==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNOGLOBULIN 06-FEB-96 1UCB . COMPND 2 MOLECULE: CHIMERIC HUMAN/MOUSE IGG FAB FRAGMENT BR96; . SOURCE 2 FRAGMENT: CL AND CH1; . AUTHOR S.SHERIFF,J.BAJORATH . 435 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19635.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 298 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 171 39.3 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 . 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 . 1 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 . 58 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 3.7 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 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 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 . 2 6 6 1 5 7 2 0 2 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 4 0 2 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 4 L M 0 0 67 0, 0.0 2,-0.4 0, 0.0 21,-0.2 0.000 360.0 360.0 360.0 142.6 60.4 58.1 20.5 2 5 L T E -A 21 0A 79 19,-2.2 19,-2.4 99,-0.1 2,-0.5 -0.920 360.0-160.8-112.2 135.1 58.3 55.7 18.3 3 6 L Q E -A 20 0A 5 -2,-0.4 17,-0.2 17,-0.2 15,-0.0 -0.967 21.3-132.9-117.3 120.3 54.8 54.5 19.1 4 7 L I E S+A 19 0A 76 15,-2.6 15,-3.1 -2,-0.5 2,-0.1 -0.981 70.4 22.5-127.9 139.5 53.5 51.4 17.3 5 8 L P - 0 0 43 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.649 55.7-161.8 -92.0 179.1 51.0 50.8 15.9 6 9 L V S S+ 0 0 99 1,-0.3 99,-3.2 98,-0.2 2,-0.4 0.904 86.5 22.0 -81.2 -42.8 49.2 53.9 14.8 7 10 L S E -d 105 0B 76 97,-0.2 -1,-0.3 2,-0.0 99,-0.2 -0.982 66.3-169.7-126.2 133.8 45.9 52.1 14.4 8 11 L L E -d 106 0B 33 97,-3.0 99,-1.7 -2,-0.4 2,-0.7 -0.812 3.0-170.7-127.5 86.9 45.0 48.9 16.2 9 12 L P E +d 107 0B 63 0, 0.0 2,-0.3 0, 0.0 99,-0.2 -0.726 22.3 168.1 -78.2 115.8 41.8 47.3 14.8 10 13 L V E -d 108 0B 4 97,-3.5 99,-1.9 -2,-0.7 2,-0.2 -0.928 29.6-126.9-132.2 153.8 41.0 44.5 17.2 11 14 L S > - 0 0 45 -2,-0.3 3,-1.1 97,-0.2 69,-0.3 -0.497 42.5 -83.2 -93.2 166.9 38.0 42.2 17.9 12 15 L L T 3 S+ 0 0 109 97,-0.4 69,-0.2 1,-0.2 -1,-0.1 -0.479 116.9 19.1 -69.4 139.9 36.3 41.5 21.2 13 16 L G T 3 S+ 0 0 46 