==== 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 1CFN . 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, . 437 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19938.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 273 62.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 169 38.7 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 . 2 0.5 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 . 41 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 3.9 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 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 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 3 3 4 8 2 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 . 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 A D 0 0 156 0, 0.0 2,-0.3 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 114.1 54.8 17.6 183.3 2 2 A I - 0 0 10 93,-0.5 2,-0.5 91,-0.1 88,-0.1 -0.662 360.0-141.4 -71.3 136.7 52.4 16.6 186.2 3 3 A K - 0 0 112 -2,-0.3 23,-1.7 94,-0.1 2,-0.5 -0.919 9.1-154.7-107.6 134.1 48.9 17.5 185.1 4 4 A M E -A 25 0A 5 -2,-0.5 2,-0.7 94,-0.4 96,-0.3 -0.916 2.2-162.1-106.2 126.7 46.4 18.9 187.6 5 5 A T E -A 24 0A 70 19,-2.6 19,-1.2 -2,-0.5 2,-0.3 -0.813 11.2-169.6-113.4 98.4 42.7 18.4 186.9 6 6 A Q E -A 23 0A 16 -2,-0.7 17,-0.2 17,-0.2 94,-0.1 -0.649 17.3-128.2 -84.4 136.5 40.6 20.8 188.9 7 7 A S E +A 22 0A 63 15,-2.0 15,-2.9 -2,-0.3 2,-0.2 -0.989 68.0 19.7-151.8 155.8 36.8 20.4 189.1 8 8 A P - 0 0 47 0, 0.0 3,-0.1 0, 0.0 14,-0.1 0.732 65.3-152.8 -75.5-167.5 34.3 21.6 188.9 9 9 A S S S+ 0 0 91 1,-0.3 94,-2.0 -2,-0.2 2,-0.3 0.715 75.9 8.5-108.7 -20.0 35.2 24.6 186.7 10 10 A S E -d 103 0B 41 92,-0.2 2,-0.4 75,-0.0 -1,-0.3 -0.968 69.3-161.4-154.5 137.5 32.5 27.0 187.8 11 11 A M E -d 104 0B 33 92,-3.3 94,-3.8 -2,-0.3 2,-0.6 -0.992 15.7-148.1-130.8 142.8 29.9 26.7 190.5 12 12 A Y E +d 105 0B 118 -2,-0.4 2,-0.3 92,-0.2 94,-0.2 -0.866 40.7 163.5-102.8 106.1 26.6 28.5 191.3 13 13 A T E -d 106 0B 2 92,-3.3 94,-2.1 -2,-0.6 2,-0.3 -0.917 32.4-122.1-125.7 171.9 26.4 28.6 195.0 14 14 A S > - 0 0 58 -2,-0.3 3,-2.1 92,-0.2 64,-0.3 -0.852 35.8 -96.5-115.3 152.0 24.5 30.3 197.9 15 15 A L T 3 S+ 0 0 98 -2,-0.3 64,-0.2 1,-0.3 3,-0.1 -0.364 114.1 23.5 -63.0 136.6 25.8 32.3 200.8 16 16 A G T 3 S+ 0 0 44 62,-2.7 -1,-0.3 1,-0.3 63,-0.1 0.256 95.2 127.3 90.8 -8.7 26.1 30.0 203.8 17 17 A E < - 0 0 95 -3,-2.1 61,-2.8 60,-0.2 2,-0.6 -0.278 63.0-114.7 -75.8 160.9 26.4 26.8 201.7 18 18 A R - 0 0 167 59,-0.2 2,-0.3 -3,-0.1 58,-0.2 -0.878 34.2-161.1-101.6 120.3 29.2 24.2 202.1 19 19 A V E - B 0 75A 3 56,-2.4 56,-2.4 -2,-0.6 