==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN/IMMUNE SYSTEM 04-JUN-04 1TJG . COMPND 2 MOLECULE: FAB 2F5 LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.OFEK,M.TANG,A.SAMBOR,H.KATINGER,J.R.MASCOLA,R.WYATT, . 458 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20709.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 293 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 180 39.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 39 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 7 5 2 4 9 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 5 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 L A 0 0 112 0, 0.0 2,-0.4 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 172.1 25.5 -22.5 68.7 2 2 L L - 0 0 8 93,-0.4 2,-0.4 88,-0.1 88,-0.1 -0.602 360.0-141.0 -76.6 123.4 21.9 -22.1 69.9 3 3 L Q - 0 0 130 -2,-0.4 23,-1.8 94,-0.0 2,-0.5 -0.716 12.2-162.4 -90.3 131.9 19.9 -19.9 67.5 4 4 L L E -A 25 0A 13 -2,-0.4 2,-0.6 94,-0.4 96,-0.5 -0.957 3.0-165.3-115.0 122.0 17.4 -17.4 68.9 5 5 L T E -A 24 0A 75 19,-3.1 19,-2.2 -2,-0.5 2,-0.3 -0.926 3.7-163.5-111.6 117.4 14.8 -16.0 66.6 6 6 L Q E -A 23 0A 16 -2,-0.6 17,-0.2 17,-0.2 94,-0.1 -0.752 18.4-124.2 -97.8 144.8 12.8 -12.9 67.7 7 7 L S E S+A 22 0A 42 15,-2.5 15,-2.9 -2,-0.3 2,-0.1 -0.994 80.2 23.6-148.9 139.8 9.6 -11.9 66.0 8 8 L P - 0 0 54 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.636 66.1-155.0 -79.5 167.0 8.5 -9.6 64.7 9 9 L S S S+ 0 0 92 1,-0.2 94,-1.9 93,-0.1 2,-0.3 0.808 86.0 20.7 -72.7 -28.0 11.8 -8.0 63.7 10 10 L S E S-d 103 0B 24 92,-0.2 2,-0.4 75,-0.0 -1,-0.2 -0.999 72.7-167.0-142.3 140.4 10.1 -4.6 63.6 11 11 L L E -d 104 0B 27 92,-3.0 94,-2.6 -2,-0.3 2,-0.5 -0.991 10.4-151.1-137.7 134.9 6.9 -3.5 65.4 12 12 L S E +d 105 0B 32 -2,-0.4 2,-0.3 92,-0.2 94,-0.2 -0.866 32.3 150.9-102.8 131.5 4.6 -0.5 65.0 13 13 L A E -d 106 0B 5 92,-2.4 94,-2.5 -2,-0.5 2,-0.3 -0.967 34.3-129.4-154.4 168.0 2.7 0.7 68.0 14 14 L S > - 0 0 46 -2,-0.3 3,-2.0 92,-0.2 64,-0.3 -0.847 43.5 -83.8-120.7 157.2 1.1 3.7 69.8 15 15 L V T 3 S+ 0 0 84 -2,-0.3 64,-0.2 1,-0.3 3,-0.1 -0.276 116.2 27.0 -57.4 142.4 1.4 4.9 73.4 16 16 L G T 3 S+ 0 0 39 62,-3.2 -1,-0.3 1,-0.3 63,-0.1 0.298 95.4 126.3 86.7 -10.8 -1.0 3.0 75.7 17 17 L D < - 0 0 72 -3,-2.0 61,-2.5 60,-0.2 2,-0.5 -0.381 60.3-123.2 -82.0 161.4 -1.0 -0.1 73.5 18 18 L R - 0 0 167 59,-0.2 2,-0.3 -3,-0.1 58,-0.2 -0.882 33.9-178.6-102.0 128.4 -0.3 -3.6 74.5 19 19 L I E - B 0 75A 12 56,-1.6 56,-1.9 -2,-0.5 2,-0.4 -0.933 14.0-159.5-129.4 155.6 2.5 -5.4 72.6 20 20 L T E - B 0 74A 56 -2,-0.3 2,-0.4 54,-0.2 