USER MOD reduce.3.24.130724 H: found=0, std=0, add=447, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 448 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 Single : A 135 CYS SG : rot -92:sc= 0.0463 USER MOD Single : A 136 TYR OH : rot -48:sc= -1.01 USER MOD Single : A 144 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 146 ASN : amide:sc= -2.1! C(o=-2.1!,f=-3.7!) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 GLN : amide:sc= -3! C(o=-3!,f=-6!) USER MOD Single : A 171 ASN : amide:sc= -0.311 X(o=-0.31,f=0.17) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 MET CE :methyl 160:sc= -2.45! (180deg=-3.43!) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ 161:sc= -0.0103 (180deg=-0.124) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 135 0.993 0.588 -1.084 1.00 0.00 N ATOM 2 CA CYS A 135 2.341 0.166 -1.425 1.00 0.00 C ATOM 3 C CYS A 135 2.280 -1.275 -1.934 1.00 0.00 C ATOM 4 O CYS A 135 3.242 -1.775 -2.514 1.00 0.00 O ATOM 5 CB CYS A 135 3.296 0.311 -0.238 1.00 0.00 C ATOM 6 SG CYS A 135 5.030 0.260 -0.820 1.00 0.00 S ATOM 0 HA CYS A 135 2.739 0.811 -2.209 1.00 0.00 H new ATOM 0 HB2 CYS A 135 3.105 1.251 0.280 1.00 0.00 H new ATOM 0 HB3 CYS A 135 3.121 -0.490 0.480 1.00 0.00 H new ATOM 0 HG CYS A 135 5.467 -0.964 -0.776 1.00 0.00 H new ATOM 12 N TYR A 136 1.138 -1.904 -1.699 1.00 0.00 N ATOM 13 CA TYR A 136 0.937 -3.278 -2.126 1.00 0.00 C ATOM 14 C TYR A 136 -0.541 -3.554 -2.414 1.00 0.00 C ATOM 15 O TYR A 136 -1.410 -2.784 -2.006 1.00 0.00 O ATOM 16 CB TYR A 136 1.388 -4.154 -0.955 1.00 0.00 C ATOM 17 CG TYR A 136 2.904 -4.346 -0.870 1.00 0.00 C ATOM 18 CD1 TYR A 136 3.696 -3.347 -0.342 1.00 0.00 C ATOM 19 CD2 TYR A 136 3.477 -5.517 -1.320 1.00 0.00 C ATOM 20 CE1 TYR A 136 5.123 -3.527 -0.261 1.00 0.00 C ATOM 21 CE2 TYR A 136 4.904 -5.698 -1.239 1.00 0.00 C ATOM 22 CZ TYR A 136 5.656 -4.693 -0.714 1.00 0.00 C ATOM 23 OH TYR A 136 7.004 -4.864 -0.637 1.00 0.00 O ATOM 0 H TYR A 136 0.341 -1.487 -1.218 1.00 0.00 H new ATOM 0 HA TYR A 136 1.496 -3.481 -3.040 1.00 0.00 H new ATOM 0 HB2 TYR A 136 1.036 -3.709 -0.025 1.00 0.00 H new ATOM 0 HB3 TYR A 136 0.912 -5.131 -1.041 1.00 0.00 H new ATOM 0 HD1 TYR A 136 3.246 -2.431 0.010 1.00 0.00 H new ATOM 0 HD2 TYR A 136 2.856 -6.298 -1.733 1.00 0.00 H new ATOM 0 HE1 TYR A 136 5.755 -2.754 0.150 1.00 0.00 H new ATOM 0 HE2 TYR A 136 5.366 -6.610 -1.587 1.00 0.00 H new ATOM 0 HH TYR A 136 7.455 -4.069 -0.991 1.00 0.00 H new ATOM 33 N VAL A 137 -0.779 -4.653 -3.114 1.00 0.00 N ATOM 34 CA VAL A 137 -2.136 -5.039 -3.460 1.00 0.00 C ATOM 35 C VAL A 137 -2.293 -6.550 -3.284 1.00 0.00 C ATOM 36 O VAL A 137 -1.303 -7.270 -3.156 1.00 0.00 O ATOM 37 CB VAL A 137 -2.469 -4.566 -4.877 1.00 0.00 C ATOM 38 CG1 VAL A 137 -2.608 -3.042 -4.929 1.00 0.00 C ATOM 39 CG2 VAL A 137 -1.421 -5.055 -5.879 1.00 0.00 C ATOM 0 H VAL A 137 -0.055 -5.288 -3.451 1.00 0.00 H new ATOM 0 HA VAL A 137 -2.851 -4.558 -2.793 1.00 0.00 H new ATOM 0 HB VAL A 137 -3.429 -5.000 -5.157 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -2.845 -2.733 -5.947 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -3.408 -2.726 -4.259 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -1.671 -2.580 -4.618 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -1.682 -4.705 -6.878 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -0.442 -4.664 -5.601 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -1.392 -6.145 -5.872 1.00 0.00 H new ATOM 49 N ARG A 138 -3.544 -6.987 -3.279 1.00 0.00 N ATOM 50 CA ARG A 138 -3.843 -8.400 -3.119 1.00 0.00 C ATOM 51 C ARG A 138 -4.692 -8.899 -4.289 1.00 0.00 C ATOM 52 O ARG A 138 -5.844 -8.497 -4.441 1.00 0.00 O ATOM 53 CB ARG A 138 -4.590 -8.660 -1.809 1.00 0.00 C ATOM 54 CG ARG A 138 -5.073 -10.109 -1.732 1.00 0.00 C ATOM 55 CD ARG A 138 -5.026 -10.627 -0.292 1.00 0.00 C ATOM 56 NE ARG A 138 -5.836 -9.755 0.587 1.00 0.00 N ATOM 57 CZ ARG A 138 -6.080 -10.009 1.879 1.00 0.00 C ATOM 58 NH1 ARG A 138 -5.578 -11.113 2.451 1.00 0.00 N ATOM 59 NH2 ARG A 138 -6.827 -9.161 2.600 1.00 0.00 N ATOM 0 H ARG A 138 -4.362 -6.387 -3.383 1.00 0.00 H new ATOM 0 HA ARG A 138 -2.896 -8.939 -3.097 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -3.935 -8.446 -0.964 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -5.442 -7.984 -1.732 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -6.092 -10.177 -2.114 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -4.451 -10.738 -2.369 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -5.404 -11.649 -0.252 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -3.995 -10.654 0.060 1.00 0.00 H new ATOM 0 HE ARG A 138 -6.234 -8.907 0.183 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -5.011 -11.759 1.902 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -5.764 -11.307 3.435 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -7.210 -8.322 2.165 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -7.013 -9.355 3.584 1.00 0.00 H new ATOM 73 N ALA A 139 -4.089 -9.768 -5.087 1.00 0.00 N ATOM 74 CA ALA A 139 -4.776 -10.326 -6.240 1.00 0.00 C ATOM 75 C ALA A 139 -5.634 -11.510 -5.793 1.00 0.00 C ATOM 76 O ALA A 139 -5.116 -12.595 -5.533 1.00 0.00 O ATOM 77 CB ALA A 139 -3.749 -10.719 -7.305 1.00 0.00 C ATOM 0 H ALA A 139 -3.133 -10.099 -4.958 1.00 0.00 H new ATOM 0 HA ALA A 139 -5.441 -9.587 -6.685 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -4.264 -11.138 -8.170 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -3.185 -9.837 -7.610 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -3.066 -11.462 -6.895 1.00 0.00 H new ATOM 83 N LEU A 140 -6.934 -11.262 -5.716 1.00 0.00 N ATOM 84 CA LEU A 140 -7.870 -12.295 -5.306 1.00 0.00 C ATOM 85 C LEU A 140 -8.334 -13.077 -6.535 1.00 0.00 C ATOM 86 O LEU A 140 -9.438 -13.618 -6.552 1.00 0.00 O ATOM 87 CB LEU A 140 -9.016 -11.686 -4.496 1.00 0.00 C ATOM 88 CG LEU A 140 -8.611 -10.748 -3.356 1.00 0.00 C ATOM 89 CD1 LEU A 140 -9.374 -9.425 -3.437 1.00 0.00 C ATOM 90 CD2 LEU A 140 -8.786 -11.429 -1.998 1.00 0.00 C ATOM 0 H LEU A 140 -7.361 -10.361 -5.931 1.00 0.00 H new ATOM 0 HA LEU A 140 -7.382 -13.008 -4.642 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -9.664 -11.136 -5.179 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -9.610 -12.499 -4.077 1.00 0.00 H new ATOM 0 HG LEU A 140 -7.552 -10.515 -3.465 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -9.067 -8.777 -2.616 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -9.155 -8.936 -4.386 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -10.445 -9.618 -3.367 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -8.491 -10.741 -1.205 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -9.830 -11.711 -1.864 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -8.161 -12.321 -1.955 1.00 0.00 H new ATOM 102 N PHE A 141 -7.465 -13.112 -7.536 1.00 0.00 N ATOM 103 CA PHE A 141 -7.772 -13.818 -8.768 1.00 0.00 C ATOM 104 C PHE A 141 -6.504 -14.403 -9.395 1.00 0.00 C ATOM 105 O PHE A 141 -5.413 -13.863 -9.215 1.00 0.00 O ATOM 106 CB PHE A 141 -8.378 -12.796 -9.732 1.00 0.00 C ATOM 107 CG PHE A 141 -9.834 -12.440 -9.425 1.00 0.00 C ATOM 108 CD1 PHE A 141 -10.118 -11.466 -8.518 1.00 0.00 C ATOM 109 CD2 PHE A 141 -10.843 -13.094 -10.059 1.00 0.00 C ATOM 110 CE1 PHE A 141 -11.469 -11.135 -8.233 1.00 0.00 C ATOM 111 CE2 PHE A 141 -12.194 -12.763 -9.773 1.00 0.00 C ATOM 112 CZ PHE A 141 -12.479 -11.790 -8.866 1.00 0.00 C ATOM 0 H PHE A 141 -6.549 -12.663 -7.518 1.00 0.00 H new ATOM 0 HA PHE A 141 -8.458 -14.640 -8.564 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -7.779 -11.886 -9.705 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -8.317 -13.188 -10.747 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -9.316 -10.945 -8.015 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -10.617 -13.865 -10.780 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -11.695 -10.362 -7.513 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -12.995 -13.284 -10.276 1.00 0.00 H new ATOM 0 HZ PHE A 141 -13.506 -11.538 -8.649 1.00 0.00 H new ATOM 122 N ASP A 142 -6.690 -15.498 -10.117 1.00 0.00 N ATOM 123 CA ASP A 142 -5.575 -16.161 -10.771 1.00 0.00 C ATOM 124 C ASP A 142 -5.377 -15.562 -12.165 1.00 0.00 C ATOM 125 O ASP A 142 -6.314 -15.511 -12.962 1.00 0.00 O ATOM 126 CB ASP A 142 -5.843 -17.658 -10.934 1.00 0.00 C ATOM 127 CG ASP A 142 -7.321 -18.045 -11.019 1.00 0.00 C ATOM 128 OD1 ASP A 142 -7.918 -17.775 -12.085 1.00 0.00 O ATOM 129 OD2 ASP A 142 -7.821 -18.603 -10.018 1.00 0.00 O ATOM 0 H ASP A 142 -7.596 -15.943 -10.263 1.00 0.00 H new ATOM 0 HA ASP A 142 -4.689 -16.018 -10.153 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -5.339 -18.006 -11.836 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -5.392 -18.186 -10.094 1.00 0.00 H new ATOM 134 N PHE A 143 -4.153 -15.125 -12.419 1.00 0.00 N ATOM 135 CA PHE A 143 -3.820 -14.531 -13.702 1.00 0.00 C ATOM 136 C PHE A 143 -2.554 -15.161 -14.286 1.00 0.00 C ATOM 137 O PHE A 143 -1.636 -15.516 -13.547 1.00 0.00 O ATOM 138 CB PHE A 143 -3.569 -13.043 -13.456 1.00 0.00 C ATOM 139 CG PHE A 143 -3.928 -12.146 -14.643 1.00 0.00 C ATOM 140 CD1 PHE A 143 -3.069 -12.031 -15.691 1.00 0.00 C ATOM 141 CD2 PHE A 143 -5.104 -11.464 -14.650 1.00 0.00 C ATOM 142 CE1 PHE A 143 -3.401 -11.200 -16.793 1.00 0.00 C ATOM 143 CE2 PHE A 143 -5.436 -10.632 -15.752 1.00 0.00 C ATOM 144 CZ PHE A 143 -4.578 -10.518 -16.799 1.00 0.00 C ATOM 0 H PHE A 143 -3.378 -15.171 -11.757 1.00 0.00 H new ATOM 0 HA PHE A 143 -4.634 -14.694 -14.409 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -4.146 -12.727 -12.587 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -2.517 -12.898 -13.210 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -2.134 -12.572 -15.685 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -5.786 -11.555 -13.817 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -2.720 -11.109 -17.626 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -6.370 -10.090 -15.758 1.00 0.00 H new ATOM 0 HZ PHE A 143 -4.831 -9.885 -17.637 1.00 0.00 H new ATOM 154 N ASN A 144 -2.543 -15.278 -15.606 1.00 0.00 N ATOM 155 CA ASN A 144 -1.404 -15.858 -16.297 1.00 0.00 C ATOM 156 C ASN A 144 -0.734 -14.784 -17.155 1.00 0.00 C ATOM 157 O ASN A 144 0.487 -14.778 -17.306 1.00 0.00 O ATOM 158 CB ASN A 144 -1.842 -16.997 -17.219 1.00 0.00 C ATOM 159 CG ASN A 144 -0.650 -17.874 -17.609 1.00 0.00 C ATOM 160 OD1 ASN A 144 0.185 -17.507 -18.419 1.00 0.00 O ATOM 161 ND2 ASN A 144 -0.618 -19.051 -16.990 1.00 0.00 N ATOM 0 H ASN A 144 -3.305 -14.981 -16.215 1.00 0.00 H new ATOM 0 HA ASN A 144 -0.715 -16.247 -15.547 1.00 0.00 H new ATOM 0 HB2 ASN A 144 -2.597 -17.604 -16.720 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -2.305 -16.586 -18.116 1.00 0.00 H new ATOM 0 HD21 ASN A 144 0.138 -19.708 -17.183 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -1.349 -19.296 -16.322 1.00 0.00 H new ATOM 168 N GLY A 145 -1.562 -13.902 -17.696 1.00 0.00 N ATOM 169 CA GLY A 145 -1.063 -12.826 -18.536 1.00 0.00 C ATOM 170 C GLY A 145 -2.019 -12.551 -19.699 1.00 0.00 C ATOM 171 O GLY A 145 -2.587 -13.480 -20.273 1.00 0.00 O ATOM 0 H GLY A 145 -2.574 -13.910 -17.569 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -0.940 -11.922 -17.940 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -0.079 -13.089 -18.924 1.00 0.00 H new ATOM 175 N ASN A 146 -2.167 -11.273 -20.013 1.00 0.00 N ATOM 176 CA ASN A 146 -3.045 -10.865 -21.096 1.00 0.00 C ATOM 177 C ASN A 146 -2.276 -9.945 -22.049 1.00 0.00 C ATOM 178 O ASN A 146 -2.324 -10.128 -23.265 1.00 0.00 O ATOM 179 CB ASN A 146 -4.253 -10.092 -20.566 1.00 0.00 C ATOM 180 CG ASN A 146 -3.829 -8.741 -19.986 1.00 0.00 C ATOM 181 OD1 ASN A 146 -3.138 -8.655 -18.986 1.00 0.00 O ATOM 182 ND2 ASN A 146 -4.282 -7.693 -20.669 1.00 0.00 N ATOM 0 H ASN A 146 -1.693 -10.506 -19.536 1.00 0.00 H new ATOM 0 HA ASN A 146 -3.389 -11.764 -21.608 1.00 0.00 H new ATOM 0 HB2 ASN A 146 -4.971 -9.937 -21.371 1.00 0.00 H new ATOM 0 HB3 ASN A 146 -4.757 -10.679 -19.798 1.00 0.00 H new ATOM 0 HD21 ASN A 146 -4.054 -6.747 -20.362 1.00 0.00 H new ATOM 0 HD22 ASN A 146 -4.857 -7.835 -21.499 1.00 0.00 H new ATOM 189 N ASP A 147 -1.589 -8.979 -21.460 1.00 0.00 N ATOM 190 CA ASP A 147 -0.812 -8.031 -22.241 1.00 0.00 C ATOM 191 C ASP A 147 0.678 -8.322 -22.055 1.00 0.00 C ATOM 192 O ASP A 147 1.057 -9.108 -21.188 1.00 0.00 O ATOM 193 CB ASP A 147 -1.074 -6.595 -21.784 1.00 0.00 C ATOM 194 CG ASP A 147 -0.635 -6.282 -20.351 1.00 0.00 C ATOM 195 OD1 ASP A 147 -1.363 -6.709 -19.430 1.00 0.00 O ATOM 196 OD2 ASP A 147 0.419 -5.624 -20.212 1.00 0.00 O ATOM 0 H ASP A 147 -1.554 -8.831 -20.451 1.00 0.00 H new ATOM 0 HA ASP A 147 -1.105 -8.136 -23.286 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -0.560 -5.914 -22.462 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -2.141 -6.390 -21.874 1.00 0.00 H new ATOM 201 N GLU A 148 1.483 -7.675 -22.884 1.00 0.00 N ATOM 202 CA GLU A 148 2.924 -7.854 -22.821 1.00 0.00 C ATOM 203 C GLU A 148 3.462 -7.365 -21.475 1.00 0.00 C ATOM 204 O GLU A 148 4.339 -7.995 -20.886 1.00 0.00 O ATOM 205 CB GLU A 148 3.617 -7.138 -23.981 1.00 0.00 C ATOM 206 CG GLU A 148 5.093 -7.532 -24.066 1.00 0.00 C ATOM 207 CD GLU A 148 5.808 -6.749 -25.169 1.00 0.00 C ATOM 208 OE1 GLU A 148 5.129 -6.432 -26.170 1.00 0.00 O ATOM 209 OE2 GLU A 148 7.016 -6.486 -24.987 1.00 0.00 O ATOM 0 H GLU A 148 1.165 -7.026 -23.603 1.00 0.00 H new ATOM 0 HA GLU A 148 3.142 -8.918 -22.912 1.00 0.00 H new ATOM 0 HB2 GLU A 148 3.116 -7.386 -24.917 1.00 0.00 H new ATOM 0 HB3 GLU A 148 3.532 -6.059 -23.850 1.00 0.00 H new ATOM 0 HG2 GLU A 148 5.579 -7.344 -23.109 1.00 0.00 H new ATOM 0 HG3 GLU A 148 5.177 -8.601 -24.261 1.00 0.00 H new ATOM 216 N GLU A 149 2.914 -6.244 -21.027 1.00 0.00 N ATOM 217 CA GLU A 149 3.328 -5.663 -19.761 1.00 0.00 C ATOM 218 C GLU A 149 2.397 -6.122 -18.636 1.00 0.00 C ATOM 219 O GLU A 149 2.280 -5.453 -17.611 1.00 0.00 O ATOM 220 CB GLU A 149 3.371 -4.136 -19.848 1.00 0.00 C ATOM 221 CG GLU A 149 4.599 -3.666 -20.631 1.00 0.00 C ATOM 222 CD GLU A 149 4.732 -2.143 -20.580 1.00 0.00 C ATOM 223 OE1 GLU A 149 5.042 -1.637 -19.480 1.00 0.00 O ATOM 224 OE2 GLU A 149 4.522 -1.519 -21.642 1.00 0.00 O ATOM 0 H GLU A 149 2.187 -5.723 -21.518 1.00 0.00 H new ATOM 0 HA GLU A 149 4.336 -6.011 -19.536 1.00 0.00 H new ATOM 0 HB2 GLU A 149 2.465 -3.770 -20.331 1.00 0.00 H new ATOM 0 HB3 GLU A 149 3.391 -3.711 -18.844 1.00 0.00 H new ATOM 0 HG2 GLU A 149 5.496 -4.127 -20.218 1.00 0.00 H new ATOM 0 HG3 GLU A 149 4.521 -3.993 -21.668 1.00 0.00 H new ATOM 231 N ASP A 150 1.759 -7.259 -18.867 1.00 0.00 N ATOM 232 CA ASP A 150 0.843 -7.816 -17.887 1.00 0.00 C ATOM 233 C ASP A 150 1.643 -8.425 -16.734 1.00 0.00 C ATOM 234 O ASP A 150 2.824 -8.733 -16.889 1.00 0.00 O ATOM 235 CB ASP A 150 -0.017 -8.922 -18.501 1.00 0.00 C ATOM 236 CG ASP A 150 0.641 -10.302 -18.548 1.00 0.00 C ATOM 237 OD1 ASP A 150 1.073 -10.761 -17.469 1.00 0.00 O ATOM 238 OD2 ASP A 150 0.697 -10.867 -19.661 1.00 0.00 O ATOM 0 H ASP A 150 1.858 -7.810 -19.719 1.00 0.00 H new ATOM 0 HA ASP A 150 0.198 -7.011 -17.535 1.00 0.00 H new ATOM 0 HB2 ASP A 150 -0.945 -8.998 -17.933 1.00 0.00 H new ATOM 0 HB3 ASP A 150 -0.287 -8.630 -19.516 1.00 0.00 H new ATOM 243 N LEU A 151 0.969 -8.581 -15.604 1.00 0.00 N ATOM 244 CA LEU A 151 1.603 -9.148 -14.427 1.00 0.00 C ATOM 245 C LEU A 151 0.787 -10.347 -13.941 1.00 0.00 C ATOM 246 O LEU A 151 -0.308 -10.183 -13.408 1.00 0.00 O ATOM 247 CB LEU A 151 1.810 -8.071 -13.359 1.00 0.00 C ATOM 248 CG LEU A 151 2.819 -8.403 -12.258 1.00 0.00 C ATOM 249 CD1 LEU A 151 4.233 -8.523 -12.829 1.00 0.00 C ATOM 250 CD2 LEU A 151 2.745 -7.382 -11.120 1.00 0.00 C ATOM 0 H LEU A 151 -0.010 -8.324 -15.479 1.00 0.00 H new ATOM 0 HA LEU A 151 2.599 -9.518 -14.671 1.00 0.00 H new ATOM 0 HB2 LEU A 151 2.131 -7.154 -13.853 1.00 0.00 H new ATOM 0 HB3 LEU A 151 0.848 -7.861 -12.891 1.00 0.00 H new ATOM 0 HG LEU A 151 2.558 -9.374 -11.837 1.00 0.00 H new ATOM 0 HD11 LEU A 151 4.931 -8.759 -12.026 1.00 0.00 H new ATOM 0 HD12 LEU A 151 4.258 -9.316 -13.576 1.00 0.00 H new ATOM 0 HD13 LEU A 151 4.520 -7.579 -13.292 1.00 0.00 H new ATOM 0 HD21 LEU A 151 3.472 -7.641 -10.351 1.00 0.00 H new ATOM 0 HD22 LEU A 151 2.966 -6.388 -11.508 1.00 0.00 H new ATOM 0 HD23 LEU A 151 1.744 -7.389 -10.690 1.00 0.00 H new ATOM 262 N PRO A 152 1.369 -11.559 -14.147 1.00 0.00 N ATOM 263 CA PRO A 152 0.709 -12.786 -13.737 1.00 0.00 C ATOM 264 C PRO A 152 0.786 -12.969 -12.220 1.00 0.00 C ATOM 265 O PRO A 152 1.605 -12.338 -11.556 1.00 0.00 O ATOM 266 CB PRO A 152 1.416 -13.891 -14.505 1.00 0.00 C ATOM 267 CG PRO A 152 2.741 -13.300 -14.958 1.00 0.00 C ATOM 268 CD PRO A 152 2.666 -11.792 -14.776 1.00 0.00 C ATOM 0 HA PRO A 152 -0.358 -12.784 -13.961 1.00 0.00 H new ATOM 0 HB2 PRO A 152 1.574 -14.766 -13.874 1.00 0.00 H new ATOM 0 HB3 PRO A 152 0.821 -14.216 -15.358 1.00 0.00 H new ATOM 0 HG2 PRO A 152 3.563 -13.714 -14.374 1.00 0.00 H new ATOM 0 HG3 PRO A 152 2.933 -13.549 -16.002 1.00 0.00 H new ATOM 0 HD2 PRO A 152 3.481 -11.428 -14.150 1.00 0.00 H new ATOM 0 HD3 PRO A 152 2.742 -11.273 -15.732 1.00 0.00 H new ATOM 276 N PHE A 153 -0.079 -13.838 -11.716 1.00 0.00 N ATOM 277 CA PHE A 153 -0.120 -14.112 -10.290 1.00 0.00 C ATOM 278 C PHE A 153 -1.176 -15.169 -9.965 1.00 0.00 C ATOM 279 O PHE A 153 -1.890 -15.631 -10.852 1.00 0.00 O ATOM 280 CB PHE A 153 -0.493 -12.803 -9.592 1.00 0.00 C ATOM 281 CG PHE A 153 -1.669 -12.066 -10.240 1.00 0.00 C ATOM 282 CD1 PHE A 153 -2.944 -12.416 -9.928 1.00 0.00 C ATOM 283 CD2 PHE A 153 -1.436 -11.062 -11.127 1.00 0.00 C ATOM 284 CE1 PHE A 153 -4.035 -11.733 -10.529 1.00 0.00 C ATOM 285 CE2 PHE A 153 -2.526 -10.379 -11.728 1.00 0.00 C ATOM 286 CZ PHE A 153 -3.802 -10.729 -11.416 1.00 0.00 C ATOM 0 H PHE A 153 -0.757 -14.361 -12.270 1.00 0.00 H new ATOM 0 HA PHE A 153 0.847 -14.489 -9.956 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.739 -13.015 -8.552 1.00 0.00 H new ATOM 0 HB3 PHE A 153 0.376 -12.145 -9.586 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -3.128 -13.213 -9.223 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -0.422 -10.784 -11.374 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -5.049 -12.011 -10.282 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -2.341 -9.582 -12.433 1.00 0.00 H new ATOM 0 HZ PHE A 153 -4.631 -10.209 -11.873 1.00 0.00 H new ATOM 296 N LYS A 154 -1.242 -15.520 -8.689 1.00 0.00 N ATOM 297 CA LYS A 154 -2.200 -16.515 -8.234 1.00 0.00 C ATOM 298 C LYS A 154 -3.152 -15.875 -7.222 1.00 0.00 C ATOM 299 O LYS A 154 -2.731 -15.070 -6.392 1.00 0.00 O ATOM 300 CB LYS A 154 -1.475 -17.752 -7.701 1.00 0.00 C ATOM 301 CG LYS A 154 -1.734 -17.936 -6.204 1.00 0.00 C ATOM 302 CD LYS A 154 -1.088 -19.225 -5.691 1.00 0.00 C ATOM 303 CE LYS A 154 0.434 -19.084 -5.619 1.00 0.00 C ATOM 304 NZ LYS A 154 0.873 -18.894 -4.219 1.00 0.00 N ATOM 0 H LYS A 154 -0.648 -15.133 -7.955 1.00 0.00 H new ATOM 0 HA LYS A 154 -2.810 -16.866 -9.067 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -1.810 -18.636 -8.243 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -0.404 -17.655 -7.879 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -1.337 -17.082 -5.655 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -2.808 -17.964 -6.018 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -1.482 -19.465 -4.703 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -1.349 -20.054 -6.349 1.00 0.00 H new ATOM 0 HE2 LYS A 154 0.907 -19.973 -6.037 1.00 0.00 H new ATOM 0 HE3 LYS A 154 0.755 -18.237 -6.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 1.908 -18.800 -4.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 0.436 -18.033 -3.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 0.583 -19.715 -3.650 1.00 0.00 H new ATOM 318 N LYS A 155 -4.416 -16.256 -7.324 1.00 0.00 N ATOM 319 CA LYS A 155 -5.431 -15.731 -6.426 1.00 0.00 C ATOM 320 C LYS A 155 -4.900 -15.757 -4.992 1.00 0.00 C ATOM 321 O LYS A 155 -4.382 -16.775 -4.536 1.00 0.00 O ATOM 322 CB LYS A 155 -6.750 -16.484 -6.609 1.00 0.00 C ATOM 323 CG LYS A 155 -7.850 -15.882 -5.733 1.00 0.00 C ATOM 324 CD LYS A 155 -8.267 -16.857 -4.629 1.00 0.00 C ATOM 325 CE LYS A 155 -7.562 -16.527 -3.312 1.00 0.00 C ATOM 326 NZ LYS A 155 -8.340 -17.046 -2.164 1.00 0.00 N ATOM 0 H LYS A 155 -4.761 -16.922 -8.015 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.650 -14.690 -6.665 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -7.052 -16.447 -7.656 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -6.612 -17.535 -6.355 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -7.497 -14.952 -5.287 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -8.714 -15.633 -6.348 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -9.347 -16.813 -4.489 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -8.026 -17.877 -4.929 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -6.563 -16.962 -3.308 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -7.440 -15.448 -3.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -7.848 -16.814 -1.278 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -9.285 -16.611 -2.