==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNOGLOBULIN 17-JAN-91 6FAB . COMPND 2 MOLECULE: IGG1-KAPPA 36-71 FAB (LIGHT CHAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR R.K.STRONG,D.R.ROSE,G.A.PETSKO,J.SHARON,M.N.MARGOLIES . 436 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19340.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 272 62.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 168 38.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 1 0.2 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 . 44 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.1 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 . 1 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 . 2 4 3 4 3 11 0 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 . 1 1 3 2 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 D 0 0 143 0, 0.0 2,-0.6 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0-179.4 44.7 62.5 36.7 2 2 L I - 0 0 5 93,-0.4 2,-0.3 91,-0.1 88,-0.1 -0.941 360.0-140.4 -95.4 124.5 47.1 61.2 33.9 3 3 L Q - 0 0 113 -2,-0.6 23,-1.5 94,-0.1 2,-0.5 -0.687 13.2-151.4 -83.0 136.9 50.1 60.0 35.9 4 4 L M E -A 25 0A 15 94,-0.5 96,-0.5 -2,-0.3 2,-0.5 -0.975 10.0-167.5-119.3 126.1 53.3 60.9 34.1 5 5 L T E -A 24 0A 48 19,-3.1 19,-3.2 -2,-0.5 2,-0.4 -0.957 4.7-169.2-115.5 123.3 56.4 58.8 34.6 6 6 L Q E -A 23 0A 13 -2,-0.5 17,-0.2 17,-0.2 94,-0.0 -0.918 22.4-131.3-102.9 129.3 60.0 59.8 33.5 7 7 L I E S+A 22 0A 92 15,-1.4 15,-2.0 -2,-0.4 2,-0.1 -0.980 79.5 26.6-122.4 141.5 62.6 57.1 33.6 8 8 L P - 0 0 42 0, 0.0 14,-0.1 0, 0.0 3,-0.1 0.755 60.6-160.6 -82.7-176.7 65.3 57.5 34.9 9 9 L S S S+ 0 0 85 1,-0.2 94,-2.7 93,-0.2 2,-0.3 0.739 85.6 26.6 -90.9 -19.9 65.2 60.1 37.7 10 10 L S E -d 103 0B 66 92,-0.2 2,-0.3 75,-0.0 -1,-0.2 -0.975 67.1-177.5-137.3 147.2 69.0 60.6 37.6 11 11 L L E -d 104 0B 42 92,-1.8 94,-1.9 -2,-0.3 2,-0.5 -0.964 10.4-160.1-150.7 126.2 71.3 60.1 34.6 12 12 L S E +d 105 0B 60 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.934 23.9 165.0-104.6 130.2 75.1 60.5 34.6 13 13 L A E -d 106 0B 7 92,-2.3 94,-1.5 -2,-0.5 2,-0.1 -0.988 37.6-109.0-143.3 158.2 76.7 61.0 31.1 14 14 L S > - 0 0 50 -2,-0.3 3,-1.6 92,-0.2 64,-0.3 -0.452 47.5 -93.4 -82.2 153.2 80.0 62.2 29.8 15 15 L L T 3 S+ 0 0 84 92,-0.3 64,-0.2 1,-0.2 -1,-0.1 -0.492 115.4 33.9 -64.3 138.5 80.1 65.6 28.1 16 16 L G T 3 S+ 0 0 37 62,-2.2 -1,-0.2 1,-0.3 63,-0.1 0.289 92.9 129.7 97.0 -14.9 79.7 65.1 24.3 17 17 L D < - 0 0 72 -3,-1.6 61,-2.4 60,-0.2 2,-0.6 -0.235 64.8-115.6 -76.9 162.8 77.3 62.1 24.8 18 18 L R - 0 0 162 59,-0.2 2,-0.3 -3,-0.1 58,-0.2 -0.873 38.1-164.8 -96.1 