==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 06-MAR-00 1EK3 . COMPND 2 MOLECULE: KAPPA-4 IMMUNOGLOBULIN LIGHT CHAIN VL; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.R.POKKULURI,D.-B.HUANG,R.RAFFEN,F.J.STEVENS,M.SCHIFFER . 228 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11002.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 142 62.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 4.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 87 38.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 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 . 22 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 3 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 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 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 1 5 4 2 0 6 0 0 0 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 0 2 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 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 0 146 0, 0.0 2,-0.4 0, 0.0 25,-0.0 0.000 360.0 360.0 360.0-177.2 -3.5 40.9 56.0 2 2 A I - 0 0 29 94,-0.1 2,-0.6 23,-0.0 94,-0.1 -0.670 360.0-145.3 -84.0 132.8 -0.7 41.8 53.6 3 3 A V - 0 0 85 -2,-0.4 23,-1.5 2,-0.0 2,-0.6 -0.881 11.1-166.9-102.5 120.7 -0.8 40.1 50.2 4 4 A M E -A 25 0A 19 -2,-0.6 2,-0.5 100,-0.3 102,-0.4 -0.929 9.1-174.9-109.1 115.1 2.5 39.3 48.6 5 5 A T E -A 24 0A 71 19,-2.7 19,-2.8 -2,-0.6 2,-0.3 -0.936 5.2-165.3-115.8 127.9 2.3 38.3 44.9 6 6 A Q E -A 23 0A 9 -2,-0.5 17,-0.2 17,-0.2 3,-0.0 -0.800 17.5-122.8-109.0 153.2 5.2 37.1 42.8 7 7 A S E S+A 22 0A 70 15,-2.2 15,-2.7 -2,-0.3 2,-0.1 -0.975 80.2 16.2-148.7 130.0 5.3 36.8 39.0 8 8 A P - 0 0 51 0, 0.0 3,-0.1 0, 0.0 14,-0.1 0.646 65.4-147.6 -84.7-174.2 5.9 34.5 37.3 9 9 A D S S+ 0 0 119 1,-0.3 100,-2.5 -2,-0.1 2,-0.3 0.732 85.4 11.5 -85.1 -24.2 5.5 31.4 39.4 10 10 A S E +d 109 0B 60 98,-0.3 2,-0.3 81,-0.1 -1,-0.3 -0.989 68.8 171.7-150.8 147.2 8.2 29.6 37.4 11 11 A L E -d 110 0B 29 98,-2.5 100,-2.4 -2,-0.3 2,-0.4 -0.991 11.9-163.5-156.2 154.3 10.8 30.7 34.8 12 12 A A E +d 111 0B 46 -2,-0.3 2,-0.3 98,-0.2 100,-0.2 -0.997 10.0 176.6-142.8 135.7 13.8 29.3 32.9 13 13 A V E -d 112 0B 25 98,-1.6 100,-2.8 -2,-0.4 3,-0.1 -0.914 38.0 -88.0-134.0 162.0 16.5 31.1 31.0 14 14 A S > - 0 0 44 -2,-0.3 3,-2.4 98,-0.2 70,-0.3 -0.218 61.7 -76.0 -66.0 158.3 19.7 29.9 29.2 