==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER COMPLEX (ANTIBODY/ANTIGEN) 30-JUN-98 1BJ1 . COMPND 2 MOLECULE: FAB FRAGMENT; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR Y.A.MULLER,H.W.CHRISTINGER,A.M.DE VOS . 1050 8 9 9 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46734.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 678 64.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 405 38.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 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 . 104 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 40 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 4 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 RESIDUES PER ALPHA HELIX . 4 2 2 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 . 8 10 11 5 10 16 1 2 2 2 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 2 8 2 2 4 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 0 138 0, 0.0 2,-0.1 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 107.4 14.4 13.9 28.1 2 2 L I - 0 0 3 93,-0.4 2,-0.5 91,-0.3 88,-0.1 -0.449 360.0-141.3 -69.6 138.9 11.0 14.1 26.6 3 3 L Q - 0 0 136 -2,-0.1 23,-1.8 94,-0.1 2,-0.4 -0.922 10.0-155.9-108.3 129.6 8.5 15.4 29.1 4 4 L M E -A 25 0A 9 94,-0.5 2,-0.5 -2,-0.5 96,-0.3 -0.890 4.5-165.0-104.8 133.8 4.9 13.9 29.2 5 5 L T E -A 24 0A 78 19,-2.0 19,-1.7 -2,-0.4 2,-0.3 -0.953 6.3-163.9-126.1 111.2 2.0 15.9 30.6 6 6 L Q E -A 23 0A 5 -2,-0.5 17,-0.2 17,-0.2 94,-0.1 -0.702 14.5-127.1 -93.3 147.5 -1.2 14.1 31.4 7 7 L S E S+A 22 0A 53 15,-2.5 15,-3.2 -2,-0.3 2,-0.1 -0.996 75.0 26.4-153.9 139.8 -4.5 15.7 32.1 8 8 L P - 0 0 54 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.624 63.8-150.2 -78.1 170.9 -6.7 15.7 34.1 9 9 L S S S- 0 0 81 1,-0.3 94,-2.2 93,-0.2 2,-0.3 0.828 82.0 -5.2 -72.7 -32.1 -4.8 14.7 37.3 10 10 L S E -d 103 0B 73 92,-0.3 -1,-0.3 75,-0.1 2,-0.3 -0.972 66.7-176.1-159.9 149.1 -7.9 13.1 38.6 11 11 L L E -d 104 0B 36 92,-2.1 94,-2.8 -2,-0.3 2,-0.4 -0.971 15.1-144.4-146.4 160.0 -11.6 12.7 37.6 12 12 L S E +d 105 0B 56 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.993 