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -8.435 -18.078 -2.247 1.00 0.00 H new ATOM 340 N GLY A 156 -5.049 -14.625 -4.318 1.00 0.00 N ATOM 341 CA GLY A 156 -4.591 -14.506 -2.945 1.00 0.00 C ATOM 342 C GLY A 156 -3.113 -14.116 -2.892 1.00 0.00 C ATOM 343 O GLY A 156 -2.438 -14.362 -1.892 1.00 0.00 O ATOM 0 H GLY A 156 -5.481 -13.783 -4.698 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.187 -13.758 -2.423 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.740 -15.452 -2.425 1.00 0.00 H new ATOM 347 N ASP A 157 -2.653 -13.514 -3.978 1.00 0.00 N ATOM 348 CA ASP A 157 -1.266 -13.088 -4.067 1.00 0.00 C ATOM 349 C ASP A 157 -1.176 -11.592 -3.755 1.00 0.00 C ATOM 350 O ASP A 157 -2.193 -10.903 -3.702 1.00 0.00 O ATOM 351 CB ASP A 157 -0.711 -13.311 -5.475 1.00 0.00 C ATOM 352 CG ASP A 157 0.726 -12.831 -5.687 1.00 0.00 C ATOM 353 OD1 ASP A 157 1.615 -13.380 -5.000 1.00 0.00 O ATOM 354 OD2 ASP A 157 0.903 -11.926 -6.532 1.00 0.00 O ATOM 0 H ASP A 157 -3.216 -13.311 -4.804 1.00 0.00 H new ATOM 0 HA ASP A 157 -0.686 -13.674 -3.354 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -0.760 -14.375 -5.704 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -1.358 -12.801 -6.189 1.00 0.00 H new ATOM 359 N ILE A 158 0.052 -11.136 -3.557 1.00 0.00 N ATOM 360 CA ILE A 158 0.288 -9.735 -3.252 1.00 0.00 C ATOM 361 C ILE A 158 1.199 -9.131 -4.322 1.00 0.00 C ATOM 362 O ILE A 158 2.067 -9.814 -4.863 1.00 0.00 O ATOM 363 CB ILE A 158 0.826 -9.580 -1.828 1.00 0.00 C ATOM 364 CG1 ILE A 158 -0.137 -10.190 -0.808 1.00 0.00 C ATOM 365 CG2 ILE A 158 1.139 -8.115 -1.516 1.00 0.00 C ATOM 366 CD1 ILE A 158 -1.524 -9.553 -0.915 1.00 0.00 C ATOM 0 H ILE A 158 0.893 -11.711 -3.602 1.00 0.00 H new ATOM 0 HA ILE A 158 -0.648 -9.177 -3.277 1.00 0.00 H new ATOM 0 HB ILE A 158 1.763 -10.132 -1.756 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -0.213 -11.265 -0.972 1.00 0.00 H new ATOM 0 HG13 ILE A 158 0.256 -10.048 0.199 1.00 0.00 H new ATOM 0 HG21 ILE A 158 1.520 -8.033 -0.498 1.00 0.00 H new ATOM 0 HG22 ILE A 158 1.890 -7.747 -2.215 1.00 0.00 H new ATOM 0 HG23 ILE A 158 0.231 -7.520 -1.613 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -2.189 -10.004 -0.179 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -1.448 -8.482 -0.727 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -1.924 -9.718 -1.915 1.00 0.00 H new ATOM 378 N LEU A 159 0.969 -7.855 -4.598 1.00 0.00 N ATOM 379 CA LEU A 159 1.758 -7.151 -5.594 1.00 0.00 C ATOM 380 C LEU A 159 2.119 -5.761 -5.065 1.00 0.00 C ATOM 381 O LEU A 159 1.286 -5.089 -4.459 1.00 0.00 O ATOM 382 CB LEU A 159 1.026 -7.126 -6.938 1.00 0.00 C ATOM 383 CG LEU A 159 0.245 -8.391 -7.300 1.00 0.00 C ATOM 384 CD1 LEU A 159 -0.960 -8.058 -8.182 1.00 0.00 C ATOM 385 CD2 LEU A 159 1.159 -9.433 -7.947 1.00 0.00 C ATOM 0 H LEU A 159 0.247 -7.291 -4.149 1.00 0.00 H new ATOM 0 HA LEU A 159 2.696 -7.676 -5.777 1.00 0.00 H new ATOM 0 HB2 LEU A 159 0.334 -6.284 -6.937 1.00 0.00 H new ATOM 0 HB3 LEU A 159 1.757 -6.937 -7.724 1.00 0.00 H new ATOM 0 HG LEU A 159 -0.141 -8.829 -6.380 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.498 -8.975 -8.425 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.624 -7.378 -7.649 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.618 -7.584 -9.102 1.00 0.00 H new ATOM 0 HD21 LEU A 159 0.579 -10.322 -8.194 1.00 0.00 H new ATOM 0 HD22 LEU A 159 1.595 -9.020 -8.856 1.00 0.00 H new ATOM 0 HD23 LEU A 159 1.955 -9.701 -7.252 1.00 0.00 H new ATOM 397 N ARG A 160 3.360 -5.372 -5.313 1.00 0.00 N ATOM 398 CA ARG A 160 3.842 -4.076 -4.869 1.00 0.00 C ATOM 399 C ARG A 160 3.536 -3.007 -5.920 1.00 0.00 C ATOM 400 O ARG A 160 4.288 -2.841 -6.879 1.00 0.00 O ATOM 401 CB ARG A 160 5.349 -4.107 -4.607 1.00 0.00 C ATOM 402 CG ARG A 160 5.842 -5.542 -4.415 1.00 0.00 C ATOM 403 CD ARG A 160 7.224 -5.564 -3.758 1.00 0.00 C ATOM 404 NE ARG A 160 8.229 -4.983 -4.676 1.00 0.00 N ATOM 405 CZ ARG A 160 9.547 -4.969 -4.436 1.00 0.00 C ATOM 406 NH1 ARG A 160 10.028 -5.505 -3.305 1.00 0.00 N ATOM 407 NH2 ARG A 160 10.385 -4.421 -5.326 1.00 0.00 N ATOM 0 H ARG A 160 4.047 -5.933 -5.817 1.00 0.00 H new ATOM 0 HA ARG A 160 3.329 -3.834 -3.938 1.00 0.00 H new ATOM 0 HB2 ARG A 160 5.877 -3.646 -5.442 1.00 0.00 H new ATOM 0 HB3 ARG A 160 5.580 -3.517 -3.720 1.00 0.00 H new ATOM 0 HG2 ARG A 160 5.133 -6.094 -3.798 1.00 0.00 H new ATOM 0 HG3 ARG A 160 5.886 -6.047 -5.380 1.00 0.00 H new ATOM 0 HD2 ARG A 160 7.202 -5.000 -2.826 1.00 0.00 H new ATOM 0 HD3 ARG A 160 7.499 -6.588 -3.505 1.00 0.00 H new ATOM 0 HE ARG A 160 7.897 -4.567 -5.546 1.00 0.00 H new ATOM 0 HH11 ARG A 160 9.390 -5.923 -2.628 1.00 0.00 H new ATOM 0 HH12 ARG A 160 11.031 -5.494 -3.122 1.00 0.00 H new ATOM 0 HH21 ARG A 160 10.020 -4.014 -6.187 1.00 0.00 H new ATOM 0 HH22 ARG A 160 11.388 -4.411 -5.143 1.00 0.00 H new ATOM 421 N ILE A 161 2.430 -2.310 -5.706 1.00 0.00 N ATOM 422 CA ILE A 161 2.015 -1.263 -6.623 1.00 0.00 C ATOM 423 C ILE A 161 2.736 0.039 -6.264 1.00 0.00 C ATOM 424 O ILE A 161 2.679 0.489 -5.121 1.00 0.00 O ATOM 425 CB ILE A 161 0.490 -1.136 -6.639 1.00 0.00 C ATOM 426 CG1 ILE A 161 0.038 -0.085 -7.654 1.00 0.00 C ATOM 427 CG2 ILE A 161 -0.051 -0.850 -5.236 1.00 0.00 C ATOM 428 CD1 ILE A 161 0.230 1.328 -7.102 1.00 0.00 C ATOM 0 H ILE A 161 1.808 -2.450 -4.910 1.00 0.00 H new ATOM 0 HA ILE A 161 2.301 -1.517 -7.644 1.00 0.00 H new ATOM 0 HB ILE A 161 0.071 -2.091 -6.957 1.00 0.00 H new ATOM 0 HG12 ILE A 161 0.605 -0.199 -8.578 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -1.011 -0.242 -7.903 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -1.137 -0.764 -5.275 1.00 0.00 H new ATOM 0 HG22 ILE A 161 0.225 -1.665 -4.567 1.00 0.00 H new ATOM 0 HG23 ILE A 161 0.373 0.083 -4.866 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -0.099 2.056 -7.843 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -0.358 1.446 -6.192 1.00 0.00 H new ATOM 0 HD13 ILE A 161 1.284 1.491 -6.877 1.00 0.00 H new ATOM 440 N ARG A 162 3.398 0.604 -7.262 1.00 0.00 N ATOM 441 CA ARG A 162 4.129 1.846 -7.066 1.00 0.00 C ATOM 442 C ARG A 162 3.567 2.942 -7.973 1.00 0.00 C ATOM 443 O ARG A 162 3.747 4.128 -7.703 1.00 0.00 O ATOM 444 CB ARG A 162 5.618 1.660 -7.365 1.00 0.00 C ATOM 445 CG ARG A 162 5.834 1.189 -8.804 1.00 0.00 C ATOM 446 CD ARG A 162 7.237 0.606 -8.986 1.00 0.00 C ATOM 447 NE ARG A 162 7.958 1.344 -10.047 1.00 0.00 N ATOM 448 CZ ARG A 162 8.512 2.553 -9.878 1.00 0.00 C ATOM 449 NH1 ARG A 162 8.430 3.166 -8.690 1.00 0.00 N ATOM 450 NH2 ARG A 162 9.147 3.147 -10.897 1.00 0.00 N ATOM 0 H ARG A 162 3.444 0.226 -8.208 1.00 0.00 H new ATOM 0 HA ARG A 162 4.012 2.139 -6.023 1.00 0.00 H new ATOM 0 HB2 ARG A 162 6.145 2.600 -7.203 1.00 0.00 H new ATOM 0 HB3 ARG A 162 6.043 0.933 -6.673 1.00 0.00 H new ATOM 0 HG2 ARG A 162 5.088 0.437 -9.060 1.00 0.00 H new ATOM 0 HG3 ARG A 162 5.692 2.025 -9.489 1.00 0.00 H new ATOM 0 HD2 ARG A 162 7.790 0.668 -8.049 1.00 0.00 H new ATOM 0 HD3 ARG A 162 7.170 -0.450 -9.247 1.00 0.00 H new ATOM 