2,-0.4 -0.759 11.5-166.9-108.3 143.1 31.5 24.0 199.1 20 20 A T E - B 0 74A 59 -2,-0.3 2,-0.4 54,-0.2 54,-0.2 -0.965 5.6-176.7-133.0 118.7 33.9 21.3 197.9 21 21 A I E - B 0 73A 0 52,-2.2 52,-2.0 -2,-0.4 2,-0.3 -0.924 13.6-152.8-109.8 138.3 36.5 21.8 195.2 22 22 A T E -AB 7 72A 30 -15,-2.9 -15,-2.0 -2,-0.4 2,-0.4 -0.848 14.8-167.9-121.0 152.4 38.8 19.0 193.9 23 23 A a E -AB 6 71A 0 48,-2.4 48,-3.4 -2,-0.3 2,-0.4 -0.984 5.0-169.1-132.6 124.8 42.2 18.4 192.4 24 24 A K E -AB 5 70A 107 -19,-1.2 -19,-2.6 -2,-0.4 2,-0.3 -0.957 12.7-149.8-108.1 135.0 43.5 15.2 190.9 25 25 A A E -A 4 0A 3 44,-2.1 -21,-0.2 -2,-0.4 4,-0.1 -0.828 19.5-127.6-102.0 146.5 47.2 14.9 190.0 26 26 A S S S+ 0 0 67 -23,-1.7 2,-0.2 -2,-0.3 -1,-0.1 0.750 96.0 12.8 -66.2 -20.8 48.3 12.7 187.1 27 27 A Q S S- 0 0 100 -24,-0.2 2,-0.4 41,-0.1 -2,-0.1 -0.780 107.0 -67.7-135.5-174.9 50.8 11.0 189.4 28 28 A D - 0 0 86 -2,-0.2 41,-0.2 1,-0.1 -2,-0.1 -0.650 39.5-172.8 -75.6 125.9 51.3 11.0 193.2 29 29 A I > - 0 0 0 39,-2.3 3,-2.1 -2,-0.4 62,-0.2 0.347 32.8-125.8-114.3 19.8 52.4 14.3 194.6 30 30 A N T 3 - 0 0 86 38,-0.3 3,-0.1 1,-0.3 39,-0.1 0.856 67.1 -62.6 54.6 35.8 53.2 13.5 198.3 31 31 A S T 3 S+ 0 0 29 37,-0.2 2,-2.2 1,-0.2 -1,-0.3 0.444 94.6 140.0 61.4 12.6 50.9 16.2 199.7 32 32 A F < + 0 0 26 -3,-2.1 59,-2.4 18,-0.2 60,-0.5 -0.431 35.4 122.3 -85.0 80.0 53.0 19.0 198.1 33 33 A L E -E 90 0B 0 -2,-2.2 18,-2.8 57,-0.2 2,-0.3 -0.992 43.4-162.2-141.8 138.2 49.9 21.1 197.2 34 34 A T E -E 89 0B 0 55,-1.9 55,-1.6 -2,-0.3 2,-0.4 -0.794 8.1-150.9-115.0 160.4 48.7 24.6 197.9 35 35 A W E +EF 88 48B 0 13,-2.0 12,-2.9 -2,-0.3 13,-1.4 -0.982 23.7 172.9-132.0 129.8 45.2 26.1 197.5 36 36 A F E -EF 87 46B 0 51,-1.9 51,-2.5 -2,-0.4 2,-0.4 -0.971 21.2-142.7-142.6 159.9 44.9 29.8 196.8 37 37 A L E -EF 86 45B 4 8,-2.0 8,-2.9 -2,-0.3 2,-0.4 -0.963 8.8-162.6-127.2 135.5 42.2 32.3 195.9 38 38 A Q E -E 85 0B 19 47,-2.4 47,-2.3 -2,-0.4 5,-0.1 -0.982 4.9-157.7-125.8 122.9 42.3 35.2 193.5 39 39 A K - 0 0 52 -2,-0.4 3,-0.3 4,-0.3 45,-0.1 -0.566 45.0 -74.7 -90.8 155.2 39.8 38.1 193.5 40 40 A P S S+ 0 0 74 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.264 118.7 2.7 -57.4 127.3 39.3 40.3 190.4 41 41 A G S S+ 0 0 83 1,-0.2 2,-0.3 -3,-0.1 -2,-0.0 0.988 113.5 108.3 56.9 66.8 42.2 42.6 190.0 42 42 A K S S- 0 0 119 -3,-0.3 -1,-0.2 -4,-0.0 3,-0.1 -0.932 70.7-104.3-169.5 146.4 44.1 41.2 192.9 43 43 A S - 0 0 45 -2,-0.3 -4,-0.3 1,-0.1 276,-0.1 -0.475 52.0 -87.4 -78.3 150.4 47.1 39.1 193.7 44 44 A P - 0 0 7 0, 0.0 2,-0.5 0, 0.0 273,-0.3 -0.194 34.3-154.4 -55.1 142.1 46.7 35.5 194.8 45 45 A K E -F 37 0B 106 -8,-2.9 -8,-2.0 