==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CATALYTIC ANTIBODY 10-AUG-94 1EAP . COMPND 2 MOLECULE: IGG2B-KAPPA 17E8 FAB (LIGHT CHAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR G.W.ZHOU,J.GUO,W.HUANG,T.S.SCANLAN,R.J.FLETTERICK . 429 2 5 4 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20000.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 295 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 162 37.8 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 . 2 0.5 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 . 3 0.7 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 . 68 15.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 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 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 3 4 3 3 6 7 1 1 1 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 . 1 1 5 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 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 69 0, 0.0 2,-0.3 0, 0.0 93,-0.1 0.000 360.0 360.0 360.0 156.0 -0.7 -5.9 35.7 2 2 A I - 0 0 3 91,-0.1 2,-0.2 88,-0.1 88,-0.1 -0.972 360.0-122.1-147.0 141.4 -1.9 -5.5 32.1 3 3 A E - 0 0 126 -2,-0.3 23,-0.9 93,-0.0 2,-0.4 -0.537 20.9-158.7 -83.2 157.9 -0.7 -7.5 29.0 4 4 A L E -A 25 0A 18 93,-0.3 2,-0.5 21,-0.2 95,-0.4 -0.927 0.5-160.7-143.4 106.1 0.8 -5.6 26.2 5 5 A T E -A 24 0A 100 19,-2.6 19,-2.3 -2,-0.4 2,-0.4 -0.775 14.2-175.1 -89.1 134.0 0.9 -7.2 22.8 6 6 A Q E -A 23 0A 14 -2,-0.5 17,-0.2 17,-0.2 93,-0.2 -0.997 12.6-129.7-135.3 140.3 3.3 -5.6 20.4 7 7 A S E +A 22 0A 56 15,-1.8 15,-1.9 -2,-0.4 2,-0.1 -0.941 59.7 23.0-150.2 162.3 3.9 -6.3 16.9 8 8 A P - 0 0 60 0, 0.0 2,-0.4 0, 0.0 14,-0.2 0.797 51.1-164.6 -67.4 177.5 5.7 -7.0 14.6 9 9 A S S S+ 0 0 64 1,-0.2 92,-0.2 92,-0.2 94,-0.1 -0.961 78.3 27.9-115.1 142.0 9.0 -8.5 16.0 10 10 A S S S- 0 0 79 -2,-0.4 2,-0.4 92,-0.2 93,-0.2 0.519 70.9-175.3 61.9 123.4 11.4 -8.3 13.0 11 11 A L E -d 103 0B 36 91,-0.9 93,-2.1 -3,-0.1 2,-0.8 -0.940 17.6-146.6-139.5 131.0 10.7 -5.5 10.6 12 12 A S E -d 104 0B 54 -2,-0.4 2,-0.3 91,-0.2 93,-0.2 -0.931 27.1-175.2 -98.9 115.7 12.9 -5.2 