 CG2 THR A 106 4.628 -5.816 -11.615 1.00 0.00 C ATOM 0 H THR A 106 3.636 -5.001 -8.752 1.00 0.00 H new ATOM 0 HA THR A 106 6.599 -4.899 -8.909 1.00 0.00 H new ATOM 0 HB THR A 106 5.575 -6.883 -10.048 1.00 0.00 H new ATOM 0 HG1 THR A 106 7.271 -4.970 -11.313 1.00 0.00 H new ATOM 0 HG21 THR A 106 4.778 -6.584 -12.374 1.00 0.00 H new ATOM 0 HG22 THR A 106 3.652 -5.952 -11.148 1.00 0.00 H new ATOM 0 HG23 THR A 106 4.673 -4.832 -12.081 1.00 0.00 H new ATOM 748 N SER A 107 4.802 -2.558 -9.076 1.00 0.00 N ATOM 749 CA SER A 107 5.026 -1.107 -9.101 1.00 0.00 C ATOM 750 C SER A 107 5.797 -0.737 -7.836 1.00 0.00 C ATOM 751 O SER A 107 5.629 -1.379 -6.798 1.00 0.00 O ATOM 752 CB SER A 107 3.718 -0.299 -9.196 1.00 0.00 C ATOM 753 OG SER A 107 2.631 -1.025 -9.737 1.00 0.00 O ATOM 0 H SER A 107 4.040 -2.857 -8.467 1.00 0.00 H new ATOM 0 HA SER A 107 5.594 -0.854 -9.997 1.00 0.00 H new ATOM 0 HB2 SER A 107 3.447 0.053 -8.200 1.00 0.00 H new ATOM 0 HB3 SER A 107 3.893 0.585 -9.810 1.00 0.00 H new ATOM 0 HG SER A 107 1.837 -0.452 -9.766 1.00 0.00 H new ATOM 759 N GLY A 108 6.580 0.336 -7.863 1.00 0.00 N ATOM 760 CA GLY A 108 7.174 0.880 -6.656 1.00 0.00 C ATOM 761 C GLY A 108 6.105 1.509 -5.763 1.00 0.00 C ATOM 762 O GLY A 108 6.133 1.348 -4.544 1.00 0.00 O ATOM 0 H GLY A 108 6.817 0.846 -8.714 1.00 0.00 H new ATOM 0 HA2 GLY A 108 7.691 0.090 -6.111 1.00 0.00 H new ATOM 0 HA3 GLY A 108 7.922 1.628 -6.918 1.00 0.00 H new ATOM 766 N MET A 109 5.078 2.129 -6.344 1.00 0.00 N ATOM 767 CA MET A 109 3.924 2.541 -5.548 1.00 0.00 C ATOM 768 C MET A 109 3.098 1.352 -5.020 1.00 0.00 C ATOM 769 O MET A 109 2.213 1.553 -4.198 1.00 0.00 O ATOM 770 CB MET A 109 3.088 3.568 -6.316 1.00 0.00 C ATOM 771 CG MET A 109 2.434 3.013 -7.578 1.00 0.00 C ATOM 772 SD MET A 109 1.663 4.264 -8.642 1.00 0.00 S ATOM 773 CE MET A 109 3.121 5.039 -9.392 1.00 0.00 C ATOM 0 H MET A 109 5.021 2.352 -7.338 1.00 0.00 H new ATOM 0 HA MET A 109 4.298 3.030 -4.648 1.00 0.00 H new ATOM 0 HB2 MET A 109 2.312 3.956 -5.657 1.00 0.00 H new ATOM 0 HB3 MET A 109 3.725 4.410 -6.589 1.00 0.00 H new ATOM 0 HG2 MET A 109 3.187 2.477 -8.156 1.00 0.00 H new ATOM 0 HG3 MET A 109 1.677 2.284 -7.289 1.00 0.00 H new ATOM 0 HE1 MET A 109 2.804 5.742 -10.162 1.00 0.00 H new ATOM 0 HE2 MET A 109 3.685 5.571 -8.626 1.00 0.00 H new ATOM 0 HE3 MET A 109 3.752 4.271 -9.840 1.00 0.00 H new ATOM 783 N GLU A 110 3.401 0.122 -5.449 1.00 0.00 N ATOM 784 CA GLU A 110 2.746 -1.110 -5.010 1.00 0.00 C ATOM 785 C GLU A 110 3.575 -1.832 -3.936 1.00 0.00 C ATOM 786 O GLU A 110 3.011 -2.501 -3.072 1.00 0.00 O ATOM 787 CB GLU A 110 2.526 -2.023 -6.230 1.00 0.00 C ATOM 788 CG GLU A 110 1.363 -3.006 -6.089 1.00 0.00 C ATOM 789 CD GLU A 110 0.024 -2.295 -6.276 1.00 0.00 C ATOM 790 OE1 GLU A 110 -0.325 -1.970 -7.442 1.00 0.00 O ATOM 791 OE2 GLU A 110 -0.659 -2.011 -5.276 1.00 0.00 O ATOM 0 H GLU A 110 4.136 -0.046 -6.136 1.00 0.00 H new ATOM 0 HA GLU A 110 1.785 -0.859 -4.562 1.00 0.00 H new ATOM 0 HB2 GLU A 110 2.353 -1.400 -7.107 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.440 -2.587 -6.415 1.00 0.00 H new ATOM 0 HG2 GLU A 110 1.463 -3.802 -6.827 1.00 0.00 H new ATOM 0 HG3 GLU A 110 1.396 -3.476 -5.106 1.00 0.00 H new ATOM 798 N VAL A 111 4.912 -1.722 -3.923 1.00 0.00 N ATOM 799 CA VAL A 111 5.698 -2.181 -2.799 1.00 0.00 C ATOM 800 C VAL A 111 5.478 -1.283 -1.579 1.00 0.00 C ATOM 801 O VAL A 111 5.587 -1.730 -0.445 1.00 0.00 O ATOM 802 CB VAL A 111 7.168 -2.259 -3.201 1.00 0.00 C ATOM 803 CG1 VAL A 111 7.420 -3.259 -4.342 1.00 0.00 C ATOM 804 CG2 VAL A 111 7.965 -0.988 -3.387 1.00 0.00 C ATOM 0 H VAL A 111 5.458 -1.318 -4.684 1.00 0.00 H new ATOM 0 HA VAL A 111 5.374 -3.182 -2.513 1.00 0.00 H new ATOM 0 HB VAL A 111 7.590 -2.634 -2.269 1.00 0.00 H new ATOM 0 HG11 VAL A 111 8.482 -3.273 -4.586 1.00 0.00 H new ATOM 0 HG12 VAL A 111 7.107 -4.255 -4.029 1.00 0.00 H new ATOM 0 HG13 VAL A 111 6.850 -2.959 -5.221 1.00 0.00 H new ATOM 0 HG21 VAL A 111 8.987 -1.238 -3.671 1.00 0.00 H new ATOM 0 HG22 VAL A 111 7.508 -0.383 -4.170 1.00 0.00 H new ATOM 0 HG23 VAL A 111 7.975 -0.425 -2.454 1.00 0.00 H new ATOM 814 N ALA A 112 5.144 -0.023 -1.817 1.00 0.00 N ATOM 815 CA ALA A 112 4.838 0.968 -0.798 1.00 0.00 C ATOM 816 C ALA A 112 3.829 0.451 0.236 1.00 0.00 C ATOM 817 O ALA A 112 4.178 0.309 1.410 1.00 0.00 O ATOM 818 CB ALA A 112 4.390 2.260 -1.480 1.00 0.00 C ATOM 0 H ALA A 112 5.076 0.351 -2.764 1.00 0.00 H new ATOM 0 HA ALA A 112 5.739 1.179 -0.222 1.00 0.00 H new ATOM 0 HB1 ALA A 112 4.158 3.009 -0.723 1.00 0.00 H new ATOM 0 HB2 ALA A 112 5.190 2.628 -2.123 1.00 0.00 H new ATOM 0 HB3 ALA A 112 3.502 2.065 -2.081 1.00 0.00 H new ATOM 824 N SER A 113 2.612 0.092 -0.182 1.00 