USER MOD reduce.3.24.130724 H: found=0, std=0, add=253, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 243 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 8 CYS SG : rot -44:sc= -31.1! USER MOD Set 1.2: A 26 CYS SG : rot -63:sc= -16.9! USER MOD Single : A 1 THR N :NH3+ -144:sc= 0.0304 (180deg=-0.983) USER MOD Single : A 1 THR OG1 : rot 117:sc= 0.111 USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 9 GLN : amide:sc= -0.459 X(o=-0.46,f=-0.0061) USER MOD Single : A 11 SER OG : rot 59:sc= 0.911 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 136:sc= -2.48! (180deg=-5.1!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 HIS : no HD1:sc= -1.04 K(o=-1,f=-1.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -1.933 -1.064 -10.987 1.00 1.00 N ATOM 2 CA THR A 1 -2.705 -0.912 -9.766 1.00 1.00 C ATOM 3 C THR A 1 -1.774 -0.766 -8.560 1.00 1.00 C ATOM 4 O THR A 1 -0.650 -1.269 -8.576 1.00 1.00 O ATOM 5 CB THR A 1 -3.657 -2.105 -9.658 1.00 1.00 C ATOM 6 OG1 THR A 1 -2.797 -3.241 -9.688 1.00 1.00 O ATOM 7 CG2 THR A 1 -4.533 -2.270 -10.900 1.00 1.00 C ATOM 0 H1 THR A 1 -2.419 -0.578 -11.768 1.00 1.00 H new ATOM 0 H2 THR A 1 -0.989 -0.648 -10.855 1.00 1.00 H new ATOM 0 H3 THR A 1 -1.838 -2.074 -11.214 1.00 1.00 H new ATOM 0 HA THR A 1 -3.303 -0.001 -9.787 1.00 1.00 H new ATOM 0 HB THR A 1 -4.291 -1.983 -8.780 1.00 1.00 H new ATOM 0 HG1 THR A 1 -2.869 -3.728 -8.841 1.00 1.00 H new ATOM 0 HG21 THR A 1 -5.189 -3.131 -10.771 1.00 1.00 H new ATOM 0 HG22 THR A 1 -5.135 -1.373 -11.042 1.00 1.00 H new ATOM 0 HG23 THR A 1 -3.900 -2.425 -11.774 1.00 1.00 H new ATOM 15 N VAL A 2 -2.273 -0.079 -7.546 1.00 1.00 N ATOM 16 CA VAL A 2 -1.501 0.137 -6.334 1.00 1.00 C ATOM 17 C VAL A 2 -1.930 -0.871 -5.270 1.00 1.00 C ATOM 18 O VAL A 2 -1.359 -0.915 -4.183 1.00 1.00 O ATOM 19 CB VAL A 2 -1.648 1.588 -5.875 1.00 1.00 C ATOM 20 CG1 VAL A 2 -0.790 1.858 -4.636 1.00 1.00 C ATOM 21 CG2 VAL A 2 -1.301 2.559 -7.005 1.00 1.00 C ATOM 0 H VAL A 2 -3.204 0.337 -7.537 1.00 1.00 H new ATOM 0 HA VAL A 2 -0.440 -0.027 -6.524 1.00 1.00 H new ATOM 0 HB VAL A 2 -2.691 1.751 -5.604 1.00 1.00 H new ATOM 0 HG11 VAL A 2 -0.911 2.897 -4.329 1.00 1.00 H new ATOM 0 HG12 VAL A 2 -1.104 1.201 -3.825 1.00 1.00 H new ATOM 0 HG13 VAL A 2 0.258 1.669 -4.871 1.00 1.00 H new ATOM 0 HG21 VAL A 2 -1.414 3.584 -6.652 1.00 1.00 H new ATOM 0 HG22 VAL A 2 -0.271 2.396 -7.322 1.00 1.00 H new ATOM 0 HG23 VAL A 2 -1.971 2.390 -7.848 1.00 1.00 H new ATOM 31 N CYS A 3 -2.937 -1.658 -5.621 1.00 1.00 N ATOM 32 CA CYS A 3 -3.452 -2.667 -4.710 1.00 1.00 C ATOM 33 C CYS A 3 -3.673 -3.958 -5.498 1.00 1.00 C ATOM 34 O CYS A 3 -3.730 -3.939 -6.726 1.00 1.00 O ATOM 35 CB CYS A 3 -4.731 -2.198 -4.012 1.00 1.00 C ATOM 36 SG CYS A 3 -6.048 -3.463 -3.889 1.00 1.00 S ATOM 0 H CYS A 3 -3.410 -1.617 -6.524 1.00 1.00 H new ATOM 0 HA CYS A 3 -2.728 -2.847 -3.916 1.00 1.00 H new ATOM 0 HB2 CYS A 3 -4.477 -1.860 -3.007 1.00 1.00 H new ATOM 0 HB3 CYS A 3 -5.125 -1.335 -4.548 1.00 1.00 H new ATOM 41 N ASN A 4 -3.793 -5.052 -4.758 1.00 1.00 N ATOM 42 CA ASN A 4 -4.005 -6.352 -5.372 1.00 1.00 C ATOM 43 C ASN A 4 -5.447 -6.442 -5.880 1.00 1.00 C ATOM 44 O ASN A 4 -6.389 -6.186 -5.131 1.00 1.00 O ATOM 45 CB ASN A 4 -3.789 -7.480 -4.362 1.00 1.00 C ATOM 46 CG ASN A 4 -2.317 -7.898 -4.318 1.00 1.00 C ATOM 47 OD1 ASN A 4 -1.413 -7.080 -4.316 1.00 1.00 O ATOM 48 ND2 ASN A 4 -2.130 -9.213 -4.275 1.00 1.00 N ATOM 0 H ASN A 4 -3.747 -5.064 -3.739 1.00 1.00 H new ATOM 0 HA ASN A 4 -3.292 -6.459 -6.190 1.00 1.00 H new ATOM 0 HB2 ASN A 4 -4.108 -7.154 -3.372 1.00 1.00 H new ATOM 0 HB3 ASN A 4 -4.407 -8.337 -4.630 1.00 1.00 H new ATOM 0 HD21 ASN A 4 -1.184 -9.593 -4.237 1.00 1.00 H new ATOM 0 HD22 ASN A 4 -2.932 -9.843 -4.280 1.00 1.00 H new ATOM 55 N LEU A 5 -5.572 -6.803 -7.148 1.00 1.00 N ATOM 56 CA LEU A 5 -6.883 -6.929 -7.763 1.00 1.00 C ATOM 57 C LEU A 5 -7.595 -8.155 -7.188 1.00 1.00 C ATOM 58 O LEU A 5 -8.642 -8.029 -6.554 1.00 1.00 O ATOM 59 CB LEU A 5 -6.758 -6.948 -9.287 1.00 1.00 C ATOM 60 CG LEU A 5 -8.068 -7.104 -10.065 1.00 1.00 C ATOM 61 CD1 LEU A 5 -8.048 -6.261 -11.343 1.00 1.00 C ATOM 62 CD2 LEU A 5 -8.362 -8.578 -10.354 1.00 1.00 C ATOM 0 H LEU A 5 -4.788 -7.012 -7.766 1.00 1.00 H new ATOM 0 HA LEU A 5 -7.501 -6.062 -7.527 1.00 1.00 H new ATOM 0 HB2 LEU A 5 -6.278 -6.022 -9.604 1.00 1.00 H new ATOM 0 HB3 LEU A 5 -6.092 -7.764 -9.567 1.00 1.00 H new ATOM 0 HG LEU A 5 -8.882 -6.730 -9.444 1.00 1.00 H new ATOM 0 HD11 LEU A 5 -8.989 -6.389 -11.878 1.00 1.00 H new ATOM 0 HD12 LEU A 5 -7.918 -5.210 -11.084 1.00 1.00 H new ATOM 0 HD13 LEU A 5 -7.223 -6.583 -11.978 1.00 1.00 H new ATOM 0 HD21 LEU A 5 -9.297 -8.661 -10.907 1.00 1.00 H new ATOM 0 HD22 LEU A 5 -7.551 -9.001 -10.947 1.00 1.00 H new ATOM 0 HD23 LEU A 5 -8.447 -9.123 -9.414 1.00 1.00 H new ATOM 74 N ARG A 6 -6.999 -9.315 -7.430 1.00 1.00 N ATOM 75 CA ARG A 6 -7.565 -10.562 -6.946 1.00 1.00 C ATOM 76 C ARG A 6 -7.908 -10.445 -5.458 1.00 1.00 C ATOM 77 O ARG A 6 -8.952 -10.926 -5.019 1.00 1.00 O ATOM 78 CB ARG A 6 -6.590 -11.722 -7.145 1.00 1.00 C ATOM 79 CG ARG A 6 -6.719 -12.310 -8.553 1.00 1.00 C ATOM 80 CD ARG A 6 -5.535 -11.900 -9.430 1.00 1.00 C ATOM 81 NE ARG A 6 -5.712 -12.430 -10.801 1.00 1.00 N ATOM 82 CZ ARG A 6 -5.322 -13.661 -11.192 1.00 1.00 C ATOM 83 NH1 ARG A 6 -4.725 -14.501 -10.320 1.00 1.00 N ATOM 84 NH2 ARG A 6 -5.529 -14.031 -12.441 1.00 1.00 N ATOM 0 H ARG A 6 -6.130 -9.416 -7.955 1.00 1.00 H new ATOM 0 HA ARG A 6 -8.471 -10.760 -7.519 1.00 1.00 H new ATOM 0 HB2 ARG A 6 -5.569 -11.376 -6.983 1.00 1.00 H new ATOM 0 HB3 ARG A 6 -6.785 -12.497 -6.404 1.00 1.00 H new ATOM 0 HG2 ARG A 6 -6.772 -13.397 -8.493 1.00 1.00 H new ATOM 0 HG3 ARG A 6 -7.649 -11.970 -9.009 1.00 1.00 H new ATOM 0 HD2 ARG A 6 -5.453 -10.814 -9.459 1.00 1.00 H new ATOM 0 HD3 ARG A 6 -4.607 -12.279 -9.002 1.00 1.00 H new ATOM 0 HE ARG A 6 -6.157 -11.827 -11.493 1.00 1.00 H new ATOM 0 HH11 ARG A 6 -4.565 -14.207 -9.356 1.00 1.00 H new ATOM 0 HH12 ARG A 6 -4.434 -15.430 -10.625 1.00 1.00 H new ATOM 0 HH21 ARG A 6 -5.978 -13.390 -13.095 1.00 1.00 H new ATOM 0 HH22 ARG A 6 -5.240 -14.958 -12.753 1.00 1.00 H new ATOM 97 N ARG A 7 -7.009 -9.804 -4.724 1.00 1.00 N ATOM 98 CA ARG A 7 -7.205 -9.620 -3.296 1.00 1.00 C ATOM 99 C ARG A 7 -8.528 -8.895 -3.032 1.00 1.00 C ATOM 100 O ARG A 7 -9.390 -9.412 -2.320 1.00 1.00 O ATOM 101 CB ARG A 7 -6.058 -8.812 -2.685 1.00 1.00 C ATOM 102 CG ARG A 7 -6.164 -8.785 -1.157 1.00 1.00 C ATOM 103 CD ARG A 7 -4.862 -8.283 -0.529 1.00 1.00 C ATOM 104 NE ARG A 7 -4.641 -8.951 0.770 1.00 1.00 N ATOM 105 CZ ARG A 7 -5.140 -8.507 1.943 1.00 1.00 C ATOM 106 NH1 ARG A 7 -5.896 -7.389 1.987 1.00 1.00 N ATOM 107 NH2 ARG A 7 -4.878 -9.181 3.047 1.00 1.00 N ATOM 0 H ARG A 7 -6.144 -9.406 -5.091 1.00 1.00 H new ATOM 0 HA ARG A 7 -7.228 -10.606 -2.832 1.00 1.00 H new ATOM 0 HB2 ARG A 7 -5.103 -9.247 -2.980 1.00 1.00 H new ATOM 0 HB3 ARG A 7 -6.078 -7.794 -3.073 1.00 1.00 H new ATOM 0 HG2 ARG A 7 -6.990 -8.140 -0.857 1.00 1.00 H