==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 23-AUG-07 2R1X . COMPND 2 MOLECULE: FAB, ANTIBODY FRAGMENT (IGG1K), LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR C.L.BROOKS,S.V.EVANS . 434 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19642.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 281 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 173 39.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 0.2 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-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 . 42 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.4 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 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 0 RESIDUES PER ALPHA HELIX . 0 1 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 PARALLEL BRIDGES PER LADDER . 4 3 7 2 5 9 0 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 . 2 0 5 1 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 0 169 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-173.8 -16.2 12.2 57.6 2 2 A I - 0 0 14 97,-0.1 2,-0.5 99,-0.1 94,-0.1 -0.902 360.0-164.4-115.4 109.5 -12.4 12.7 57.1 3 3 A V - 0 0 70 -2,-0.6 23,-1.5 2,-0.0 2,-0.5 -0.764 2.4-162.3 -89.6 126.4 -11.6 14.3 53.7 4 4 A M E -A 25 0A 15 -2,-0.5 2,-0.4 99,-0.3 21,-0.2 -0.924 10.3-178.1-110.7 132.3 -8.0 14.1 52.6 5 5 A S E -A 24 0A 61 19,-2.6 19,-3.0 -2,-0.5 2,-0.3 -0.982 7.5-159.8-132.3 137.8 -6.7 16.4 49.9 6 6 A Q E -A 23 0A 27 -2,-0.4 17,-0.2 17,-0.2 87,-0.0 -0.871 13.8-123.3-118.8 154.7 -3.3 16.7 48.2 7 7 A S E S+A 22 0A 70 15,-2.0 15,-3.4 -2,-0.3 2,-0.2 -0.987 76.5 24.7-145.4 144.4 -1.5 19.4 46.2 8 8 A P - 0 0 38 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.721 63.7-147.6 -78.2 175.1 -0.3 19.7 43.6 9 9 A S S S- 0 0 92 1,-0.3 99,-2.6 98,-0.2 2,-0.3 0.883 81.0 -14.7 -67.4 -40.0 -2.0 17.2 41.4 10 10 A S E +d 108 0B 64 97,-0.2 -1,-0.3 81,-0.0 2,-0.3 -0.977 65.0 169.4-157.3 158.2 1.2 16.8 39.5 11 11 A L E -d 109 0B 49 97,-1.9 99,-3.0 -2,-0.3 2,-0.4 -0.953 23.4-132.0-161.9 165.5 4.6 18.5 38.9 12 12 A A E -d 110 0B 50 -2,-0.3 2,-0.3 97,-0.2 99,-0.3 -0.988 21.8-178.9-126.9 137.7 8.0 17.9 37.3 13 13 A V E -d 111 0B 9 97,-2.0 99,-1.8 -2,-0.4 2,-0.2 -0.985 26.2-117.4-135.3 144.8 11.3 18.5 38.9 14 14 A S E > -d 112 0B 33 -2,-0.3 3,-2.1 97,-0.2 70,-0.2 -0.508 45.2 -86.7 -81.5 151.6 14.9 18.1 37.6 15 15 A A T 3 S+ 0 0 68 97,-0.7 70,-0.2 1,-0.3 -1,-0.1 -0.239 115.9 27.1 -54.7 139.8 17.3 