54,-0.2 -0.995 1.5-165.5-137.1 131.2 4.1 -8.8 72.6 21 21 L I E - B 0 73A 2 52,-2.6 52,-2.5 -2,-0.4 2,-0.3 -0.940 12.5-152.4-115.2 137.2 7.5 -9.9 71.3 22 22 L T E -AB 7 72A 26 -15,-2.9 -15,-2.5 -2,-0.4 2,-0.4 -0.807 8.8-168.0-112.5 151.2 8.3 -13.6 70.8 23 23 L a E -AB 6 71A 0 48,-2.4 48,-2.4 -2,-0.3 2,-0.4 -0.999 5.5-166.4-136.2 132.5 11.7 -15.4 70.9 24 24 L R E -AB 5 70A 114 -19,-2.2 -19,-3.1 -2,-0.4 2,-0.3 -0.992 7.9-149.6-126.6 130.7 12.2 -19.0 69.7 25 25 L A E -A 4 0A 12 44,-1.4 -21,-0.2 -2,-0.4 3,-0.1 -0.711 22.4-126.2 -98.3 147.8 15.3 -21.1 70.5 26 26 L S S S+ 0 0 70 -23,-1.8 2,-0.3 -2,-0.3 -1,-0.1 0.695 95.3 0.2 -63.4 -20.2 16.6 -23.8 68.2 27 27 L Q S S- 0 0 104 -24,-0.2 -1,-0.1 41,-0.2 41,-0.0 -0.970 103.7 -54.6-160.2 166.9 16.4 -26.1 71.2 28 28 L G + 0 0 36 -2,-0.3 41,-0.2 1,-0.1 3,-0.1 -0.181 37.9 171.7 -54.1 130.3 15.4 -26.2 74.8 29 29 L V > - 0 0 0 39,-2.2 3,-2.2 1,-0.4 62,-0.2 0.030 34.2-142.5-124.0 23.7 17.0 -23.6 77.1 30 30 L T T 3 - 0 0 76 1,-0.3 38,-2.1 2,-0.1 -1,-0.4 -0.269 67.0 -36.0 48.1-124.2 14.8 -24.4 80.1 31 31 L S T 3 S+ 0 0 41 36,-0.2 2,-2.3 -3,-0.1 -1,-0.3 0.232 101.8 120.0-111.4 12.7 14.1 -21.0 81.8 32 32 L A < + 0 0 2 -3,-2.2 59,-2.2 18,-0.2 60,-0.4 -0.392 43.8 120.9 -78.3 67.1 17.5 -19.5 81.2 33 33 L L E -E 90 0B 0 -2,-2.3 18,-3.6 57,-0.2 2,-0.3 -0.994 38.6-172.4-135.8 133.5 16.2 -16.5 79.1 34 34 L A E -E 89 0B 0 55,-2.6 55,-1.9 -2,-0.4 2,-0.4 -0.915 11.2-146.7-125.7 152.6 16.5 -12.8 79.7 35 35 L W E -EF 88 48B 0 13,-2.3 12,-3.1 -2,-0.3 13,-1.2 -0.965 15.6-173.3-120.6 136.7 15.0 -9.8 78.1 36 36 L Y E -EF 87 46B 0 51,-2.6 51,-2.0 -2,-0.4 2,-0.4 -0.907 15.5-146.2-127.6 154.8 16.6 -6.4 77.7 37 37 L R E -EF 86 45B 21 8,-2.5 8,-1.9 -2,-0.3 2,-0.4 -0.966 16.7-168.6-117.6 135.2 15.5 -2.9 76.4 38 38 L Q E -E 85 0B 16 47,-3.3 47,-2.4 -2,-0.4 3,-0.1 -0.979 5.1-163.0-132.2 124.8 18.0 -0.7 74.6 39 39 L K > - 0 0 78 4,-0.5 3,-2.0 -2,-0.4 45,-0.1 -0.718 43.4 -80.6 -98.5 151.9 17.6 2.9 73.7 40 40 L P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.186 115.1 10.9 -52.5 137.6 19.7 4.7 71.1 41 41 L G T 3 S+ 0 0 98 1,-0.2 -3,-0.0 -3,-0.1 0, 0.0 0.510 115.6 91.1 71.8 4.0 23.1 5.7 72.3 42 42 L S S < S- 0 0 38 -3,-2.0 -1,-0.2 1,-0.0 3,-0.1 -0.833 77.5-102.1-128.2 165.5 22.7 3.8 75.6 43 43 L P - 0 0 41 0, 0.0 -4,-0.5 0, 0.0 296,-0.1 -0.340 48.9 -82.6 -81.7 167.0 23.5 0.3 76.8 44 44 L P - 0 0 5 0, 0.0 2,-0.4 0, 0.0 293,-0.3 -0.319 41.8-150.4 -65.4 152.6 21.0 -2.6 77.2 45 45 L Q E -F 37 0B 94 -8,-1.9 -8,-2.5 291,-0.1 2,-0.2 -0.996 17.2-116.4-130.0 130.9 18.9 -2.6 80.4 46 46 L L E +F 36 0B 6 -2,-0.4 -10,-0.2 289,-0.4 3,-0.1 -0.450 38.3 162.1 -69.0 131.2 17.6 -5.8 82.0 47 47 L L E + 0 0 2 -12,-3.1 8,-2.2 1,-0.4 2,-0.4 0.764 66.5 15.6-110.2 -56.1 13.8 -6.2 82.2 48 48 L I E -FG 35 54B 0 -13,-1.2 -13,-2.3 6,-0.2 -1,-0.4 -0.974 62.7-168.5-127.1 135.8 13.1 -9.9 82.8 49 49 L Y E >> S+ G 0 53B 49 4,-2.6 4,-2.2 -2,-0.4 3,-0.5 -0.875 70.1 18.8-121.9 156.0 15.4 -12.6 84.1 50 50 L D T 34 S- 0 0 32 282,-1.9 2,-2.2 -2,-0.3 -1,-0.2 0.907 124.0 -71.9 53.4 46.4 14.9 -16.4 84.2 51 51 L A T 34 S+ 0 0 2 -18,-3.6 -1,-0.3 281,-0.3 21,-0.2 -0.106 128.7 20.7 68.0 -41.2 12.1 -16.2 81.6 52 52 L S T <4 S+ 0 0 74 -2,-2.2 12,-0.4 -3,-0.5 2,-0.3 0.482 86.7 114.4-136.6 -4.0 9.5 -14.6 83.9 53 53 L S E < -G 49 0B 35 -4,-2.2 -4,-2.6 -3,-0.1 2,-0.6 -0.558 60.5-130.1 -79.1 133.6 11.1 -12.9 86.9 54 54 L L E -G 48 0B 69 -2,-0.3 -6,-0.2 -6,-0.2 3,-0.1 -0.705 21.8-125.3 -84.1 119.0 10.8 -9.1 87.1 55 55 L E > - 0 0 27 -8,-2.2 3,-2.0 -2,-0.6 -1,-0.0 -0.365 38.0 -96.0 -62.2 138.6 14.1 -7.3 87.7 56 56 L S T 3 S+ 0 0 114 1,-0.3 -1,-0.1 -2,-0.0 0, 0.0 -0.278 110.7 23.5 -57.3 136.8 13.9 -5.1 90.7 57 57 L G T 3 S+ 0 0 80 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.275 92.0 123.5 90.7 -13.2 13.2 -1.5 89.8 58 58 L V S < S- 0 0 18 -3,-2.0 -1,-0.3 -11,-0.1 -11,-0.1 -0.695 71.5-103.3 -85.3 132.0 11.5 -2.4 86.5 59 59 L P > - 0 0 58 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.177 24.3-120.7 -53.3 141.9 7.9 -1.2 86.1 60 60 L S T 3 S+ 0 0 113 1,-0.3 16,-0.1 -6,-0.1 -2,-0.0 0.561 102.5 83.0 -63.0 -7.9 5.2 -3.8 86.5 61 61 L R T 3 S+ 0 0 31 14,-0.1 15,-2.4 16,-0.1 2,-0.4 0.743 78.8 79.2 -70.1 -19.4 4.0 -3.2 83.0 62 62 L F E < +C 75 0A 4 -3,-1.9 2,-0.3 13,-0.2 13,-0.2 -0.711 59.0 164.4 -89.4 137.4 6.7 -5.6 81.8 63 63 L S E -C 74 0A 62 11,-2.0 11,-2.9 -2,-0.4 2,-0.3 -0.988 16.1-162.0-149.5 151.9 6.1 -9.3 82.0 64 64 L G E +C 73 0A 10 -12,-0.4 2,-0.3 -2,-0.3 9,-0.2 -0.972 12.1 167.6-137.1 152.1 7.7 -12.4 80.6 65 65 L S E +C 72 0A 60 7,-2.1 7,-2.4 -2,-0.3 2,-0.2 -0.965 24.0 74.9-155.4 170.6 6.6 -16.0 80.1 66 66 L G E -C 71 0A 40 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.463 40.7-145.5 113.2 174.4 7.4 -19.3 78.5 67 67 L S E > +C 70 0A 84 3,-1.3 2,-1.1 -2,-0.2 3,-1.0 -0.933 62.0 20.6-173.3 155.3 10.0 -22.1 78.8 68 68 L G T 3 S- 0 0 23 -38,-2.1 -39,-2.2 -2,-0.3 -41,-0.2 -0.674 129.1 -16.0 84.5-100.0 11.8 -24.5 76.6 69 69 L T T 3 S+ 0 0 66 -2,-1.1 -44,-1.4 -41,-0.2 2,-0.4 0.377 123.9 66.3-122.5 -0.5 11.9 -23.1 73.1 70 70 L E E < +BC 24 67A 101 -3,-1.0 -3,-1.3 -46,-0.2 2,-0.3 -0.971 53.5 161.8-132.9 123.8 9.2 -20.4 73.2 71 71 L F E -BC 23 66A 