==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM/METAL TRANSPORT 14-AUG-08 2W0F . COMPND 2 MOLECULE: ANTIBODY FAB FRAGMENT LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR M.J.LENAEUS,P.J.FOCIA,T.WAGNER,A.GROSS . 532 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24499.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 354 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 168 31.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 . 49 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 15.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 0 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 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 . 3 5 6 2 4 7 2 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 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 Q 0 0 175 0, 0.0 2,-0.6 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 167.7 30.8 -34.0 18.8 2 2 A V - 0 0 100 1,-0.1 3,-0.1 22,-0.0 107,-0.1 -0.617 360.0-162.4 -71.3 117.0 27.6 -34.4 16.6 3 3 A Q S S+ 0 0 41 -2,-0.6 22,-1.6 1,-0.2 2,-0.4 0.852 70.9 32.7 -74.9 -37.1 24.8 -32.9 18.6 4 4 A L E -A 24 0A 5 104,-0.4 2,-0.6 20,-0.2 106,-0.5 -0.975 69.3-159.0-130.5 123.3 21.7 -34.4 16.8 5 5 A Q E +A 23 0A 124 18,-3.4 18,-2.3 -2,-0.4 104,-0.1 -0.863 15.8 168.7-106.5 120.3 21.7 -37.9 15.2 6 6 A Q - 0 0 24 -2,-0.6 16,-0.1 16,-0.2 104,-0.1 -0.960 38.8-102.3-125.4 147.2 19.2 -38.9 12.5 7 7 A P - 0 0 46 0, 0.0 106,-0.1 0, 0.0 3,-0.1 -0.307 27.9-130.9 -52.6 146.5 19.1 -41.9 10.2 8 8 A G S S+ 0 0 28 104,-0.2 105,-2.8 1,-0.2 2,-0.3 0.871 78.9 10.6 -69.2 -40.0 20.2 -41.2 6.6 9 9 A A E -d 113 0B 9 103,-0.2 2,-0.3 196,-0.1 105,-0.2 -0.970 47.2-173.6-147.8 154.8 17.2 -42.8 4.9 10 10 A E E -d 114 0B 64 103,-2.2 105,-2.0 -2,-0.3 2,-0.4 -0.924 13.6-156.9-148.5 121.8 13.7 -44.2 5.2 11 11 A L E +d 115 0B 46 -2,-0.3 2,-0.3 103,-0.2 105,-0.2 -0.869 18.1 179.9-101.3 135.4 11.7 -45.9 2.4 12 12 A V E -d 116 0B 9 103,-2.4 105,-2.3 -2,-0.4 3,-0.1 -0.982 24.0-125.9-140.2 140.6 8.0 -45.9 2.9 13 13 A K > - 0 0 132 -2,-0.3 3,-2.6 103,-0.2 73,-0.2 -0.629 45.7 -85.6 -86.7 148.9 5.2 -47.3 0.7 14 14 A P T 3 S+ 0 0 79 0, 0.0 73,-0.2 0, 0.0 -1,-0.1 -0.300 120.0 17.9 -52.6 131.9 2.3 -45.1 -0.4 15 15 A G T 3 S+ 0 0 57 71,-3.0 70,-0.4 1,-0.3 72,-0.1 0.151 105.1 114.7 88.5 -17.8 -0.3 -45.1 2.4 16 16 A A < - 0 0 38 -3,-2.6 70,-2.1 70,-0.3 2,-0.3 -0.166 