0.00 N ATOM 825 CA SER A 113 1.622 -0.518 0.699 1.00 0.00 C ATOM 826 C SER A 113 2.132 -1.799 1.370 1.00 0.00 C ATOM 827 O SER A 113 1.748 -2.079 2.502 1.00 0.00 O ATOM 828 CB SER A 113 0.322 -0.770 -0.079 1.00 0.00 C ATOM 829 OG SER A 113 0.545 -1.096 -1.441 1.00 0.00 O ATOM 0 H SER A 113 2.289 0.218 -1.141 1.00 0.00 H new ATOM 0 HA SER A 113 1.423 0.183 1.510 1.00 0.00 H new ATOM 0 HB2 SER A 113 -0.228 -1.581 0.397 1.00 0.00 H new ATOM 0 HB3 SER A 113 -0.307 0.118 -0.022 1.00 0.00 H new ATOM 0 HG SER A 113 -0.315 -1.247 -1.886 1.00 0.00 H new ATOM 835 N TYR A 114 3.010 -2.562 0.717 1.00 0.00 N ATOM 836 CA TYR A 114 3.566 -3.797 1.268 1.00 0.00 C ATOM 837 C TYR A 114 4.502 -3.505 2.441 1.00 0.00 C ATOM 838 O TYR A 114 4.518 -4.235 3.429 1.00 0.00 O ATOM 839 CB TYR A 114 4.283 -4.584 0.161 1.00 0.00 C ATOM 840 CG TYR A 114 5.596 -5.242 0.557 1.00 0.00 C ATOM 841 CD1 TYR A 114 5.569 -6.460 1.255 1.00 0.00 C ATOM 842 CD2 TYR A 114 6.836 -4.634 0.272 1.00 0.00 C ATOM 843 CE1 TYR A 114 6.761 -7.133 1.573 1.00 0.00 C ATOM 844 CE2 TYR A 114 8.031 -5.284 0.617 1.00 0.00 C ATOM 845 CZ TYR A 114 8.003 -6.555 1.234 1.00 0.00 C ATOM 846 OH TYR A 114 9.165 -7.224 1.469 1.00 0.00 O ATOM 0 H TYR A 114 3.357 -2.338 -0.216 1.00 0.00 H new ATOM 0 HA TYR A 114 2.750 -4.408 1.654 1.00 0.00 H new ATOM 0 HB2 TYR A 114 3.607 -5.357 -0.204 1.00 0.00 H new ATOM 0 HB3 TYR A 114 4.475 -3.908 -0.673 1.00 0.00 H new ATOM 0 HD1 TYR A 114 4.621 -6.885 1.551 1.00 0.00 H new ATOM 0 HD2 TYR A 114 6.866 -3.669 -0.211 1.00 0.00 H new ATOM 0 HE1 TYR A 114 6.727 -8.089 2.075 1.00 0.00 H new ATOM 0 HE2 TYR A 114 8.979 -4.809 0.409 1.00 0.00 H new ATOM 0 HH TYR A 114 9.004 -8.189 1.412 1.00 0.00 H new ATOM 856 N LEU A 115 5.308 -2.454 2.334 1.00 0.00 N ATOM 857 CA LEU A 115 6.286 -2.106 3.348 1.00 0.00 C ATOM 858 C LEU A 115 5.567 -1.684 4.626 1.00 0.00 C ATOM 859 O LEU A 115 5.924 -2.162 5.704 1.00 0.00 O ATOM 860 CB LEU A 115 7.215 -1.019 2.780 1.00 0.00 C ATOM 861 CG LEU A 115 8.384 -1.588 1.967 1.00 0.00 C ATOM 862 CD1 LEU A 115 9.143 -0.465 1.255 1.00 0.00 C ATOM 863 CD2 LEU A 115 9.371 -2.367 2.833 1.00 0.00 C ATOM 0 H LEU A 115 5.298 -1.819 1.536 1.00 0.00 H new ATOM 0 HA LEU A 115 6.908 -2.961 3.613 1.00 0.00 H new ATOM 0 HB2 LEU A 115 6.634 -0.348 2.148 1.00 0.00 H new ATOM 0 HB3 LEU A 115 7.609 -0.421 3.602 1.00 0.00 H new ATOM 0 HG LEU A 115 7.947 -2.272 1.239 1.00 0.00 H new ATOM 0 HD11 LEU A 115 9.969 -0.889 0.684 1.00 0.00 H new ATOM 0 HD12 LEU A 115 8.467 0.060 0.580 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.535 0.235 1.993 1.00 0.00 H new ATOM 0 HD21 LEU A 115 10.179 -2.749 2.210 1.00 0.00 H new ATOM 0 HD22 LEU A 115 9.783 -1.708 3.598 1.00 0.00 H new ATOM 0 HD23 LEU A 115 8.857 -3.201 3.311 1.00 0.00 H new ATOM 875 N VAL A 116 4.523 -0.859 4.514 1.00 0.00 N ATOM 876 CA VAL A 116 3.671 -0.490 5.652 1.00 0.00 C ATOM 877 C VAL A 116 2.877 -1.706 6.144 1.00 0.00 C ATOM 878 O VAL A 116 2.668 -1.854 7.348 1.00 0.00 O ATOM 879 CB VAL A 116 2.770 0.727 5.289 1.00 0.00 C ATOM 880 CG1 VAL A 116 2.061 1.387 6.489 1.00 0.00 C ATOM 881 CG2 VAL A 116 3.524 1.855 4.559 1.00 0.00 C ATOM 0 H VAL A 116 4.243 -0.427 3.633 1.00 0.00 H new ATOM 0 HA VAL A 116 4.297 -0.171 6.485 1.00 0.00 H new ATOM 0 HB VAL A 116 2.030 0.266 4.635 1.00 0.00 H new ATOM 0 HG11 VAL A 116 1.457 2.224 6.139 1.00 0.00 H new ATOM 0 HG12 VAL A 116 1.418 0.656 6.979 1.00 0.00 H new ATOM 0 HG13 VAL A 116 2.806 1.748 7.198 1.00 0.00 H new ATOM 0 HG21 VAL A 116 2.834 2.670 4.337 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.330 2.224 5.194 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.942 1.470 3.629 1.00 0.00 H new ATOM 891 N ALA A 117 2.510 -2.635 5.261 1.00 0.00 N ATOM 892 CA ALA A 117 1.852 -3.872 5.661 1.00 0.00 C ATOM 893 C ALA A 117 2.765 -4.748 6.527 1.00 0.00 C ATOM 894 O ALA A 117 2.293 -5.399 7.459 1.00 0.00 O ATOM 895 CB ALA A 117 1.371 -4.631 4.424 1.00 0.00 C ATOM 0 H ALA A 117 2.661 -2.549 4.256 1.00 0.00 H new ATOM 0 HA ALA A 117 0.988 -3.614 6.273 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.880 -5.554 4.732 1.00 0.00 H new ATOM 0 HB2 ALA A 117 0.665 -4.013 3.869 1.00 0.00 H new ATOM 0 HB3 ALA A 117 2.224 -4.868 3.788 1.00 0.00 H new ATOM 901 N GLN A 118 4.065 -4.792 6.229 1.00 0.00 N ATOM 902 CA GLN A 118 5.043 -5.510 7.031 1.00 0.00 C ATOM 903 C GLN A 118 5.349 -4.751 8.327 1.00 0.00 C ATOM 904 O GLN A 118 5.173 -5.302 9.412 1.00 0.00 O ATOM 905 CB GLN A 118 6.295 -5.783 6.183 1.00 0.00 C ATOM 906 CG GLN A 118 6.093 -6.905 5.149 1.00 0.00 C ATOM 907 CD GLN A 118 5.809 -8.274 5.779 1.00 0.00 C ATOM 908 OE1 GLN A 118 6.149 -8.546 6.927 1.00 0.00 O ATOM 909 NE2 GLN A 118 5.151 -9.167 5.061 