28.4 162.2-129.1 132.5 -14.8 11.2 39.0 13 13 L A E -d 106 0B 9 92,-2.3 94,-2.2 -2,-0.4 2,-0.1 -0.998 32.1-109.1-152.3 157.1 -17.4 9.6 36.8 14 14 L S > - 0 0 42 -2,-0.3 3,-2.0 92,-0.2 64,-0.4 -0.443 44.1 -87.8 -88.3 158.2 -20.3 7.3 36.8 15 15 L V T 3 S+ 0 0 76 92,-0.5 64,-0.2 1,-0.3 -1,-0.1 -0.382 117.2 28.2 -62.2 128.0 -20.7 3.7 35.6 16 16 L G T 3 S+ 0 0 40 62,-2.2 -1,-0.3 1,-0.4 63,-0.1 0.144 94.8 125.0 103.5 -18.5 -21.7 3.8 31.9 17 17 L D < - 0 0 71 -3,-2.0 61,-3.1 61,-0.2 2,-0.4 -0.350 63.8-118.2 -74.1 155.1 -20.0 7.1 31.3 18 18 L R - 0 0 174 59,-0.2 2,-0.4 -3,-0.1 58,-0.2 -0.782 30.7-165.2 -94.0 135.3 -17.4 7.8 28.6 19 19 L V E - B 0 75A 8 56,-2.9 56,-3.1 -2,-0.4 2,-0.4 -0.981 6.5-171.4-125.5 132.0 -14.1 8.8 30.0 20 20 L T E - B 0 74A 56 -2,-0.4 2,-0.4 54,-0.2 54,-0.2 -0.996 3.4-164.3-128.3 128.9 -11.2 10.4 28.0 21 21 L I E - B 0 73A 0 52,-3.0 52,-2.8 -2,-0.4 2,-0.3 -0.907 12.6-142.1-113.7 140.7 -7.7 11.1 29.3 22 22 L T E -AB 7 72A 52 -15,-3.2 -15,-2.5 -2,-0.4 2,-0.3 -0.776 14.4-174.2-107.5 150.8 -5.2 13.4 27.6 23 23 L C E -AB 6 71A 0 48,-2.2 48,-2.8 -2,-0.3 2,-0.4 -1.000 3.1-169.0-142.7 134.8 -1.5 13.2 27.1 24 24 L S E -AB 5 70A 46 -19,-1.7 -19,-2.0 -2,-0.3 2,-0.3 -0.986 11.2-148.3-128.5 124.0 0.8 15.9 25.6 25 25 L A E -A 4 0A 6 44,-1.9 -21,-0.2 -2,-0.4 4,-0.0 -0.709 18.4-130.9 -93.2 146.5 4.5 15.3 24.6 26 26 L S S S+ 0 0 71 -23,-1.8 2,-0.3 -2,-0.3 -1,-0.1 0.535 93.1 9.3 -70.3 -6.1 7.1 18.1 24.8 27 27 L Q S S- 0 0 97 41,-0.2 2,-0.1 -24,-0.2 -1,-0.1 -0.955 104.7 -67.3-165.0 157.9 8.2 17.2 21.2 28 28 L D + 0 0 96 -2,-0.3 41,-0.2 1,-0.2 3,-0.1 -0.354 45.0 169.5 -57.5 122.0 7.0 15.0 18.4 29 29 L I > - 0 0 0 39,-2.5 3,-2.0 1,-0.3 2,-0.4 0.159 34.2-143.6-117.8 11.4 7.3 11.3 19.4 30 30 L S T 3 - 0 0 58 38,-0.3 38,-1.8 1,-0.3 -1,-0.3 -0.456 65.2 -32.6 59.9-114.7 5.2 10.1 16.4 31 31 L N T 3 S+ 0 0 59 -2,-0.4 2,-1.9 36,-0.2 -1,-0.3 0.113 100.4 122.6-119.9 19.6 3.1 7.2 17.5 32 32 L Y < + 0 0 90 -3,-2.0 59,-2.1 18,-0.2 2,-0.4 -0.446 42.7 118.7 -84.6 66.0 5.6 5.8 20.0 33 33 L L E -E 90 0B 0 -2,-1.9 18,-2.8 57,-0.2 2,-0.3 -0.993 40.3-168.6-137.2 137.6 