59.0-126.1 -81.2 179.1 2.2 -46.5 4.9 17 17 A S - 0 0 60 67,-0.2 2,-0.3 68,-0.2 67,-0.2 -0.979 17.7-169.3-135.1 138.1 3.6 -44.9 8.1 18 18 A V E - B 0 83A 13 65,-2.0 65,-3.1 -2,-0.3 2,-0.6 -0.953 14.1-146.5-131.5 146.4 7.2 -44.2 9.4 19 19 A K E - B 0 82A 111 -2,-0.3 63,-0.3 63,-0.2 2,-0.2 -0.942 19.5-158.4-116.9 109.8 8.6 -43.0 12.7 20 20 A L E - B 0 81A 3 61,-2.9 61,-1.9 -2,-0.6 2,-0.3 -0.528 6.5-149.4 -88.4 154.6 11.7 -40.8 12.4 21 21 A S E - B 0 80A 35 59,-0.2 2,-0.3 -2,-0.2 59,-0.2 -0.896 16.3-170.9-129.8 155.8 14.2 -40.3 15.3 22 22 A a E - B 0 79A 1 57,-1.6 57,-2.5 -2,-0.3 2,-0.4 -0.853 13.0-160.7-147.6 98.0 16.5 -37.6 16.5 23 23 A K E -AB 5 78A 27 -18,-2.3 -18,-3.4 -2,-0.3 2,-0.2 -0.739 14.5-153.6 -86.3 130.8 19.0 -38.6 19.2 24 24 A A E +A 4 0A 22 53,-2.4 2,-0.2 -2,-0.4 -20,-0.2 -0.685 20.9 161.7-107.0 155.7 20.5 -35.6 21.1 25 25 A S + 0 0 41 -22,-1.6 2,-0.1 -2,-0.2 -22,-0.0 -0.873 38.7 60.7-154.5-174.8 23.7 -35.1 23.0 26 26 A G S S- 0 0 33 -2,-0.2 2,-0.2 -24,-0.1 -2,-0.0 -0.499 103.6 -3.2 82.6-162.2 25.8 -32.1 24.3 27 27 A Y S S- 0 0 185 -2,-0.1 2,-0.4 1,-0.0 -2,-0.1 -0.476 71.5-169.1 -64.3 127.3 24.3 -29.6 26.8 28 28 A T - 0 0 83 -2,-0.2 2,-0.3 -4,-0.1 -2,-0.1 -0.983 7.5-177.4-122.0 134.5 20.7 -30.4 27.6 29 29 A F > - 0 0 110 -2,-0.4 3,-1.9 1,-0.0 25,-0.2 -0.945 37.4-122.9-126.6 151.3 18.2 -28.2 29.5 30 30 A T T 3 S+ 0 0 64 -2,-0.3 24,-0.2 1,-0.3 -1,-0.0 0.558 113.4 62.5 -65.9 -8.7 14.6 -28.9 30.5 31 31 A S T 3 S+ 0 0 34 22,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.257 80.2 115.9 -98.2 7.4 13.8 -25.7 28.6 32 32 A D < - 0 0 11 -3,-1.9 2,-0.4 68,-0.1 22,-0.4 -0.582 48.6-155.5 -81.6 141.4 15.0 -27.1 25.2 33 33 A W E -E 99 0B 0 66,-3.2 66,-3.1 -2,-0.2 2,-0.5 -0.927 6.0-147.5-112.6 142.8 12.7 -27.6 22.2 34 34 A I E -EF 98 51B 11 17,-2.3 17,-1.9 -2,-0.4 2,-0.3 -0.937 20.1-166.1-103.7 126.1 13.2 -30.0 19.3 35 35 A H E -EF 97 50B 0 62,-2.5 62,-2.1 -2,-0.5 2,-0.4 -0.803 10.9-145.1-109.5 151.1 11.8 -28.8 16.0 36 36 A W E -EF 96 49B 0 13,-2.4 12,-2.9 -2,-0.3 13,-1.1 -0.965 16.0-173.0-118.0 137.3 11.1 -30.7 12.7 37 37 A V E -EF 95 47B 0 58,-2.5 58,-2.8 -2,-0.4 2,-0.4 -0.994 10.5-147.8-134.2 133.7 11.7 -29.0 9.4 38 38 A K E -EF 94 46B 25 8,-2.9 8,-1.5 -2,-0.4 2,-0.4 -0.888 11.4-175.7-108.4 133.5 10.8 -30.4 5.9 39 39 A Q E -E 93 0B 23 54,-2.5 54,-2.5 -2,-0.4 6,-0.1 -0.968 11.6-155.4-128.2 112.0 12.7 -29.7 