==== 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 3FO0 . 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 . 430 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19771.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 282 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 173 40.2 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 . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 51 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 2.6 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 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 0 RESIDUES PER ALPHA HELIX . 0 1 0 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 PARALLEL BRIDGES PER LADDER . 4 4 6 2 5 9 0 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 . 1 0 5 1 1 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 E 0 0 185 0, 0.0 2,-0.2 0, 0.0 98,-0.0 0.000 360.0 360.0 360.0 105.4 6.6 10.1 -36.6 2 2 L L - 0 0 10 98,-0.3 2,-0.4 97,-0.1 93,-0.1 -0.467 360.0-157.9 -73.6 131.8 7.1 6.8 -38.3 3 3 L V - 0 0 85 -2,-0.2 23,-1.9 99,-0.0 2,-0.6 -0.910 4.2-151.5-107.5 139.5 4.8 3.9 -37.3 4 4 L M E -A 25 0A 10 -2,-0.4 2,-0.7 99,-0.4 101,-0.4 -0.954 9.5-160.3-111.5 119.5 5.8 0.2 -37.8 5 5 L T E -A 24 0A 80 19,-3.7 19,-2.5 -2,-0.6 2,-0.5 -0.874 8.4-172.6-106.4 108.1 2.8 -2.1 -38.3 6 6 L Q E -A 23 0A 8 -2,-0.7 17,-0.2 17,-0.2 99,-0.1 -0.891 14.6-137.7-101.1 123.6 3.5 -5.8 -37.7 7 7 L T E +A 22 0A 63 15,-1.5 15,-2.3 -2,-0.5 2,-0.1 -0.915 67.6 32.0-124.5 156.5 1.0 -8.5 -38.5 8 8 L P - 0 0 48 0, 0.0 3,-0.1 0, 0.0 100,-0.1 0.738 59.3-154.6 -82.1 170.8 -0.1 -10.9 -37.4 9 9 L L S S+ 0 0 137 1,-0.2 99,-3.3 98,-0.2 2,-0.4 0.935 87.4 23.7 -67.5 -46.5 0.0 -10.5 -33.6 10 10 L S E -d 108 0B 66 97,-0.2 -1,-0.2 80,-0.0 99,-0.2 -0.979 68.6-167.1-123.9 137.5 0.2 -14.2 -33.0 11 11 L L E -d 109 0B 31 97,-4.1 99,-0.8 -2,-0.4 2,-0.3 -0.803 2.7-166.1-129.0 89.3 1.4 -16.8 -35.5 12 12 L P E +d 110 0B 63 0, 0.0 2,-0.4 0, 0.0 99,-0.2 -0.563 19.1 174.1 -71.1 131.2 0.7 -20.5 -34.8 13 13 L V E -d 111 0B 9 97,-2.3 99,-3.6 -2,-0.3 2,-0.1 -0.995 30.3-121.3-145.6 135.1 2.8 -22.7 -37.0 14 14 L S E > -d 112 0B 44 -2,-0.4 3,-1.9 97,-0.2 69,-0.3 -0.411 47.8 -88.1 -66.6 147.7 3.4 -26.5 -37.3 15 15 L L T 3 S+ 0 0 86 97,-1.6 69,-0.2 1,-0.3 -1,-0.1 -0.395 115.2 16.3 -56.9 127.1 7.0 -27.8 -36.9 16 16 L G T 3 S+ 0 0 42 67,-2.8 66,-0.5 1,-0.3 -1,-0.3 0.273 101.5 114.9 90.2 -10.3 8.7 -27.8 -40.3 17 17 L D S < S- 0 0 92 -3,-1.9 66,-2.9 65,-0.2 2,-0.4 -0.211 71.5 -95.8 -79.6 176.9 6.2 -25.5 -41.9 18 18 L Q - 0 0 106 64,-0.2 2,-0.4 63,-0.2 63,-0.2 -0.787 30.2-158.7 -98.6 142.4 6.9 -22.0 -43.2 19 19 L A E - B 0 80A 2 61,-2.5 61,-2.9 -2,-0.4 2,-0.5 -0.983 4.3-167.7-123.1 130.5 6.2 -18.8 -41.2 20 20 L S E - B 0 79A 62 -2,-0.4 2,-0.4 59,-0.2 59,-0.2 -0.970 2.5-170.1-122.3 120.7 5.8 -15.4 -42.8 21 21 L I E - B 0 78A 0 57,-3.1 57,-2.8 -2,-0.5 2,-0.4 -0.947 10.3-147.9-116.2 136.5 5.8 -12.1 -40.8 22 22 L S E -AB 7 77A 19 -15,-2.3 -15,-1.5 -2,-0.4 2,-0.4 -0.822 13.2-176.3-111.3 132.4 4.9 -8.7 -42.2 23 23 L a E -AB 6 76A 0 53,-2.8 53,-2.3 -2,-0.4 2,-0.4 -0.992 7.2-175.7-124.8 119.4 6.2 -5.3 -41.3 24 24 L R E -AB 5 75A 134 -19,-2.5 -19,-3.7 -2,-0.4 2,-0.4 -0.964 11.1-151.5-116.1 136.3 4.7 -2.2 -42.9 25 25 L S E -A 4 0A 9 49,-1.6 -21,-0.2 -2,-0.4 4,-0.1 -0.845 19.8-130.1-107.4 144.2 6.1 1.3 -42.3 26 26 L S S S+ 0 0 72 -23,-1.9 2,-0.3 -2,-0.4 -22,-0.1 0.615 93.1 14.9 -71.2 -11.9 3.9 4.4 -42.6 27 27 L Q S S- 0 0 87 -24,-0.2 -2,-0.1 46,-0.1 2,-0.1 -0.919 103.3 -69.6-145.9 169.4 6.5 6.1 -44.8 28 28 L S - 0 0 57 -2,-0.3 46,-0.2 1,-0.1 -2,-0.1 -0.370 32.6-160.5 -58.7 138.4 9.5 5.0 -46.9 29 29 L I + 0 0 0 44,-1.7 2,-0.7 -4,-0.1 8,-0.6 -0.014 49.5 125.6-112.9 26.7 12.4 4.0 -44.7 30 30 L V B -J 36 0C 62 6,-0.2 6,-0.2 2,-0.0 5,-0.1 -0.795 59.6-134.8 -81.6 116.2 15.0 4.4 -47.5 31 31 L H > - 0 0 33 4,-3.0 3,-2.4 -2,-0.7 67,-0.1 -0.318 21.3-107.9 -67.4 154.3 17.5 6.8 -46.0 32 32 L S T 3 S+ 0 0 124 1,-0.3 -1,-0.1 65,-0.2 -2,-0.0 0.702 121.0 62.5 -53.0 -22.4 18.8 9.7 -48.0 33 33 L N T 3 S- 0 0 62 2,-0.2 -1,-0.3 1,-0.0 3,-0.1 0.438 119.7-108.8 -85.7 2.2 22.1 7.7 -48.3 34 34 L G S < S+ 0 0 52 -3,-2.4 2,-0.2 1,-0.4 -2,-0.1 0.095 83.9 114.4 93.0 -22.2 20.3 4.9 -50.2 35 35 L N - 0 0 53 -5,-0.1 -4,-3.0 62,-0.0 2,-0.5 -0.508 56.3-146.9 -75.7 152.0 20.5 2.4 -47.3 36 36 L T B -J 30 0C 28 -6,-0.2 2,-1.5 -2,-0.2 -6,-0.2 -0.965 9.7-151.3-121.9 111.4 17.3 1.1 -45.7 37 37 L Y + 0 0 11 -8,-0.6 59,-2.5 -2,-0.5 2,-0.5 -0.596 37.1 144.7 -91.9 80.1 17.9 0.4 -42.0 38 38 L L E -E 95 0B 0 -2,-1.5 18,-2.9 57,-0.2 2,-0.3 -0.981 21.9-177.4-121.6 124.2 15.4 -2.3 -41.1 39 39 L