==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM/IMMUNOSUPPRESSANT 09-DEC-93 1IKF . COMPND 2 MOLECULE: IGG1-KAPPA R45-45-11 FAB (LIGHT CHAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR O.VIX,D.ALTSCHUH,B.REES,J.-C.THIERRY . 451 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20284.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 297 65.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 178 39.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 51 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 2.9 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+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 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 0 0 PARALLEL BRIDGES PER LADDER . 4 5 4 2 4 9 2 0 1 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 0 4 2 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 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 0 162 0, 0.0 2,-0.3 0, 0.0 93,-0.1 0.000 360.0 360.0 360.0 172.2 -2.9 25.7 71.7 2 2 L I - 0 0 7 93,-0.4 2,-0.5 91,-0.1 88,-0.1 -0.804 360.0-131.9 -91.1 142.1 -5.1 22.8 70.3 3 3 L Q - 0 0 125 -2,-0.3 23,-1.8 94,-0.0 2,-0.5 -0.823 13.9-155.9-108.6 131.5 -3.3 20.5 67.9 4 4 L M E -A 25 0A 7 -2,-0.5 2,-0.5 94,-0.5 21,-0.2 -0.859 8.1-166.1-100.9 138.7 -4.8 19.6 64.6 5 5 L T E -A 24 0A 58 19,-2.9 19,-1.4 -2,-0.5 2,-0.6 -0.964 9.3-161.7-127.2 121.6 -3.7 16.4 63.0 6 6 L Q E -A 23 0A 24 -2,-0.5 17,-0.2 17,-0.2 94,-0.0 -0.957 15.5-147.7-106.4 121.6 -4.4 15.5 59.3 7 7 L T S S+ 0 0 98 15,-0.6 2,-0.4 -2,-0.6 -1,-0.1 0.814 79.4 37.0 -56.3 -35.7 -4.0 11.7 59.0 8 8 L T - 0 0 64 14,-0.4 3,-0.1 1,-0.1 14,-0.1 -0.910 54.2-172.3-124.1 141.7 -2.7 11.8 55.4 9 9 L S S S+ 0 0 83 1,-0.4 94,-2.4 -2,-0.4 2,-0.3 0.460 80.6 22.4-108.9 -6.1 -0.4 14.4 53.8 10 10 L S E +d 103 0B 79 92,-0.2 -1,-0.4 75,-0.0 2,-0.3 -0.952 64.2 166.9-154.3 131.1 -0.7 13.1 50.2 11 11 L L E -d 104 0B 42 92,-1.9 94,-2.8 -2,-0.3 2,-0.4 -0.986 17.0-154.4-140.9 148.3 -3.4 10.9 48.5 12 12 L S E +d 105 0B 62 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.982 20.2 163.8-125.0 137.4 -4.0 10.2 44.8 13 