==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNOGLOBULIN 03-DEC-93 1VFA . COMPND 2 MOLECULE: IGG1-KAPPA D1.3 FV (LIGHT CHAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR T.N.BHAT,R.J.POLJAK . 224 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10233.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 134 59.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 88 39.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 13 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 5 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 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 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 . 1 1 5 1 2 5 1 0 0 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 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 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 A D 0 0 126 0, 0.0 2,-0.5 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 157.7 3.5 14.6 22.9 2 2 A I - 0 0 30 93,-0.3 2,-0.4 90,-0.2 88,-0.1 -0.707 360.0-156.2 -89.3 132.3 5.5 15.3 26.0 3 3 A V - 0 0 80 -2,-0.5 23,-1.8 94,-0.0 2,-0.5 -0.870 4.3-145.2-108.4 140.7 4.0 13.7 29.1 4 4 A L E -A 25 0A 9 94,-0.5 2,-0.5 -2,-0.4 96,-0.5 -0.923 10.8-165.6-108.2 125.6 4.8 15.1 32.6 5 5 A T E -A 24 0A 82 19,-3.0 19,-2.9 -2,-0.5 2,-0.4 -0.963 6.7-159.0-113.1 124.3 5.0 12.6 35.5 6 6 A Q E -A 23 0A 16 -2,-0.5 17,-0.2 17,-0.2 94,-0.0 -0.811 13.5-129.0-103.2 140.8 4.9 14.0 39.0 7 7 A S E S+A 22 0A 45 15,-1.9 15,-2.9 -2,-0.4 2,-0.1 -0.995 80.2 28.0-137.5 145.6 6.3 12.3 42.1 8 8 A P - 0 0 48 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.707 65.2-158.8 -72.5 165.4 5.1 11.6 44.8 9 9 A A S S+ 0 0 76 1,-0.3 94,-2.5 93,-0.2 2,-0.3 0.863 84.0 15.2 -74.6 -31.2 1.5 11.4 43.8 10 10 A S E -d 103 0B 52 92,-0.2 2,-0.4 75,-0.0 -1,-0.3 -0.998 67.9-176.7-143.5 142.8 0.6 12.0 47.5 11 11 A L E -d 104 0B 44 92,-2.7 94,-2.8 -2,-0.3 2,-0.4 -0.997 12.9-155.1-143.2 125.8 2.7 13.3 50.5 12 12 A S E +d 105 0B 49 -2,-0.4 2,-0.3 92,-0.2 94,-0.2 -0.887 29.8 163.8 -97.1 137.6 1.7 13.7 54.1 13 13 A A E -d 106 0B 0 92,-2.3 94,-2.0 -2,-0.4 2,-0.3 -0.995 31.6-121.5-155.4 153.8 3.8 16.3 55.9 14 14 A S > - 0 0 42 -2,-0.3 3,-2.3 92,-0.2 64,-0.3 -0.663 41.3 -90.1 -95.7 155.3 3.8 18.4 59.0 15 15 A V T 3 S+ 0 0 66 -2,-0.3 64,-0.2 1,-0.3 -1,-0.1 -0.328 116.6 32.7 -57.1 136.1 3.9 22.1 59.3 16 16 A G T 3 S+ 0 0 39 62,-3.0 61,-0.3 1,-0.3 -1,-0.3 0.195 92.0 122.0 95.7 -15.5 7.5 23.2 59.5 17 17 A E < - 0 0 77 -3,-2.3 61,-3.2 60,-0.2 2,-0.5 -0.389 58.4-131.3 -79.8 156.2 8.8 20.4 57.2 18 18 A T - 0 0 71 59,-0.2 2,-0.3 58,-0.2 58,-0.2 -0.891 30.5-179.8-105.0 129.4 