new ATOM 0 HG3 ARG A 7 -6.390 -9.785 -0.786 1.00 1.00 H new ATOM 0 HD2 ARG A 7 -4.025 -8.483 -1.198 1.00 1.00 H new ATOM 0 HD3 ARG A 7 -4.908 -7.203 -0.389 1.00 1.00 H new ATOM 0 HE ARG A 7 -4.076 -9.800 0.781 1.00 1.00 H new ATOM 0 HH11 ARG A 7 -6.094 -6.873 1.130 1.00 1.00 H new ATOM 0 HH12 ARG A 7 -6.269 -7.060 2.878 1.00 1.00 H new ATOM 0 HH21 ARG A 7 -4.306 -10.024 3.006 1.00 1.00 H new ATOM 0 HH22 ARG A 7 -5.248 -8.859 3.941 1.00 1.00 H new ATOM 120 N CYS A 8 -8.646 -7.713 -3.615 1.00 1.00 N ATOM 121 CA CYS A 8 -9.848 -6.914 -3.451 1.00 1.00 C ATOM 122 C CYS A 8 -11.029 -7.698 -4.026 1.00 1.00 C ATOM 123 O CYS A 8 -12.135 -7.644 -3.489 1.00 1.00 O ATOM 124 CB CYS A 8 -9.705 -5.537 -4.105 1.00 1.00 C ATOM 125 SG CYS A 8 -9.310 -4.176 -2.948 1.00 1.00 S ATOM 0 H CYS A 8 -7.929 -7.288 -4.202 1.00 1.00 H new ATOM 0 HA CYS A 8 -10.020 -6.725 -2.391 1.00 1.00 H new ATOM 0 HB2 CYS A 8 -8.923 -5.590 -4.863 1.00 1.00 H new ATOM 0 HB3 CYS A 8 -10.634 -5.298 -4.622 1.00 1.00 H new ATOM 0 HG CYS A 8 -10.044 -4.287 -1.881 1.00 1.00 H new ATOM 130 N GLN A 9 -10.755 -8.411 -5.108 1.00 1.00 N ATOM 131 CA GLN A 9 -11.781 -9.206 -5.761 1.00 1.00 C ATOM 132 C GLN A 9 -12.264 -10.318 -4.829 1.00 1.00 C ATOM 133 O GLN A 9 -13.411 -10.303 -4.382 1.00 1.00 O ATOM 134 CB GLN A 9 -11.269 -9.784 -7.083 1.00 1.00 C ATOM 135 CG GLN A 9 -12.120 -9.300 -8.259 1.00 1.00 C ATOM 136 CD GLN A 9 -12.189 -10.361 -9.359 1.00 1.00 C ATOM 137 OE1 GLN A 9 -12.745 -11.432 -9.191 1.00 1.00 O ATOM 138 NE2 GLN A 9 -11.591 -10.004 -10.493 1.00 1.00 N ATOM 0 H GLN A 9 -9.836 -8.455 -5.549 1.00 1.00 H new ATOM 0 HA GLN A 9 -12.626 -8.556 -5.989 1.00 1.00 H new ATOM 0 HB2 GLN A 9 -10.231 -9.489 -7.235 1.00 1.00 H new ATOM 0 HB3 GLN A 9 -11.288 -10.873 -7.040 1.00 1.00 H new ATOM 0 HG2 GLN A 9 -13.126 -9.065 -7.912 1.00 1.00 H new ATOM 0 HG3 GLN A 9 -11.699 -8.379 -8.663 1.00 1.00 H new ATOM 0 HE21 GLN A 9 -11.143 -9.091 -10.568 1.00 1.00 H new ATOM 0 HE22 GLN A 9 -11.581 -10.644 -11.287 1.00 1.00 H new ATOM 147 N LEU A 10 -11.368 -11.253 -4.559 1.00 1.00 N ATOM 148 CA LEU A 10 -11.688 -12.370 -3.686 1.00 1.00 C ATOM 149 C LEU A 10 -12.393 -11.846 -2.432 1.00 1.00 C ATOM 150 O LEU A 10 -13.256 -12.521 -1.874 1.00 1.00 O ATOM 151 CB LEU A 10 -10.434 -13.196 -3.387 1.00 1.00 C ATOM 152 CG LEU A 10 -9.359 -12.501 -2.547 1.00 1.00 C ATOM 153 CD1 LEU A 10 -9.793 -12.392 -1.084 1.00 1.00 C ATOM 154 CD2 LEU A 10 -8.009 -13.204 -2.695 1.00 1.00 C ATOM 0 H LEU A 10 -10.418 -11.261 -4.930 1.00 1.00 H new ATOM 0 HA LEU A 10 -12.379 -13.053 -4.180 1.00 1.00 H new ATOM 0 HB2 LEU A 10 -10.737 -14.107 -2.872 1.00 1.00 H new ATOM 0 HB3 LEU A 10 -9.988 -13.499 -4.334 1.00 1.00 H new ATOM 0 HG LEU A 10 -9.235 -11.485 -2.922 1.00 1.00 H new ATOM 0 HD11 LEU A 10 -9.012 -11.895 -0.509 1.00 1.00 H new ATOM 0 HD12 LEU A 10 -10.715 -11.814 -1.020 1.00 1.00 H new ATOM 0 HD13 LEU A 10 -9.962 -13.390 -0.679 1.00 1.00 H new ATOM 0 HD21 LEU A 10 -7.263 -12.691 -2.088 1.00 1.00 H new ATOM 0 HD22 LEU A 10 -8.099 -14.238 -2.362 1.00 1.00 H new ATOM 0 HD23 LEU A 10 -7.702 -13.185 -3.741 1.00 1.00 H new ATOM 166 N SER A 11 -11.999 -10.648 -2.029 1.00 1.00 N ATOM 167 CA SER A 11 -12.582 -10.025 -0.851 1.00 1.00 C ATOM 168 C SER A 11 -14.075 -9.781 -1.075 1.00 1.00 C ATOM 169 O SER A 11 -14.899 -10.133 -0.232 1.00 1.00 O ATOM 170 CB SER A 11 -11.874 -8.712 -0.516 1.00 1.00 C ATOM 171 OG SER A 11 -10.486 -8.905 -0.253 1.00 1.00 O ATOM 0 H SER A 11 -11.283 -10.091 -2.496 1.00 1.00 H new ATOM 