==== 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 IMMUNOGLOBULIN 13-NOV-97 1AY1 . COMPND 2 MOLECULE: TP7 FAB; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR R.MURALI,M.HELMER-CITTERICH,D.J.SHARKEY,E.R.SCALICE, . 423 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19304.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 267 63.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 170 40.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 5 1.2 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 . 40 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 2.8 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 1 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 RESIDUES PER ALPHA HELIX . 1 1 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 0 PARALLEL BRIDGES PER LADDER . 4 3 3 5 3 8 2 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 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 0 137 0, 0.0 2,-0.3 0, 0.0 92,-0.1 0.000 360.0 360.0 360.0 48.7 27.3 -16.0 19.7 2 2 L I - 0 0 8 92,-0.4 2,-0.4 90,-0.3 87,-0.1 -0.665 360.0-133.8 -87.7 139.8 27.6 -13.8 16.6 3 3 L Q - 0 0 129 -2,-0.3 23,-1.5 93,-0.1 2,-0.5 -0.781 18.8-147.6 -93.8 136.6 26.3 -10.2 16.7 4 4 L M E -Ab 25 98A 3 93,-0.6 2,-0.6 -2,-0.4 95,-0.5 -0.930 8.5-163.1-113.1 125.0 24.1 -9.2 13.7 5 5 L T E -A 24 0A 69 19,-2.2 19,-2.4 -2,-0.5 2,-0.6 -0.893 1.4-166.1-113.6 116.8 24.1 -5.7 12.4 6 6 L Q E -A 23 0A 17 -2,-0.6 17,-0.2 17,-0.2 93,-0.1 -0.889 19.5-147.5-103.8 115.3 21.3 -4.5 10.1 7 7 L S E S+A 22 0A 56 15,-0.9 15,-0.7 -2,-0.6 2,-0.1 -0.985 74.9 41.1-133.8 120.5 22.1 -1.3 8.3 8 8 L P - 0 0 52 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.275 68.5-161.8 -92.2 152.8 20.2 0.9 7.5 9 9 L A S S+ 0 0 66 1,-0.2 93,-2.7 92,-0.2 2,-0.3 0.895 78.8 8.6 -67.2 -39.9 18.0 0.8 10.6 10 10 L I E +e 102 0B 99 91,-0.2 2,-0.3 74,-0.0 -1,-0.2 -0.966 69.8 161.2-140.4 155.4 15.3 2.7 8.7 11 11 L M E -e 103 0B 48 91,-2.2 93,-3.6 -2,-0.3 2,-0.3 -0.967 22.6-140.0-165.4 160.7 14.7 3.7 5.1 12 12 L S E +e 104 0B 44 -2,-0.3 2,-0.3 91,-0.2 93,-0.2 -0.891 18.6 