USER MOD reduce.3.24.130724 H: found=0, std=0, add=131, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 132 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 : B 4 THR OG1 : rot -20:sc= 0.0513 USER MOD Single : B 7 HIS : no HE2:sc= -1.1 X(o=-1.1,f=-1.5) USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 535 N THR B 4 2.426 3.796 5.132 1.00 0.00 N ATOM 536 CA THR B 4 1.364 4.795 5.319 1.00 0.00 C ATOM 537 C THR B 4 1.260 5.824 4.205 1.00 0.00 C ATOM 538 O THR B 4 0.146 6.107 3.766 1.00 0.00 O ATOM 539 CB THR B 4 1.319 5.505 6.689 1.00 0.00 C ATOM 540 OG1 THR B 4 2.608 5.943 7.121 1.00 0.00 O ATOM 541 CG2 THR B 4 0.656 4.585 7.749 1.00 0.00 C ATOM 0 HA THR B 4 0.485 4.152 5.280 1.00 0.00 H new ATOM 0 HB THR B 4 0.712 6.403 6.571 1.00 0.00 H new ATOM 0 HG1 THR B 4 3.301 5.448 6.636 1.00 0.00 H new ATOM 0 HG21 THR B 4 0.630 5.097 8.711 1.00 0.00 H new ATOM 0 HG22 THR B 4 -0.361 4.346 7.438 1.00 0.00 H new ATOM 0 HG23 THR B 4 1.232 3.665 7.844 1.00 0.00 H new ATOM 549 N ARG B 5 2.401 6.389 3.721 1.00 0.00 N ATOM 550 CA ARG B 5 2.501 7.376 2.650 1.00 0.00 C ATOM 551 C ARG B 5 1.850 6.854 1.363 1.00 0.00 C ATOM 552 O ARG B 5 0.998 7.546 0.795 1.00 0.00 O ATOM 553 CB ARG B 5 3.986 7.825 2.439 1.00 0.00 C ATOM 554 CG ARG B 5 4.540 8.851 3.467 1.00 0.00 C ATOM 555 CD ARG B 5 4.573 8.390 4.940 1.00 0.00 C ATOM 556 NE ARG B 5 5.260 9.435 5.777 1.00 0.00 N ATOM 557 CZ ARG B 5 5.377 9.408 7.145 1.00 0.00 C ATOM 558 NH1 ARG B 5 4.791 8.456 7.932 1.00 0.00 N ATOM 559 NH2 ARG B 5 6.115 10.389 7.749 1.00 0.00 N ATOM 0 H ARG B 5 3.316 6.143 4.100 1.00 0.00 H new ATOM 0 HA ARG B 5 1.945 8.267 2.943 1.00 0.00 H new ATOM 0 HB2 ARG B 5 4.620 6.938 2.463 1.00 0.00 H new ATOM 0 HB3 ARG B 5 4.077 8.255 1.441 1.00 0.00 H new ATOM 0 HG2 ARG B 5 5.553 9.121 3.170 1.00 0.00 H new ATOM 0 HG3 ARG B 5 3.938 9.757 3.405 1.00 0.00 H new ATOM 0 HD2 ARG B 5 3.559 8.226 5.304 1.00 0.00 H new ATOM 0 HD3 ARG B 5 5.099 7.439 5.023 1.00 0.00 H new ATOM 0 HE ARG B 5 5.673 10.229 5.288 1.00 0.00 H new ATOM 0 HH11 ARG B 5 4.233 7.716 7.507 1.00 0.00 H new ATOM 0 HH12 ARG B 5 4.912 8.486 8.944 1.00 0.00 H new ATOM 0 HH21 ARG B 5 6.560 11.113 7.185 1.00 0.00 H new ATOM 0 HH22 ARG B 5 6.221 10.396 8.763 1.00 0.00 H new ATOM 573 N ARG B 6 2.190 5.600 0.930 1.00 0.00 N ATOM 574 CA ARG B 6 1.616 4.887 -0.201 1.00 0.00 C ATOM 575 C ARG B 6 0.142 4.570 0.106 1.00 0.00 C ATOM 576 O ARG B 6 -0.727 4.934 -0.691 1.00 0.00 O ATOM 577 CB ARG B 6 2.431 3.598 -0.551 1.00 0.00 C ATOM 578 CG ARG B 6 1.748 2.606 -1.525 1.00 0.00 C ATOM 579 CD ARG B 6 2.626 1.421 -1.929 1.00 0.00 C ATOM 580 NE ARG B 6 1.772 0.328 -2.517 1.00 0.00 N ATOM 581 CZ ARG B 6 1.404 0.209 -3.833 1.00 0.00 C ATOM 582 NH1 ARG B 6 1.611 1.197 -4.751 1.00 0.00 N ATOM 583 NH2 ARG B 6 0.799 -0.946 -4.246 1.00 0.00 N ATOM 0 H ARG B 6 2.911 5.053 1.401 1.00 0.00 H new ATOM 0 HA ARG B 6 1.666 5.521 -1.086 1.00 0.00 H new ATOM 0 HB2 ARG B 6 3.385 3.901 -0.983 1.00 0.00 H new ATOM 0 HB3 ARG B 6 2.654 3.070 0.376 1.00 0.00 H new ATOM 0 HG2 ARG B 6 0.837 2.228 -1.061 1.00 0.00 H new ATOM 0 HG3 ARG B 6 1.448 3.145 -2.424 1.00 0.00 H new ATOM 0 HD2 ARG B 6 3.373 1.741 -2.655 1.00 0.00 H new ATOM 0 HD3 ARG B 6 3.167 1.045 -1.060 1.00 0.00 H new ATOM 0 HE ARG B 6 1.436 -0.391 -1.876 1.00 0.00 H new ATOM 0 HH11 ARG B 6 2.057 2.070 -4.469 1.00 0.00 H new ATOM 0 HH12 ARG B 6 1.320 1.063 -5.719 1.00 0.00 H new ATOM 0 HH21 ARG B 6 0.629 -1.699 -3.580 1.00 0.00 H new ATOM 0 HH22 ARG B 6 0.518 -1.054 -5.220 1.00 0.00 H new ATOM 597 N HIS B 7 -0.146 3.882 1.263 1.00 0.00 N ATOM 598 CA HIS B 7 -1.437 3.464 1.779 1.00 0.00 C ATOM 599 C HIS B 7 -2.483 4.550 1.655 1.00 0.00 C ATOM 600 O HIS B 7 -3.486 4.278 1.023 1.00 0.00 O ATOM 601 CB HIS B 7 -1.386 2.940 3.244 1.00 0.00 C ATOM 602 CG HIS B 7 -2.714 2.541 3.829 1.00 0.00 C ATOM 603 ND1 HIS B 7 -3.065 1.244 4.076 1.00 0.00 N ATOM 604 CD2 HIS B 7 -3.761 3.313 4.201 1.00 0.00 C ATOM 605 CE1 HIS B 7 -4.290 1.234 4.582 1.00 0.00 C ATOM 606 NE2 HIS B 7 -4.730 2.477 4.677 1.00 0.00 N ATOM 0 H HIS B 7 0.606 3.596 1.890 1.00 0.00 H new ATOM 0 HA HIS B 7 -1.726 2.624 1.147 1.00 0.00 H new ATOM 0 HB2 HIS B 7 -0.717 2.080 3.282 1.00 0.00 H new ATOM 0 HB3 HIS B 7 -0.947 3.713 3.874 1.00 0.00 H new ATOM 0 HD1 HIS B 7 -2.484 0.424 3.901 1.00 0.00 H new ATOM 0 HD2 HIS B 7 -3.819 4.389 4.134 1.00 0.00 H new ATOM 0 HE1 HIS B 7 -4.841 0.351 4.871 1.00 0.00 H new ATOM 615 N GLU B 8 -2.285 5.780 2.218 1.00 0.00 N ATOM 616 CA GLU B 8 -3.173 6.937 2.192 1.00 0.00 C ATOM 617 C GLU B 8 -3.894 7.128 0.841 1.00 0.00 C ATOM 618 O GLU B 8 -5.127 7.127 0.805 1.00 0.00 O ATOM 619 CB GLU B 8 -2.401 8.224 2.640 1.00 