==== 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 21-JUN-05 2A1W . COMPND 2 MOLECULE: IMMUNOGLOBULIN LIGHT CHAIN KAPPA; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR E.POZHARSKI,A.HEWAGAMA,A.SHANAFELT,D.RINGE,G.A.PETSKO . 882 4 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40000.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 553 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 343 38.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 80 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 25 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.0 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 3 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 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 0 0 PARALLEL BRIDGES PER LADDER . 7 8 12 4 11 16 1 0 3 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 . 2 1 8 3 1 1 0 0 0 0 0 1 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 0 116 0, 0.0 2,-0.8 0, 0.0 100,-0.1 0.000 360.0 360.0 360.0 142.0 97.5 51.1 67.1 2 2 L V - 0 0 3 98,-0.5 2,-0.7 96,-0.2 93,-0.1 -0.751 360.0-148.0 -87.4 111.6 98.4 47.9 65.2 3 3 L L - 0 0 120 -2,-0.8 23,-0.7 99,-0.0 2,-0.5 -0.726 8.9-159.4 -86.3 116.3 98.4 45.0 67.7 4 4 L M E -A 25 0A 7 -2,-0.7 2,-0.5 99,-0.5 101,-0.4 -0.839 5.1-165.9 -93.9 124.0 100.9 42.3 66.9 5 5 L T E -A 24 0A 76 19,-2.3 19,-3.0 -2,-0.5 2,-0.4 -0.948 3.3-160.5-113.6 126.7 100.3 38.9 68.5 6 6 L Q E -A 23 0A 14 -2,-0.5 17,-0.2 17,-0.2 15,-0.0 -0.836 13.1-132.9-105.2 142.6 103.0 36.2 68.5 7 7 L S E S+A 22 0A 49 15,-1.5 15,-2.4 -2,-0.4 2,-0.2 -0.983 71.5 25.1-150.2 142.1 102.5 32.5 69.0 8 8 L P - 0 0 51 0, 0.0 3,-0.1 0, 0.0 14,-0.1 0.640 64.0-152.2 -78.4-179.3 103.7 30.3 70.5 9 9 L L S S+ 0 0 138 1,-0.3 99,-3.6 -2,-0.2 2,-0.3 0.934 84.1 17.0 -81.0 -55.7 105.3 32.0 73.6 10 10 L S E S-d 108 0B 63 97,-0.2 -1,-0.3 80,-0.1 99,-0.2 -0.896 70.3-173.5-114.2 152.5 107.9 29.4 74.1 11 11 L L E -d 109 0B 36 97,-2.3 99,-2.4 -2,-0.3 2,-0.5 -0.876 8.8-157.3-149.8 108.7 109.1 26.8 71.6 12 12 L P E +d 110 0B 46 0, 0.0 2,-0.3 0, 0.0 99,-0.2 -0.791 18.5 175.7 -90.0 124.3 111.5 24.0 72.2 13 13 L V E -d 111 0B 12 97,-2.2 99,-2.4 -2,-0.5 2,-0.4 -0.919 33.8-116.4-120.2 152.3 113.3 22.5 69.1 14 14 L S > - 0 0 53 -2,-0.3 3,-2.3 97,-0.2 69,-0.2 -0.743 48.7 -99.1 -77.6 133.0 116.0 19.9 68.7 15 