178.2-127.7 157.0 11.9 4.8 2.8 13 13 L A E -e 105 0B 3 91,-1.6 93,-2.6 -2,-0.3 3,-0.1 -0.974 23.7-127.7-158.6 147.6 11.2 3.9 -0.8 14 14 L S > - 0 0 33 -2,-0.3 3,-1.6 91,-0.2 63,-0.3 -0.683 47.6 -84.5 -94.7 151.7 8.6 4.6 -3.4 15 15 L P T 3 S+ 0 0 76 0, 0.0 63,-0.2 0, 0.0 -1,-0.1 -0.265 115.5 35.2 -52.5 140.8 6.9 1.8 -5.3 16 16 L G T 3 S+ 0 0 36 61,-2.7 2,-0.1 1,-0.3 62,-0.1 0.310 89.4 119.7 97.4 -8.4 9.0 0.8 -8.3 17 17 L E < - 0 0 88 -3,-1.6 60,-1.4 59,-0.1 2,-0.6 -0.457 67.8-112.2 -90.4 162.1 12.5 1.2 -6.7 18 18 L K - 0 0 137 58,-0.2 2,-0.3 -2,-0.1 57,-0.2 -0.852 37.1-160.9 -93.4 120.6 15.2 -1.3 -6.2 19 19 L V E + C 0 74A 2 55,-2.4 55,-2.5 -2,-0.6 2,-0.3 -0.809 13.4 178.3-107.6 144.5 15.7 -1.9 -2.5 20 20 L T E + C 0 73A 53 -2,-0.3 2,-0.3 53,-0.2 53,-0.2 -0.944 1.9 179.2-148.8 119.6 18.7 -3.4 -0.7 21 21 L M E - C 0 72A 0 51,-2.6 51,-2.1 -2,-0.3 2,-0.3 -0.807 17.4-140.4-114.5 161.9 19.3 -4.0 3.0 22 22 L T E -AC 7 71A 49 -15,-0.7 -15,-0.9 -2,-0.3 2,-0.4 -0.897 11.3-162.6-127.9 154.4 22.3 -5.6 4.6 23 23 L a E -AC 6 70A 0 47,-3.0 47,-2.1 -2,-0.3 2,-0.3 -0.984 12.7-165.2-136.7 116.6 23.1 -7.9 7.5 24 24 L S E -AC 5 69A 43 -19,-2.4 -19,-2.2 -2,-0.4 2,-0.4 -0.822 5.8-152.5-102.7 146.2 26.6 -8.1 8.9 25 25 L A E -A 4 0A 9 43,-1.6 -21,-0.2 -2,-0.3 3,-0.1 -0.938 19.9-132.0-117.8 141.1 27.8 -10.9 11.1 26 26 L S S S+ 0 0 77 -23,-1.5 2,-0.3 -2,-0.4 -1,-0.1 0.839 95.8 7.0 -59.2 -33.6 30.6 -10.4 13.6 27 27 L S S S- 0 0 52 -24,-0.2 -1,-0.2 40,-0.1 65,-0.1 -0.977 108.3 -59.2-148.0 153.3 32.2 -13.6 12.3 28 29 L S - 0 0 81 -2,-0.3 64,-0.3 -3,-0.1 2,-0.3 0.127 47.0-168.7 -35.4 138.0 31.4 -15.9 9.4 29 30 L V - 0 0 5 38,-1.5 2,-1.0 62,-0.1 38,-0.3 -0.943 24.9-126.4-131.6 144.9 28.0 -17.6 9.1 30 31 L S S S- 0 0 77 -2,-0.3 60,-0.2 1,-0.3 19,-0.1 -0.838 81.5 -27.7 -97.4 94.5 27.0 -20.4 6.8 31 32 L Y S S- 0 0 47 -2,-1.0 59,-0.4 18,-0.1 -1,-0.3 0.866 70.2-128.1 63.4 118.4 23.8 -19.0 5.1 32 33 L M - 0 0 0 -3,-0.2 18,-2.9 57,-0.1 2,-0.3 -0.398 9.7-138.8 -82.3 160.5 21.4 -16.4 6.6 33 34 L Y E -F 88 0B 4 55,-3.0 55,-2.9 16,-0.2 2,-0.4 -0.913 12.0-156.5-121.0 145.7 