67,-2.4 66,-0.3 1,-0.3 -1,-0.2 0.143 100.1 121.6 87.0 -19.3 38.1 38.9 23.3 14 17 L D < - 0 0 73 -3,-1.1 66,-2.7 65,-0.2 2,-0.3 -0.163 64.2-113.0 -71.4 166.0 41.3 39.4 21.3 15 18 L Q - 0 0 156 64,-0.2 2,-0.3 63,-0.2 63,-0.2 -0.786 29.9-165.3-102.6 149.5 44.7 40.4 22.7 16 19 L A E - B 0 77A 9 61,-2.8 61,-2.9 -2,-0.3 2,-0.4 -0.965 7.6-167.4-135.9 152.0 46.3 43.8 22.0 17 20 L S E - B 0 76A 61 -2,-0.3 2,-0.4 59,-0.2 59,-0.2 -0.989 1.0-171.9-145.0 127.6 49.8 45.2 22.4 18 21 L I E - B 0 75A 0 57,-2.5 57,-3.1 -2,-0.4 2,-0.4 -0.978 13.2-165.8-118.5 133.8 51.1 48.8 22.1 19 22 L S E -AB 4 74A 25 -15,-3.1 -15,-2.6 -2,-0.4 2,-0.4 -0.919 15.7-165.3-129.0 149.3 54.8 49.8 22.2 20 23 L a E -AB 3 73A 0 53,-2.3 53,-2.0 -2,-0.4 2,-0.5 -0.996 11.4-164.5-128.1 128.4 57.0 52.8 22.6 21 24 L R E -AB 2 72A 118 -19,-2.4 -19,-2.2 -2,-0.4 51,-0.2 -0.967 3.0-159.8-119.5 123.5 60.7 52.8 21.7 22 25 L S - 0 0 13 49,-2.8 4,-0.1 -2,-0.5 49,-0.0 -0.434 24.9-129.5 -92.5 169.1 63.1 55.4 22.9 23 26 L S S S+ 0 0 102 -2,-0.1 2,-0.2 2,-0.1 -1,-0.1 0.605 95.1 56.6 -88.7 -16.2 66.5 56.2 21.3 24 27 L Q S S- 0 0 91 47,-0.1 2,-1.1 46,-0.1 -2,-0.3 -0.693 102.0 -96.9-112.6 163.3 68.0 55.9 24.7 25 27AL I + 0 0 107 -2,-0.2 46,-0.3 1,-0.2 45,-0.1 -0.739 54.4 161.2 -80.6 105.7 68.0 53.2 27.3 26 27BL I + 0 0 3 44,-1.8 2,-0.4 -2,-1.1 -1,-0.2 0.808 42.3 85.2 -96.5 -37.0 65.1 54.5 29.4 27 27CL V + 0 0 16 43,-3.1 2,-0.3 -3,-0.2 43,-0.3 -0.526 46.9 173.8 -76.5 126.7 64.1 51.4 31.3 28 27DL H > - 0 0 105 -2,-0.4 3,-1.9 41,-0.1 5,-0.1 -0.701 15.5-158.7-134.0 80.4 66.0 50.7 34.5 29 27EL N T 3 S+ 0 0 142 -2,-0.3 3,-0.1 1,-0.3 40,-0.0 -0.290 85.5 24.4 -57.4 143.3 64.5 47.7 36.5 30 28 L N T 3 S+ 0 0 159 1,-0.3 -1,-0.3 0, 0.0 -2,-0.0 0.028 120.4 69.0 84.9 -25.4 65.6 48.0 40.2 31 29 L G S < S- 0 0 46 -3,-1.9 -1,-0.3 0, 0.0 2,-0.2 0.444 102.5 -95.1 -88.0-126.1 66.0 51.7 39.7 32 30 L N - 0 0 82 -3,-0.1 2,-0.4 2,-0.0 -3,-0.1 -0.633 37.8-174.7-163.8 95.7 62.9 53.8 39.1 33 31 L T - 0 0 12 -2,-0.2 2,-1.3 19,-0.1 61,-0.1 -0.823 19.3-146.4-101.2 132.8 61.6 54.6 35.7 34 32 L Y + 0 0 81 -2,-0.4 59,-3.0 18,-0.2 2,-0.5 -0.696 40.8 149.1 -96.9 77.6 58.6 56.9 35.1 35 