==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 21-JAN-04 1S5I . COMPND 2 MOLECULE: FAB-FRAGMENT OF MONOCLONAL ANTIBODY; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR V.Z.PLETNEV,E.A.GORYACHEVA,I.N.TSYGANNIK,V.A.NESMEYANOV, . 439 2 5 4 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19660.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 282 64.2 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 . 177 40.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 4 0.9 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 . 43 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 3.0 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+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 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 1 0 0 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 PARALLEL BRIDGES PER LADDER . 4 3 7 2 4 7 3 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 . 1 0 5 1 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 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 0 160 0, 0.0 2,-0.8 0, 0.0 98,-0.1 0.000 360.0 360.0 360.0 26.4 5.9 34.8 22.2 2 2 L V - 0 0 9 98,-0.4 2,-0.2 96,-0.2 93,-0.1 -0.834 360.0-135.0 -90.3 106.1 7.8 31.5 22.6 3 3 L Q - 0 0 137 -2,-0.8 23,-1.5 1,-0.1 2,-0.6 -0.410 14.9-159.5 -70.5 134.1 6.9 30.4 26.2 4 4 L M E -A 25 0A 11 99,-0.5 101,-0.7 21,-0.2 2,-0.5 -0.935 9.1-166.6-117.2 107.1 9.7 29.2 28.5 5 5 L T E -A 24 0A 61 19,-2.7 19,-2.0 -2,-0.6 2,-0.3 -0.831 1.9-165.5 -99.6 125.7 8.5 27.0 31.4 6 6 L Q E -A 23 0A 11 -2,-0.5 17,-0.2 17,-0.2 3,-0.0 -0.802 14.8-123.3-109.1 151.8 10.8 26.2 34.3 7 7 L T E S+A 22 0A 80 15,-2.3 15,-3.0 -2,-0.3 2,-0.1 -0.979 79.4 19.9-151.0 134.1 10.4 23.6 37.0 8 8 L P - 0 0 44 0, 0.0 -1,-0.2 0, 0.0 3,-0.2 0.637 64.1-151.3 -83.7 174.7 10.3 23.6 39.9 9 9 L L S S+ 0 0 130 1,-0.3 99,-2.3 -2,-0.1 2,-0.4 0.815 89.7 22.9 -74.2 -32.4 9.4 27.3 40.8 10 10 L T E S-d 108 0B 92 97,-0.2 2,-0.5 80,-0.0 -1,-0.3 -0.995 71.9-166.1-138.9 130.2 11.3 26.8 44.0 11 11 L L E -d 109 0B 30 97,-3.6 99,-3.7 -2,-0.4 2,-0.6 -0.965 3.3-163.3-122.8 125.0 14.0 24.3 44.8 12 12 L S E +d 110 0B 35 -2,-0.5 2,-0.4 97,-0.2 99,-0.2 -0.921 17.8 176.8-108.0 120.6 15.2 23.5 48.3 13 13 L V E -d 111 0B 10 97,-2.8 99,-2.0 -2,-0.6 2,-0.5 -0.973 28.9-126.1-130.3 140.2 18.5 21.7 48.5 14 14 L T E > -d 112 0B 44 -2,-0.4 