15.6 39.2 16 16 A G T 3 S+ 0 0 53 68,-3.2 67,-0.5 1,-0.3 -1,-0.3 0.259 99.9 107.4 90.5 -12.4 19.1 17.2 42.2 17 17 A E S < S- 0 0 105 -3,-2.1 67,-2.6 67,-0.2 -1,-0.3 -0.434 72.5 -97.8 -96.6 174.7 16.4 19.8 43.0 18 18 A K - 0 0 140 65,-0.2 2,-0.4 64,-0.2 64,-0.2 -0.655 27.6-157.8 -96.4 146.1 13.9 19.9 45.9 19 19 A V E - B 0 81A 2 62,-2.9 62,-2.6 -2,-0.3 2,-0.4 -0.984 7.8-174.7-122.9 134.0 10.3 18.7 45.8 20 20 A T E + B 0 80A 73 -2,-0.4 2,-0.3 60,-0.2 60,-0.2 -0.997 8.0 170.5-126.4 128.7 7.6 19.9 48.2 21 21 A M E - B 0 79A 0 58,-2.1 58,-2.4 -2,-0.4 2,-0.3 -0.982 17.2-140.2-138.9 159.1 4.0 18.5 48.3 22 22 A S E -AB 7 78A 51 -15,-3.4 -15,-2.0 -2,-0.3 2,-0.4 -0.784 11.0-166.4-126.3 156.1 1.2 18.9 50.6 23 23 A a E -AB 6 77A 2 54,-2.5 54,-2.8 -2,-0.3 2,-0.4 -0.985 10.1-166.9-144.8 122.8 -1.6 17.0 52.3 24 24 A K E -AB 5 76A 105 -19,-3.0 -19,-2.6 -2,-0.4 2,-0.4 -0.925 4.5-158.2-113.6 139.1 -4.6 18.5 54.1 25 25 A S E -A 4 0A 3 50,-2.2 -21,-0.2 -2,-0.4 4,-0.1 -0.908 20.4-136.9-111.3 147.3 -7.1 16.7 56.4 26 26 A S S S+ 0 0 69 -23,-1.5 2,-0.3 -2,-0.4 -22,-0.1 0.629 94.5 34.2 -76.0 -12.7 -10.6 18.1 57.1 27 27 A Q S S- 0 0 77 -24,-0.2 -1,-0.1 47,-0.1 -25,-0.0 -0.986 102.1 -89.5-139.2 147.0 -10.1 17.2 60.8 28 28 A S - 0 0 52 -2,-0.3 47,-0.2 1,-0.1 -2,-0.1 -0.331 26.8-159.5 -56.1 135.2 -7.0 17.3 63.0 29 29 A L + 0 0 0 45,-2.4 9,-2.5 -4,-0.1 2,-0.7 0.253 54.2 118.7 -98.4 8.5 -5.1 14.0 63.0 30 30 A L E -J 37 0C 69 7,-0.2 2,-0.6 8,-0.1 7,-0.3 -0.689 58.2-146.2 -82.0 111.4 -3.3 14.7 66.2 31 30AA N E >> -J 36 0C 29 5,-3.1 4,-1.8 -2,-0.7 5,-0.5 -0.698 2.8-156.0 -79.8 119.6 -4.3 12.1 68.8 32 30BA S T 45S+ 0 0 107 -2,-0.6 -1,-0.2 1,-0.2 -2,-0.0 0.817 89.3 52.3 -68.8 -29.1 -4.4 13.8 72.2 33 30CA R T 45S+ 0 0 188 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.924 123.6 24.6 -73.7 -46.4 -3.8 10.5 74.1 34 30DA T T 45S- 0 0 33 2,-0.2 -2,-0.2 0, 0.0 -1,-0.2 0.539 97.3-133.9 -95.0 -11.8 -0.7 9.4 72.2 35 30EA R T <5 + 0 0 196 -4,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.736 64.9 119.4 62.8 29.3 0.4 12.9 71.1 36 30FA K E < -J 31 0C 61 -5,-0.5 -5,-3.1 -7,-0.1 2,-0.5 -0.886 66.4-122.0-122.9 152.7 1.0 11.7 67.5 37 31 A N E -J 30 0C 17 19,-0.3 2,-1.9 -2,-0.3 -7,-0.2 -0.862 21.0-139.7 -91.5 125.0 -0.4 12.6 64.1 38 32 A Y + 0 0 22 -9,-2.5 59,-2.0 -2,-0.5 60,-0.5 -0.503 59.1 123.7 -88.4 72.7 -2.0 9.6 62.4 39 33 A L E -E 96 0B 1 -2,-1.9 18,-3.1 57,-0.2 2,-0.3 -0.992 35.2-177.7-139.9 122.9 -0.7 10.5 58.9 40 34 A A