USER MOD reduce.3.24.130724 H: found=0, std=0, add=435, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 434 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 149 LYS NZ :NH3+ 180:sc=-0.000949 (180deg=-0.000949) USER MOD Set 1.2: A 171 CYS SG : rot -110:sc= -0.78 USER MOD Set 2.1: A 126 SER OG : rot -120:sc= 0.463 USER MOD Set 2.2: A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 152:sc= -0.149 (180deg=-0.501) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 HIS : no HD1:sc= -0.17 K(o=-0.17,f=-0.75) USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 ASN : amide:sc=-0.00649 K(o=-0.0065,f=-1.6) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 156 SER OG : rot -13:sc= 0.301 USER MOD Single : A 157 THR OG1 : rot -19:sc= 0.136 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD Single : A 162 LYS NZ :NH3+ -143:sc= -0.0645 (180deg=-1.41!) USER MOD Single : A 167 TYR OH : rot 34:sc= 0.183 USER MOD Single : A 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 172 TYR OH : rot 63:sc= 0.459 USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 175 ASN : amide:sc= 0 X(o=0,f=-0.0027) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 117 -5.734 -11.869 -3.749 1.00 0.00 N ATOM 2 CA ALA A 117 -4.649 -12.878 -3.755 1.00 0.00 C ATOM 3 C ALA A 117 -3.732 -12.619 -4.909 1.00 0.00 C ATOM 4 O ALA A 117 -3.991 -13.054 -6.032 1.00 0.00 O ATOM 5 CB ALA A 117 -5.235 -14.301 -3.856 1.00 0.00 C ATOM 0 HA ALA A 117 -4.090 -12.801 -2.823 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -4.424 -15.029 -3.859 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.887 -14.488 -3.002 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.809 -14.393 -4.778 1.00 0.00 H new ATOM 11 N GLU A 118 -2.636 -11.871 -4.647 1.00 0.00 N ATOM 12 CA GLU A 118 -1.684 -11.469 -5.653 1.00 0.00 C ATOM 13 C GLU A 118 -0.362 -11.517 -4.945 1.00 0.00 C ATOM 14 O GLU A 118 -0.087 -12.459 -4.204 1.00 0.00 O ATOM 15 CB GLU A 118 -1.933 -10.047 -6.237 1.00 0.00 C ATOM 16 CG GLU A 118 -3.312 -9.865 -6.899 1.00 0.00 C ATOM 17 CD GLU A 118 -3.453 -8.430 -7.408 1.00 0.00 C ATOM 18 OE1 GLU A 118 -2.667 -8.042 -8.313 1.00 0.00 O ATOM 19 OE2 GLU A 118 -4.346 -7.704 -6.897 1.00 0.00 O ATOM 0 H GLU A 118 -2.404 -11.536 -3.712 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.751 -12.126 -6.520 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -1.828 -9.315 -5.436 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -1.159 -9.828 -6.972 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -3.425 -10.567 -7.725 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -4.103 -10.086 -6.182 1.00 0.00 H new ATOM 26 N LYS A 119 0.496 -10.496 -5.163 1.00 0.00 N ATOM 27 CA LYS A 119 1.769 -10.393 -4.512 1.00 0.00 C ATOM 28 C LYS A 119 1.709 -9.281 -3.507 1.00 0.00 C ATOM 29 O LYS A 119 0.849 -8.402 -3.570 1.00 0.00 O ATOM 30 CB LYS A 119 2.951 -10.214 -5.473 1.00 0.00 C ATOM 31 CG LYS A 119 4.122 -11.164 -5.162 1.00 0.00 C ATOM 32 CD LYS A 119 5.389 -10.910 -5.994 1.00 0.00 C ATOM 33 CE LYS A 119 6.082 -9.581 -5.658 1.00 0.00 C ATOM 34 NZ LYS A 119 7.356 -9.441 -6.402 1.00 0.00 N ATOM 0 H LYS A 119 0.299 -9.728 -5.805 1.00 0.00 H new ATOM 0 HA LYS A 119 1.959 -11.344 -4.015 1.00 0.00 H new ATOM 0 HB2 LYS A 119 2.612 -10.385 -6.495 1.00 0.00 H new ATOM 0 HB3 LYS A 119 3.302 -9.183 -5.422 1.00 0.00 H new ATOM 0 HG2 LYS A 119 4.373 -11.076 -4.105 1.00 0.00 H new ATOM 0 HG3 LYS A 119 3.794 -12.190 -5.327 1.00 0.00 H new ATOM 0 HD2 LYS A 119 6.091 -11.728 -5.833 1.00 0.00 H new ATOM 0 HD3 LYS A 119 5.128 -10.918 -7.052 1.00 0.00 H new ATOM 0 HE2 LYS A 119 5.421 -8.750 -5.904 1.00 0.00 H new ATOM 0 HE3 LYS A 119 6.275 -9.529 -4.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 7.804 -8.535 -6.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 7.994 -10.222 -6.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 7.166 -9.468 -7.424 1.00 0.00 H new ATOM 48 N CYS A 120 2.662 -9.320 -2.554 1.00 0.00 N ATOM 49 CA CYS A 120 2.911 -8.289 -1.587 1.00 0.00 C ATOM 50 C CYS A 120 4.058 -7.500 -2.151 1.00 0.00 C ATOM 51 O CYS A 120 5.090 -8.065 -2.511 1.00 0.00 O ATOM 52 CB CYS A 120 3.291 -8.868 -0.206 1.00 0.00 C ATOM 53 SG CYS A 120 3.395 -7.629 1.111 1.00 0.00 S ATOM 0 H CYS A 120 3.294 -10.115 -2.453 1.00 0.00 H new ATOM 0 HA CYS A 120 2.020 -7.684 -1.421 1.00 0.00 H new ATOM 0 HB2 CYS A 120 2.555 -9.621 0.075 1.00 0.00 H new ATOM 0 HB3 CYS A 120 4.252 -9.376 -0.289 1.00 0.00 H new ATOM 58 N SER A 121 3.871 -6.167 -2.276 1.00 0.00 N ATOM 59 CA SER A 121 4.808 -5.275 -2.920 1.00 0.00 C ATOM 60 C SER A 121 5.976 -4.970 -2.009 1.00 0.00 C ATOM 61 O SER A 121 7.059 -4.629 -2.482 1.00 0.00 O ATOM 62 CB SER A 121 4.109 -3.951 -3.326 1.00 0.00 C ATOM 63 OG SER A 121 4.917 -3.149 -4.182 1.00 0.00 O ATOM 0 H SER A 121 3.043 -5.691 -1.919 1.00 0.00 H new ATOM 0 HA SER A 121 5.180 -5.774 -3.815 1.00 0.00 H new ATOM 0 HB2 SER A 121 3.169 -4.179 -3.828 1.00 0.00 H new ATOM 0 HB3 SER A 121 3.862 -3.384 -2.428 1.00 0.00 H new ATOM 0 HG SER A 121 4.435 -2.327 -4.412 1.00 0.00 H new ATOM 69 N ARG A 122 5.773 -5.084 -0.674 1.00 0.00 N ATOM 70 CA ARG A 122 6.733 -4.655 0.312 1.00 0.00 C ATOM 71 C ARG A 122 7.781 -5.708 0.508 1.00 0.00 C ATOM 72 O ARG A 122 8.960 -5.461 0.258 1.00 0.00 O ATOM 73 CB ARG A 122 6.032 -4.344 1.651 1.00 0.00 C ATOM 74 CG ARG A 122 6.869 -3.660 2.751 1.00 0.00 C ATOM 75 CD ARG A 122 7.685 -4.601 3.647 1.00 0.00 C ATOM 76 NE ARG A 122 8.154 -3.819 4.840 1.00 0.00 N ATOM 77 CZ ARG A 122 8.319 -4.369 6.082 1.00 0.00 C ATOM 78 NH1 ARG A 122 8.140 -5.705 6.294 1.00 0.00 N ATOM 79 NH2 ARG A 122 8.665 -3.561 7.128 1.00 0.00 N ATOM 0 H ARG A 122 4.924 -5.482 -0.272 1.00 0.00 H new ATOM 0 HA ARG A 122 7.213 -3.744 -0.047 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.171 -3.710 1.440 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.647 -5.281 2.055 1.00 0.00 H new ATOM 0 HG2 ARG A 122 7.553 -2.956 2.277 1.00 0.00 H new ATOM 0 HG3 ARG A 122 6.199 -3.077 3.383 1.00 0.00 H new ATOM 0 HD2 ARG A 122 7.077 -5.449 3.963 1.00 0.00 H new ATOM 0 HD3 ARG A 122 8.536 -5.006 3.099 1.00 0.00 H new ATOM 0 HE ARG A 122 8.360 -2.827 4.718 1.00 0.00 H new ATOM 0 HH11 ARG A 122 7.878 -6.314 5.519 1.00 0.00 H new ATOM 0 HH12 ARG A 122 8.268 -6.095 7.228 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.797 -2.561 6.978 1.00 0.00 H new ATOM 0 HH22 ARG A 122 8.791 -3.958 8.059 1.00 0.00 H new ATOM 93 N CYS A 123 7.369 -6.911 0.972 1.00 0.00 N ATOM 94 CA CYS A 123 8.293 -7.920 1.428 1.00 0.00 C ATOM 95 C CYS