10.7 20.9 54.0 19 19 A V E - B 0 75A 10 56,-2.3 56,-2.9 -2,-0.5 2,-0.4 -0.945 16.7-158.0-128.3 157.3 9.5 18.9 51.0 20 20 A T E - B 0 74A 69 -2,-0.3 2,-0.4 54,-0.2 54,-0.2 -0.998 7.3-170.2-134.1 135.0 10.5 18.6 47.4 21 21 A I E - B 0 73A 0 52,-2.6 52,-2.4 -2,-0.4 2,-0.3 -0.950 13.7-146.1-123.1 145.3 8.2 17.3 44.7 22 22 A T E -AB 7 72A 28 -15,-2.9 -15,-1.9 -2,-0.4 2,-0.4 -0.795 11.5-161.1-118.2 159.9 9.4 16.5 41.2 23 23 A a E -AB 6 71A 0 48,-2.6 48,-2.1 -2,-0.3 2,-0.4 -0.985 12.5-166.0-138.5 118.2 8.1 16.7 37.7 24 24 A R E -AB 5 70A 95 -19,-2.9 -19,-3.0 -2,-0.4 2,-0.3 -0.940 7.0-149.2-111.7 134.9 9.7 14.7 34.9 25 25 A A E -A 4 0A 11 44,-2.3 -21,-0.2 -2,-0.4 4,-0.1 -0.752 15.6-137.4 -99.9 148.4 9.1 15.2 31.2 26 26 A S S S+ 0 0 82 -23,-1.8 2,-0.3 -2,-0.3 -22,-0.1 0.420 92.9 19.8 -83.8 6.3 9.2 12.5 28.5 27 27 A G S S- 0 0 24 -24,-0.2 2,-0.1 41,-0.1 -1,-0.0 -0.960 105.8 -74.5-164.4 156.2 11.2 14.8 26.2 28 28 A N - 0 0 70 -2,-0.3 41,-0.2 1,-0.2 -2,-0.1 -0.382 38.2-176.4 -65.8 129.2 13.3 17.9 26.8 29 29 A I > - 0 0 0 39,-1.7 3,-2.0 -2,-0.1 62,-0.2 0.298 35.1-129.2-110.5 7.1 11.1 20.9 27.5 30 30 A H T 3 - 0 0 75 1,-0.3 39,-0.1 38,-0.2 3,-0.1 0.859 64.9 -57.7 53.9 46.2 14.0 23.4 27.7 31 31 A N T 3 S+ 0 0 41 37,-0.4 2,-2.0 1,-0.2 -1,-0.3 0.479 96.6 134.1 64.1 7.2 13.0 25.0 31.0 32 32 A Y < + 0 0 50 -3,-2.0 59,-2.1 18,-0.2 2,-0.4 -0.552 35.9 131.5 -84.2 75.1 9.5 26.1 29.9 33 33 A L E -E 90 0B 1 -2,-2.0 18,-2.7 57,-0.2 2,-0.3 -0.996 35.2-172.2-134.8 132.5 7.9 24.7 33.0 34 34 A A E -E 89 0B 0 55,-2.7 55,-2.1 -2,-0.4 2,-0.4 -0.844 11.7-146.5-120.0 154.6 5.4 26.4 35.4 35 35 A W E -EF 88 48B 0 13,-2.5 12,-2.7 -2,-0.3 13,-1.5 -0.979 13.6-170.7-120.3 140.7 4.1 25.2 38.8 36 36 A Y E -EF 87 46B 0 51,-2.5 51,-2.2 -2,-0.4 2,-0.4 -0.940 12.8-147.8-128.0 149.1 0.5 25.8 40.1 37 37 A Q E -EF 86 45B 9 8,-2.6 8,-2.5 -2,-0.3 2,-0.5 -0.945 12.9-166.7-111.3 139.0 -1.0 25.3 43.5 38 38 A Q E -E 85 0B 17 47,-2.8 47,-2.6 -2,-0.4 2,-0.2 -0.987 4.5-158.4-127.7 119.5 -4.8 24.4 43.7 39 39 A K > - 0 0 65 4,-0.5 3,-2.5 -2,-0.5 45,-0.1 -0.615 46.1 -67.1 -92.4 160.9 -6.6 24.5 47.0 40 40 A Q T 3 S- 0 0 189 1,-0.3 -1,-0.1 -2,-0.2 3,-0.1 -0.144 119.4 -3.8 -49.0 123.0 -9.8 22.6 47.6 41 41 A G T 3 S+ 0 0 70 1,-0.2 -1,-0.3 -3,-0.1 2,-0.3 0.594 112.4 108.0 69.1 8.8 -12.7 23.9 45.5 42 42 A K S < S- 0 0 130 -3,-2.5 -1,-0.2 1,-0.1 3,-0.1 -0.761 74.7-104.0-114.5 162.7 -10.5 26.8 44.1 43 43 A S - 0 0 28 -2,-0.3 -4,-0.5 1,-0.1 174,-0.1 -0.441 52.3 -85.6 -75.9 159.8 -9.0 27.3 40.6 44 44 A P - 0 0 2 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.264 42.8-148.9 -59.6 150.5 -5.2 26.7 40.2 45 45 