==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 27-DEC-08 3FO2 . COMPND 2 MOLECULE: CATALYTIC ANTIBODY FAB 13G5 KAPPA LIGHT CHAIN CHI . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS, HOMO SAPIENS; . AUTHOR E.W.DEBLER,I.A.WILSON . 860 6 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37291.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 553 64.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 351 40.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 9 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 85 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 22 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 4 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 RESIDUES PER ALPHA HELIX . 0 2 0 0 2 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 . 8 8 9 7 10 16 2 0 2 2 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 10 2 2 2 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 E 0 0 96 0, 0.0 2,-0.4 0, 0.0 441,-0.2 0.000 360.0 360.0 360.0 100.0 -27.4 11.8 35.0 2 2 L L - 0 0 5 98,-0.3 2,-0.5 97,-0.1 93,-0.1 -0.587 360.0-151.1 -76.2 126.9 -27.7 8.7 37.2 3 3 L V - 0 0 31 -2,-0.4 23,-1.6 99,-0.0 2,-0.5 -0.875 1.5-153.8-100.5 132.3 -25.4 5.8 36.2 4 4 L M E -A 25 0A 10 -2,-0.5 2,-0.6 99,-0.4 101,-0.4 -0.912 8.2-157.9-102.2 122.3 -26.3 2.2 36.8 5 5 L T E -A 24 0A 18 19,-3.9 19,-2.9 -2,-0.5 2,-0.5 -0.918 10.0-171.3-108.4 116.1 -23.3 -0.2 37.3 6 6 L Q E -A 23 0A 5 -2,-0.6 17,-0.2 17,-0.2 99,-0.1 -0.924 14.8-136.7-111.3 129.6 -24.1 -3.8 36.6 7 7 L T E +A 22 0A 23 15,-2.2 15,-2.7 -2,-0.5 2,-0.1 -0.951 66.2 31.5-138.6 159.0 -21.7 -6.5 37.3 8 8 L P - 0 0 37 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.759 60.4-152.3 -74.4 172.2 -20.5 -9.0 36.3 9 9 L L S S+ 0 0 79 1,-0.3 99,-2.7 425,-0.2 2,-0.3 0.817 86.7 18.1 -73.2 -36.3 -20.5 -8.4 32.5 10 10 L S E -d 108 0B 56 97,-0.2 -1,-0.3 424,-0.1 99,-0.2 -0.992 67.9-168.1-140.0 144.0 -20.7 -12.1 31.9 11 11 L L E -d 109 0B 30 97,-2.9 99,-1.7 -2,-0.3 2,-0.4 -0.841 3.5-164.9-137.7 88.2 -21.7 -14.8 34.4 12 12 L P E +d 110 0B 65 0, 0.0 2,-0.3 0, 0.0 99,-0.2 -0.658 21.0 174.1 -73.4 131.6 -21.1 -18.4 33.5 13 13 L V E -d 111 0B 8 97,-2.8 99,-2.5 -2,-0.4 3,-0.1 -0.995 29.8-116.1-140.4 138.0 -23.1 -20.6 35.8 14 14 L S E > -d 112 0B 43 -2,-0.3 3,-2.1 97,-0.2 69,-0.2 -0.292 45.8 -87.0 -64.6 151.5 -23.7 -24.4 