==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 24-JUL-01 1JNL . COMPND 2 MOLECULE: MONOCLONAL ANTI-ESTRADIOL 17E12E5 IMMUNOGLOBULIN . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR C.MONNET,F.BETTSWORTH,E.A.STURA,M.-H.LE DU,R.MENEZ, . 427 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19647.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 272 63.7 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 . 160 37.5 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 . 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 . 56 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 2.3 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 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 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 PARALLEL BRIDGES PER LADDER . 4 3 2 4 5 10 0 0 0 1 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 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 L Q 0 0 94 0, 0.0 2,-0.8 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0-176.4 56.4 41.4 37.0 2 2 L I - 0 0 17 93,-0.3 2,-0.5 91,-0.1 95,-0.4 -0.806 360.0-151.6 -92.9 112.1 54.8 43.8 34.6 3 3 L V - 0 0 87 -2,-0.8 23,-1.5 1,-0.0 2,-0.5 -0.692 6.0-140.6 -88.5 121.0 53.5 47.0 36.4 4 4 L M E -A 25 0A 11 -2,-0.5 2,-0.6 21,-0.2 96,-0.3 -0.668 13.3-164.1 -81.7 128.8 50.6 48.8 35.0 5 5 L T E -A 24 0A 64 19,-1.8 19,-3.1 -2,-0.5 2,-0.3 -0.945 12.0-164.1-116.2 107.9 50.9 52.5 35.3 6 6 L Q E -A 23 0A 22 -2,-0.6 17,-0.2 17,-0.2 3,-0.1 -0.742 7.9-125.6-101.7 147.5 47.6 54.3 34.8 7 7 L T E +A 22 0A 59 15,-2.8 15,-2.5 -2,-0.3 2,-0.1 -0.992 66.7 20.1-153.1 152.0 46.8 58.0 34.0 8 8 L P - 0 0 45 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.637 58.0-156.9 -87.1 161.7 45.3 60.5 34.7 9 9 L A S S+ 0 0 75 1,-0.2 94,-2.8 93,-0.2 2,-0.4 0.952 79.7 18.9 -64.2 -51.1 44.5 59.9 38.4 10 10 L S E S-d 103 0B 96 92,-0.2 2,-0.3 94,-0.0 94,-0.2 -0.973 73.9-174.0-124.9 142.0 41.5 62.3 38.6 11 11 L L E -d 104 0B 42 92,-3.3 94,-3.6 -2,-0.4 2,-0.4 -0.994 13.9-170.9-142.2 138.8 39.5 63.6 35.6 12 12 L S E +d 105 0B 73 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.995 