A 123 8.699 -8.806 0.274 1.00 0.00 C ATOM 96 O CYS A 123 9.800 -9.355 0.276 1.00 0.00 O ATOM 97 CB CYS A 123 7.727 -8.745 2.617 1.00 0.00 C ATOM 98 SG CYS A 123 6.256 -9.756 2.242 1.00 0.00 S ATOM 0 H CYS A 123 6.389 -7.187 1.032 1.00 0.00 H new ATOM 0 HA CYS A 123 9.181 -7.416 1.808 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.514 -9.403 2.987 1.00 0.00 H new ATOM 0 HB3 CYS A 123 7.478 -8.059 3.427 1.00 0.00 H new ATOM 103 N GLY A 124 7.825 -8.929 -0.755 1.00 0.00 N ATOM 104 CA GLY A 124 8.153 -9.581 -2.001 1.00 0.00 C ATOM 105 C GLY A 124 7.580 -10.964 -2.073 1.00 0.00 C ATOM 106 O GLY A 124 7.725 -11.635 -3.093 1.00 0.00 O ATOM 0 H GLY A 124 6.871 -8.569 -0.721 1.00 0.00 H new ATOM 0 HA2 GLY A 124 7.774 -8.987 -2.833 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.236 -9.630 -2.111 1.00 0.00 H new ATOM 110 N ASP A 125 6.911 -11.429 -0.990 1.00 0.00 N ATOM 111 CA ASP A 125 6.345 -12.758 -0.915 1.00 0.00 C ATOM 112 C ASP A 125 4.955 -12.685 -1.475 1.00 0.00 C ATOM 113 O ASP A 125 4.333 -11.628 -1.464 1.00 0.00 O ATOM 114 CB ASP A 125 6.241 -13.313 0.531 1.00 0.00 C ATOM 115 CG ASP A 125 7.635 -13.511 1.133 1.00 0.00 C ATOM 116 OD1 ASP A 125 8.303 -12.492 1.455 1.00 0.00 O ATOM 117 OD2 ASP A 125 8.045 -14.692 1.291 1.00 0.00 O ATOM 0 H ASP A 125 6.759 -10.873 -0.149 1.00 0.00 H new ATOM 0 HA ASP A 125 7.004 -13.426 -1.469 1.00 0.00 H new ATOM 0 HB2 ASP A 125 5.666 -12.625 1.150 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.703 -14.261 0.525 1.00 0.00 H new ATOM 122 N SER A 126 4.435 -13.823 -1.991 1.00 0.00 N ATOM 123 CA SER A 126 3.114 -13.887 -2.566 1.00 0.00 C ATOM 124 C SER A 126 2.152 -14.149 -1.439 1.00 0.00 C ATOM 125 O SER A 126 2.325 -15.109 -0.689 1.00 0.00 O ATOM 126 CB SER A 126 2.993 -14.987 -3.651 1.00 0.00 C ATOM 127 OG SER A 126 1.756 -14.912 -4.349 1.00 0.00 O ATOM 0 H SER A 126 4.937 -14.711 -2.010 1.00 0.00 H new ATOM 0 HA SER A 126 2.891 -12.945 -3.068 1.00 0.00 H new ATOM 0 HB2 SER A 126 3.816 -14.890 -4.359 1.00 0.00 H new ATOM 0 HB3 SER A 126 3.088 -15.968 -3.185 1.00 0.00 H new ATOM 0 HG SER A 126 1.260 -15.748 -4.226 1.00 0.00 H new ATOM 133 N VAL A 127 1.133 -13.268 -1.293 1.00 0.00 N ATOM 134 CA VAL A 127 0.169 -13.355 -0.223 1.00 0.00 C ATOM 135 C VAL A 127 -1.156 -13.660 -0.866 1.00 0.00 C ATOM 136 O VAL A 127 -1.573 -13.016 -1.827 1.00 0.00 O ATOM 137 CB VAL A 127 0.145 -12.124 0.681 1.00 0.00 C ATOM 138 CG1 VAL A 127 -0.338 -10.853 -0.045 1.00 0.00 C ATOM 139 CG2 VAL A 127 -0.680 -12.431 1.946 1.00 0.00 C ATOM 0 H VAL A 127 0.976 -12.484 -1.926 1.00 0.00 H new ATOM 0 HA VAL A 127 0.443 -14.151 0.470 1.00 0.00 H new ATOM 0 HB VAL A 127 1.170 -11.902 0.979 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -0.333 -10.013 0.650 1.00 0.00 H new ATOM 0 HG12 VAL A 127 0.327 -10.637 -0.881 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.350 -11.009 -0.418 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.697 -11.553 2.591 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -1.699 -12.692 1.661 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -0.228 -13.266 2.482 1.00 0.00 H new ATOM 149 N TYR A 128 -1.824 -14.718 -0.351 1.00 0.00 N ATOM 150 CA TYR A 128 -3.012 -15.279 -0.940 1.00 0.00 C ATOM 151 C TYR A 128 -4.156 -14.860 -0.067 1.00 0.00 C ATOM 152 O TYR A 128 -4.769 -13.820 -0.299 1.00 0.00 O ATOM 153 CB TYR A 128 -2.942 -16.823 -1.051 1.00 0.00 C ATOM 154 CG TYR A 128 -1.831 -17.201 -1.996 1.00 0.00 C ATOM 155 CD1 TYR A 128 -2.042 -17.181 -3.386 1.00 0.00 C ATOM 156 CD2 TYR A 128 -0.561 -17.557 -1.506 1.00 0.00 C ATOM 157 CE1 TYR A 128 -1.008 -17.517 -4.269 1.00 0.00 C ATOM 158 CE2 TYR A 128 0.475 -17.891 -2.386 1.00 0.00 C ATOM 159 CZ TYR A 128 0.251 -17.876 -3.770 1.00 0.00 C ATOM 160 OH TYR A 128 1.296 -18.218 -4.658 1.00 0.00 O ATOM 0 H TYR A 128 -1.529 -15.197 0.500 1.00 0.00 H new ATOM 0 HA TYR A 128 -3.131 -14.916 -1.961 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -2.766 -17.263 -0.069 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -3.892 -17.217 -1.411 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -3.010 -16.904 -3.776 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -0.384 -17.573 -0.441 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -1.181 -17.499 -5.335 1.00 0.00 H new ATOM 0 HE2 TYR A 128 1.447 -18.160 -1.999 1.00 0.00 H new ATOM 0 HH TYR A 128 2.101 -18.440 -4.146 1.00 0.00 H new ATOM 170 N ALA A 129 -4.460 -15.671 0.969 1.00 0.00 N ATOM 171 CA ALA A 129 -5.472 -15.368 1.944 1.00 0.00 C ATOM 172 C ALA A 129 -4.942 -15.880 3.251 1.00 0.00 C ATOM 173 O ALA A 129 -5.671 -16.475 4.044 1.00 0.00 O ATOM 174 CB ALA A 129 -6.821 -16.047 1.628 1.00 0.00 C ATOM 0 H ALA A 129 -3.990 -16.561 1.134 1.00 0.00 H new ATOM 0 HA ALA A 129 -5.670 -14.296 1.957 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -7.549 -15.785 2.396 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -7.180 -15.708 0.656 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -6.688 -17.129 1.609 1.00 0.00 H new ATOM 180 N ALA A 130 -3.632 -15.642 3.501 1.00 0.00 N ATOM 181 CA ALA A 130 -2.943 -16.060 4.696 1.00 0.00 C ATOM 182 C ALA A 130 -3.137 -14.974 5.715 1.00 0.00 C ATOM 183 O ALA A 130 -4.037 -15.052 6.549 1.00 0.00 O ATOM 184 CB ALA A 130 -1.439 -16.296 4.441 1.00 0.00 C ATOM 0 H ALA A 130 -3.031 -15.140 2.847 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.348 -17.010 5.045 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -0.958 -16.610 5.367 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -1.315 -17.073 3.687 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -0.980 -15.372 4.089 1.00 0.00 H new ATOM 190 N GLU A 131 -2.304 -13.914 5.629 1.00 0.00 N ATOM 191 CA GLU A 131 -2.481 -12.687 6.355 1.00 0.00 C ATOM 192 C GLU A 131 -2.578 -11.687 5.249 1.00 0.00 C ATOM 193 O GLU A 131 -1.628 -10.968 4.948 1.00 0.00 O ATOM 194 CB GLU A 131 -1.307 -12.362 7.318 1.00 0.00 C ATOM 195 CG GLU A 131 -1.403 -11.015 8.068 1.00 0.00 C ATOM 196 CD GLU A 131 -2.715 -10.912 8.844 1.00 0.00 C ATOM 197 OE1 GLU A 131 -2.925 -11.741 9.769 1.00 0.00 O ATOM 198 OE2 GLU A 131 -3.523 -9.999 8.524 1.00 0.00 O ATOM 0 H GLU A 131 -1.477 -13.912 5.032 1.00 0.00 H new ATOM 0 HA GLU A 131 -3.345 -12.713 7.019 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -1.235 -13.162 8.055 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -0.380 -12.372 6.745 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -0.562 -10.916 8.754 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -1.332 -10.193 7.356 