17.6 -16.3 7.1 34 35 L W E -FG 87 47B 0 13,-2.3 12,-3.2 -2,-0.3 13,-1.5 -0.986 5.3-168.7-129.1 134.8 15.3 -13.4 6.6 35 36 L Y E -FG 86 45B 5 51,-2.3 51,-2.0 -2,-0.4 2,-0.5 -0.880 12.2-146.1-118.5 150.3 11.9 -12.8 8.1 36 37 L Q E -FG 85 44B 5 8,-3.2 8,-2.7 -2,-0.3 2,-0.6 -0.979 10.3-164.6-117.1 130.5 9.4 -10.1 7.0 37 38 L Q E -FG 84 43B 48 47,-3.1 47,-2.1 -2,-0.5 5,-0.1 -0.895 5.5-156.9-124.2 98.5 7.3 -8.6 9.7 38 39 L K > - 0 0 65 -2,-0.6 3,-0.7 4,-0.6 45,-0.1 -0.533 39.4 -93.5 -68.0 136.6 4.3 -6.6 8.5 39 40 L P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.269 110.7 13.3 -52.8 132.9 3.1 -4.0 11.0 40 41 L G T 3 S+ 0 0 86 1,-0.2 2,-0.3 -3,-0.1 -2,-0.0 0.927 115.8 80.4 65.6 46.9 0.3 -5.6 13.1 41 42 L S S < S- 0 0 59 -3,-0.7 -1,-0.2 281,-0.0 3,-0.1 -0.954 86.0 -79.2-171.1 159.1 0.9 -9.2 12.0 42 43 L S - 0 0 76 -2,-0.3 -4,-0.6 1,-0.1 2,-0.1 -0.290 52.2-102.0 -62.4 148.4 3.1 -12.2 12.7 43 44 L P E -G 37 0B 32 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.423 37.7-154.3 -62.7 150.6 6.6 -12.3 11.2 44 45 L R E -G 36 0B 97 -8,-2.7 -8,-3.2 -2,-0.1 2,-0.1 -0.986 19.6-111.2-132.1 141.6 6.9 -14.6 8.2 45 46 L L E +G 35 0B 18 -2,-0.4 -10,-0.3 -10,-0.2 3,-0.1 -0.464 37.5 169.5 -68.3 139.5 9.9 -16.4 6.8 46 47 L L E + 0 0 0 -12,-3.2 8,-2.9 1,-0.4 2,-0.4 0.669 62.7 21.7-114.8 -54.9 11.0 -14.9 3.5 47 48 L I E -GH 34 53B 0 -13,-1.5 -13,-2.3 6,-0.2 -1,-0.4 -0.955 58.6-175.6-124.7 134.6 14.4 -16.4 2.7 48 49 L Y E >> S+ H 0 52B 57 4,-2.9 4,-1.2 -2,-0.4 3,-0.6 -0.978 72.4 15.9-128.3 138.3 16.0 -19.5 4.0 49 50 L D T 34 S- 0 0 54 -2,-0.4 2,-1.2 1,-0.2 3,-0.2 0.879 119.5 -75.4 67.1 45.1 19.6 -20.6 3.2 50 51 L S T 34 S+ 0 0 13 -18,-2.9 -1,-0.2 1,-0.2 21,-0.2 0.042 126.8 20.5 61.9 -27.6 20.8 -17.2 1.9 51 52 L T T <4 S+ 0 0 85 -2,-1.2 2,-0.6 -3,-0.6 12,-0.3 0.512 90.0 108.9-146.7 -13.4 19.0 -17.3 -1.5 52 53 L N E < -H 48 0B 76 -4,-1.2 -4,-2.9 -3,-0.2 2,-0.3 -0.646 59.7-140.5 -82.0 118.1 16.2 -19.8 -1.3 53 54 L L E -H 47 0B 54 -2,-0.6 -6,-0.2 -6,-0.2 3,-0.1 -0.604 16.2-124.8 -78.3 134.2 12.8 -18.1 -1.3 54 55 L A > - 0 0 20 -8,-2.9 3,-1.2 -2,-0.3 