0 HA SER A 11 -12.453 -10.701 -0.006 1.00 1.00 H new ATOM 0 HB2 SER A 11 -11.992 -8.015 -1.345 1.00 1.00 H new ATOM 0 HB3 SER A 11 -12.348 -8.256 0.354 1.00 1.00 H new ATOM 0 HG SER A 11 -10.059 -9.314 -1.034 1.00 1.00 H new ATOM 177 N CYS A 12 -14.381 -9.179 -2.216 1.00 1.00 N ATOM 178 CA CYS A 12 -15.760 -8.885 -2.560 1.00 1.00 C ATOM 179 C CYS A 12 -16.480 -10.205 -2.836 1.00 1.00 C ATOM 180 O CYS A 12 -17.663 -10.347 -2.532 1.00 1.00 O ATOM 181 CB CYS A 12 -15.855 -7.924 -3.749 1.00 1.00 C ATOM 182 SG CYS A 12 -15.112 -6.276 -3.463 1.00 1.00 S ATOM 0 H CYS A 12 -13.696 -8.887 -2.913 1.00 1.00 H new ATOM 0 HA CYS A 12 -16.243 -8.377 -1.726 1.00 1.00 H new ATOM 0 HB2 CYS A 12 -15.367 -8.383 -4.609 1.00 1.00 H new ATOM 0 HB3 CYS A 12 -16.905 -7.793 -4.010 1.00 1.00 H new ATOM 187 N ARG A 13 -15.736 -11.139 -3.410 1.00 1.00 N ATOM 188 CA ARG A 13 -16.287 -12.444 -3.731 1.00 1.00 C ATOM 189 C ARG A 13 -16.918 -13.075 -2.488 1.00 1.00 C ATOM 190 O ARG A 13 -17.737 -13.986 -2.597 1.00 1.00 O ATOM 191 CB ARG A 13 -15.207 -13.381 -4.275 1.00 1.00 C ATOM 192 CG ARG A 13 -15.829 -14.541 -5.056 1.00 1.00 C ATOM 193 CD ARG A 13 -14.844 -15.099 -6.086 1.00 1.00 C ATOM 194 NE ARG A 13 -15.188 -14.601 -7.436 1.00 1.00 N ATOM 195 CZ ARG A 13 -16.054 -15.212 -8.271 1.00 1.00 C ATOM 196 NH1 ARG A 13 -16.676 -16.351 -7.899 1.00 1.00 N ATOM 197 NH2 ARG A 13 -16.287 -14.678 -9.457 1.00 1.00 N ATOM 0 H ARG A 13 -14.755 -11.017 -3.661 1.00 1.00 H new ATOM 0 HA ARG A 13 -17.048 -12.301 -4.498 1.00 1.00 H new ATOM 0 HB2 ARG A 13 -14.530 -12.824 -4.922 1.00 1.00 H new ATOM 0 HB3 ARG A 13 -14.611 -13.772 -3.451 1.00 1.00 H new ATOM 0 HG2 ARG A 13 -16.126 -15.331 -4.366 1.00 1.00 H new ATOM 0 HG3 ARG A 13 -16.734 -14.201 -5.560 1.00 1.00 H new ATOM 0 HD2 ARG A 13 -13.828 -14.802 -5.828 1.00 1.00 H new ATOM 0 HD3 ARG A 13 -14.870 -16.189 -6.074 1.00 1.00 H new ATOM 0 HE ARG A 13 -14.742 -13.741 -7.756 1.00 1.00 H new ATOM 0 HH11 ARG A 13 -16.493 -16.756 -6.981 1.00 1.00 H new ATOM 0 HH12 ARG A 13 -17.329 -16.807 -8.536 1.00 1.00 H new ATOM 0 HH21 ARG A 13 -15.815 -13.816 -9.730 1.00 1.00 H new ATOM 0 HH22 ARG A 13 -16.939 -15.128 -10.100 1.00 1.00 H new ATOM 210 N SER A 14 -16.515 -12.562 -1.335 1.00 1.00 N ATOM 211 CA SER A 14 -17.031 -13.062 -0.071 1.00 1.00 C ATOM 212 C SER A 14 -18.560 -13.060 -0.095 1.00 1.00 C ATOM 213 O SER A 14 -19.192 -14.022 0.336 1.00 1.00 O ATOM 214 CB SER A 14 -16.515 -12.230 1.098 1.00 1.00 C ATOM 215 OG SER A 14 -17.183 -12.551 2.316 1.00 1.00 O ATOM 0 H SER A 14 -15.837 -11.805 -1.249 1.00 1.00 H new ATOM 0 HA SER A 14 -16.679 -14.085 0.065 1.00 1.00 H new ATOM 0 HB2 SER A 14 -15.444 -12.396 1.217 1.00 1.00 H new ATOM 0 HB3 SER A 14 -16.651 -11.171 0.878 1.00 1.00 H new ATOM 0 HG SER A 14 -16.824 -11.999 3.041 1.00 1.00 H new ATOM 221 N LEU A 15 -19.111 -11.968 -0.604 1.00 1.00 N ATOM 222 CA LEU A 15 -20.554 -11.829 -0.688 1.00 1.00 C ATOM 223 C LEU A 15 -21.078 -12.670 -1.854 1.00 1.00 C ATOM 224 O LEU A 15 -22.256 -13.023 -1.889 1.00 1.00 O ATOM 225 CB LEU A 15 -20.944 -10.351 -0.773 1.00 1.00 C ATOM 226 CG LEU A 15 -21.462 -9.718 0.518 1.00 1.00 C ATOM 227 CD1 LEU A 15 -22.773 -10.371 0.962 1.00 1.00 C ATOM 228 CD2 LEU A 15 -20.397 -9.769 1.616 1.00 1.00 C ATOM 0 H LEU A 15 -18.584 -11.172 -0.962 1.00 1.00 H new ATOM 0 HA LEU A 15 -21.026 -12.210 0.217 1.00 1.00 H new ATOM 0 HB2 LEU A 15 -20.075 -9.785 -1.108 1.00 1.00 H new ATOM 0 HB3 LEU A 15 -21.710 -10.242 -1.540 1.00 1.00 H new ATOM 0 HG LEU