1.00 0.00 H new ATOM 205 N LYS A 132 -3.754 -11.663 4.586 1.00 0.00 N ATOM 206 CA LYS A 132 -4.025 -10.748 3.512 1.00 0.00 C ATOM 207 C LYS A 132 -5.089 -9.821 4.008 1.00 0.00 C ATOM 208 O LYS A 132 -6.107 -10.254 4.546 1.00 0.00 O ATOM 209 CB LYS A 132 -4.487 -11.471 2.224 1.00 0.00 C ATOM 210 CG LYS A 132 -4.506 -10.593 0.957 1.00 0.00 C ATOM 211 CD LYS A 132 -5.830 -9.875 0.629 1.00 0.00 C ATOM 212 CE LYS A 132 -6.853 -10.720 -0.151 1.00 0.00 C ATOM 213 NZ LYS A 132 -7.429 -11.816 0.664 1.00 0.00 N ATOM 0 H LYS A 132 -4.530 -12.290 4.799 1.00 0.00 H new ATOM 0 HA LYS A 132 -3.116 -10.212 3.239 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -3.830 -12.323 2.048 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -5.489 -11.869 2.388 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -3.726 -9.838 1.055 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -4.239 -11.219 0.106 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -6.288 -9.547 1.562 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -5.606 -8.978 0.051 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -7.657 -10.075 -0.505 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -6.372 -11.143 -1.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -8.384 -12.040 0.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -6.826 -12.660 0.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -7.481 -11.518 1.659 1.00 0.00 H new ATOM 227 N VAL A 133 -4.852 -8.507 3.816 1.00 0.00 N ATOM 228 CA VAL A 133 -5.782 -7.449 4.094 1.00 0.00 C ATOM 229 C VAL A 133 -5.624 -6.524 2.923 1.00 0.00 C ATOM 230 O VAL A 133 -4.576 -6.497 2.277 1.00 0.00 O ATOM 231 CB VAL A 133 -5.544 -6.701 5.407 1.00 0.00 C ATOM 232 CG1 VAL A 133 -6.028 -7.583 6.577 1.00 0.00 C ATOM 233 CG2 VAL A 133 -4.061 -6.310 5.572 1.00 0.00 C ATOM 0 H VAL A 133 -3.965 -8.164 3.447 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.785 -7.856 4.222 1.00 0.00 H new ATOM 0 HB VAL A 133 -6.111 -5.770 5.399 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -5.863 -7.060 7.519 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -7.091 -7.792 6.459 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.472 -8.520 6.580 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -3.927 -5.780 6.515 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -3.445 -7.209 5.570 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -3.761 -5.664 4.747 1.00 0.00 H new ATOM 243 N ILE A 134 -6.694 -5.767 2.598 1.00 0.00 N ATOM 244 CA ILE A 134 -6.737 -4.916 1.435 1.00 0.00 C ATOM 245 C ILE A 134 -6.754 -3.508 1.961 1.00 0.00 C ATOM 246 O ILE A 134 -7.464 -3.201 2.918 1.00 0.00 O ATOM 247 CB ILE A 134 -7.950 -5.195 0.546 1.00 0.00 C ATOM 248 CG1 ILE A 134 -7.923 -6.679 0.089 1.00 0.00 C ATOM 249 CG2 ILE A 134 -7.962 -4.226 -0.658 1.00 0.00 C ATOM 250 CD1 ILE A 134 -9.119 -7.098 -0.772 1.00 0.00 C ATOM 0 H ILE A 134 -7.549 -5.744 3.153 1.00 0.00 H new ATOM 0 HA ILE A 134 -5.874 -5.099 0.794 1.00 0.00 H new ATOM 0 HB ILE A 134 -8.868 -5.028 1.109 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -7.006 -6.857 -0.473 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -7.885 -7.318 0.972 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -8.830 -4.434 -1.284 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -8.012 -3.199 -0.298 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -7.052 -4.361 -1.243 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -9.020 -8.148 -1.047 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -10.041 -6.956 -0.208 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -9.149 -6.488 -1.675 1.00 0.00 H new ATOM 262 N GLY A 135 -5.948 -2.623 1.327 1.00 0.00 N ATOM 263 CA GLY A 135 -5.900 -1.216 1.625 1.00 0.00 C ATOM 264 C GLY A 135 -6.766 -0.547 0.607 1.00 0.00 C ATOM 265 O GLY A 135 -7.914 -0.205 0.884 1.00 0.00 O ATOM 0 H GLY A 135 -5.308 -2.898 0.582 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -6.261 -1.019 2.634 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -4.878 -0.841 1.574 1.00 0.00 H new ATOM 269 N ALA A 136 -6.215 -0.365 -0.616 1.00 0.00 N ATOM 270 CA ALA A 136 -6.919 0.193 -1.741 1.00 0.00 C ATOM 271 C ALA A 136 -7.491 -0.958 -2.516 1.00 0.00 C ATOM 272 O ALA A 136 -8.694 -1.210 -2.472 1.00 0.00 O ATOM 273 CB ALA A 136 -5.994 1.012 -2.660 1.00 0.00 C ATOM 0 H ALA A 136 -5.249 -0.614 -0.828 1.00 0.00 H new ATOM 0 HA ALA A 136 -7.691 0.872 -1.379 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -6.571 1.412 -3.494 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -5.555 1.834 -2.095 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -5.200 0.370 -3.043 1.00 0.00 H new ATOM 279 N GLY A 137 -6.614 -1.694 -3.230 1.00 0.00 N ATOM 280 CA GLY A 137 -6.990 -2.866 -3.971 1.00 0.00 C ATOM 281 C GLY A 137 -5.757 -3.696 -4.125 1.00 0.00 C ATOM 282 O GLY A 137 -5.613 -4.424 -5.107 1.00 0.00 O ATOM 0 H GLY A 137 -5.621 -1.470 -3.294 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -7.767 -3.422 -3.446 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -7.396 -2.593 -4.945 1.00 0.00 H new ATOM 286 N LYS A 138 -4.830 -3.593 -3.142 1.00 0.00 N ATOM 287 CA LYS A 138 -3.557 -4.263 -3.161 1.00 0.00 C ATOM 288 C LYS A 138 -3.543 -5.226 -2.000 1.00 0.00 C ATOM 289 O LYS A 138 -3.855 -4.812 -0.886 1.00 0.00 O ATOM 290 CB LYS A 138 -2.378 -3.288 -2.961 1.00 0.00 C ATOM 291 CG LYS A 138 -2.204 -2.310 -4.133 1.00 0.00 C ATOM 292 CD LYS A 138 -1.050 -1.325 -3.905 1.00 0.00 C ATOM 293 CE LYS A 138 -0.808 -0.400 -5.100 1.00 0.00 C ATOM 294 NZ LYS A 138 0.291 0.550 -4.818 1.00 0.00 N ATOM 0 H LYS A 138 -4.973 -3.024 -2.307 1.00 0.00 H new ATOM 0 HA LYS A 138 -3.439 -4.750 -4.129 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -2.533 -2.722 -2.042 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -1.459 -3.859 -2.832 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -2.022 -2.873 -5.049 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -3.130 -1.754 -4.279 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -1.264 -0.721 -3.023 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -0.138 -1.884 -3.695 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -0.564 -0.994 -5.981 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -1.720 0.151 -5.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 0.437 1.167 -5.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 0.045 1.130 -3.