==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 09-MAY-05 1ZLU . COMPND 2 MOLECULE: FAB 2G12, LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.A.CALARESE,H.-K.LEE,M.D.BEST,R.D.ASTRONOMO,R.L.STANFIELD, . 853 7 8 7 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37322.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 548 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 334 39.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.8 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 . 81 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 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 . 1 0 0 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 0 0 PARALLEL BRIDGES PER LADDER . 9 10 10 6 9 12 4 1 3 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 . 0 1 7 2 0 3 2 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 2 L V 0 0 73 0, 0.0 2,-0.4 0, 0.0 88,-0.1 0.000 360.0 360.0 360.0 103.4 27.0 5.7 -59.0 2 3 L V - 0 0 101 2,-0.0 23,-3.3 94,-0.0 2,-0.4 -0.780 360.0-157.4-100.7 142.9 26.0 8.9 -57.2 3 4 L M E -A 24 0A 8 -2,-0.4 2,-0.5 94,-0.3 21,-0.2 -0.964 7.4-169.1-119.5 128.2 22.6 10.5 -57.8 4 5 L T E -A 23 0A 77 19,-2.6 19,-1.9 -2,-0.4 94,-0.1 -0.890 3.9-161.3-130.5 100.0 22.0 14.2 -57.1 5 6 L Q E -A 22 0A 7 -2,-0.5 17,-0.2 17,-0.2 94,-0.1 -0.291 20.2-129.4 -63.1 159.3 18.7 15.8 -57.0 6 7 L S E S+A 21 0A 59 15,-1.6 15,-2.1 2,-0.1 2,-0.2 -0.874 74.0 25.1-167.5 142.8 18.2 19.7 -57.3 7 8 L P - 0 0 49 0, 0.0 3,-0.2 0, 0.0 -1,-0.0 0.626 63.8-157.9 -68.1-168.7 16.9 21.8 -56.0 8 9 L S S S+ 0 0 67 1,-0.4 94,-2.9 -2,-0.2 2,-0.4 0.705 85.4 29.3-101.5 -34.6 16.6 20.4 -52.4 9 10 L T E S-d 102 0B 52 92,-0.2 2,-0.5 75,-0.0 -1,-0.4 -0.998 70.8-171.2-128.3 123.6 13.7 22.7 -51.5 10 11 L L E -d 103 0B 21 92,-2.3 94,-2.4 -2,-0.4 2,-0.5 -0.977 8.9-158.7-115.8 124.9 11.4 24.0 -54.2 11 12 L S E +d 104 0B 34 -2,-0.5 2,-0.3 92,-0.2 94,-0.2 -0.935 30.9 132.6-110.0 126.7 9.0 26.6 -53.1 12 13 L A E -d 105 0B 3 92,-2.3 94,-3.0 -2,-0.5 2,-0.3 -0.875 41.1-108.5-156.8-169.8 5.9 27.1 -55.1 13 14 L S > - 0 0 49 -2,-0.3 3,-1.6 92,-0.2 64,-0.5 -0.819 41.1 -80.8-127.9 161.8 2.1 27.6 -55.1 14 15 L V T 3 S+ 0 0 92 -2,-0.3 64,-0.2 1,-0.2 3,-0.1 -0.397 117.4 32.9 -53.8 138.5 -1.0 25.7 -55.9 15 16 L G T 3 S+ 0 0 58 62,-2.5 -1,-0.2 1,-0.3 2,-0.2 0.335 93.0 124.2 97.6 -4.3 -1.5 26.1 -59.6 16 17 L D < - 0 0 60 -3,-1.6 60,-2.3 61,-0.1 61,-0.6 -0.527 56.6-132.8 -94.3 154.4 2.2 26.1 -60.7 17 18 L T E + B 0 75A 93 58,-0.3 2,-0.3 -2,-0.2 58,-0.3 -0.884 36.0 