A Q E -F 37 0B 84 -8,-2.5 -8,-2.6 -3,-0.1 2,-0.2 -0.992 19.2-112.0-127.0 135.1 -2.9 29.6 41.1 46 46 A L E +F 36 0B 21 -2,-0.4 -10,-0.2 167,-0.3 3,-0.1 -0.450 39.8 164.5 -65.0 133.3 0.4 30.3 39.4 47 47 A L E + 0 0 5 -12,-2.7 8,-2.8 1,-0.4 2,-0.3 0.723 62.1 6.0-112.0 -52.0 3.4 29.8 41.7 48 48 A V E -FG 35 54B 0 -13,-1.5 -13,-2.5 6,-0.3 -1,-0.4 -0.987 60.2-171.0-142.7 139.2 6.6 29.6 39.5 49 49 A Y E > + G 0 53B 46 4,-2.6 4,-2.1 -2,-0.3 3,-0.3 -0.926 67.0 22.8-138.3 166.5 7.2 30.0 35.8 50 50 A Y T 4 S- 0 0 104 160,-0.5 2,-2.4 -2,-0.3 -16,-0.2 0.905 123.1 -73.8 37.9 57.5 10.2 29.4 33.5 51 51 A T T 4 S+ 0 0 3 -18,-2.7 -1,-0.2 1,-0.2 21,-0.1 -0.248 127.2 27.4 65.1 -51.7 11.5 26.9 36.0 52 52 A T T 4 S+ 0 0 85 -2,-2.4 2,-0.5 -3,-0.3 12,-0.3 0.538 86.1 104.8-120.0 -12.2 12.8 29.4 38.7 53 53 A T E < -G 49 0B 57 -4,-2.1 -4,-2.6 -3,-0.1 2,-0.2 -0.633 58.5-142.5 -84.0 123.6 10.8 32.7 38.7 54 54 A L E -G 48 0B 53 -2,-0.5 -6,-0.3 -6,-0.2 3,-0.1 -0.567 19.4-120.7 -78.3 141.9 8.2 33.1 41.5 55 55 A A > - 0 0 18 -8,-2.8 3,-2.0 -2,-0.2 -1,-0.1 -0.344 50.5 -68.4 -73.0 165.8 5.0 34.8 40.5 56 56 A D T 3 S+ 0 0 171 1,-0.3 -1,-0.2 -2,-0.1 0, 0.0 -0.282 120.8 11.4 -58.4 135.9 4.1 38.1 42.4 57 57 A G T 3 S+ 0 0 70 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.561 86.6 136.1 74.8 7.9 3.2 37.6 46.0 58 58 A V < - 0 0 25 -3,-2.0 -1,-0.3 -11,-0.1 -4,-0.1 -0.766 61.0-112.4 -83.6 133.7 4.5 33.9 46.2 59 59 A P > - 0 0 50 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.364 18.9-116.6 -65.7 149.6 6.5 33.6 49.5 60 60 A S T 3 S+ 0 0 113 1,-0.3 16,-0.1 -2,-0.1 -2,-0.0 0.577 103.4 83.1 -62.9 -13.5 10.2 33.0 49.2 61 61 A R T 3 S+ 0 0 48 14,-0.1 15,-2.7 16,-0.1 2,-0.4 0.610 80.8 77.3 -68.9 -10.0 9.9 29.6 50.9 62 62 A F E < +C 75 0A 5 -3,-1.8 2,-0.3 13,-0.2 13,-0.2 -0.826 59.4 167.0 -91.9 135.9 9.0 28.2 47.4 63 63 A S E -C 74 0A 44 11,-1.9 11,-2.9 -2,-0.4 2,-0.3 -0.969 17.6-156.4-147.7 142.5 11.8 27.6 44.9 64 64 A G E +C 73 0A 9 -12,-0.3 2,-0.3 -2,-0.3 9,-0.2 -0.848 15.6 170.1-112.9 153.8 11.8 25.7 41.6 65 65 A S E +C 72 0A 65 7,-2.2 7,-2.4 -2,-0.3 2,-0.2 -0.930 16.5 103.0-148.0 170.3 14.8 24.2 39.8 66 66 A G E -C 71 0A 29 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.727 29.9-155.2 142.8 169.8 15.5 22.0 36.8 67 67 A S E > +C 70 0A 77 3,-1.8 3,-2.1 -2,-0.2 2,-0.4 -0.922 64.8 6.7-168.1 164.4 16.6 21.6 33.3 68 68 A G T 3 S- 0 0 22 -2,-0.3 -39,-1.7 1,-0.3 -37,-0.4 -0.409 130.7 -22.1 61.9-114.8 16.1 19.2 30.4 69 69 A T T 3 S+ 0 0 58 -2,-0.4 -44,-2.3 -41,-0.2 2,-0.4 0.275 122.5 77.6-110.1 5.9 13.5 16.6 31.6 70 70 A Q E < +BC 24 67A 102 -3,-2.1 -3,-1.8 -46,-0.2 2,-0.3 -0.977 49.9 163.5-128.8 122.0 13.9 16.9 35.4 71 71 A Y E -BC 23 66A 0 -48,-2.1 -48,-2.6 -2,-0.4 2,-0.3 -0.971 12.7-165.7-137.7 151.1 12.3 19.8 37.5 72 72 A S E -BC 22 65A 32 -7,-2.4 -7,-2.2 -2,-0.3 2,-0.5 -0.983 13.8-154.5-140.7 148.3 11.7 20.2 41.2 73 73 A L E -BC 21 64A 0 -52,-2.4 -52,-2.6 -2,-0.3 2,-0.5 -0.996 18.2-164.3-119.0 123.9 9.7 22.5 43.5 74 74 A K E -BC 20 63A 67 -11,-2.9 -11,-1.9 -2,-0.5 2,-0.6 -0.920 4.8-164.7-109.8 132.7 11.0 22.7 47.0 75 75 A I E -BC 19 62A 0 -56,-2.9 -56,-2.3 -2,-0.5 2,-0.4 -0.972 11.7-150.8-118.8 113.9 8.9 24.1 49.8 76 76 A N S S- 0 0 63 -15,-2.7 -58,-0.2 -2,-0.6 -59,-0.1 -0.744 71.1 -7.9 -82.7 129.8 10.9 25.1 52.9 77 77 A S S S- 0 0 59 -2,-0.4 -1,-0.2 -61,-0.3 -59,-0.2 0.952 87.3-125.9 46.9 68.4 9.1 24.9 56.2 78 78 A L - 0 0 0 -61,-3.2 -62,-3.0 -3,-0.4 -61,-0.1 -0.061 22.1-157.3 -42.5 126.1 5.5 24.2 55.2 79 79 A Q > - 0 0 75 -64,-0.2 3,-2.5 -63,-0.1 4,-0.3 -0.755 33.7-102.3-102.6 160.2 2.9 26.6 56.5 80 80 A P G > S+ 0 0 77 0, 0.0 3,-1.4 0, 0.0 26,-0.1 0.844 119.2 61.2 -55.3 -35.6 -0.8 25.6 56.8 81 81 A E G 3 S+ 0 0 101 1,-0.3 -3,-0.0 -42,-0.0 0, 0.0 0.531 93.0 68.1 -70.6 -5.6 -1.8 27.5 53.7 82 82 A D G < S+ 0 0 3 -3,-2.5 -1,-0.3 2,-0.0 22,-0.1 0.550 71.7 103.4 -91.5 -10.9 0.6 25.4 51.5 83 83 A F < + 0 0 28 -3,-1.4 2,-0.3 -4,-0.3 22,-0.2 -0.466 54.7 76.3 -73.0 148.4 -1.3 22.1 51.7 84 84 A G E S- H 0 104B 16 20,-2.0 20,-3.0 -45,-0.1 2,-0.3 -0.965 86.0 -40.2 145.8-164.5 -3.2 21.3 48.6 85 85 A S E -EH 38 103B 25 -47,-2.6 -47,-2.8 -2,-0.3 2,-0.4 -0.789 43.4-157.0-105.0 144.7 -2.4 20.0 45.1 86 86 A Y E -EH 37 102B 0 16,-2.4 16,-1.8 -2,-0.3 2,-0.4 -0.970 10.4-174.4-120.9 133.2 0.6 21.0 43.0 87 87 A Y E -E 36 0B 11 -51,-2.2 -51,-2.5 -2,-0.4 2,-0.3 -0.984 12.0-152.9-126.8 136.2 0.7 20.7 39.2 88 88 A a E -E 35 0B 0 -2,-0.4 11,-2.5 -53,-0.2 2,-0.3 -0.778 15.1-172.7-101.1 155.5 3.5 21.3 36.8 89 89 A Q E -EI 34 98B 0 -55,-2.1 -55,-2.7 -2,-0.3 2,-0.3 -0.989 11.7-142.6-145.1 140.3 2.8 22.3 33.2 90 90 A H E -E 33 0B 2 7,-1.8 7,-0.4 -2,-0.3 -57,-0.2 -0.718 9.7-165.3-105.3 162.6 5.1 22.7 30.2 91 91 A F + 0 0 6 -59,-2.1 2,-0.9 -2,-0.3 -58,-0.1 -0.096 41.8 133.9-130.1 27.9 5.0 25.3 27.5 92 92 A W S S- 0 0 101 -60,-0.3 -90,-0.2 3,-0.1 -2,-0.1 -0.775 82.6 -57.2 -85.5 108.8 7.3 23.7 24.9 93 93 A S S S- 0 0 84 -2,-0.9 -64,-0.0 -64,-0.1 0, 0.0 -0.163 98.6 -19.4 57.4-148.9 5.6 23.9 21.6 94 94 A T S S+ 0 0 53 2,-0.1 2,-0.1 1,-0.0 -3,-0.1 -0.968 106.2 46.9-137.3 155.3 2.1 22.4 21.5 95 95 A P S S- 0 0 18 0, 0.0 -93,-0.3 0, 0.0 2,-0.3 0.577 72.1-154.6 -72.3 157.3 0.2 20.4 22.9 96 96 A R - 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