A 15 -21.676 -8.667 0.322 1.00 1.00 H new ATOM 0 HD11 LEU A 15 -23.120 -9.902 1.883 1.00 1.00 H new ATOM 0 HD12 LEU A 15 -23.525 -10.242 0.184 1.00 1.00 H new ATOM 0 HD13 LEU A 15 -22.609 -11.434 1.136 1.00 1.00 H new ATOM 0 HD21 LEU A 15 -20.789 -9.313 2.525 1.00 1.00 H new ATOM 0 HD22 LEU A 15 -20.131 -10.807 1.817 1.00 1.00 H new ATOM 0 HD23 LEU A 15 -19.511 -9.224 1.289 1.00 1.00 H new ATOM 240 N GLY A 16 -20.176 -12.966 -2.779 1.00 1.00 N ATOM 241 CA GLY A 16 -20.532 -13.761 -3.942 1.00 1.00 C ATOM 242 C GLY A 16 -20.380 -12.945 -5.229 1.00 1.00 C ATOM 243 O GLY A 16 -20.065 -13.495 -6.282 1.00 1.00 O ATOM 0 H GLY A 16 -19.200 -12.670 -2.747 1.00 1.00 H new ATOM 0 HA2 GLY A 16 -19.897 -14.646 -3.991 1.00 1.00 H new ATOM 0 HA3 GLY A 16 -21.560 -14.111 -3.848 1.00 1.00 H new ATOM 247 N LEU A 17 -20.616 -11.648 -5.099 1.00 1.00 N ATOM 248 CA LEU A 17 -20.510 -10.751 -6.237 1.00 1.00 C ATOM 249 C LEU A 17 -19.043 -10.625 -6.647 1.00 1.00 C ATOM 250 O LEU A 17 -18.174 -11.274 -6.066 1.00 1.00 O ATOM 251 CB LEU A 17 -21.181 -9.411 -5.929 1.00 1.00 C ATOM 252 CG LEU A 17 -20.413 -8.477 -4.993 1.00 1.00 C ATOM 253 CD1 LEU A 17 -20.962 -7.052 -5.069 1.00 1.00 C ATOM 254 CD2 LEU A 17 -20.410 -9.016 -3.560 1.00 1.00 C ATOM 0 H LEU A 17 -20.880 -11.197 -4.223 1.00 1.00 H new ATOM 0 HA LEU A 17 -21.046 -11.159 -7.094 1.00 1.00 H new ATOM 0 HB2 LEU A 17 -21.354 -8.889 -6.870 1.00 1.00 H new ATOM 0 HB3 LEU A 17 -22.159 -9.609 -5.490 1.00 1.00 H new ATOM 0 HG LEU A 17 -19.375 -8.440 -5.324 1.00 1.00 H new ATOM 0 HD11 LEU A 17 -20.398 -6.408 -4.394 1.00 1.00 H new ATOM 0 HD12 LEU A 17 -20.867 -6.679 -6.089 1.00 1.00 H new ATOM 0 HD13 LEU A 17 -22.013 -7.051 -4.779 1.00 1.00 H new ATOM 0 HD21 LEU A 17 -19.857 -8.333 -2.915 1.00 1.00 H new ATOM 0 HD22 LEU A 17 -21.436 -9.103 -3.202 1.00 1.00 H new ATOM 0 HD23 LEU A 17 -19.935 -9.997 -3.541 1.00 1.00 H new ATOM 266 N LEU A 18 -18.810 -9.785 -7.646 1.00 1.00 N ATOM 267 CA LEU A 18 -17.460 -9.566 -8.140 1.00 1.00 C ATOM 268 C LEU A 18 -17.014 -8.148 -7.779 1.00 1.00 C ATOM 269 O LEU A 18 -17.845 -7.252 -7.632 1.00 1.00 O ATOM 270 CB LEU A 18 -17.382 -9.873 -9.636 1.00 1.00 C ATOM 271 CG LEU A 18 -17.602 -8.687 -10.578 1.00 1.00 C ATOM 272 CD1 LEU A 18 -16.375 -8.451 -11.458 1.00 1.00 C ATOM 273 CD2 LEU A 18 -18.876 -8.874 -11.405 1.00 1.00 C ATOM 0 H LEU A 18 -19.532 -9.248 -8.126 1.00 1.00 H new ATOM 0 HA LEU A 18 -16.762 -10.252 -7.660 1.00 1.00 H new ATOM 0 HB2 LEU A 18 -16.403 -10.302 -9.848 1.00 1.00 H new ATOM 0 HB3 LEU A 18 -18.123 -10.638 -9.869 1.00 1.00 H new ATOM 0 HG LEU A 18 -17.740 -7.790 -9.974 1.00 1.00 H new ATOM 0 HD11 LEU A 18 -16.558 -7.603 -12.118 1.00 1.00 H new ATOM 0 HD12 LEU A 18 -15.511 -8.241 -10.828 1.00 1.00 H new ATOM 0 HD13 LEU A 18 -16.180 -9.341 -12.057 1.00 1.00 H new ATOM 0 HD21 LEU A 18 -19.010 -8.018 -12.066 1.00 1.00 H new ATOM 0 HD22 LEU A 18 -18.793 -9.783 -12.001 1.00 1.00 H new ATOM 0 HD23 LEU A 18 -19.734 -8.955 -10.738 1.00 1.00 H new ATOM 285 N GLY A 19 -15.706 -7.990 -7.646 1.00 1.00 N ATOM 286 CA GLY A 19 -15.141 -6.694 -7.305 1.00 1.00 C ATOM 287 C GLY A 19 -13.856 -6.431 -8.096 1.00 1.00 C ATOM 288 O GLY A 19 -13.506 -7.199 -8.989 1.00 1.00 O ATOM 0 H GLY A 19 -15.021 -8.736 -7.768 1.00 1.00 H new ATOM 0 HA2 GLY A 19 -15.868 -5.910 -7.514 1.00 1.00 H new ATOM 0 HA3 GLY A 19 -14.929 -6.655 -6.236 1.00 1.00 H new ATOM 292 N LYS A 20 -13.192 -5.342 -7.737 1.00 1.00 N ATOM 293 CA LYS A 20 -11.956 -4.969 -8.403 1.00 1.00 C ATOM 294 