36.0 15 15 L L T 3 S+ 0 0 86 97,-1.8 69,-0.2 1,-0.3 -1,-0.1 -0.409 117.0 16.3 -58.4 128.3 -27.2 -25.8 35.4 16 16 L G T 3 S+ 0 0 44 67,-3.1 66,-0.5 1,-0.3 -1,-0.3 0.310 102.1 114.8 86.4 -7.0 -29.0 -25.8 38.8 17 17 L D S < S- 0 0 88 -3,-2.1 66,-3.1 65,-0.2 2,-0.4 -0.352 70.9 -96.5 -82.0 172.6 -26.6 -23.4 40.5 18 18 L Q - 0 0 108 64,-0.2 2,-0.4 63,-0.2 63,-0.2 -0.762 30.2-160.6 -92.2 133.3 -27.3 -19.9 41.8 19 19 L A E - B 0 80A 2 61,-2.6 61,-2.6 -2,-0.4 2,-0.4 -0.891 4.9-167.6-109.2 144.4 -26.6 -16.9 39.8 20 20 L S E - B 0 79A 54 -2,-0.4 2,-0.4 59,-0.2 59,-0.2 -0.983 1.8-170.4-138.5 120.0 -26.3 -13.5 41.5 21 21 L I E - B 0 78A 1 57,-3.0 57,-2.6 -2,-0.4 2,-0.4 -0.906 9.5-149.6-113.3 140.3 -26.2 -10.2 39.6 22 22 L S E -AB 7 77A 22 -15,-2.7 -15,-2.2 -2,-0.4 2,-0.4 -0.876 12.0-175.6-115.6 141.4 -25.4 -6.9 41.1 23 23 L a E -AB 6 76A 0 53,-2.9 53,-2.6 -2,-0.4 2,-0.4 -0.992 6.7-174.4-134.7 121.4 -26.7 -3.4 40.1 24 24 L R E -AB 5 75A 103 -19,-2.9 -19,-3.9 -2,-0.4 2,-0.3 -0.968 12.6-145.7-117.0 136.9 -25.3 -0.3 41.9 25 25 L S E -A 4 0A 10 49,-2.0 -21,-0.2 -2,-0.4 4,-0.1 -0.737 18.3-129.6 -97.4 152.1 -26.6 3.2 41.3 26 26 L S S S+ 0 0 15 -23,-1.6 2,-0.3 -2,-0.3 -22,-0.1 0.680 95.1 10.9 -72.4 -20.0 -24.5 6.4 41.4 27 27 L Q S S- 0 0 91 -24,-0.2 -2,-0.0 46,-0.1 -1,-0.0 -0.932 105.2 -67.3-143.8 170.5 -27.0 8.0 43.8 28 28 L S - 0 0 51 -2,-0.3 46,-0.2 1,-0.1 -2,-0.1 -0.318 33.3-161.2 -61.7 136.3 -30.0 6.8 45.8 29 29 L I + 0 0 0 44,-2.0 2,-0.7 2,-0.1 8,-0.6 0.019 50.7 124.8-106.9 22.9 -32.9 5.7 43.6 30 30 L V B -J 36 0C 63 6,-0.2 6,-0.3 7,-0.0 5,-0.1 -0.777 60.3-137.0 -76.9 116.2 -35.4 6.0 46.5 31 31 L H > - 0 0 47 4,-3.6 3,-1.7 -2,-0.7 67,-0.1 -0.366 18.2-111.6 -67.1 158.6 -38.0 8.4 45.0 32 32 L S T 3 S+ 0 0 120 1,-0.3 -1,-0.1 65,-0.2 4,-0.1 0.594 119.3 63.9 -68.3 -12.0 -39.3 11.2 47.3 33 33 L N T 3 S- 0 0 85 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.383 122.2-109.4 -90.2 2.7 -42.7 9.4 47.2 34 34 L G S < S+ 0 0 53 -3,-1.7 2,-0.2 1,-0.3 -2,-0.1 0.164 83.1 116.5 94.5 -16.4 -40.9 6.5 49.0 35 35 L N - 0 0 51 -5,-0.1 -4,-3.6 62,-0.0 2,-0.5 -0.541 54.3-149.6 -77.9 153.7 -40.9 4.0 46.1 36 36 L T B -J 30 0C 23 -6,-0.3 2,-1.7 -2,-0.2 -6,-0.2 -0.971 11.3-151.4-121.9 108.4 -37.6 2.9 44.6 37 37 L Y + 0 0 10 -8,-0.6 59,-2.2 -2,-0.5 2,-0.5 -0.482 36.9 147.6 -89.3 71.5 -38.3 2.1 40.9 38 38 L L E -E 95 0B 0 -2,-1.7 18,-2.9 57,-0.2 2,-0.3 -0.924 20.2-179.6-107.5 132.4 -35.7 -0.6 40.0 39 39 L Q E -E 94 0B 1 55,-2.5 55,-2.0 -2,-0.5 2,-0.4 -0.874 19.2-146.0-128.3 156.7 -36.6 -3.2 37.5 40 40 L W E -EF 93 53B 0 13,-1.9 12,-2.8 -2,-0.3 13,-1.6 -0.990 17.4-171.1-123.5 131.5 -34.8 -6.2 36.1 41 41 L Y E -EF 92 51B 0 51,-2.8 51,-2.2 -2,-0.4 2,-0.4 -0.872 11.2-149.1-116.6 153.9 -35.4 -7.3 32.5 42 42 L L E -EF 91 50B 3 8,-2.5 8,-2.0 -2,-0.3 2,-0.6 -0.997 5.4-166.0-124.2 126.6 -34.2 -10.4 30.6 43 43 L Q E -EF 90 49B 19 47,-2.8 47,-2.6 -2,-0.4 3,-0.1 -0.941 12.4-160.8-111.4 106.0 -33.5 -10.4 26.9 44 44 L K > - 0 0 19 -2,-0.6 3,-2.0 4,-0.5 45,-0.2 -0.452 40.3 -73.1 -81.3 158.6 -33.3 -13.9 25.5 45 45 L P T 3 S+ 0 0 36 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.282 120.5 4.7 -54.6 133.3 -31.5 -14.6 22.2 46 46 L G T 3 S+ 0 0 88 1,-0.2 2,-0.3 -3,-0.1 -2,-0.1 0.733 115.4 109.2 60.3 27.0 -33.6 -13.4 19.3 47 47 L Q S < S- 0 0 94 -3,-2.0 -1,-0.2 3,-0.0 3,-0.1 -0.880 71.1-112.0-131.1 161.0 -36.1 -11.9 21.7 48 48 L S - 0 0 27 -2,-0.3 -4,-0.5 1,-0.1 282,-0.1 -0.539 54.0 -88.2 -76.0 153.6 -37.4 -8.6 22.9 49 49 L P E -F 43 0B 5 0, 0.0 2,-0.4 0, 0.0 -6,-0.3 -0.284 43.1-153.8 -61.7 154.4 -36.7 -7.8 26.5 50 50 L K E -F 42 0B 85 -8,-2.0 -8,-2.5 -3,-0.1 2,-0.3 -0.991 17.7-111.8-136.5 142.4 -39.1 -9.0 29.2 51 51 L L E +F 41 0B 5 -2,-0.4 -10,-0.2 275,-0.3 3,-0.1 -0.529 38.1 161.5 -76.6 129.6 -39.9 -7.7 32.6 52 52 L L E + 0 0 4 -12,-2.8 8,-2.9 1,-0.4 2,-0.3 0.782 65.0 16.4-109.0 -51.4 -38.9 -9.9 35.6 53 53 L I E -FG 40 59B 0 -13,-1.6 -13,-1.9 6,-0.2 -1,-0.4 -0.962 59.8-173.6-132.0 140.6 -38.8 -7.8 38.6 54 54 L Y E > S+ G 0 58B 42 4,-2.4 4,-2.1 -2,-0.3 3,-0.4 -0.961 70.3 19.7-131.6 155.2 -40.3 -4.3 39.4 55 55 L K T 4 S- 0 0 50 268,-0.5 2,-2.4 -2,-0.3 -16,-0.2 0.920 122.2 -74.0 51.0 47.8 -40.0 -2.1 42.4 56 56 L V T 4 S+ 0 0 15 -18,-2.9 -1,-0.2 1,-0.2 21,-0.1 -0.218 127.9 25.9 72.7 -51.2 -36.7 -4.0 43.5 57 57 L S T 4 S+ 0 0 69 -2,-2.4 2,-0.5 -3,-0.4 12,-0.3 0.445 87.4 108.3-129.2 -1.6 -38.4 -7.1 44.8 58 58 L N E < -G 54 0B 60 -4,-2.1 -4,-2.4 10,-0.1 2,-0.4 -0.716 58.3-135.9 -92.8 128.8 -41.7 -7.8 43.1 59 59 L R E -G 53 0B 95 -2,-0.5 -6,-0.2 -6,-0.2 3,-0.1 -0.650 18.3-125.9 -78.7 130.3 -42.0 -10.6 40.5 60 60 L F > - 0 0 36 -8,-2.9 3,-2.2 -2,-0.4 -1,-0.1 -0.374 47.1 -78.1 -67.3 154.9 -43.9 -9.9 37.3 61 61 L S T 3 S+ 0 