USER MOD reduce.3.24.130724 H: found=0, std=0, add=117, rem=0, adj=5 USER MOD reduce.3.24.130724 removed 116 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 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -123:sc= 0.489 (180deg=-1.89!) USER MOD Single : A 13 GLN : amide:sc= -2.25! C(o=-2.3!,f=-6.2!) USER MOD Single : A 14 CYS SG : rot 87:sc= -0.649 USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 21 LYS NZ :NH3+ 162:sc= -0.0448 (180deg=-0.357) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 108 N ASP A 9 -1.852 0.401 0.541 1.00 0.00 N ATOM 109 CA ASP A 9 -1.906 0.226 1.972 1.00 0.00 C ATOM 110 C ASP A 9 -2.085 1.583 2.525 1.00 0.00 C ATOM 111 O ASP A 9 -1.263 2.461 2.246 1.00 0.00 O ATOM 112 CB ASP A 9 -0.612 -0.342 2.524 1.00 0.00 C ATOM 113 CG ASP A 9 -0.630 -0.441 4.022 1.00 0.00 C ATOM 114 OD1 ASP A 9 -1.292 -1.335 4.576 1.00 0.00 O ATOM 115 OD2 ASP A 9 0.024 0.361 4.673 1.00 0.00 O ATOM 0 HA ASP A 9 -2.705 -0.466 2.235 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -0.440 -1.331 2.098 1.00 0.00 H new ATOM 0 HB3 ASP A 9 0.221 0.288 2.213 1.00 0.00 H new ATOM 120 N CYS A 10 -3.112 1.792 3.287 1.00 0.00 N ATOM 121 CA CYS A 10 -3.412 3.116 3.751 1.00 0.00 C ATOM 122 C CYS A 10 -2.332 3.651 4.678 1.00 0.00 C ATOM 123 O CYS A 10 -2.081 4.860 4.720 1.00 0.00 O ATOM 124 CB CYS A 10 -4.779 3.210 4.401 1.00 0.00 C ATOM 125 SG CYS A 10 -5.429 4.888 4.292 1.00 0.00 S ATOM 0 H CYS A 10 -3.757 1.067 3.602 1.00 0.00 H new ATOM 0 HA CYS A 10 -3.434 3.748 2.863 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -5.466 2.517 3.915 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -4.710 2.909 5.446 1.00 0.00 H new ATOM 130 N SER A 11 -1.651 2.762 5.371 1.00 0.00 N ATOM 131 CA SER A 11 -0.602 3.176 6.239 1.00 0.00 C ATOM 132 C SER A 11 0.584 3.679 5.405 1.00 0.00 C ATOM 133 O SER A 11 1.210 4.686 5.741 1.00 0.00 O ATOM 134 CB SER A 11 -0.212 2.035 7.167 1.00 0.00 C ATOM 135 OG SER A 11 -1.374 1.461 7.762 1.00 0.00 O ATOM 0 H SER A 11 -1.814 1.756 5.341 1.00 0.00 H new ATOM 0 HA SER A 11 -0.940 4.000 6.867 1.00 0.00 H new ATOM 0 HB2 SER A 11 0.333 1.274 6.609 1.00 0.00 H new ATOM 0 HB3 SER A 11 0.459 2.402 7.944 1.00 0.00 H new ATOM 0 HG SER A 11 -1.109 0.727 8.355 1.00 0.00 H new ATOM 141 N LYS A 12 0.823 3.017 4.275 1.00 0.00 N ATOM 142 CA LYS A 12 1.893 3.396 3.378 1.00 0.00 C ATOM 143 C LYS A 12 1.561 4.643 2.635 1.00 0.00 C ATOM 144 O LYS A 12 2.360 5.531 2.527 1.00 0.00 O ATOM 145 CB LYS A 12 2.195 2.318 2.377 1.00 0.00 C ATOM 146 CG LYS A 12 2.759 1.085 2.991 1.00 0.00 C ATOM 147 CD LYS A 12 3.198 0.084 1.959 1.00 0.00 C ATOM 148 CE LYS A 12 4.373 0.586 1.111 1.00 0.00 C ATOM 149 NZ LYS A 12 3.983 1.398 -0.078 1.00 0.00 N ATOM 0 H LYS A 12 0.281 2.211 3.964 1.00 0.00 H new ATOM 0 HA LYS A 12 2.769 3.560 4.006 1.00 0.00 H new ATOM 0 HB2 LYS A 12 1.281 2.063 1.841 1.00 0.00 H new ATOM 0 HB3 LYS A 12 2.900 2.703 1.640 1.00 0.00 H new ATOM 0 HG2 LYS A 12 3.608 1.351 3.621 1.00 0.00 H new ATOM 0 HG3 LYS A 12 2.011 0.630 3.640 1.00 0.00 H new ATOM 0 HD2 LYS A 12 3.484 -0.843 2.456 1.00 0.00 H new ATOM 0 HD3 LYS A 12 2.358 -0.151 1.306 1.00 0.00 H new ATOM 0 HE2 LYS A 12 5.030 1.184 1.743 1.00 0.00 H new ATOM 0 HE3 LYS A 12 4.952 -0.273 0.