0 HE ARG A 162 8.038 0.905 -10.964 1.00 0.00 H new ATOM 0 HH11 ARG A 162 7.946 2.713 -7.915 1.00 0.00 H new ATOM 0 HH12 ARG A 162 8.851 4.086 -8.561 1.00 0.00 H new ATOM 0 HH21 ARG A 162 9.209 2.679 -11.801 1.00 0.00 H new ATOM 0 HH22 ARG A 162 9.569 4.067 -10.769 1.00 0.00 H new ATOM 464 N ASP A 163 2.898 2.507 -9.030 1.00 0.00 N ATOM 465 CA ASP A 163 2.309 3.436 -9.978 1.00 0.00 C ATOM 466 C ASP A 163 0.901 2.960 -10.345 1.00 0.00 C ATOM 467 O ASP A 163 0.626 1.761 -10.340 1.00 0.00 O ATOM 468 CB ASP A 163 3.133 3.509 -11.264 1.00 0.00 C ATOM 469 CG ASP A 163 3.934 2.245 -11.591 1.00 0.00 C ATOM 470 OD1 ASP A 163 4.003 1.372 -10.701 1.00 0.00 O ATOM 471 OD2 ASP A 163 4.458 2.184 -12.725 1.00 0.00 O ATOM 0 H ASP A 163 2.751 1.522 -9.251 1.00 0.00 H new ATOM 0 HA ASP A 163 2.282 4.421 -9.511 1.00 0.00 H new ATOM 0 HB2 ASP A 163 2.462 3.721 -12.096 1.00 0.00 H new ATOM 0 HB3 ASP A 163 3.823 4.349 -11.188 1.00 0.00 H new ATOM 476 N LYS A 164 0.047 3.924 -10.654 1.00 0.00 N ATOM 477 CA LYS A 164 -1.325 3.619 -11.023 1.00 0.00 C ATOM 478 C LYS A 164 -1.882 4.755 -11.884 1.00 0.00 C ATOM 479 O LYS A 164 -2.693 5.552 -11.416 1.00 0.00 O ATOM 480 CB LYS A 164 -2.161 3.323 -9.777 1.00 0.00 C ATOM 481 CG LYS A 164 -2.083 4.479 -8.778 1.00 0.00 C ATOM 482 CD LYS A 164 -0.832 4.365 -7.904 1.00 0.00 C ATOM 483 CE LYS A 164 -1.200 4.330 -6.419 1.00 0.00 C ATOM 484 NZ LYS A 164 0.000 4.553 -5.582 1.00 0.00 N ATOM 0 H LYS A 164 0.278 4.917 -10.657 1.00 0.00 H new ATOM 0 HA LYS A 164 -1.365 2.713 -11.627 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -3.199 3.154 -10.063 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -1.807 2.406 -9.306 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -2.071 5.428 -9.314 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -2.972 4.480 -8.148 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -0.282 3.462 -8.167 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -0.170 5.209 -8.098 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -1.947 5.095 -6.205 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -1.649 3.368 -6.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -0.268 4.526 -4.577 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 0.700 3.808 -5.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 0.412 5.481 -5.806 1.00 0.00 H new ATOM 498 N PRO A 165 -1.413 4.793 -13.159 1.00 0.00 N ATOM 499 CA PRO A 165 -1.856 5.817 -14.089 1.00 0.00 C ATOM 500 C PRO A 165 -3.276 5.534 -14.584 1.00 0.00 C ATOM 501 O PRO A 165 -4.075 6.454 -14.751 1.00 0.00 O ATOM 502 CB PRO A 165 -0.824 5.808 -15.207 1.00 0.00 C ATOM 503 CG PRO A 165 -0.106 4.472 -15.098 1.00 0.00 C ATOM 504 CD PRO A 165 -0.451 3.865 -13.749 1.00 0.00 C ATOM 0 HA PRO A 165 -1.917 6.803 -13.629 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -1.302 5.917 -16.181 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -0.125 6.637 -15.100 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -0.413 3.807 -15.905 1.00 0.00 H new ATOM 0 HG3 PRO A 165 0.971 4.609 -15.190 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -0.879 2.869 -13.861 1.00 0.00 H new ATOM 0 HD3 PRO A 165 0.435 3.762 -13.123 1.00 0.00 H new ATOM 512 N GLU A 166 -3.546 4.255 -14.803 1.00 0.00 N ATOM 513 CA GLU A 166 -4.855 3.837 -15.275 1.00 0.00 C ATOM 514 C GLU A 166 -5.810 3.649 -14.093 1.00 0.00 C ATOM 515 O GLU A 166 -5.390 3.696 -12.939 1.00 0.00 O ATOM 516 CB GLU A 166 -4.756 2.560 -16.109 1.00 0.00 C ATOM 517 CG GLU A 166 -3.663 2.682 -17.173 1.00 0.00 C ATOM 518 CD GLU A 166 -4.264 2.997 -18.544 1.00 0.00 C ATOM 519 OE1 GLU A 166 -4.681 2.029 -19.215 1.00 0.00 O ATOM 520 OE2 GLU A 166 -4.292 4.198 -18.888 1.00 0.00 O ATOM 0 H GLU A 166 -2.881 3.495 -14.662 1.00 0.00 H new ATOM 0 HA GLU A 166 -5.255 4.620 -15.919 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -4.542 1.712 -15.458 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -5.714 2.360 -16.588 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -2.962 3.467 -16.890 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -3.096 1.752 -17.225 1.00 0.00 H new ATOM 527 N GLU A 167 -7.076 3.440 -14.425 1.00 0.00 N ATOM 528 CA GLU A 167 -8.093 3.243 -13.406 1.00 0.00 C ATOM 529 C GLU A 167 -8.587 1.796 -13.421 1.00 0.00 C ATOM 530 O GLU A 167 -9.791 1.547 -13.458 1.00 0.00 O ATOM 531 CB GLU A 167 -9.254 4.221 -13.595 1.00 0.00 C ATOM 532 CG GLU A 167 -9.105 5.434 -12.674 1.00 0.00 C ATOM 533 CD GLU A 167 -10.266 5.514 -11.681 1.00 0.00 C ATOM 534 OE1 GLU A 167 -11.396 5.181 -12.100 1.00 0.00 O ATOM 535 OE2 GLU A 167 -9.999 5.908 -10.525 1.00 0.00 O ATOM 0 H GLU A 167 -7.420 3.403 -15.384 1.00 0.00 H new ATOM 0 HA GLU A 167 -7.647 3.443 -12.432 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.291 4.551 -14.633 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -10.197 3.716 -13.387 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -8.162 5.370 -12.132 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -9.068 6.346 -13.270 1.00 0.00 H new ATOM 542 N GLN A 168 -7.632 0.877 -13.391 1.00 0.00 N ATOM 543 CA GLN A 168 -7.956 -0.540 -13.402 1.00 0.00 C ATOM 544 C GLN A 168 -6.687 -1.372 -13.595 1.00 0.00 C ATOM 545 O GLN A 168 -6.586 -2.484 -13.081 1.00 0.00 O ATOM 546 CB GLN A 168 -8.991 -0.858 -14.482 1.00 0.00 C ATOM 547 CG GLN A 168 -10.373 -1.084 -13.867 1.00 0.00 C ATOM 548 CD GLN A 168 -11.064 -2.293 -14.502 1.00 0.00 C ATOM 549 OE1 GLN A 168 -10.458 -3.095 -15.194 1.00 0.00 O ATOM 550 NE2 GLN A 168 -12.363 -2.379 -14.231 1.00 0.00 N ATOM 0 H GLN A 168 -6.634 1.086 -13.359 1.00 0.00 H new ATOM 0 HA GLN A 168 -8.395 -0.800 -12.439 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -9.038 -0.038 -15.199 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -8.685 -1.747 -15.034 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -10.276 -1.239 -12.792 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -10.987 -0.194 -14.007 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -12.809 -1.674 -13.644 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -12.913 -3.150 -14.610 1.00 0.00 H new ATOM 559 N TRP A 169 -5.751 -0.801 -14.339 1.00 0.00 N ATOM 560 CA TRP A 169 -4.493 -1.477 -14.607 1.00 0.00 C ATOM 561 C TRP A 169 -3.361 -0.597 -14.073 1.00 0.00 C ATOM 562 O TRP A 169 -2.966 0.373 -14.719 1.00 0.00 O ATOM 563 CB TRP A 169 -4.349 -1.797 -16.096 1.00 0.00 C ATOM 564 CG TRP A 169 -5.138 -3.029 -16.547 1.00 0.00 C ATOM 565 CD1 TRP A 169 -6.224 -3.070 -17.331 1.00 0.00 C ATOM 566 CD2 TRP A 169 -4.857 -4.402 -16.206 1.00 0.00 C ATOM 567 NE1 TRP A 169 -6.662 -4.366 -17.519 1.00 0.00 N ATOM 568 CE2 TRP A 169 -5.804 -5.201 -16.814 1.00 0.00 C ATOM 569 CE3 TRP A 169 -3.837 -4.951 -15.409 1.00 0.00 C ATOM 570 CZ2 TRP A 169 -5.825 -6.596 -16.689 1.00 0.00 C ATOM 571 CZ3 TRP A 169 -3.871 -6.347 -15.296 1.00 0.00 C ATOM 572 CH2 TRP A 169 -4.817 -7.166 -15.901 1.00 0.00 C ATOM 0 H TRP A 169 -5.839 0.122 -14.764 1.00 0.00 H new ATOM 0 HA TRP A 169 -4.456 -2.440 -14.097 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -4.678 -0.935 -16.676 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -3.294 -1.950 -16.324 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -6.697 -2.200 -17.761 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -7.467 -4.657 -18.073 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -3.087 -4.345 -14.923 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -6.578 -7.200 -17.174 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -3.108 -6.820 -14.696 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -4.775 -8.236 -15.764 1.00 0.00 H new ATOM 583 N TRP A 170 -2.869 -0.968 -12.899 1.00 0.00 N ATOM 584 CA TRP A 170 -1.790 -0.224 -12.272 1.00 0.00 C ATOM 585 C TRP A 170 -0.507 -1.045 -12.411 1.00 0.00 C ATOM 586 O TRP A 170 -0.557 -2.237 -12.711 1.00 0.00 O ATOM 587 CB TRP A 170 -2.129 0.112 -10.818 1.00 0.00 C ATOM 588 CG TRP A 170 -3.451 0.865 -10.646 1.00 0.00 C ATOM 589 CD1 TRP A 170 -4.183 1.473 -11.589 1.00 0.00 C ATOM 590 CD2 TRP A 170 -4.170 1.066 -9.411 1.00 0.00 C ATOM 591 NE1 TRP A 170 -5.318 2.049 -11.055 1.00 0.00 N ATOM 592 CE2 TRP A 170 -5.310 1.793 -9.689 1.00 0.00 C ATOM 593 CE3 TRP A 170 -3.869 0.646 -8.103 1.00 0.00 C ATOM 594 CZ2 TRP A 170 -6.239 2.165 -8.710 1.00 0.00 C ATOM 595 CZ3 TRP A 170 -4.808 1.026 -7.136 1.00 0.00 C ATOM 596 CH2 TRP A 170 -5.960 1.758 -7.400 1.00 0.00 C ATOM 0 H TRP A 170 -3.198 -1.773 -12.366 1.00 0.00 H new ATOM 0 HA TRP A 170 -1.645 0.736 -12.767 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -2.172 -0.813 -10.242 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -1.323 0.713 -10.397 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -3.918 1.508 -12.635 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -6.031 2.567 -11.568 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -2.984 0.076 -7.863 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -7.123 2.735 -8.952 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -4.624 0.730 -6.114 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.637 2.012 -6.598 1.00 0.00 H new ATOM 607 N ASN A 171 0.614 -0.375 -12.187 1.00 0.00 N ATOM 608 CA ASN A 171 1.908 -1.028 -12.284 1.00 0.00 C ATOM 609 C ASN A 171 2.390 -1.408 -10.883 1.00 0.00 C ATOM 610 O ASN A 171 2.663 -0.538 -10.059 1.00 0.00 O ATOM 611 CB ASN A 171 2.951 -0.095 -12.904 1.00 0.00 C ATOM 612 CG ASN A 171 3.360 -0.579 -14.297 1.00 0.00 C ATOM 613 OD1 ASN A 171 3.479 -1.764 -14.561 1.00 0.00 O ATOM 614 ND2 ASN A 171 3.569 0.401 -15.171 1.00 0.00 N ATOM 0 H ASN A 171 0.653 0.614 -11.939 1.00 0.00 H new ATOM 0 HA ASN A 171 1.793 -1.911 -12.913 1.00 0.00 H new ATOM 0 HB2 ASN A 171 2.547 0.915 -12.970 1.00 0.00 H new ATOM 0 HB3 ASN A 171 3.829 -0.046 -12.260 1.00 0.00 H new ATOM 0 HD21 ASN A 171 3.846 0.181 -16.127 1.00 0.00 H new ATOM 0 HD22 ASN A 171 3.452 1.373 -14.885 1.00 0.00 H new ATOM 621 N ALA A 172 2.477 -2.711 -10.655 1.00 0.00 N ATOM 622 CA ALA A 172 2.920 -3.218 -9.367 1.00 0.00 C ATOM 623 C ALA A 172 3.854 -4.409 -9.587 1.00 0.00 C ATOM 624 O ALA A 172 3.926 -4.951 -10.689 1.00 0.00 O ATOM 625 CB ALA A 172 1.702 -3.581 -8.515 1.00 0.00 C ATOM 0 H ALA A 172 2.248 -3.431 -11.341 1.00 0.00 H new ATOM 0 HA ALA A 172 3.480 -2.455 -8.826 1.00 0.00 H new ATOM 0 HB1 ALA A 172 2.034 -3.961 -7.549 1.00 0.00 H new ATOM 0 HB2 ALA A 172 1.086 -2.694 -8.364 1.00 0.00 H new ATOM 0 HB3 ALA A 172 1.117 -4.346 -9.024 1.00 0.00 H new ATOM 631 N GLU A 173 4.546 -4.782 -8.521 1.00 0.00 N ATOM 632 CA GLU A 173 5.472 -5.900 -8.582 1.00 0.00 C ATOM 633 C GLU A 173 4.793 -7.181 -8.094 1.00 0.00 C ATOM 634 O GLU A 173 3.811 -7.124 -7.355 1.00 0.00 O ATOM 635 CB GLU A 173 6.738 -5.609 -7.774 1.00 0.00 C ATOM 636 CG GLU A 173 7.788 -4.904 -8.635 1.00 0.00 C ATOM 637 CD GLU A 173 7.633 -3.384 -8.554 1.00 0.00 C ATOM 638 OE1 GLU A 173 6.476 -2.924 -8.671 1.00 0.00 O ATOM 639 OE2 GLU A 173 8.674 -2.715 -8.380 1.00 0.00 O ATOM 0 H GLU A 173 4.484 -4.329 -7.609 1.00 0.00 H new ATOM 0 HA GLU A 173 5.768 -6.043 -9.621 1.00 0.00 H new ATOM 0 HB2 GLU A 173 6.490 -4.987 -6.914 1.00 0.00 H new ATOM 0 HB3 GLU A 173 7.148 -6.541 -7.385 1.00 0.00 H new ATOM 0 HG2 GLU A 173 8.786 -5.189 -8.304 1.00 0.00 H new ATOM 0 HG3 GLU A 173 7.691 -5.228 -9.671 1.00 0.00 H new ATOM 646 N ASP A 174 5.343 -8.306 -8.526 1.00 0.00 N ATOM 647 CA ASP A 174 4.802 -9.599 -8.142 1.00 0.00 C ATOM 648 C ASP A 174 5.477 -10.067 -6.852 1.00 0.00 C ATOM 649 O ASP A 174 6.098 -9.271 -6.148 1.00 0.00 O ATOM 650 CB ASP A 174 5.066 -10.649 -9.223 1.00 0.00 C ATOM 651 CG ASP A 174 3.813 -11.300 -9.813 1.00 0.00 C ATOM 652 OD1 ASP A 174 2.709 -10.869 -9.416 1.00 0.00 O ATOM 653 OD2 ASP A 174 3.988 -12.212 -10.649 1.00 0.00 O ATOM 0 H ASP A 174 6.158 -8.349 -9.138 1.00 0.00 H new ATOM 0 HA ASP A 174 3.727 -9.487 -8.003 1.00 0.00 H new ATOM 0 HB2 ASP A 174 5.630 -10.183 -10.031 1.00 0.00 H new ATOM 0 HB3 ASP A 174 5.699 -11.430 -8.802 1.00 0.00 H new ATOM 658 N SER A 175 5.335 -11.355 -6.581 1.00 0.00 N ATOM 659 CA SER A 175 5.925 -11.939 -5.387 1.00 0.00 C ATOM 660 C SER A 175 7.411 -12.216 -5.619 1.00 0.00 C ATOM 661 O SER A 175 8.059 -12.870 -4.803 1.00 0.00 O ATOM 662 CB SER A 175 5.201 -13.227 -4.988 1.00 0.00 C ATOM 663 OG SER A 175 5.185 -14.180 -6.047 1.00 0.00 O ATOM 0 H SER A 175 4.820 -12.012 -7.167 1.00 0.00 H new ATOM 0 HA SER A 175 5.818 -11.226 -4.570 1.00 0.00 H new ATOM 0 HB2 SER A 175 5.689 -13.662 -4.116 1.00 0.00 H new ATOM 0 HB3 SER A 175 4.177 -12.992 -4.696 1.00 0.00 H new ATOM 0 HG SER A 175 4.716 -14.988 -5.753 1.00 0.00 H new ATOM 669 N GLU A 176 7.908 -11.705 -6.737 1.00 0.00 N ATOM 670 CA GLU A 176 9.306 -11.889 -7.087 1.00 0.00 C ATOM 671 C GLU A 176 9.936 -10.551 -7.478 1.00 0.00 C ATOM 672 O GLU A 176 11.139 -10.476 -7.724 1.00 0.00 O ATOM 673 CB GLU A 176 9.460 -12.918 -8.209 1.00 0.00 C ATOM 674 CG GLU A 176 9.084 -14.320 -7.725 1.00 0.00 C ATOM 675 CD GLU A 176 8.039 -14.955 -8.642 1.00 0.00 C ATOM 676 OE1 GLU A 176 7.195 -14.190 -9.157 1.00 0.00 O ATOM 677 OE2 GLU A 176 8.105 -16.192 -8.808 1.00 0.00 O ATOM 0 H GLU A 176 7.367 -11.164 -7.412 1.00 0.00 H new ATOM 0 HA GLU A 176 9.832 -12.273 -6.213 1.00 0.00 H new ATOM 0 HB2 GLU A 176 8.828 -12.639 -9.052 1.00 0.00 H new ATOM 0 HB3 GLU A 176 10.489 -12.918 -8.568 1.00 0.00 H new ATOM 0 HG2 GLU A 176 9.974 -14.948 -7.693 1.00 0.00 H new ATOM 0 HG3 GLU A 176 8.695 -14.265 -6.708 1.00 0.00 H new ATOM 684 N GLY A 177 9.095 -9.529 -7.525 1.00 0.00 N ATOM 685 CA GLY A 177 9.555 -8.198 -7.883 1.00 0.00 C ATOM 686 C GLY A 177 9.171 -7.854 -9.323 1.00 0.00 C ATOM 687 O GLY A 177 9.282 -6.702 -9.741 1.00 0.00 O ATOM 0 H GLY A 177 8.098 -9.595 -7.321 1.00 0.00 H new ATOM 0 HA2 GLY A 177 9.122 -7.465 -7.202 1.00 0.00 H new ATOM 0 HA3 GLY A 177 10.637 -8.140 -7.768 1.00 0.00 H new ATOM 691 N LYS A 178 8.724 -8.873 -10.042 1.00 0.00 N ATOM 692 CA LYS A 178 8.322 -8.694 -11.427 1.00 0.00 C ATOM 693 C LYS A 178 7.312 -7.548 -11.516 1.00 0.00 C ATOM 694 O LYS A 178 6.187 -7.669 -11.032 1.00 0.00 O ATOM 695 CB LYS A 178 7.811 -10.011 -12.012 1.00 0.00 C ATOM 696 CG LYS A 178 8.959 -10.998 -12.226 1.00 0.00 C ATOM 697 CD LYS A 178 8.915 -11.595 -13.635 1.00 0.00 C ATOM 698 CE LYS A 178 10.325 -11.767 -14.203 1.00 0.00 C ATOM 699 NZ LYS A 178 10.415 -11.167 -15.553 1.00 0.00 N ATOM 0 H LYS A 178 8.631 -9.826 -9.691 1.00 0.00 H new ATOM 0 HA LYS A 178 9.179 -8.413 -12.039 1.00 0.00 H new ATOM 0 HB2 LYS A 178 7.071 -10.448 -11.341 1.00 0.00 H new ATOM 0 HB3 LYS A 178 7.309 -9.821 -12.960 1.00 0.00 H new ATOM 0 HG2 LYS A 178 9.912 -10.492 -12.071 1.00 0.00 H new ATOM 0 HG3 LYS A 178 8.899 -11.797 -11.487 1.00 0.00 H new ATOM 0 HD2 LYS A 178 8.410 -12.560 -13.609 1.00 0.00 H new ATOM 0 HD3 LYS A 178 8.332 -10.948 -14.290 1.00 0.00 H new ATOM 0 HE2 LYS A 178 11.051 -11.296 -13.540 1.00 0.00 H new ATOM 0 HE3 LYS A 178 10.578 -12.826 -14.