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 1.165 0.022 -4.622 1.00 0.00 H new ATOM 308 N PRO A 139 -3.170 -6.492 -2.184 1.00 0.00 N ATOM 309 CA PRO A 139 -2.919 -7.418 -1.090 1.00 0.00 C ATOM 310 C PRO A 139 -1.715 -7.014 -0.274 1.00 0.00 C ATOM 311 O PRO A 139 -0.736 -6.534 -0.845 1.00 0.00 O ATOM 312 CB PRO A 139 -2.680 -8.756 -1.797 1.00 0.00 C ATOM 313 CG PRO A 139 -3.598 -8.662 -3.012 1.00 0.00 C ATOM 314 CD PRO A 139 -3.398 -7.212 -3.440 1.00 0.00 C ATOM 0 HA PRO A 139 -3.745 -7.450 -0.379 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -1.637 -8.880 -2.087 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -2.937 -9.602 -1.160 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -3.312 -9.363 -3.796 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -4.636 -8.874 -2.758 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -2.549 -7.110 -4.116 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -4.272 -6.828 -3.966 1.00 0.00 H new ATOM 322 N TRP A 140 -1.815 -7.164 1.064 1.00 0.00 N ATOM 323 CA TRP A 140 -0.877 -6.620 2.007 1.00 0.00 C ATOM 324 C TRP A 140 -0.862 -7.535 3.190 1.00 0.00 C ATOM 325 O TRP A 140 -1.902 -8.034 3.607 1.00 0.00 O ATOM 326 CB TRP A 140 -1.251 -5.233 2.590 1.00 0.00 C ATOM 327 CG TRP A 140 -1.359 -4.067 1.633 1.00 0.00 C ATOM 328 CD1 TRP A 140 -2.422 -3.223 1.475 1.00 0.00 C ATOM 329 CD2 TRP A 140 -0.288 -3.523 0.841 1.00 0.00 C ATOM 330 NE1 TRP A 140 -2.091 -2.186 0.640 1.00 0.00 N ATOM 331 CE2 TRP A 140 -0.778 -2.339 0.250 1.00 0.00 C ATOM 332 CE3 TRP A 140 1.022 -3.943 0.629 1.00 0.00 C ATOM 333 CZ2 TRP A 140 0.040 -1.551 -0.550 1.00 0.00 C ATOM 334 CZ3 TRP A 140 1.845 -3.148 -0.180 1.00 0.00 C ATOM 335 CH2 TRP A 140 1.362 -1.966 -0.759 1.00 0.00 C ATOM 0 H TRP A 140 -2.575 -7.682 1.505 1.00 0.00 H new ATOM 0 HA TRP A 140 0.063 -6.518 1.464 1.00 0.00 H new ATOM 0 HB2 TRP A 140 -2.207 -5.333 3.104 1.00 0.00 H new ATOM 0 HB3 TRP A 140 -0.509 -4.977 3.346 1.00 0.00 H new ATOM 0 HD1 TRP A 140 -3.387 -3.354 1.942 1.00 0.00 H new ATOM 0 HE1 TRP A 140 -2.712 -1.429 0.356 1.00 0.00 H new ATOM 0 HE3 TRP A 140 1.393 -4.854 1.075 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 -0.333 -0.642 -0.999 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 2.866 -3.450 -0.360 1.00 0.00 H new ATOM 0 HH2 TRP A 140 2.017 -1.367 -1.374 1.00 0.00 H new ATOM 346 N HIS A 141 0.337 -7.753 3.779 1.00 0.00 N ATOM 347 CA HIS A 141 0.464 -8.257 5.125 1.00 0.00 C ATOM 348 C HIS A 141 0.306 -7.064 6.012 1.00 0.00 C ATOM 349 O HIS A 141 0.495 -5.927 5.581 1.00 0.00 O ATOM 350 CB HIS A 141 1.791 -8.951 5.489 1.00 0.00 C ATOM 351 CG HIS A 141 2.125 -10.106 4.596 1.00 0.00 C ATOM 352 ND1 HIS A 141 3.080 -10.066 3.613 1.00 0.00 N ATOM 353 CD2 HIS A 141 1.621 -11.361 4.617 1.00 0.00 C ATOM 354 CE1 HIS A 141 3.139 -11.269 3.056 1.00 0.00 C ATOM 355 NE2 HIS A 141 2.269 -12.073 3.649 1.00 0.00 N ATOM 0 H HIS A 141 1.230 -7.578 3.317 1.00 0.00 H new ATOM 0 HA HIS A 141 -0.286 -9.040 5.241 1.00 0.00 H new ATOM 0 HB2 HIS A 141 2.599 -8.221 5.443 1.00 0.00 H new ATOM 0 HB3 HIS A 141 1.738 -9.302 6.520 1.00 0.00 H new ATOM 0 HD2 HIS A 141 0.850 -11.731 5.276 1.00 0.00 H new ATOM 0 HE1 HIS A 141 3.795 -11.549 2.245 1.00 0.00 H new ATOM 0 HE2 HIS A 141 2.111 -13.055 3.422 1.00 0.00 H new ATOM 363 N LYS A 142 -0.128 -7.293 7.268 1.00 0.00 N ATOM 364 CA LYS A 142 -0.500 -6.239 8.176 1.00 0.00 C ATOM 365 C LYS A 142 0.654 -5.403 8.692 1.00 0.00 C ATOM 366 O LYS A 142 0.429 -4.473 9.464 1.00 0.00 O ATOM 367 CB LYS A 142 -1.326 -6.769 9.372 1.00 0.00 C ATOM 368 CG LYS A 142 -0.563 -7.745 10.286 1.00 0.00 C ATOM 369 CD LYS A 142 -1.418 -8.319 11.430 1.00 0.00 C ATOM 370 CE LYS A 142 -1.831 -7.276 12.478 1.00 0.00 C ATOM 371 NZ LYS A 142 -2.604 -7.906 13.575 1.00 0.00 N ATOM 0 H LYS A 142 -0.224 -8.228 7.664 1.00 0.00 H new ATOM 0 HA LYS A 142 -1.115 -5.578 7.565 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -1.666 -5.922 9.968 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -2.217 -7.268 8.991 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -0.179 -8.568 9.683 1.00 0.00 H new ATOM 0 HG3 LYS A 142 0.299 -7.232 10.711 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -2.315 -8.772 11.008 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -0.861 -9.115 11.923 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -0.943 -6.792 12.885 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -2.430 -6.498 12.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -2.872 -7.182 14.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -3.462 -8.347 13.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -2.021 -8.632 14.038 1.00 0.00 H new ATOM 385 N ASN A 143 1.909 -5.704 8.284 1.00 0.00 N ATOM 386 CA ASN A 143 3.052 -4.866 8.560 1.00 0.00 C ATOM 387 C ASN A 143 3.834 -4.787 7.268 1.00 0.00 C ATOM 388 O ASN A 143 5.034 -5.056 7.238 1.00 0.00 O ATOM 389 CB ASN A 143 3.914 -5.438 9.722 1.00 0.00 C ATOM 390 CG ASN A 143 4.967 -4.440 10.241 1.00 0.00 C ATOM 391 OD1 ASN A 143 5.042 -3.286 9.807 1.00 0.00 O ATOM 392 ND2 ASN A 143 5.801 -4.926 11.211 1.00 0.00 N ATOM 0 H ASN A 143 2.136 -6.544 7.753 1.00 0.00 H new ATOM 0 HA ASN A 143 2.743 -3.874 8.891 1.00 0.00 H new ATOM 0 HB2 ASN A 143 3.259 -5.727 10.544 1.00 0.00 H new ATOM 0 HB3 ASN A 143 4.417 -6.343 9.382 1.00 0.00 H new ATOM 0 HD21 ASN A 143 6.525 -4.327 11.608 1.00 0.00 H new ATOM 0 HD22 ASN A 143 5.699 -5.887 11.537 1.00 0.00 H new ATOM 399 N CYS A 144 3.151 -4.424 6.156 1.00 0.00 N ATOM 400 CA CYS A 144 3.761 -4.381 4.848 1.00 0.00 C ATOM 401 C CYS A 144 3.089 -3.318 4.003 1.00 0.00 C ATOM 402 O CYS A 144 3.101 -3.417 2.779 1.00 0.00 O ATOM 403 CB CYS A 144 3.603 -5.729 4.086 1.00 0.00 C ATOM 404 SG CYS A 144 4.775 -7.058 4.503 1.00 0.00 S ATOM 0 H CYS A 144 2.166 -4.158 6.163 1.00 0.00 H new ATOM 0 HA CYS A 144 4.819 -4.169 5.003 1.00 0.00 H new ATOM 0 HB2 CYS A 144 2.593 -6.101 4.261 1.00 0.00 H new ATOM 0 HB3 CYS A 144 3.687 -5.526 3.018 1.00 0.00 H new ATOM 409 N PHE A 145 2.485 -2.257 4.587 1.00 0.00 N ATOM 410 CA PHE A 145 1.722 -1.309 3.790 1.00 0.00 C ATOM 411 C PHE A 145 2.653 -0.247 3.254 1.00 0.00 C ATOM 412 O PHE A 145 2.901 0.743 3.936 1.00 0.00 O ATOM 413 CB PHE A 145 0.611 -0.573 4.598 1.00 0.00 C ATOM 414 CG PHE A 145 -0.669 -1.368 4.731 1.00 0.00 C ATOM 415 CD1 PHE A 145 -0.700 -2.661 5.288 1.00 0.00 C ATOM 416 CD2 PHE A 145 -1.889 -0.776 4.349 1.00 0.00 C ATOM 417 CE1 PHE A 145 -1.915 -3.336 5.460 1.00 0.00 C ATOM 418 CE2 PHE A 145 -3.102 -1.453 4.511 1.00 0.00 C ATOM 419 CZ PHE A 145 -3.116 -2.734 5.069 1.00 0.00 C ATOM 0 H PHE A 145 2.518 -2.051 5.585 1.00 0.00 H new ATOM 0 HA PHE A 145 1.247 -1.890 