==== 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 POLYSPECIFICITY 19-MAR-99 1CFS . COMPND 2 MOLECULE: PROTEIN (IGG2A KAPPA ANTIBODY CB41 (LIGHT CHAIN) . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR T.KEITEL,A.KRAMER,H.WESSNER,C.SCHOLZ,J.SCHNEIDER-MERGENER, . 438 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20358.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 280 63.9 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 . 166 37.9 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 . 2 0.5 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-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 . 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 11.9 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 . 16 3.7 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 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 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 . 4 4 7 2 4 5 3 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 1 3 2 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 A D 0 0 141 0, 0.0 2,-0.7 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 163.4 53.2 48.8 44.4 2 2 A I - 0 0 8 93,-0.2 88,-0.1 91,-0.1 25,-0.0 -0.932 360.0-138.1-110.4 101.5 51.5 52.2 43.9 3 3 A K - 0 0 179 -2,-0.7 23,-1.9 22,-0.1 2,-0.5 -0.382 20.6-154.4 -59.4 128.8 52.2 53.5 40.4 4 4 A M E -A 25 0A 18 94,-0.4 2,-0.5 21,-0.2 96,-0.2 -0.989 7.1-162.2-106.1 126.1 52.9 57.2 41.1 5 5 A T E -A 24 0A 77 19,-3.1 19,-2.7 -2,-0.5 2,-0.5 -0.963 7.5-175.2-115.3 111.2 52.1 59.4 38.0 6 6 A Q E -A 23 0A 16 -2,-0.5 17,-0.2 17,-0.2 94,-0.1 -0.899 17.9-134.6-113.9 124.6 53.6 62.9 37.9 7 7 A S E S+A 22 0A 67 15,-1.5 15,-2.7 -2,-0.5 2,-0.2 -0.974 72.8 32.4-135.1 141.6 52.8 65.3 35.1 8 8 A P - 0 0 47 0, 0.0 3,-0.1 0, 0.0 14,-0.1 0.564 64.2-154.5 -70.0-176.2 54.2 67.2 33.4 9 9 A S S S- 0 0 78 1,-0.4 94,-1.6 -2,-0.2 2,-0.3 0.696 80.7 -2.5 -89.3 -29.6 57.5 65.5 33.0 10 10 A S E S-e 103 0B 71 92,-0.3 -1,-0.4 75,-0.1 2,-0.3 -0.952 71.6-162.0-154.0 160.0 59.3 68.8 32.2 11 11 A M E -e 104 0B 40 92,-2.1 94,-1.5 -2,-0.3 2,-0.6 -0.995 17.3-140.0-158.1 152.1 58.1 72.3 