2,-0.1 -0.247 41.4 -84.8 -69.6 166.0 10.2 -19.6 1.0 55 56 L S T 3 S+ 0 0 126 1,-0.2 -1,-0.1 3,-0.0 0, 0.0 -0.480 116.4 30.3 -73.9 144.2 6.9 -20.7 -0.6 56 57 L G T 3 S+ 0 0 72 1,-0.3 -1,-0.2 -2,-0.1 -2,-0.1 0.531 91.8 126.9 84.7 6.7 4.3 -17.9 -1.1 57 58 L V < - 0 0 18 -3,-1.2 -1,-0.3 -11,-0.1 2,-0.2 -0.833 64.6-113.3-101.3 131.8 7.1 -15.4 -1.4 58 59 L P > - 0 0 42 0, 0.0 3,-2.5 0, 0.0 -1,-0.0 -0.467 18.2-125.4 -68.1 132.4 7.2 -13.0 -4.5 59 60 L V T 3 S+ 0 0 139 1,-0.3 16,-0.1 -2,-0.2 -2,-0.0 0.652 101.3 79.9 -47.5 -22.8 10.0 -13.5 -7.0 60 61 L R T 3 S+ 0 0 39 14,-0.1 15,-2.5 15,-0.1 2,-0.4 0.698 80.2 80.7 -63.1 -19.0 10.9 -9.8 -6.6 61 62 L F E < +D 74 0A 3 -3,-2.5 2,-0.3 13,-0.2 13,-0.2 -0.723 59.7 173.3 -89.9 138.0 12.7 -10.6 -3.4 62 63 L S E -D 73 0A 55 11,-2.5 11,-2.5 -2,-0.4 2,-0.4 -0.963 15.0-156.1-141.6 154.8 16.2 -12.1 -3.7 63 64 L G E +D 72 0A 3 -2,-0.3 2,-0.3 -12,-0.3 9,-0.2 -0.988 20.7 153.7-133.4 143.6 18.9 -12.9 -1.1 64 65 L S E +D 71 0A 74 7,-2.0 7,-2.1 -2,-0.4 2,-0.1 -0.873 11.8 106.7-152.5-176.5 22.6 -13.2 -1.5 65 66 L G E -D 70 0A 34 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.388 34.2-144.0 120.6 165.9 25.9 -12.8 0.4 66 67 L S E > -D 69 0A 98 3,-1.6 3,-2.0 -2,-0.1 2,-0.2 -0.959 62.3 -0.2-159.4 157.9 28.6 -15.0 1.9 67 68 L G T 3 S- 0 0 25 -38,-0.3 -38,-1.5 -2,-0.3 -40,-0.1 -0.339 130.3 -13.3 61.5-119.6 30.8 -14.9 5.0 68 69 L T T 3 S+ 0 0 56 -2,-0.2 -43,-1.6 -40,-0.2 2,-0.4 0.204 123.8 75.0-102.3 14.0 30.1 -11.9 7.1 69 70 L S E < +CD 24 66A 66 -3,-2.0 -3,-1.6 -45,-0.2 2,-0.3 -0.985 50.3 163.0-134.3 126.1 28.0 -10.0 4.6 70 71 L Y E -CD 23 65A 9 -47,-2.1 -47,-3.0 -2,-0.4 2,-0.3 -0.990 11.9-168.4-138.9 144.3 24.5 -10.8 3.5 71 72 L S E -CD 22 64A 31 -7,-2.1 -7,-2.0 -2,-0.3 2,-0.4 -0.977 15.9-147.7-139.3 153.8 21.9 -8.7 1.7 72 73 L L E -CD 21 63A 0 -51,-2.1 -51,-2.6 -2,-0.3 2,-0.3 -0.954 22.0-172.1-117.4 132.4 18.2 -8.6 0.8 73 74 L T E -CD 20 62A 27 -11,-2.5 -11,-2.5 -2,-0.4 2,-0.5 -0.952 18.0-161.4-129.2 144.1 17.1 -7.0 -2.4 74 75 L I E -CD 19 61A 0 -55,-2.5 -55,-2.4 -2,-0.3 -13,-0.2 -0.971 10.1-157.7-123.0 106.7 