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 4.371 0.962 -0.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 2.946 1.437 -0.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 4.360 2.362 0.021 1.00 0.00 H new ATOM 163 N GLN A 13 0.366 4.715 2.136 1.00 0.00 N ATOM 164 CA GLN A 13 -0.049 5.846 1.358 1.00 0.00 C ATOM 165 C GLN A 13 -0.131 7.133 2.179 1.00 0.00 C ATOM 166 O GLN A 13 0.140 8.227 1.662 1.00 0.00 O ATOM 167 CB GLN A 13 -1.310 5.527 0.581 1.00 0.00 C ATOM 168 CG GLN A 13 -1.103 4.348 -0.378 1.00 0.00 C ATOM 169 CD GLN A 13 0.102 4.559 -1.296 1.00 0.00 C ATOM 170 OE1 GLN A 13 0.447 5.680 -1.633 1.00 0.00 O ATOM 171 NE2 GLN A 13 0.740 3.494 -1.701 1.00 0.00 N ATOM 0 H GLN A 13 -0.348 3.996 2.254 1.00 0.00 H new ATOM 0 HA GLN A 13 0.727 6.051 0.621 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -2.116 5.293 1.276 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -1.621 6.406 0.016 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -0.964 3.433 0.198 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -2.000 4.211 -0.983 1.00 0.00 H new ATOM 0 HE21 GLN A 13 0.429 2.569 -1.403 1.00 0.00 H new ATOM 0 HE22 GLN A 13 1.549 3.587 -2.315 1.00 0.00 H new ATOM 180 N CYS A 14 -0.451 7.013 3.458 1.00 0.00 N ATOM 181 CA CYS A 14 -0.394 8.167 4.339 1.00 0.00 C ATOM 182 C CYS A 14 1.057 8.438 4.764 1.00 0.00 C ATOM 183 O CYS A 14 1.399 9.540 5.127 1.00 0.00 O ATOM 184 CB CYS A 14 -1.332 8.024 5.550 1.00 0.00 C ATOM 185 SG CYS A 14 -3.112 7.977 5.103 1.00 0.00 S ATOM 0 H CYS A 14 -0.748 6.144 3.903 1.00 0.00 H new ATOM 0 HA CYS A 14 -0.754 9.032 3.782 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -1.078 7.112 6.090 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -1.160 8.856 6.232 1.00 0.00 H new ATOM 0 HG CYS A 14 -3.459 6.754 4.833 1.00 0.00 H new ATOM 190 N GLU A 15 1.903 7.427 4.662 1.00 0.00 N ATOM 191 CA GLU A 15 3.332 7.544 4.942 1.00 0.00 C ATOM 192 C GLU A 15 4.045 8.228 3.758 1.00 0.00 C ATOM 193 O GLU A 15 4.994 8.989 3.927 1.00 0.00 O ATOM 194 CB GLU A 15 3.889 6.128 5.157 1.00 0.00 C ATOM 195 CG GLU A 15 5.387 6.000 5.218 1.00 0.00 C ATOM 196 CD GLU A 15 5.821 4.565 5.361 1.00 0.00 C ATOM 197 OE1 GLU A 15 5.331 3.686 4.604 1.00 0.00 O ATOM 198 OE2 GLU A 15 6.653 4.274 6.224 1.00 0.00 O ATOM 0 H GLU A 15 1.618 6.489 4.379 1.00 0.00 H new ATOM 0 HA GLU A 15 3.499 8.150 5.832 1.00 0.00 H new ATOM 0 HB2 GLU A 15 3.475 5.735 6.086 1.00 0.00 H new ATOM 0 HB3 GLU A 15 3.524 5.491 4.351 1.00 0.00 H new ATOM 0 HG2 GLU A 15 5.825 6.424 4.314 1.00 0.00 H new ATOM 0 HG3 GLU A 15 5.767 6.580 6.059 1.00 0.00 H new ATOM 205 N GLU A 16 3.560 