13 L A E -d 106 0B 10 92,-1.7 94,-2.2 -2,-0.4 2,-0.2 -0.920 35.0-102.4-144.9 162.1 -7.4 9.3 43.4 14 14 L S > - 0 0 42 -2,-0.3 3,-1.9 92,-0.2 64,-0.4 -0.556 45.6 -87.8 -87.0 154.5 -8.9 9.1 39.9 15 15 L L T 3 S+ 0 0 82 92,-0.4 2,-0.2 1,-0.3 64,-0.2 -0.231 119.0 31.9 -56.0 141.8 -11.4 11.7 38.4 16 16 L G T 3 S+ 0 0 42 62,-2.5 61,-0.5 1,-0.3 -1,-0.3 -0.170 95.4 123.9 97.5 -41.0 -14.8 10.7 39.3 17 17 L D < - 0 0 74 -3,-1.9 61,-1.8 60,-0.2 2,-0.5 0.132 62.8-124.0 -52.2 161.7 -13.7 9.2 42.7 18 18 L R - 0 0 182 59,-0.2 2,-0.4 58,-0.2 58,-0.2 -0.936 30.4-168.9-106.7 129.7 -15.0 10.3 46.1 19 19 L V E - B 0 75A 9 56,-1.9 56,-2.3 -2,-0.5 2,-0.5 -0.983 10.2-160.1-126.2 134.3 -12.1 11.3 48.3 20 20 L T E - B 0 74A 56 -2,-0.4 2,-0.4 54,-0.2 54,-0.2 -0.967 4.1-162.6-116.1 118.0 -12.4 11.9 52.0 21 21 L I E - B 0 73A 2 52,-2.5 52,-2.3 -2,-0.5 2,-0.3 -0.798 19.0-147.3 -89.9 133.1 -9.7 14.1 53.6 22 22 L S E - B 0 72A 43 -2,-0.4 -15,-0.6 50,-0.2 -14,-0.4 -0.843 18.1-175.8-113.9 149.3 -9.6 13.7 57.5 23 23 L a E -AB 6 71A 4 48,-2.0 48,-2.2 -2,-0.3 2,-0.4 -0.923 4.6-166.2-133.4 149.3 -8.8 16.0 60.4 24 24 L R E -AB 5 70A 121 -19,-1.4 -19,-2.9 -2,-0.3 2,-0.4 -0.982 8.6-149.4-147.6 130.1 -8.6 15.3 64.1 25 25 L A E -A 4 0A 2 44,-2.1 -21,-0.2 -2,-0.4 4,-0.1 -0.760 19.0-132.7 -97.1 144.3 -8.4 17.7 66.9 26 26 L S S S+ 0 0 72 -23,-1.8 2,-0.3 -2,-0.4 -22,-0.1 0.585 93.6 22.4 -69.7 -6.8 -6.6 17.0 70.2 27 27 L Q S S- 0 0 87 -24,-0.2 2,-0.3 41,-0.1 -2,-0.1 -0.931 105.5 -72.6-153.0 161.1 -9.7 18.2 72.1 28 28 L D - 0 0 95 -2,-0.3 41,-0.2 1,-0.1 -2,-0.1 -0.527 42.0-173.8 -66.6 123.3 -13.5 18.6 71.4 29 29 L I > - 0 0 0 39,-2.7 3,-2.2 -2,-0.3 62,-0.2 0.107 33.0-126.5-108.8 21.0 -13.7 21.6 69.1 30 30 L S T 3 - 0 0 59 1,-0.3 39,-0.1 38,-0.2 3,-0.1 0.745 62.7 -63.1 46.9 33.2 -17.5 21.9 69.1 31 31 L T T 3 S+ 0 0 44 37,-0.3 2,-2.0 1,-0.2 -1,-0.3 0.422 100.1 131.4 74.9 4.3 -18.1 21.8 65.2 32 32 L Y < + 0 0 44 -3,-2.2 59,-3.0 18,-0.2 2,-0.4 -0.442 35.4 126.7 -89.9 74.3 -16.1 25.1 64.9 33 33 L L E -E 90 0B 0 -2,-2.0 18,-2.6 57,-0.2 2,-0.3 -0.990 39.5-165.9-138.1 136.9 -13.9 23.8 62.1 34 34 L N E -E 