1.00 0.00 N ATOM 0 H GLN A 118 4.466 -4.325 5.416 1.00 0.00 H new ATOM 0 HA GLN A 118 4.637 -6.474 7.337 1.00 0.00 H new ATOM 0 HB2 GLN A 118 6.582 -4.868 5.665 1.00 0.00 H new ATOM 0 HB3 GLN A 118 7.121 -6.049 6.842 1.00 0.00 H new ATOM 0 HG2 GLN A 118 5.266 -6.638 4.492 1.00 0.00 H new ATOM 0 HG3 GLN A 118 6.984 -6.979 4.526 1.00 0.00 H new ATOM 0 HE21 GLN A 118 4.867 -8.945 4.107 1.00 0.00 H new ATOM 0 HE22 GLN A 118 4.927 -10.078 5.461 1.00 0.00 H new ATOM 918 N TYR A 119 5.816 -3.505 8.220 1.00 0.00 N ATOM 919 CA TYR A 119 6.492 -2.792 9.309 1.00 0.00 C ATOM 920 C TYR A 119 5.904 -1.412 9.651 1.00 0.00 C ATOM 921 O TYR A 119 6.500 -0.658 10.426 1.00 0.00 O ATOM 922 CB TYR A 119 7.939 -2.598 8.886 1.00 0.00 C ATOM 923 CG TYR A 119 8.730 -3.834 8.558 1.00 0.00 C ATOM 924 CD1 TYR A 119 9.246 -4.641 9.584 1.00 0.00 C ATOM 925 CD2 TYR A 119 8.986 -4.142 7.212 1.00 0.00 C ATOM 926 CE1 TYR A 119 10.042 -5.751 9.259 1.00 0.00 C ATOM 927 CE2 TYR A 119 9.761 -5.261 6.884 1.00 0.00 C ATOM 928 CZ TYR A 119 10.314 -6.067 7.909 1.00 0.00 C ATOM 929 OH TYR A 119 11.146 -7.104 7.613 1.00 0.00 O ATOM 0 H TYR A 119 5.735 -2.955 7.365 1.00 0.00 H new ATOM 0 HA TYR A 119 6.370 -3.398 10.207 1.00 0.00 H new ATOM 0 HB2 TYR A 119 7.951 -1.947 8.012 1.00 0.00 H new ATOM 0 HB3 TYR A 119 8.457 -2.068 9.685 1.00 0.00 H new ATOM 0 HD1 TYR A 119 9.032 -4.410 10.617 1.00 0.00 H new ATOM 0 HD2 TYR A 119 8.585 -3.515 6.429 1.00 0.00 H new ATOM 0 HE1 TYR A 119 10.449 -6.368 10.047 1.00 0.00 H new ATOM 0 HE2 TYR A 119 9.937 -5.510 5.848 1.00 0.00 H new ATOM 0 HH TYR A 119 11.228 -7.190 6.640 1.00 0.00 H new ATOM 939 N GLY A 120 4.780 -1.041 9.048 1.00 0.00 N ATOM 940 CA GLY A 120 4.115 0.236 9.246 1.00 0.00 C ATOM 941 C GLY A 120 4.909 1.377 8.624 1.00 0.00 C ATOM 942 O GLY A 120 4.973 1.563 7.424 1.00 0.00 O ATOM 0 H GLY A 120 4.292 -1.644 8.386 1.00 0.00 H new ATOM 0 HA2 GLY A 120 3.119 0.201 8.806 1.00 0.00 H new ATOM 0 HA3 GLY A 120 3.986 0.419 10.313 1.00 0.00 H new ATOM 946 N GLU A 121 5.537 2.183 9.433 1.00 0.00 N ATOM 947 CA GLU A 121 6.356 3.290 8.981 1.00 0.00 C ATOM 948 C GLU A 121 7.779 3.132 9.475 1.00 0.00 C ATOM 949 O GLU A 121 8.707 3.302 8.686 1.00 0.00 O ATOM 950 CB GLU A 121 5.759 4.611 9.432 1.00 0.00 C ATOM 951 CG GLU A 121 4.671 5.081 8.477 1.00 0.00 C ATOM 952 CD GLU A 121 4.446 6.565 8.736 1.00 0.00 C ATOM 953 OE1 GLU A 121 3.864 6.877 9.801 1.00 0.00 O ATOM 954 OE2 GLU A 121 4.979 7.413 7.983 1.00 0.00 O ATOM 0 H GLU A 121 5.498 2.093 10.448 1.00 0.00 H new ATOM 0 HA GLU A 121 6.378 3.288 7.891 1.00 0.00 H new ATOM 0 HB2 GLU A 121 5.344 4.502 10.434 1.00 0.00 H new ATOM 0 HB3 GLU A 121 6.544 5.365 9.492 1.00 0.00 H new ATOM 0 HG2 GLU A 121 4.970 4.913 7.442 1.00 0.00 H new ATOM 0 HG3 GLU A 121 3.751 4.520 8.638 1.00 0.00 H new ATOM 961 N GLN A 122 7.941 2.802 10.761 1.00 0.00 N ATOM 962 CA GLN A 122 9.215 2.710 11.456 1.00 0.00 C ATOM 963 C GLN A 122 10.164 1.804 10.685 1.00 0.00 C ATOM 964 O GLN A 122 10.963 2.305 9.905 1.00 0.00 O ATOM 965 CB GLN A 122 8.983 2.232 12.896 1.00 0.00 C ATOM 966 CG GLN A 122 8.600 3.357 13.856 1.00 0.00 C ATOM 967 CD GLN A 122 9.807 4.234 14.164 1.00 0.00 C ATOM 968 OE1 GLN A 122 10.717 3.819 14.880 1.00 0.00 O ATOM 969 NE2 GLN A 122 9.877 5.418 13.589 1.00 0.00 N ATOM 0 H GLN A 122 7.149 2.584 11.366 1.00 0.00 H new ATOM 0 HA GLN A 122 9.685 3.692 11.510 1.00 0.00 H new ATOM 0 HB2 GLN A 122 8.195 1.479 12.898 1.00 0.00 H new ATOM 0 HB3 GLN A 122 9.889 1.747 13.260 1.00 0.00 H new ATOM 0 HG2 GLN A 122 7.807 3.962 13.417 1.00 0.00 H new ATOM 0 HG3 GLN A 122 8.205 2.935 14.780 1.00 0.00 H new ATOM 0 HE21 GLN A 122 9.112 5.744 12.999 1.00 0.00 H new ATOM 0 HE22 GLN A 122 10.696 6.008 13.734 1.00 0.00 H new ATOM 978 N ARG A 123 10.085 0.477 10.840 1.00 0.00 N ATOM 979 CA ARG A 123 10.963 -0.394 10.051 1.00 0.00 C ATOM 980 C ARG A 123 10.601 -0.353 8.571 1.00 0.00 C ATOM 981 O ARG A 123 11.450 -0.697 7.750 1.00 0.00 O ATOM 982 CB ARG A 123 10.977 -1.840 10.582 1.00 0.00 C ATOM 983 CG ARG A 123 12.098 -2.109 11.580 1.00 0.00 C ATOM 984 CD ARG A 123 11.983 -1.207 12.811 1.00 0.00 C ATOM 985 NE ARG A 123 12.610 -1.814 13.987 1.00 0.00 N ATOM 986 CZ ARG A 123 12.007 -2.584 14.898 1.00 0.00 C ATOM 987 NH1 ARG A 123 10.737 -2.969 14.755 1.00 0.00 N ATOM 988 NH2 ARG A 123 12.691 -2.959 15.965 1.00 0.00 N ATOM 0 H ARG A 123 9.449 -0.002 11.478 1.00 0.00 H new ATOM 0 HA ARG A 123 11.975 -0.005 10.159 1.00 0.00 H new ATOM 0 HB2 ARG A 123 10.019 -2.054 11.057 1.00 0.00 H new ATOM 0 HB3 ARG A 123 11.077 -2.527 9.741 1.00 0.00 H new ATOM 0 HG2 ARG A 123 12.068 -3.154 11.889 1.00 0.00 H new ATOM 0 HG3 ARG A 123 13.062 -1.947 11.098 1.00 0.00 H new ATOM 0 HD2 ARG A 123 