==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 09-FEB-11 3QNZ . COMPND 2 MOLECULE: FAB FRAGMENT OF IMMUNOGLOBULIN G1 LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.TRAJTENBERG,A.CORREA,A.BUSCHIAZZO . 430 5 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19707.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 282 65.6 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 . 170 39.5 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 . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 43 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.2 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 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 . 5 4 5 3 4 8 1 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 0 134 0, 0.0 2,-0.4 0, 0.0 100,-0.1 0.000 360.0 360.0 360.0 150.8 -27.0 -11.7 1.8 2 2 A I - 0 0 2 98,-0.4 2,-0.5 96,-0.1 93,-0.1 -0.715 360.0-141.3 -81.6 125.4 -30.0 -11.1 -0.4 3 3 A V - 0 0 92 -2,-0.4 23,-1.2 99,-0.1 2,-0.5 -0.822 10.6-155.2 -92.2 128.0 -29.4 -12.7 -3.9 4 4 A M E -A 25 0A 8 -2,-0.5 2,-0.5 99,-0.4 101,-0.3 -0.925 7.9-167.2-108.1 119.5 -30.7 -10.7 -6.8 5 5 A T E -A 24 0A 55 19,-3.3 19,-3.4 -2,-0.5 2,-0.4 -0.929 2.7-161.8-108.9 128.3 -31.5 -12.7 -10.0 6 6 A Q E -A 23 0A 7 -2,-0.5 17,-0.2 17,-0.2 99,-0.1 -0.870 11.3-134.4-110.5 143.1 -32.1 -10.9 -13.4 7 7 A S E S+A 22 0A 73 15,-2.3 15,-3.2 -2,-0.4 2,-0.1 -0.970 79.5 19.3-142.8 123.6 -33.8 -12.3 -16.5 8 8 A P - 0 0 46 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.620 63.1-156.0 -84.8-177.9 -32.7 -12.0 -19.3 9 9 A L S S+ 0 0 99 1,-0.3 99,-2.3 98,-0.1 2,-0.3 0.630 82.2 8.2 -92.3 -15.5 -29.0 -11.1 -19.2 10 10 A S E +d 108 0B 84 97,-0.3 -1,-0.3 80,-0.0 2,-0.3 -0.971 65.4 175.3-159.9 150.5 -29.3 -9.5 -22.7 11 11 A L E -d 109 0B 34 97,-2.0 99,-3.4 -2,-0.3 2,-0.5 -0.967 21.2-143.1-156.8 155.4 -32.0 -8.6 -25.2 12 12 A S E +d 110 0B 36 -2,-0.3 2,-0.4 97,-0.2 99,-0.2 -0.993 25.8 174.3-126.0 113.2 -32.3 -6.9 -28.6 13 13 A V E -d 111 0B 17 97,-2.2 99,-2.3 -2,-0.5 6,-0.1 -0.977 28.0-127.9-124.6 137.8 -35.5 -4.7 -29.1 14 14 A T > - 0 0 47 -2,-0.4 3,-2.0 97,-0.2 69,-0.4 -0.665 43.5 -91.5 -82.7 138.8 -36.3 -2.5 -32.1 15 15 A P T 3 S+ 0 0 60 0, 0.0 69,-0.2 0, 0.0 -1,-0.1 -0.223 115.0 33.4 -52.4 138.0 -37.3 1.2 -31.1 16 16 A G T 3 S+ 0 0 53 67,-1.8 