15 L L T 3 S+ 0 0 92 -2,-0.4 69,-0.2 97,-0.3 3,-0.1 -0.342 112.9 34.4 -51.4 127.3 119.1 21.5 67.2 16 16 L G T 3 S+ 0 0 47 67,-1.6 66,-0.6 1,-0.4 -1,-0.3 0.070 101.4 100.1 108.7 -20.6 119.1 20.8 63.5 17 17 L D S < S- 0 0 90 -3,-2.3 66,-1.9 66,-0.2 -1,-0.4 0.013 73.8 -95.4 -86.1-168.1 115.3 20.9 63.1 18 18 L Q - 0 0 105 63,-0.2 2,-0.3 64,-0.2 63,-0.2 -0.865 28.8-163.7-114.6 147.4 112.9 23.6 61.9 19 19 L A E - B 0 80A 3 61,-1.8 61,-2.3 -2,-0.3 2,-0.4 -0.966 4.5-157.8-131.1 148.2 110.9 26.2 63.9 20 20 L S E - B 0 79A 57 -2,-0.3 2,-0.5 59,-0.2 59,-0.2 -0.981 7.1-174.5-130.0 117.7 107.9 28.3 62.9 21 21 L I E - B 0 78A 0 57,-2.4 57,-2.5 -2,-0.4 2,-0.3 -0.955 13.0-153.8-111.3 128.1 107.1 31.5 64.7 22 22 L S E -AB 7 77A 32 -15,-2.4 -15,-1.5 -2,-0.5 2,-0.3 -0.716 9.6-169.4-103.9 155.2 103.8 33.3 63.8 23 23 L a E -AB 6 76A 0 53,-1.8 53,-2.2 -2,-0.3 2,-0.3 -0.929 7.8-164.6-148.7 111.1 103.0 37.0 64.0 24 24 L R E -AB 5 75A 84 -19,-3.0 -19,-2.3 -2,-0.3 2,-0.3 -0.751 7.0-146.5-102.6 147.9 99.4 38.3 63.6 25 25 L C E -A 4 0A 13 49,-2.3 -21,-0.2 -2,-0.3 3,-0.1 -0.853 13.2-145.4-111.0 146.7 98.2 41.9 63.0 26 26 L S S S+ 0 0 65 -23,-0.7 2,-0.3 -2,-0.3 -22,-0.1 0.563 88.8 7.6 -84.9 -8.8 94.9 43.5 64.2 27 27 L Q S S- 0 0 96 -24,-0.1 -1,-0.1 46,-0.1 -25,-0.0 -0.966 102.0 -61.0-159.6 168.9 94.8 45.5 60.9 28 28 L S - 0 0 60 -2,-0.3 46,-0.1 1,-0.1 45,-0.1 -0.239 31.3-167.2 -57.0 137.3 96.6 45.9 57.6 29 29 L I + 0 0 0 44,-0.7 8,-0.7 2,-0.1 2,-0.6 0.029 47.8 123.6-114.6 23.2 100.3 46.8 57.7 30 30 L V B -P 36 0C 16 6,-0.2 6,-0.2 686,-0.1 5,-0.1 -0.762 59.5-136.4 -73.0 121.7 100.5 47.6 54.0 31 31 L K > - 0 0 44 4,-2.6 3,-2.8 -2,-0.6 67,-0.1 -0.335 28.3 -94.3 -75.0 164.2 101.7 51.2 53.8 32 32 L S T 3 S+ 0 0 19 1,-0.3 685,-0.1 65,-0.2 -1,-0.1 0.738 126.7 58.2 -49.5 -26.8 100.3 53.9 51.5 33 33 L N T 3 S- 0 0 32 2,-0.2 681,-0.3 679,-0.1 -1,-0.3 0.435 120.2-108.3 -86.6 0.8 103.0 53.0 49.0 34 34 L G S < S+ 0 0 2 -3,-2.8 2,-0.3 1,-0.3 -2,-0.1 0.365 79.9 121.9 93.5 -2.6 101.9 49.3 48.9 35 35 L H - 0 0 77 -5,-0.1 -4,-2.6 62,-0.1 2,-0.6 -0.709 56.0-138.0-100.9 145.2 104.9 48.0 50.8 36 36 L T B -P 30 0C 22 -2,-0.3 2,-1.1 -6,-0.2 -6,-0.2 -0.886 8.3-160.9-103.4 114.5 104.8 46.0 54.0 37 37 L Y + 0 0 7 -8,-0.7 59,-2.8 -2,-0.6 2,-0.4 -0.395 31.3 153.5 -96.0 59.1 107.5 47.0 56.5 38 38 L L E -E 95 0B 0 -2,-1.1 