33 L L E -E 92 0B 0 -2,-1.3 18,-2.8 57,-0.2 2,-0.3 -0.979 23.7-179.7-112.3 120.9 57.2 55.3 32.0 36 34 L E E -E 91 0B 0 55,-2.5 55,-2.8 -2,-0.5 2,-0.4 -0.865 23.6-146.3-126.9 161.4 53.4 55.7 31.8 37 35 L W E -EF 90 50B 0 13,-2.0 12,-2.8 -2,-0.3 13,-1.0 -0.986 15.4-168.9-128.3 133.7 50.4 54.9 29.7 38 36 L Y E -EF 89 48B 0 51,-3.0 51,-2.3 -2,-0.4 2,-0.4 -0.901 8.7-154.6-123.1 150.4 47.2 57.0 29.2 39 37 L L E -EF 88 47B 4 8,-2.3 8,-2.4 -2,-0.3 2,-0.5 -0.990 5.8-169.1-123.6 132.7 43.8 56.3 27.7 40 38 L Q E -E 87 0B 18 47,-2.1 47,-2.2 -2,-0.4 3,-0.1 -0.961 8.9-158.6-126.1 109.5 41.7 59.0 26.3 41 39 L K > - 0 0 47 -2,-0.5 3,-0.7 4,-0.4 45,-0.2 -0.583 46.9 -66.4 -82.7 152.3 38.1 58.0 25.4 42 40 L P T 3 S- 0 0 57 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.051 119.8 -2.2 -41.3 124.7 36.1 60.1 22.9 43 41 L G T 3 S+ 0 0 86 1,-0.2 2,-0.3 -3,-0.1 -2,-0.0 0.936 111.6 106.5 54.0 54.7 35.4 63.5 24.3 44 42 L Q S < S- 0 0 102 -3,-0.7 -1,-0.2 3,-0.0 3,-0.1 -0.960 74.7 -98.7-153.1 159.1 37.1 62.9 27.7 45 43 L S - 0 0 38 -2,-0.3 -4,-0.4 1,-0.1 283,-0.1 -0.440 54.8 -86.8 -79.5 156.1 40.3 64.0 29.3 46 44 L P - 0 0 2 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.305 45.7-149.5 -61.1 151.0 43.2 61.5 29.3 47 45 L Q E -F 39 0B 62 -8,-2.4 -8,-2.3 -3,-0.1 2,-0.5 -0.964 15.7-111.7-127.2 145.4 43.3 58.9 32.1 48 46 L L E +F 38 0B 6 276,-0.5 -10,-0.2 -2,-0.4 12,-0.1 -0.621 37.1 164.6 -76.1 121.8 46.1 57.1 33.8 49 47 L L E + 0 0 3 -12,-2.8 8,-2.4 -2,-0.5 2,-0.3 0.868 65.5 4.7 -98.3 -57.2 46.3 53.4 33.1 50 48 L I E -FG 37 56B 0 -13,-1.0 -13,-2.0 6,-0.2 -1,-0.4 -0.972 60.7-169.5-135.2 142.6 49.8 52.3 34.3 51 49 L Y E >> + G 0 55B 21 4,-2.6 4,-2.6 -2,-0.3 3,-0.6 -0.931 68.7 24.3-130.7 156.6 52.7 54.1 36.0 52 50 L K T 34 S- 0 0 45 268,-0.4 2,-1.8 -2,-0.3 -1,-0.2 0.903 124.8 -71.1 55.0 45.3 56.3 53.1 36.7 53 51 L V T 34 S+ 0 0 12 -18,-2.8 -1,-0.3 1,-0.2 21,-0.1 -0.120 129.1 21.7 68.7 -36.3 56.3 50.8 33.7 54 52 L S T <4 S+ 0 0 68 -2,-1.8 2,-0.4 -3,-0.6 12,-0.3 0.396 86.5 108.8-143.5 5.4 54.0 48.2 35.3 55 53 L N E < -G 51 0B 63 -4,-2.6 -4,-2.6 10,-0.1 2,-0.3 -0.728 58.1-136.8 -89.6 137.9 51.9 49.5 38.2 56 54 L R