C LYS A 20 -11.248 -3.888 -7.584 1.00 1.00 C ATOM 295 O LYS A 20 -11.895 -3.114 -6.880 1.00 1.00 O ATOM 296 CB LYS A 20 -12.228 -4.563 -9.852 1.00 1.00 C ATOM 297 CG LYS A 20 -12.626 -3.089 -9.943 1.00 1.00 C ATOM 298 CD LYS A 20 -11.393 -2.193 -10.057 1.00 1.00 C ATOM 299 CE LYS A 20 -11.045 -1.920 -11.522 1.00 1.00 C ATOM 300 NZ LYS A 20 -9.705 -1.300 -11.630 1.00 1.00 N ATOM 0 H LYS A 20 -13.486 -4.707 -6.995 1.00 1.00 H new ATOM 0 HA LYS A 20 -11.281 -5.823 -8.458 1.00 1.00 H new ATOM 0 HB2 LYS A 20 -11.339 -4.741 -10.456 1.00 1.00 H new ATOM 0 HB3 LYS A 20 -13.023 -5.184 -10.264 1.00 1.00 H new ATOM 0 HG2 LYS A 20 -13.272 -2.936 -10.808 1.00 1.00 H new ATOM 0 HG3 LYS A 20 -13.202 -2.809 -9.061 1.00 1.00 H new ATOM 0 HD2 LYS A 20 -11.576 -1.250 -9.541 1.00 1.00 H new ATOM 0 HD3 LYS A 20 -10.547 -2.669 -9.561 1.00 1.00 H new ATOM 0 HE2 LYS A 20 -11.068 -2.852 -12.087 1.00 1.00 H new ATOM 0 HE3 LYS A 20 -11.793 -1.262 -11.963 1.00 1.00 H new ATOM 0 HZ1 LYS A 20 -9.176 -1.749 -12.405 1.00 1.00 H new ATOM 0 HZ2 LYS A 20 -9.807 -0.283 -11.824 1.00 1.00 H new ATOM 0 HZ3 LYS A 20 -9.189 -1.432 -10.737 1.00 1.00 H new ATOM 313 N CYS A 21 -9.928 -3.869 -7.702 1.00 1.00 N ATOM 314 CA CYS A 21 -9.127 -2.894 -6.980 1.00 1.00 C ATOM 315 C CYS A 21 -8.857 -1.710 -7.913 1.00 1.00 C ATOM 316 O CYS A 21 -7.864 -1.701 -8.638 1.00 1.00 O ATOM 317 CB CYS A 21 -7.831 -3.510 -6.451 1.00 1.00 C ATOM 318 SG CYS A 21 -7.213 -2.776 -4.892 1.00 1.00 S ATOM 0 H CYS A 21 -9.394 -4.512 -8.286 1.00 1.00 H new ATOM 0 HA CYS A 21 -9.673 -2.547 -6.103 1.00 1.00 H new ATOM 0 HB2 CYS A 21 -7.989 -4.577 -6.296 1.00 1.00 H new ATOM 0 HB3 CYS A 21 -7.059 -3.410 -7.214 1.00 1.00 H new ATOM 323 N ILE A 22 -9.757 -0.741 -7.862 1.00 1.00 N ATOM 324 CA ILE A 22 -9.631 0.440 -8.693 1.00 1.00 C ATOM 325 C ILE A 22 -8.463 1.290 -8.185 1.00 1.00 C ATOM 326 O ILE A 22 -8.573 1.948 -7.152 1.00 1.00 O ATOM 327 CB ILE A 22 -10.958 1.195 -8.758 1.00 1.00 C ATOM 328 CG1 ILE A 22 -11.603 1.056 -10.138 1.00 1.00 C ATOM 329 CG2 ILE A 22 -10.776 2.661 -8.356 1.00 1.00 C ATOM 330 CD1 ILE A 22 -13.059 0.601 -10.020 1.00 1.00 C ATOM 0 H ILE A 22 -10.578 -0.751 -7.256 1.00 1.00 H new ATOM 0 HA ILE A 22 -9.401 0.161 -9.721 1.00 1.00 H new ATOM 0 HB ILE A 22 -11.641 0.745 -8.037 1.00 1.00 H new ATOM 0 HG12 ILE A 22 -11.558 2.011 -10.662 1.00 1.00 H new ATOM 0 HG13 ILE A 22 -11.041 0.338 -10.735 1.00 1.00 H new ATOM 0 HG21 ILE A 22 -11.736 3.175 -8.411 1.00 1.00 H new ATOM 0 HG22 ILE A 22 -10.394 2.714 -7.337 1.00 1.00 H new ATOM 0 HG23 ILE A 22 -10.069 3.139 -9.034 1.00 1.00 H new ATOM 0 HD11 ILE A 22 -13.494 0.510 -11.015 1.00 1.00 H new ATOM 0 HD12 ILE A 22 -13.099 -0.365 -9.517 1.00 1.00 H new ATOM 0 HD13 ILE A 22 -13.623 1.334 -9.443 1.00 1.00 H new ATOM 342 N GLY A 23 -7.372 1.247 -8.934 1.00 1.00 N ATOM 343 CA GLY A 23 -6.185 2.006 -8.572 1.00 1.00 C ATOM 344 C GLY A 23 -5.622 1.534 -7.230 1.00 1.00 C ATOM 345 O GLY A 23 -4.626 0.813 -7.189 1.00 1.00 O ATOM 0 H GLY A 23 -7.284 0.699 -9.790 1.00 1.00 H new ATOM 0 HA2 GLY A 23 -5.427 1.895 -9.348 1.00 1.00 H new ATOM 0 HA3 GLY A 23 -6.430 3.067 -8.515 1.00 1.00 H new ATOM 349 N VAL A 24 -6.284 1.959 -6.164 1.00 1.00 N ATOM 350 CA VAL A 24 -5.861 1.590 -4.825 1.00 1.00 C ATOM 351 C VAL A 24 -7.083 1.534 -3.906 1.00 1.00 C ATOM 352 O VAL A 24 -6.991 1.854 -2.721 1.00 1.00 O ATOM 353 CB VAL A 24 -4.786 2.560 -4.329 1.00 1.00 C ATOM 354 CG1 VAL A 24 -5.412 3.734 -3.574 1.00 1.00 C ATOM 355 CG2 VAL A 24 -3.756 1.837 -3.459 1.00 1.00 C ATOM 0 H VAL A 24 -7.111 2.556 -6.201 1.00 1.00 H new ATOM 0 HA VAL A 24 -5.409 0.598 -4.828 1.00 1.00 H new ATOM 0 HB VAL A 24 -4.268 2.960 -5.201 1.00 1.00 H new ATOM 0 HG11 VAL A 24 -4.626 4.408 -3.233 1.00 1.00 H new ATOM 0 HG12 VAL A 24 -6.089 4.273 -4.236 1.00 1.00 H new ATOM 0 HG13 VAL A 24 -5.967 3.359 -2.714 1.00 1.00 H new ATOM 0 HG21 VAL A 24 -3.003 2.548 -3.119 1.00 1.00 H new ATOM 0 HG22 VAL A 24 -4.254 1.396 -2.596 1.00 1.00 H new ATOM 0 HG23 VAL A 24 -3.276 1.051 -4.041 1.00 1.00 H new ATOM 365 N LYS A 25 -8.202 1.125 -4.487 1.00 1.00 N ATOM 366 CA LYS A 25 -9.441 1.022 -3.736 1.00 1.00 C ATOM 367 C LYS A 25 -10.280 -0.124 -4.298 1.00 1.00 C ATOM 368 O LYS A 25 -10.537 -0.179 -5.500 1.00 1.00 O ATOM 369 CB LYS A 25 -10.172 2.366 -3.720 1.00 1.00 C ATOM 370 CG LYS A 25 -9.626 3.275 -2.617 1.00 1.00 C ATOM 371 CD LYS A 25 -10.647 4.350 -2.239 1.00 1.00 C ATOM 372 CE LYS A 25 -11.825 3.746 -1.477 1.00 1.00 C ATOM 373 NZ LYS A 25 -12.540 4.789 -0.707 1.00 1.00 N ATOM 0 H LYS A 25 -8.276 0.861 -5.470 1.00 1.00 H new ATOM 0 HA LYS A 25 -9.233 0.785 -2.693 1.00 1.00 H new ATOM 0 HB2 LYS A 25 -10.061 2.856 -4.688 1.00 1.00 H new ATOM 0 HB3 LYS A 25 -11.239 2.202 -3.566 1.00 1.00 H new ATOM 0 HG2 LYS A 25 -9.378 2.679 -1.739 1.00 1.00 H new ATOM 0 HG3 LYS A 25 -8.703 3.747 -2.953 1.00 1.00 H new ATOM 0 HD2 LYS A 25 -10.166 5.113 -1.627 1.00 1.00 H new ATOM 0 HD3 LYS A 25 -11.008 4.846 -3.140 1.00 1.00 H new ATOM 0 HE2 LYS A 25 -12.511 3.269 -2.177 1.00 1.00 H new ATOM 0 HE3 LYS A 25 -11.468 2.969 -0.801 1.00 1.00 H new ATOM 0 HZ1 LYS A 25 -13.337 4.358 -0.196 1.00 1.00 H new ATOM 0 HZ2 LYS A 25 -11.887 5.226 -0.025 1.00 1.00 H new ATOM 0 HZ3 LYS A 25 -12.899 5.517 -1.358 1.00 1.00 H new ATOM 386 N CYS A 26 -10.685 -1.012 -3.403 1.00 1.00 N ATOM 387 CA CYS A 26 -11.489 -2.156 -3.795 1.00 1.00 C ATOM 388 C CYS A 26 -12.909 -1.668 -4.088 1.00 1.00 C ATOM 389 O CYS A 26 -13.344 -0.650 -3.551 1.00 1.00 O ATOM 390 CB CYS A 26 -11.473 -3.252 -2.727 1.00 1.00 C ATOM 391 SG CYS A 26 -9.823 -3.615 -2.023 1.00 1.00 S ATOM 0 H CYS A 26 -10.471 -0.962 -2.407 1.00 1.00 H new ATOM 0 HA CYS A 26 -11.068 -2.608 -4.693 1.00 1.00 H new ATOM 0 HB2 CYS A 26 -12.142 -2.960 -1.917 1.00 1.00 H new ATOM 0 HB3 CYS A 26 -11.877 -4.167 -3.160 1.00 1.00 H new ATOM 0 HG CYS A 26 -9.042 -4.066 -2.959 1.00 1.00 H new ATOM 396 N GLU A 27 -13.593 -2.416 -4.942 1.00 1.00 N ATOM 397 CA GLU A 27 -14.954 -2.071 -5.315 1.00 1.00 C ATOM 398 C GLU A 27 -15.729 -3.329 -5.714 1.00 1.00 C ATOM 399 O GLU A 27 -15.386 -3.988 -6.695 1.00 1.00 O ATOM 400 CB GLU A 27 -14.969 -1.038 -6.442 1.00 1.00 C ATOM 401 CG GLU A 27 -15.920 0.112 -6.114 1.00 1.00 C ATOM 402 CD GLU A 27 -16.986 0.271 -7.202 1.00 1.00 C ATOM 403 OE1 GLU A 27 -18.092 -0.271 -7.069 1.00 1.00 O ATOM 404 OE2 GLU A 27 -16.630 0.990 -8.212 1.00 1.00 O ATOM 0 H GLU A 27 -13.230 -3.259 -5.386 1.00 1.00 H new ATOM 0 HA GLU A 27 -15.445 -1.623 -4.451 1.00 1.00 H new ATOM 0 HB2 GLU A 27 -13.963 -0.650 -6.598 1.00 1.00 H new ATOM 0 HB3 GLU A 27 -15.275 -1.514 -7.373 1.00 1.00 H new ATOM 0 HG2 GLU A 27 -16.401 -0.072 -5.153 1.00 1.00 H new ATOM 0 HG3 GLU A 27 -15.355 1.039 -6.015 1.00 1.00 H new ATOM 412 N CYS A 28 -16.760 -3.622 -4.935 1.00 1.00 N ATOM 413 CA CYS A 28 -17.588 -4.788 -5.197 1.00 1.00 C ATOM 414 C CYS A 28 -18.751 -4.361 -6.094 1.00 1.00 C ATOM 415 O CYS A 28 -19.210 -3.222 -6.021 1.00 1.00 O ATOM 416 CB CYS A 28 -18.075 -5.438 -3.900 1.00 1.00 C ATOM 417 SG CYS