==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNOGLOBULIN 27-MAR-92 1DFB . COMPND 2 MOLECULE: IGG1-KAPPA 3D6 FAB (LIGHT CHAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR X.M.HE,F.RUEKER,E.CASALE,D.C.CARTER . 441 2 5 4 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20017.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 285 64.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 169 38.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.4 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 52 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 2.7 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+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 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 RESIDUES PER ALPHA HELIX . 0 0 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 0 0 PARALLEL BRIDGES PER LADDER . 5 4 3 3 5 7 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 5 1 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 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 D 0 0 144 0, 0.0 25,-0.1 0, 0.0 92,-0.0 0.000 360.0 360.0 360.0 167.9 -12.1 11.0 48.3 2 2 L I - 0 0 17 23,-0.1 2,-0.4 1,-0.1 88,-0.1 -0.191 360.0-165.4 -73.0 128.6 -10.6 10.9 44.7 3 3 L Q - 0 0 151 2,-0.0 23,-2.2 94,-0.0 2,-0.4 -0.862 9.5-169.2 -99.4 132.9 -9.3 7.5 43.7 4 4 L M E -A 25 0A 18 -2,-0.4 2,-0.3 92,-0.3 21,-0.3 -0.988 5.1-174.6-128.5 134.4 -7.1 7.9 40.6 5 5 L T E -A 24 0A 73 19,-2.6 19,-2.4 -2,-0.4 2,-0.3 -0.965 10.3-141.0-137.8 162.8 -5.9 4.8 38.5 6 6 L Q E -A 23 0A 14 -2,-0.3 17,-0.2 17,-0.2 15,-0.0 -0.871 6.5-136.1-126.1 145.1 -3.5 4.1 35.6 7 7 L S E S+A 22 0A 49 15,-1.3 15,-3.2 -2,-0.3 2,-0.1 -0.963 85.0 37.5-134.7 146.3 -3.4 1.9 32.5 8 8 L P - 0 0 46 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.719 60.4-167.6 -59.5 164.6 -1.0 0.4 31.7 9 9 L S S S+ 0 0 91 1,-0.4 92,-2.1 91,-0.1 2,-0.3 0.888 85.4 9.9 -72.6 -44.1 0.6 -0.8 34.9 10 10 L T E -d 101 0B 78 90,-0.2 -1,-0.4 75,-0.0 2,-0.4 -0.955 69.0-167.3-138.4 156.8 3.6 -1.6 32.7 11 11 L L E -d 102 0B 37 90,-1.9 92,-3.3 -2,-0.3 2,-0.5 -0.990 10.8-156.6-147.3 128.2 4.7 -0.9 29.2 12 12 L S E +d 103 0B 52 -2,-0.4 2,-0.3 90,-0.2 92,-0.2 -0.934 31.8 153.9-101.3 134.8 7.4 -2.2 26.9 13 13 L A E -d 104 0B 0 90,-2.2 92,-2.4 -2,-0.5 2,-0.4 -0.947 33.4-132.6-146.1 170.1 8.3 0.1 24.1 14 14 L S > - 0 0 34 -2,-0.3 3,-2.1 90,-0.2 64,-0.3 -0.931 45.1 -78.2-126.8 152.9 11.3 0.9 21.9 15 15 L V T 3 S+ 0 0 92 -2,-0.4 64,-0.2 1,-0.3 3,-0.1 -0.232 116.8 33.7 -56.8 110.2 12.8 4.2 21.1 16 16 L G T 3 S+ 0 0 43 1,-0.5 -1,-0.3 62,-0.4 63,-0.1 -0.132 86.1 116.6 137.9 -35.6 10.7 5.9 18.5 17 17 L D < - 0 0 60 -3,-2.1 61,-0.9 60,-0.2 2,-0.6 -0.303 62.4-130.0 -67.5 141.9 7.2 4.7 19.4 18 18 L R - 0 0 177 59,-0.2 2,-0.3 -3,-0.1 58,-0.2 -0.828 33.8-175.0 -82.1 116.6 4.5 7.1 20.5 19 19 L V E - B 0 75A 14 56,-0.9 56,-1.9 -2,-0.6 2,-0.3 -0.895 11.2-153.7-111.9 161.8 3.1 5.5 23.7 20 20 L T E - B 0 74A 63 -2,-0.3 2,-0.4 54,-0.2 54,-0.2 -0.976 3.6-162.9-133.7 138.9 0.1 6.8 25.6 21 21 L I E - B 0 73A 0 52,-1.7 52,-2.0 -2,-0.3 2,-0.3 -0.951 14.3-142.1-125.8 144.3 -0.6 6.3 29.4 22 22 L T E -AB 7 72A 41 -15,-3.2 -15,-1.3 -2,-0.4 2,-0.4 -0.858 13.1-169.8-116.5 146.1 -4.1 6.9 30.9 23 23 L a E -AB 6 71A 0 48,-2.8 48,-1.7 -2,-0.3 2,-0.4 -0.978 6.4-172.3-136.0 113.0 -5.2 8.4 34.2 24 24 L R E -AB 5 70A 93 -19,-2.4 -19,-2.6 -2,-0.4 2,-0.5 -0.933 4.7-163.5-108.8 138.4 -8.8 8.0 35.4 25 25 L A E -A 4 0A 2 44,-1.1 2,-0.7 -2,-0.4 -21,-0.3 -0.934 21.3-132.1-122.7 108.7 -10.0 9.9 38.5 26 26 L S S S+ 0 0 79 -23,-2.2 2,-0.3 -2,-0.5 -22,-0.1 0.479 89.5 33.3 -49.3 -3.2 -13.4 8.8 40.1 27 27 L Q S S- 0 0 124 -2,-0.7 -2,-0.0 -24,-0.2 41,-0.0 -0.973 110.3 -73.9-142.0 152.1 -15.0 12.3 40.4 28 28 L S + 0 0 61 -2,-0.3 41,-0.2 1,-0.2 40,-0.1 -0.277 44.0 175.0 -51.1 129.3 -14.5 15.3 38.1 29 29 L I > - 0 0 0 39,-2.5 3,-1.3 1,-0.2 62,-0.2 0.059 23.7-160.3-111.1 5.0 -11.1 16.7 38.6 30 30 L S T 3 - 0 0 49 38,-0.5 38,-2.1 1,-0.3 -1,-0.2 -0.169 66.4 -27.1 41.5-112.2 -11.6 19.2 35.7 31 31 L R T 3 S+ 0 0 100 36,-0.2 2,-2.8 1,-0.1 20,-0.5 0.728 107.2 112.0-100.5 -21.0 -8.2 20.4 34.5 32 32 L W < + 0 0 37 -3,-1.3 59,-2.9 18,-0.2 2,-0.3 -0.312 46.7 111.1 -70.5 61.0 -6.5 19.9 37.9 33 33 L L E -E 90 0B 2 -2,-2.8 18,-2.0 57,-0.3 17,-0.2 -0.947 39.6-178.6-131.3 147.5 -4.2 17.0 36.9 34 34 L A E -E 89 0B 0 55,-1.7 55,-1.2 -2,-0.3 2,-0.3 -0.762 14.8-138.3-136.2 174.9 -0.4 17.0 36.6 35 35 L W E -EF 88 48B 0 13,-1.8 12,-2.8 53,-0.2 13,-0.6 -0.999 10.7-162.6-146.9 140.1 2.3 14.3 35.5 36 36 L Y E -EF 87 46B 0 51,-2.3 51,-1.4 -2,-0.3 2,-0.4 -0.917 10.6-147.5-127.0 147.5 5.8 13.4 36.9 37 37 L Q E -EF 86 45B 8 8,-2.4 8,-2.5 -2,-0.4 2,-0.4 -0.917 21.9-178.9-103.2 140.8 8.6 11.4 35.5 38 38 L Q E -E 85 0B 15 47,-2.5 47,-2.3 -2,-0.4 5,-0.1 -0.992 15.1-167.7-138.4 133.4 10.7 9.4 38.0 39 39 L K > - 0 0 59 -2,-0.4 3,-1.1 4,-0.4 45,-0.1 -0.901 49.8 -86.6-108.6 146.4 13.8 7.2 37.4 40 40 L P T 3 S+ 0 0 101 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 -0.291 116.8 20.6 -63.2 136.5 14.8 5.0 40.5 41 41 L G T 3 S+ 0 0 91 1,-0.3 2,-0.3 -3,-0.0 -3,-0.0 0.785 109.1 93.0 77.8 28.4 17.0 6.9 42.8 42 42 L K S < S- 0 0 59 -3,-1.1 -1,-0.3 3,-0.0 3,-0.1 -0.928 78.4 -99.1-141.9 172.5 16.0 10.4 41.5 43 43 L V - 0 0 30 -2,-0.3 -4,-0.4 1,-0.1 