89 0B 3 55,-2.1 55,-1.7 -2,-0.4 2,-0.4 -0.916 10.4-142.2-128.4 148.8 -13.2 25.3 58.7 35 35 L W E -EF 88 48B 0 13,-2.8 12,-2.7 -2,-0.3 13,-1.3 -0.919 16.1-168.3-116.6 141.1 -11.6 23.8 55.5 36 36 L Y E -EF 87 46B 0 51,-2.0 51,-1.9 -2,-0.4 2,-0.5 -0.888 12.9-145.7-126.6 151.9 -9.3 25.8 53.1 37 37 L Q E -EF 86 45B 11 8,-2.1 8,-1.4 -2,-0.3 2,-0.6 -0.972 10.5-172.6-122.1 117.9 -8.0 25.1 49.6 38 38 L Q E -EF 85 44B 14 47,-2.9 47,-3.0 -2,-0.5 6,-0.2 -0.950 18.2-152.0-110.2 120.7 -4.5 26.2 48.7 39 39 L K > - 0 0 49 4,-2.7 3,-1.7 -2,-0.6 45,-0.2 -0.537 36.2 -84.8 -84.9 165.5 -3.9 25.6 45.0 40 40 L P T 3 S+ 0 0 54 0, 0.0 44,-0.1 0, 0.0 125,-0.1 0.638 124.6 55.7 -46.1 -19.7 -0.5 25.0 43.4 41 41 L D T 3 S- 0 0 126 2,-0.1 3,-0.1 1,-0.0 -2,-0.0 0.089 120.4 -97.0-105.4 28.4 0.2 28.7 43.1 42 42 L G S < S+ 0 0 16 -3,-1.7 -1,-0.0 1,-0.3 0, 0.0 0.055 77.6 139.3 86.9 -29.9 -0.2 29.9 46.8 43 43 L T - 0 0 51 -5,-0.1 -4,-2.7 1,-0.1 2,-0.3 -0.213 33.0-165.9 -56.3 132.5 -3.8 31.0 46.3 44 44 L V E +F 38 0B 10 287,-0.4 286,-0.5 -6,-0.2 2,-0.3 -0.935 9.3 178.3-118.5 137.9 -6.0 30.1 49.3 45 45 L K E -F 37 0B 91 -8,-1.4 -8,-2.1 -2,-0.3 2,-0.3 -0.991 34.3-108.6-140.2 152.5 -9.9 30.1 49.6 46 46 L L E +F 36 0B 0 282,-0.8 -10,-0.2 -2,-0.3 3,-0.1 -0.613 36.6 172.2 -72.6 135.0 -12.5 29.2 52.3 47 47 L L E + 0 0 2 -12,-2.7 8,-1.7 1,-0.4 2,-0.3 0.741 62.1 0.6-111.8 -53.8 -14.2 26.1 51.3 48 48 L I E -FG 35 54B 0 -13,-1.3 -13,-2.8 6,-0.2 -1,-0.4 -0.976 61.2-172.8-142.6 145.5 -16.4 25.0 54.3 49 49 L F E > + G 0 53B 10 4,-2.7 4,-1.2 -2,-0.3 -15,-0.2 -0.929 69.3 31.4-137.5 156.9 -17.0 26.7 57.8 50 50 L Y T >4 S- 0 0 43 -2,-0.3 2,-3.2 1,-0.2 3,-0.9 0.968 121.0 -84.6 51.4 58.0 -18.9 25.5 61.0 51 51 L T T 34 S+ 0 0 5 -18,-2.6 -1,-0.2 -20,-0.2 21,-0.1 -0.118 123.4 31.2 30.7 -38.6 -17.9 22.0 59.8 52 52 L S T 34 S+ 0 0 76 -2,-3.2 2,-0.6 -3,-0.1 12,-0.3 0.562 90.9 104.9-112.1 -9.1 -20.8 21.3 57.3 53 53 L R E << -G 49 0B 101 -4,-1.2 -4,-2.7 -3,-0.9 2,-0.2 -0.577 55.9-152.7 -89.6 115.4 -21.6 24.7 56.0 54 54 L L E -G 48 0B 61 -2,-0.6 2,-0.2 -6,-0.2 -6,-0.2 -0.557 13.2-131.7 -76.6 146.0 -20.4 25.5 52.4 55 