3.000 1.00 0.00 H new ATOM 0 HB2 PHE A 145 0.990 -0.342 5.593 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.390 0.377 4.112 1.00 0.00 H new ATOM 0 HD1 PHE A 145 0.223 -3.137 5.586 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -1.888 0.217 3.924 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -1.925 -4.324 5.896 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -4.027 -0.986 4.205 1.00 0.00 H new ATOM 0 HZ PHE A 145 -4.051 -3.258 5.198 1.00 0.00 H new ATOM 429 N ARG A 146 3.174 -0.397 2.004 1.00 0.00 N ATOM 430 CA ARG A 146 3.969 0.655 1.404 1.00 0.00 C ATOM 431 C ARG A 146 3.068 1.638 0.734 1.00 0.00 C ATOM 432 O ARG A 146 2.063 1.298 0.113 1.00 0.00 O ATOM 433 CB ARG A 146 5.031 0.263 0.345 1.00 0.00 C ATOM 434 CG ARG A 146 6.256 -0.435 0.939 1.00 0.00 C ATOM 435 CD ARG A 146 7.333 -0.711 -0.119 1.00 0.00 C ATOM 436 NE ARG A 146 8.555 -1.243 0.568 1.00 0.00 N ATOM 437 CZ ARG A 146 9.516 -1.974 -0.075 1.00 0.00 C ATOM 438 NH1 ARG A 146 9.428 -2.236 -1.412 1.00 0.00 N ATOM 439 NH2 ARG A 146 10.576 -2.457 0.637 1.00 0.00 N ATOM 0 H ARG A 146 3.049 -1.225 1.422 1.00 0.00 H new ATOM 0 HA ARG A 146 4.526 1.037 2.260 1.00 0.00 H new ATOM 0 HB2 ARG A 146 4.571 -0.394 -0.394 1.00 0.00 H new ATOM 0 HB3 ARG A 146 5.354 1.160 -0.183 1.00 0.00 H new ATOM 0 HG2 ARG A 146 6.677 0.184 1.731 1.00 0.00 H new ATOM 0 HG3 ARG A 146 5.950 -1.375 1.398 1.00 0.00 H new ATOM 0 HD2 ARG A 146 6.968 -1.431 -0.852 1.00 0.00 H new ATOM 0 HD3 ARG A 146 7.572 0.203 -0.662 1.00 0.00 H new ATOM 0 HE ARG A 146 8.675 -1.051 1.562 1.00 0.00 H new ATOM 0 HH11 ARG A 146 8.635 -1.885 -1.949 1.00 0.00 H new ATOM 0 HH12 ARG A 146 10.155 -2.783 -1.873 1.00 0.00 H new ATOM 0 HH21 ARG A 146 10.645 -2.272 1.638 1.00 0.00 H new ATOM 0 HH22 ARG A 146 11.299 -3.003 0.168 1.00 0.00 H new ATOM 453 N CYS A 147 3.496 2.906 0.846 1.00 0.00 N ATOM 454 CA CYS A 147 2.942 4.076 0.242 1.00 0.00 C ATOM 455 C CYS A 147 3.303 4.051 -1.225 1.00 0.00 C ATOM 456 O CYS A 147 4.392 3.617 -1.591 1.00 0.00 O ATOM 457 CB CYS A 147 3.553 5.305 0.934 1.00 0.00 C ATOM 458 SG CYS A 147 2.808 6.842 0.392 1.00 0.00 S ATOM 0 H CYS A 147 4.311 3.132 1.416 1.00 0.00 H new ATOM 0 HA CYS A 147 1.858 4.114 0.346 1.00 0.00 H new ATOM 0 HB2 CYS A 147 3.432 5.207 2.013 1.00 0.00 H new ATOM 0 HB3 CYS A 147 4.624 5.335 0.735 1.00 0.00 H new ATOM 463 N ALA A 148 2.371 4.467 -2.111 1.00 0.00 N ATOM 464 CA ALA A 148 2.594 4.437 -3.540 1.00 0.00 C ATOM 465 C ALA A 148 3.174 5.741 -4.024 1.00 0.00 C ATOM 466 O ALA A 148 3.632 5.829 -5.162 1.00 0.00 O ATOM 467 CB ALA A 148 1.301 4.158 -4.319 1.00 0.00 C ATOM 0 H ALA A 148 1.456 4.827 -1.840 1.00 0.00 H new ATOM 0 HA ALA A 148 3.298 3.626 -3.723 1.00 0.00 H new ATOM 0 HB1 ALA A 148 1.516 4.145 -5.388 1.00 0.00 H new ATOM 0 HB2 ALA A 148 0.896 3.192 -4.018 1.00 0.00 H new ATOM 0 HB3 ALA A 148 0.572 4.939 -4.105 1.00 0.00 H new ATOM 473 N LYS A 149 3.198 6.778 -3.153 1.00 0.00 N ATOM 474 CA LYS A 149 3.797 8.060 -3.436 1.00 0.00 C ATOM 475 C LYS A 149 5.231 7.970 -3.003 1.00 0.00 C ATOM 476 O LYS A 149 6.130 7.953 -3.843 1.00 0.00 O ATOM 477 CB LYS A 149 3.115 9.225 -2.669 1.00 0.00 C ATOM 478 CG LYS A 149 1.978 9.907 -3.451 1.00 0.00 C ATOM 479 CD LYS A 149 2.420 11.090 -4.332 1.00 0.00 C ATOM 480 CE LYS A 149 2.321 12.471 -3.655 1.00 0.00 C ATOM 481 NZ LYS A 149 3.238 12.612 -2.499 1.00 0.00 N ATOM 0 H LYS A 149 2.787 6.723 -2.221 1.00 0.00 H new ATOM 0 HA LYS A 149 3.687 8.275 -4.499 1.00 0.00 H new ATOM 0 HB2 LYS A 149 2.718 8.844 -1.728 1.00 0.00 H new ATOM 0 HB3 LYS A 149 3.868 9.972 -2.418 1.00 0.00 H new ATOM 0 HG2 LYS A 149 1.493 9.163 -4.083 1.00 0.00 H new ATOM 0 HG3 LYS A 149 1.229 10.260 -2.742 1.00 0.00 H new ATOM 0 HD2 LYS A 149 3.451 10.927 -4.644 1.00 0.00 H new ATOM 0 HD3 LYS A 149 1.811 11.099 -5.236 1.00 0.00 H new ATOM 0 HE2 LYS A 149 2.546 13.246 -4.387 1.00 0.00 H new ATOM 0 HE3 LYS A 149 1.296 12.634 -3.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 3.129 13.559 -2.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 3.009 11.892 -1.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 4.220 12.485 -2.817 1.00 0.00 H new ATOM 495 N CYS A 150 5.473 7.929 -1.671 1.00 0.00 N ATOM 496 CA CYS A 150 6.789 8.134 -1.120 1.00 0.00 C ATOM 497 C CYS A 150 7.531 6.833 -0.900 1.00 0.00 C ATOM 498 O CYS A 150 8.760 6.832 -0.859 1.00 0.00 O ATOM 499 CB CYS A 150 6.756 9.034 0.146 1.00 0.00 C ATOM 500 SG CYS A 150 6.004 8.332 1.655 1.00 0.00 S ATOM 0 H CYS A 150 4.752 7.753 -0.972 1.00 0.00 H new ATOM 0 HA CYS A 150 7.364 8.681 -1.868 1.00 0.00 H new ATOM 0 HB2 CYS A 150 7.781 9.321 0.382 1.00 0.00 H new ATOM 0 HB3 CYS A 150 6.218 9.949 -0.104 1.00 0.00 H new ATOM 505 N GLY A 151 6.808 5.690 -0.785 1.00 0.00 N ATOM 506 CA GLY A 151 7.413 4.374 -0.704 1.00 0.00 C ATOM 507 C GLY A 151 7.744 3.969 0.699 1.00 0.00 C ATOM 508 O GLY A 151 8.434 2.970 0.903 1.00 0.00 O ATOM 0 H GLY A 151 5.789 5.676 -0.747 1.00 0.00 H new ATOM 0 HA2 GLY A 151 6.734 3.640 -1.138 1.00 0.00 H new ATOM 0 HA3 GLY A 151 8.322 4.360 -1.305 1.00 0.00 H new ATOM 512 N LYS A 152 7.261 4.736 1.705 1.00 0.00 N ATOM 513 CA LYS A 152 7.511 4.478 3.103 1.00 0.00 C ATOM 514 C LYS A 152 6.678 3.303 3.535 1.00 0.00 C ATOM 515 O LYS A 152 5.469 3.283 3.312 1.00 0.00 O ATOM 516 CB LYS A 152 7.140 5.700 3.977 1.00 0.00 C ATOM 517 CG LYS A 152 7.416 5.537 5.480 1.00 0.00 C ATOM 518 CD LYS A 152 7.022 6.783 6.288 1.00 0.00 C ATOM 519 CE LYS A 152 7.222 6.598 7.798 1.00 0.00 C ATOM 520 NZ LYS A 152 6.805 7.810 8.540 1.00 0.00 N ATOM 0 H LYS A 152 6.680 5.559 1.543 1.00 0.00 H new ATOM 0 HA LYS A 152 8.574 4.272 3.231 1.00 0.00 H new ATOM 0 HB2 LYS A 152 7.692 6.567 3.614 1.00 0.00 H new ATOM 0 HB3 LYS A 152 6.081 5.917 3.840 1.00 0.00 H new ATOM 0 HG2 LYS A 152 6.865 4.675 5.856 1.00 0.00 H new ATOM 0 HG3 LYS A 152 8.475 5.329 5.631 1.00 0.00 H new ATOM 0 HD2 LYS A 152 7.614 7.633 5.949 1.00 0.00 H new ATOM 0 HD3 LYS A 152 5.977 7.023 6.091 1.00 0.00 H new ATOM 0 HE2 LYS A 152 6.645 5.740 8.143 1.00 0.00 H new ATOM 0 HE3 LYS A 152 8.270 6.382 8.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 6.950 7.660 9.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 7.373 8.622 8.