3.3 6.0 23.0 34 34 L N E -E 89 0B 0 55,-2.6 55,-1.9 -2,-0.4 2,-0.4 -0.843 10.8-145.5-120.0 158.3 1.9 3.3 25.5 35 35 L W E -EF 88 48B 0 13,-2.7 12,-2.9 -2,-0.3 13,-1.3 -0.993 15.5-170.5-126.7 136.2 -0.9 3.5 28.2 36 36 L Y E -EF 87 46B 0 51,-3.0 51,-2.0 -2,-0.4 2,-0.4 -0.874 13.4-147.9-124.1 155.9 -0.8 1.5 31.5 37 37 L Q E -EF 86 45B 7 8,-3.1 8,-2.3 -2,-0.3 2,-0.5 -0.988 14.1-168.3-123.3 128.1 -3.4 0.9 34.2 38 38 L Q E -E 85 0B 20 47,-2.5 47,-1.6 -2,-0.4 5,-0.1 -0.972 2.3-163.2-122.4 123.6 -2.2 0.5 37.9 39 39 L K > - 0 0 50 -2,-0.5 3,-2.4 4,-0.5 45,-0.1 -0.604 44.0 -67.9 -99.6 159.1 -4.5 -0.7 40.7 40 40 L P T 3 S- 0 0 64 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.217 118.7 -1.2 -48.2 121.3 -3.9 -0.4 44.4 41 41 L G T 3 S+ 0 0 87 1,-0.2 2,-0.3 -3,-0.1 -3,-0.0 0.429 113.9 103.4 76.0 4.1 -0.9 -2.4 45.6 42 42 L K S < S- 0 0 122 -3,-2.4 -1,-0.2 1,-0.1 3,-0.1 -0.730 74.2-101.3-117.9 167.0 -0.2 -3.8 42.1 43 43 L A - 0 0 24 -2,-0.3 -4,-0.5 1,-0.1 -6,-0.1 -0.384 52.6 -87.5 -77.7 154.3 2.2 -3.3 39.3 44 44 L P - 0 0 4 0, 0.0 2,-0.4 0, 0.0 -6,-0.3 -0.265 41.0-148.0 -59.3 156.5 1.2 -1.3 36.2 45 45 L K E -F 37 0B 96 -8,-2.3 -8,-3.1 -3,-0.1 2,-0.2 -0.998 14.3-120.9-131.3 128.4 -0.5 -3.2 33.5 46 46 L V E +F 36 0B 7 -2,-0.4 -10,-0.2 278,-0.3 3,-0.1 -0.492 34.1 166.5 -72.0 129.4 -0.2 -2.4 29.8 47 47 L L E + 0 0 0 -12,-2.9 8,-2.8 1,-0.4 2,-0.3 0.800 65.2 13.2-103.8 -52.6 -3.4 -1.6 28.0 48 48 L I E -FG 35 54B 1 -13,-1.3 -13,-2.7 6,-0.2 -1,-0.4 -0.956 60.7-173.3-132.5 140.9 -2.5 -0.0 24.7 49 49 L Y E > + G 0 53B 53 4,-2.2 4,-2.2 -2,-0.3 3,-0.4 -0.946 67.0 26.6-132.2 154.6 0.9 0.2 22.8 50 50 L F T 4 S- 0 0 67 -2,-0.3 2,-2.5 1,-0.2 -1,-0.2 0.940 125.4 -68.9 59.0 49.8 1.9 2.1 19.6 51 51 L T T 4 S+ 0 0 6 -18,-2.8 -1,-0.2 1,-0.2 21,-0.2 -0.241 127.6 14.5 68.0 -46.9 -0.8 4.7 20.2 52 52 L S T 4 S+ 0 0 76 -2,-2.5 2,-0.5 -3,-0.4 12,-0.3 0.360 83.2 118.6-143.5 10.1 -3.8 2.5 19.4 53 53 L S E < -G 49 0B 45 -4,-2.2 -4,-2.2 10,-0.1 2,-0.4 -0.722 56.5-135.8 -85.3 122.8 -3.0 -1.2 19.5 54 54 L L E -G 48 0B 68 -2,-0.5 -6,-0.2 -6,-0.2 2,-0.1 -0.633 19.5-126.1 -75.4 130.7 -5.0 -3.1 