31.9 12 12 A Y E +e 105 0B 79 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.939 39.0 158.3-118.5 104.7 59.2 75.7 30.5 13 13 A T E -e 106 0B 8 92,-1.7 94,-1.4 -2,-0.6 2,-0.4 -0.813 30.3-133.3-126.6 164.5 58.2 78.6 32.8 14 14 A S > - 0 0 47 -2,-0.3 3,-2.3 92,-0.2 64,-0.3 -0.915 38.1 -87.6-123.6 151.6 59.3 82.1 33.5 15 15 A L T 3 S+ 0 0 90 -2,-0.4 64,-0.2 1,-0.2 3,-0.1 -0.294 115.3 31.4 -49.9 131.0 60.0 84.0 36.7 16 16 A G T 3 S+ 0 0 52 62,-1.6 -1,-0.2 1,-0.4 2,-0.1 0.015 93.3 118.7 108.3 -25.7 56.7 85.4 38.0 17 17 A E < - 0 0 108 -3,-2.3 61,-2.3 60,-0.2 2,-0.6 -0.407 67.3-112.4 -80.5 156.5 54.5 82.7 36.7 18 18 A R - 0 0 153 59,-0.2 2,-0.3 -2,-0.1 58,-0.2 -0.767 33.6-158.1 -84.4 110.3 52.2 80.3 38.6 19 19 A V E - B 0 75A 2 56,-2.0 56,-3.3 -2,-0.6 2,-0.4 -0.705 12.1-176.3 -99.9 140.0 53.4 76.6 38.5 20 20 A T E - B 0 74A 53 -2,-0.3 2,-0.4 54,-0.2 54,-0.2 -0.938 2.3-179.0-134.3 122.9 51.4 73.5 39.1 21 21 A I E - B 0 73A 0 52,-1.6 52,-1.6 -2,-0.4 2,-0.3 -0.873 17.9-147.3-109.7 139.9 52.7 69.9 39.1 22 22 A T E -AB 7 72A 48 -15,-2.7 -15,-1.5 -2,-0.4 2,-0.5 -0.831 7.8-160.1-114.6 145.8 50.3 67.0 39.7 23 23 A a E -AB 6 71A 0 48,-4.1 48,-3.1 -2,-0.3 2,-0.5 -0.984 7.7-167.8-123.1 127.5 50.8 63.7 41.4 24 24 A K E -AB 5 70A 87 -19,-2.7 -19,-3.1 -2,-0.5 2,-0.4 -0.958 4.2-159.2-123.2 125.9 48.5 60.7 40.7 25 25 A A E -A 4 0A 0 44,-2.8 -21,-0.2 -2,-0.5 -22,-0.1 -0.845 23.4-131.9-104.9 143.8 48.5 57.6 42.9 26 26 A S S S+ 0 0 54 -23,-1.9 2,-0.3 -2,-0.4 -22,-0.1 0.551 92.7 19.5 -68.4 -12.6 47.2 54.3 41.8 27 27 A Q S S- 0 0 90 -24,-0.2 2,-0.6 42,-0.1 -2,-0.1 -0.895 103.4 -71.9-141.8 179.2 45.3 54.0 45.1 28 28 A D - 0 0 83 -2,-0.3 41,-0.2 1,-0.2 -2,-0.1 -0.655 41.3-172.4 -75.1 112.7 44.1 56.2 48.0 29 29 A I > - 0 0 0 39,-1.5 3,-3.1 -2,-0.6 62,-0.3 0.265 36.6-123.3-101.1 16.8 47.3 57.2 49.7 30 30 A N T 3 - 0 0 77 38,-0.4 406,-0.1 1,-0.3 3,-0.1 0.846 66.8 -60.6 55.6 34.3 45.4 58.9 52.6 31 31 A S T 3 S+ 0 0 36 37,-0.4 2,-2.0 1,-0.2 -1,-0.3 0.617 96.9 144.2 64.3 21.9 47.2 62.2 52.0 32 32 A F < + 0 0 32 -3,-3.1 59,-1.2 18,-0.2 60,-0.5 -0.481 30.3 131.5 -90.6 74.6 50.5 60.4 52.8 33 33 A L E -F 90 0B 0 -2,-2.0 18,-2.8 57,-0.2 2,-0.4 -0.982 38.7-166.5-131.0 139.0 52.3 62.5 50.2 34 34 A T E -F 89 0B 4 55,-2.6 55,-1.6 -2,-0.4 2,-0.4 -0.992 7.7-152.4-125.7 139.6 55.6 64.4 50.4 35 35 A W E +FG 88 48B 0 13,-2.6 12,-2.6 -2,-0.4 13,-1.7 -0.875 21.2 170.5-111.4 138.4 57.0 67.0 47.9 36 36 A F E -FG 87 46B 3 51,-2.4 51,-1.7 -2,-0.4 2,-0.5 -0.997 24.4-132.5-154.6 153.5 60.7 67.6 47.4 37 37 A L E -FG 86 45B 15 8,-2.2 8,-1.9 -2,-0.3 2,-0.6 -0.850 4.8-160.8-110.5 128.1 63.2 69.4 45.2 38 38 A Q E -F 85 0B 17 47,-3.3 47,-2.7 -2,-0.5 5,-0.1 -0.939 11.4-162.1-108.2 110.9 66.4 68.2 43.7 39 39 A K > - 0 0 78 -2,-0.6 3,-2.9 45,-0.2 45,-0.2 -0.775 43.4 -87.7 -91.6 133.5 68.6 71.0 42.7 40 40 A P T 3 S+ 0 0 94 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.320 116.5 13.6 -50.7 115.4 71.2 69.8 40.2 41 41 A G T 3 S+ 0 0 89 1,-0.3 2,-0.3 -2,-0.1 -3,-0.0 0.387 114.0 103.5 96.7 2.1 74.2 68.4 42.1 42 42 A K S < S- 0 0 102 -3,-2.9 -1,-0.3 3,-0.0 3,-0.1 -0.783 72.5-109.5-126.5 159.9 72.3 68.3 45.4 43 43 A S - 0 0 10 -2,-0.3 -4,-0.2 1,-0.2 274,-0.1 -0.597 57.8 -81.5 -79.9 141.8 70.5 66.0 47.8 44 44 A P - 0 0 5 0, 0.0 2,-0.5 0, 0.0 273,-0.2 0.095 38.6-149.7 -45.0 144.7 66.8 66.3 48.0 45 45 A K E -G 37 0B 116 -8,-1.9 -8,-2.2 -3,-0.1 2,-0.1 -0.969 15.1-129.9-116.9 124.0 65.2 69.1 50.0 46 46 A T E +G 36 0B 7 269,-0.6 -10,-0.2 -2,-0.5 3,-0.1 -0.455 33.6 163.7 -75.6 139.1 61.7 68.5 51.6 47 47 A L E + 0 0 5 -12,-2.6 8,-2.8 1,-0.4 2,-0.4 0.602 63.0 20.0-118.7 -48.8 59.2 71.2 51.0 48 48 A I E -GH 35 54B 0 -13,-1.7 -13,-2.6 6,-0.3 -1,-0.4 -0.994 61.2-170.4-135.1 137.0 55.8 69.7 51.8 49 49 A Y E > + H 0 53B 25 4,-3.1 4,-3.5 -2,-0.4 3,-0.4 -0.787 66.2 16.6-126.0 163.8 54.7 66.7 53.9 50 50 A R T 4 S- 0 0 71 1,-0.3 2,-3.0 -2,-0.3 -1,-0.2 0.893 123.5 -67.1 34.4 64.6 51.4 64.9 54.5 51 51 A A T 4 S+ 0 0 3 -18,-2.8 -1,-0.3 1,-0.2 21,-0.1 -0.087 130.2 21.3 71.0 -57.0 49.9 66.4 51.4 52 52 A N T 4 S+ 0 0 95 -2,-3.0 2,-0.6 -3,-0.4 12,-0.3 0.460 85.3 110.8-131.1 13.6 49.7 70.0 52.5 53 53 A R E < -H 49 0B 105 -4,-3.5 -4,-3.1 10,-0.1 2,-0.3 -0.792 57.6-137.1 -98.5 123.8 52.2 70.9 55.4 54 54 A L E -H 48 0B 61 -2,-0.6 -6,-0.3 -6,-0.2 