7.5 13 13 A A E -d 105 0B 8 91,-2.6 93,-2.9 -2,-0.8 2,-0.4 -0.803 23.5-134.6-107.0 152.0 13.2 -1.6 6.8 14 14 A S > - 0 0 58 -2,-0.3 3,-2.2 91,-0.2 2,-0.4 -0.873 35.7-109.1 -99.0 139.7 14.8 0.2 3.9 15 15 A L T 3 S+ 0 0 91 -2,-0.4 64,-0.2 91,-0.3 3,-0.1 -0.605 109.4 38.6 -71.7 122.0 17.0 3.0 5.1 16 16 A G T 3 S+ 0 0 48 62,-1.4 -1,-0.3 -2,-0.4 2,-0.1 0.023 103.5 82.8 122.1 -18.2 15.1 6.1 3.9 17 17 A G S < S- 0 0 33 -3,-2.2 61,-1.8 60,-0.1 -1,-0.4 -0.313 75.6 -92.2-108.0-167.0 11.5 4.9 4.7 18 18 A K - 0 0 123 59,-0.2 2,-0.3 -2,-0.1 58,-0.2 -0.690 21.6-157.7-112.2 155.8 9.1 4.6 7.7 19 19 A V E - B 0 75A 2 56,-1.7 56,-1.8 -2,-0.2 2,-0.5 -0.956 2.6-161.4-128.6 147.5 8.3 2.0 10.4 20 20 A T E - B 0 74A 68 -2,-0.3 2,-0.2 54,-0.2 54,-0.2 -0.935 8.9-174.6-135.9 106.8 5.1 1.7 12.4 21 21 A I E - B 0 73A 0 52,-2.6 52,-2.1 -2,-0.5 2,-0.3 -0.631 10.8-155.3 -94.8 156.8 5.3 -0.4 15.6 22 22 A T E -AB 7 72A 45 -15,-1.9 -15,-1.8 50,-0.2 2,-0.4 -0.995 14.8-170.2-140.9 137.2 2.1 -1.0 17.6 23 23 A a E -AB 6 71A 0 48,-2.2 48,-1.1 -2,-0.3 2,-0.4 -0.998 7.9-171.3-125.8 128.3 1.2 -1.9 21.3 24 24 A K E -AB 5 70A 86 -19,-2.3 -19,-2.6 -2,-0.4 46,-0.2 -0.980 12.9-150.7-120.5 128.9 -2.3 -2.9 22.2 25 25 A A E -A 4 0A 10 44,-1.2 -21,-0.2 -2,-0.4 44,-0.1 -0.366 19.0-129.4 -96.3 174.4 -3.2 -3.2 25.9 26 26 A S S S+ 0 0 44 -23,-0.9 2,-0.3 -2,-0.1 -22,-0.1 0.684 95.2 26.4 -94.9 -25.2 -5.7 -5.4 27.8 27 27 A Q S S- 0 0 86 -24,-0.3 2,-0.5 41,-0.1 -2,-0.1 -0.791 104.0 -86.1-123.8 171.7 -7.2 -2.5 29.8 28 28 A D - 0 0 69 -2,-0.3 41,-0.2 1,-0.1 40,-0.1 -0.720 41.6-167.9 -78.5 127.4 -7.5 1.1 28.9 29 29 A I > - 0 0 0 39,-1.9 3,-1.8 -2,-0.5 62,-0.2 0.233 29.5-125.0-106.0 9.2 -4.1 2.5 30.1 30 30 A K T 3 - 0 0 88 38,-0.3 38,-0.1 1,-0.3 3,-0.1 0.809 63.9 -60.1 59.1 41.6 -4.9 6.2 29.8 31 31 A K T 3 S+ 0 0 82 36,-0.8 2,-1.6 37,-0.4 -1,-0.3 0.547 99.3 132.8 62.3 7.7 -1.9 7.3 27.5 32 32 A Y < + 0 0 96 -3,-1.8 59,-1.4 18,-0.2 60,-0.4 -0.687 34.8 114.2 -86.4 87.3 0.5 6.1 30.2 33 33 A I E -E 90 0C 0 -2,-1.6 18,-2.0 57,-0.2 17,-0.4 -0.962 45.0-162.4-146.6 153.5 2.8 4.2 27.9 34 34 A G E -E 89 0C 4 55,-1.0 55,-1.5 -2,-0.3 2,-0.4 -0.758 11.9-135.2-129.2 173.1 6.5 4.9 26.9 35 35 A W E -EF 88 48C 0 13,-1.6 12,-2.8 -2,-0.2 13,-1.1 -0.981 19.6-168.0-135.0 131.3 8.8 3.7 24.1 36 36 A Y E -EF 87 46C 10 51,-2.9 51,-0.9 -2,-0.4 2,-0.4 -0.732 13.1-145.4-114.4 161.1 12.4 2.5 24.5 37 37 A Q E -EF 86 45C 6 8,-2.1 8,-2.2 -2,-0.3 2,-0.4 -0.977 15.5-173.8-122.7 138.8 15.2 1.8 22.1 38 38 A H E +E 85 0C 18 47,-2.2 47,-2.7 -2,-0.4 5,-0.1 -0.916 5.2 175.9-138.4 108.2 17.6 -1.0 22.9 39 39 A K - 0 0 54 -2,-0.4 3,-0.2 4,-0.3 45,-0.1 -0.499 44.8 -87.7 -91.3 170.9 20.7 -1.5 20.7 40 40 A P S S+ 0 0 118 0, 0.0 2,-1.5 0, 0.0 -1,-0.2 -0.326 110.6 29.8 -59.4 161.4 23.3 -4.2 21.6 41 41 A G S S+ 0 0 95 -3,-0.1 2,-0.2 1,-0.1 -3,-0.0 -0.120 111.0 66.1 82.8 -46.1 26.1 -3.0 24.0 42 42 A K S S- 0 0 72 -2,-1.5 3,-0.1 -3,-0.2 -1,-0.1 -0.652 83.1-102.2-112.9 170.1 24.1 -0.4 25.9 43 43 A G - 0 0 24 -2,-0.2 -4,-0.3 1,-0.1 2,-0.1 -0.410 62.7 -71.7 -78.7 162.3 21.1 -0.2 28.4 44 44 A P - 0 0 4 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.389 43.6-145.3 -66.5 133.1 17.7 0.9 27.0 45 45 A R E -F 37 0C 130 -8,-2.2 -8,-2.1 -2,-0.1 2,-0.2 -0.844 18.5-126.9 -96.0 124.8 17.5 4.6 26.0 46 46 A L E +F 36 0C 13 -2,-0.4 -10,-0.2 -10,-0.2 275,-0.1 -0.536 30.5 175.6 -75.6 141.4 13.9 6.1 26.7 47 47 A L E + 0 0 0 -12,-2.8 8,-1.3 1,-0.4 2,-0.3 0.797 58.2 8.3-111.7 -43.9 12.5 7.8 23.6 48 48 A I E -FG 35 54C 0 -13,-1.1 -13,-1.6 6,-0.2 -1,-0.4 -0.982 61.8-162.0-138.8 137.3 8.9 9.1 24.2 49 49 A H E > + G 0 53C 17 4,-2.4 4,-1.1 -2,-0.3 3,-0.3 -0.952 68.7 18.2-126.5 163.3 6.9 9.2 27.4 50 50 A Y T >4 S- 0 0 95 -17,-0.4 2,-2.8 -2,-0.3 3,-0.9 0.972 121.9 -73.0 45.9 59.2 3.1 9.5 28.1 51 51 A T T 34 S+ 0 0 2 -18,-2.0 -1,-0.2 1,-0.3 -19,-0.1 -0.252 126.2 21.9 63.8 -56.9 2.3 8.5 24.5 52 52 A S T 34 S+ 0 0 68 -2,-2.8 2,-1.1 -3,-0.3 12,-0.3 0.605 85.0 110.1-118.7 -19.9 3.3 11.6 22.6 53 53 A T E << -G 49 0C 61 -4,-1.1 -4,-2.4 -3,-0.9 -2,-0.1 -0.447 57.7-149.0 -70.9 92.8 5.8 13.6 24.7 54 54 A L E -G 48 0C 50 -2,-1.1 -6,-0.2 -6,-0.2 -2,-0.1 0.003 19.2-110.9 -47.0 160.9 9.2 13.3 22.9 55 55 A L > - 0 0 13 -8,-1.3 3,-1.9 4,-0.1 2,-0.2 -0.747 37.2 -86.2 -99.1 155.0 12.4 