22.8 148.7-129.8 125.1 36.6 66.1 34.9 13 13 L A E -d 106 0B 5 92,-1.3 94,-4.0 -2,-0.4 2,-0.1 -0.965 35.1-117.8-149.3 160.4 34.9 66.4 31.5 14 14 L S E > -d 107 0B 35 -2,-0.3 3,-1.4 92,-0.2 64,-0.3 -0.468 39.9 -78.6-102.0 172.7 31.5 67.3 30.3 15 15 L V T 3 S+ 0 0 77 92,-0.7 64,-0.2 1,-0.2 -1,-0.1 -0.438 118.3 29.0 -62.3 138.3 28.7 65.5 28.4 16 16 L G T 3 S+ 0 0 49 62,-2.6 61,-0.5 1,-0.3 -1,-0.2 0.086 95.4 120.4 97.1 -24.2 29.6 65.4 24.6 17 17 L E < - 0 0 91 -3,-1.4 61,-2.7 60,-0.2 2,-0.5 -0.179 60.9-127.7 -75.8 162.4 33.3 65.5 25.2 18 18 L T - 0 0 74 58,-0.2 2,-0.3 59,-0.2 58,-0.3 -0.948 30.3-175.9-108.9 131.0 35.8 62.8 24.1 19 19 L V E - B 0 75A 12 56,-2.5 56,-3.0 -2,-0.5 2,-0.4 -0.865 13.2-157.6-126.0 166.0 38.2 61.5 26.8 20 20 L T E - B 0 74A 57 -2,-0.3 2,-0.5 54,-0.3 54,-0.3 -0.998 1.2-163.7-146.1 129.7 41.1 59.1 26.8 21 21 L I E - B 0 73A 0 52,-2.9 52,-2.9 -2,-0.4 2,-0.4 -0.982 18.1-154.8-114.6 128.0 42.5 57.1 29.7 22 22 L T E -AB 7 72A 34 -15,-2.5 -15,-2.8 -2,-0.5 2,-0.4 -0.905 12.1-169.3-111.8 144.3 45.9 55.7 29.2 23 23 L a E -AB 6 71A 0 48,-3.3 48,-2.1 -2,-0.4 2,-0.6 -0.995 5.3-163.5-127.8 126.8 47.6 52.7 30.7 24 24 L R E -AB 5 70A 120 -19,-3.1 -19,-1.8 -2,-0.4 2,-0.2 -0.942 9.4-149.4-118.3 111.2 51.4 52.1 30.3 25 25 L A E -A 4 0A 2 44,-2.3 -21,-0.2 -2,-0.6 4,-0.1 -0.567 15.6-134.5 -74.8 139.3 52.7 48.6 31.1 26 26 L S S S+ 0 0 78 -23,-1.5 2,-0.2 -2,-0.2 -1,-0.1 0.931 92.5 26.5 -59.4 -45.1 56.2 48.5 32.4 27 27 L G S S- 0 0 21 1,-0.1 -2,-0.1 42,-0.1 2,-0.0 -0.701 105.8 -79.4-114.6 166.4 56.9 45.6 30.0 28 28 L N - 0 0 55 -2,-0.2 41,-0.2 1,-0.1 -1,-0.1 -0.409 38.7-177.3 -64.4 139.8 55.4 44.6 26.7 29 29 L I > - 0 0 0 39,-1.5 3,-2.3 -4,-0.1 62,-0.2 0.264 32.7-131.2-122.4 9.9 52.1 42.7 27.2 30 30 L Y T 3 S- 0 0 131 38,-0.3 3,-0.1 1,-0.3 39,-0.1 0.857 71.6 -53.2 39.2 53.0 51.2 41.9 23.6 31 31 L N T 3 S+ 0 0 49 37,-0.3 2,-1.7 1,-0.2 -1,-0.3 0.574 95.2 139.5 64.1 15.7 47.6 43.2 23.9 32 32 L Y < + 0 0 100 -3,-2.3 59,-1.5 18,-0.2 2,-0.3 -0.672 39.3 118.4 -88.8 81.9 46.8 41.1 27.0 33 33 L L E -E 90 0B 0 -2,-1.7 18,-1.8 57,-0.2 2,-0.3 -0.967 40.9-170.5-144.7 