E E -E 94 0B 4 55,-2.1 55,-1.5 -2,-0.5 2,-0.4 -0.826 16.8-144.5-117.6 154.7 16.3 -5.0 -38.5 40 40 L W E -EF 93 53B 0 13,-2.4 12,-3.0 -2,-0.3 13,-1.4 -0.988 17.2-169.2-120.6 133.3 14.6 -8.1 -37.2 41 41 L Y E -EF 92 51B 0 51,-2.6 51,-2.5 -2,-0.4 2,-0.5 -0.941 11.0-151.6-122.1 141.0 14.9 -9.2 -33.6 42 42 L L E -EF 91 50B 4 8,-2.8 8,-3.3 -2,-0.4 2,-0.6 -0.943 6.0-168.0-104.9 129.0 13.9 -12.4 -31.8 43 43 L Q E -E 90 0B 19 47,-2.1 47,-2.5 -2,-0.5 3,-0.1 -0.943 11.6-164.3-116.2 109.9 13.1 -12.4 -28.1 44 44 L K > - 0 0 31 -2,-0.6 3,-1.6 4,-0.5 45,-0.2 -0.446 41.7 -68.9 -82.1 159.8 12.9 -15.9 -26.7 45 45 L P T 3 S+ 0 0 35 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.282 119.7 1.4 -51.3 128.9 11.2 -16.7 -23.3 46 46 L G T 3 S+ 0 0 86 1,-0.2 2,-0.3 -3,-0.1 -2,-0.0 0.783 114.9 104.8 61.3 31.2 13.3 -15.4 -20.4 47 47 L Q S < S- 0 0 107 -3,-1.6 -1,-0.2 3,-0.0 3,-0.1 -0.943 72.4-107.6-137.9 158.7 15.9 -13.9 -22.8 48 48 L S - 0 0 28 -2,-0.3 -4,-0.5 1,-0.1 282,-0.1 -0.432 55.1 -79.8 -73.4 156.8 17.0 -10.5 -24.1 49 49 L P - 0 0 5 0, 0.0 2,-0.4 0, 0.0 -6,-0.3 -0.301 46.7-153.4 -53.8 140.1 16.2 -9.6 -27.8 50 50 L K E -F 42 0B 87 -8,-3.3 -8,-2.8 -3,-0.1 2,-0.3 -0.972 14.7-118.5-123.1 139.4 18.6 -11.1 -30.3 51 51 L L E +F 41 0B 4 -2,-0.4 -10,-0.2 275,-0.3 3,-0.1 -0.557 38.6 158.3 -75.4 128.4 19.5 -9.7 -33.8 52 52 L L E + 0 0 4 -12,-3.0 8,-3.3 1,-0.4 2,-0.4 0.771 64.4 20.2-109.9 -49.7 18.6 -11.9 -36.8 53 53 L I E -FG 40 59B 0 -13,-1.4 -13,-2.4 6,-0.2 -1,-0.4 -0.970 60.2-174.9-133.6 135.2 18.4 -9.6 -39.9 54 54 L Y E > + G 0 58B 39 4,-2.3 4,-2.0 -2,-0.4 3,-0.3 -0.969 67.5 17.3-132.2 151.7 19.8 -6.1 -40.5 55 55 L K T 4 S- 0 0 53 268,-0.5 2,-2.4 -2,-0.3 -1,-0.2 0.942 124.6 -68.7 53.7 50.0 19.5 -3.7 -43.4 56 56 L V T 4 S+ 0 0 10 -18,-2.9 -1,-0.3 1,-0.2 21,-0.1 -0.299 127.3 19.2 73.6 -56.1 16.4 -5.6 -44.7 57 57 L S T 4 S+ 0 0 72 -2,-2.4 2,-0.5 -3,-0.3 12,-0.2 0.400 85.4 111.7-134.0 6.1 18.0 -8.9 -45.8 58 58 L N E < -G 54 0B 59 -4,-2.0 -4,-2.3 -3,-0.1 2,-0.3 -0.732 59.5-132.4 -89.3 126.1 21.5 -9.5 -44.3 59 59 L R E -G 53 0B 99 -2,-0.5 -6,-0.2 -6,-0.2 2,-0.1 -0.564 18.5-124.0 -73.8 132.9 21.7 -12.4 -41.9 60 60 L F > - 0 0 34 -8,-3.3 3,-2.3 -2,-0.3 -1,-0.1 -0.497 45.9 -84.3 -72.2 147.7 23.5 -11.6 -38.6 61 61 L S T 3 S+ 0 0 99 1,-0.3 -1,-0.1 -2,-0.1 0, 0.0 -0.311 