2.7 40 40 A R > - 0 0 51 4,-0.5 3,-2.6 -2,-0.4 52,-0.2 -0.670 48.6 -80.2 -78.9 141.4 11.4 -31.1 -0.7 41 41 A P T 3 S+ 0 0 112 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.152 118.0 8.2 -50.6 129.9 14.2 -31.5 -3.3 42 42 A G T 3 S+ 0 0 88 1,-0.3 2,-0.1 -3,-0.1 -2,-0.0 0.404 117.0 98.6 78.3 0.2 15.0 -28.1 -4.9 43 43 A H S < S- 0 0 128 -3,-2.6 -1,-0.3 1,-0.2 276,-0.0 -0.429 71.2 -90.2-116.4-175.4 12.7 -26.3 -2.4 44 44 A G - 0 0 24 -2,-0.1 -4,-0.5 1,-0.1 2,-0.3 -0.084 46.3 -79.5 -88.7-175.0 12.8 -24.3 0.8 45 45 A L - 0 0 14 273,-0.4 2,-0.4 -6,-0.1 272,-0.2 -0.709 40.6-166.5 -87.6 140.6 12.6 -25.1 4.5 46 46 A E E -F 38 0B 67 -8,-1.5 -8,-2.9 -2,-0.3 2,-0.2 -0.983 18.4-129.9-135.3 121.6 9.2 -25.7 6.0 47 47 A W E +F 37 0B 8 -2,-0.4 -10,-0.2 -10,-0.2 3,-0.1 -0.496 26.6 174.7 -74.9 131.0 8.4 -25.8 9.7 48 48 A I E - 0 0 13 -12,-2.9 13,-2.9 1,-0.4 2,-0.3 0.852 52.1 -57.1-101.3 -50.6 6.4 -28.8 10.8 49 49 A G E -FG 36 60B 0 -13,-1.1 -13,-2.4 11,-0.3 -1,-0.4 -0.973 40.6-125.3 179.5 178.1 6.2 -28.7 14.6 50 50 A E E -FG 35 59B 0 9,-2.4 9,-1.9 -2,-0.3 2,-0.3 -0.935 12.8-159.3-140.6 156.5 8.1 -28.5 17.9 51 51 A I E -FG 34 58B 1 -17,-1.9 -17,-2.3 -2,-0.3 7,-0.2 -0.999 17.9-146.4-140.7 141.3 8.2 -30.5 21.1 52 52 A I E >>> - G 0 57B 0 5,-2.4 4,-1.6 -2,-0.3 3,-1.1 -0.900 21.7-166.3 -98.3 100.9 9.3 -29.7 24.7 53 53 A P T 345S+ 0 0 39 0, 0.0 2,-0.4 0, 0.0 3,-0.2 0.863 81.6 60.5 -63.0 -37.8 10.6 -33.2 25.5 54 54 A S T 345S+ 0 0 56 -22,-0.4 -24,-0.0 1,-0.2 -21,-0.0 -0.019 122.3 24.5 -79.4 31.2 10.9 -32.6 29.3 55 55 A Y T <45S- 0 0 141 -3,-1.1 -1,-0.2 -2,-0.4 3,-0.1 0.287 97.1-129.1-168.1 -11.2 7.1 -31.9 29.3 56 56 A G T <5 + 0 0 50 -4,-1.6 2,-0.3 1,-0.2 -2,-0.1 0.339 57.5 142.1 73.8 -6.5 5.7 -33.8 26.3 57 57 A R E < -G 52 0B 90 -5,-0.5 -5,-2.4 -6,-0.0 2,-0.3 -0.537 28.5-172.4 -73.9 128.3 3.8 -30.8 24.9 58 58 A A E -G 51 0B 22 -2,-0.3 2,-0.3 -7,-0.2 -7,-0.2 -0.953 11.6-163.9-127.0 144.4 3.9 -30.5 21.1 59 59 A N E -G 50 0B 9 -9,-1.9 -9,-2.4 -2,-0.3 2,-0.3 -0.967 11.3-153.8-129.2 144.4 2.7 -27.8 18.6 60 60 A Y E -G 49 0B 53 -2,-0.3 2,-0.9 -11,-0.2 -11,-0.3 -0.862 29.8-101.4-123.9 147.5 2.1 -28.2 14.9 61 61 A N > - 0 0 24 -13,-2.9 3,-1.0 -2,-0.3 -12,-0.0 -0.562 35.5-168.8 -60.2 102.0 2.1 -26.0 11.8 62 62 A E T 3 S+ 0 0 129 -2,-0.9 -1,-0.2 1,-0.2 4,-0.1 0.477 75.1 73.4 -79.4 -0.9 -1.6 -25.6 11.4 63 63 A K T 3 S+ 0 0 119 2,-0.1 2,-0.3 0, 