121.9 73.9 61.6 23.2 19 19 L V E - B 0 75A 4 56,-3.0 56,-2.1 -2,-0.6 2,-0.4 -0.878 10.4-167.9-109.7 146.5 71.4 61.5 26.1 20 20 L S E - B 0 74A 46 -2,-0.3 2,-0.4 54,-0.2 54,-0.2 -0.996 0.7-170.9-133.2 135.8 67.7 60.3 25.9 21 21 L I E - B 0 73A 0 52,-2.5 52,-2.0 -2,-0.4 2,-0.4 -0.918 15.4-149.1-119.3 138.3 65.1 60.9 28.7 22 22 L S E -AB 7 72A 43 -15,-2.0 -15,-1.4 -2,-0.4 2,-0.4 -0.856 13.6-171.9-122.2 154.0 61.8 59.1 28.5 23 23 L a E -AB 6 71A 0 48,-2.7 48,-2.8 -2,-0.4 2,-0.4 -0.993 3.7-174.0-137.5 126.2 58.4 60.0 29.6 24 24 L R E -AB 5 70A 103 -19,-3.2 -19,-3.1 -2,-0.4 2,-0.3 -0.964 9.9-151.2-123.1 144.3 55.4 57.8 29.6 25 25 L A E -A 4 0A 3 44,-2.1 -21,-0.2 -2,-0.4 4,-0.1 -0.756 24.5-119.6-108.2 158.9 51.8 58.7 30.4 26 26 L S S S+ 0 0 72 -23,-1.5 2,-0.3 -2,-0.3 -22,-0.1 0.807 97.0 15.9 -69.5 -25.8 49.0 56.5 31.8 27 27 L Q S S- 0 0 105 -24,-0.2 -2,-0.1 41,-0.1 2,-0.1 -0.851 108.1 -67.7-136.0 168.6 46.7 56.9 28.8 28 28 L D - 0 0 87 -2,-0.3 41,-0.2 1,-0.1 -2,-0.1 -0.371 40.9-164.3 -60.5 131.8 47.3 58.1 25.2 29 29 L I > - 0 0 0 39,-2.0 3,-1.9 -2,-0.1 62,-0.2 0.309 31.8-125.0-106.4 2.8 48.1 61.8 25.4 30 30 L N T 3 - 0 0 90 1,-0.3 3,-0.1 38,-0.1 39,-0.1 0.863 63.9 -65.7 59.3 37.0 47.5 62.5 21.7 31 31 L N T 3 S+ 0 0 45 37,-0.3 2,-2.0 1,-0.2 -1,-0.3 0.508 97.2 135.7 63.9 3.0 51.0 64.0 21.3 32 32 L F < + 0 0 36 -3,-1.9 59,-3.0 18,-0.2 2,-0.4 -0.536 32.6 135.1 -84.0 83.3 50.2 67.0 23.6 33 33 L L E -E 90 0B 0 -2,-2.0 18,-1.7 57,-0.3 19,-1.1 -0.998 34.0-172.3-135.6 127.0 53.4 66.7 25.4 34 34 L N E -E 89 0B 7 55,-2.4 55,-1.9 -2,-0.4 2,-0.4 -0.884 11.7-146.9-121.5 147.5 55.8 69.6 26.3 35 35 L W E -EF 88 48B 0 13,-2.3 12,-2.2 -2,-0.3 13,-1.2 -0.969 13.6-168.1-118.5 137.6 59.2 69.3 27.8 36 36 L Y E -EF 87 46B 0 51,-2.8 51,-2.3 -2,-0.4 2,-0.5 -0.897 10.9-146.1-127.3 152.7 60.8 71.9 30.3 37 37 L Q E -EF 86 45B 9 8,-2.5 8,-2.0 -2,-0.3 2,-0.5 -0.977 6.1-164.0-122.4 129.5 64.4 72.5 31.7 38 38 L Q E -EF 85 44B 12 47,-3.4 47,-2.3 -2,-0.5 6,-0.2 -0.959 14.8-151.5-113.6 116.8 65.0 73.7 35.2 39 39 L K > - 0 0 66 4,-1.9 3,-0.6 -2,-0.5 45,-0.2 -0.277 39.6 -72.5 -81.4 169.7 68.6 75.0 35.6 40 40 L P T 3 S+ 0 0 64 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 -0.451 126.4 33.9 -58.1 138.7 70.5 75.0 39.0 41 41 L D T 3 S- 0 0 162 1,-0.2 2,-0.6 -3,-0.1 -2,-0.1 0.945 126.1 -85.8 62.3 45.0 68.9 77.6 41.0 42 42 L G S < S+ 0 0 28 -3,-0.6 -1,-0.2 -4,-0.1 2,-0.1 0.055 71.1 144.7 67.3 1.1 65.5 77.1 39.7 43 43 L T - 0 0 82 -2,-0.6 -4,-1.9 -3,-0.3 2,-0.4 -0.419 34.5-148.7 -75.9 142.7 64.6 79.0 36.4 44 44 L I E -F 38 0B 12 283,-0.3 2,-0.4 -6,-0.2 282,-0.3 -0.941 15.6-177.5-125.8 139.7 62.4 77.2 