==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 09-FEB-11 3QO0 . COMPND 2 MOLECULE: FAB FRAGMENT OF IMMUNOGLOBULIN G1 LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.TRAJTENBERG,A.CORREA-BOVE,A.BUSCHIAZZO . 441 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19748.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 299 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 175 39.7 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 . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 48 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 . 4 6 5 2 5 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 0 1 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 0 133 0, 0.0 2,-0.4 0, 0.0 100,-0.1 0.000 360.0 360.0 360.0 143.1 19.0 -15.2 -2.1 2 2 A I - 0 0 3 98,-0.3 2,-0.4 96,-0.1 93,-0.1 -0.600 360.0-139.8 -73.4 126.3 22.2 -14.6 -0.0 3 3 A V - 0 0 83 -2,-0.4 23,-2.2 99,-0.0 2,-0.5 -0.804 11.0-158.1 -95.5 132.4 21.6 -16.0 3.5 4 4 A M E -A 25 0A 7 99,-0.5 2,-0.6 -2,-0.4 101,-0.3 -0.949 6.3-167.8-111.4 114.8 22.9 -14.0 6.5 5 5 A T E -A 24 0A 35 19,-2.8 19,-2.5 -2,-0.5 2,-0.3 -0.938 5.9-162.9-110.7 114.2 23.4 -15.9 9.7 6 6 A Q E -A 23 0A 6 -2,-0.6 17,-0.2 17,-0.2 99,-0.1 -0.685 11.7-130.5 -95.6 151.0 24.1 -13.9 12.8 7 7 A S E S+A 22 0A 73 15,-2.3 15,-3.4 -2,-0.3 2,-0.2 -0.961 76.4 20.6-154.5 128.8 25.6 -15.2 16.1 8 8 A P - 0 0 45 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.662 63.0-152.0 -80.4 179.7 24.7 -15.0 19.0 9 9 A L S S+ 0 0 110 1,-0.3 99,-2.2 -2,-0.2 2,-0.3 0.605 82.8 2.8 -85.8 -17.4 21.0 -14.1 18.9 10 10 A S E +d 108 0B 59 97,-0.3 2,-0.3 80,-0.0 -1,-0.3 -0.976 63.7 177.2-162.7 156.0 21.4 -12.3 22.2 11 11 A L E -d 109 0B 40 97,-1.9 99,-3.2 -2,-0.3 2,-0.5 -0.963 20.9-140.3-162.3 153.0 24.1 -11.4 24.8 12 12 A S E +d 110 0B 37 -2,-0.3 2,-0.4 97,-0.2 99,-0.2 -0.993 24.7 179.6-124.1 115.2 24.4 -9.5 28.0 13 13 A V E -d 111 0B 16 97,-2.3 99,-2.6 -2,-0.5 6,-0.1 -0.976 26.2-127.3-122.4 134.3 27.6 -7.4 28.5 14 14 A T > - 0 0 56 -2,-0.4 3,-2.0 97,-0.2 69,-0.3 -0.591 45.0 -91.3 -77.9 136.7 28.5 -5.2 31.5 15 15 A P T 3 S+ 0 0 64 0, 0.0 69,-0.2 0, 0.0 -1,-0.1 -0.281 114.2 28.0 -53.8 132.6 29.4 -1.5 30.5 16 16 A G T 3 S+ 0 0 45 67,-2.3 68,-0.1 1,-0.4 -2,-0.0 0.034 101.0 101.4 