0.0 -1,-0.2 0.543 95.9 53.7 -90.7 -10.6 -1.3 -24.1 7.9 64 64 A I S < S- 0 0 59 -3,-1.0 2,-0.2 -16,-0.1 -4,-0.0 -0.785 103.8 -78.4-119.6 165.7 -0.4 -27.5 6.3 65 65 A Q - 0 0 148 -2,-0.3 2,-1.2 1,-0.1 3,-0.2 -0.459 52.4-115.9 -62.5 126.3 -2.0 -30.9 6.3 66 66 A K + 0 0 123 -2,-0.2 -1,-0.1 1,-0.2 -4,-0.1 -0.535 58.3 143.7 -75.2 96.1 -1.3 -32.7 9.6 67 67 A K + 0 0 34 -2,-1.2 17,-1.6 16,-0.1 2,-0.2 0.563 51.9 81.0 -98.3 -17.0 0.9 -35.7 8.8 68 68 A A E -C 83 0A 3 15,-0.2 2,-0.3 -3,-0.2 15,-0.2 -0.626 46.7-176.7-104.9 153.4 3.1 -35.5 11.9 69 69 A T E -C 82 0A 59 13,-0.9 13,-3.4 -2,-0.2 2,-0.4 -0.968 20.0-149.4-140.0 127.9 2.9 -36.6 15.5 70 70 A L E +C 81 0A 7 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.838 22.9 159.9-109.9 139.4 5.7 -35.7 17.9 71 71 A T E -C 80 0A 62 9,-2.2 9,-3.1 -2,-0.4 2,-0.3 -0.894 18.0-151.2-143.5 166.1 6.9 -37.7 20.9 72 72 A A E -C 79 0A 39 -2,-0.3 2,-0.6 7,-0.2 7,-0.2 -0.998 14.3-144.8-145.2 149.7 10.0 -37.9 23.0 73 73 A D E > -C 78 0A 64 5,-2.7 5,-1.5 -2,-0.3 4,-0.5 -0.965 13.7-168.1-108.3 112.2 11.9 -40.4 25.2 74 74 A K T 5S+ 0 0 80 -2,-0.6 -1,-0.1 3,-0.2 -20,-0.1 0.732 83.6 53.4 -72.9 -23.9 13.5 -38.4 28.1 75 75 A S T 5S+ 0 0 116 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.868 121.7 28.3 -82.2 -38.0 15.7 -41.3 29.2 76 76 A S T 5S- 0 0 63 2,-0.1 -52,-0.2 -53,-0.0 -2,-0.2 0.378 104.5-132.0 -93.9 2.5 17.4 -42.0 25.8 77 77 A S T 5 + 0 0 55 -4,-0.5 -53,-2.4 1,-0.2 2,-0.4 0.891 53.6 148.2 35.9 58.4 16.9 -38.3 24.9 78 78 A T E < -BC 23 73A 21 -5,-1.5 -5,-2.7 -55,-0.2 2,-0.4 -0.922 38.7-148.4-114.4 138.3 15.4 -39.1 21.5 79 79 A A E -BC 22 72A 4 -57,-2.5 -57,-1.6 -2,-0.4 2,-0.4 -0.888 16.4-158.2-103.2 140.4 12.8 -37.1 19.7 80 80 A F E -BC 21 71A 48 -9,-3.1 -9,-2.2 -2,-0.4 2,-0.5 -0.951 13.4-165.3-122.4 139.0 10.3 -38.9 17.4 81 81 A M E -BC 20 70A 0 -61,-1.9 -61,-2.9 -2,-0.4 2,-0.9 -0.955 11.3-156.4-119.9 112.2 8.2 -37.8 14.5 82 82 A Q E -BC 19 69A 57 -13,-3.4 -13,-0.9 -2,-0.5 2,-0.4 -0.781 10.7-169.3 -85.2 109.8 5.5 -40.2 13.5 83 83 A L E -BC 18 68A 2 -65,-3.1 -65,-2.0 -2,-0.9 2,-0.3 -0.878 11.9-171.2 -97.3 134.2 4.6 -39.6 9.9 84 84 A S + 0 0 45 -17,-1.6 -67,-0.2 -2,-0.4 -68,-0.1 -0.962 50.8 9.4-136.7 147.6 1.5 -41.4 8.8 85 85 A S S S- 0 0 71 -70,-0.4 -68,-0.2 -2,-0.3 -1,-0.2 0.899 80.9-166.8 57.5 50.9 -0.5 -42.1 5.6 86 86 A L - 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