3,-0.1 -0.503 22.5-118.5 -71.1 128.6 55.1 73.2 54.5 55 55 A M > - 0 0 10 -8,-2.8 3,-0.8 -2,-0.3 -1,-0.1 -0.277 43.1 -89.2 -60.6 148.3 58.4 72.1 56.0 56 56 A I T 3 S+ 0 0 132 1,-0.2 2,-0.2 0, 0.0 -1,-0.1 -0.409 115.4 26.6 -63.6 134.1 59.9 74.7 58.3 57 57 A G T 3 S+ 0 0 77 1,-0.4 -1,-0.2 -3,-0.1 -10,-0.0 -0.240 89.1 124.1 106.5 -46.4 62.1 77.2 56.4 58 58 A V < - 0 0 17 -3,-0.8 -1,-0.4 -2,-0.2 2,-0.1 -0.180 66.9-115.8 -50.5 139.1 60.2 76.7 53.2 59 59 A P > - 0 0 52 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 -0.375 21.4-116.7 -72.4 159.3 58.9 80.0 51.8 60 60 A S T 3 S+ 0 0 111 1,-0.2 16,-0.1 -2,-0.1 -2,-0.1 0.523 102.3 85.2 -83.3 0.1 55.0 80.4 51.5 61 61 A R T 3 S+ 0 0 39 14,-0.1 15,-2.9 15,-0.1 2,-0.3 0.830 82.4 78.0 -59.5 -32.9 55.1 80.7 47.7 62 62 A F E < +C 75 0A 6 -3,-1.0 2,-0.3 13,-0.2 13,-0.2 -0.665 62.0 162.6 -80.8 135.0 55.0 76.8 47.9 63 63 A S E -C 74 0A 59 11,-1.6 11,-3.2 -2,-0.3 2,-0.3 -0.985 21.7-111.3-157.1 153.2 51.7 75.1 48.7 64 64 A G E -C 73 0A 20 -12,-0.3 9,-0.2 -2,-0.3 -12,-0.1 -0.618 17.1 -84.5-123.6 159.9 50.3 71.6 48.4 65 65 A S - 0 0 22 7,-1.5 6,-0.2 -2,-0.3 -1,-0.1 0.744 30.8-109.2 0.8-159.0 48.0 69.0 47.0 66 66 A G - 0 0 43 4,-0.2 2,-0.3 1,-0.0 5,-0.2 0.172 36.5-111.2-123.3-106.1 44.5 67.6 47.4 67 67 A S B > S+D 70 0A 75 3,-1.1 3,-1.0 -16,-0.0 2,-0.6 -0.963 76.6 50.8 178.6-178.8 43.6 64.2 48.8 68 68 A G T 3 S- 0 0 21 -2,-0.3 -39,-1.5 1,-0.2 -37,-0.4 -0.625 123.7 -33.2 70.4-111.1 42.1 60.8 47.7 69 69 A Q T 3 S+ 0 0 80 -2,-0.6 -44,-2.8 -41,-0.2 2,-0.4 0.595 121.7 62.8-125.9 -4.0 44.4 60.0 44.9 70 70 A T E < +BD 24 67A 73 -3,-1.0 -3,-1.1 -46,-0.2 2,-0.3 -0.923 56.9 174.9-122.7 136.4 45.6 63.1 42.9 71 71 A Y E -B 23 0A 1 -48,-3.1 -48,-4.1 -2,-0.4 2,-0.3 -0.960 10.3-160.8-132.8 157.6 47.7 65.7 44.6 72 72 A S E -B 22 0A 33 -2,-0.3 -7,-1.5 -50,-0.3 2,-0.6 -0.992 15.4-147.5-140.6 148.8 49.4 68.9 43.4 73 73 A L E -BC 21 64A 0 -52,-1.6 -52,-1.6 -2,-0.3 2,-0.5 -0.944 25.6-159.5-106.3 117.8 52.3 71.3 44.6 74 74 A T E -BC 20 63A 31 -11,-3.2 -11,-1.6 -2,-0.6 2,-0.7 -0.888 9.0-157.2 -99.7 132.5 51.4 74.8 43.4 75 75 A I E -BC 19 62A 0 -56,-3.3 -56,-2.0 -2,-0.5 