168.5 -99.0 133.2 4.2 24.1 -63.0 18 19 L I E - B 0 74A 22 56,-2.6 56,-2.3 -2,-0.5 2,-0.4 -0.973 20.6-155.3-143.3 157.7 7.5 22.8 -61.6 19 20 L T E - B 0 73A 72 -2,-0.3 2,-0.4 54,-0.2 54,-0.2 -0.998 6.0-150.8-136.5 136.9 10.2 20.4 -62.4 20 21 L I E - B 0 72A 0 52,-2.7 52,-2.0 -2,-0.4 2,-0.2 -0.930 15.7-144.4-107.0 126.7 12.8 18.5 -60.3 21 22 L T E -AB 6 71A 48 -15,-2.1 -15,-1.6 -2,-0.4 2,-0.3 -0.614 12.7-172.2 -81.7 150.2 16.2 17.6 -61.8 22 23 L a E -AB 5 70A 0 48,-1.9 48,-1.8 -2,-0.2 2,-0.4 -0.925 9.4-162.4-138.7 114.3 17.9 14.4 -60.9 23 24 L R E -AB 4 69A 105 -19,-1.9 -19,-2.6 -2,-0.3 2,-0.5 -0.834 6.1-148.7 -98.2 142.7 21.5 14.0 -62.2 24 25 L A E -A 3 0A 2 44,-3.0 -21,-0.2 -2,-0.4 4,-0.1 -0.923 14.5-137.1-109.9 129.5 23.4 10.7 -62.4 25 26 L S S S+ 0 0 68 -23,-3.3 2,-0.3 -2,-0.5 -1,-0.1 0.876 92.1 5.8 -51.1 -46.8 27.2 10.5 -62.0 26 27 L Q S S- 0 0 98 -24,-0.2 2,-0.1 41,-0.1 0, 0.0 -0.845 107.8 -61.2-123.3 179.3 27.4 8.0 -64.9 27 28 L S + 0 0 77 -2,-0.3 41,-0.2 1,-0.1 3,-0.1 -0.339 39.9 173.4 -59.3 125.4 24.8 6.7 -67.4 28 29 L I > - 0 0 7 39,-2.0 3,-2.8 1,-0.4 2,-0.2 -0.008 33.0-142.9-117.1 24.6 21.9 4.7 -66.0 29 30 L E T 3 - 0 0 127 1,-0.2 -1,-0.4 2,-0.1 38,-0.1 -0.314 67.7 -40.4 44.2-111.1 20.1 4.5 -69.2 30 31 L T T 3 S+ 0 0 47 36,-0.2 2,-1.4 -2,-0.2 -1,-0.2 0.012 97.8 124.5-131.3 32.8 16.5 4.8 -68.0 31 32 L W < + 0 0 74 -3,-2.8 59,-1.8 18,-0.1 2,-0.4 -0.421 42.4 118.5 -92.6 61.8 16.6 2.8 -64.8 32 33 L L E -E 89 0B 0 -2,-1.4 18,-3.1 57,-0.2 2,-0.3 -0.967 40.5-172.3-123.2 138.5 15.3 5.6 -62.7 33 34 L A E -E 88 0B 0 55,-3.1 55,-1.1 -2,-0.4 2,-0.3 -0.923 14.7-136.3-123.4 154.9 12.1 5.7 -60.6 34 35 L W E -EF 87 47B 0 13,-3.8 12,-2.7 -2,-0.3 13,-1.0 -0.880 19.1-170.7-111.5 155.3 10.4 8.6 -58.7 35 36 L Y E -EF 86 45B 0 51,-1.9 51,-2.2 -2,-0.3 2,-0.4 -0.996 13.3-150.1-145.8 145.2 8.8 8.5 -55.3 36 37 L Q E -EF 85 44B 14 8,-2.5 8,-3.3 -2,-0.3 2,-0.4 -0.907 13.5-174.4-113.7 142.8 6.8 10.7 -53.0 37 38 L Q E -E 84 0B 2 47,-1.9 47,-2.1 -2,-0.4 5,-0.1 -0.997 9.5-157.2-142.1 125.7 6.9 10.7 -49.2 38 39 L K > - 0 0 53 -2,-0.4 3,-3.0 4,-0.3 45,-0.1 -0.782 48.1 -74.9 -95.9 148.8 4.7 12.6 -46.8 39 40 L P T 3 S+ 0 0 66 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.134 119.1 1.9 -42.7 122.4 5.9 13.2 -43.2 40 41 L G T 3 S+ 0 0 72 1,-0.2 2,-0.2 -3,-0.0 -3,-0.0 0.534 112.9 106.9 69.7 9.9 5.7 10.1 -41.2 41 42 L K S < S- 0 0 144 -3,-3.0 -1,-0.2 1,-0.1 3,-0.0 -0.661 74.8 -96.9-113.7 169.1 4.5 8.0 -44.1 42 43 L A - 0 0 27 -2,-0.2 -4,-0.3 -3,-0.1 -6,-0.1 -0.547 