117.5 23.5 -61.4 129.8 26.4 -14.1 -38.0 62 62 L G T 3 S+ 0 0 77 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.224 89.7 125.2 96.3 -12.7 25.3 -17.3 -36.4 63 63 L V < - 0 0 14 -3,-2.3 -1,-0.3 -11,-0.1 -4,-0.1 -0.716 64.0-119.8 -77.6 123.3 21.8 -16.9 -37.7 64 64 L P > - 0 0 52 0, 0.0 3,-1.5 0, 0.0 -4,-0.1 -0.162 18.8-111.1 -62.9 158.9 20.7 -20.1 -39.7 65 65 L D T 3 S+ 0 0 118 1,-0.3 16,-0.1 -6,-0.0 -2,-0.0 0.613 106.5 80.6 -66.3 -18.3 19.7 -19.9 -43.4 66 66 L R T 3 S+ 0 0 42 14,-0.1 15,-2.2 16,-0.1 2,-0.6 0.708 83.2 80.3 -61.8 -19.2 16.1 -20.8 -42.7 67 67 L F E < +C 80 0A 5 -3,-1.5 2,-0.4 13,-0.2 13,-0.2 -0.814 58.8 165.7 -95.7 119.1 15.8 -17.1 -41.8 68 68 L S E -C 79 0A 40 11,-2.6 11,-2.8 -2,-0.6 2,-0.3 -0.987 19.4-159.7-138.0 133.3 15.4 -14.6 -44.6 69 69 L G E +C 78 0A 7 -2,-0.4 2,-0.3 -12,-0.2 9,-0.2 -0.776 21.4 160.7 -99.2 146.9 14.4 -10.9 -44.7 70 70 L S E +C 77 0A 49 7,-2.2 7,-2.2 -2,-0.3 2,-0.2 -0.920 17.0 84.7-151.6-179.2 13.1 -9.1 -47.8 71 71 L G E -C 76 0A 37 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.527 42.0-139.3 113.1 177.4 11.2 -6.1 -49.0 72 72 L S E > +C 75 0A 89 3,-1.7 3,-1.2 -2,-0.2 2,-1.0 -0.942 64.0 10.9-170.6 157.5 11.8 -2.4 -49.8 73 73 L G T 3 S- 0 0 21 -2,-0.3 -44,-1.7 1,-0.2 -46,-0.1 -0.579 130.9 -22.8 73.2-100.5 10.3 1.0 -49.4 74 74 L T T 3 S+ 0 0 64 -2,-1.0 -49,-1.6 -46,-0.2 2,-0.5 0.626 121.1 78.0-115.0 -27.5 7.4 0.4 -46.9 75 75 L D E < +BC 24 72A 71 -3,-1.2 -3,-1.7 -51,-0.2 2,-0.3 -0.796 55.4 167.3 -94.9 121.6 6.6 -3.4 -47.3 76 76 L F E -BC 23 71A 0 -53,-2.3 -53,-2.8 -2,-0.5 2,-0.4 -0.970 13.0-165.2-135.2 154.5 8.9 -5.9 -45.5 77 77 L T E -BC 22 70A 29 -7,-2.2 -7,-2.2 -2,-0.3 2,-0.5 -0.992 13.1-157.0-142.9 135.0 8.8 -9.6 -44.7 78 78 L L E -BC 21 69A 0 -57,-2.8 -57,-3.1 -2,-0.4 2,-0.4 -0.978 19.4-167.7-109.6 128.8 10.6 -12.1 -42.5 79 79 L K E -BC 20 68A 83 -11,-2.8 -11,-2.6 -2,-0.5 2,-0.6 -0.973 9.3-168.1-119.3 130.7 10.3 -15.7 -43.7 80 80 L I E -BC 19 67A 0 -61,-2.9 -61,-2.5 -2,-0.4 3,-0.4 -0.964 11.9-157.0-119.8 109.1 11.3 -18.7 -41.6 81 81 L N S S+ 0 0 65 -15,-2.2 -63,-0.2 -2,-0.6 -64,-0.1 -0.624 73.7 6.8 -82.7 145.8 11.5 -21.9 -43.6 82 82 L R S S- 0 0 191 -66,-0.5 -1,-0.2 -2,-0.3 -64,-0.2 0.944 89.7-135.9 45.9 65.4 11.1 -25.2 -41.8 83 83 L V - 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