0 100 1,-0.3 -1,-0.1 -2,-0.1 0, 0.0 -0.271 120.3 21.9 -61.7 136.1 -46.7 -12.3 36.6 62 62 L G T 3 S+ 0 0 82 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.221 88.5 131.1 92.2 -14.4 -45.4 -15.6 35.2 63 63 L V < - 0 0 17 -3,-2.2 -1,-0.3 -11,-0.1 -4,-0.1 -0.609 60.8-120.3 -77.0 120.4 -42.0 -15.1 36.7 64 64 L P > - 0 0 48 0, 0.0 3,-1.9 0, 0.0 -4,-0.1 -0.200 18.8-112.2 -62.1 152.4 -40.9 -18.3 38.5 65 65 L D T 3 S+ 0 0 129 1,-0.3 16,-0.1 -6,-0.0 -2,-0.1 0.515 108.1 80.5 -57.0 -13.4 -40.1 -18.2 42.3 66 66 L R T 3 S+ 0 0 36 14,-0.1 15,-1.9 16,-0.1 2,-0.5 0.758 81.0 75.9 -68.5 -26.0 -36.4 -18.9 41.4 67 67 L F E < +C 80 0A 5 -3,-1.9 2,-0.4 13,-0.2 13,-0.2 -0.795 61.3 169.1 -91.7 126.5 -36.0 -15.2 40.6 68 68 L S E -C 79 0A 43 11,-2.3 11,-2.9 -2,-0.5 2,-0.4 -0.999 16.9-159.2-138.0 134.2 -35.7 -12.9 43.5 69 69 L G E +C 78 0A 7 -2,-0.4 2,-0.3 -12,-0.3 9,-0.2 -0.895 20.7 156.9-108.3 144.2 -34.8 -9.2 43.7 70 70 L S E +C 77 0A 53 7,-2.4 7,-2.1 -2,-0.4 2,-0.2 -0.889 14.6 91.3-150.1 179.8 -33.5 -7.4 46.7 71 71 L G E -C 76 0A 37 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.591 41.5-132.5 120.1 178.3 -31.5 -4.3 47.9 72 72 L S E > +C 75 0A 91 3,-2.0 3,-2.2 -2,-0.2 2,-1.0 -0.964 60.8 0.9-165.8 156.5 -32.1 -0.7 48.8 73 73 L G T 3 S- 0 0 20 -2,-0.3 -44,-2.0 1,-0.3 -46,-0.1 -0.504 131.8 -15.8 71.1 -97.2 -30.8 2.8 48.3 74 74 L T T 3 S+ 0 0 64 -2,-1.0 -49,-2.0 -46,-0.2 2,-0.5 0.352 122.4 77.4-118.8 0.1 -28.0 2.4 45.8 75 75 L D E < +BC 24 72A 60 -3,-2.2 -3,-2.0 -51,-0.2 2,-0.3 -0.953 52.0 167.2-126.4 122.5 -27.3 -1.4 46.0 76 76 L F E -BC 23 71A 0 -53,-2.6 -53,-2.9 -2,-0.5 2,-0.4 -0.968 13.3-165.2-138.3 145.1 -29.4 -4.1 44.4 77 77 L T E -BC 22 70A 30 -7,-2.1 -7,-2.4 -2,-0.3 2,-0.5 -0.981 8.9-157.8-132.3 137.5 -29.1 -7.8 43.6 78 78 L L E -BC 21 69A 0 -57,-2.6 -57,-3.0 -2,-0.4 2,-0.4 -0.977 18.7-168.1-106.5 130.1 -31.0 -10.3 41.3 79 79 L K E -BC 20 68A 76 -11,-2.9 -11,-2.3 -2,-0.5 2,-0.5 -0.973 11.4-169.0-121.2 136.7 -30.7 -13.9 42.4 80 80 L I E -BC 19 67A 0 -61,-2.6 -61,-2.6 -2,-0.4 3,-0.4 -0.974 10.7-160.8-124.0 109.8 -31.7 -16.9 40.3 81 81 L N S S+ 0 0 67 -15,-1.9 -63,-0.2 -2,-0.5 -64,-0.1 -0.523 74.4 14.3 -78.9 157.2 -31.7 -20.2 42.2 82 82 L R S S- 0 0 194 -66,-0.5 -1,-0.2 -2,-0.2 -64,-0.2 0.891 89.6-140.6 40.6 59.6 -31.6 -23.4 40.3 83 83 L V - 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