0.00 C ATOM 620 CG GLU B 8 -3.305 9.406 3.062 1.00 0.00 C ATOM 621 CD GLU B 8 -2.468 10.609 3.503 1.00 0.00 C ATOM 622 OE1 GLU B 8 -1.823 11.247 2.626 1.00 0.00 O ATOM 623 OE2 GLU B 8 -2.474 10.915 4.726 1.00 0.00 O ATOM 0 H GLU B 8 -1.430 5.982 2.736 1.00 0.00 H new ATOM 0 HA GLU B 8 -3.970 6.746 2.910 1.00 0.00 H new ATOM 0 HB2 GLU B 8 -1.748 7.968 3.474 1.00 0.00 H new ATOM 0 HB3 GLU B 8 -1.759 8.550 1.821 1.00 0.00 H new ATOM 0 HG2 GLU B 8 -3.948 9.692 2.229 1.00 0.00 H new ATOM 0 HG3 GLU B 8 -3.959 9.095 3.877 1.00 0.00 H new ATOM 630 N ARG B 9 -3.127 7.250 -0.286 1.00 0.00 N ATOM 631 CA ARG B 9 -3.596 7.408 -1.663 1.00 0.00 C ATOM 632 C ARG B 9 -4.275 6.134 -2.179 1.00 0.00 C ATOM 633 O ARG B 9 -5.414 6.208 -2.640 1.00 0.00 O ATOM 634 CB ARG B 9 -2.451 7.821 -2.652 1.00 0.00 C ATOM 635 CG ARG B 9 -1.685 9.122 -2.301 1.00 0.00 C ATOM 636 CD ARG B 9 -0.489 9.417 -3.225 1.00 0.00 C ATOM 637 NE ARG B 9 0.235 10.636 -2.706 1.00 0.00 N ATOM 638 CZ ARG B 9 1.504 11.025 -3.059 1.00 0.00 C ATOM 639 NH1 ARG B 9 2.267 10.341 -3.963 1.00 0.00 N ATOM 640 NH2 ARG B 9 2.024 12.149 -2.480 1.00 0.00 N ATOM 0 H ARG B 9 -2.108 7.238 -0.233 1.00 0.00 H new ATOM 0 HA ARG B 9 -4.325 8.218 -1.632 1.00 0.00 H new ATOM 0 HB2 ARG B 9 -1.732 7.003 -2.706 1.00 0.00 H new ATOM 0 HB3 ARG B 9 -2.881 7.934 -3.647 1.00 0.00 H new ATOM 0 HG2 ARG B 9 -2.379 9.962 -2.343 1.00 0.00 H new ATOM 0 HG3 ARG B 9 -1.328 9.055 -1.273 1.00 0.00 H new ATOM 0 HD2 ARG B 9 0.185 8.561 -3.255 1.00 0.00 H new ATOM 0 HD3 ARG B 9 -0.833 9.588 -4.245 1.00 0.00 H new ATOM 0 HE ARG B 9 -0.262 11.222 -2.035 1.00 0.00 H new ATOM 0 HH11 ARG B 9 1.899 9.501 -4.409 1.00 0.00 H new ATOM 0 HH12 ARG B 9 3.205 10.671 -4.192 1.00 0.00 H new ATOM 0 HH21 ARG B 9 1.472 12.676 -1.804 1.00 0.00 H new ATOM 0 HH22 ARG B 9 2.964 12.460 -2.724 1.00 0.00 H new ATOM 654 N ARG B 10 -3.601 4.939 -2.100 1.00 0.00 N ATOM 655 CA ARG B 10 -4.088 3.626 -2.525 1.00 0.00 C ATOM 656 C ARG B 10 -5.416 3.253 -1.841 1.00 0.00 C ATOM 657 O ARG B 10 -6.328 2.820 -2.536 1.00 0.00 O ATOM 658 CB ARG B 10 -2.987 2.528 -2.329 1.00 0.00 C ATOM 659 CG ARG B 10 -3.323 1.086 -2.795 1.00 0.00 C ATOM 660 CD ARG B 10 -2.148 0.095 -2.655 1.00 0.00 C ATOM 661 NE ARG B 10 -2.626 -1.334 -2.799 1.00 0.00 N ATOM 662 CZ ARG B 10 -2.658 -2.096 -3.938 1.00 0.00 C ATOM 663 NH1 