3,-1.9 97,-0.2 69,-0.3 -0.683 46.6 -93.6 -84.6 125.8 20.8 20.5 51.3 15 15 L I T 3 S+ 0 0 85 97,-0.6 69,-0.2 -2,-0.5 -1,-0.1 0.042 109.5 24.1 -35.5 133.5 24.4 21.7 51.0 16 16 L G T 3 S+ 0 0 31 67,-2.6 -1,-0.2 1,-0.3 68,-0.1 0.277 99.5 104.4 91.2 -11.3 26.7 19.2 49.3 17 17 L Q S < S- 0 0 100 -3,-1.9 66,-2.0 65,-0.1 -1,-0.3 -0.701 75.9 -95.8-104.4 157.4 24.0 17.4 47.3 18 18 L P - 0 0 68 0, 0.0 2,-0.3 0, 0.0 63,-0.2 -0.384 35.5-161.6 -71.8 146.1 23.1 17.7 43.6 19 19 L A E - B 0 80A 4 61,-2.2 61,-3.0 -2,-0.1 2,-0.4 -0.917 2.2-161.2-126.0 152.8 20.4 19.9 42.3 20 20 L S E - B 0 79A 57 -2,-0.3 2,-0.4 59,-0.2 59,-0.2 -0.971 5.0-171.3-143.2 126.5 18.5 19.9 39.0 21 21 L I E - B 0 78A 0 57,-2.4 57,-2.4 -2,-0.4 2,-0.4 -0.930 15.3-146.1-115.2 137.3 16.4 22.6 37.3 22 22 L S E -AB 7 77A 37 -15,-3.0 -15,-2.3 -2,-0.4 2,-0.4 -0.873 12.7-173.9-111.4 134.9 14.3 22.0 34.2 23 23 L a E +AB 6 76A 0 53,-2.4 53,-2.3 -2,-0.4 2,-0.3 -0.963 6.2 177.3-123.4 139.4 13.6 24.3 31.3 24 24 L E E -AB 5 75A 87 -19,-2.0 -19,-2.7 -2,-0.4 2,-0.2 -0.963 11.5-153.8-148.6 128.2 11.2 23.6 28.5 25 25 L S E -A 4 0A 8 49,-0.8 -21,-0.2 -2,-0.3 4,-0.1 -0.603 25.1-126.1-100.2 160.5 10.1 25.7 25.5 26 26 L S S S+ 0 0 73 -23,-1.5 2,-0.3 -2,-0.2 -22,-0.1 0.662 97.3 30.8 -75.0 -18.0 7.0 25.7 23.3 27 27 L Q S S- 0 0 92 -24,-0.2 -2,-0.1 46,-0.1 -1,-0.1 -0.982 99.6 -83.6-141.8 153.2 9.1 25.3 20.2 28 27AL S - 0 0 65 -2,-0.3 46,-0.2 1,-0.1 -2,-0.1 -0.201 27.1-157.0 -53.2 141.1 12.4 23.7 19.3 29 27BL L + 0 0 2 44,-2.4 8,-1.1 -4,-0.1 2,-0.4 0.232 57.3 116.8-104.7 10.6 15.4 25.9 20.0 30 27CL L B -J 36 0C 88 6,-0.2 6,-0.2 43,-0.1 2,-0.2 -0.678 57.1-146.4 -79.8 130.1 17.5 24.1 17.4 31 27DL Y > - 0 0 106 4,-1.7 3,-1.9 -2,-0.4 -2,-0.1 -0.512 23.1-105.6 -98.7 166.7 18.5 26.6 14.7 32 27EL S T 3 S+ 0 0 106 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.781 117.8 59.3 -59.6 -30.1 19.1 26.1 11.0 33 28 L N T 3 S- 0 0 83 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.393 122.0-106.0 -82.1 7.7 22.9 26.4 11.4 34 29 L G S < S+ 0 0 54 -3,-1.9 2,-0.4 1,-0.3 -2,-0.1 0.445 83.5 119.9 85.2 0.5 22.7 23.4 13.7 35 30 L K - 0 0 79 -5,-0.0 -4,-1.7 2,-0.0 2,-0.6 -0.801 55.5-140.5-105.0 142.1 23.3 25.4 16.9 36 31 L T B -J 30 0C 19 -2,-0.4 2,-1.2 -6,-0.2 -6,-0.2 -0.880 8.7-152.7-102.5 120.0 21.0 25.7 19.9 37 32 L Y + 0 0 35 -8,-1.1 59,-2.4 -2,-0.6 2,-0.4 -0.662 