12.453 -0.246 12.603 1.00 0.00 H new ATOM 0 HD3 ARG A 123 10.932 -1.009 13.020 1.00 0.00 H new ATOM 0 HE ARG A 123 13.604 -1.631 14.124 1.00 0.00 H new ATOM 0 HH11 ARG A 123 10.204 -2.675 13.936 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.299 -3.557 15.464 1.00 0.00 H new ATOM 0 HH21 ARG A 123 13.660 -2.661 16.081 1.00 0.00 H new ATOM 0 HH22 ARG A 123 12.250 -3.547 16.673 1.00 0.00 H new ATOM 1002 N ALA A 124 9.399 0.083 8.186 1.00 0.00 N ATOM 1003 CA ALA A 124 9.032 0.113 6.773 1.00 0.00 C ATOM 1004 C ALA A 124 9.898 1.081 5.985 1.00 0.00 C ATOM 1005 O ALA A 124 9.957 0.976 4.762 1.00 0.00 O ATOM 1006 CB ALA A 124 7.568 0.501 6.607 1.00 0.00 C ATOM 0 H ALA A 124 8.675 0.415 8.823 1.00 0.00 H new ATOM 0 HA ALA A 124 9.193 -0.891 6.381 1.00 0.00 H new ATOM 0 HB1 ALA A 124 7.314 0.518 5.547 1.00 0.00 H new ATOM 0 HB2 ALA A 124 6.938 -0.226 7.120 1.00 0.00 H new ATOM 0 HB3 ALA A 124 7.403 1.490 7.035 1.00 0.00 H new ATOM 1012 N TRP A 125 10.573 1.991 6.684 1.00 0.00 N ATOM 1013 CA TRP A 125 11.531 2.895 6.113 1.00 0.00 C ATOM 1014 C TRP A 125 12.887 2.661 6.778 1.00 0.00 C ATOM 1015 O TRP A 125 13.823 2.322 6.080 1.00 0.00 O ATOM 1016 CB TRP A 125 10.951 4.309 6.181 1.00 0.00 C ATOM 1017 CG TRP A 125 11.220 5.182 5.001 1.00 0.00 C ATOM 1018 CD1 TRP A 125 11.544 6.484 5.101 1.00 0.00 C ATOM 1019 CD2 TRP A 125 11.141 4.891 3.566 1.00 0.00 C ATOM 1020 NE1 TRP A 125 11.696 7.024 3.839 1.00 0.00 N ATOM 1021 CE2 TRP A 125 11.522 6.069 2.856 1.00 0.00 C ATOM 1022 CE3 TRP A 125 10.767 3.774 2.783 1.00 0.00 C ATOM 1023 CZ2 TRP A 125 11.617 6.096 1.455 1.00 0.00 C ATOM 1024 CZ3 TRP A 125 10.825 3.805 1.376 1.00 0.00 C ATOM 1025 CH2 TRP A 125 11.279 4.953 0.708 1.00 0.00 C ATOM 0 H TRP A 125 10.455 2.112 7.690 1.00 0.00 H new ATOM 0 HA TRP A 125 11.723 2.724 5.054 1.00 0.00 H new ATOM 0 HB2 TRP A 125 9.872 4.232 6.313 1.00 0.00 H new ATOM 0 HB3 TRP A 125 11.347 4.801 7.070 1.00 0.00 H new ATOM 0 HD1 TRP A 125 11.667 7.025 6.028 1.00 0.00 H new ATOM 0 HE1 TRP A 125 11.910 8.004 3.656 1.00 0.00 H new ATOM 0 HE3 TRP A 125 10.428 2.875 3.276 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 11.949 6.992 0.952 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 10.518 2.940 0.807 1.00 0.00 H new ATOM 0 HH2 TRP A 125 11.368 4.959 -0.368 1.00 0.00 H new ATOM 1036 N ASP A 126 13.015 2.721 8.103 1.00 0.00 N ATOM 1037 CA ASP A 126 14.270 2.508 8.856 1.00 0.00 C ATOM 1038 C ASP A 126 15.061 1.254 8.453 1.00 0.00 C ATOM 1039 O ASP A 126 16.293 1.293 8.421 1.00 0.00 O ATOM 1040 CB ASP A 126 13.943 2.407 10.355 1.00 0.00 C ATOM 1041 CG ASP A 126 15.146 2.498 11.292 1.00 0.00 C ATOM 1042 OD1 ASP A 126 15.854 1.483 11.517 1.00 0.00 O ATOM 1043 OD2 ASP A 126 15.254 3.540 11.972 1.00 0.00 O ATOM 0 H ASP A 126 12.223 2.926 8.713 1.00 0.00 H new ATOM 0 HA ASP A 126 14.903 3.363 8.620 1.00 0.00 H new ATOM 0 HB2 ASP A 126 13.242 3.201 10.612 1.00 0.00 H new ATOM 0 HB3 ASP A 126 13.433 1.461 10.536 1.00 0.00 H new ATOM 1048 N LEU A 127 14.388 0.137 8.134 1.00 0.00 N ATOM 1049 CA LEU A 127 15.050 -1.035 7.592 1.00 0.00 C ATOM 1050 C LEU A 127 15.263 -0.781 6.100 1.00 0.00 C ATOM 1051 O LEU A 127 16.395 -0.809 5.633 1.00 0.00 O ATOM 1052 CB LEU A 127 14.275 -2.311 7.985 1.00 0.00 C ATOM 1053 CG LEU A 127 14.216 -3.431 6.942 1.00 0.00 C ATOM 1054 CD1 LEU A 127 15.597 -3.978 6.617 1.00 0.00 C ATOM 1055 CD2 LEU A 127 13.321 -4.567 7.434 1.00 0.00 C ATOM 0 H LEU A 127 13.380 0.032 8.247 1.00 0.00 H new ATOM 0 HA LEU A 127 16.040 -1.213 8.013 1.00 0.00 H new ATOM 0 HB2 LEU A 127 14.724 -2.715 8.893 1.00 0.00 H new ATOM 0 HB3 LEU A 127 13.253 -2.025 8.235 1.00 0.00 H new ATOM 0 HG LEU A 127 13.799 -3.001 6.031 1.00 0.00 H new ATOM 0 HD11 LEU A 127 15.509 -4.770 5.873 1.00 0.00 H new ATOM 0 HD12 LEU A 127 16.222 -3.177 6.222 1.00 0.00 H new ATOM 0 HD13 LEU A 127 16.052 -4.380 7.523 1.00 0.00 H new ATOM 0 HD21 LEU A 127 13.288 -5.356 6.683 1.00 0.00 H new ATOM 0 HD22 LEU A 127 13.721 -4.969 8.365 1.00 0.00 H new ATOM 0 HD23 LEU A 127 12.314 -4.188 7.606 1.00 0.00 H new ATOM 1067 N ALA A 128 14.198 -0.493 5.356 1.00 0.00 N ATOM 1068 CA ALA A 128 14.223 -0.319 3.908 1.00 0.00 C ATOM 1069 C ALA A 128 15.315 0.653 3.407 1.00 0.00 C ATOM 1070 O ALA A 128 15.914 0.384 2.366 1.00 0.00 O ATOM 1071 CB ALA A 128 12.814 0.075 3.473 1.00 0.00 C ATOM 0 H ALA A 128 13.268 -0.371 5.756 1.00 0.00 H new ATOM 0 HA ALA A 128 14.509 -1.260 3.438 1.00 0.00 H new ATOM 0 HB1 ALA A 128 12.793 0.215 2.392 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.114 -0.713 3.751 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.528 1.005 3.965 1.00 0.00 H new ATOM 1077 N LEU A 129 15.632 1.716 4.156 1.00 0.00 N ATOM 1078 CA LEU A 