------------------------------------------------------------------------------------------------------------------------- Will print the top 5 alignments (based on backbone shifts) for each pairing of chains, as measured by a combination of score and contiguity. Some relevant parameters: HELIX min length: 5 STRAND min length: 3 shift-tolerance = -10 permissible-violations = 4 max-breaks = NIL retain-m = 100 best-n = 100 anglethresh = 0.5 septhresh = 5 min_length = 4 rmsd-tol = 9.9999999999999E12 Legend: score1 [score2] pairings L2ERR {Xbad/Xsig:Xtot} Breaks (score2 is the score from protein2's perspective, not the minimum of the two perspectives as in some earlier printouts.) Recall that "SIMILARITY" refers to similarities over all alignments not just the top ones. ------------------------------------------------------------------------------------------------------------------------- [5332, 473]: Comparing 1qhd_A and 1bvp_1, based on their crossing files. There are 30 (13 H + 17 S) secondary structure elements in 1qhd_A, of which 11 satisfy the size requirements. There are 22 (10 H + 12 S) secondary structure elements in 1bvp_1, of which 9 satisfy the size requirements. 2.92571 [ 2.54128] ((1 . 1) (2 . 2) (5 . 3) (6 . 5)) 8.465 {1/5:6} B:0 3.10103 [ 3.04739] ((1 . 1) (2 . 2) (5 . 3) (7 . 5) (8 . 19) (30 . 21)) 10.388 {3/10:15} B:0 3.13273 [ 2.83670] ((1 . 2) (6 . 4) (8 . 5) (29 . 22)) 7.951 {1/4:6} B:0 4.20730 [ 4.09709] ((5 . 3) (7 . 4) (8 . 5) (29 . 22)) 9.908 {2/5:6} B:0 6.71458 [ 6.68836] ((1 . 2) (6 . 4) (8 . 21) (30 . 3)) 10.760 {2/3:6} B:1 SIMILARITY (1/min{score1}): 0.3418 [and 1/min{score2}: 0.3935] [5332, 5332]: Comparing 1qhd_A and 1qhd_A, based on their crossing files. There are 30 (13 H + 17 S) secondary structure elements in 1qhd_A, of which 11 satisfy the size requirements. There are 30 (13 H + 17 S) secondary structure elements in 1qhd_A, of which 11 satisfy the size requirements. 1.00000 [ 1.00000] ((1 . 1) (2 . 2) (3 . 3) (4 . 4) (5 . 5) (6 . 6) (7 . 7) (8 . 8) (27 . 27) (29 . 29) (30 . 30)) 0.000 {0/48:55} B:0 2.20017 [ 2.20017] ((1 . 1) (2 . 2) (5 . 5) (7 . 6) (27 . 27)) 4.686 {0/9:10} B:0 2.20017 [ 2.20017] ((1 . 1) (2 . 2) (5 . 5) (6 . 7) (27 . 27)) 4.686 {0/9:10} B:0 4.20693 [ 4.20693] ((2 . 1) (4 . 3) (5 . 5) (6 . 6)) 7.013 {2/5:6} B:0 SIMILARITY (1/min{score1}): 1.0000 [and 1/min{score2}: 1.0000] [5332, 5996]: Comparing 1qhd_A and 1uf2_C, based on their crossing files. There are 30 (13 H + 17 S) secondary structure elements in 1qhd_A, of which 11 satisfy the size requirements. There are 27 (16 H + 11 S) secondary structure elements in 1uf2_C, of which 13 satisfy the size requirements. 1.37766 [ 1.62662] ((1 . 1) (2 . 2) (5 . 3) (6 . 6) (8 . 8) (27 . 24) (29 . 26) (30 . 27)) 6.532 {0/20:28} B:0 1.38475 [ 1.63094] ((1 . 1) (2 . 2) (5 . 3) (6 . 6) (8 . 8) (27 . 24) (29 . 25) (30 . 27)) 7.911 {1/22:28} B:0 1.58594 [ 1.86599] ((1 . 1) (5 . 2) (7 . 7) (8 . 8) (27 . 24) (29 . 25) (30 . 27)) 8.394 {1/16:21} B:0 1.58875 [ 1.86772] ((1 . 1) (2 . 2) (5 . 3) (8 . 8) (27 . 24) (29 . 25) (30 . 27)) 8.396 {1/15:21} B:0 1.85528 [ 2.18008] ((5 . 2) (7 . 7) (8 . 8) (27 . 24) (29 . 25) (30 . 27)) 8.182 {1/12:15} B:0 SIMILARITY (1/min{score1}): 0.7259 [and 1/min{score2}: 0.6148] -------------------------------------------------------------------------------------------------------------------------