55 L R > - 0 0 41 -8,-1.7 3,-1.6 -2,-0.2 2,-0.1 -0.621 38.9 -79.4 -96.5 162.9 -19.7 29.0 51.4 56 56 L S T 3 S+ 0 0 115 1,-0.2 -1,-0.1 -2,-0.2 0, 0.0 -0.327 112.6 27.9 -66.6 134.4 -21.0 30.5 48.2 57 57 L G T 3 S+ 0 0 83 1,-0.4 -1,-0.2 -2,-0.1 -10,-0.0 0.080 92.5 114.7 104.4 -15.4 -19.3 29.8 44.9 58 58 L V S < S- 0 0 23 -3,-1.6 -1,-0.4 -11,-0.1 -4,-0.0 -0.638 73.0-101.0 -88.4 135.3 -18.0 26.4 46.1 59 59 L P > - 0 0 56 0, 0.0 3,-2.3 0, 0.0 -1,-0.1 -0.244 17.7-125.0 -46.4 140.2 -19.3 23.2 44.4 60 60 L S T 3 S+ 0 0 109 1,-0.3 16,-0.1 15,-0.1 -2,-0.0 0.668 104.4 81.3 -58.0 -25.5 -21.9 21.0 46.0 61 61 L R T 3 S+ 0 0 25 14,-0.1 15,-3.0 16,-0.1 2,-0.5 0.705 77.6 77.7 -52.8 -28.1 -19.3 18.3 45.6 62 62 L F E < +C 75 0A 5 -3,-2.3 2,-0.3 13,-0.2 13,-0.2 -0.796 59.3 164.0 -92.1 129.4 -17.6 19.5 48.8 63 63 L S E -C 74 0A 46 11,-2.2 11,-2.6 -2,-0.5 2,-0.3 -0.941 16.3-161.9-135.3 155.2 -19.4 18.4 51.9 64 64 L G E +C 73 0A 7 -12,-0.3 2,-0.2 -2,-0.3 9,-0.2 -0.966 10.9 171.8-143.0 129.3 -18.0 18.3 55.5 65 65 L S E +C 72 0A 67 7,-1.1 7,-1.6 -2,-0.3 2,-0.2 -0.696 9.7 136.1-121.4 178.0 -19.1 16.5 58.7 66 66 L G E -C 71 0A 29 5,-0.2 2,-0.3 -2,-0.2 5,-0.2 -0.658 26.5-153.9 155.5 159.3 -17.9 15.9 62.2 67 67 L S E > -C 70 0A 97 3,-1.5 3,-1.8 -2,-0.2 2,-0.9 -0.984 69.9 -21.3-150.2 137.1 -18.4 15.7 65.9 68 68 L G T 3 S- 0 0 23 -2,-0.3 -39,-2.7 1,-0.3 -37,-0.3 -0.513 129.8 -15.7 75.4-102.3 -16.1 16.3 68.8 69 69 L T T 3 S+ 0 0 44 -2,-0.9 -44,-2.1 -41,-0.2 2,-0.5 0.464 116.5 85.9-115.5 -12.5 -12.5 15.8 67.5 70 70 L D E < +BC 24 67A 78 -3,-1.8 -3,-1.5 -46,-0.2 2,-0.3 -0.827 49.1 165.9-107.2 130.0 -13.2 14.0 64.2 71 71 L Y E -BC 23 66A 2 -48,-2.2 -48,-2.0 -2,-0.5 2,-0.3 -0.903 12.6-165.5-136.8 156.7 -13.9 15.9 60.9 72 72 L S E -BC 22 65A 28 -7,-1.6 -7,-1.1 -2,-0.3 2,-0.5 -0.996 15.3-155.8-147.8 146.2 -14.0 15.1 57.1 73 73 L L E -BC 21 64A 0 -52,-2.3 -52,-2.5 -2,-0.3 2,-0.4 -0.986 20.7-166.3-115.6 124.8 -14.0 16.9 53.8 74 74 L T E -BC 20 63A 15 -11,-2.6 -11,-2.2 -2,-0.5 2,-0.6 -0.938 10.0-158.7-114.2 135.4 -15.6 14.6 51.1 75 75 L I E -BC 19 62A 0 -56,-2.3 -56,-1.9 -2,-0.4 2,-0.5 -0.988 