158.3 44.8 44.0 28.6 34 34 L A E -E 89 0B 3 55,-1.8 55,-3.4 -2,-0.3 2,-0.4 -0.990 13.3-138.7-152.6 149.3 41.3 44.7 29.7 35 35 L W E -EF 88 48B 0 13,-2.4 12,-3.3 -2,-0.3 13,-0.9 -0.909 17.9-174.6-116.2 141.7 39.4 47.7 30.9 36 36 L Y E -EF 87 46B 13 51,-3.0 51,-1.2 -2,-0.4 2,-0.4 -0.825 17.0-151.0-128.2 164.6 36.9 48.0 33.7 37 37 L Q E -EF 86 45B 13 8,-1.7 8,-2.6 -2,-0.3 2,-0.6 -0.999 12.7-163.3-133.3 121.1 34.5 50.6 35.2 38 38 L Q E -E 85 0B 9 47,-2.1 47,-1.7 -2,-0.4 2,-0.4 -0.957 4.4-161.0-111.4 117.7 33.7 50.3 38.8 39 39 L K > - 0 0 29 -2,-0.6 3,-2.4 4,-0.3 45,-0.1 -0.777 44.1 -78.4 -92.0 144.4 30.7 52.2 39.9 40 40 L Q T 3 S+ 0 0 97 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 -0.109 115.2 3.1 -46.0 118.8 30.5 53.0 43.7 41 41 L G T 3 S+ 0 0 84 1,-0.3 -1,-0.3 -3,-0.0 2,-0.3 0.518 112.5 98.0 82.0 8.0 29.2 49.9 45.5 42 42 L K S < S- 0 0 111 -3,-2.4 -1,-0.3 1,-0.0 3,-0.1 -0.809 80.3 -91.1-124.9 164.3 29.1 47.6 42.5 43 43 L S - 0 0 29 -2,-0.3 -4,-0.3 1,-0.1 -6,-0.1 -0.469 55.4 -91.3 -73.3 144.9 31.4 44.9 41.0 44 44 L P - 0 0 6 0, 0.0 272,-0.4 0, 0.0 2,-0.4 -0.314 43.6-141.9 -55.7 135.9 33.9 46.1 38.3 45 45 L Q E -F 37 0B 64 -8,-2.6 -8,-1.7 270,-0.1 2,-0.3 -0.838 11.3-125.5-102.1 140.7 32.3 45.8 34.9 46 46 L L E +F 36 0B 41 -2,-0.4 -10,-0.2 -10,-0.2 3,-0.1 -0.699 29.8 172.8 -87.7 140.0 34.4 44.7 31.9 47 47 L L E + 0 0 8 -12,-3.3 8,-3.2 1,-0.4 2,-0.3 0.766 64.3 0.3-110.8 -47.9 34.4 47.0 28.9 48 48 L V E -FG 35 54B 1 -13,-0.9 -13,-2.4 6,-0.3 -1,-0.4 -0.997 58.0-165.4-150.6 143.0 37.0 45.6 26.6 49 49 L Y E > S+ G 0 53B 76 4,-1.8 4,-1.3 -2,-0.3 -15,-0.2 -0.644 70.5 31.8-118.0 173.8 39.4 42.7 26.5 50 50 L N T 4 S- 0 0 81 -17,-0.3 2,-2.5 1,-0.2 3,-0.3 0.844 120.4 -80.4 42.5 42.5 42.5 41.8 24.4 51 51 L A T 4 S+ 0 0 0 -18,-1.8 -1,-0.2 1,-0.2 21,-0.1 -0.332 123.8 30.0 68.6 -58.6 43.2 45.5 24.1 52 52 L K T 4 S+ 0 0 115 -2,-2.5 2,-0.6 -21,-0.1 12,-0.4 0.626 85.3 104.0-109.1 -15.1 40.7 46.4 21.3 53 53 L T E < -G 49 0B 69 -4,-1.3 -4,-1.8 -3,-0.3 2,-0.2 -0.588 59.6-144.6 -78.0 119.8 37.6 44.1 21.5 54 54 L L E -G 48 0B 45 -2,-0.6 -6,-0.3 -6,-0.2 2,-0.1 -0.564 