18,-2.3 57,-0.2 17,-0.5 -0.721 19.2-174.9 -85.1 133.9 107.5 43.9 58.7 39 39 L E E -E 94 0B 0 55,-3.1 55,-2.5 -2,-0.4 2,-0.5 -0.968 16.7-148.9-131.1 145.4 110.8 43.1 60.5 40 40 L W E -EF 93 53B 0 13,-2.4 12,-2.7 -2,-0.4 13,-1.0 -0.961 15.8-170.0-113.1 132.1 112.0 40.2 62.7 41 41 L Y E -EF 92 51B 0 51,-3.2 51,-1.9 -2,-0.5 2,-0.4 -0.905 11.1-149.6-115.2 146.3 114.5 40.8 65.5 42 42 L L E -EF 91 50B 14 8,-2.5 8,-2.8 -2,-0.3 2,-0.5 -0.966 12.1-168.5-111.1 133.5 116.4 38.3 67.6 43 43 L Q E -E 90 0B 14 47,-3.2 47,-2.6 -2,-0.4 5,-0.1 -0.974 2.8-163.5-122.8 122.5 117.4 39.1 71.2 44 44 L K > - 0 0 78 -2,-0.5 3,-2.0 4,-0.3 45,-0.1 -0.758 43.0 -82.0 -97.0 148.2 119.8 37.1 73.2 45 45 L P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.188 115.5 9.9 -49.4 134.6 120.0 37.4 77.0 46 46 L G T 3 S+ 0 0 92 1,-0.2 2,-0.2 -3,-0.1 -3,-0.0 0.067 116.3 87.8 84.6 -23.1 122.1 40.4 78.1 47 47 L R S < S- 0 0 176 -3,-2.0 -1,-0.2 1,-0.1 3,-0.1 -0.480 78.4-105.4-107.5 171.4 122.3 41.8 74.6 48 48 L S - 0 0 34 -2,-0.2 -4,-0.3 1,-0.1 -6,-0.1 -0.634 49.4 -77.2 -97.1 157.4 120.2 44.1 72.4 49 49 L P - 0 0 4 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.192 42.6-151.4 -51.6 138.5 117.9 43.0 69.5 50 50 L K E -F 42 0B 87 -8,-2.8 -8,-2.5 279,-0.1 2,-0.4 -0.948 19.3-117.5-114.3 133.7 119.6 42.2 66.2 51 51 L L E +F 41 0B 1 -2,-0.4 -10,-0.2 277,-0.4 3,-0.1 -0.592 41.1 161.5 -75.4 123.3 117.8 42.8 62.9 52 52 L L E + 0 0 7 -12,-2.7 8,-3.0 -2,-0.4 2,-0.4 0.846 61.9 18.7-102.2 -69.0 117.3 39.5 61.0 53 53 L I E -FG 40 59B 0 -13,-1.0 -13,-2.4 6,-0.2 -1,-0.4 -0.886 65.0-172.6-108.7 137.1 114.6 39.9 58.3 54 54 L Y E > + G 0 58B 47 4,-2.8 4,-1.8 -2,-0.4 3,-0.5 -0.967 65.3 17.2-127.2 150.8 113.3 43.2 57.0 55 55 L K T 4 S- 0 0 37 -17,-0.5 2,-2.2 -2,-0.4 -1,-0.2 0.949 125.2 -66.2 58.9 52.8 110.4 44.1 54.7 56 56 L V T 4 S+ 0 0 21 -18,-2.3 -1,-0.3 1,-0.2 21,-0.1 -0.263 129.3 16.9 72.1 -49.7 108.8 40.6 55.2 57 57 L S T 4 S+ 0 0 64 -2,-2.2 2,-0.6 -3,-0.5 -1,-0.2 0.067 86.8 114.9-150.0 26.7 111.4 38.4 53.6 58 58 L N E < -G 54 0B 68 -4,-1.8 -4,-2.8 10,-0.1 2,-0.3 -0.933 56.3-134.3-110.2 120.4 114.8 40.2 53.1 59 59 L R E -G 53 0B 110 -2,-0.6 -6,-0.2 -6,-0.2 3,-0.1 -0.516 21.6-138.9 -67.9 127.8 117.8 38.9 55.0 60 60 L F > - 0 0 28 -8,-3.0 3,-1.7 -2,-0.3 -1,-0.1 -0.203 45.3 -52.8 -76.6 175.5 119.8 41.6 56.6 61 61 L