68,-0.1 1,-0.4 -2,-0.0 0.148 101.7 99.8 97.9 -13.1 -41.1 1.5 -30.7 17 17 A E S < S- 0 0 105 -3,-2.0 66,-1.9 66,-0.2 -1,-0.4 -0.720 76.3-104.9-101.9 151.7 -41.4 -2.0 -29.3 18 18 A P - 0 0 92 0, 0.0 2,-0.3 0, 0.0 63,-0.2 -0.346 24.7-159.4 -77.6 160.4 -41.6 -3.0 -25.6 19 19 A A E - B 0 80A 6 61,-1.9 61,-2.7 -2,-0.1 2,-0.4 -0.978 3.3-164.4-134.1 142.0 -38.8 -4.5 -23.3 20 20 A S E - B 0 79A 54 -2,-0.3 2,-0.4 59,-0.2 59,-0.2 -0.999 4.6-173.8-132.9 132.2 -39.3 -6.5 -20.1 21 21 A I E - B 0 78A 2 57,-2.7 57,-3.3 -2,-0.4 2,-0.3 -0.994 12.7-152.8-128.1 121.5 -36.7 -7.2 -17.5 22 22 A S E -AB 7 77A 51 -15,-3.2 -15,-2.3 -2,-0.4 2,-0.4 -0.681 6.7-165.1 -92.2 148.2 -37.5 -9.5 -14.6 23 23 A a E -AB 6 76A 0 53,-2.5 53,-2.8 -2,-0.3 2,-0.4 -0.996 1.5-163.2-136.4 125.7 -35.8 -9.4 -11.1 24 24 A R E -AB 5 75A 143 -19,-3.4 -19,-3.3 -2,-0.4 2,-0.3 -0.937 5.2-154.9-114.1 131.1 -36.0 -12.1 -8.4 25 25 A S E -A 4 0A 6 49,-3.0 -21,-0.2 -2,-0.4 4,-0.1 -0.799 16.5-140.0-101.2 144.5 -35.0 -11.5 -4.8 26 26 A S S S+ 0 0 62 -23,-1.2 2,-0.3 -2,-0.3 -1,-0.1 0.757 93.0 27.0 -74.0 -26.8 -33.9 -14.4 -2.5 27 27 A Q S S- 0 0 85 -24,-0.2 -1,-0.1 46,-0.1 -25,-0.0 -0.941 103.7 -83.7-131.4 153.5 -36.0 -12.8 0.4 28 28 A S - 0 0 54 -2,-0.3 46,-0.2 1,-0.1 -2,-0.1 -0.282 28.2-166.7 -59.8 139.1 -39.1 -10.6 0.4 29 29 A L + 0 0 0 44,-2.4 8,-2.7 -4,-0.1 -1,-0.1 0.284 41.5 135.1-108.6 4.8 -38.5 -6.9 -0.1 30 30 A L B -J 36 0C 86 6,-0.2 6,-0.2 7,-0.1 2,-0.2 -0.293 41.5-152.0 -59.5 135.1 -42.1 -5.9 0.9 31 31 A R > - 0 0 70 4,-2.8 3,-0.9 24,-0.1 -1,-0.1 -0.571 27.6-110.0-100.7 169.9 -42.3 -2.9 3.3 32 32 A R T 3 S+ 0 0 115 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.0 0.887 115.7 61.2 -69.7 -33.9 -45.0 -2.2 5.9 33 33 A D T 3 S- 0 0 92 1,-0.1 -1,-0.2 -3,-0.0 3,-0.1 0.447 120.9-102.9 -70.6 -6.0 -46.2 0.8 3.8 34 34 A G S < S+ 0 0 49 -3,-0.9 -1,-0.1 1,-0.4 -2,-0.1 0.092 91.8 104.2 101.6 -20.7 -47.1 -1.4 0.8 35 35 A H - 0 0 69 -5,-0.1 -4,-2.8 37,-0.1 -1,-0.4 -0.168 66.2-122.3 -79.6-178.4 -43.9 -0.4 -1.2 36 36 A N B -J 30 0C 6 19,-1.2 2,-1.3 -6,-0.2 -6,-0.2 -0.917 15.3-121.0-128.6 152.5 -40.8 -2.6 -1.7 37 37 A D S S+ 0 0 11 -8,-2.7 59,-2.3 -2,-0.3 60,-0.6 -0.399 76.0 117.2 -90.9 60.0 -37.2 -2.1 -0.9 38 38 A L E -E 95 0B 0 -2,-1.3 18,-2.7 57,-0.3 2,-0.3 -0.991 40.8-174.0-133.9 131.4 -36.3 -2.6 -4.7 39 39 A E E -E 94 0B 17 55,-3.1 55,-2.4 -2,-0.4 2,-0.4 -0.867 13.3-145.0-126.2 155.1 -34.6 -0.1 -7.1 40 40 A W E -EF 93 53B 0 13,-2.4 12,-3.3 -2,-0.3 13,-1.4 -0.980 17.4-173.9-123.3 135.4 -33.9 -0.0 -10.9 41 41 A Y E -EF 92 51B 10 51,-2.7 51,-2.2 -2,-0.4 2,-0.4 -0.943 14.1-150.4-127.6 151.3 -30.8 1.6 -12.5 42 42 A L E -EF 91 50B 2 8,-2.8 8,-3.0 -2,-0.3 2,-0.6 -0.985 6.0-162.9-119.9 131.6 -29.6 2.2 -16.0 43 43 A Q E -E 90 0B 22 47,-3.1 47,-2.6 -2,-0.4 3,-0.1 -0.938 9.5-165.2-116.3 108.0 -26.0 2.4 -16.9 44 44 A K > - 0 0 23 -2,-0.6 3,-1.7 4,-0.5 45,-0.2 -0.437 43.2 -73.2 -81.0 156.8 -25.3 4.1 -20.3 45 45 A P T 3 S+ 0 0 53 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.372 118.4 4.7 -61.8 130.7 -21.8 3.7 -21.9 46 46 A G T 3 S+ 0 0 92 1,-0.3 2,-0.2 -2,-0.1 -2,-0.0 0.297 114.5 103.2 81.0 -4.7 -19.1 5.8 -20.2 47 47 A Q S < S- 0 0 88 -3,-1.7 -1,-0.3 1,-0.1 3,-0.1 -0.628 74.6-111.5-107.3 163.2 -21.6 6.9 -17.5 48 48 A S - 0 0 8 -2,-0.2 -4,-0.5 276,-0.1 278,-0.1 -0.479 56.8 -79.3 -77.6 158.5 -22.3 6.0 -13.9 49 49 A P - 0 0 3 0, 0.0 -6,-0.3 0, 0.0 275,-0.2 -0.370 47.2-152.9 -67.2 141.3 -25.6 4.1 -13.2 50 50 A Q E -F 42 0B 62 -8,-3.0 -8,-2.8 -3,-0.1 2,-0.1 -0.949 20.0-109.1-115.0 138.5 -28.7 6.5 -13.1 51 51 A P E +F 41 0B 53 0, 0.0 -10,-0.3 0, 0.0 3,-0.1 -0.399 38.3 164.6 -71.3 141.9 -31.8 5.7 -11.1 52 52 A L E + 0 0 3 -12,-3.3 8,-2.6 1,-0.4 2,-0.3 0.716 67.6 17.1-113.3 -51.1 -35.0 4.8 -12.9 53 53 A I E +FG 40 59B 1 -13,-1.4 -13,-2.4 6,-0.3 -1,-0.4 -0.958 58.4 179.0-130.9 139.7 -37.2 3.3 -10.2 54 54 A Y E >> + G 0 58B 99 4,-2.7 4,-2.5 -2,-0.3 3,-0.6 -0.904 69.5 26.6-134.2 160.5 -37.2 3.4 -6.4 55 55 A L T 34 S- 0 0 42 -2,-0.3 -19,-1.2 1,-0.3 2,-0.5 0.717 125.4 -74.8 58.3 24.1 -39.6 1.8 -3.7 56 56 A G T 34 S+ 0 0 2 -18,-2.7 -1,-0.3 -21,-0.2 21,-0.2 -0.200 128.3 23.3 86.7 -38.0 -40.4 -0.8 -6.4 57 57 A S T <4 S+ 0 0 68 -3,-0.6 2,-0.5 -2,-0.5 12,-0.4 0.416 88.1 111.0-139.0 -5.1 -42.7 1.4 -8.6 58 58 A T E < -G 54 0B 47 -4,-2.5 -4,-2.7 10,-0.1 -2,-0.1 -0.703 61.0-133.0 -86.0 121.3 -41.8 5.0 -8.1 59 59 A R E -G 53 0B 111 -2,-0.5 -6,-0.3 -6,-0.2 3,-0.1 -0.447 20.3-118.1 -70.7 142.2 -40.1 6.8 -11.0 60 60 A A > - 0 0 9 -8,-2.6 3,-2.0 1,-0.1 -1,-0.1 -0.414 49.1 -76.9 -75.2 154.1 -37.0 8.9 -10.4 61 61 A S T 3 S+ 0 0 106 1,-0.3 -1,-0.1 -2,-0.1 0, 0.0 -0.288 