15 15 A P T 3 S+ 0 0 78 0, 0.0 70,-0.2 0, 0.0 -1,-0.2 -0.304 121.5 13.9 -55.5 135.4 23.0 29.6 31.1 16 16 A G T 3 S+ 0 0 37 68,-2.8 2,-0.1 1,-0.3 69,-0.1 0.383 99.9 125.1 80.4 -6.3 24.4 33.0 31.7 17 17 A E < - 0 0 99 -3,-2.4 67,-2.4 67,-0.2 -1,-0.3 -0.451 67.4 -95.9 -85.8 163.0 21.2 34.9 30.8 18 18 A R - 0 0 176 65,-0.2 2,-0.4 -2,-0.1 64,-0.2 -0.538 33.1-160.3 -79.6 138.8 19.4 37.4 33.0 19 19 A A E - B 0 81A 1 62,-2.5 62,-2.9 -2,-0.2 2,-0.4 -0.978 5.5-164.7-121.0 132.4 16.5 36.2 35.2 20 20 A T E - B 0 80A 62 -2,-0.4 2,-0.4 60,-0.2 60,-0.2 -0.971 5.7-173.2-124.1 131.5 13.9 38.6 36.5 21 21 A I E - B 0 79A 1 58,-2.8 58,-2.6 -2,-0.4 2,-0.3 -0.981 10.7-152.3-124.2 131.4 11.3 38.1 39.3 22 22 A N E -AB 7 78A 54 -15,-2.7 -15,-2.2 -2,-0.4 2,-0.4 -0.764 9.9-173.1-104.5 148.1 8.6 40.5 40.2 23 23 A a E -AB 6 77A 0 54,-2.5 54,-2.9 -2,-0.3 2,-0.4 -0.998 3.9-164.8-140.6 135.7 6.9 40.9 43.7 24 24 A K E -AB 5 76A 108 -19,-2.8 -19,-2.7 -2,-0.4 2,-0.4 -0.978 4.7-156.9-125.5 133.3 4.0 43.1 44.6 25 25 A S E -A 4 0A 4 50,-3.1 -21,-0.2 -2,-0.4 4,-0.1 -0.897 15.6-151.1-109.7 137.6 2.9 44.1 48.1 26 26 A S S S+ 0 0 74 -23,-1.5 2,-0.4 -2,-0.4 -1,-0.1 0.652 87.6 65.9 -76.4 -14.4 -0.6 45.1 49.1 27 27 A Q S S- 0 0 65 -24,-0.2 2,-0.5 48,-0.1 -2,-0.1 -0.902 93.4-115.4-112.8 135.4 1.0 47.2 51.8 28 27AA N - 0 0 86 -2,-0.4 47,-0.2 1,-0.2 -2,-0.1 -0.554 31.3-174.7 -67.2 115.7 3.3 50.2 51.3 29 27BA L + 0 0 4 45,-2.8 9,-2.1 -2,-0.5 2,-0.5 0.386 46.2 105.6 -96.7 3.2 6.6 48.9 52.7 30 27CA L E -J 37 0C 53 7,-0.2 2,-0.9 8,-0.1 7,-0.2 -0.738 53.4-158.6 -93.1 128.0 8.6 52.2 52.4 31 27DA D E >>> -J 36 0C 69 5,-2.6 4,-1.7 -2,-0.5 5,-1.2 -0.897 10.0-161.8 -99.8 104.9 9.4 54.3 55.4 32 27EA S T 345S+ 0 0 77 -2,-0.9 -1,-0.2 1,-0.2 5,-0.0 0.801 84.3 58.6 -59.8 -31.5 10.0 57.7 53.7 33 27FA S T 345S+ 0 0 94 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.857 120.0 26.9 -69.5 -33.7 11.8 59.1 56.7 34 28 A F T <45S- 0 0 148 -3,-0.6 -2,-0.2 2,-0.2 -1,-0.2 0.510 98.9-130.5-104.6 -7.1 14.5 56.4 56.7 35 29 A D T <5 + 0 0 129 -4,-1.7 2,-0.4 1,-0.2 -3,-0.2 0.843 63.1 133.8 59.7 35.8 14.3 55.6 53.0 36 30 A T E < -J 31 0C 34 -5,-1.2 -5,-2.6 21,-0.0 2,-0.5 -0.940 46.7-151.7-122.0 141.8 14.1 51.9 53.8 37 31 A N E -J 30 0C 13 -2,-0.4 2,-2.4 -7,-0.2 -7,-0.2 -0.940 17.0-138.5-109.6 126.7 11.7 49.2 52.5 38 32 A T + 0 0 32 -9,-2.1 59,-2.0 -2,-0.5 2,-0.4 -0.368 