129 16.675 2.717 3.920 1.00 0.00 C ATOM 1079 C LEU A 129 18.038 2.060 3.681 1.00 0.00 C ATOM 1080 O LEU A 129 18.776 2.508 2.805 1.00 0.00 O ATOM 1081 CB LEU A 129 16.778 3.675 5.135 1.00 0.00 C ATOM 1082 CG LEU A 129 16.112 5.064 5.034 1.00 0.00 C ATOM 1083 CD1 LEU A 129 16.697 5.937 3.926 1.00 0.00 C ATOM 1084 CD2 LEU A 129 14.598 5.051 4.840 1.00 0.00 C ATOM 0 H LEU A 129 15.120 1.913 5.016 1.00 0.00 H new ATOM 0 HA LEU A 129 16.398 3.277 3.027 1.00 0.00 H new ATOM 0 HB2 LEU A 129 16.351 3.164 5.998 1.00 0.00 H new ATOM 0 HB3 LEU A 129 17.836 3.829 5.348 1.00 0.00 H new ATOM 0 HG LEU A 129 16.333 5.484 6.015 1.00 0.00 H new ATOM 0 HD11 LEU A 129 16.183 6.898 3.911 1.00 0.00 H new ATOM 0 HD12 LEU A 129 17.759 6.096 4.111 1.00 0.00 H new ATOM 0 HD13 LEU A 129 16.566 5.441 2.964 1.00 0.00 H new ATOM 0 HD21 LEU A 129 14.230 6.075 4.781 1.00 0.00 H new ATOM 0 HD22 LEU A 129 14.354 4.524 3.917 1.00 0.00 H new ATOM 0 HD23 LEU A 129 14.128 4.544 5.683 1.00 0.00 H new ATOM 1096 N HIS A 130 18.365 0.985 4.410 1.00 0.00 N ATOM 1097 CA HIS A 130 19.612 0.237 4.243 1.00 0.00 C ATOM 1098 C HIS A 130 19.804 -0.181 2.786 1.00 0.00 C ATOM 1099 O HIS A 130 20.927 -0.255 2.299 1.00 0.00 O ATOM 1100 CB HIS A 130 19.598 -1.005 5.156 1.00 0.00 C ATOM 1101 CG HIS A 130 20.584 -2.090 4.796 1.00 0.00 C ATOM 1102 ND1 HIS A 130 21.678 -2.480 5.533 1.00 0.00 N ATOM 1103 CD2 HIS A 130 20.504 -2.904 3.694 1.00 0.00 C ATOM 1104 CE1 HIS A 130 22.245 -3.512 4.888 1.00 0.00 C ATOM 1105 NE2 HIS A 130 21.573 -3.806 3.759 1.00 0.00 N ATOM 0 H HIS A 130 17.762 0.608 5.141 1.00 0.00 H new ATOM 0 HA HIS A 130 20.446 0.881 4.523 1.00 0.00 H new ATOM 0 HB2 HIS A 130 19.795 -0.684 6.179 1.00 0.00 H new ATOM 0 HB3 HIS A 130 18.595 -1.432 5.144 1.00 0.00 H new ATOM 0 HD2 HIS A 130 19.754 -2.857 2.919 1.00 0.00 H new ATOM 0 HE1 HIS A 130 23.125 -4.037 5.230 1.00 0.00 H new ATOM 0 HE2 HIS A 130 21.798 -4.539 3.086 1.00 0.00 H new ATOM 1113 N THR A 131 18.731 -0.499 2.069 1.00 0.00 N ATOM 1114 CA THR A 131 18.819 -1.043 0.721 1.00 0.00 C ATOM 1115 C THR A 131 19.373 0.009 -0.265 1.00 0.00 C ATOM 1116 O THR A 131 19.811 -0.330 -1.363 1.00 0.00 O ATOM 1117 CB THR A 131 17.437 -1.584 0.322 1.00 0.00 C ATOM 1118 OG1 THR A 131 16.707 -2.066 1.439 1.00 0.00 O ATOM 1119 CG2 THR A 131 17.510 -2.711 -0.705 1.00 0.00 C ATOM 0 H THR A 131 17.776 -0.386 2.408 1.00 0.00 H new ATOM 0 HA THR A 131 19.527 -1.871 0.688 1.00 0.00 H new ATOM 0 HB THR A 131 16.927 -0.728 -0.119 1.00 0.00 H new ATOM 0 HG1 THR A 131 16.220 -1.325 1.856 1.00 0.00 H new ATOM 0 HG21 THR A 131 16.502 -3.050 -0.946 1.00 0.00 H new ATOM 0 HG22 THR A 131 17.996 -2.347 -1.610 1.00 0.00 H new ATOM 0 HG23 THR A 131 18.084 -3.542 -0.294 1.00 0.00 H new ATOM 1127 N TRP A 132 19.444 1.282 0.134 1.00 0.00 N ATOM 1128 CA TRP A 132 20.141 2.323 -0.616 1.00 0.00 C ATOM 1129 C TRP A 132 21.659 2.276 -0.415 1.00 0.00 C ATOM 1130 O TRP A 132 22.406 2.837 -1.220 1.00 0.00 O ATOM 1131 CB TRP A 132 19.642 3.691 -0.177 1.00 0.00 C ATOM 1132 CG TRP A 132 18.166 3.958 -0.233 1.00 0.00 C ATOM 1133 CD1 TRP A 132 17.496 4.605 0.740 1.00 0.00 C ATOM 1134 CD2 TRP A 132 17.165 3.635 -1.251 1.00 0.00 C ATOM 1135 NE1 TRP A 132 16.178 4.777 0.378 1.00 0.00 N ATOM 1136 CE2 TRP A 132 15.913 4.185 -0.833 1.00 0.00 C ATOM 1137 CE3 TRP A 132 17.164 2.929 -2.475 1.00 0.00 C ATOM 1138 CZ2 TRP A 132 14.742 4.079 -1.595 1.00 0.00 C ATOM 1139 CZ3 TRP A 132 15.988 2.805 -3.241 1.00 0.00 C ATOM 1140 CH2 TRP A 132 14.785 3.391 -2.815 1.00 0.00 C ATOM 0 H TRP A 132 19.014 1.619 0.995 1.00 0.00 H new ATOM 0 HA TRP A 132 19.931 2.147 -1.671 1.00 0.00 H new ATOM 0 HB2 TRP A 132 19.971 3.852 0.850 1.00 0.00 H new ATOM 0 HB3 TRP A 132 20.140 4.440 -0.792 1.00 0.00 H new ATOM 0 HD1 TRP A 132 17.930 4.941 1.670 1.00 0.00 H new ATOM 0 HE1 TRP A 132 15.488 5.279 0.937 1.00 0.00 H new ATOM 0 HE3 TRP A 132 18.079 2.477 -2.829 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 13.820 4.521 -1.247 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 16.012 2.252 -4.168 1.00 0.00 H new ATOM 0 HH2 TRP A 132 13.897 3.312 -3.425 1.00 0.00 H new ATOM 1151 N GLU A 133 22.137 1.613 0.634 1.00 0.00 N ATOM 1152 CA GLU A 133 23.515 1.159 0.721 1.00 0.00 C ATOM 1153 C GLU A 133 23.725 0.170 -0.429 1.00 0.00 C ATOM 1154 O GLU A 133 24.566 0.406 -1.293 1.00 0.00 O ATOM 1155 CB GLU A 133 23.850 0.536 2.091 1.00 0.00 C ATOM 1156 CG GLU A 133 25.370 0.541 2.316 1.00 0.00 C ATOM 1157 CD GLU A 133 25.829 -0.641 3.172 1.00 0.00 C ATOM 1158 OE1 GLU A 133 25.734 -0.610 4.417 1.00 0.00 O ATOM 1159 OE2 GLU A 133 26.303 -1.651 2.601 1.00 0.00 O ATOM 0 H GLU A 133 21.573 1.376 1.450 1.00 0.00 H new ATOM 0 HA GLU A 133 24.196 2.005 0.632 1.00 