13.4 25.0 56 56 A P T 3 S+ 0 0 71 0, 0.0 -1,-0.1 0, 0.0 262,-0.0 -0.362 119.4 11.2 -46.9 114.6 15.1 16.2 25.1 57 57 A G T 3 S+ 0 0 74 1,-0.4 262,-0.0 -2,-0.2 -3,-0.0 0.135 96.1 123.1 98.1 -22.3 17.5 15.3 22.3 58 58 A I < - 0 0 19 -3,-1.9 -1,-0.4 -11,-0.1 2,-0.1 -0.582 66.9-114.4 -77.3 131.1 15.2 12.7 20.8 59 59 A P > - 0 0 44 0, 0.0 3,-1.7 0, 0.0 -4,-0.1 -0.343 10.5-122.8 -62.7 148.7 14.6 13.6 17.1 60 60 A S T 3 S+ 0 0 109 1,-0.3 16,-0.1 -2,-0.1 -2,-0.1 0.397 102.1 79.8 -72.7 2.6 11.2 14.5 15.8 61 61 A R T 3 S+ 0 0 53 14,-0.1 15,-2.5 15,-0.1 2,-0.4 0.708 83.7 74.8 -78.3 -18.4 11.3 11.7 13.2 62 62 A F E < S+C 75 0A 5 -3,-1.7 2,-0.3 13,-0.2 13,-0.2 -0.743 70.6 170.8 -83.7 137.8 10.3 9.5 16.1 63 63 A R E -C 74 0A 138 11,-2.0 11,-2.7 -2,-0.4 2,-0.3 -0.968 17.3-159.3-148.9 148.0 6.7 10.1 16.8 64 64 A G E +C 73 0A 2 -2,-0.3 2,-0.3 -12,-0.3 9,-0.2 -0.976 14.8 166.0-133.3 146.9 4.2 8.4 19.1 65 65 A S E +C 72 0A 28 7,-2.4 7,-2.4 -2,-0.3 2,-0.2 -0.961 14.9 99.8-151.8 160.0 0.3 8.3 19.1 66 66 A G E -C 71 0A 27 -2,-0.3 5,-0.2 5,-0.3 -14,-0.0 -0.725 29.1-155.5 145.6 171.9 -2.7 6.4 20.6 67 67 A S + 0 0 77 3,-2.0 -36,-0.8 -2,-0.2 -38,-0.2 0.414 68.4 20.2-146.4 -69.3 -5.4 6.4 23.2 68 68 A G S S- 0 0 37 -38,-0.1 -39,-1.9 -40,-0.1 -37,-0.4 0.931 127.9 -38.0 -74.4 -85.8 -7.4 3.5 24.8 69 69 A R S S+ 0 0 102 -41,-0.2 -44,-1.2 -40,-0.1 2,-0.3 0.590 121.0 86.1-109.2 -27.3 -5.5 0.3 24.4 70 70 A D E +B 24 0A 86 -46,-0.2 -3,-2.0 -48,-0.1 2,-0.3 -0.666 50.7 163.2 -85.0 135.2 -4.2 1.0 20.9 71 71 A Y E -BC 23 66A 2 -48,-1.1 -48,-2.2 -2,-0.3 2,-0.3 -0.981 17.9-156.5-148.6 143.5 -0.9 3.0 20.5 72 72 A S E -BC 22 65A 38 -7,-2.4 -7,-2.4 -2,-0.3 2,-0.4 -0.922 4.8-158.0-127.7 148.5 1.5 3.4 17.5 73 73 A F E -BC 21 64A 0 -52,-2.1 -52,-2.6 -2,-0.3 2,-0.3 -0.972 18.9-169.7-121.2 140.0 5.3 4.3 17.3 74 74 A S E -BC 20 63A 9 -11,-2.7 -11,-2.0 -2,-0.4 2,-0.5 -0.982 20.8-168.1-142.2 138.1 6.6 5.7 14.1 75 75 A I E -BC 19 62A 0 -56,-1.8 -56,-1.7 -2,-0.3 -13,-0.2 -0.974 8.9-169.8-125.5 107.4 10.0 6.5 12.6 76 76 A S S S+ 0 0 59 -15,-2.5 2,-0.7 -2,-0.5 -1,-0.1 0.930 79.1 32.3 -68.8 -45.0 9.6 8.5 9.5 77 77 A N S S- 