105.3 -20.2 33.2 -1.1 29.9 17 17 A E S < S- 0 0 111 -3,-2.0 66,-1.9 65,-0.1 -1,-0.4 -0.608 77.3-101.5 -88.7 154.0 33.6 -4.8 28.7 18 18 A P - 0 0 92 0, 0.0 2,-0.3 0, 0.0 63,-0.2 -0.324 27.7-159.9 -79.2 161.3 33.8 -5.8 25.0 19 19 A A E - B 0 80A 6 61,-2.1 61,-2.8 -6,-0.1 2,-0.4 -0.996 3.9-168.3-136.7 139.1 31.1 -7.3 22.7 20 20 A S E - B 0 79A 58 -2,-0.3 2,-0.4 59,-0.2 59,-0.2 -0.996 1.6-167.9-133.3 134.2 31.5 -9.3 19.5 21 21 A I E - B 0 78A 3 57,-2.7 57,-2.7 -2,-0.4 2,-0.3 -0.992 11.7-147.7-123.6 128.6 28.8 -10.3 16.9 22 22 A S E -AB 7 77A 46 -15,-3.4 -15,-2.3 -2,-0.4 2,-0.4 -0.712 12.0-174.6 -96.1 145.4 29.4 -12.8 14.1 23 23 A a E -AB 6 76A 0 53,-2.5 53,-3.7 -2,-0.3 2,-0.4 -0.986 4.7-166.2-140.8 122.7 27.7 -12.7 10.7 24 24 A R E -AB 5 75A 138 -19,-2.5 -19,-2.8 -2,-0.4 2,-0.4 -0.964 9.8-148.9-113.1 129.2 28.2 -15.5 8.1 25 25 A S E -A 4 0A 6 49,-3.2 -21,-0.2 -2,-0.4 4,-0.1 -0.834 11.6-145.2 -99.8 140.2 27.2 -14.9 4.5 26 26 A S S S+ 0 0 67 -23,-2.2 2,-0.3 -2,-0.4 -1,-0.1 0.629 89.7 36.7 -73.3 -17.8 26.0 -17.9 2.3 27 27 A Q S S- 0 0 73 -24,-0.3 2,-0.2 46,-0.1 -2,-0.1 -0.920 102.4 -85.0-133.0 158.4 27.7 -16.2 -0.7 28 28 A S - 0 0 59 -2,-0.3 46,-0.2 1,-0.1 -2,-0.1 -0.465 31.8-175.9 -66.1 128.3 30.9 -14.2 -1.2 29 29 A L + 0 0 0 44,-3.2 8,-2.5 -2,-0.2 -1,-0.1 0.348 39.8 129.9-104.9 3.8 30.5 -10.5 -0.4 30 30 A L B -J 36 0C 90 6,-0.2 2,-0.2 43,-0.1 6,-0.2 -0.378 43.7-152.7 -66.0 131.0 34.1 -9.6 -1.5 31 31 A R > - 0 0 78 4,-2.7 3,-1.5 -2,-0.1 -2,-0.1 -0.675 26.9-113.8-100.4 157.7 34.5 -6.7 -4.0 32 32 A R T 3 S+ 0 0 264 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.819 114.7 60.4 -57.2 -38.2 37.4 -6.1 -6.5 33 33 A D T 3 S- 0 0 91 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.320 121.4-102.3 -75.3 1.8 38.5 -3.0 -4.5 34 34 A G S < S+ 0 0 51 -3,-1.5 -2,-0.1 1,-0.4 -1,-0.1 0.202 90.2 105.8 94.4 -14.4 39.2 -5.0 -1.3 35 35 A H - 0 0 68 -5,-0.1 -4,-2.7 37,-0.1 -1,-0.4 -0.256 63.3-127.8 -85.6-179.1 36.0 -4.0 0.5 36 36 A N B -J 30 0C 5 19,-1.2 2,-2.0 -6,-0.2 -6,-0.2 -0.972 17.4-120.6-132.6 146.2 32.9 -6.1 1.2 37 37 A D S S+ 0 0 9 -8,-2.5 59,-1.6 -2,-0.3 60,-0.5 -0.451 73.6 122.1 -85.4 64.7 29.2 -5.5 0.4 38 38 A L E -E 95 0B 0 -2,-2.0 18,-2.5 57,-0.2 2,-0.3 -0.994 38.6-174.3-134.7 129.0 28.4 -5.9 4.1 39 