12.9-153.1-112.8 104.4 -15.1 15.6 47.5 76 76 L S S S+ 0 0 43 -15,-3.0 -58,-0.2 -2,-0.6 -59,-0.1 -0.784 75.2 7.1 -77.2 119.5 -18.0 13.8 45.8 77 77 L N S S- 0 0 97 -2,-0.5 2,-0.3 -61,-0.5 -1,-0.2 0.988 83.9-124.1 68.7 92.9 -16.6 13.4 42.3 78 78 L L - 0 0 4 -61,-1.8 -62,-2.5 -64,-0.4 2,-0.3 -0.455 27.9-169.4 -68.5 123.6 -13.0 14.4 41.7 79 79 L E > - 0 0 81 -2,-0.3 3,-1.9 -64,-0.2 4,-0.1 -0.812 36.7-107.3-104.4 163.1 -12.6 16.9 38.9 80 80 L Q G > S+ 0 0 31 -2,-0.3 3,-1.1 1,-0.3 26,-0.1 0.847 115.2 65.4 -51.8 -39.5 -9.3 18.0 37.4 81 81 L E G 3 S+ 0 0 118 1,-0.3 -1,-0.3 88,-0.0 -3,-0.0 0.662 80.1 79.3 -61.0 -23.0 -9.5 21.3 39.2 82 82 L D G < + 0 0 3 -3,-1.9 2,-0.6 -43,-0.1 -1,-0.3 0.367 54.8 121.5 -79.0 6.3 -9.3 19.8 42.7 83 83 L I < + 0 0 11 -3,-1.1 2,-0.3 85,-0.1 22,-0.1 -0.590 46.7 101.1 -70.5 116.8 -5.5 19.4 42.7 84 84 L A S S- 0 0 2 -2,-0.6 20,-2.0 20,-0.4 2,-0.4 -0.911 77.0 -89.5-175.0-172.9 -4.5 21.5 45.6 85 85 L T E -EH 38 103B 31 -47,-3.0 -47,-2.9 -2,-0.3 2,-0.4 -0.974 37.9-147.4-122.6 131.4 -3.6 21.1 49.3 86 86 L Y E -EH 37 102B 0 16,-2.3 16,-0.8 -2,-0.4 2,-0.4 -0.887 13.1-169.5-107.4 130.6 -6.5 21.1 51.8 87 87 L F E -E 36 0B 0 -51,-1.9 -51,-2.0 -2,-0.4 2,-0.3 -0.977 11.0-153.4-124.5 133.2 -6.2 22.4 55.4 88 88 L a E -E 35 0B 0 -2,-0.4 11,-2.3 -53,-0.2 2,-0.4 -0.691 15.3-170.5 -90.4 153.8 -8.5 22.2 58.4 89 89 L Q E -EI 34 98B 6 -55,-1.7 -55,-2.1 -2,-0.3 2,-0.4 -0.995 15.0-136.6-141.3 135.5 -8.3 24.9 61.0 90 90 L Q E -EI 33 97B 0 7,-2.2 7,-0.8 -2,-0.4 -57,-0.2 -0.785 14.9-175.6 -96.5 142.5 -10.0 25.0 64.3 91 91 L G + 0 0 16 -59,-3.0 358,-0.5 -2,-0.4 -58,-0.1 0.017 58.6 99.2-113.6 24.6 -11.7 28.1 65.5 92 92 L S S S+ 0 0 9 -60,-0.3 2,-0.3 356,-0.1 -1,-0.1 0.915 89.6 16.4 -78.4 -44.5 -12.7 26.8 69.1 93 93 L R S S- 0 0 150 2,-0.3 4,-0.1 4,-0.1 -91,-0.1 -0.805 96.2 -74.1-123.9 166.0 -9.8 28.4 71.1 94 94 L I S S+ 0 0 61 -2,-0.3 -3,-0.1 2,-0.1 3,-0.0 -0.866 106.2 50.7-100.4 133.2 -7.3 31.2 70.4 95 95 L P S S- 0 0 31 0, 0.0 -93,-0.4 0, 0.0 -2,-0.3 0.556 86.4-131.7 -66.8 155.4 -4.9 30.8 68.6 96 96 L P - 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