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 5.799 8.000 8.358 1.00 0.00 H new ATOM 534 N SER A 153 7.330 2.292 4.162 1.00 0.00 N ATOM 535 CA SER A 153 6.669 1.110 4.659 1.00 0.00 C ATOM 536 C SER A 153 6.072 1.434 6.001 1.00 0.00 C ATOM 537 O SER A 153 6.706 2.062 6.847 1.00 0.00 O ATOM 538 CB SER A 153 7.582 -0.142 4.750 1.00 0.00 C ATOM 539 OG SER A 153 8.763 0.097 5.507 1.00 0.00 O ATOM 0 H SER A 153 8.337 2.297 4.327 1.00 0.00 H new ATOM 0 HA SER A 153 5.897 0.839 3.939 1.00 0.00 H new ATOM 0 HB2 SER A 153 7.024 -0.962 5.203 1.00 0.00 H new ATOM 0 HB3 SER A 153 7.857 -0.460 3.745 1.00 0.00 H new ATOM 0 HG SER A 153 9.303 -0.720 5.537 1.00 0.00 H new ATOM 545 N LEU A 154 4.797 1.032 6.175 1.00 0.00 N ATOM 546 CA LEU A 154 3.974 1.385 7.300 1.00 0.00 C ATOM 547 C LEU A 154 3.524 0.078 7.881 1.00 0.00 C ATOM 548 O LEU A 154 3.873 -0.990 7.375 1.00 0.00 O ATOM 549 CB LEU A 154 2.727 2.211 6.884 1.00 0.00 C ATOM 550 CG LEU A 154 3.043 3.429 5.977 1.00 0.00 C ATOM 551 CD1 LEU A 154 1.767 3.991 5.332 1.00 0.00 C ATOM 552 CD2 LEU A 154 3.834 4.538 6.693 1.00 0.00 C ATOM 0 H LEU A 154 4.316 0.434 5.503 1.00 0.00 H new ATOM 0 HA LEU A 154 4.535 2.003 8.001 1.00 0.00 H new ATOM 0 HB2 LEU A 154 2.029 1.556 6.363 1.00 0.00 H new ATOM 0 HB3 LEU A 154 2.222 2.564 7.784 1.00 0.00 H new ATOM 0 HG LEU A 154 3.694 3.052 5.188 1.00 0.00 H new ATOM 0 HD11 LEU A 154 2.023 4.844 4.703 1.00 0.00 H new ATOM 0 HD12 LEU A 154 1.296 3.219 4.723 1.00 0.00 H new ATOM 0 HD13 LEU A 154 1.075 4.310 6.112 1.00 0.00 H new ATOM 0 HD21 LEU A 154 4.020 5.358 5.999 1.00 0.00 H new ATOM 0 HD22 LEU A 154 3.258 4.905 7.543 1.00 0.00 H new ATOM 0 HD23 LEU A 154 4.785 4.138 7.045 1.00 0.00 H new ATOM 564 N GLU A 155 2.725 0.141 8.973 1.00 0.00 N ATOM 565 CA GLU A 155 2.222 -1.030 9.645 1.00 0.00 C ATOM 566 C GLU A 155 0.962 -1.454 8.934 1.00 0.00 C ATOM 567 O GLU A 155 1.040 -2.024 7.847 1.00 0.00 O ATOM 568 CB GLU A 155 2.014 -0.810 11.166 1.00 0.00 C ATOM 569 CG GLU A 155 1.775 -2.116 11.950 1.00 0.00 C ATOM 570 CD GLU A 155 1.623 -1.805 13.437 1.00 0.00 C ATOM 571 OE1 GLU A 155 0.646 -1.096 13.796 1.00 0.00 O ATOM 572 OE2 GLU A 155 2.479 -2.276 14.234 1.00 0.00 O ATOM 0 H GLU A 155 2.424 1.019 9.396 1.00 0.00 H new ATOM 0 HA GLU A 155 2.960 -1.831 9.594 1.00 0.00 H new ATOM 0 HB2 GLU A 155 2.889 -0.305 11.575 1.00 0.00 H new ATOM 0 HB3 GLU A 155 1.163 -0.145 11.316 1.00 0.00 H new ATOM 0 HG2 GLU A 155 0.879 -2.615 11.580 1.00 0.00 H new ATOM 0 HG3 GLU A 155 2.608 -2.802 11.796 1.00 0.00 H new ATOM 579 N SER A 156 -0.229 -1.185 9.520 1.00 0.00 N ATOM 580 CA SER A 156 -1.505 -1.570 8.969 1.00 0.00 C ATOM 581 C SER A 156 -2.023 -0.364 8.232 1.00 0.00 C ATOM 582 O SER A 156 -1.265 0.316 7.541 1.00 0.00 O ATOM 583 CB SER A 156 -2.508 -2.016 10.064 1.00 0.00 C ATOM 584 OG SER A 156 -1.992 -3.120 10.795 1.00 0.00 O ATOM 0 H SER A 156 -0.307 -0.684 10.405 1.00 0.00 H new ATOM 0 HA SER A 156 -1.388 -2.430 8.309 1.00 0.00 H new ATOM 0 HB2 SER A 156 -2.708 -1.186 10.741 1.00 0.00 H new ATOM 0 HB3 SER A 156 -3.458 -2.289 9.605 1.00 0.00 H new ATOM 0 HG SER A 156 -1.218 -3.492 10.323 1.00 0.00 H new ATOM 590 N THR A 157 -3.336 -0.063 8.371 1.00 0.00 N ATOM 591 CA THR A 157 -3.938 1.121 7.812 1.00 0.00 C ATOM 592 C THR A 157 -3.755 2.203 8.840 1.00 0.00 C ATOM 593 O THR A 157 -4.479 2.269 9.832 1.00 0.00 O ATOM 594 CB THR A 157 -5.411 0.957 7.478 1.00 0.00 C ATOM 595 OG1 THR A 157 -5.579 -0.120 6.565 1.00 0.00 O ATOM 596 CG2 THR A 157 -5.956 2.251 6.834 1.00 0.00 C ATOM 0 H THR A 157 -3.992 -0.654 8.882 1.00 0.00 H new ATOM 0 HA THR A 157 -3.458 1.355 6.862 1.00 0.00 H new ATOM 0 HB THR A 157 -5.958 0.751 8.398 1.00 0.00 H new ATOM 0 HG1 THR A 157 -4.726 -0.309 6.121 1.00 0.00 H new ATOM 0 HG21 THR A 157 -7.013 2.123 6.598 1.00 0.00 H new ATOM 0 HG22 THR A 157 -5.837 3.082 7.530 1.00 0.00 H new ATOM 0 HG23 THR A 157 -5.403 2.463 5.919 1.00 0.00 H new ATOM 604 N THR A 158 -2.742 3.068 8.609 1.00 0.00 N ATOM 605 CA THR A 158 -2.460 4.219 9.429 1.00 0.00 C ATOM 606 C THR A 158 -2.254 5.319 8.418 1.00 0.00 C ATOM 607 O THR A 158 -1.294 6.085 8.477 1.00 0.00 O ATOM 608 CB THR A 158 -1.234 4.034 10.323 1.00 0.00 C ATOM 609 OG1 THR A 158 -1.278 2.767 10.971 1.00 0.00 O ATOM 610 CG2 THR A 158 -1.164 5.134 11.405 1.00 0.00 C ATOM 0 H THR A 158 -2.097 2.964 7.826 1.00 0.00 H new ATOM 0 HA THR A 158 -3.263 4.425 10.137 1.00 0.00 H new ATOM 0 HB THR A 158 -0.353 4.097 9.684 1.00 0.00 H new ATOM 0 HG1 THR A 158 -0.486 2.662 11.538 1.00 0.00 H new ATOM 0 HG21 THR A 158 -0.282 4.978 12.026 1.00 0.00 H new ATOM 0 HG22 THR A 158 -1.102 6.111 10.927 1.00 0.00 H new ATOM 0 HG23 THR A 158 -2.058 5.090 12.027 1.00 0.00 H new ATOM 618 N LEU A 159 -3.174 5.394 7.427 1.00 0.00 N ATOM 619 CA LEU A 159 -3.061 6.327 6.340 1.00 0.00 C ATOM 620 C LEU A 159 -4.390 6.396 5.648 1.00 0.00 C ATOM 621 O LEU A 159 -5.328 5.687 6.006 1.00 0.00 O ATOM 622 CB LEU A 159 -1.958 5.986 5.297 1.00 0.00 C ATOM 623 CG LEU A 159 -2.132 4.715 4.420 1.00 0.00 C ATOM 624 CD1 LEU A 159 -1.131 4.761 3.251 1.00 0.00 C ATOM 625 CD2 LEU A 159 -2.013 3.383 5.181 1.00 0.00 C ATOM 0 H LEU A 159 -4.003 4.801 7.381 1.00 0.00 H new ATOM 0 HA LEU A 159 -2.764 7.281 6.775 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -1.861 6.840 4.627 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -1.013 5.892 5.833 1.00 0.00 H new ATOM 0 HG LEU A 159 -3.158 4.737 4.054 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.251 3.870 2.634 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.318 5.649 2.647 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.115 4.796 3.643 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -2.148 2.554 4.487 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -1.027 3.314 5.641 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -2.779 3.337 5.955 1.00 0.00 H new ATOM 637 N THR A 160 -4.478 7.274 4.618 1.00 0.00 N ATOM 638 CA THR A 160 -5.635 7.424 3.770 1.00 0.00 C ATOM 639 C THR A 160 -5.414 6.533 2.569 1.00 0.00 C ATOM 640 O THR A 160 -4.283 6.298 2.144 1.00 0.00 O ATOM 641 CB THR A 160 -5.893 8.883 3.383 1.00 0.00 C ATOM 642 OG1 THR A 160 -7.116 9.037 2.669 1.00 0.00 O ATOM 643 CG2 THR A 160 -4.725 9.483 2.567 1.00 0.00 C ATOM 0 H THR A 160 -3.715 7.902 4.367 1.00 0.00 H new ATOM 0 HA THR A 160 -6.538 7.124 4.302 1.00 0.00 H new ATOM 0 HB THR A 160 -5.972 9.434 4.320 1.00 0.00 H new ATOM 0 HG1 THR A 160 -7.245 9.981 2.442 1.00 0.00 H new ATOM 0 HG21 THR A 160 -4.952 10.519 2.315 1.00 0.00 H new ATOM 0 HG22 THR A 160 -3.811 9.446 3.159 1.00 0.00 H new ATOM 0 HG23 THR A 160 -4.588 8.908 1.651 1.00 0.00 H new ATOM 651 N GLU A 161 -6.522 5.991 2.015 1.00 0.00 N ATOM 652 CA GLU A 161 -6.485 5.136 0.860 1.00 0.00 C ATOM 653 C GLU A 161 -7.342 5.798 -0.169 1.00 0.00 C ATOM 654 O GLU A 161 -8.374 6.386 0.153 1.00 0.00 O ATOM 655 CB GLU A 161 -7.042 3.711 1.102 1.00 