67.4 120.0 -80.2 60.5 10.9 46.3 54.8 39 33 A L E +E 96 0B 0 -2,-2.4 18,-3.1 57,-0.2 2,-0.3 -0.994 37.3 175.3-129.4 131.0 11.2 44.0 51.8 40 34 A A E -E 95 0B 0 55,-2.8 55,-2.9 -2,-0.4 2,-0.4 -0.880 21.1-138.0-132.0 163.6 13.7 41.1 51.5 41 35 A W E -EF 94 54B 0 13,-2.4 12,-3.1 -2,-0.3 13,-1.7 -0.982 19.3-169.9-124.8 136.8 14.5 38.3 49.1 42 36 A Y E -EF 93 52B 0 51,-3.1 51,-1.9 -2,-0.4 2,-0.4 -0.871 13.8-141.9-124.5 158.6 15.3 34.7 50.1 43 37 A Q E -EF 92 51B 33 8,-2.8 8,-2.8 -2,-0.3 2,-0.5 -0.973 13.5-166.3-121.2 133.4 16.7 31.7 48.3 44 38 A Q E -E 91 0B 23 47,-2.8 47,-2.4 -2,-0.4 3,-0.1 -0.959 1.7-163.2-126.5 116.6 15.4 28.2 49.0 45 39 A K > - 0 0 59 -2,-0.5 3,-2.1 4,-0.4 45,-0.1 -0.510 49.0 -66.0 -88.1 161.8 17.2 25.0 47.8 46 40 A P T 3 S+ 0 0 120 0, 0.0 -1,-0.2 0, 0.0 44,-0.0 -0.203 119.5 0.6 -51.9 129.7 15.4 21.6 47.7 47 41 A G T 3 S+ 0 0 60 1,-0.2 165,-0.1 165,-0.1 -2,-0.0 0.398 112.1 103.6 73.7 -3.0 14.5 20.3 51.2 48 42 A Q S < S- 0 0 73 -3,-2.1 -1,-0.2 1,-0.1 3,-0.1 -0.656 73.8-108.7-109.0 164.8 16.0 23.4 52.9 49 43 A P - 0 0 1 0, 0.0 -4,-0.4 0, 0.0 2,-0.2 -0.452 51.8 -82.3 -84.0 165.6 14.4 26.5 54.6 50 44 A P - 0 0 0 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.457 43.2-153.5 -72.1 140.4 14.8 29.9 52.8 51 45 A K E -F 43 0B 61 -8,-2.8 -8,-2.8 -2,-0.2 2,-0.1 -0.914 24.9 -99.3-116.0 141.0 18.0 31.8 53.4 52 46 A L E +F 42 0B 18 -2,-0.4 -10,-0.2 -10,-0.2 3,-0.1 -0.322 43.0 160.7 -63.0 132.5 18.4 35.6 53.2 53 47 A L E + 0 0 11 -12,-3.1 8,-2.8 1,-0.4 2,-0.3 0.728 66.8 11.8-113.3 -51.8 19.8 37.2 50.0 54 48 A I E -FG 41 60B 0 -13,-1.7 -13,-2.4 6,-0.2 -1,-0.4 -0.992 58.1-173.2-137.8 141.7 18.7 40.8 50.1 55 49 A Y E >> S+ G 0 59B 61 4,-2.8 4,-2.3 -2,-0.3 3,-0.5 -0.862 71.0 29.7-128.2 164.2 17.2 43.1 52.7 56 50 A W T 34 S- 0 0 95 -2,-0.3 2,-2.1 1,-0.3 -16,-0.2 0.881 123.9 -78.3 50.7 39.6 15.9 46.7 52.6 57 51 A A T 34 S+ 0 0 3 -18,-3.1 -1,-0.3 1,-0.2 21,-0.1 -0.088 126.9 27.3 67.4 -37.9 15.0 45.9 49.0 58 52 A S T <4 S+ 0 0 75 -2,-2.1 2,-0.6 -3,-0.5 12,-0.3 0.481 86.0 107.8-133.3 -5.0 18.5 46.3 47.5 59 53 A S E < -G 55 0B 40 -4,-2.3 -4,-2.8 10,-0.1 2,-0.2 -0.694 59.8-139.5 -83.7 120.3 21.1 45.5 50.2 60 54 A R E -G 54 0B 111 -2,-0.6 -6,-0.2 -6,-0.2 2,-0.1 -0.557 16.1-119.5 -79.9 139.5 22.9 42.2 49.7 61 55 A E > - 0 0 37 -8,-2.8 3,-2.0 -2,-0.2 -1,-0.1 -0.428 45.8 -86.4 -71.7 150.1 23.7 39.9 52.6 