ARG B 10 -2.233 -1.660 -5.156 1.00 0.00 N ATOM 664 NH2 ARG B 10 -3.136 -3.373 -3.819 1.00 0.00 N ATOM 0 H ARG B 10 -2.658 4.888 -1.715 1.00 0.00 H new ATOM 0 HA ARG B 10 -4.302 3.683 -3.592 1.00 0.00 H new ATOM 0 HB2 ARG B 10 -2.091 2.852 -2.858 1.00 0.00 H new ATOM 0 HB3 ARG B 10 -2.735 2.489 -1.269 1.00 0.00 H new ATOM 0 HG2 ARG B 10 -4.169 0.715 -2.216 1.00 0.00 H new ATOM 0 HG3 ARG B 10 -3.638 1.116 -3.838 1.00 0.00 H new ATOM 0 HD2 ARG B 10 -1.395 0.309 -3.413 1.00 0.00 H new ATOM 0 HD3 ARG B 10 -1.670 0.227 -1.684 1.00 0.00 H new ATOM 0 HE ARG B 10 -2.964 -1.783 -1.948 1.00 0.00 H new ATOM 0 HH11 ARG B 10 -1.864 -0.715 -5.259 1.00 0.00 H new ATOM 0 HH12 ARG B 10 -2.284 -2.279 -5.965 1.00 0.00 H new ATOM 0 HH21 ARG B 10 -3.448 -3.718 -2.911 1.00 0.00 H new ATOM 0 HH22 ARG B 10 -3.180 -3.980 -4.638 1.00 0.00 H new ATOM 678 N ARG B 11 -5.560 3.452 -0.491 1.00 0.00 N ATOM 679 CA ARG B 11 -6.700 3.259 0.397 1.00 0.00 C ATOM 680 C ARG B 11 -7.925 3.891 -0.235 1.00 0.00 C ATOM 681 O ARG B 11 -8.874 3.159 -0.484 1.00 0.00 O ATOM 682 CB ARG B 11 -6.408 3.779 1.834 1.00 0.00 C ATOM 683 CG ARG B 11 -7.523 3.629 2.891 1.00 0.00 C ATOM 684 CD ARG B 11 -7.552 4.777 3.911 1.00 0.00 C ATOM 685 NE ARG B 11 -8.625 4.499 4.939 1.00 0.00 N ATOM 686 CZ ARG B 11 -8.434 3.965 6.191 1.00 0.00 C ATOM 687 NH1 ARG B 11 -7.200 3.642 6.681 1.00 0.00 N ATOM 688 NH2 ARG B 11 -9.531 3.740 6.975 1.00 0.00 N ATOM 0 H ARG B 11 -4.762 3.796 0.044 1.00 0.00 H new ATOM 0 HA ARG B 11 -6.895 2.194 0.520 1.00 0.00 H new ATOM 0 HB2 ARG B 11 -5.523 3.262 2.204 1.00 0.00 H new ATOM 0 HB3 ARG B 11 -6.153 4.836 1.763 1.00 0.00 H new ATOM 0 HG2 ARG B 11 -8.488 3.576 2.386 1.00 0.00 H new ATOM 0 HG3 ARG B 11 -7.388 2.686 3.420 1.00 0.00 H new ATOM 0 HD2 ARG B 11 -6.581 4.872 4.397 1.00 0.00 H new ATOM 0 HD3 ARG B 11 -7.750 5.723 3.407 1.00 0.00 H new ATOM 0 HE ARG B 11 -9.584 4.730 4.678 1.00 0.00 H new ATOM 0 HH11 ARG B 11 -6.369 3.795 6.110 1.00 0.00 H new ATOM 0 HH12 ARG B 11 -7.110 3.248 7.617 1.00 0.00 H new ATOM 0 HH21 ARG B 11 -10.462 3.968 6.627 1.00 0.00 H new ATOM 0 HH22 ARG B 11 -9.418 3.345 7.908 1.00 0.00 H new ATOM 702 N LYS B 12 -7.916 5.229 -0.544 1.00 0.00 N ATOM 703 CA LYS B 12 -8.976 5.997 -1.201 1.00 0.00 C ATOM 704 C LYS B 12 -9.594 5.227 -2.379 1.00 0.00 C ATOM 705 O LYS B 12 -10.802 