42.5 133.1 -96.1 81.9 20.7 29.1 21.5 38 33 L L E -E 95 0B 0 -2,-1.2 18,-2.4 57,-0.2 2,-0.3 -0.999 27.8-177.8-131.2 131.1 19.8 28.4 25.1 39 34 L N E -E 94 0B 3 55,-1.9 55,-2.8 -2,-0.4 2,-0.5 -0.863 19.1-139.3-126.8 160.3 21.5 30.1 28.1 40 35 L W E -EF 93 53B 0 13,-1.9 12,-3.2 -2,-0.3 13,-1.2 -0.983 19.0-166.7-122.1 121.8 21.2 29.8 31.9 41 36 L L E -EF 92 51B 7 51,-3.4 51,-2.1 -2,-0.5 2,-0.4 -0.748 4.5-158.8-106.8 156.2 21.4 33.0 34.0 42 37 L L E -EF 91 50B 1 8,-1.9 8,-2.2 -2,-0.3 2,-0.5 -0.999 3.5-169.0-133.1 134.7 21.9 33.2 37.8 43 38 L Q E -E 90 0B 18 47,-2.3 47,-2.1 -2,-0.4 3,-0.1 -0.927 7.9-159.4-128.3 107.1 20.9 36.2 39.9 44 39 L R > - 0 0 66 -2,-0.5 3,-1.9 4,-0.5 45,-0.2 -0.449 44.8 -74.9 -78.5 157.1 22.1 36.3 43.5 45 40 L P T 3 S+ 0 0 52 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.235 119.2 11.4 -53.9 138.4 20.2 38.5 45.9 46 41 L G T 3 S+ 0 0 90 1,-0.2 2,-0.3 -3,-0.1 -2,-0.1 0.650 115.4 92.3 69.3 17.1 21.1 42.2 45.4 47 42 L Q S < S- 0 0 107 -3,-1.9 -1,-0.2 1,-0.0 3,-0.1 -0.837 75.6 -92.3-137.4 175.2 22.8 41.6 42.1 48 43 L S - 0 0 30 -2,-0.3 -4,-0.5 1,-0.1 -6,-0.1 -0.430 50.6 -88.7 -85.2 157.9 22.4 41.4 38.4 49 44 L P - 0 0 4 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.379 45.3-159.6 -62.7 145.7 21.6 38.4 36.3 50 45 L K E -F 42 0B 77 -8,-2.2 -8,-1.9 -3,-0.1 2,-0.2 -0.986 15.5-124.9-134.5 124.3 24.8 36.6 35.3 51 46 L R E +F 41 0B 12 -2,-0.4 -10,-0.2 -10,-0.2 3,-0.1 -0.472 31.3 168.8 -68.9 134.7 25.2 34.1 32.4 52 47 L L E + 0 0 2 -12,-3.2 8,-1.8 1,-0.3 2,-0.3 0.616 64.9 25.8-114.8 -28.9 26.6 30.8 33.4 53 48 L I E -FG 40 59B 0 -13,-1.2 -13,-1.9 6,-0.2 -1,-0.3 -0.993 56.9-179.4-146.1 135.3 25.9 28.7 30.3 54 49 L Y E >> S+ G 0 58B 23 4,-2.4 4,-1.8 -2,-0.3 3,-0.6 -0.885 71.9 27.5-126.8 160.2 25.5 29.4 26.6 55 50 L L T 34 S- 0 0 27 266,-0.3 2,-3.0 -2,-0.3 3,-0.5 0.945 122.8 -80.1 50.9 49.5 24.9 27.0 23.7 56 51 L V T 34 S+ 0 0 16 -18,-2.4 -1,-0.3 1,-0.2 21,-0.2 0.039 126.1 26.6 48.9 -26.2 23.1 24.7 26.3 57 52 L S T <4 S+ 0 0 64 -2,-3.0 2,-0.4 -3,-0.6 12,-0.3 0.497 85.8 111.4-137.0 -10.2 26.4 23.2 27.7 58 53 L K E < -G 54 0B 97 -4,-1.8 -4,-2.4 -3,-0.5 2,-0.1 -0.571 61.3-135.3 -74.6 123.4 29.2 25.6 27.2 59 54 L L E -G 53 0B 61 -2,-0.4 -6,-0.2 -6,-0.2 2,-0.2 -0.446 14.8-124.8 -77.0 149.6 30.4 27.1 30.5 60 55 L D > - 0 0 12 -8,-1.8 3,-2.4 1,-0.1 -1,-0.1 -0.580 43.6 -74.9 -92.1 158.7 31.1 30.8 30.9 61 56 L S T 3 S+ 0 0 102 1,-0.3 -1,-0.1 263,-0.2 0, 0.0 -0.272 119.0 10.0 -53.9 126.4 34.4 32.1 32.1 62 57 L G T 3 S+ 0 0 77 1,-0.3 -1,-0.3 -3,-0.1 -10,-0.0 0.378 89.5 137.1 86.0 -5.2 34.8 31.6 35.8 63 58 L V < - 0 0 21 -3,-2.4 -1,-0.3 -11,-0.1 -4,-0.1 -0.647 59.3-106.4 -80.3 130.3 31.8 29.4 36.2 64 59 L P > - 0 0 45 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.129 16.5-118.8 -55.7 144.0 32.5 26.4 38.5 65 60 L D T 3 S+ 0 0 156 1,-0.3 16,-0.1 15,-0.0 -2,-0.1 0.760 107.1 78.0 -52.4 -27.5 33.0 22.8 37.2 66 61 L R T 3 S+ 0 0 25 14,-0.1 15,-2.3 16,-0.1 -1,-0.3 0.858 78.0 78.8 -52.6 -44.7 29.9 22.0 39.4 67 62 L F E < +C 80 0A 4 -3,-1.5 2,-0.3 13,-0.2 13,-0.2 -0.436 59.5 180.0 -73.5 144.1 27.4 23.4 36.9 68 63 L T E -C 79 0A 69 11,-1.5 11,-2.8 -2,-0.1 2,-0.4 -0.998 11.6-156.6-145.4 138.4 26.5 21.3 33.9 69 64 L G E +C 78 0A 8 -12,-0.3 2,-0.3 -2,-0.3 9,-0.2 -0.942 20.4 153.9-121.5 141.2 24.1 22.0 31.0 70 65 L S E +C 77 0A 67 7,-2.1 7,-3.4 -2,-0.4 2,-0.2 -0.961 14.4 104.4-152.7 167.9 22.3 19.5 28.7 71 66 L G E -C 76 0A 31 5,-0.3 5,-0.3 -2,-0.3 2,-0.3 -0.809 35.6-143.0 142.4 177.5 19.2 19.3 26.6 72 67 L S E > -C 75 0A 90 3,-1.9 3,-1.5 -2,-0.2 2,-1.2 -0.878 63.5 -11.7-175.3 140.3 18.1 19.4 23.0 73 68 L G T 3 S- 0 0 18 -2,-0.3 -44,-2.4 1,-0.2 -46,-0.1 -0.478 133.6 -9.8 68.3 -95.3 15.1 20.7 21.0 74 69 L T T 3 S+ 0 0 46 -2,-1.2 -49,-0.8 -46,-0.2 2,-0.4 0.261 123.0 69.8-122.3 9.3 12.6 21.6 23.7 75 70 L D E < +BC 24 72A 69 -3,-1.5 -3,-1.9 -51,-0.2 2,-0.3 -0.925 51.0 164.9-138.9 115.8 14.0 20.2 26.9 76 71 L F E -BC 23 71A 0 -53,-2.3 -53,-2.4 -2,-0.4 2,-0.4 -0.856 14.7-159.7-123.6 154.7 17.1 21.5 28.6 77 72 L T E -BC 22 70A 44 -7,-3.4 -7,-2.1 -2,-0.3 2,-0.6 -1.000 10.9-152.8-141.6 138.7 18.4 20.8 32.1 78 73 L L E -BC 21 69A 0 -57,-2.4 -57,-2.4 -2,-0.4 2,-0.5 -0.958 20.5-169.2-109.2 119.5 20.8 22.6 34.4 79 74 L R E -BC 20 68A 122 -11,-2.8 -11,-1.5 -2,-0.6 2,-0.7 -0.940 12.7-158.8-114.6 129.9 22.5 20.2 36.9 80 75 L I E -BC 19 67A 0 -61,-3.0 -61,-2.2 -2,-0.5 3,-0.2 -0.931 8.4-155.0-106.5 114.0 24.5 21.3 39.8 81 76 L S S S+ 0 0 53 -15,-2.3 2,-0.3 -2,-0.7 -1,-0.2 0.891 80.9 1.4 -53.6 -48.2 26.8 18.5 40.9 82 77 L R S S- 0 0 117 -64,-0.1 -1,-0.3 -3,-0.1 -65,-0.1 -0.938 79.8-133.7-147.3 120.2 27.1 19.6 44.5 83 78 L V - 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