7.959 2.577 1.00 0.00 N ATOM 206 CA GLU A 16 4.096 8.520 1.356 1.00 0.00 C ATOM 207 C GLU A 16 3.401 9.837 1.021 1.00 0.00 C ATOM 208 O GLU A 16 3.811 10.567 0.114 1.00 0.00 O ATOM 209 CB GLU A 16 3.978 7.476 0.244 1.00 0.00 C ATOM 210 CG GLU A 16 4.808 6.242 0.574 1.00 0.00 C ATOM 211 CD GLU A 16 4.599 5.059 -0.334 1.00 0.00 C ATOM 212 OE1 GLU A 16 5.122 5.061 -1.469 1.00 0.00 O ATOM 213 OE2 GLU A 16 3.997 4.053 0.106 1.00 0.00 O ATOM 0 H GLU A 16 2.768 7.334 2.428 1.00 0.00 H new ATOM 0 HA GLU A 16 5.152 8.762 1.476 1.00 0.00 H new ATOM 0 HB2 GLU A 16 2.933 7.193 0.113 1.00 0.00 H new ATOM 0 HB3 GLU A 16 4.313 7.904 -0.701 1.00 0.00 H new ATOM 0 HG2 GLU A 16 5.862 6.517 0.547 1.00 0.00 H new ATOM 0 HG3 GLU A 16 4.584 5.937 1.596 1.00 0.00 H new ATOM 220 N GLY A 17 2.339 10.117 1.765 1.00 0.00 N ATOM 221 CA GLY A 17 1.640 11.375 1.669 1.00 0.00 C ATOM 222 C GLY A 17 0.933 11.562 0.358 1.00 0.00 C ATOM 223 O GLY A 17 0.908 12.667 -0.190 1.00 0.00 O ATOM 0 H GLY A 17 1.944 9.473 2.450 1.00 0.00 H new ATOM 0 HA2 GLY A 17 0.913 11.442 2.479 1.00 0.00 H new ATOM 0 HA3 GLY A 17 2.351 12.189 1.810 1.00 0.00 H new ATOM 227 N ILE A 18 0.363 10.504 -0.155 1.00 0.00 N ATOM 228 CA ILE A 18 -0.337 10.595 -1.411 1.00 0.00 C ATOM 229 C ILE A 18 -1.834 10.731 -1.147 1.00 0.00 C ATOM 230 O ILE A 18 -2.379 11.825 -1.183 1.00 0.00 O ATOM 231 CB ILE A 18 -0.052 9.372 -2.339 1.00 0.00 C ATOM 232 CG1 ILE A 18 1.457 9.166 -2.494 1.00 0.00 C ATOM 233 CG2 ILE A 18 -0.683 9.587 -3.719 1.00 0.00 C ATOM 234 CD1 ILE A 18 1.828 7.978 -3.350 1.00 0.00 C ATOM 0 H ILE A 18 0.368 9.577 0.271 1.00 0.00 H new ATOM 0 HA ILE A 18 0.027 11.478 -1.936 1.00 0.00 H new ATOM 0 HB ILE A 18 -0.492 8.486 -1.881 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.894 10.065 -2.929 1.00 0.00 H new ATOM 0 HG13 ILE A 18 1.900 9.042 -1.506 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -0.474 8.725 -4.353 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -1.761 9.706 -3.612 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -0.263 10.483 -4.176 1.00 0.00 H new ATOM 0 HD11 ILE A 18 2.913 7.899 -3.412 1.00 0.00 H new ATOM 0 HD12 ILE A 18 1.423 7.069 -2.906 1.00 0.00 H new ATOM 0 HD13 ILE A 18 1.416 8.108 -4.351 1.00 0.00 H new ATOM 246 N GLY A 19 -2.483 9.620 -0.851 1.00 0.00 N ATOM 247 CA GLY A 19 -3.918 9.623 -0.559 1.00 0.00 C ATOM 248 C GLY A 19 -4.787 9.675 -1.811 1.00 0.00 C ATOM 249 O GLY A 19 -5.981 9.439 -1.749 1.00 0.00 O ATOM 0 H GLY A 19 -2.045 8.700 -0.805 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -4.168 8.728 0.012 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -4.152 10.480 0.073 1.00 0.00 H new ATOM 253 N HIS A 20 -4.167 9.932 -2.937 1.00 0.00 N ATOM 254 CA HIS A 20 -4.845 10.020 -4.215 1.00 0.00 C ATOM 255 C HIS A 20 -5.139 8.626 -4.720 1.00 0.00 C ATOM 256 O HIS A 20 -4.224 7.830 -4.839 1.00 0.00 O ATOM 257 CB HIS A 20 -3.949 10.762 -5.218 1.00 0.00 C ATOM 258 CG HIS A 