4.977 -2.374 1.00 0.00 O ATOM 706 CB LYS B 12 -8.490 7.421 -1.642 1.00 0.00 C ATOM 707 CG LYS B 12 -8.172 8.405 -0.488 1.00 0.00 C ATOM 708 CD LYS B 12 -7.481 9.715 -0.944 1.00 0.00 C ATOM 709 CE LYS B 12 -7.055 10.682 0.183 1.00 0.00 C ATOM 710 NZ LYS B 12 -8.216 11.284 0.887 1.00 0.00 N ATOM 0 H LYS B 12 -7.112 5.814 -0.319 1.00 0.00 H new ATOM 0 HA LYS B 12 -9.760 6.142 -0.458 1.00 0.00 H new ATOM 0 HB2 LYS B 12 -7.596 7.307 -2.255 1.00 0.00 H new ATOM 0 HB3 LYS B 12 -9.256 7.867 -2.276 1.00 0.00 H new ATOM 0 HG2 LYS B 12 -9.100 8.656 0.026 1.00 0.00 H new ATOM 0 HG3 LYS B 12 -7.532 7.903 0.237 1.00 0.00 H new ATOM 0 HD2 LYS B 12 -6.597 9.453 -1.525 1.00 0.00 H new ATOM 0 HD3 LYS B 12 -8.157 10.245 -1.615 1.00 0.00 H new ATOM 0 HE2 LYS B 12 -6.436 10.146 0.903 1.00 0.00 H new ATOM 0 HE3 LYS B 12 -6.438 11.476 -0.238 1.00 0.00 H new ATOM 0 HZ1 LYS B 12 -7.876 11.924 1.633 1.00 0.00 H new ATOM 0 HZ2 LYS B 12 -8.794 11.819 0.208 1.00 0.00 H new ATOM 0 HZ3 LYS B 12 -8.792 10.531 1.314 1.00 0.00 H new ATOM 724 N LEU B 13 -8.759 4.794 -3.373 1.00 0.00 N ATOM 725 CA LEU B 13 -9.137 4.007 -4.543 1.00 0.00 C ATOM 726 C LEU B 13 -9.608 2.609 -4.202 1.00 0.00 C ATOM 727 O LEU B 13 -10.680 2.214 -4.653 1.00 0.00 O ATOM 728 CB LEU B 13 -8.088 3.964 -5.667 1.00 0.00 C ATOM 729 CG LEU B 13 -7.800 5.346 -6.332 1.00 0.00 C ATOM 730 CD1 LEU B 13 -9.040 6.269 -6.563 1.00 0.00 C ATOM 731 CD2 LEU B 13 -6.595 6.072 -5.679 1.00 0.00 C ATOM 0 H LEU B 13 -7.761 5.006 -3.359 1.00 0.00 H new ATOM 0 HA LEU B 13 -9.986 4.562 -4.942 1.00 0.00 H new ATOM 0 HB2 LEU B 13 -7.156 3.567 -5.263 1.00 0.00 H new ATOM 0 HB3 LEU B 13 -8.424 3.268 -6.435 1.00 0.00 H new ATOM 0 HG LEU B 13 -7.507 5.094 -7.351 1.00 0.00 H new ATOM 0 HD11 LEU B 13 -8.719 7.200 -7.030 1.00 0.00 H new ATOM 0 HD12 LEU B 13 -9.753 5.764 -7.214 1.00 0.00 H new ATOM 0 HD13 LEU B 13 -9.514 6.488 -5.606 1.00 0.00 H new ATOM 0 HD21 LEU B 13 -6.434 7.029 -6.176 1.00 0.00 H new ATOM 0 HD22 LEU B 13 -6.802 6.242 -4.622 1.00 0.00 H new ATOM 0 HD23 LEU B 13 -5.701 5.456 -5.779 1.00 0.00 H new ATOM 743 N ALA B 14 -8.836 1.844 -3.378 1.00 0.00 N ATOM 744 CA ALA B 14 -9.111 0.505 -2.887 1.00 0.00 C ATOM 745 C ALA B 14 -10.491 0.418 -2.289 1.00 0.00 C ATOM 746 O ALA B 14 -11.240 -0.490 -2.665 1.00 0.00 O ATOM 747 CB ALA B 14 -8.120 0.020 -1.820 