22.2 55 55 L H > - 0 0 39 -8,-2.8 3,-1.4 -2,-0.4 -1,-0.1 -0.463 39.5 -87.0 -74.3 149.7 -2.9 -5.6 24.1 56 56 L S T 3 S+ 0 0 100 1,-0.2 -1,-0.1 -2,-0.1 0, 0.0 -0.329 114.0 25.2 -58.4 135.4 -4.2 -9.1 24.1 57 57 L G T 3 S+ 0 0 80 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.504 90.7 121.6 89.7 5.3 -6.7 -9.7 27.0 58 58 L V < - 0 0 16 -3,-1.4 -1,-0.3 -11,-0.1 2,-0.1 -0.851 68.4-106.6-104.2 135.2 -7.7 -6.1 27.4 59 59 L P > - 0 0 46 0, 0.0 3,-2.0 0, 0.0 -1,-0.0 -0.327 21.9-123.2 -60.3 141.8 -11.4 -5.1 27.0 60 60 L S T 3 S+ 0 0 112 1,-0.3 16,-0.1 -2,-0.1 -2,-0.0 0.561 102.1 80.0 -64.0 -9.5 -12.5 -3.3 23.9 61 61 L R T 3 S+ 0 0 47 14,-0.1 15,-2.3 16,-0.1 2,-0.5 0.625 81.3 81.1 -73.4 -11.0 -13.9 -0.4 25.9 62 62 L F E < +C 75 0A 7 -3,-2.0 2,-0.3 13,-0.2 13,-0.2 -0.838 61.1 159.9 -95.3 126.7 -10.3 0.8 26.1 63 63 L S E -C 74 0A 60 11,-1.9 11,-2.8 -2,-0.5 2,-0.3 -0.989 23.3-152.1-145.6 153.0 -9.0 2.6 23.0 64 64 L G E +C 73 0A 10 -2,-0.3 2,-0.3 -12,-0.3 9,-0.2 -0.961 14.9 171.5-128.8 147.5 -6.2 5.0 22.1 65 65 L S E +C 72 0A 65 7,-2.1 7,-2.4 -2,-0.3 2,-0.2 -0.897 25.5 72.7-142.1 171.9 -5.8 7.8 19.5 66 66 L G E -C 71 0A 34 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.551 39.0-144.7 117.1 179.2 -3.4 10.6 18.5 67 67 L S E > +C 70 0A 77 3,-2.0 2,-1.2 -2,-0.2 3,-1.1 -0.888 62.2 16.6 179.0 152.5 -0.0 11.4 17.0 68 68 L G T 3 S- 0 0 17 -38,-1.8 -39,-2.5 -2,-0.3 -38,-0.3 -0.646 129.8 -17.5 83.3 -98.3 2.8 13.8 17.3 69 69 L T T 3 S+ 0 0 51 -2,-1.2 -44,-1.9 -41,-0.2 2,-0.4 0.313 123.7 71.6-124.4 -0.8 2.5 15.6 20.6 70 70 L D E < +BC 24 67A 93 -3,-1.1 -3,-2.0 -46,-0.2 2,-0.3 -0.976 52.0 163.4-129.2 125.5 -1.2 14.9 21.4 71 71 L F E -BC 23 66A 1 -48,-2.8 -48,-2.2 -2,-0.4 2,-0.3 -0.914 15.5-157.3-135.3 160.2 -2.7 11.6 22.5 72 72 L T E -BC 22 65A 39 -7,-2.4 -7,-2.1 -2,-0.3 2,-0.4 -0.999 7.4-157.5-144.6 135.2 -5.9 10.3 24.1 73 73 L L E -BC 21 64A 1 -52,-2.8 -52,-3.0 -2,-0.3 2,-0.4 -0.943 20.5-165.1-107.2 135.2 -7.0 7.2 26.1 74 74 L T E -BC 20 63A 27 -11,-2.8 -11,-1.9 -2,-0.4 2,-0.6 -0.972 21.0-167.5-127.7 134.8 -10.8 6.5 26.1 75 75 L I E -BC 19 62A 1 -56,-3.1 -56,-2.9 -2,-0.4 3,-0.3 -0.975 15.4-161.0-113.9 105.2 -13.0 4.2 28.3 76 76 L S S S+ 0 0 67 -15,-2.3 2,-0.3 -2,-0.6 -1,-0.1 0.802 79.3 13.1 -61.3 -30.0 -16.2 4.2 26.3 77 77 L S S S- 0 0 45 -16,-0.1 -1,-0.3 -59,-0.1 -59,-0.2 -0.843 85.9-130.9-151.3 103.6 -18.3 3.0 29.2 78 78 L L - 0 0 0 -61,-3.1 -62,-2.2 -64,-0.4 -61,-0.2 -0.343 21.8-164.1 -63.6 131.2 -16.8 3.1 32.7 79 79 L Q > - 0 0 56 -64,-0.2 3,-2.1 -63,-0.1 4,-0.1 -0.814 31.9-112.0-110.9 155.1 -17.1 -0.1 34.9 80 80 L P G > S+ 0 0 26 0, 0.0 3,-1.2 0, 0.0 26,-0.1 0.857 115.9 60.2 -56.6 -32.4 -16.5 -0.3 38.7 81 81 L E G 3 S+ 0 0 74 1,-0.3 87,-0.1 88,-0.1 88,-0.1 0.408 85.3 80.8 -74.9 0.8 -13.4 -2.3 38.2 82 82 L D G < + 0 0 2 -3,-2.1 2,-0.3 86,-0.1 -1,-0.3 0.363 57.0 124.3 -90.2 5.0 -11.8 0.5 36.2 83 83 L F < + 0 0 8 -3,-1.2 2,-0.3 85,-0.1 22,-0.2 -0.529 44.5 98.0 -63.8 124.5 -10.9 2.4 39.4 84 84 L A E S- H 0 104B 2 20,-1.0 20,-2.4 -2,-0.3 2,-0.4 -0.962 75.3 -85.8 176.8-173.1 -7.1 3.0 39.0 85 85 L T E -EH 38 103B 25 -47,-1.6 -47,-2.5 -2,-0.3 2,-0.4 -0.991 37.8-148.8-122.7 131.1 -4.4 5.4 37.9 86 86 L Y E -EH 37 102B 0 16,-2.2 16,-1.5 -2,-0.4 2,-0.3 -0.868 13.5-169.5-106.6 135.7 -3.6 5.5 34.2 87 87 L Y E -E 36 0B 11 -51,-2.0 -51,-3.0 -2,-0.4 2,-0.3 -0.960 11.0-149.4-126.2 145.1 -0.1 6.4 32.9 88 88 L C E -E 35 0B 0 -2,-0.3 11,-2.1 -53,-0.2 2,-0.3 -0.791 13.6-168.4-108.1 153.2 1.4 7.2 29.5 89 89 L Q E -EI 34 98B 0 -55,-1.9 -55,-2.6 -2,-0.3 2,-0.3 -0.985 10.3-146.2-145.0 132.7 4.9 6.4 28.4 90 90 L Q E -EI 33 97B 0 7,-2.0 7,-0.8 -2,-0.3 -57,-0.2 -0.759 11.8-176.1 -99.6 142.6 6.9 7.4 25.3 91 91 L Y + 0 0 6 -59,-2.1 231,-0.2 -2,-0.3 3,-0.1 -0.178 56.3 104.7-126.5 37.8 9.5 5.2 23.7 92 92 L S S S+ 0 0 32 1,-0.3 2,-0.3 -60,-0.3 4,-0.1 0.892 90.6 6.4 -81.2 -46.1 10.7 7.7 21.1 93 93 L T S S- 0 0 49 2,-0.2 -1,-0.3 4,-0.0 -91,-0.3 -0.999 95.5 -74.3-141.7 140.7 14.1 8.6 22.7 94 94 L V S S+ 0 0 54 -2,-0.3 2,-0.1 -3,-0.1 -3,-0.1 -0.473 104.3 56.5 -74.1 142.3 15.9 7.2 25.8 95 95 L P S S- 0 0 18 0, 0.0 -93,-0.4 0, 0.0 -2,-0.2 0.549 86.6-135.4 -77.6 147.3 15.3 7.6 28.7 96 96 L W - 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