0.00 H new ATOM 0 HB2 GLU A 133 23.355 1.096 2.885 1.00 0.00 H new ATOM 0 HB3 GLU A 133 23.471 -0.485 2.137 1.00 0.00 H new ATOM 0 HG2 GLU A 133 25.879 0.509 1.353 1.00 0.00 H new ATOM 0 HG3 GLU A 133 25.661 1.473 2.800 1.00 0.00 H new ATOM 1166 N GLN A 134 22.909 -0.889 -0.473 1.00 0.00 N ATOM 1167 CA GLN A 134 23.031 -1.996 -1.418 1.00 0.00 C ATOM 1168 C GLN A 134 22.959 -1.526 -2.880 1.00 0.00 C ATOM 1169 O GLN A 134 23.799 -1.918 -3.691 1.00 0.00 O ATOM 1170 CB GLN A 134 21.940 -3.046 -1.146 1.00 0.00 C ATOM 1171 CG GLN A 134 22.002 -3.733 0.232 1.00 0.00 C ATOM 1172 CD GLN A 134 22.549 -5.153 0.114 1.00 0.00 C ATOM 1173 OE1 GLN A 134 21.802 -6.115 -0.056 1.00 0.00 O ATOM 1174 NE2 GLN A 134 23.860 -5.324 0.122 1.00 0.00 N ATOM 0 H GLN A 134 22.124 -0.999 0.168 1.00 0.00 H new ATOM 0 HA GLN A 134 24.014 -2.442 -1.269 1.00 0.00 H new ATOM 0 HB2 GLN A 134 20.967 -2.567 -1.249 1.00 0.00 H new ATOM 0 HB3 GLN A 134 22.000 -3.814 -1.917 1.00 0.00 H new ATOM 0 HG2 GLN A 134 22.633 -3.151 0.904 1.00 0.00 H new ATOM 0 HG3 GLN A 134 21.006 -3.759 0.674 1.00 0.00 H new ATOM 0 HE21 GLN A 134 24.478 -4.525 0.263 1.00 0.00 H new ATOM 0 HE22 GLN A 134 24.254 -6.255 -0.013 1.00 0.00 H new ATOM 1183 N MET A 135 21.950 -0.728 -3.251 1.00 0.00 N ATOM 1184 CA MET A 135 21.778 -0.245 -4.617 1.00 0.00 C ATOM 1185 C MET A 135 22.604 1.008 -4.911 1.00 0.00 C ATOM 1186 O MET A 135 22.695 1.399 -6.073 1.00 0.00 O ATOM 1187 CB MET A 135 20.299 0.047 -4.863 1.00 0.00 C ATOM 1188 CG MET A 135 19.409 -1.193 -4.829 1.00 0.00 C ATOM 1189 SD MET A 135 17.662 -0.790 -4.614 1.00 0.00 S ATOM 1190 CE MET A 135 17.420 0.563 -5.802 1.00 0.00 C ATOM 0 H MET A 135 21.230 -0.401 -2.606 1.00 0.00 H new ATOM 0 HA MET A 135 22.135 -1.027 -5.288 1.00 0.00 H new ATOM 0 HB2 MET A 135 19.949 0.754 -4.111 1.00 0.00 H new ATOM 0 HB3 MET A 135 20.191 0.533 -5.833 1.00 0.00 H new ATOM 0 HG2 MET A 135 19.537 -1.753 -5.755 1.00 0.00 H new ATOM 0 HG3 MET A 135 19.730 -1.844 -4.016 1.00 0.00 H new ATOM 0 HE1 MET A 135 16.372 0.604 -6.098 1.00 0.00 H new ATOM 0 HE2 MET A 135 17.704 1.508 -5.340 1.00 0.00 H new ATOM 0 HE3 MET A 135 18.039 0.389 -6.682 1.00 0.00 H new ATOM 1200 N GLY A 136 23.172 1.668 -3.901 1.00 0.00 N ATOM 1201 CA GLY A 136 24.028 2.826 -4.108 1.00 0.00 C ATOM 1202 C GLY A 136 23.298 4.141 -4.378 1.00 0.00 C ATOM 1203 O GLY A 136 23.955 5.141 -4.683 1.00 0.00 O ATOM 0 H GLY A 136 23.049 1.412 -2.921 1.00 0.00 H new ATOM 0 HA2 GLY A 136 24.657 2.954 -3.227 1.00 0.00 H new ATOM 0 HA3 GLY A 136 24.692 2.620 -4.947 1.00 0.00 H new ATOM 1207 N LEU A 137 21.965 4.182 -4.262 1.00 0.00 N ATOM 1208 CA LEU A 137 21.160 5.364 -4.569 1.00 0.00 C ATOM 1209 C LEU A 137 21.246 6.327 -3.393 1.00 0.00 C ATOM 1210 O LEU A 137 20.355 6.408 -2.542 1.00 0.00 O ATOM 1211 CB LEU A 137 19.693 5.008 -4.877 1.00 0.00 C ATOM 1212 CG LEU A 137 19.372 4.445 -6.275 1.00 0.00 C ATOM 1213 CD1 LEU A 137 19.562 5.463 -7.394 1.00 0.00 C ATOM 1214 CD2 LEU A 137 20.174 3.202 -6.599 1.00 0.00 C ATOM 0 H LEU A 137 21.412 3.385 -3.948 1.00 0.00 H new ATOM 0 HA LEU A 137 21.557 5.832 -5.470 1.00 0.00 H new ATOM 0 HB2 LEU A 137 19.362 4.279 -4.137 1.00 0.00 H new ATOM 0 HB3 LEU A 137 19.092 5.905 -4.731 1.00 0.00 H new ATOM 0 HG LEU A 137 18.315 4.185 -6.225 1.00 0.00 H new ATOM 0 HD11 LEU A 137 19.319 5.001 -8.351 1.00 0.00 H new ATOM 0 HD12 LEU A 137 18.905 6.316 -7.225 1.00 0.00 H new ATOM 0 HD13 LEU A 137 20.598 5.801 -7.407 1.00 0.00 H new ATOM 0 HD21 LEU A 137 19.909 2.847 -7.595 1.00 0.00 H new ATOM 0 HD22 LEU A 137 21.238 3.437 -6.569 1.00 0.00 H new ATOM 0 HD23 LEU A 137 19.953 2.425 -5.867 1.00 0.00 H new ATOM 1226 N ARG A 138 22.346 7.076 -3.367 1.00 0.00 N ATOM 1227 CA ARG A 138 22.612 8.103 -2.377 1.00 0.00 C ATOM 1228 C ARG A 138 21.462 9.095 -2.354 1.00 0.00 C ATOM 1229 O ARG A 138 20.969 9.388 -1.273 1.00 0.00 O ATOM 1230 CB ARG A 138 23.936 8.791 -2.714 1.00 0.00 C ATOM 1231 CG ARG A 138 24.633 9.485 -1.541 1.00 0.00 C ATOM 1232 CD ARG A 138 25.989 9.949 -2.078 1.00 0.00 C ATOM 1233 NE ARG A 138 26.764 10.714 -1.099 1.00 0.00 N ATOM 1234 CZ ARG A 138 27.812 11.487 -1.388 1.00 0.00 C ATOM 1235 NH1 ARG A 138 28.293 11.557 -2.628 1.00 0.00 N ATOM 1236 NH2 ARG A 138 28.405 12.176 -0.425 1.00 0.00 N ATOM 0 H ARG A 138 23.093 6.979 -4.054 1.00 0.00 H new ATOM 0 HA ARG A 138 22.696 7.661 -1.384 1.00 0.00 H new ATOM 0 HB2 ARG A 138 24.616 8.048 -3.131 1.00 0.00 H new ATOM 0 HB3 ARG A 138 23.754 9.530 -3.495 1.00 0.00 H new ATOM 0 HG2 ARG A 138 24.045 10.329 -1.181 1.00 0.00 H new ATOM 0 HG3 ARG A 138 24.758 8.802 -0.701 1.00 0.00 H new ATOM 0 HD2 ARG A 138 26.567 9.079 -2.390 1.00 0.00 H new ATOM 0 HD3 ARG A 138 25.831 10.561 -2.966 1.00 0.00 