34.1 45 45 L K E -F 37 0B 99 -8,-2.0 -8,-2.5 -2,-0.4 2,-0.4 -0.999 28.3-119.8-129.3 143.2 62.2 77.2 30.4 46 46 L L E +F 36 0B 3 278,-0.4 -10,-0.2 -2,-0.4 3,-0.1 -0.559 33.6 167.2 -72.7 130.4 60.2 75.7 27.6 47 47 L L E + 0 0 3 -12,-2.2 9,-2.5 1,-0.4 10,-0.5 0.809 61.5 11.3-109.6 -49.1 62.3 73.6 25.3 48 48 L I E -FG 35 55B 1 -13,-1.2 -13,-2.3 7,-0.2 -1,-0.4 -0.984 62.3-167.1-136.2 137.3 60.0 71.6 23.1 49 49 L Y E > + G 0 54B 43 5,-2.5 5,-1.4 -2,-0.4 -15,-0.2 -0.841 56.8 28.1-127.0 167.3 56.2 71.7 22.5 50 50 L F T 5S- 0 0 62 -2,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.938 129.6 -27.6 40.1 77.8 53.6 69.4 20.9 51 51 L T T 5S- 0 0 18 -18,-1.7 2,-0.2 -20,-0.2 -1,-0.2 0.674 105.7 -76.7 67.0 41.3 54.9 65.9 21.2 52 52 L S T 5S+ 0 0 0 -19,-1.1 2,-2.9 2,-0.1 13,-0.2 -0.500 113.8 92.3 63.0-150.9 58.4 66.6 21.3 53 53 L R T 5S+ 0 0 191 11,-1.9 2,-0.6 -2,-0.2 -2,-0.1 -0.138 70.5 86.8 62.0 -54.9 59.2 67.4 17.6 54 54 L S E < -G 49 0B 18 -2,-2.9 -5,-2.5 -5,-1.4 2,-0.4 -0.658 65.3-152.6 -96.8 129.7 58.7 71.3 17.9 55 55 L Q E -G 48 0B 73 -2,-0.6 -7,-0.2 -7,-0.2 -8,-0.1 -0.678 11.2-161.5 -95.3 135.6 61.4 73.5 19.1 56 56 L S - 0 0 58 -9,-2.5 -1,-0.2 -2,-0.4 -8,-0.1 0.821 65.5 -71.7 -78.9 -39.3 60.9 76.7 20.9 57 57 L G S S+ 0 0 70 -10,-0.5 3,-0.1 2,-0.1 -9,-0.1 0.363 90.9 124.8 141.7 33.4 64.4 78.3 20.4 58 58 L V S S- 0 0 19 -11,-0.3 -11,-0.0 1,-0.2 -3,-0.0 -0.427 77.1 -54.6 -98.6 179.5 66.6 76.4 22.5 59 59 L P > - 0 0 46 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 -0.232 48.0-118.7 -55.0 154.2 69.8 74.8 20.9 60 60 L S T 3 S+ 0 0 112 1,-0.3 16,-0.1 -3,-0.1 -5,-0.0 0.557 105.7 77.5 -76.2 -2.8 69.2 72.5 18.0 61 61 L R T 3 S+ 0 0 39 14,-0.1 15,-1.7 16,-0.1 2,-0.5 0.650 79.4 84.7 -82.2 -7.1 70.8 69.6 19.9 62 62 L F E < +C 75 0A 2 -3,-1.6 2,-0.3 13,-0.2 13,-0.2 -0.748 56.0 149.5 -93.5 125.7 67.5 69.3 21.8 63 63 L S E -C 74 0A 56 11,-2.3 11,-2.9 -2,-0.5 2,-0.3 -0.987 21.2-164.6-143.5 168.8 64.9 67.2 20.0 64 64 L G E +C 73 0A 8 -2,-0.3 -11,-1.9 9,-0.3 2,-0.2 -0.992 8.0 172.9-148.0 165.8 62.0 65.0 21.0 65 65 L S E +C 72 0A 65 7,-2.1 7,-2.2 -2,-0.3 2,-0.2 -0.796 14.8 122.0-152.9-172.5 59.7 62.4 19.7 66 66 L G E -C 71 0A 25 5,-0.3 2,-0.3 -2,-0.2 5,-0.3 -0.650 30.1-140.8 137.4 172.1 57.0 59.9 20.7 67 67 L S E > -C 70 0A 85 3,-1.6 3,-1.8 -2,-0.2 2,-0.5 -0.917 66.3 -9.6-161.5 149.9 53.3 58.8 20.1 68 68 L G T 3 S- 0 0 16 1,-0.3 -39,-2.0 -2,-0.3 -37,-0.3 -0.345 130.7 -12.5 64.3-106.8 50.5 57.6 22.4 69 69 L T T 3 S+ 0 0 42 -2,-0.5 -44,-2.1 -41,-0.2 2,-0.5 0.687 122.3 69.2-102.0 -12.5 52.0 56.9 25.8 70 70 L D E < +BC 24 67A 80 -3,-1.8 -3,-1.6 -46,-0.2 2,-0.3 -0.891 52.1 