20 -4.526 10.895 -6.604 1.00 0.00 C ATOM 259 ND1 HIS A 20 -3.877 10.485 -7.743 1.00 0.00 N ATOM 260 CD2 HIS A 20 -5.704 11.421 -7.017 1.00 0.00 C ATOM 261 CE1 HIS A 20 -4.653 10.766 -8.792 1.00 0.00 C ATOM 262 NE2 HIS A 20 -5.782 11.340 -8.406 1.00 0.00 N ATOM 0 H HIS A 20 -3.161 10.089 -2.996 1.00 0.00 H new ATOM 0 HA HIS A 20 -5.781 10.566 -4.100 1.00 0.00 H new ATOM 0 HB2 HIS A 20 -3.741 11.759 -4.829 1.00 0.00 H new ATOM 0 HB3 HIS A 20 -2.994 10.240 -5.286 1.00 0.00 H new ATOM 0 HD2 HIS A 20 -6.463 11.838 -6.372 1.00 0.00 H new ATOM 0 HE1 HIS A 20 -4.394 10.553 -9.819 1.00 0.00 H new ATOM 0 HE2 HIS A 20 -6.548 11.656 -9.001 1.00 0.00 H new ATOM 270 N LYS A 21 -6.416 8.358 -5.016 1.00 0.00 N ATOM 271 CA LYS A 21 -6.914 7.050 -5.496 1.00 0.00 C ATOM 272 C LYS A 21 -7.061 6.076 -4.344 1.00 0.00 C ATOM 273 O LYS A 21 -7.319 4.870 -4.537 1.00 0.00 O ATOM 274 CB LYS A 21 -6.046 6.457 -6.631 1.00 0.00 C ATOM 275 CG LYS A 21 -5.985 7.300 -7.900 1.00 0.00 C ATOM 276 CD LYS A 21 -7.336 7.398 -8.586 1.00 0.00 C ATOM 277 CE LYS A 21 -7.226 8.124 -9.919 1.00 0.00 C ATOM 278 NZ LYS A 21 -6.377 7.384 -10.886 1.00 0.00 N ATOM 0 H LYS A 21 -7.154 9.056 -4.929 1.00 0.00 H new ATOM 0 HA LYS A 21 -7.899 7.225 -5.928 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -5.032 6.316 -6.257 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -6.432 5.470 -6.886 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -5.631 8.301 -7.653 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -5.260 6.866 -8.588 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.739 6.398 -8.746 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -8.038 7.925 -7.939 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -8.222 8.260 -10.341 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -6.809 9.118 -9.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -6.565 7.730 -11.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -5.374 7.534 -10.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -6.596 6.369 -10.834 1.00 0.00 H new ATOM 292 N TYR A 22 -6.954 6.608 -3.140 1.00 0.00 N ATOM 293 CA TYR A 22 -7.035 5.827 -1.939 1.00 0.00 C ATOM 294 C TYR A 22 -8.089 6.483 -1.070 1.00 0.00 C ATOM 295 O TYR A 22 -7.783 7.366 -0.262 1.00 0.00 O ATOM 296 CB TYR A 22 -5.668 5.782 -1.198 1.00 0.00 C ATOM 297 CG TYR A 22 -4.481 5.578 -2.122 1.00 0.00 C ATOM 298 CD1 TYR A 22 -4.483 4.582 -3.076 1.00 0.00 C ATOM 299 CD2 TYR A 22 -3.404 6.438 -2.091 1.00 0.00 C ATOM 300 CE1 TYR A 22 -3.452 4.436 -3.957 1.00 0.00 C ATOM 301 CE2 TYR A 22 -2.366 6.308 -2.980 1.00 0.00 C ATOM 302 CZ TYR A 22 -2.391 5.306 -3.907 1.00 0.00 C ATOM 303 OH TYR A 22 -1.371 5.196 -4.802 1.00 0.00 O ATOM 0 H TYR A 22 -6.807 7.604 -2.977 1.00 0.00 H new ATOM 0 HA TYR A 22 -7.296 4.794 -2.171 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -5.533 6.712 -0.647 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -5.689 4.977 -0.464 