1.00 0.00 C ATOM 0 H ALA B 14 -7.945 2.194 -3.027 1.00 0.00 H new ATOM 0 HA ALA B 14 -9.017 -0.133 -3.765 1.00 0.00 H new ATOM 0 HB1 ALA B 14 -8.391 -0.987 -1.503 1.00 0.00 H new ATOM 0 HB2 ALA B 14 -7.113 0.011 -2.236 1.00 0.00 H new ATOM 0 HB3 ALA B 14 -8.152 0.691 -0.962 1.00 0.00 H new ATOM 753 N ILE B 15 -10.861 1.395 -1.384 1.00 0.00 N ATOM 754 CA ILE B 15 -12.169 1.481 -0.780 1.00 0.00 C ATOM 755 C ILE B 15 -13.174 1.592 -1.920 1.00 0.00 C ATOM 756 O ILE B 15 -13.993 0.689 -2.057 1.00 0.00 O ATOM 757 CB ILE B 15 -12.507 2.533 0.306 1.00 0.00 C ATOM 758 CG1 ILE B 15 -11.435 2.776 1.414 1.00 0.00 C ATOM 759 CG2 ILE B 15 -13.838 2.068 0.956 1.00 0.00 C ATOM 760 CD1 ILE B 15 -11.090 4.253 1.525 1.00 0.00 C ATOM 0 H ILE B 15 -10.226 2.132 -1.077 1.00 0.00 H new ATOM 0 HA ILE B 15 -12.206 0.577 -0.172 1.00 0.00 H new ATOM 0 HB ILE B 15 -12.563 3.499 -0.196 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -11.808 2.413 2.372 1.00 0.00 H new ATOM 0 HG13 ILE B 15 -10.535 2.205 1.186 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -14.129 2.774 1.734 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -14.618 2.023 0.196 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -13.703 1.080 1.395 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -10.341 4.394 2.304 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -10.694 4.607 0.573 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -11.987 4.818 1.777 1.00 0.00 H new ATOM 772 N GLU B 16 -13.095 2.688 -2.741 1.00 0.00 N ATOM 773 CA GLU B 16 -13.961 3.010 -3.858 1.00 0.00 C ATOM 774 C GLU B 16 -14.281 1.815 -4.782 1.00 0.00 C ATOM 775 O GLU B 16 -15.450 1.629 -5.127 1.00 0.00 O ATOM 776 CB GLU B 16 -13.413 4.251 -4.661 1.00 0.00 C ATOM 777 CG GLU B 16 -14.412 4.914 -5.640 1.00 0.00 C ATOM 778 CD GLU B 16 -13.773 6.124 -6.332 1.00 0.00 C ATOM 779 OE1 GLU B 16 -13.540 7.156 -5.648 1.00 0.00 O ATOM 780 OE2 GLU B 16 -13.518 6.030 -7.563 1.00 0.00 O ATOM 0 H GLU B 16 -12.371 3.394 -2.608 1.00 0.00 H new ATOM 0 HA GLU B 16 -14.921 3.282 -3.419 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -13.080 5.004 -3.947 1.00 0.00 H new ATOM 0 HB3 GLU B 16 -12.535 3.936 -5.225 1.00 0.00 H new ATOM 0 HG2 GLU B 16 -14.731 4.188 -6.388 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -15.305 5.228 -5.099 1.00 0.00 H new