164.1-126.1 122.2 55.8 57.0 25.2 71 71 L Y E -BC 23 66A 0 -48,-2.8 -48,-2.7 -2,-0.5 2,-0.3 -0.940 15.8-155.6-130.2 156.6 57.8 60.1 24.4 72 72 L S E -BC 22 65A 36 -7,-2.2 -7,-2.1 -2,-0.3 2,-0.4 -0.959 10.8-157.6-136.0 147.3 61.5 60.9 24.4 73 73 L L E -BC 21 64A 0 -52,-2.0 -52,-2.5 -2,-0.3 2,-0.4 -0.975 21.8-172.4-112.6 135.0 63.7 64.0 24.7 74 74 L T E -BC 20 63A 16 -11,-2.9 -11,-2.3 -2,-0.4 2,-0.5 -0.974 19.1-158.7-135.0 142.6 67.2 63.5 23.3 75 75 L I E -BC 19 62A 0 -56,-2.1 -56,-3.0 -2,-0.4 3,-0.2 -0.999 13.9-154.7-110.8 120.6 70.2 65.8 23.6 76 76 L S S S+ 0 0 69 -15,-1.7 2,-0.3 -2,-0.5 -1,-0.1 0.695 80.5 13.0 -80.2 -19.1 72.5 64.8 20.7 77 77 L N S S- 0 0 65 -16,-0.1 -1,-0.3 -59,-0.1 -59,-0.2 -0.800 87.7-127.3-154.6 107.6 75.8 66.0 22.1 78 78 L L - 0 0 3 -61,-2.4 -62,-2.2 -64,-0.3 2,-0.2 -0.356 24.8-166.6 -68.9 133.9 75.8 66.9 25.8 79 79 L E > - 0 0 76 -64,-0.2 3,-1.2 -2,-0.1 4,-0.1 -0.574 33.3-113.7-112.1 171.0 77.1 70.4 26.8 80 80 L Q G > S+ 0 0 70 1,-0.3 3,-1.5 -2,-0.2 -1,-0.1 0.927 115.7 60.6 -75.5 -31.1 78.0 71.7 30.3 81 81 L E G 3 S+ 0 0 102 1,-0.3 -1,-0.3 -42,-0.0 -3,-0.0 0.462 93.8 69.9 -69.1 4.2 75.1 74.2 30.2 82 82 L D G < + 0 0 0 -3,-1.2 2,-0.6 2,-0.1 -1,-0.3 0.389 61.2 112.0-107.5 0.8 72.7 71.2 29.8 83 83 L I < + 0 0 29 -3,-1.5 2,-0.3 -4,-0.1 22,-0.1 -0.703 52.2 114.4 -86.8 123.7 73.0 69.7 33.3 84 84 L A S S- 0 0 3 -2,-0.6 20,-2.0 -45,-0.2 2,-0.4 -0.919 73.0 -85.1-167.9 174.1 69.6 70.5 34.5 85 85 L T E -EH 38 103B 27 -47,-2.3 -47,-3.4 -2,-0.3 2,-0.4 -0.887 41.2-155.1-104.4 134.0 66.4 68.9 35.6 86 86 L Y E -EH 37 102B 0 16,-2.0 16,-2.2 -2,-0.4 2,-0.4 -0.907 8.9-169.2-114.7 139.1 64.0 68.1 32.7 87 87 L F E -E 36 0B 0 -51,-2.3 -51,-2.8 -2,-0.4 2,-0.3 -0.998 11.7-150.7-131.1 130.5 60.3 67.7 33.1 88 88 L a E -E 35 0B 0 -2,-0.4 11,-3.0 -53,-0.2 2,-0.3 -0.702 14.9-167.7 -94.6 154.9 57.6 66.4 30.7 89 89 L Q E -EI 34 98B 0 -55,-1.9 -55,-2.4 -2,-0.3 2,-0.4 -0.972 13.3-140.7-138.7 131.8 54.0 67.9 30.9 90 90 L Q E -EI 33 97B 0 7,-2.0 7,-0.6 -2,-0.3 -57,-0.3 -0.746 13.2-174.3 -96.5 134.1 50.9 66.4 29.3 91 91 L G + 0 0 2 -59,-3.0 230,-0.2 -2,-0.4 -58,-0.1 -0.064 58.3 96.4-110.5 36.7 48.5 68.9 27.9 92 92 L N S S+ 0 0 54 -60,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.728 89.9 7.7 -97.4 -24.3 45.7 66.5 26.8 93 93 L A S S- 0 0 35 2,-0.2 4,-0.2 -3,-0.1 -1,-0.2 -0.947 90.1 -66.8-148.6 163.1 43.3 66.7 29.8 94 94 L L S S+ 0 0 110 -2,-0.3 2,-0.1 2,-0.1 3,-0.1 -0.733 105.5 52.5 -84.5 149.1 42.8 68.6 33.1 95 95 L P S S- 0 0 25 0, 0.0 -93,-0.4 0, 0.0 2,-0.3 0.701 87.0-135.5 -65.3 147.8 44.6 68.6 35.5 96 96 L R - 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