22.6-113.8 -79.4 139.3 34.6 45.8 22.9 55 55 L V > - 0 0 24 -8,-3.2 3,-1.3 -2,-0.2 2,-0.1 -0.392 34.9 -98.5 -72.8 152.7 32.4 43.6 25.1 56 56 L D T 3 S+ 0 0 154 1,-0.2 -1,-0.1 -2,-0.1 0, 0.0 -0.449 109.3 27.5 -68.1 144.3 28.9 42.8 23.9 57 57 L G T 3 S+ 0 0 89 1,-0.3 -1,-0.2 -2,-0.1 -2,-0.1 0.510 93.8 115.4 82.5 3.5 26.2 45.0 25.5 58 58 L V S < S- 0 0 25 -3,-1.3 -1,-0.3 -11,-0.1 -11,-0.0 -0.918 74.7 -98.1-108.6 129.6 28.7 47.9 26.1 59 59 L P > - 0 0 43 0, 0.0 3,-1.7 0, 0.0 -4,-0.1 -0.025 21.4-122.5 -45.8 147.3 28.0 51.2 24.2 60 60 L L T 3 S+ 0 0 150 1,-0.3 16,-0.1 -6,-0.0 -6,-0.0 0.681 103.8 78.5 -67.9 -15.1 29.8 52.1 21.0 61 61 L R T 3 S+ 0 0 59 1,-0.1 15,-2.4 14,-0.1 2,-0.9 0.764 77.3 81.8 -66.5 -20.8 31.1 55.2 22.6 62 62 L F E < +C 75 0A 9 -3,-1.7 2,-0.4 13,-0.2 13,-0.2 -0.752 62.1 177.4 -90.3 105.1 33.8 53.2 24.4 63 63 L S E -C 74 0A 57 11,-2.9 11,-2.7 -2,-0.9 2,-0.4 -0.902 10.5-159.1-110.0 132.8 36.7 52.6 22.1 64 64 L G E +C 73 0A 13 -12,-0.4 2,-0.2 -2,-0.4 9,-0.2 -0.881 20.4 149.3-114.2 146.3 39.8 50.7 23.1 65 65 L S E +C 72 0A 44 7,-1.5 7,-1.6 -2,-0.4 2,-0.1 -0.869 3.3 117.5-154.1-172.3 43.3 50.8 21.6 66 66 L G E -C 71 0A 12 5,-0.3 2,-0.3 -2,-0.2 5,-0.3 -0.390 28.7-143.2 122.2 159.1 47.1 50.5 22.1 67 67 L S E > -C 70 0A 89 3,-2.1 3,-1.6 -2,-0.1 2,-0.8 -0.981 64.7 -7.5-155.9 144.0 50.2 48.5 21.1 68 68 L G T 3 S- 0 0 24 -2,-0.3 -39,-1.5 1,-0.3 -37,-0.3 -0.564 131.3 -19.1 75.4-109.5 53.4 47.4 22.9 69 69 L T T 3 S+ 0 0 55 -2,-0.8 -44,-2.3 -41,-0.2 2,-0.5 0.595 123.7 79.1-107.7 -16.0 53.5 49.1 26.2 70 70 L Q E < +BC 24 67A 75 -3,-1.6 -3,-2.1 -46,-0.2 2,-0.3 -0.829 50.0 158.0-101.2 128.2 51.0 51.9 25.5 71 71 L Y E -BC 23 66A 0 -48,-2.1 -48,-3.3 -2,-0.5 2,-0.3 -0.982 13.8-170.5-142.3 152.5 47.2 51.3 25.6 72 72 L S E -BC 22 65A 21 -7,-1.6 -7,-1.5 -2,-0.3 2,-0.3 -0.983 20.1-136.7-156.0 135.8 44.4 53.7 26.1 73 73 L L E -BC 21 64A 0 -52,-2.9 -52,-2.9 -2,-0.3 2,-0.4 -0.667 24.2-160.0 -84.9 142.4 40.6 53.8 26.6 74 74 L K E -BC 20 63A 78 -11,-2.7 -11,-2.9 -2,-0.3 2,-0.6 -0.991 10.5-167.9-130.6 126.6 38.7 56.3 24.6 75 75 L I E -BC 19 62A 0 -56,-3.0 -56,-2.5 -2,-0.4 3,-0.3 -0.922 10.4-167.1-115.6 101.4 35.3 57.6 25.4 76 76 L N S S+ 0 0 54 -15,-2.4 -58,-0.2 -2,-0.6 -59,-0.1 -0.660 71.8 9.0 -83.5 146.4 33.8 59.5 22.5 77 77 L S S S- 0 0 56 -61,-0.5 -1,-0.2 -2,-0.3 -59,-0.2 0.936 90.3-138.0 45.3 74.1 30.7 61.6 23.3 78 78 L L - 0 0 0 -61,-2.7 -62,-2.6 -3,-0.3 -61,-0.1 -0.298 17.2-157.2 -58.6 146.4 30.7 61.3 27.1 79 79 L Q > - 0 0 62 -64,-0.2 3,-2.0 -63,-0.1 4,-0.1 -0.886 30.1-103.8-127.8 153.5 27.4 60.7 28.8 80 80 L P G > S+ 0 0 21 0, 0.0 3,-0.7 0, 0.0 26,-0.1 0.687 116.8 57.0 -45.8 -32.3 26.2 61.3 32.5 81 81 L E G 3 S+ 0 0 84 1,-0.2 87,-0.1 88,-0.1 88,-0.1 0.174 83.5 87.0 -89.7 15.6 26.4 57.7 33.5 82 82 L D G < + 0 0 1 -3,-2.0 -1,-0.2 86,-0.1 22,-0.1 0.478 60.7 111.0 -91.3 -5.7 30.1 57.5 32.5 83 83 L F < + 0 0 17 -3,-0.7 2,-0.3 -4,-0.1 22,-0.2 -0.399 47.5 76.4 -67.7 149.0 31.3 58.7 35.9 84 84 L G E S- H 0 104B 5 20,-1.3 20,-2.4 -45,-0.1 2,-0.3 -0.986 83.4 -49.6 148.5-156.9 33.1 56.1 38.0 85 85 L N E -EH 38 103B 20 -47,-1.7 -47,-2.1 -2,-0.3 2,-0.5 -0.869 39.4-155.6-115.1 150.5 36.5 54.5 38.1 86 86 L Y E -E 37 0B 0 16,-0.8 2,-0.4 -2,-0.3 16,-0.3 -0.998 9.3-172.7-128.2 124.6 38.4 52.9 35.2 87 87 L Y E -E 36 0B 12 -51,-1.2 -51,-3.0 -2,-0.5 2,-0.5 -0.955 13.2-151.9-119.4 135.9 41.0 50.3 35.8 88 88 L a E -E 35 0B 0 -2,-0.4 11,-2.5 -53,-0.2 2,-0.4 -0.921 21.0-161.4-102.3 135.3 43.1 48.8 33.1 89 89 L H E -EI 34 98B 6 -55,-3.4 -55,-1.8 -2,-0.5 2,-0.3 -0.978 5.7-150.5-126.4 134.8 44.2 45.3 34.0 90 90 L H E +E 33 0B 0 7,-2.5 -57,-0.2 -2,-0.4 -86,-0.1 -0.752 21.4 166.4-101.9 151.6 47.0 43.2 32.6 91 91 L F + 0 0 48 -59,-1.5 -58,-0.1 -2,-0.3 5,-0.1 -0.166 40.4 115.7-154.4 43.8 47.2 39.5 32.2 92 92 L W S S- 0 0 105 1,-0.3 2,-0.2 -60,-0.3 4,-0.1 0.937 93.0 -10.6 -76.2 -53.8 50.1 38.7 29.9 93 93 L N S S- 0 0 62 2,-0.2 -1,-0.3 -61,-0.1 -91,-0.1 -0.814 99.1 -39.1-136.8 173.7 51.9 36.9 32.8 94 94 L T S S+ 0 0 58 -2,-0.2 2,-0.1 -3,-0.1 178,-0.1 -0.618 111.0 41.3 -88.4 142.4 51.6 36.4 36.5 95 95 L P S S- 0 0 23 0, 0.0 2,-1.3 0, 0.0 -93,-0.3 0.558 79.3-148.1 -83.5 146.3 50.8 38.2 38.6 96 96 L Y - 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