0 -48,-2.4 -48,-2.4 -2,-0.4 2,-0.3 -0.960 14.7-162.3-136.0 151.8 9.2 -17.2 75.2 72 72 L T E -BC 22 65A 32 -7,-2.4 -7,-2.1 -2,-0.3 2,-0.4 -0.975 7.5-155.6-136.2 150.5 7.3 -13.9 75.1 73 73 L L E -BC 21 64A 2 -52,-2.5 -52,-2.6 -2,-0.3 2,-0.4 -0.976 18.9-168.2-121.1 136.0 7.8 -10.4 76.5 74 74 L T E -BC 20 63A 9 -11,-2.9 -11,-2.0 -2,-0.4 2,-0.5 -0.975 19.7-162.9-132.1 143.0 4.8 -8.2 77.0 75 75 L I E -BC 19 62A 1 -56,-1.9 -56,-1.6 -2,-0.4 3,-0.3 -0.954 11.6-160.8-121.4 105.3 4.3 -4.6 77.8 76 76 L S S S+ 0 0 49 -15,-2.4 2,-0.5 -2,-0.5 -1,-0.2 0.914 81.8 16.4 -52.9 -53.0 0.7 -4.1 79.1 77 77 L T S S- 0 0 52 -59,-0.1 -1,-0.3 -16,-0.1 -59,-0.2 -0.953 86.5-132.2-128.8 111.4 0.6 -0.4 78.5 78 78 L L - 0 0 0 -61,-2.5 -62,-3.2 -2,-0.5 -61,-0.1 -0.366 21.7-160.7 -66.3 135.3 3.2 1.1 76.2 79 79 L R > - 0 0 92 -64,-0.2 3,-2.4 -2,-0.1 4,-0.3 -0.789 32.1-107.8-114.1 157.9 5.0 4.3 77.4 80 80 L P G > S+ 0 0 79 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.874 120.7 55.1 -50.5 -42.3 7.0 6.9 75.4 81 81 L E G 3 S+ 0 0 89 1,-0.3 -3,-0.0 -42,-0.0 0, 0.0 0.603 94.2 72.9 -70.1 -8.4 10.2 5.6 76.8 82 82 L D G < + 0 0 0 -3,-2.4 2,-1.2 2,-0.1 -1,-0.3 0.564 64.6 104.0 -84.1 -8.2 9.3 2.1 75.5 83 83 L F < + 0 0 45 -3,-1.4 2,-0.2 -4,-0.3 22,-0.1 -0.640 62.6 88.2 -76.6 101.3 10.0 3.0 71.9 84 84 L A S S- 0 0 8 -2,-1.2 20,-2.7 18,-0.1 2,-0.4 -0.857 81.6 -62.8-166.6-162.5 13.3 1.2 71.5 85 85 L T E -EH 38 103B 32 -47,-2.4 -47,-3.3 -2,-0.2 2,-0.4 -0.881 41.2-157.7-108.9 139.9 14.9 -2.1 70.6 86 86 L Y E -EH 37 102B 0 16,-2.5 16,-2.0 -2,-0.4 2,-0.3 -0.915 7.5-169.8-118.1 144.5 14.4 -5.3 72.7 87 87 L Y E -E 36 0B 13 -51,-2.0 -51,-2.6 -2,-0.4 2,-0.3 -0.984 11.9-149.8-134.6 143.0 16.6 -8.3 72.8 88 88 L a E -E 35 0B 0 -2,-0.3 11,-2.2 -53,-0.2 2,-0.3 -0.761 15.3-167.9-104.5 156.9 16.4 -11.8 74.3 89 89 L Q E -EI 34 98B 0 -55,-1.9 -55,-2.6 -2,-0.3 2,-0.4 -0.989 10.1-148.5-144.0 137.5 19.4 -13.7 75.6 90 90 L Q E +EI 33 97B 0 7,-2.3 7,-1.1 -2,-0.3 -57,-0.2 -0.889 13.5 179.3-108.0 139.4 19.8 -17.4 76.5 91 91 L L + 0 0 0 -59,-2.2 367,-0.2 -2,-0.4 -58,-0.1 -0.058 60.3 92.4-126.5 31.7 22.2 -18.4 79.2 92 92 L H S S+ 0 0 25 -60,-0.4 364,-3.0 1,-0.2 2,-0.3 0.781 90.1 35.4 -91.7 -34.2 21.6 -22.2 79.3 93 93 L F B S-J 455 0C 41 362,-0.3 362,-0.2 -61,-0.2 -1,-0.2 -0.903 93.2 -89.7-122.1 150.1 24.3 -23.1 76.8 94 94 L Y S S+ 0 0 18 360,-3.7 2,-0.1 -2,-0.3 -3,-0.1 -0.860 108.0 46.3 -97.6 135.9 27.8 -21.7 76.1 95 95 L P S S- 0 0 18 0, 0.0 -93,-0.4 0, 0.0 -2,-0.2 0.567 91.6-137.3 -80.3 152.9 28.2 -19.5 74.2 96 96 L H - 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