3,-0.2 -0.945 7.6-157.3-101.7 113.2 54.2 77.4 43.2 76 76 A S S S+ 0 0 65 -15,-2.9 2,-0.4 -2,-0.7 -1,-0.2 0.914 78.5 3.2 -56.9 -58.1 52.4 80.8 43.4 77 77 A S S S- 0 0 45 -59,-0.1 -1,-0.2 -58,-0.0 -59,-0.2 -0.994 85.6-122.6-130.6 121.2 55.1 82.9 41.7 78 78 A L - 0 0 3 -61,-2.3 -62,-1.6 -2,-0.4 2,-0.3 -0.411 27.6-170.3 -67.4 131.0 58.2 81.1 40.3 79 79 A E > - 0 0 79 -2,-0.2 3,-1.8 -64,-0.2 4,-0.1 -0.892 33.9-114.2-125.4 151.7 61.6 82.2 41.5 80 80 A Y G > S+ 0 0 127 -2,-0.3 3,-2.8 1,-0.3 -1,-0.1 0.913 114.0 63.7 -46.2 -53.0 65.1 81.3 40.2 81 81 A E G 3 S+ 0 0 112 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.792 93.5 66.7 -44.6 -34.9 66.0 79.4 43.3 82 82 A D G < S+ 0 0 6 -3,-1.8 2,-0.6 -43,-0.0 -1,-0.3 0.389 70.4 115.8 -71.6 -1.6 63.1 77.0 42.5 83 83 A M < + 0 0 24 -3,-2.8 2,-0.3 -4,-0.1 22,-0.1 -0.662 44.8 85.8 -78.9 119.1 64.7 75.6 39.4 84 84 A G S S- 0 0 8 -2,-0.6 20,-1.3 -45,-0.2 2,-0.4 -0.905 86.2 -63.7 178.7-171.1 65.4 71.9 39.9 85 85 A I E -FI 38 103B 40 -47,-2.7 -47,-3.3 -2,-0.3 2,-0.3 -0.739 47.2-145.0 -96.7 142.8 63.5 68.6 39.4 86 86 A Y E -FI 37 102B 0 16,-2.8 16,-1.5 -2,-0.4 2,-0.3 -0.823 17.3-172.4-105.1 149.3 60.4 68.2 41.7 87 87 A Y E -F 36 0B 11 -51,-1.7 -51,-2.4 -2,-0.3 2,-0.3 -0.995 12.0-151.6-145.7 141.9 59.4 64.7 43.0 88 88 A a E -F 35 0B 0 -2,-0.3 11,-2.2 -53,-0.2 2,-0.3 -0.886 11.9-168.4-115.2 152.0 56.4 63.3 45.0 89 89 A L E -FJ 34 98B 12 -55,-1.6 -55,-2.6 -2,-0.3 2,-0.3 -0.995 11.6-152.0-144.1 133.4 56.5 60.4 47.3 90 90 A Q E +FJ 33 97B 0 7,-1.4 7,-0.7 -2,-0.3 -57,-0.2 -0.813 12.7 177.1 -98.4 143.3 53.7 58.3 49.0 91 91 A Y + 0 0 2 -59,-1.2 346,-2.8 -2,-0.3 -58,-0.1 0.000 49.2 110.6-140.9 21.6 54.5 56.7 52.3 92 92 A D S S- 0 0 28 -60,-0.5 2,-0.3 344,-0.3 346,-0.1 0.821 91.3 -2.9 -64.1 -35.3 51.1 55.2 53.0 93 93 A D S S- 0 0 86 2,-0.2 4,-0.2 -61,-0.1 -1,-0.1 -0.973 91.0 -55.0-153.2 166.0 52.5 51.7 52.4 94 94 A F S S+ 0 0 59 -2,-0.3 2,-0.1 2,-0.1 -3,-0.1 -0.723 101.3 45.1-101.8 150.8 55.6 49.8 51.5 95 95 A P S S- 0 0 24 0, 0.0 2,-0.3 0, 0.0 -93,-0.2 0.535 87.7-130.3 -68.1 172.4 57.4 49.8 49.4 96 96 A L - 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