A 28 -16.835 -5.491 -2.555 1.00 1.00 S ATOM 0 H CYS A 28 -17.041 -3.073 -4.123 1.00 1.00 H new ATOM 0 HA CYS A 28 -16.998 -5.549 -5.708 1.00 1.00 H new ATOM 0 HB2 CYS A 28 -18.952 -4.896 -3.546 1.00 1.00 H new ATOM 0 HB3 CYS A 28 -18.397 -6.456 -4.119 1.00 1.00 H new ATOM 422 N VAL A 29 -19.196 -5.299 -6.917 1.00 1.00 N ATOM 423 CA VAL A 29 -20.298 -5.035 -7.827 1.00 1.00 C ATOM 424 C VAL A 29 -20.935 -6.359 -8.248 1.00 1.00 C ATOM 425 O VAL A 29 -20.248 -7.373 -8.366 1.00 1.00 O ATOM 426 CB VAL A 29 -19.807 -4.203 -9.013 1.00 1.00 C ATOM 427 CG1 VAL A 29 -19.426 -2.788 -8.573 1.00 1.00 C ATOM 428 CG2 VAL A 29 -18.637 -4.890 -9.719 1.00 1.00 C ATOM 0 H VAL A 29 -18.814 -6.243 -6.973 1.00 1.00 H new ATOM 0 HA VAL A 29 -21.071 -4.447 -7.332 1.00 1.00 H new ATOM 0 HB VAL A 29 -20.628 -4.122 -9.725 1.00 1.00 H new ATOM 0 HG11 VAL A 29 -19.081 -2.219 -9.436 1.00 1.00 H new ATOM 0 HG12 VAL A 29 -20.296 -2.296 -8.138 1.00 1.00 H new ATOM 0 HG13 VAL A 29 -18.630 -2.840 -7.830 1.00 1.00 H new ATOM 0 HG21 VAL A 29 -18.308 -4.277 -10.558 1.00 1.00 H new ATOM 0 HG22 VAL A 29 -17.813 -5.017 -9.017 1.00 1.00 H new ATOM 0 HG23 VAL A 29 -18.956 -5.866 -10.086 1.00 1.00 H new ATOM 438 N LYS A 30 -22.240 -6.310 -8.465 1.00 1.00 N ATOM 439 CA LYS A 30 -22.979 -7.493 -8.870 1.00 1.00 C ATOM 440 C LYS A 30 -22.899 -7.642 -10.391 1.00 1.00 C ATOM 441 O LYS A 30 -22.407 -6.750 -11.081 1.00 1.00 O ATOM 442 CB LYS A 30 -24.410 -7.444 -8.331 1.00 1.00 C ATOM 443 CG LYS A 30 -24.429 -7.006 -6.865 1.00 1.00 C ATOM 444 CD LYS A 30 -24.061 -8.168 -5.940 1.00 1.00 C ATOM 445 CE LYS A 30 -25.241 -8.550 -5.047 1.00 1.00 C ATOM 446 NZ LYS A 30 -25.447 -7.531 -3.994 1.00 1.00 N ATOM 0 H LYS A 30 -22.806 -5.467 -8.368 1.00 1.00 H new ATOM 0 HA LYS A 30 -22.532 -8.388 -8.437 1.00 1.00 H new ATOM 0 HB2 LYS A 30 -25.004 -6.753 -8.929 1.00 1.00 H new ATOM 0 HB3 LYS A 30 -24.872 -8.426 -8.427 1.00 1.00 H new ATOM 0 HG2 LYS A 30 -23.728 -6.184 -6.718 1.00 1.00 H new ATOM 0 HG3 LYS A 30 -25.419 -6.631 -6.607 1.00 1.00 H new ATOM 0 HD2 LYS A 30 -23.757 -9.029 -6.535 1.00 1.00 H new ATOM 0 HD3 LYS A 30 -23.207 -7.890 -5.322 1.00 1.00 H new ATOM 0 HE2 LYS A 30 -26.144 -8.646 -5.650 1.00 1.00 H new ATOM 0 HE3 LYS A 30 -25.058 -9.522 -4.589 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 -26.253 -7.807 -3.397 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 -24.591 -7.459 -3.408 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 -25.643 -6.610 -4.436 1.00 1.00 H new ATOM 459 N HIS A 31 -23.392 -8.775 -10.869 1.00 1.00 N ATOM 460 CA HIS A 31 -23.383 -9.053 -12.296 1.00 1.00 C ATOM 461 C HIS A 31 -24.751 -9.586 -12.724 1.00 1.00 C ATOM 462 O HIS A 31 -25.701 -8.819 -12.882 1.00 1.00 O ATOM 463 CB HIS A 31 -22.237 -9.998 -12.658 1.00 1.00 C ATOM 464 CG HIS A 31 -22.505 -10.848 -13.878 1.00 1.00 C ATOM 465 ND1 HIS A 31 -23.188 -10.376 -14.984 1.00 1.00 N ATOM 466 CD2 HIS A 31 -22.172 -12.141 -14.154 1.00 1.00 C ATOM 467 CE1 HIS A 31 -23.261 -11.349 -15.880 1.00 1.00 C ATOM 468 NE2 HIS A 31 -22.630 -12.444 -15.363 1.00 1.00 N ATOM 0 H HIS A 31 -23.800 -9.512 -10.294 1.00 1.00 H new ATOM 0 HA HIS A 31 -23.203 -8.131 -12.849 1.00 1.00 H new ATOM 0 HB2 HIS A 31 -21.335 -9.410 -12.828 1.00 1.00 H new ATOM 0 HB3 HIS A 31 -22.036 -10.652 -11.809 1.00 1.00 H new ATOM 0 HD2 HIS A 31 -21.628 -12.806 -13.500 1.00 1.00 H new ATOM 0 HE1 HIS A 31 -23.736 -11.287 -16.848 1.00 1.00 H new ATOM 0 HE2 HIS A 31 -22.527 -13.346 -15.829 1.00 1.00 H new TER 476 HIS A 31