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -5.320 3.902 -3.127 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -3.376 7.228 -1.355 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -3.470 3.642 -4.689 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -1.534 6.995 -2.946 1.00 0.00 H new ATOM 0 HH TYR A 22 -0.704 5.891 -4.625 1.00 0.00 H new ATOM 313 N PRO A 23 -9.363 6.098 -1.257 1.00 0.00 N ATOM 314 CA PRO A 23 -10.527 6.743 -0.598 1.00 0.00 C ATOM 315 C PRO A 23 -10.489 6.643 0.926 1.00 0.00 C ATOM 316 O PRO A 23 -11.096 7.438 1.645 1.00 0.00 O ATOM 317 CB PRO A 23 -11.719 5.968 -1.166 1.00 0.00 C ATOM 318 CG PRO A 23 -11.156 4.670 -1.613 1.00 0.00 C ATOM 319 CD PRO A 23 -9.793 4.990 -2.135 1.00 0.00 C ATOM 0 HA PRO A 23 -10.559 7.815 -0.793 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -12.492 5.824 -0.411 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -12.180 6.505 -1.995 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -11.104 3.959 -0.789 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -11.777 4.217 -2.386 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -9.121 4.134 -2.066 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -9.820 5.290 -3.183 1.00 0.00 H new ATOM 327 N PHE A 24 -9.754 5.699 1.387 1.00 0.00 N ATOM 328 CA PHE A 24 -9.575 5.442 2.786 1.00 0.00 C ATOM 329 C PHE A 24 -8.449 6.285 3.381 1.00 0.00 C ATOM 330 O PHE A 24 -8.373 6.465 4.600 1.00 0.00 O ATOM 331 CB PHE A 24 -9.336 3.933 2.996 1.00 0.00 C ATOM 332 CG PHE A 24 -8.623 3.279 1.836 1.00 0.00 C ATOM 333 CD1 PHE A 24 -7.252 3.300 1.731 1.00 0.00 C ATOM 334 CD2 PHE A 24 -9.354 2.666 0.834 1.00 0.00 C ATOM 335 CE1 PHE A 24 -6.619 2.726 0.648 1.00 0.00 C ATOM 336 CE2 PHE A 24 -8.734 2.092 -0.245 1.00 0.00 C ATOM 337 CZ PHE A 24 -7.362 2.122 -0.342 1.00 0.00 C ATOM 0 H PHE A 24 -9.238 5.056 0.787 1.00 0.00 H new ATOM 0 HA PHE A 24 -10.481 5.734 3.317 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -8.750 3.787 3.904 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -10.294 3.438 3.152 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -6.664 3.771 2.505 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -10.431 2.639 0.903 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -5.542 2.750 0.576 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -9.321 1.617 -1.017 1.00 0.00 H new ATOM 0 HZ PHE A 24 -6.869 1.673 -1.192 1.00 0.00 H new ATOM 347 N CYS A 25 -7.620 6.858 2.536 1.00 0.00 N ATOM 348 CA CYS A 25 -6.472 7.582 3.029 1.00 0.00 C ATOM 349 C CYS A 25 -6.657 9.065 3.021 1.00 0.00 C ATOM 350 O CYS A 25 -6.267 9.762 2.077 1.00 0.00 O ATOM 351 CB CYS A 25 -5.197 7.200 2.311 1.00 0.00 C ATOM 352 SG CYS A 25 -4.770 5.450 2.445 1.00 0.00 S ATOM 0 H CYS A 25 -7.717 6.837 1.521 1.00 0.00 H new ATOM 0 HA CYS A 25 -6.376 7.280 4.072 1.00 0.00 H new ATOM 0 HB2 CYS A 25 -5.295 7.459 1.257 1.00 0.00 H new ATOM 0 HB3 CYS A 25 -4.376 7.795 2.711 1.00 0.00 H new