S T 3 S+ 0 0 82 1,-0.3 -1,-0.2 -2,-0.0 -10,-0.0 -0.275 122.6 1.0 -54.9 127.6 123.7 41.7 56.7 62 62 L G T 3 S+ 0 0 86 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.618 90.4 139.9 68.5 16.3 125.4 38.6 58.0 63 63 L V < - 0 0 12 -3,-1.7 -1,-0.2 -11,-0.1 -4,-0.1 -0.835 55.0-118.7 -92.8 122.7 122.1 36.7 58.6 64 64 L P > - 0 0 49 0, 0.0 3,-2.1 0, 0.0 -1,-0.0 -0.271 19.4-113.1 -68.3 145.6 122.5 33.0 57.6 65 65 L D T 3 S+ 0 0 130 1,-0.3 16,-0.1 -6,-0.0 -2,-0.0 0.669 105.3 81.4 -50.9 -20.6 120.3 31.6 54.8 66 66 L R T 3 S+ 0 0 25 16,-0.1 15,-2.0 14,-0.1 2,-0.4 0.737 78.0 78.9 -62.8 -25.5 118.5 29.3 57.3 67 67 L F E < +C 80 0A 4 -3,-2.1 2,-0.3 13,-0.2 13,-0.2 -0.725 59.0 166.4 -80.5 128.0 116.2 32.3 58.3 68 68 L S E -C 79 0A 47 11,-2.0 11,-2.8 -2,-0.4 2,-0.3 -0.976 16.6-159.8-145.3 136.0 113.4 33.0 55.9 69 69 L G E +C 78 0A 8 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.874 18.6 154.7-114.9 147.2 110.3 35.1 56.4 70 70 L S E +C 77 0A 61 7,-2.3 7,-2.4 -2,-0.3 2,-0.2 -0.891 5.1 127.6-153.7-178.7 107.0 35.1 54.5 71 71 L G E -C 76 0A 33 5,-0.3 5,-0.2 -2,-0.3 -2,-0.0 -0.543 33.4-133.3 135.1 160.3 103.3 36.0 54.9 72 72 L S - 0 0 105 3,-1.1 4,-0.0 -2,-0.2 0, 0.0 0.716 67.2 -16.3-109.2 -95.4 100.5 38.0 53.3 73 73 L G S S- 0 0 38 -45,-0.1 -44,-0.7 1,-0.0 -46,-0.1 0.978 129.0 -12.4 -92.4 -68.8 98.0 40.4 54.8 74 74 L T S S+ 0 0 66 -46,-0.1 -49,-2.3 -45,-0.1 2,-0.5 0.243 120.8 82.3-115.6 5.7 97.7 40.2 58.6 75 75 L D E +B 24 0A 72 -51,-0.2 -3,-1.1 -53,-0.0 2,-0.4 -0.948 51.6 173.8-123.3 120.6 99.7 36.9 58.9 76 76 L F E -BC 23 71A 1 -53,-2.2 -53,-1.8 -2,-0.5 2,-0.3 -0.985 9.5-162.4-132.6 135.7 103.5 36.6 59.0 77 77 L T E -BC 22 70A 32 -7,-2.4 -7,-2.3 -2,-0.4 2,-0.5 -0.878 9.6-160.0-117.2 142.1 105.8 33.6 59.5 78 78 L L E -BC 21 69A 0 -57,-2.5 -57,-2.4 -2,-0.3 2,-0.5 -0.982 14.1-168.0-117.0 116.3 109.4 33.2 60.4 79 79 L R E -BC 20 68A 116 -11,-2.8 -11,-2.0 -2,-0.5 2,-0.6 -0.907 2.8-168.6-104.6 128.1 110.9 29.8 59.6 80 80 L I E -BC 19 67A 0 -61,-2.3 -61,-1.8 -2,-0.5 3,-0.4 -0.954 7.7-170.8-117.7 110.8 114.3 28.8 61.0 81 81 L S + 0 0 16 -15,-2.0 3,-0.2 -2,-0.6 -63,-0.2 -0.483 67.5 19.6 -90.7 165.6 115.9 25.7 59.5 82 82 L R S S- 0 0 153 -66,-0.6 -1,-0.2 1,-0.2 -65,-0.2 0.789 86.7-151.4 44.8 37.1 119.0 23.9 60.8 83 83 L V - 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