39 A E E -E 94 0B 1 55,-3.2 55,-2.1 -2,-0.4 2,-0.4 -0.824 13.5-147.7-121.7 156.5 26.7 -3.4 6.5 40 40 A W E -EF 93 53B 0 13,-2.5 12,-2.7 -2,-0.3 13,-1.6 -0.994 16.4-173.1-125.4 128.3 25.9 -3.3 10.2 41 41 A Y E -EF 92 51B 2 51,-2.8 51,-2.4 -2,-0.4 2,-0.4 -0.901 11.5-153.0-118.9 148.9 22.8 -1.5 11.7 42 42 A L E -EF 91 50B 2 8,-2.5 8,-2.3 -2,-0.3 2,-0.5 -0.983 4.1-162.9-117.7 135.7 21.8 -0.8 15.2 43 43 A Q E -E 90 0B 23 47,-2.6 47,-2.5 -2,-0.4 3,-0.1 -0.947 9.9-160.9-119.6 108.1 18.1 -0.5 16.2 44 44 A K > - 0 0 28 -2,-0.5 3,-1.7 4,-0.4 45,-0.2 -0.481 41.9 -75.2 -79.2 154.1 17.6 1.2 19.6 45 45 A P T 3 S+ 0 0 36 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.257 118.8 8.6 -56.7 136.2 14.2 0.8 21.4 46 46 A G T 3 S+ 0 0 83 1,-0.2 2,-0.3 -3,-0.1 -2,-0.0 0.668 115.3 102.1 67.6 20.0 11.4 2.9 19.9 47 47 A Q S < S- 0 0 87 -3,-1.7 -1,-0.2 3,-0.0 3,-0.1 -0.842 74.1-107.5-130.5 164.7 13.7 3.9 16.9 48 48 A S - 0 0 10 -2,-0.3 -4,-0.4 1,-0.1 -6,-0.1 -0.548 56.3 -82.3 -78.6 158.4 14.3 3.1 13.2 49 49 A P - 0 0 3 0, 0.0 280,-0.5 0, 0.0 -6,-0.2 -0.248 47.9-154.8 -62.8 148.2 17.6 1.1 12.3 50 50 A Q E -F 42 0B 60 -8,-2.3 -8,-2.5 278,-0.1 278,-0.1 -0.984 18.6-107.8-129.4 138.2 20.7 3.4 12.1 51 51 A P E +F 41 0B 18 0, 0.0 -10,-0.2 0, 0.0 3,-0.1 -0.429 40.7 159.7 -69.4 142.0 23.9 2.7 10.1 52 52 A L E + 0 0 3 -12,-2.7 8,-2.7 1,-0.4 2,-0.3 0.633 66.7 14.4-120.2 -51.9 27.1 1.7 12.0 53 53 A I E +FG 40 59B 2 -13,-1.6 -13,-2.5 6,-0.3 -1,-0.4 -0.986 59.3 174.9-132.5 143.5 29.4 0.1 9.4 54 54 A Y E >> + G 0 58B 56 4,-2.3 4,-2.6 -2,-0.3 3,-0.8 -0.875 67.9 32.7-140.0 165.6 29.3 -0.1 5.6 55 55 A L T 34 S- 0 0 39 1,-0.3 -19,-1.2 -2,-0.3 2,-0.2 0.707 126.9 -76.2 54.9 22.3 31.7 -1.6 3.0 56 56 A G T 34 S+ 0 0 4 -18,-2.5 -1,-0.3 -21,-0.2 21,-0.2 -0.134 127.3 24.0 86.1 -33.0 32.4 -4.2 5.7 57 57 A S T <4 S+ 0 0 67 -3,-0.8 2,-0.5 -2,-0.2 12,-0.4 0.388 85.7 112.6-144.3 -4.2 34.6 -1.9 7.9 58 58 A T E < -G 54 0B 45 -4,-2.6 -4,-2.3 10,-0.1 2,-0.2 -0.698 62.7-129.8 -82.5 125.9 33.9 1.8 7.2 59 59 A R E -G 53 0B 111 -2,-0.5 -6,-0.3 -6,-0.2 3,-0.1 -0.571 21.2-121.2 -74.8 136.5 32.3 3.5 10.2 60 60 A A > - 0 0 7 -8,-2.7 3,-2.0 -2,-0.2 -1,-0.1 -0.357 50.5 -71.0 -67.3 156.2 29.1 5.5 9.4 61 61 A S T 3 S+ 0 0 106 1,-0.3 -1,-0.2 -2,-0.1 0, 0.0 -0.202 121.1 