121.2 18.0 -54.8 131.5 -37.3 12.6 -11.2 62 62 A G T 3 S+ 0 0 86 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.483 91.4 125.7 81.8 5.4 -37.0 13.1 -15.0 63 63 A V < - 0 0 14 -3,-2.0 -1,-0.3 -11,-0.1 2,-0.1 -0.851 59.3-129.3 -94.9 122.7 -37.7 9.5 -15.8 64 64 A P > - 0 0 57 0, 0.0 3,-2.1 0, 0.0 -4,-0.1 -0.398 20.6-107.8 -75.1 157.2 -40.7 9.3 -18.3 65 65 A D T 3 S+ 0 0 120 1,-0.3 16,-0.1 -2,-0.1 -2,-0.0 0.520 107.4 86.9 -59.9 -4.1 -43.9 7.1 -17.8 66 66 A R T 3 S+ 0 0 16 14,-0.1 15,-3.5 15,-0.1 2,-0.4 0.700 86.4 65.8 -59.4 -30.6 -42.5 4.9 -20.7 67 67 A F E < +C 80 0A 8 -3,-2.1 2,-0.3 13,-0.2 13,-0.2 -0.862 68.1 174.0 -99.8 131.3 -40.6 3.2 -17.8 68 68 A S E -C 79 0A 41 11,-2.3 11,-2.6 -2,-0.4 2,-0.5 -0.999 21.8-152.6-142.1 142.4 -42.5 1.3 -15.0 69 69 A G E +C 78 0A 7 -12,-0.4 2,-0.3 -2,-0.3 9,-0.2 -0.937 27.0 169.7-109.1 126.3 -41.5 -0.8 -12.1 70 70 A S E +C 77 0A 42 7,-2.6 7,-2.7 -2,-0.5 2,-0.1 -0.891 22.4 65.0-134.2 166.2 -44.0 -3.4 -10.9 71 71 A G E -C 76 0A 43 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.445 49.8-127.5 112.4 174.2 -44.1 -6.4 -8.6 72 72 A S E > +C 75 0A 63 3,-1.2 3,-1.5 -2,-0.1 2,-1.0 -0.980 64.0 0.9-160.0 155.9 -43.9 -7.2 -4.8 73 73 A G T 3 S- 0 0 13 -2,-0.3 -44,-2.4 1,-0.2 -46,-0.1 -0.524 130.6 -10.9 68.6 -98.8 -42.1 -9.4 -2.3 74 74 A T T 3 S+ 0 0 53 -2,-1.0 -49,-3.0 -46,-0.2 2,-0.5 0.592 121.6 70.8-108.2 -18.8 -39.6 -11.5 -4.3 75 75 A D E < +BC 24 72A 76 -3,-1.5 -3,-1.2 -51,-0.2 2,-0.3 -0.934 54.7 170.6-116.4 125.1 -40.6 -10.8 -8.0 76 76 A F E -BC 23 71A 2 -53,-2.8 -53,-2.5 -2,-0.5 2,-0.4 -0.882 14.7-158.5-130.8 153.5 -40.2 -7.6 -9.9 77 77 A T E -BC 22 70A 31 -7,-2.7 -7,-2.6 -2,-0.3 2,-0.5 -0.992 6.8-160.1-138.8 131.0 -40.5 -6.3 -13.4 78 78 A L E -BC 21 69A 1 -57,-3.3 -57,-2.7 -2,-0.4 2,-0.4 -0.954 21.4-170.0-103.7 123.2 -39.0 -3.3 -15.2 79 79 A K E -BC 20 68A 89 -11,-2.6 -11,-2.3 -2,-0.5 2,-0.5 -0.946 18.5-163.0-116.9 138.3 -41.0 -2.5 -18.4 80 80 A I E -BC 19 67A 1 -61,-2.7 -61,-1.9 -2,-0.4 -13,-0.2 -0.979 9.6-160.6-116.7 105.8 -40.1 -0.1 -21.1 81 81 A I S S+ 0 0 81 -15,-3.5 2,-0.4 -2,-0.5 -1,-0.1 0.906 82.4 9.0 -55.4 -50.1 -43.4 0.6 -23.0 82 82 A R S S- 0 0 122 -16,-0.2 2,-0.3 -64,-0.1 -1,-0.3 -0.985 83.2-136.2-136.5 119.6 -41.6 1.8 -26.2 83 83 A V - 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