0 0 88 -16,-0.1 2,-0.5 -59,-0.1 -1,-0.3 -0.938 78.7-149.7-116.5 108.9 13.1 8.3 8.3 78 78 A L - 0 0 2 -61,-1.8 -62,-1.4 -2,-0.7 2,-0.4 -0.702 24.3-157.4 -74.4 124.6 14.8 5.1 9.2 79 79 A E > - 0 0 93 -2,-0.5 3,-2.5 -64,-0.2 2,-0.9 -0.864 30.0-103.4-107.1 147.9 18.3 6.1 9.6 80 80 A G T 3 S+ 0 0 61 -2,-0.4 -2,-0.0 1,-0.3 -65,-0.0 -0.671 122.2 44.1 -65.5 100.8 21.4 4.0 9.4 81 81 A G T 3 S+ 0 0 48 -2,-0.9 -1,-0.3 3,-0.0 -3,-0.0 0.321 87.8 84.1 131.3 4.4 21.6 4.1 13.2 82 82 A D < + 0 0 8 -3,-2.5 2,-0.9 2,-0.1 -2,-0.1 0.305 56.2 121.0-109.7 9.4 18.0 3.4 14.2 83 83 A I + 0 0 48 -4,-0.3 2,-0.2 19,-0.1 21,-0.1 -0.610 43.7 105.8 -78.3 103.4 18.5 -0.4 13.9 84 84 A A S S- 0 0 5 -2,-0.9 19,-1.7 -45,-0.1 2,-0.4 -0.855 75.8 -83.9-162.3 179.7 17.7 -1.5 17.4 85 85 A T E -EH 38 102C 13 -47,-2.7 -47,-2.2 -2,-0.2 2,-0.5 -0.904 37.5-152.1-103.3 138.1 14.8 -3.2 19.3 86 86 A Y E -EH 37 101C 0 15,-2.0 15,-1.6 -2,-0.4 2,-0.4 -0.939 13.2-176.6-112.1 124.1 11.9 -1.0 20.4 87 87 A Y E -E 36 0C 9 -51,-0.9 -51,-2.9 -2,-0.5 2,-0.3 -0.873 15.1-145.7-115.4 149.1 9.8 -2.0 23.4 88 88 A a E -E 35 0C 0 -2,-0.4 10,-1.8 -53,-0.2 2,-0.3 -0.738 14.1-159.3-105.2 165.7 6.8 -0.2 24.6 89 89 A L E -EI 34 97C 17 -55,-1.5 -55,-1.0 -2,-0.3 8,-0.2 -0.808 4.8-155.4-152.4 99.7 6.1 0.0 28.3 90 90 A Q E +EI 33 96C 0 6,-1.9 6,-1.5 -2,-0.3 -57,-0.2 -0.480 13.9 174.9 -73.3 157.7 2.8 0.8 30.1 91 91 A Y + 0 0 67 -59,-1.4 3,-0.3 -62,-0.2 -58,-0.1 -0.137 47.2 109.3-150.2 34.0 2.9 2.2 33.5 92 92 A Y S S+ 0 0 84 -60,-0.4 2,-0.2 1,-0.3 3,-0.1 0.708 101.6 10.0 -81.1 -22.4 -0.8 2.8 34.2 93 93 A N S S- 0 0 69 1,-0.5 -1,-0.3 -91,-0.1 -91,-0.1 -0.658 134.5 -43.2-162.8 100.5 -0.7 -0.1 36.7 94 94 A L S S- 0 0 37 -3,-0.3 -1,-0.5 -2,-0.2 2,-0.4 -0.397 91.8 -69.1 62.6-148.0 2.7 -1.5 37.5 95 96 A R + 0 0 67 -4,-0.1 2,-0.3 -3,-0.1 -4,-0.2 -0.999 48.3 171.7-139.9 142.6 4.9 -1.9 34.4 96 97 A T E -I 90 0C 32 -6,-1.5 -6,-1.9 -2,-0.4 2,-0.3 -0.974 16.3-152.2-148.1 131.7 4.7 -4.3 31.4 97 98 A F E -I 89 0C 19 -2,-0.3 -93,-0.3 162,-0.3 -8,-0.2 -0.763 18.8-117.8-104.7 156.0 6.8 -4.2 28.2 98 99 A G - 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