46.8-102.9 -80.7 143.2 6.0 5.3 -46.4 43 44 L P - 0 0 4 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.455 35.5-147.6 -60.7 146.7 7.4 6.4 -49.7 44 45 L K E -F 36 0B 141 -8,-3.3 -8,-2.5 -2,-0.1 2,-0.2 -0.986 14.4-118.0-123.2 134.8 5.3 5.7 -52.7 45 46 L L E +F 35 0B 10 -2,-0.4 -10,-0.3 277,-0.3 3,-0.1 -0.416 36.9 166.1 -56.8 118.6 6.4 4.8 -56.2 46 47 L L E + 0 0 10 -12,-2.7 8,-2.0 1,-0.4 2,-0.4 0.816 63.1 8.9 -99.8 -60.9 5.1 7.4 -58.6 47 48 L I E -FG 34 53B 0 -13,-1.0 -13,-3.8 6,-0.2 -1,-0.4 -0.948 65.2-172.3-125.7 144.6 7.1 6.9 -61.9 48 49 L Y E >> + G 0 52B 58 4,-2.8 4,-3.0 -2,-0.4 3,-0.6 -0.956 64.9 30.2-139.7 161.7 9.4 4.2 -62.9 49 50 L K T 34 S- 0 0 93 -2,-0.3 2,-0.5 1,-0.3 -16,-0.2 0.745 125.5 -74.5 57.9 30.8 11.7 3.4 -65.8 50 51 L A T 34 S+ 0 0 2 -18,-3.1 -1,-0.3 1,-0.2 21,-0.1 -0.078 127.7 24.9 79.3 -28.2 12.1 7.2 -65.9 51 52 L S T <4 S+ 0 0 69 -3,-0.6 2,-0.7 -2,-0.5 12,-0.2 0.489 83.2 108.1-147.7 7.6 8.7 7.8 -67.4 52 53 L T E < -G 48 0B 62 -4,-3.0 -4,-2.8 10,-0.1 2,-0.2 -0.803 56.9-143.3 -89.8 117.9 6.1 5.1 -66.8 53 54 L L E -G 47 0B 53 -2,-0.7 -6,-0.2 -6,-0.2 2,-0.1 -0.564 20.4-119.7 -72.8 143.1 3.4 6.3 -64.4 54 55 L K > - 0 0 86 -8,-2.0 3,-1.3 -2,-0.2 -1,-0.1 -0.386 45.3 -74.6 -79.8 157.0 2.1 3.6 -62.0 55 56 L T T 3 S+ 0 0 138 1,-0.2 -1,-0.1 -2,-0.1 0, 0.0 -0.338 120.4 18.1 -59.6 129.5 -1.7 2.7 -62.0 56 57 L G T 3 S+ 0 0 73 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.760 85.1 134.3 78.9 28.9 -3.6 5.5 -60.3 57 58 L V < - 0 0 25 -3,-1.3 -1,-0.3 -11,-0.1 -4,-0.1 -0.937 60.9-115.8-102.7 135.0 -1.1 8.3 -60.4 58 59 L P > - 0 0 53 0, 0.0 3,-0.9 0, 0.0 -3,-0.0 -0.383 21.8-129.1 -61.2 147.6 -2.6 11.6 -61.6 59 60 L S T 3 S+ 0 0 101 1,-0.3 16,-0.1 -6,-0.0 -6,-0.0 0.225 93.3 92.2 -95.1 6.8 -1.0 12.7 -64.9 60 61 L R T 3 S+ 0 0 57 14,-0.1 15,-2.3 16,-0.1 -1,-0.3 0.585 86.7 75.5 -63.1 -13.9 -0.1 16.2 -63.8 61 62 L F E < +C 74 0A 5 -3,-0.9 2,-0.2 13,-0.2 13,-0.2 -0.635 60.8 148.3 -88.6 158.5 3.0 14.0 -63.1 62 63 L S E -C 73 0A 49 11,-0.5 11,-2.4 -2,-0.2 2,-0.3 -0.753 28.5-140.1 174.9 149.6 5.5 12.7 -65.6 63 64 L G E +C 72 0A 12 -12,-0.2 2,-0.3 -2,-0.2 9,-0.2 -0.698 17.7 169.3-110.9 156.4 9.2 11.8 -66.2 64 65 L S E +C 71 0A 68 7,-1.3 7,-1.3 -2,-0.3 2,-0.1 -0.864 30.5 83.6-149.8 177.2 11.6 12.2 -69.0 65 66 L G E -C 70 0A 30 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.202 36.3-162.2 109.4 158.6 15.4 11.7 -69.3 66 67 L S E > +C 69 0A 72 3,-1.0 3,-1.1 -2,-0.1 -36,-0.2 -0.859 62.1 17.8-156.5-162.6 18.1 9.0 -69.9 67 68 L G T 3 S- 0 0 20 -2,-0.2 -39,-2.0 1,-0.2 -41,-0.1 -0.033 131.5 -16.9 30.5 -96.4 21.8 8.5 -69.4 68 69 L T T 3 S+ 0 0 54 -41,-0.2 -44,-3.0 1,-0.1 2,-0.4 0.681 121.2 66.1-116.9 -19.3 22.7 11.2 -66.9 69 70 L E E < +BC 23 66A 117 -3,-1.1 -3,-1.0 -46,-0.2 2,-0.4 -0.930 53.5 171.7-112.4 131.3 19.9 13.9 -66.8 70 71 L F E -BC 22 65A 0 -48,-1.8 -48,-1.9 -2,-0.4 2,-0.4 -0.992 10.0-164.0-136.3 135.8 16.3 13.2 -65.5 71 72 L T E -BC 21 64A 39 -7,-1.3 -7,-1.3 -2,-0.4 2,-0.4 -0.926 10.2-161.2-122.1 148.1 13.3 15.4 -64.7 72 73 L L E -BC 20 63A 1 -52,-2.0 -52,-2.7 -2,-0.4 2,-0.5 -0.991 18.0-165.6-117.1 132.5 10.0 15.0 -62.8 73 74 L T E -BC 19 62A 28 -11,-2.4 2,-0.6 -2,-0.4 -11,-0.5 -0.983 15.6-172.9-127.7 124.2 7.4 17.5 -63.7 74 75 L I E -BC 18 61A 0 -56,-2.3 -56,-2.6 -2,-0.5 2,-0.9 -0.982 14.1-161.1-108.7 109.8 4.2 18.3 -61.8 75 76 L S E S+B 17 0A 58 -15,-2.3 -58,-0.3 -2,-0.6 -59,-0.1 -0.879 73.6 9.8 -95.2 103.7 2.2 20.7 -64.0 76 77 L G S S- 0 0 25 -60,-2.3 2,-0.3 -2,-0.9 -1,-0.2 0.799 84.3-133.9 94.7 95.2 -0.3 22.4 -61.7 77 78 L L - 0 0 2 -61,-0.6 -62,-2.5 -64,-0.5 2,-0.4 -0.623 16.2-160.5 -78.9 139.3 0.4 21.7 -58.0 78 79 L Q >> - 0 0 103 -2,-0.3 3,-1.8 -64,-0.2 4,-0.7 -0.898 38.5-103.0-108.8 148.9 -2.5 20.7 -55.8 79 80 L F G >4 S+ 0 0 143 -2,-0.4 3,-0.7 1,-0.3 26,-0.0 0.780 121.1 61.7 -34.9 -39.0 -2.1 21.0 -52.0 80 81 L D G 34 S+ 0 0 89 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.873 91.5 61.8 -64.1 -38.5 -1.6 17.2 -52.0 81 82 L D G <4 S+ 0 0 1 -3,-1.8 2,-0.6 2,-0.1 -1,-0.2 0.768 72.5 111.3 -63.4 -22.6 1.6 17.2 -54.1 82 83 L F << + 0 0 26 -3,-0.7 2,-0.2 -4,-0.7 22,-0.1 -0.378 57.8 94.4 -57.2 106.3 3.4 19.3 -51.5 83 84 L A S S- 0 0 6 -2,-0.6 20,-2.6 20,-0.2 2,-0.5 -0.847 79.5 -62.1-171.2-171.8 5.7 16.6 -50.3 84 85 L T E -EH 37 102B 15 -47,-2.1 -47,-1.9 -2,-0.2 2,-0.5 -0.912 36.5-159.8-104.7 135.8 9.1 15.1 -50.7 85 86 L Y E -EH 36 101B 0 16,-2.6 16,-1.1 -2,-0.5 2,-0.4 -0.961 7.2-172.7-112.1 118.6 10.3 13.6 -54.0 86 87 L H E -E 35 0B 0 -51,-2.2 -51,-1.9 -2,-0.5 2,-0.2 -0.934 12.0-149.1-100.3 136.0 13.2 11.1 -54.0 87 88 L a E -E 34 0B 0 -2,-0.4 11,-1.1 -53,-0.2 2,-0.3 -0.578 16.3-163.3 -96.9 160.4 14.7 9.9 -57.3 88 89 L Q E -EI 33 97B 0 -55,-1.1 -55,-3.1 9,-0.2 2,-0.5 -0.896 21.0-151.2-153.5 118.8 16.2 6.4 -57.3 89 90 L H E -EI 32 96B 23 7,-2.3 7,-2.5 -2,-0.3 2,-0.4 -0.859 29.5-162.8 -82.0 127.9 18.5 4.6 -59.7 90 91 L Y E + I 0 95B 2 -59,-1.8 2,-0.2 -2,-0.5 5,-0.2 -0.969 12.3 175.9-129.1 129.0 17.4 0.9 -59.3 91 92 L A - 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