12.2 -55.2 132.8 29.2 9.3 10.2 62 62 A G T 3 S+ 0 0 84 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.378 92.0 130.2 81.7 -2.9 29.2 10.1 13.9 63 63 A V < - 0 0 16 -3,-2.0 -1,-0.2 -11,-0.1 -4,-0.1 -0.730 56.4-124.7 -86.2 120.1 29.8 6.4 14.8 64 64 A P > - 0 0 61 0, 0.0 3,-2.2 0, 0.0 -4,-0.1 -0.317 17.3-102.7 -74.6 163.7 32.7 6.2 17.3 65 65 A D T 3 S+ 0 0 134 1,-0.3 16,-0.1 15,-0.1 -2,-0.0 0.664 111.5 73.1 -41.0 -41.9 36.1 4.4 17.4 66 66 A R T 3 S+ 0 0 20 14,-0.1 15,-3.1 16,-0.1 2,-0.4 0.666 87.3 74.7 -57.2 -19.2 34.8 1.7 19.8 67 67 A F E < +C 80 0A 8 -3,-2.2 2,-0.4 13,-0.2 13,-0.2 -0.833 63.8 170.1 -98.7 128.6 32.7 0.2 17.0 68 68 A S E -C 79 0A 48 11,-2.4 11,-3.0 -2,-0.4 2,-0.4 -1.000 23.4-155.5-143.3 143.0 34.5 -1.8 14.3 69 69 A G E +C 78 0A 9 -12,-0.4 2,-0.3 -2,-0.4 9,-0.2 -0.953 25.8 161.5-113.8 134.5 33.6 -4.1 11.5 70 70 A S E +C 77 0A 41 7,-2.2 7,-3.1 -2,-0.4 2,-0.2 -0.933 18.5 81.7-146.3 168.5 36.0 -6.7 10.2 71 71 A G E -C 76 0A 40 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.511 50.4-121.0 118.9 172.5 36.1 -9.9 8.2 72 72 A S E > -C 75 0A 71 3,-1.1 2,-2.0 -2,-0.2 3,-1.3 -0.988 64.8 -11.5-155.7 145.5 36.2 -10.8 4.5 73 73 A G T 3 S- 0 0 14 -2,-0.3 -44,-3.2 1,-0.2 -43,-0.1 -0.481 131.7 -10.6 73.2 -79.1 34.3 -12.7 1.9 74 74 A T T 3 S+ 0 0 59 -2,-2.0 -49,-3.2 -46,-0.2 2,-0.6 0.551 117.7 75.8-127.6 -19.7 31.8 -14.6 4.0 75 75 A D E < +BC 24 72A 91 -3,-1.3 -3,-1.1 -51,-0.2 2,-0.3 -0.910 57.8 178.4-111.1 114.9 32.8 -14.3 7.7 76 76 A F E -BC 23 71A 0 -53,-3.7 -53,-2.5 -2,-0.6 2,-0.4 -0.849 13.1-165.8-121.6 145.9 32.1 -11.0 9.5 77 77 A T E -BC 22 70A 29 -7,-3.1 -7,-2.2 -2,-0.3 2,-0.5 -0.992 7.8-162.5-132.0 132.8 32.5 -9.5 12.9 78 78 A L E -BC 21 69A 1 -57,-2.7 -57,-2.7 -2,-0.4 2,-0.4 -0.968 20.6-167.6-107.1 125.2 31.1 -6.4 14.6 79 79 A K E -BC 20 68A 82 -11,-3.0 -11,-2.4 -2,-0.5 2,-0.6 -0.935 20.0-166.1-115.9 138.9 33.1 -5.5 17.7 80 80 A I E -BC 19 67A 2 -61,-2.8 -61,-2.1 -2,-0.4 3,-0.2 -0.962 10.8-165.2-117.0 100.3 32.2 -3.0 20.4 81 81 A I S S+ 0 0 92 -15,-3.1 2,-0.4 -2,-0.6 -1,-0.1 0.868 80.4 18.4 -56.5 -40.0 35.5 -2.5 22.3 82 82 A R S S- 0 0 122 -16,-0.2 -1,-0.3 -64,-0.1 2,-0.2 -0.971 84.5-140.3-136.7 110.4 33.9 -0.8 25.3 83 83 A V - 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