271,-0.1 271,-0.1 -0.937 13.9-137.5-116.4 113.1 46.2 34.7 198.5 46 46 A T E +F 36 0B 7 269,-0.6 -10,-0.3 -2,-0.5 3,-0.1 -0.396 21.6 179.7 -70.9 137.4 47.3 31.2 199.6 47 47 A L E + 0 0 0 -12,-2.9 8,-2.0 1,-0.4 2,-0.3 0.737 64.8 11.8 -99.7 -47.3 44.8 29.6 201.9 48 48 A I E -FG 35 54B 0 -13,-1.4 -13,-2.0 6,-0.2 -1,-0.4 -0.981 61.5-166.4-138.3 147.8 46.4 26.2 202.6 49 49 A Y E >> + G 0 53B 34 4,-1.9 4,-2.5 -2,-0.3 3,-0.6 -0.884 69.4 26.5-138.8 162.4 49.8 24.6 202.0 50 50 A R T 34 S- 0 0 62 -2,-0.3 2,-2.2 1,-0.3 -1,-0.2 0.923 125.4 -71.3 45.5 53.2 51.3 21.1 202.2 51 51 A A T 34 S+ 0 0 0 -18,-2.8 -1,-0.3 1,-0.2 14,-0.2 -0.129 127.8 21.7 66.6 -46.3 47.7 19.8 201.4 52 52 A N T <4 S+ 0 0 75 -2,-2.2 2,-0.6 -3,-0.6 12,-0.3 0.372 82.6 115.6-142.3 21.3 46.1 20.6 204.8 53 53 A R E < -G 49 0B 116 -4,-2.5 -4,-1.9 10,-0.1 -2,-0.1 -0.778 58.7-135.0 -89.4 117.8 48.0 23.3 206.7 54 54 A L E -G 48 0B 64 -2,-0.6 -6,-0.2 -6,-0.2 2,-0.2 -0.349 22.4-121.6 -64.8 155.4 45.9 26.5 207.2 55 55 A M > - 0 0 21 -8,-2.0 3,-2.3 4,-0.1 -1,-0.1 -0.613 39.8 -84.5 -99.7 146.8 47.9 29.7 206.6 56 56 A I T 3 S+ 0 0 131 1,-0.3 -1,-0.1 -2,-0.2 0, 0.0 -0.359 116.5 16.9 -55.3 131.0 48.2 32.3 209.4 57 57 A G T 3 S+ 0 0 76 1,-0.3 -1,-0.3 -3,-0.0 3,-0.0 0.355 89.4 127.5 92.7 -5.2 45.0 34.4 209.2 58 58 A V < - 0 0 15 -3,-2.3 -1,-0.3 -11,-0.2 -11,-0.0 -0.766 67.2-106.3 -91.0 134.6 42.8 32.3 207.1 59 59 A P > - 0 0 57 0, 0.0 3,-1.7 0, 0.0 -4,-0.1 -0.066 24.5-120.6 -48.6 153.9 39.4 31.5 208.6 60 60 A S T 3 S+ 0 0 116 1,-0.3 -2,-0.0 -6,-0.1 16,-0.0 0.398 102.1 84.3 -83.9 9.6 38.9 28.0 209.9 61 61 A R T 3 S+ 0 0 25 16,-0.1 15,-1.6 14,-0.1 -1,-0.3 0.706 78.3 80.3 -48.8 -57.9 36.0 27.4 207.5 62 62 A F E < +C 75 0A 5 -3,-1.7 2,-0.3 13,-0.2 13,-0.2 -0.572 60.8 166.4 -60.3 146.8 38.7 26.5 204.9 63 63 A S E -C 74 0A 59 11,-1.1 11,-2.3 -2,-0.3 2,-0.2 -0.905 19.4-153.1-162.8 128.6 40.1 23.0 205.3 64 64 A G E +C 73 0A 9 -12,-0.3 2,-0.3 -2,-0.3 9,-0.2 -0.639 18.4 169.1-104.7 157.7 42.3 20.9 202.9 65 65 A S E +C 72 0A 62 7,-2.1 7,-3.1 -14,-0.2 2,-0.2 -0.981 18.4 79.1-164.3 162.2 42.5 17.2 202.6 66 66 A G E -C 71 0A 30 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.611 36.0-146.7 126.9 178.1 43.8 14.3 200.6 67 67 A S E > +C 70 0A 83 3,-0.8 3,-1.1 -2,-0.2 2,-0.9 -0.900 68.9 17.7-169.7 160.8 46.9 12.3 199.9 68 68 A G T 3 S- 0 0 22 -2,-0.3 -39,-2.3 1,-0.2 -38,-0.3 -0.563 128.3 -23.6 73.8-109.6 48.2 10.6 196.8 69 69 A Q T 3 S+ 0 0 95 -2,-0.9 -44,-2.1 -41,-0.2 2,-0.6 0.581 118.5 72.1-119.0 -20.4 46.4 11.9 193.8 70 70 A T E < +BC 24 67A 62 -3,-1.1 -3,-0.8 -46,-0.2 2,-0.3 -0.907 56.7 178.6-111.7 116.1 43.1 