13.7 -6.2 -3.9 75 76 L S S S+ 0 0 58 -15,-2.5 2,-0.4 -2,-0.5 -1,-0.2 0.931 84.9 15.7 -48.6 -53.3 14.0 -5.7 -7.6 76 77 L R S S- 0 0 149 -16,-0.2 -1,-0.2 -58,-0.1 2,-0.2 -0.995 84.8-133.1-128.5 123.4 10.8 -3.6 -7.8 77 78 L M - 0 0 3 -60,-1.4 -61,-2.7 -2,-0.4 2,-0.3 -0.505 19.6-167.6 -76.8 142.8 9.3 -2.1 -4.6 78 79 L E > - 0 0 77 -63,-0.2 3,-2.5 -2,-0.2 4,-0.2 -0.944 34.5-114.2-127.7 150.9 5.5 -2.5 -3.9 79 80 L A G > S+ 0 0 48 -2,-0.3 3,-2.3 1,-0.3 -1,-0.1 0.936 115.9 61.0 -48.0 -49.0 3.5 -0.7 -1.3 80 81 L E G 3 S+ 0 0 87 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.400 89.0 73.1 -62.7 5.4 2.9 -4.0 0.4 81 82 L D G < + 0 0 2 -3,-2.5 2,-0.6 2,-0.0 -1,-0.3 0.500 64.6 115.1 -97.5 -4.3 6.6 -4.4 1.0 82 83 L A < + 0 0 27 -3,-2.3 2,-0.3 -4,-0.2 22,-0.2 -0.544 49.0 97.5 -69.3 112.7 6.7 -1.7 3.7 83 84 L A E S- I 0 103B 5 -2,-0.6 20,-2.8 20,-0.6 2,-0.4 -0.968 76.0 -76.0-175.6-179.0 7.7 -3.6 6.9 84 85 L T E -FI 37 102B 20 -47,-2.1 -47,-3.1 -2,-0.3 2,-0.4 -0.803 40.2-157.3 -99.5 139.6 10.5 -4.5 9.2 85 86 L Y E -FI 36 101B 0 16,-2.1 16,-1.4 -2,-0.4 2,-0.4 -0.964 4.8-163.7-120.9 134.0 12.9 -7.2 8.0 86 87 L Y E -F 35 0B 18 -51,-2.0 -51,-2.3 -2,-0.4 2,-0.4 -0.904 8.0-148.8-117.1 143.0 15.1 -9.3 10.3 87 88 L a E -F 34 0B 0 -2,-0.4 11,-1.4 -53,-0.2 2,-0.3 -0.861 19.2-175.4-106.8 147.6 18.1 -11.4 9.4 88 89 L Q E -FJ 33 97B 0 -55,-2.9 -55,-3.0 -2,-0.4 2,-0.3 -0.986 5.5-169.7-141.5 147.2 18.8 -14.6 11.5 89 90 L Q E + J 0 96B 0 7,-1.8 7,-0.9 -2,-0.3 -57,-0.1 -0.909 16.4 179.3-136.0 166.4 21.6 -17.1 11.5 90 91 L W + 0 0 82 -59,-0.4 3,-0.4 -2,-0.3 5,-0.1 0.395 52.2 98.4-146.4 4.2 22.3 -20.5 13.1 91 92 L S S S+ 0 0 29 1,-0.3 2,-2.4 -60,-0.2 -62,-0.1 0.934 94.7 19.0 -63.4-100.9 25.8 -21.8 12.0 92 93 L T S S- 0 0 77 -64,-0.3 -90,-0.3 -65,-0.1 -1,-0.3 -0.500 119.5-155.4 -68.7 82.4 28.5 -21.1 14.6 93 94 L Y S S+ 0 0 50 -2,-2.4 2,-0.3 -3,-0.4 -3,-0.1 -0.896 84.1 123.8-136.7 157.0 25.8 -20.7 17.2 94 95 L P S S- 0 0 42 0, 0.0 -92,-0.4 0, 0.0 -3,-0.1 -0.788 84.2-103.0 -73.0 129.5 23.6 -20.0 19.8 95 96 L L - 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