0.00 C ATOM 656 CG GLU A 161 -6.299 2.928 2.205 1.00 0.00 C ATOM 657 CD GLU A 161 -7.114 2.872 3.498 1.00 0.00 C ATOM 658 OE1 GLU A 161 -7.294 3.939 4.143 1.00 0.00 O ATOM 659 OE2 GLU A 161 -7.564 1.752 3.859 1.00 0.00 O ATOM 0 H GLU A 161 -7.462 6.150 2.377 1.00 0.00 H new ATOM 0 HA GLU A 161 -5.443 5.008 0.566 1.00 0.00 H new ATOM 0 HB2 GLU A 161 -8.096 3.784 1.369 1.00 0.00 H new ATOM 0 HB3 GLU A 161 -6.988 3.147 0.171 1.00 0.00 H new ATOM 0 HG2 GLU A 161 -6.094 1.915 1.859 1.00 0.00 H new ATOM 0 HG3 GLU A 161 -5.336 3.399 2.401 1.00 0.00 H new ATOM 666 N LYS A 162 -6.917 5.703 -1.448 1.00 0.00 N ATOM 667 CA LYS A 162 -7.704 6.119 -2.580 1.00 0.00 C ATOM 668 C LYS A 162 -7.843 4.887 -3.416 1.00 0.00 C ATOM 669 O LYS A 162 -6.985 4.006 -3.374 1.00 0.00 O ATOM 670 CB LYS A 162 -7.052 7.241 -3.419 1.00 0.00 C ATOM 671 CG LYS A 162 -6.975 8.575 -2.654 1.00 0.00 C ATOM 672 CD LYS A 162 -6.316 9.748 -3.408 1.00 0.00 C ATOM 673 CE LYS A 162 -7.135 10.356 -4.560 1.00 0.00 C ATOM 674 NZ LYS A 162 -7.098 9.523 -5.787 1.00 0.00 N ATOM 0 H LYS A 162 -6.004 5.328 -1.703 1.00 0.00 H new ATOM 0 HA LYS A 162 -8.651 6.537 -2.238 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -6.048 6.935 -3.713 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -7.623 7.384 -4.337 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -7.986 8.870 -2.375 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -6.425 8.409 -1.728 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -6.096 10.537 -2.689 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -5.362 9.406 -3.808 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -8.170 10.479 -4.240 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -6.751 11.350 -4.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -7.071 10.139 -6.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -6.250 8.921 -5.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -7.947 8.924 -5.825 1.00 0.00 H new ATOM 688 N GLU A 163 -8.957 4.796 -4.184 1.00 0.00 N ATOM 689 CA GLU A 163 -9.341 3.619 -4.931 1.00 0.00 C ATOM 690 C GLU A 163 -8.435 3.453 -6.121 1.00 0.00 C ATOM 691 O GLU A 163 -8.617 4.087 -7.159 1.00 0.00 O ATOM 692 CB GLU A 163 -10.819 3.657 -5.386 1.00 0.00 C ATOM 693 CG GLU A 163 -11.307 2.341 -6.023 1.00 0.00 C ATOM 694 CD GLU A 163 -12.784 2.463 -6.393 1.00 0.00 C ATOM 695 OE1 GLU A 163 -13.617 2.639 -5.463 1.00 0.00 O ATOM 696 OE2 GLU A 163 -13.101 2.379 -7.610 1.00 0.00 O ATOM 0 H GLU A 163 -9.615 5.569 -4.289 1.00 0.00 H new ATOM 0 HA GLU A 163 -9.238 2.764 -4.263 1.00 0.00 H new ATOM 0 HB2 GLU A 163 -11.448 3.889 -4.527 1.00 0.00 H new ATOM 0 HB3 GLU A 163 -10.948 4.467 -6.104 1.00 0.00 H new ATOM 0 HG2 GLU A 163 -10.717 2.116 -6.912 1.00 0.00 H new ATOM 0 HG3 GLU A 163 -11.164 1.514 -5.327 1.00 0.00 H new ATOM 703 N GLY A 164 -7.396 2.609 -5.945 1.00 0.00 N ATOM 704 CA GLY A 164 -6.351 2.441 -6.907 1.00 0.00 C ATOM 705 C GLY A 164 -5.130 2.090 -6.125 1.00 0.00 C ATOM 706 O GLY A 164 -4.612 0.979 -6.246 1.00 0.00 O ATOM 0 H GLY A 164 -7.283 2.031 -5.112 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -6.598 1.654 -7.619 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -6.198 3.355 -7.482 1.00 0.00 H new ATOM 710 N GLU A 165 -4.630 3.053 -5.311 1.00 0.00 N ATOM 711 CA GLU A 165 -3.375 2.905 -4.614 1.00 0.00 C ATOM 712 C GLU A 165 -3.476 3.694 -3.342 1.00 0.00 C ATOM 713 O GLU A 165 -4.216 4.673 -3.266 1.00 0.00 O ATOM 714 CB GLU A 165 -2.142 3.454 -5.378 1.00 0.00 C ATOM 715 CG GLU A 165 -1.949 2.892 -6.799 1.00 0.00 C ATOM 716 CD GLU A 165 -0.614 3.371 -7.370 1.00 0.00 C ATOM 717 OE1 GLU A 165 -0.448 4.608 -7.538 1.00 0.00 O ATOM 718 OE2 GLU A 165 0.258 2.504 -7.643 1.00 0.00 O ATOM 0 H GLU A 165 -5.100 3.941 -5.135 1.00 0.00 H new ATOM 0 HA GLU A 165 -3.220 1.835 -4.475 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -2.227 4.539 -5.442 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -1.247 3.238 -4.794 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -1.975 1.803 -6.775 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -2.767 3.216 -7.442 1.00 0.00 H new ATOM 725 N ILE A 166 -2.707 3.282 -2.305 1.00 0.00 N ATOM 726 CA ILE A 166 -2.693 3.933 -1.015 1.00 0.00 C ATOM 727 C ILE A 166 -1.602 4.973 -1.040 1.00 0.00 C ATOM 728 O ILE A 166 -0.607 4.803 -1.740 1.00 0.00 O ATOM 729 CB ILE A 166 -2.527 2.959 0.149 1.00 0.00 C ATOM 730 CG1 ILE A 166 -1.136 2.275 0.213 1.00 0.00 C ATOM 731 CG2 ILE A 166 -3.658 1.915 0.035 1.00 0.00 C ATOM 732 CD1 ILE A 166 -1.008 1.273 1.369 1.00 0.00 C ATOM 0 H ILE A 166 -2.081 2.479 -2.363 1.00 0.00 H new ATOM 0 HA ILE A 166 -3.662 4.402 -0.842 1.00 0.00 H new ATOM 0 HB ILE A 166 -2.592 3.521 1.081 1.00 0.00 H new ATOM 0 HG12 ILE A 166 -0.948 1.759 -0.729 1.00 0.00 H new ATOM 0 HG13 ILE A 166 -0.366 3.040 0.317 1.00 0.00 H new ATOM 0 HG21 ILE A 166 -3.575 1.198 0.852 1.00 0.00 H new ATOM 0 HG22 ILE A 166 -4.624 2.417 0.090 1.00 0.00 H new ATOM 0 HG23 ILE A 166 -3.575 1.392 -0.918 1.00 0.00 H new ATOM 0 HD11 ILE A 166 -0.012 0.830 1.358 1.00 0.00 H new ATOM 0 HD12 ILE A 166 -1.165 1.789 2.316 1.00 0.00 H new ATOM 0 HD13 ILE A 166 -1.756 0.488 1.255 1.00 0.00 H new ATOM 744 N TYR A 167 -1.785 6.101 -0.310 1.00 0.00 N ATOM 745 CA TYR A 167 -0.850 7.211 -0.344 1.00 0.00 C ATOM 746 C TYR A 167 -0.926 7.814 1.029 1.00 0.00 C ATOM 747 O TYR A 167 -2.021 7.868 1.583 1.00 0.00 O ATOM 748 CB TYR A 167 -1.247 8.356 -1.312 1.00 0.00 C ATOM 749 CG TYR A 167 -1.557 7.884 -2.708 1.00 0.00 C ATOM 750 CD1 TYR A 167 -0.535 7.460 -3.570 1.00 0.00 C ATOM 751 CD2 TYR A 167 -2.875 7.929 -3.196 1.00 0.00 C ATOM 752 CE1 TYR A 167 -0.808 7.151 -4.908 1.00 0.00 C ATOM 753 CE2 TYR A 167 -3.157 7.613 -4.529 1.00 0.00 C ATOM 754 CZ TYR A 167 -2.120 7.240 -5.393 1.00 0.00 C ATOM 755 OH TYR A 167 -2.402 6.947 -6.746 1.00 0.00 O ATOM 0 H TYR A 167 -2.583 6.249 0.308 1.00 0.00 H new ATOM 0 HA TYR A 167 0.119 6.828 -0.664 1.00 0.00 H new ATOM 0 HB2 TYR A 167 -2.118 8.874 -0.911 1.00 0.00 H new ATOM 0 HB3 TYR A 167 -0.435 9.082 -1.355 1.00 0.00 H new ATOM 0 HD1 TYR A 167 0.475 7.371 -3.197 1.00 0.00 H new ATOM 0 HD2 TYR A 167 -3.680 8.211 -2.533 1.00 0.00 H new ATOM 0 HE1 TYR A 167 -0.008 6.844 -5.566 1.00 0.00 H new ATOM 0 HE2 TYR A 167 -4.173 7.657 -4.892 1.00 0.00 H new ATOM 0 HH TYR A 167 -1.808 6.232 -7.056 1.00 0.00 H new ATOM 765 N CYS A 168 0.205 8.257 1.650 1.00 0.00 N ATOM 766 CA CYS A 168 0.190 8.460 3.082 1.00 0.00 C ATOM 767 C CYS A 168 0.064 9.905 3.450 1.00 0.00 C ATOM 768 O CYS A 168 0.229 10.802 2.627 1.00 0.00 O