H new ATOM 0 HE ARG A 138 26.481 10.651 -0.121 1.00 0.00 H new ATOM 0 HH11 ARG A 138 27.859 11.014 -3.375 1.00 0.00 H new ATOM 0 HH12 ARG A 138 29.095 12.153 -2.831 1.00 0.00 H new ATOM 0 HH21 ARG A 138 28.060 12.114 0.533 1.00 0.00 H new ATOM 0 HH22 ARG A 138 29.207 12.768 -0.641 1.00 0.00 H new ATOM 1250 N SER A 139 21.011 9.548 -3.526 1.00 0.00 N ATOM 1251 CA SER A 139 19.872 10.424 -3.732 1.00 0.00 C ATOM 1252 C SER A 139 18.668 9.955 -2.935 1.00 0.00 C ATOM 1253 O SER A 139 18.105 10.728 -2.177 1.00 0.00 O ATOM 1254 CB SER A 139 19.535 10.472 -5.227 1.00 0.00 C ATOM 1255 OG SER A 139 19.572 9.169 -5.796 1.00 0.00 O ATOM 0 H SER A 139 21.463 9.294 -4.404 1.00 0.00 H new ATOM 0 HA SER A 139 20.131 11.423 -3.382 1.00 0.00 H new ATOM 0 HB2 SER A 139 18.545 10.907 -5.367 1.00 0.00 H new ATOM 0 HB3 SER A 139 20.244 11.119 -5.743 1.00 0.00 H new ATOM 0 HG SER A 139 19.352 9.222 -6.750 1.00 0.00 H new ATOM 1261 N LEU A 140 18.263 8.696 -3.079 1.00 0.00 N ATOM 1262 CA LEU A 140 17.048 8.199 -2.451 1.00 0.00 C ATOM 1263 C LEU A 140 17.204 8.142 -0.939 1.00 0.00 C ATOM 1264 O LEU A 140 16.274 8.523 -0.225 1.00 0.00 O ATOM 1265 CB LEU A 140 16.687 6.824 -3.011 1.00 0.00 C ATOM 1266 CG LEU A 140 16.398 6.849 -4.522 1.00 0.00 C ATOM 1267 CD1 LEU A 140 16.235 5.431 -5.036 1.00 0.00 C ATOM 1268 CD2 LEU A 140 15.157 7.690 -4.864 1.00 0.00 C ATOM 0 H LEU A 140 18.764 7.999 -3.630 1.00 0.00 H new ATOM 0 HA LEU A 140 16.236 8.889 -2.678 1.00 0.00 H new ATOM 0 HB2 LEU A 140 17.505 6.131 -2.814 1.00 0.00 H new ATOM 0 HB3 LEU A 140 15.812 6.442 -2.485 1.00 0.00 H new ATOM 0 HG LEU A 140 17.248 7.322 -5.014 1.00 0.00 H new ATOM 0 HD11 LEU A 140 16.030 5.453 -6.106 1.00 0.00 H new ATOM 0 HD12 LEU A 140 17.152 4.870 -4.853 1.00 0.00 H new ATOM 0 HD13 LEU A 140 15.406 4.949 -4.518 1.00 0.00 H new ATOM 0 HD21 LEU A 140 14.994 7.677 -5.942 1.00 0.00 H new ATOM 0 HD22 LEU A 140 14.285 7.273 -4.360 1.00 0.00 H new ATOM 0 HD23 LEU A 140 15.311 8.717 -4.533 1.00 0.00 H new ATOM 1280 N CYS A 141 18.365 7.714 -0.439 1.00 0.00 N ATOM 1281 CA CYS A 141 18.659 7.749 0.989 1.00 0.00 C ATOM 1282 C CYS A 141 18.609 9.184 1.508 1.00 0.00 C ATOM 1283 O CYS A 141 18.058 9.452 2.577 1.00 0.00 O ATOM 1284 CB CYS A 141 20.040 7.132 1.228 1.00 0.00 C ATOM 1285 SG CYS A 141 20.289 6.855 2.998 1.00 0.00 S ATOM 0 H CYS A 141 19.121 7.337 -1.011 1.00 0.00 H new ATOM 0 HA CYS A 141 17.909 7.173 1.532 1.00 0.00 H new ATOM 0 HB2 CYS A 141 20.126 6.189 0.687 1.00 0.00 H new ATOM 0 HB3 CYS A 141 20.816 7.793 0.841 1.00 0.00 H new ATOM 0 HG CYS A 141 21.462 6.329 3.194 1.00 0.00 H new ATOM 1291 N ALA A 142 19.202 10.092 0.740 1.00 0.00 N ATOM 1292 CA ALA A 142 19.323 11.492 1.047 1.00 0.00 C ATOM 1293 C ALA A 142 17.931 12.119 1.051 1.00 0.00 C ATOM 1294 O ALA A 142 17.460 12.496 2.112 1.00 0.00 O ATOM 1295 CB ALA A 142 20.327 12.133 0.077 1.00 0.00 C ATOM 0 H ALA A 142 19.628 9.848 -0.154 1.00 0.00 H new ATOM 0 HA ALA A 142 19.728 11.664 2.044 1.00 0.00 H new ATOM 0 HB1 ALA A 142 20.424 13.195 0.303 1.00 0.00 H new ATOM 0 HB2 ALA A 142 21.297 11.648 0.185 1.00 0.00 H new ATOM 0 HB3 ALA A 142 19.973 12.011 -0.947 1.00 0.00 H new ATOM 1301 N GLN A 143 17.203 12.154 -0.063 1.00 0.00 N ATOM 1302 CA GLN A 143 15.835 12.656 -0.150 1.00 0.00 C ATOM 1303 C GLN A 143 14.881 11.995 0.865 1.00 0.00 C ATOM 1304 O GLN A 143 13.893 12.620 1.255 1.00 0.00 O ATOM 1305 CB GLN A 143 15.300 12.516 -1.584 1.00 0.00 C ATOM 1306 CG GLN A 143 15.696 13.632 -2.548 1.00 0.00 C ATOM 1307 CD GLN A 143 17.048 13.464 -3.229 1.00 0.00 C ATOM 1308 OE1 GLN A 143 17.122 12.882 -4.310 1.00 0.00 O ATOM 1309 NE2 GLN A 143 18.115 14.028 -2.694 1.00 0.00 N ATOM 0 H GLN A 143 17.561 11.823 -0.959 1.00 0.00 H new ATOM 0 HA GLN A 143 15.871 13.713 0.113 1.00 0.00 H new ATOM 0 HB2 GLN A 143 15.649 11.567 -1.992 1.00 0.00 H new ATOM 0 HB3 GLN A 143 14.212 12.465 -1.543 1.00 0.00 H new ATOM 0 HG2 GLN A 143 14.929 13.712 -3.318 1.00 0.00 H new ATOM 0 HG3 GLN A 143 15.699 14.575 -2.002 1.00 0.00 H new ATOM 0 HE21 GLN A 143 18.042 14.508 -1.797 1.00 0.00 H new ATOM 0 HE22 GLN A 143 19.012 13.984 -3.178 1.00 0.00 H new ATOM 1318 N ALA A 144 15.139 10.766 1.328 1.00 0.00 N ATOM 1319 CA ALA A 144 14.367 10.163 2.410 1.00 0.00 C ATOM 1320 C ALA A 144 14.613 10.831 3.772 1.00 0.00 C ATOM 1321 O ALA A 144 13.753 10.696 4.644 1.00 0.00 O ATOM 1322 CB ALA A 144 14.626 8.655 2.490 1.00 0.00 C ATOM 0 H ALA A 144 15.883 10.170 0.964 1.00 0.00 H new ATOM 0 HA ALA A 144 13.317 10.330 2.169 1.00 0.00 H new ATOM 0 HB1 ALA A 144 14.040 8.228 3.304 1.00 0.00 H new ATOM 0 HB2 ALA A 144 14.337 8.186 1.549 1.00 0.00 H new ATOM 0 HB3 ALA A 144 15.686 8.477 2.674 1.00 0.00 H new ATOM 1328 N GLN