62 56 A S T 3 S+ 0 0 109 1,-0.2 -1,-0.1 -2,-0.1 0, 0.0 -0.341 117.3 28.4 -58.9 136.3 27.4 39.3 53.1 63 57 A G T 3 S+ 0 0 83 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.0 0.153 87.0 124.6 99.4 -20.2 28.5 36.3 51.0 64 58 A V < - 0 0 18 -3,-2.0 -1,-0.3 -11,-0.1 -4,-0.1 -0.628 65.5-116.0 -78.6 127.0 25.8 36.8 48.3 65 59 A P > - 0 0 45 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.224 20.5-116.4 -60.7 149.8 27.4 37.1 44.8 66 60 A D T 3 S+ 0 0 129 1,-0.3 16,-0.1 15,-0.0 -2,-0.0 0.513 104.6 81.0 -68.8 -3.5 27.0 40.4 42.9 67 61 A R T 3 S+ 0 0 36 14,-0.1 15,-2.5 16,-0.1 2,-0.5 0.643 82.3 79.8 -75.6 -10.6 25.0 38.8 40.1 68 62 A F E < +C 81 0A 3 -3,-1.7 2,-0.3 13,-0.2 13,-0.2 -0.831 60.4 161.4 -97.3 129.9 22.0 39.2 42.6 69 63 A S E -C 80 0A 59 11,-2.0 11,-3.0 -2,-0.5 2,-0.4 -0.994 22.3-153.9-150.6 142.9 20.4 42.6 42.9 70 64 A G E +C 79 0A 9 -2,-0.3 2,-0.3 -12,-0.3 9,-0.2 -0.901 16.5 170.3-118.8 147.7 17.1 43.9 44.1 71 65 A S E +C 78 0A 58 7,-2.3 7,-2.4 -2,-0.4 2,-0.1 -0.889 25.0 78.9-144.1 173.6 15.2 47.0 43.2 72 66 A G E -C 77 0A 38 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.359 45.9-134.5 110.9 167.6 11.8 48.7 43.7 73 67 A S E > +C 76 0A 60 3,-1.3 2,-1.5 -2,-0.1 3,-1.4 -0.986 63.5 1.6-159.3 154.7 10.1 50.7 46.4 74 68 A G T 3 S- 0 0 10 -2,-0.3 -45,-2.8 1,-0.2 -47,-0.1 -0.466 130.4 -13.4 70.5 -89.0 6.7 50.9 48.2 75 69 A T T 3 S+ 0 0 50 -2,-1.5 -50,-3.1 -47,-0.2 2,-0.5 0.573 122.1 66.2-124.5 -17.5 4.7 48.1 46.7 76 70 A D E < +BC 24 73A 79 -3,-1.4 -3,-1.3 -52,-0.2 2,-0.3 -0.947 57.5 165.4-117.6 122.8 6.5 46.9 43.6 77 71 A F E -BC 23 72A 0 -54,-2.9 -54,-2.5 -2,-0.5 2,-0.4 -0.880 18.0-154.4-131.8 162.6 9.9 45.2 43.7 78 72 A T E -BC 22 71A 31 -7,-2.4 -7,-2.3 -2,-0.3 2,-0.5 -0.999 6.5-156.2-142.9 136.1 12.2 43.1 41.5 79 73 A L E -BC 21 70A 0 -58,-2.6 -58,-2.8 -2,-0.4 2,-0.4 -0.940 20.6-167.7-107.3 130.5 14.9 40.5 42.0 80 74 A T E -BC 20 69A 23 -11,-3.0 -11,-2.0 -2,-0.5 2,-0.7 -0.978 17.3-164.2-125.0 132.7 17.3 40.3 39.1 81 75 A I E -BC 19 68A 0 -62,-2.9 -62,-2.5 -2,-0.4 3,-0.3 -0.945 10.9-163.3-113.1 104.3 20.0 37.6 38.5 82 76 A S S S+ 0 0 63 -15,-2.5 2,-0.4 -2,-0.7 -1,-0.2 0.862 78.9 16.8 -56.1 -45.3 22.3 39.1 35.9 83 77 A S S S- 0 0 39 -16,-0.1 -1,-0.2 -65,-0.1 -65,-0.2 -0.879 84.1-137.9-135.3 100.9 24.0 35.8 34.8 84 78 A L - 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