13.3 195.0 71 71 A Y E -BC 23 66A 1 -48,-3.4 -48,-2.4 -2,-0.6 2,-0.3 -0.853 6.1-163.1-113.0 155.5 43.0 16.6 196.9 72 72 A S E -BC 22 65A 23 -7,-3.1 -7,-2.1 -2,-0.3 2,-0.4 -0.985 15.5-164.5-140.3 152.5 40.2 18.6 198.4 73 73 A L E -BC 21 64A 0 -52,-2.0 -52,-2.2 -2,-0.3 2,-0.4 -0.991 16.0-166.9-130.6 127.0 39.3 22.0 199.7 74 74 A T E -BC 20 63A 22 -11,-2.3 -11,-1.1 -2,-0.4 2,-0.5 -0.966 11.3-162.9-120.5 137.1 36.1 22.4 201.7 75 75 A I E -BC 19 62A 0 -56,-2.4 -56,-2.4 -2,-0.4 3,-0.3 -0.996 11.6-159.3-117.2 106.4 34.6 25.8 202.6 76 76 A S S S+ 0 0 50 -15,-1.6 2,-0.3 -2,-0.5 -1,-0.1 0.836 76.0 10.8 -66.7 -34.7 32.1 25.0 205.3 77 77 A S S S- 0 0 47 -59,-0.1 -1,-0.3 -58,-0.0 -59,-0.2 -0.839 84.1-127.1-149.0 107.6 29.9 28.0 205.1 78 78 A L - 0 0 3 -61,-2.8 -62,-2.7 -2,-0.3 2,-0.3 -0.286 24.4-167.0 -61.1 132.3 30.2 30.4 202.2 79 79 A E > - 0 0 87 -64,-0.2 3,-3.4 -63,-0.1 4,-0.2 -0.926 34.0-113.6-124.9 147.8 30.7 34.0 202.9 80 80 A Y G > S+ 0 0 114 -2,-0.3 3,-1.4 1,-0.3 -1,-0.1 0.772 115.9 60.0 -46.8 -33.9 30.5 36.9 200.4 81 81 A E G 3 S+ 0 0 92 1,-0.3 -1,-0.3 -3,-0.0 -3,-0.0 0.614 92.4 68.7 -69.9 -11.9 34.2 37.6 200.8 82 82 A D G < S+ 0 0 7 -3,-3.4 -1,-0.3 2,-0.1 -2,-0.2 0.482 71.7 115.6 -86.5 -10.8 35.0 34.0 199.6 83 83 A M < + 0 0 24 -3,-1.4 2,-0.3 -4,-0.2 22,-0.1 -0.435 46.4 74.5 -70.2 127.2 33.8 34.8 196.0 84 84 A G S S- 0 0 7 20,-0.2 20,-1.8 -2,-0.2 2,-0.5 -0.981 86.5 -45.9 163.4-159.3 36.6 34.6 193.4 85 85 A I E -EH 38 103B 51 -47,-2.3 -47,-2.4 -2,-0.3 2,-0.4 -0.894 46.4-154.4-111.4 133.3 38.6 32.0 191.6 86 86 A Y E -EH 37 102B 0 16,-2.8 16,-0.8 -2,-0.5 2,-0.3 -0.828 14.0-179.1-104.8 137.5 40.2 29.1 193.4 87 87 A Y E -E 36 0B 24 -51,-2.5 -51,-1.9 -2,-0.4 2,-0.3 -0.976 18.5-145.8-131.8 150.3 43.3 27.2 192.2 88 88 A a E -E 35 0B 0 -2,-0.3 11,-1.8 -53,-0.2 2,-0.4 -0.721 14.7-158.5-107.8 155.0 45.4 24.3 193.4 89 89 A L E -EI 34 98B 1 -55,-1.6 -55,-1.9 -2,-0.3 2,-0.4 -0.960 6.1-150.7-137.2 120.8 49.2 24.2 192.8 90 90 A Q E +EI 33 97B 0 7,-2.3 7,-0.9 -2,-0.4 -57,-0.2 -0.754 19.2 170.5 -90.6 135.0 51.4 21.0 192.8 91 91 A Y + 0 0 2 -59,-2.4 -58,-0.1 -2,-0.4 -1,-0.1 0.040 45.8 108.9-135.3 25.7 55.0 21.6 193.9 92 92 A D S S- 0 0 32 -60,-0.5 2,-0.3 1,-0.2 4,-0.1 0.906 91.0 -3.8 -64.5 -47.3 56.1 18.0 194.1 93 93 A D S S- 0 0 88 2,-0.2 4,-0.2 -61,-0.1 -1,-0.2 -0.947 91.8 -56.5-145.4 167.0 58.3 18.3 191.0 94 94 A F S S+ 0 0 57 -2,-0.3 2,-0.1 2,-0.1 -3,-0.1 -0.628 103.8 49.3 -91.2 150.3 59.3 20.7 188.3 95 95 A P S S- 0 0 20 0, 0.0 -93,-0.5 0, 0.0 -2,-0.2 0.534 87.8-133.6 -73.2 150.4 57.9 22.2 186.4 96 96 A L - 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