A 145 15.747 11.504 4.012 1.00 0.00 N ATOM 1329 CA GLN A 145 16.214 11.854 5.357 1.00 0.00 C ATOM 1330 C GLN A 145 16.881 13.236 5.413 1.00 0.00 C ATOM 1331 O GLN A 145 17.450 13.611 6.436 1.00 0.00 O ATOM 1332 CB GLN A 145 17.141 10.744 5.884 1.00 0.00 C ATOM 1333 CG GLN A 145 16.357 9.429 5.995 1.00 0.00 C ATOM 1334 CD GLN A 145 17.101 8.327 6.715 1.00 0.00 C ATOM 1335 OE1 GLN A 145 16.653 7.864 7.763 1.00 0.00 O ATOM 1336 NE2 GLN A 145 18.195 7.866 6.146 1.00 0.00 N ATOM 0 H GLN A 145 16.370 11.823 3.270 1.00 0.00 H new ATOM 0 HA GLN A 145 15.344 11.927 6.009 1.00 0.00 H new ATOM 0 HB2 GLN A 145 17.991 10.617 5.213 1.00 0.00 H new ATOM 0 HB3 GLN A 145 17.542 11.023 6.858 1.00 0.00 H new ATOM 0 HG2 GLN A 145 15.419 9.620 6.516 1.00 0.00 H new ATOM 0 HG3 GLN A 145 16.101 9.085 4.993 1.00 0.00 H new ATOM 0 HE21 GLN A 145 18.531 8.280 5.276 1.00 0.00 H new ATOM 0 HE22 GLN A 145 18.707 7.095 6.575 1.00 0.00 H new ATOM 1345 N GLU A 146 16.809 14.011 4.333 1.00 0.00 N ATOM 1346 CA GLU A 146 17.402 15.342 4.185 1.00 0.00 C ATOM 1347 C GLU A 146 16.321 16.425 4.310 1.00 0.00 C ATOM 1348 O GLU A 146 16.447 17.538 3.800 1.00 0.00 O ATOM 1349 CB GLU A 146 18.210 15.367 2.881 1.00 0.00 C ATOM 1350 CG GLU A 146 17.330 15.575 1.650 1.00 0.00 C ATOM 1351 CD GLU A 146 17.984 15.484 0.271 1.00 0.00 C ATOM 1352 OE1 GLU A 146 19.126 15.003 0.128 1.00 0.00 O ATOM 1353 OE2 GLU A 146 17.310 15.865 -0.711 1.00 0.00 O ATOM 0 H GLU A 146 16.311 13.714 3.494 1.00 0.00 H new ATOM 0 HA GLU A 146 18.103 15.567 4.989 1.00 0.00 H new ATOM 0 HB2 GLU A 146 18.951 16.164 2.932 1.00 0.00 H new ATOM 0 HB3 GLU A 146 18.757 14.430 2.778 1.00 0.00 H new ATOM 0 HG2 GLU A 146 16.527 14.839 1.687 1.00 0.00 H new ATOM 0 HG3 GLU A 146 16.866 16.558 1.734 1.00 0.00 H new ATOM 1360 N GLY A 147 15.196 16.037 4.906 1.00 0.00 N ATOM 1361 CA GLY A 147 13.972 16.823 4.975 1.00 0.00 C ATOM 1362 C GLY A 147 13.353 16.974 3.589 1.00 0.00 C ATOM 1363 O GLY A 147 12.758 18.011 3.292 1.00 0.00 O ATOM 0 H GLY A 147 15.111 15.133 5.370 1.00 0.00 H new ATOM 0 HA2 GLY A 147 13.261 16.341 5.646 1.00 0.00 H new ATOM 0 HA3 GLY A 147 14.188 17.807 5.392 1.00 0.00 H new ATOM 1367 N ALA A 148 13.539 15.973 2.719 1.00 0.00 N ATOM 1368 CA ALA A 148 13.295 16.003 1.278 1.00 0.00 C ATOM 1369 C ALA A 148 14.043 17.122 0.525 1.00 0.00 C ATOM 1370 O ALA A 148 13.865 17.279 -0.687 1.00 0.00 O ATOM 1371 CB ALA A 148 11.786 15.985 1.012 1.00 0.00 C ATOM 0 H ALA A 148 13.886 15.064 3.026 1.00 0.00 H new ATOM 0 HA ALA A 148 13.730 15.097 0.855 1.00 0.00 H new ATOM 0 HB1 ALA A 148 11.606 16.007 -0.063 1.00 0.00 H new ATOM 0 HB2 ALA A 148 11.353 15.078 1.434 1.00 0.00 H new ATOM 0 HB3 ALA A 148 11.324 16.857 1.476 1.00 0.00 H new ATOM 1377 N GLY A 149 14.925 17.865 1.196 1.00 0.00 N ATOM 1378 CA GLY A 149 15.739 18.917 0.617 1.00 0.00 C ATOM 1379 C GLY A 149 14.885 20.160 0.541 1.00 0.00 C ATOM 1380 O GLY A 149 14.516 20.587 -0.557 1.00 0.00 O ATOM 0 H GLY A 149 15.093 17.740 2.194 1.00 0.00 H new ATOM 0 HA2 GLY A 149 16.624 19.097 1.227 1.00 0.00 H new ATOM 0 HA3 GLY A 149 16.088 18.630 -0.375 1.00 0.00 H new ATOM 1384 N HIS A 150 14.508 20.699 1.703 1.00 0.00 N ATOM 1385 CA HIS A 150 13.533 21.776 1.766 1.00 0.00 C ATOM 1386 C HIS A 150 13.773 22.779 2.887 1.00 0.00 C ATOM 1387 O HIS A 150 13.270 23.898 2.762 1.00 0.00 O ATOM 1388 CB HIS A 150 12.119 21.194 1.888 1.00 0.00 C ATOM 1389 CG HIS A 150 11.116 22.060 1.178 1.00 0.00 C ATOM 1390 ND1 HIS A 150 10.903 22.051 -0.179 1.00 0.00 N ATOM 1391 CD2 HIS A 150 10.290 23.002 1.728 1.00 0.00 C ATOM 1392 CE1 HIS A 150 9.947 22.947 -0.449 1.00 0.00 C ATOM 1393 NE2 HIS A 150 9.518 23.530 0.682 1.00 0.00 N ATOM 0 H HIS A 150 14.867 20.403 2.611 1.00 0.00 H new ATOM 0 HA HIS A 150 13.646 22.332 0.835 1.00 0.00 H new ATOM 0 HB2 HIS A 150 12.098 20.188 1.468 1.00 0.00 H new ATOM 0 HB3 HIS A 150 11.848 21.105 2.940 1.00 0.00 H new ATOM 0 HD2 HIS A 150 10.241 23.285 2.769 1.00 0.00 H new ATOM 0 HE1 HIS A 150 9.573 23.170 -1.437 1.00 0.00 H new ATOM 0 HE2 HIS A 150 8.774 24.223 0.765 1.00 0.00 H new ATOM 1401 N SER A 151 14.489 22.432 3.961 1.00 0.00 N ATOM 1402 CA SER A 151 14.647 23.353 5.080 1.00 0.00 C ATOM 1403 C SER A 151 15.441 24.583 4.633 1.00 0.00 C ATOM 1404 O SER A 151 16.228 24.529 3.676 1.00 0.00 O ATOM 1405 CB SER A 151 15.253 22.644 6.297 1.00 0.00 C ATOM 1406 OG SER A 151 16.577 22.215 6.071 1.00 0.00 O ATOM 0 H SER A 151 14.960 21.534 4.075 1.00 0.00 H new ATOM 0 HA SER A 151 13.668 23.706 5.403 1.00 0.00 H new ATOM 0 HB2 SER A 151 15.235 23.319 7.152 1.00 0.00 H new ATOM 0 HB3 SER A 151 14.636 21.784 6.557 1.00 0.00 H new ATOM 0 HG SER A 151 16.919 21.771 6.875 1.00 0.00 H new TER 1412 SER A 151