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 11.378 -11.292 -15.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 9.736 -11.635 -16.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 10.194 -10.152 -15.497 1.00 0.00 H new ATOM 713 N ARG A 179 7.748 -6.462 -12.136 1.00 0.00 N ATOM 714 CA ARG A 179 6.897 -5.296 -12.294 1.00 0.00 C ATOM 715 C ARG A 179 6.083 -5.404 -13.586 1.00 0.00 C ATOM 716 O ARG A 179 6.648 -5.553 -14.668 1.00 0.00 O ATOM 717 CB ARG A 179 7.724 -4.009 -12.326 1.00 0.00 C ATOM 718 CG ARG A 179 9.144 -4.258 -11.815 1.00 0.00 C ATOM 719 CD ARG A 179 9.850 -2.939 -11.493 1.00 0.00 C ATOM 720 NE ARG A 179 10.380 -2.333 -12.734 1.00 0.00 N ATOM 721 CZ ARG A 179 10.139 -1.071 -13.116 1.00 0.00 C ATOM 722 NH1 ARG A 179 9.376 -0.274 -12.355 1.00 0.00 N ATOM 723 NH2 ARG A 179 10.662 -0.605 -14.259 1.00 0.00 N ATOM 0 H ARG A 179 8.681 -6.365 -12.536 1.00 0.00 H new ATOM 0 HA ARG A 179 6.223 -5.259 -11.438 1.00 0.00 H new ATOM 0 HB2 ARG A 179 7.763 -3.622 -13.344 1.00 0.00 H new ATOM 0 HB3 ARG A 179 7.242 -3.247 -11.714 1.00 0.00 H new ATOM 0 HG2 ARG A 179 9.109 -4.883 -10.923 1.00 0.00 H new ATOM 0 HG3 ARG A 179 9.714 -4.806 -12.566 1.00 0.00 H new ATOM 0 HD2 ARG A 179 9.154 -2.252 -11.012 1.00 0.00 H new ATOM 0 HD3 ARG A 179 10.663 -3.115 -10.788 1.00 0.00 H new ATOM 0 HE ARG A 179 10.965 -2.912 -13.337 1.00 0.00 H new ATOM 0 HH11 ARG A 179 8.979 -0.628 -11.485 1.00 0.00 H new ATOM 0 HH12 ARG A 179 9.193 0.686 -12.646 1.00 0.00 H new ATOM 0 HH21 ARG A 179 11.243 -1.211 -14.838 1.00 0.00 H new ATOM 0 HH22 ARG A 179 10.478 0.355 -14.550 1.00 0.00 H new ATOM 737 N GLY A 180 4.770 -5.325 -13.429 1.00 0.00 N ATOM 738 CA GLY A 180 3.874 -5.411 -14.569 1.00 0.00 C ATOM 739 C GLY A 180 2.541 -4.720 -14.272 1.00 0.00 C ATOM 740 O GLY A 180 2.448 -3.914 -13.348 1.00 0.00 O ATOM 0 H GLY A 180 4.305 -5.202 -12.529 1.00 0.00 H new ATOM 0 HA2 GLY A 180 4.341 -4.949 -15.439 1.00 0.00 H new ATOM 0 HA3 GLY A 180 3.698 -6.457 -14.819 1.00 0.00 H new ATOM 744 N MET A 181 1.543 -5.060 -15.075 1.00 0.00 N ATOM 745 CA MET A 181 0.221 -4.481 -14.911 1.00 0.00 C ATOM 746 C MET A 181 -0.662 -5.372 -14.033 1.00 0.00 C ATOM 747 O MET A 181 -0.971 -6.503 -14.404 1.00 0.00 O ATOM 748 CB MET A 181 -0.434 -4.306 -16.283 1.00 0.00 C ATOM 749 CG MET A 181 0.231 -3.173 -17.067 1.00 0.00 C ATOM 750 SD MET A 181 -0.857 -1.759 -17.137 1.00 0.00 S ATOM 751 CE MET A 181 -0.311 -0.876 -15.684 1.00 0.00 C ATOM 0 H MET A 181 1.624 -5.729 -15.841 1.00 0.00 H new ATOM 0 HA MET A 181 0.327 -3.512 -14.423 1.00 0.00 H new ATOM 0 HB2 MET A 181 -0.359 -5.236 -16.847 1.00 0.00 H new ATOM 0 HB3 MET A 181 -1.496 -4.093 -16.159 1.00 0.00 H new ATOM 0 HG2 MET A 181 1.172 -2.895 -16.593 1.00 0.00 H new ATOM 0 HG3 MET A 181 0.470 -3.509 -18.076 1.00 0.00 H new ATOM 0 HE1 MET A 181 -0.612 0.169 -15.759 1.00 0.00 H new ATOM 0 HE2 MET A 181 -0.762 -1.321 -14.797 1.00 0.00 H new ATOM 0 HE3 MET A 181 0.775 -0.936 -15.608 1.00 0.00 H new ATOM 761 N ILE A 182 -1.043 -4.827 -12.888 1.00 0.00 N ATOM 762 CA ILE A 182 -1.883 -5.558 -11.954 1.00 0.00 C ATOM 763 C ILE A 182 -3.318 -5.032 -12.047 1.00 0.00 C ATOM 764 O ILE A 182 -3.541 -3.822 -12.029 1.00 0.00 O ATOM 765 CB ILE A 182 -1.296 -5.497 -10.544 1.00 0.00 C ATOM 766 CG1 ILE A 182 -1.385 -4.080 -9.973 1.00 0.00 C ATOM 767 CG2 ILE A 182 0.135 -6.035 -10.522 1.00 0.00 C ATOM 768 CD1 ILE A 182 -2.680 -3.888 -9.181 1.00 0.00 C ATOM 0 H ILE A 182 -0.786 -3.888 -12.585 1.00 0.00 H new ATOM 0 HA ILE A 182 -1.913 -6.616 -12.215 1.00 0.00 H new ATOM 0 HB ILE A 182 -1.892 -6.142 -9.898 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -0.528 -3.890 -9.327 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -1.340 -3.354 -10.784 1.00 0.00 H new ATOM 0 HG21 ILE A 182 0.529 -5.980 -9.507 1.00 0.00 H new ATOM 0 HG22 ILE A 182 0.139 -7.072 -10.857 1.00 0.00 H new ATOM 0 HG23 ILE A 182 0.759 -5.437 -11.186 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -2.718 -2.873 -8.786 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -3.535 -4.055 -9.836 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -2.711 -4.599 -8.356 1.00 0.00 H new ATOM 780 N PRO A 183 -4.277 -5.991 -12.147 1.00 0.00 N ATOM 781 CA PRO A 183 -5.682 -5.637 -12.242 1.00 0.00 C ATOM 782 C PRO A 183 -6.227 -5.185 -10.886 1.00 0.00 C ATOM 783 O PRO A 183 -6.148 -5.921 -9.904 1.00 0.00 O ATOM 784 CB PRO A 183 -6.368 -6.886 -12.772 1.00 0.00 C ATOM 785 CG PRO A 183 -5.403 -8.032 -12.512 1.00 0.00 C ATOM 786 CD PRO A 183 -4.048 -7.433 -12.172 1.00 0.00 C ATOM 0 HA PRO A 183 -5.858 -4.790 -12.905 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -7.319 -7.054 -12.267 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -6.585 -6.791 -13.836 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -5.762 -8.654 -11.692 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -5.327 -8.674 -13.390 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -3.686 -7.793 -11.209 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -3.298 -7.702 -12.916 1.00 0.00 H new ATOM 794 N VAL A 184 -6.768 -3.976 -10.875 1.00 0.00 N ATOM 795 CA VAL A 184 -7.326 -3.416 -9.655 1.00 0.00 C ATOM 796 C VAL A 184 -8.625 -4.149 -9.311 1.00 0.00 C ATOM 797 O VAL A 184 -8.976 -4.279 -8.140 1.00 0.00 O ATOM 798 CB VAL A 184 -7.515 -1.906 -9.810 1.00 0.00 C ATOM 799 CG1 VAL A 184 -8.246 -1.318 -8.602 1.00 0.00 C ATOM 800 CG2 VAL A 184 -6.172 -1.206 -10.033 1.00 0.00 C ATOM 0 H VAL A 184 -6.832 -3.368 -11.691 1.00 0.00 H new ATOM 0 HA VAL A 184 -6.640 -3.560 -8.820 1.00 0.00 H new ATOM 0 HB VAL A 184 -8.133 -1.734 -10.691 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.367 -0.243 -8.738 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -9.226 -1.785 -8.507 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -7.666 -1.506 -7.699 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -6.334 -0.133 -10.140 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -5.519 -1.391 -9.180 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -5.705 -1.595 -10.938 1.00 0.00 H new ATOM 810 N PRO A 185 -9.320 -4.619 -10.381 1.00 0.00 N ATOM 811 CA PRO A 185 -10.572 -5.334 -10.204 1.00 0.00 C ATOM 812 C PRO A 185 -10.324 -6.756 -9.696 1.00 0.00 C ATOM 813 O PRO A 185 -11.170 -7.332 -9.013 1.00 0.00 O ATOM 814 CB PRO A 185 -11.242 -5.299 -11.568 1.00 0.00 C ATOM 815 CG PRO A 185 -10.141 -4.976 -12.565 1.00 0.00 C ATOM 816 CD PRO A 185 -8.935 -4.482 -11.783 1.00 0.00 C ATOM 0 HA PRO A 185 -11.213 -4.879 -9.449 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -11.709 -6.257 -11.798 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -12.029 -4.545 -11.597 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -9.882 -5.860 -13.148 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -10.476 -4.216 -13.271 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -8.047 -5.073 -12.009 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -8.700 -3.447 -12.030 1.00 0.00 H new ATOM 824 N TYR A 186 -9.160 -7.282 -10.049 1.00 0.00 N ATOM 825 CA TYR A 186 -8.790 -8.626 -9.639 1.00 0.00 C ATOM 826 C TYR A 186 -7.856 -8.590 -8.427 1.00 0.00 C ATOM 827 O TYR A 186 -7.508 -9.633 -7.877 1.00 0.00 O ATOM 828 CB TYR A 186 -8.045 -9.240 -10.824 1.00 0.00 C ATOM 829 CG TYR A 186 -8.963 -9.812 -11.907 1.00 0.00 C ATOM 830 CD1 TYR A 186 -10.003 -9.052 -12.402 1.00 0.00 C ATOM 831 CD2 TYR A 186 -8.749 -11.087 -12.389 1.00 0.00 C ATOM 832 CE1 TYR A 186 -10.867 -9.591 -13.421 1.00 0.00 C ATOM 833 CE2 TYR A 186 -9.612 -11.625 -13.409 1.00 0.00 C ATOM 834 CZ TYR A 186 -10.629 -10.851 -13.873 1.00 0.00 C ATOM 835 OH TYR A 186 -11.444 -11.360 -14.837 1.00 0.00 O ATOM 0 H TYR A 186 -8.461 -6.801 -10.615 1.00 0.00 H new ATOM 0 HA TYR A 186 -9.674 -9.199 -9.360 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -7.403 -8.480 -11.270 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -7.393 -10.033 -10.459 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -10.169 -8.053 -12.026 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -7.935 -11.681 -12.002 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -11.685 -9.008 -13.817 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -9.455 -12.621 -13.797 1.00 0.00 H new ATOM 0 HH TYR A 186 -11.155 -12.268 -15.064 1.00 0.00 H new ATOM 845 N VAL A 187 -7.477 -7.379 -8.047 1.00 0.00 N ATOM 846 CA VAL A 187 -6.589 -7.194 -6.913 1.00 0.00 C ATOM 847 C VAL A 187 -7.160 -6.110 -5.996 1.00 0.00 C ATOM 848 O VAL A 187 -8.024 -5.337 -6.406 1.00 0.00 O ATOM 849 CB VAL A 187 -5.174 -6.880 -7.400 1.00 0.00 C ATOM 850 CG1 VAL A 187 -4.828 -7.700 -8.645 1.00 0.00 C ATOM 851 CG2 VAL A 187 -5.004 -5.383 -7.664 1.00 0.00 C ATOM 0 H VAL A 187 -7.769 -6.516 -8.505 1.00 0.00 H new ATOM 0 HA VAL A 187 -6.520 -8.112 -6.329 1.00 0.00 H new ATOM 0 HB VAL A 187 -4.478 -7.161 -6.610 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -3.816 -7.458 -8.971 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -4.889 -8.762 -8.409 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -5.532 -7.465 -9.443 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -3.989 -5.187 -8.009 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -5.714 -5.065 -8.427 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -5.188 -4.828 -6.744 1.00 0.00 H new ATOM 861 N GLU A 188 -6.653 -6.088 -4.772 1.00 0.00 N ATOM 862 CA GLU A 188 -7.102 -5.110 -3.794 1.00 0.00 C ATOM 863 C GLU A 188 -5.982 -4.115 -3.485 1.00 0.00 C ATOM 864 O GLU A 188 -4.805 -4.470 -3.520 1.00 0.00 O ATOM 865 CB GLU A 188 -7.591 -5.798 -2.518 1.00 0.00 C ATOM 866 CG GLU A 188 -8.878 -5.147 -2.004 1.00 0.00 C ATOM 867 CD GLU A 188 -9.686 -6.130 -1.153 1.00 0.00 C ATOM 868 OE1 GLU A 188 -9.172 -6.508 -0.079 1.00 0.00 O ATOM 869 OE2 GLU A 188 -10.803 -6.478 -1.596 1.00 0.00 O ATOM 0 H GLU A 188 -5.936 -6.731 -4.435 1.00 0.00 H new ATOM 0 HA GLU A 188 -7.943 -4.560 -4.218 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -7.767 -6.855 -2.715 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -6.819 -5.741 -1.751 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -8.633 -4.265 -1.413 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -9.481 -4.809 -2.847 1.00 0.00 H new ATOM 876 N LYS A 189 -6.388 -2.890 -3.189 1.00 0.00 N ATOM 877 CA LYS A 189 -5.433 -1.841 -2.875 1.00 0.00 C ATOM 878 C LYS A 189 -5.132 -1.864 -1.374 1.00 0.00 C ATOM 879 O LYS A 189 -5.937 -1.401 -0.569 1.00 0.00 O ATOM 880 CB LYS A 189 -5.939 -0.488 -3.379 1.00 0.00 C ATOM 881 CG LYS A 189 -7.172 -0.036 -2.595 1.00 0.00 C ATOM 882 CD LYS A 189 -7.874 1.128 -3.299 1.00 0.00 C ATOM 883 CE LYS A 189 -9.190 0.673 -3.933 1.00 0.00 C ATOM 884 NZ LYS A 189 -10.194 0.380 -2.886 1.00 0.00 N ATOM 0 H LYS A 189 -7.365 -2.600 -3.160 1.00 0.00 H new ATOM 0 HA LYS A 189 -4.490 -2.017 -3.393 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -5.150 0.258 -3.284 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -6.184 -0.559 -4.439 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -7.864 -0.871 -2.487 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -6.878 0.267 -1.590 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -8.068 1.927 -2.583 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -7.220 1.541 -4.067 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -9.567 1.448 -4.600 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -9.020 -0.215 -4.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -11.146 0.389 -3.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -10.005 -0.557 -2.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -10.138 1.102 -2.140 1.00 0.00 H new ATOM 898 N TYR A 190 -3.969 -2.408 -1.046 1.00 0.00 N ATOM 899 CA TYR A 190 -3.552 -2.498 0.343 1.00 0.00 C ATOM 900 C TYR A 190 -2.798 -1.237 0.771 1.00 0.00 C ATOM 901 O TYR A 190 -2.854 -0.840 1.934 1.00 0.00 O ATOM 902 CB TYR A 190 -2.604 -3.696 0.421 1.00 0.00 C ATOM 903 CG TYR A 190 -2.432 -4.262 1.833 1.00 0.00 C ATOM 904 CD1 TYR A 190 -3.323 -5.199 2.313 1.00 0.00 C ATOM 905 CD2 TYR A 190 -1.386 -3.835 2.625 1.00 0.00 C ATOM 906 CE1 TYR A 190 -3.161 -5.732 3.642 1.00 0.00 C ATOM 907 CE2 TYR A 190 -1.224 -4.367 3.952 1.00 0.00 C ATOM 908 CZ TYR A 190 -2.120 -5.289 4.396 1.00 0.00 C ATOM 909 OH TYR A 190 -1.966 -5.792 5.650 1.00 0.00 O ATOM 0 H TYR A 190 -3.303 -2.790 -1.717 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.417 -2.606 0.998 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -2.977 -4.485 -0.233 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -1.628 -3.399 0.038 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -4.142 -5.533 1.693 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -0.689 -3.101 2.249 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -3.851 -6.467 4.030 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -0.409 -4.041 4.582 1.00 0.00 H new ATOM 0 HH TYR A 190 -1.180 -5.386 6.071 1.00 0.00 H new ATOM 919 N GLY A 191 -2.108 -0.643 -0.192 1.00 0.00 N ATOM 920 CA GLY A 191 -1.343 0.565 0.071 1.00 0.00 C ATOM 921 C GLY A 191 0.156 0.265 0.116 1.00 0.00 C ATOM 922 O GLY A 191 0.600 -0.590 0.881 1.00 0.00 O ATOM 0 H GLY A 191 -2.063 -0.975 -1.155 1.00 0.00 H new ATOM 0 HA2 GLY A 191 -1.546 1.305 -0.703 1.00 0.00 H new ATOM 0 HA3 GLY A 191 -1.659 1.001 1.019 1.00 0.00 H new TER 926 GLY A 191