E -G 50 0B 104 -2,-0.4 -6,-0.2 -6,-0.2 2,-0.2 -0.727 15.6-123.0 -93.8 142.6 48.2 49.8 37.5 57 55 L F > - 0 0 28 -8,-2.4 3,-1.6 -2,-0.3 -1,-0.0 -0.505 47.0 -78.6 -77.5 154.0 46.3 52.9 38.7 58 56 L S T 3 S+ 0 0 93 1,-0.2 -1,-0.2 -2,-0.2 2,-0.2 -0.166 118.6 20.4 -54.2 141.0 43.3 52.3 41.0 59 57 L G T 3 S+ 0 0 82 1,-0.3 -1,-0.2 -3,-0.1 -10,-0.0 -0.068 89.3 127.2 91.9 -36.4 40.2 51.2 39.1 60 58 L V < - 0 0 22 -3,-1.6 -1,-0.3 -2,-0.2 -4,-0.1 -0.392 64.8-114.8 -61.4 124.5 42.2 49.9 36.1 61 59 L P > - 0 0 55 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.245 16.2-118.7 -60.6 145.5 41.3 46.3 35.3 62 60 L D T 3 S+ 0 0 121 1,-0.3 16,-0.1 -6,-0.0 -2,-0.1 0.507 104.4 85.4 -63.9 -6.0 43.9 43.5 35.6 63 61 L R T 3 S+ 0 0 12 14,-0.1 15,-2.6 16,-0.1 2,-0.4 0.649 80.0 79.1 -66.8 -18.5 43.4 42.9 31.8 64 62 L F E < +C 77 0A 4 -3,-2.1 2,-0.3 13,-0.2 13,-0.2 -0.818 59.9 165.0 -94.9 132.1 46.0 45.7 31.5 65 63 L S E -C 76 0A 47 11,-2.3 11,-3.5 -2,-0.4 2,-0.3 -0.981 15.7-161.5-144.3 152.2 49.6 44.9 32.0 66 64 L G E +C 75 0A 10 -2,-0.3 2,-0.3 -12,-0.3 9,-0.2 -0.991 13.7 163.1-138.2 146.5 52.9 46.7 31.3 67 65 L S E -C 74 0A 57 7,-1.7 7,-2.9 -2,-0.3 2,-0.3 -0.900 10.5-168.9-148.4 172.9 56.5 45.6 31.0 68 66 L G E -C 73 0A 32 -2,-0.3 2,-0.3 5,-0.3 5,-0.3 -0.978 15.4-159.3-168.9 155.5 59.7 47.0 29.5 69 67 L S E > -C 72 0A 98 3,-2.7 3,-2.7 -2,-0.3 2,-0.8 -0.900 59.2 -68.3-145.2 113.0 63.3 46.3 28.6 70 68 L G T 3 S+ 0 0 18 -2,-0.3 -43,-3.1 1,-0.3 -44,-1.8 -0.224 128.2 15.2 50.2 -91.3 65.9 49.0 28.1 71 69 L T T 3 S+ 0 0 35 -2,-0.8 -49,-2.8 -46,-0.3 2,-0.3 0.682 123.3 62.9 -88.2 -16.6 64.8 50.9 25.0 72 70 L D E < -BC 21 69A 38 -3,-2.7 -3,-2.7 -51,-0.2 2,-0.4 -0.841 49.6-179.2-117.1 143.3 61.2 49.5 24.9 73 71 L F E -BC 20 68A 0 -53,-2.0 -53,-2.3 -2,-0.3 2,-0.3 -0.996 17.5-165.1-136.6 132.9 58.2 49.7 27.1 74 72 L T E -BC 19 67A 22 -7,-2.9 -7,-1.7 -2,-0.4 2,-0.5 -0.913 18.2-147.0-124.0 152.3 54.9 47.9 26.2 75 73 L L E -BC 18 66A 0 -57,-3.1 -57,-2.5 -2,-0.3 2,-0.5 -0.967 18.4-164.0-116.4 124.9 51.2 47.9 27.2 76 74 L K E -BC 17 65A 62 -11,-3.5 -11,-2.3 -2,-0.5 2,-0.5 -0.925 6.5-168.4-112.6 130.4 49.5 44.5 26.9 77 75 L I E -BC 16 64A 1 -61,-2.9 -61,-2.8 -2,-0.5 2,-0.5 -0.982 8.8-160.0-116.3 111.7 45.7 44.2 26.9 78 76 L S S S+ 0 0 66 -15,-2.6 -63,-0.2 -2,-0.5 -64,-0.1 -0.844 72.9 5.3 -91.6 130.1 44.5 40.7 27.4 79 77 L R S S- 0 0 117 -2,-0.5 -1,-0.3 -66,-0.3 -64,-0.2 0.977 85.3-132.4 61.5 87.2 40.9 40.2 26.2 80 78 L V - 0 0 0 -66,-2.7 -67,-2.4 -69,-0.3 2,-0.3 -0.361 21.1-161.2 -69.9 144.3 39.8 43.5 24.6 81 79 L E > - 0 0 59 -69,-0.2 3,-1.5 -68,-0.1 4,-0.1 -0.839 30.8-106.9-122.0 164.4 36.4 44.9 25.6 82 80 L A G > S+ 0 0 28 -2,-0.3 3,-1.4 1,-0.3 26,-0.1 0.881 115.8 56.2 -60.2 -42.8 34.1 47.4 23.9 83 81 L E G 3 S+ 0 0 97 1,-0.3 -1,-0.3 88,-0.1 87,-0.1 0.269 88.1 81.5 -76.8 14.8 34.8 50.3 26.4 84 82 L D G < + 0 0 6 -3,-1.5 -1,-0.3 86,-0.1 -2,-0.2 0.459 65.1 116.4 -95.5 -3.4 38.5 49.9 25.7 85 83 L L < + 0 0 7 -3,-1.4 2,-0.3 -4,-0.1 22,-0.1 -0.400 41.4 78.8 -70.8 143.1 38.2 52.0 22.5 86 84 L G E S- H 0 106B 8 20,-0.8 20,-2.8 -45,-0.2 2,-0.4 -0.963 83.1 -52.5 153.9-166.1 40.1 55.3 22.4 87 85 L V E -EH 40 105B 32 -47,-2.2 -47,-2.1 -2,-0.3 2,-0.4 -0.889 45.1-150.2-106.9 135.1 43.6 56.6 21.8 88 86 L Y E -EH 39 104B 0 16,-2.6 16,-1.8 -2,-0.4 2,-0.4 -0.871 13.7-173.4-105.9 139.8 46.5 55.3 23.9 89 87 L Y E -E 38 0B 3 -51,-2.3 -51,-3.0 -2,-0.4 2,-0.3 -0.997 13.0-150.9-134.7 135.9 49.5 57.4 24.7 90 88 L a E -E 37 0B 0 -2,-0.4 11,-3.1 -53,-0.2 2,-0.5 -0.770 11.9-154.1-102.5 146.0 52.8 56.5 26.4 91 89 L F E -EI 36 100B 0 -55,-2.8 -55,-2.5 -2,-0.3 2,-0.7 -0.986 4.5-155.5-122.1 131.6 54.6 59.1 28.4 92 90 L Q E +EI 35 99B 4 7,-3.3 7,-0.6 -2,-0.5 -57,-0.2 -0.915 25.6 161.0-105.9 101.7 58.3 59.0 28.9 93 91 L G + 0 0 3 -59,-3.0 -58,-0.1 -2,-0.7 3,-0.1 -0.125 56.4 66.2-116.6 40.4 59.0 61.0 32.1 94 92 L S S S+ 0 0 46 1,-0.3 2,-0.5 3,-0.1 4,-0.1 0.643 94.8 50.8-120.6 -41.9 62.5 59.8 33.3 95 93 L H S S- 0 0 73 2,-0.2 -1,-0.3 -61,-0.1 4,-0.3 -0.896 95.4 -97.0-108.7 123.6 64.8 61.1 30.6 96 94 L V S S+ 0 0 96 -2,-0.5 -3,-0.1 1,-0.1 2,-0.0 -0.622 108.4 59.8 -74.6 134.2 64.7 64.7 29.4 97 95 L P S S- 0 0 88 0, 0.0 2,-0.9 0, 0.0 -2,-0.2 0.362 85.1-150.1 -74.0 131.6 63.2 65.5 27.0 98 96 L F - 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