2,-0.2 -0.420 48.8 -88.7 -86.3 158.5 13.4 12.9 42.6 44 44 L P - 0 0 7 0, 0.0 2,-0.5 0, 0.0 -6,-0.2 -0.563 40.2-151.9 -65.3 138.1 10.0 13.3 40.8 45 45 L K E -F 37 0B 90 -8,-2.5 -8,-2.4 -2,-0.2 2,-0.3 -0.959 13.5-127.7-116.5 110.4 10.2 15.7 37.8 46 46 L L E +F 36 0B 7 -2,-0.5 -10,-0.3 281,-0.3 9,-0.2 -0.470 33.4 168.8 -60.6 111.9 6.9 17.7 36.8 47 47 L L E + 0 0 2 -12,-2.8 8,-1.5 -2,-0.3 2,-0.3 0.896 62.9 7.8 -88.5 -52.2 6.3 17.1 33.0 48 48 L I E +FG 35 54B 0 -13,-0.6 -13,-1.8 6,-0.2 2,-0.3 -0.898 61.2 174.3-126.2 149.9 2.7 18.5 32.4 49 49 L Y + 0 0 36 4,-2.3 3,-0.3 -2,-0.3 -15,-0.2 -0.955 65.4 40.1-148.3 169.8 0.1 20.4 34.7 50 50 L K S > S- 0 0 63 274,-0.4 2,-2.7 -2,-0.3 3,-0.7 0.900 124.8 -80.6 48.6 45.9 -3.3 22.0 34.1 51 51 L A T 3 S+ 0 0 2 -18,-2.0 -1,-0.3 -20,-0.5 21,-0.1 -0.169 126.5 27.2 51.3 -34.9 -3.8 18.9 32.0 52 52 L S T 3 S+ 0 0 70 -2,-2.7 -1,-0.3 -3,-0.3 -2,-0.2 0.814 88.3 103.0-115.0 -53.9 -1.9 20.4 29.0 53 53 L S < - 0 0 32 -3,-0.7 -4,-2.3 -5,-0.2 2,-0.2 0.043 55.2-151.0 -51.9 118.6 0.7 23.0 30.0 54 54 L L B -G 48 0B 61 -6,-0.2 -6,-0.2 1,-0.1 -7,-0.1 -0.529 20.2-113.6 -79.1 156.3 4.3 21.7 30.0 55 55 L E > - 0 0 45 -8,-1.5 3,-1.2 -9,-0.2 -1,-0.1 -0.235 49.1 -74.8 -71.5 175.6 6.8 23.1 32.4 56 56 L S T 3 S+ 0 0 103 1,-0.2 -1,-0.2 -2,-0.0 0, 0.0 -0.390 118.4 15.7 -63.3 143.3 9.8 25.2 31.0 57 57 L G T 3 S+ 0 0 73 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.488 83.7 132.8 76.4 -7.3 12.4 22.9 29.4 58 58 L V < - 0 0 13 -3,-1.2 -1,-0.2 -11,-0.1 2,-0.2 -0.698 68.7-106.2 -76.4 132.6 10.3 19.8 29.1 59 59 L P > - 0 0 53 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.433 23.6-117.5 -49.5 129.8 10.9 18.6 25.5 60 60 L S T 3 S+ 0 0 120 1,-0.3 -2,-0.0 -2,-0.2 -6,-0.0 0.563 101.9 82.5 -51.3 -9.6 7.9 19.2 23.1 61 61 L R T 3 S+ 0 0 52 14,-0.1 15,-2.0 16,-0.1 -1,-0.3 0.651 77.9 74.7 -77.4 -11.5 7.5 15.5 22.5 62 62 L F E < +C 75 0A 4 -3,-1.8 2,-0.3 13,-0.2 13,-0.2 -0.635 63.9 166.4 -90.2 151.8 5.5 14.9 25.8 63 63 L S E -C 74 0A 52 11,-1.5 11,-1.1 -2,-0.2 2,-0.3 -0.956 18.4-155.2-155.8 178.1 1.9 16.2 25.7 64 64 L G E +C 73 0A 12 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.979 14.2 164.5-165.2 145.4 -1.4 15.9 27.6 65 65 L S E +C 72 0A 66 7,-1.4 7,-2.8 -2,-0.3 2,-0.3 -0.963 16.0 129.3-161.9 151.7 -5.0 16.2 27.1 66 66 L G E -C 71 0A 21 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.804 38.9-128.4 159.2 163.2 -7.9 15.3 29.0 67 67 L S - 0 0 64 3,-1.8 2,-1.9 -2,-0.3 3,-0.3 -0.833 59.9 -61.6-144.5 84.3 -11.1 16.5 30.3 68 68 L G S S+ 0 0 4 -38,-2.1 -39,-2.5 -2,-0.4 -38,-0.5 -0.079 127.6 23.9 76.8 -43.5 -12.3 16.2 33.8 69 69 L T S S+ 0 0 64 -2,-1.9 -44,-1.1 1,-0.4 2,-0.4 0.382 121.1 45.6-131.3 -7.4 -12.5 12.3 34.3 70 70 L E E +B 24 0A 99 -3,-0.3 -3,-1.8 -46,-0.2 -1,-0.4 -0.997 62.0 175.9-146.1 126.9 -10.0 10.9 31.8 71 71 L F E -BC 23 66A 3 -48,-1.7 -48,-2.8 -2,-0.4 2,-0.3 -0.992 6.9-166.8-138.4 142.1 -6.6 12.2 31.2 72 72 L T E -BC 22 65A 37 -7,-2.8 -7,-1.4 -2,-0.3 2,-0.4 -0.917 10.0-153.7-136.7 150.2 -3.8 10.9 28.9 73 73 L L E -BC 21 64A 0 -52,-2.0 -52,-1.7 -2,-0.3 2,-0.4 -0.992 15.6-169.0-127.6 124.4 0.0 11.5 28.4 74 74 L T E -BC 20 63A 14 -11,-1.1 -11,-1.5 -2,-0.4 2,-0.5 -0.889 15.1-164.7-117.9 141.2 1.7 10.9 25.1 75 75 L I E -BC 19 62A 0 -56,-1.9 -56,-0.9 -2,-0.4 -13,-0.2 -0.971 9.3-162.8-111.2 130.0 5.4 10.8 24.2 76 76 L S S S+ 0 0 60 -15,-2.0 2,-0.6 -2,-0.5 -1,-0.2 0.934 80.6 24.4 -82.2 -49.3 5.7 11.1 20.3 77 77 L S S S- 0 0 32 -16,-0.1 2,-0.4 -59,-0.1 -1,-0.3 -0.955 77.6-146.0-110.1 108.8 9.2 9.9 20.0 78 78 L L - 0 0 0 -61,-0.9 -62,-0.4 -2,-0.6 -61,-0.1 -0.650 19.7-168.4 -65.3 125.6 10.5 7.6 22.9 79 79 L Q > - 0 0 75 -2,-0.4 3,-1.5 -64,-0.2 2,-1.2 -0.919 40.7 -97.5-106.1 155.0 14.2 8.5 23.2 80 80 L P T 3 S+ 0 0 74 0, 0.0 -2,-0.1 0, 0.0 24,-0.0 0.180 118.8 62.7 -61.1 12.7 16.3 6.1 25.4 81 81 L D T 3 S+ 0 0 102 -2,-1.2 -3,-0.0 1,-0.1 0, 0.0 -0.030 84.4 70.3-129.8 22.3 15.9 8.4 28.4 82 82 L D < + 0 0 5 -3,-1.5 2,-0.8 2,-0.1 20,-0.1 0.147 63.3 114.8-117.4 16.8 12.2 8.4 28.9 83 83 L F + 0 0 31 -4,-0.1 2,-0.3 18,-0.1 20,-0.1 -0.829 52.2 96.7 -89.7 111.2 12.0 4.9 30.2 84 84 L A S S- 0 0 7 -2,-0.8 18,-2.2 16,-0.1 2,-0.4 -0.878 80.1 -70.9-169.8-170.1 10.9 5.6 33.8 85 85 L T E -EH 38 101B 27 -47,-2.3 -47,-2.5 -2,-0.3 2,-0.4 -0.855 38.3-158.5-106.4 142.1 7.7 5.6 35.8 86 86 L Y E -EH 37 100B 0 14,-1.5 14,-0.8 -2,-0.4 2,-0.3 -0.954 8.4-172.5-119.9 137.7 5.2 8.3 35.3 87 87 L Y E -E 36 0B 15 -51,-1.4 -51,-2.3 -2,-0.4 2,-0.3 -0.932 12.1-147.7-127.1 149.5 2.6 9.2 37.9 88 88 L a E -E 35 0B 0 -2,-0.3 9,-3.4 -53,-0.2 2,-0.4 -0.903 12.6-164.1-111.9 150.9 -0.4 11.6 37.6 89 89 L Q E -EI 34 96B 0 -55,-1.2 -55,-1.7 -2,-0.3 2,-0.3 -0.997 9.8-143.0-130.5 142.1 -1.7 13.7 40.7 90 90 L Q E > -E 33 0B 0 5,-1.9 4,-0.7 -2,-0.4 -57,-0.3 -0.755 6.8-146.2 -97.3 155.8 -5.0 15.4 41.0 91 91 L Y T 4 S+ 0 0 13 -59,-2.9 232,-0.2 -2,-0.3 -58,-0.1 0.162 84.5 74.6-116.3 22.1 -5.2 18.8 42.8 92 92 L N T 4 S- 0 0 79 -60,-0.3 -1,-0.1 3,-0.1 -59,-0.1 0.834 128.6 -1.6 -86.1 -36.5 -8.6 18.9 44.5 93 93 L S T 4 S- 0 0 21 2,-0.2 -2,-0.2 179,-0.0 0, 0.0 0.286 92.8-119.1-138.9 14.7 -7.1 16.4 47.1 94 94 L Y < + 0 0 48 -4,-0.7 2,-0.5 1,-0.2 166,-0.3 0.631 55.5 150.5 56.5 23.2 -3.5 15.6 46.1 95 95 L S - 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