ATOM 769 CB CYS A 168 1.304 7.709 3.871 1.00 0.00 C ATOM 770 SG CYS A 168 2.992 8.383 3.824 1.00 0.00 S ATOM 0 H CYS A 168 1.089 8.465 1.185 1.00 0.00 H new ATOM 0 HA CYS A 168 -0.723 7.971 3.421 1.00 0.00 H new ATOM 0 HB2 CYS A 168 0.995 7.657 4.915 1.00 0.00 H new ATOM 0 HB3 CYS A 168 1.344 6.685 3.499 1.00 0.00 H new ATOM 775 N LYS A 169 -0.280 10.126 4.739 1.00 0.00 N ATOM 776 CA LYS A 169 -0.522 11.408 5.348 1.00 0.00 C ATOM 777 C LYS A 169 0.753 12.188 5.548 1.00 0.00 C ATOM 778 O LYS A 169 0.715 13.410 5.679 1.00 0.00 O ATOM 779 CB LYS A 169 -1.253 11.253 6.705 1.00 0.00 C ATOM 780 CG LYS A 169 -0.525 10.372 7.735 1.00 0.00 C ATOM 781 CD LYS A 169 -1.348 10.137 9.010 1.00 0.00 C ATOM 782 CE LYS A 169 -0.605 9.286 10.047 1.00 0.00 C ATOM 783 NZ LYS A 169 -1.449 9.044 11.241 1.00 0.00 N ATOM 0 H LYS A 169 -0.397 9.358 5.399 1.00 0.00 H new ATOM 0 HA LYS A 169 -1.159 11.964 4.660 1.00 0.00 H new ATOM 0 HB2 LYS A 169 -1.402 12.243 7.136 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -2.242 10.832 6.523 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -0.288 9.410 7.280 1.00 0.00 H new ATOM 0 HG3 LYS A 169 0.422 10.841 8.002 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -1.606 11.099 9.453 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -2.285 9.646 8.747 1.00 0.00 H new ATOM 0 HE2 LYS A 169 -0.317 8.334 9.602 1.00 0.00 H new ATOM 0 HE3 LYS A 169 0.315 9.790 10.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 -0.923 8.466 11.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -1.702 9.954 11.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 -2.315 8.542 10.958 1.00 0.00 H new ATOM 797 N GLY A 170 1.916 11.491 5.563 1.00 0.00 N ATOM 798 CA GLY A 170 3.209 12.082 5.802 1.00 0.00 C ATOM 799 C GLY A 170 3.710 12.790 4.580 1.00 0.00 C ATOM 800 O GLY A 170 4.338 13.841 4.687 1.00 0.00 O ATOM 0 H GLY A 170 1.957 10.484 5.404 1.00 0.00 H new ATOM 0 HA2 GLY A 170 3.144 12.785 6.633 1.00 0.00 H new ATOM 0 HA3 GLY A 170 3.918 11.308 6.095 1.00 0.00 H new ATOM 804 N CYS A 171 3.438 12.220 3.382 1.00 0.00 N ATOM 805 CA CYS A 171 3.847 12.791 2.120 1.00 0.00 C ATOM 806 C CYS A 171 2.782 13.708 1.580 1.00 0.00 C ATOM 807 O CYS A 171 3.047 14.464 0.649 1.00 0.00 O ATOM 808 CB CYS A 171 4.201 11.719 1.062 1.00 0.00 C ATOM 809 SG CYS A 171 2.938 10.477 0.770 1.00 0.00 S ATOM 0 H CYS A 171 2.923 11.344 3.286 1.00 0.00 H new ATOM 0 HA CYS A 171 4.754 13.361 2.321 1.00 0.00 H new ATOM 0 HB2 CYS A 171 4.417 12.221 0.119 1.00 0.00 H new ATOM 0 HB3 CYS A 171 5.117 11.215 1.372 1.00 0.00 H new ATOM 0 HG CYS A 171 3.339 9.332 1.237 1.00 0.00 H new ATOM 814 N TYR A 172 1.561 13.680 2.167 1.00 0.00 N ATOM 815 CA TYR A 172 0.496 14.606 1.843 1.00 0.00 C ATOM 816 C TYR A 172 0.633 15.837 2.702 1.00 0.00 C ATOM 817 O TYR A 172 0.043 16.872 2.396 1.00 0.00 O ATOM 818 CB TYR A 172 -0.916 14.003 2.071 1.00 0.00 C ATOM 819 CG TYR A 172 -1.424 13.142 0.932 1.00 0.00 C ATOM 820 CD1 TYR A 172 -0.658 12.752 -0.190 1.00 0.00 C ATOM 821 CD2 TYR A 172 -2.777 12.761 0.977 1.00 0.00 C ATOM 822 CE1 TYR A 172 -1.249 12.053 -1.251 1.00 0.00 C ATOM 823 CE2 TYR A 172 -3.369 12.060 -0.080 1.00 0.00 C ATOM 824 CZ TYR A 172 -2.608 11.723 -1.205 1.00 0.00 C ATOM 825 OH TYR A 172 -3.216 11.070 -2.298 1.00 0.00 O ATOM 0 H TYR A 172 1.305 13.000 2.883 1.00 0.00 H new ATOM 0 HA TYR A 172 0.590 14.844 0.783 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -0.899 13.405 2.982 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -1.622 14.817 2.237 1.00 0.00 H new ATOM 0 HD1 TYR A 172 0.393 12.995 -0.230 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -3.370 13.014 1.843 1.00 0.00 H new ATOM 0 HE1 TYR A 172 -0.654 11.768 -2.106 1.00 0.00 H new ATOM 0 HE2 TYR A 172 -4.411 11.780 -0.027 1.00 0.00 H new ATOM 0 HH TYR A 172 -2.799 10.193 -2.428 1.00 0.00 H new ATOM 835 N ALA A 173 1.448 15.765 3.783 1.00 0.00 N ATOM 836 CA ALA A 173 1.787 16.904 4.603 1.00 0.00 C ATOM 837 C ALA A 173 2.835 17.729 3.900 1.00 0.00 C ATOM 838 O ALA A 173 2.848 18.954 4.015 1.00 0.00 O ATOM 839 CB ALA A 173 2.348 16.489 5.976 1.00 0.00 C ATOM 0 H ALA A 173 1.881 14.896 4.095 1.00 0.00 H new ATOM 0 HA ALA A 173 0.870 17.472 4.762 1.00 0.00 H new ATOM 0 HB1 ALA A 173 2.588 17.380 6.556 1.00 0.00 H new ATOM 0 HB2 ALA A 173 1.603 15.899 6.510 1.00 0.00 H new ATOM 0 HB3 ALA A 173 3.250 15.894 5.836 1.00 0.00 H new ATOM 845 N LYS A 174 3.728 17.055 3.135 1.00 0.00 N ATOM 846 CA LYS A 174 4.805 17.677 2.405 1.00 0.00 C ATOM 847 C LYS A 174 4.279 18.246 1.112 1.00 0.00 C ATOM 848 O LYS A 174 4.506 19.417 0.810 1.00 0.00 O ATOM 849 CB LYS A 174 5.915 16.657 2.058 1.00 0.00 C ATOM 850 CG LYS A 174 6.648 16.119 3.299 1.00 0.00 C ATOM 851 CD LYS A 174 7.592 14.941 3.003 1.00 0.00 C ATOM 852 CE LYS A 174 8.781 15.304 2.103 1.00 0.00 C ATOM 853 NZ LYS A 174 9.668 14.134 1.901 1.00 0.00 N ATOM 0 H LYS A 174 3.699 16.042 3.021 1.00 0.00 H new ATOM 0 HA LYS A 174 5.221 18.461 3.038 1.00 0.00 H new ATOM 0 HB2 LYS A 174 5.475 15.822 1.512 1.00 0.00 H new ATOM 0 HB3 LYS A 174 6.638 17.128 1.392 1.00 0.00 H new ATOM 0 HG2 LYS A 174 7.223 16.929 3.749 1.00 0.00 H new ATOM 0 HG3 LYS A 174 5.910 15.804 4.037 1.00 0.00 H new ATOM 0 HD2 LYS A 174 7.971 14.546 3.946 1.00 0.00 H new ATOM 0 HD3 LYS A 174 7.022 14.142 2.529 1.00 0.00 H new ATOM 0 HE2 LYS A 174 8.417 15.660 1.139 1.00 0.00 H new ATOM 0 HE3 LYS A 174 9.346 16.121 2.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 10.465 14.404 1.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 10.031 13.811 2.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 9.131 13.365 1.451 1.00 0.00 H new ATOM 867 N ASN A 175 3.555 17.414 0.328 1.00 0.00 N ATOM 868 CA ASN A 175 3.048 17.771 -0.975 1.00 0.00 C ATOM 869 C ASN A 175 1.687 18.456 -0.779 1.00 0.00 C ATOM 870 O ASN A 175 0.721 17.769 -0.356 1.00 0.00 O ATOM 871 CB ASN A 175 2.899 16.524 -1.890 1.00 0.00 C ATOM 872 CG ASN A 175 2.512 16.912 -3.326 1.00 0.00 C ATOM 873 OD1 ASN A 175 3.238 17.661 -3.991 1.00 0.00 O ATOM 874 ND2 ASN A 175 1.344 16.380 -3.801 1.00 0.00 N ATOM 0 H ASN A 175 3.314 16.463 0.608 1.00 0.00 H new ATOM 0 HA ASN A 175 3.750 18.444 -1.467 1.00 0.00 H new ATOM 0 HB2 ASN A 175 3.837 15.969 -1.904 1.00 0.00 H new ATOM 0 HB3 ASN A 175 2.141 15.858 -1.477 1.00 0.00 H new ATOM 0 HD21 ASN A 175 1.033 16.596 -4.748 1.00 0.00 H new ATOM 0 HD22 ASN A 175 0.784 15.767 -3.208 1.00 0.00 H new TER 881 ASN A 175 HETATM 882 ZN ZN A 195 4.581 -8.327 2.794 1.00 0.00 ZN HETATM 883 ZN ZN A 196 3.378 8.823 1.401 1.00 0.00 ZN