E -E 95 0B 2 55,-2.5 55,-2.0 -2,-0.4 2,-0.4 -0.878 16.4-141.0-120.2 158.4 1.4 8.3 56.6 41 35 A W E -EF 94 54B 0 13,-2.6 12,-2.9 -2,-0.3 13,-1.6 -0.967 15.4-168.0-120.5 135.4 3.0 8.8 53.2 42 36 A Y E -EF 93 52B 0 51,-3.0 51,-2.5 -2,-0.4 2,-0.5 -0.919 10.3-147.5-119.8 145.0 3.1 6.1 50.5 43 37 A Q E -EF 92 51B 7 8,-2.8 8,-2.2 -2,-0.3 2,-0.6 -0.945 10.0-169.3-112.3 128.5 5.1 6.0 47.3 44 38 A Q E -E 91 0B 18 47,-3.1 47,-2.4 -2,-0.5 3,-0.1 -0.895 6.4-162.3-121.9 102.8 3.7 4.2 44.2 45 39 A K > - 0 0 27 -2,-0.6 3,-2.4 4,-0.4 45,-0.2 -0.405 45.8 -70.6 -76.9 157.5 6.2 3.8 41.4 46 40 A P T 3 S+ 0 0 46 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.245 118.9 1.1 -57.6 132.0 4.7 3.0 37.9 47 41 A G T 3 S+ 0 0 90 1,-0.2 2,-0.2 -3,-0.1 -2,-0.1 0.474 113.5 106.2 70.7 7.0 3.4 -0.6 37.7 48 42 A Q S < S- 0 0 109 -3,-2.4 -1,-0.2 1,-0.1 3,-0.1 -0.663 74.1-102.5-111.0 167.4 4.2 -1.2 41.4 49 43 A S - 0 0 26 -2,-0.2 -4,-0.4 1,-0.1 285,-0.1 -0.479 53.0 -86.9 -75.0 156.5 2.3 -1.6 44.7 50 44 A P - 0 0 5 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.347 43.7-152.5 -61.7 148.8 2.4 1.4 47.1 51 45 A K E -F 43 0B 97 -8,-2.2 -8,-2.8 280,-0.1 2,-0.2 -0.987 18.3-113.4-125.3 134.4 5.4 1.4 49.5 52 46 A L E +F 42 0B 7 -2,-0.4 -10,-0.2 278,-0.4 3,-0.1 -0.478 40.7 161.4 -66.3 130.5 5.4 2.9 53.0 53 47 A L E + 0 0 1 -12,-2.9 8,-2.4 1,-0.4 2,-0.3 0.753 62.1 8.6-110.0 -50.3 7.8 5.9 53.3 54 48 A I E -FG 41 60B 1 -13,-1.6 -13,-2.6 6,-0.2 -1,-0.4 -0.980 59.4-179.1-140.2 140.9 6.8 7.9 56.4 55 49 A Y E > + G 0 59B 14 4,-2.5 4,-2.6 -2,-0.3 3,-0.4 -0.927 67.0 33.6-140.5 170.2 4.3 7.4 59.3 56 50 A W T 4 S- 0 0 21 271,-0.5 2,-2.1 -2,-0.3 -19,-0.3 0.866 123.8 -79.4 47.7 39.9 3.2 9.3 62.4 57 51 A A T 4 S+ 0 0 2 -18,-3.1 -1,-0.3 1,-0.2 21,-0.1 -0.173 126.7 28.6 69.3 -41.4 3.8 12.4 60.1 58 52 A S T 4 S+ 0 0 80 -2,-2.1 2,-0.7 -3,-0.4 12,-0.3 0.446 83.5 110.7-133.0 -3.1 7.6 12.5 60.5 59 53 A T E < -G 55 0B 51 -4,-2.6 -4,-2.5 10,-0.1 2,-0.6 -0.704 56.9-146.2 -83.2 116.1 8.9 8.9 61.2 60 54 A R E -G 54 0B 75 -2,-0.7 -6,-0.2 -6,-0.2 3,-0.1 -0.716 20.9-121.0 -83.6 121.7 10.9 7.7 58.2 61 55 A E > - 0 0 42 -8,-2.4 3,-2.0 -2,-0.6 -1,-0.1 -0.182 38.7 -86.8 -60.4 148.5 10.5 3.9 57.8 62 56 A S T 3 S+ 0 0 110 1,-0.2 -1,-0.1 3,-0.0 0, 0.0 -0.352 115.4 23.6 -55.4 130.9 13.7 1.8 57.9 63 57 A G T 3 S+ 0 0 76 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.366 88.7 125.4 95.8 -6.3 15.3 1.6 54.5 64 58 A V S < S- 0 0 12 -3,-2.0 -1,-0.3 -11,-0.1 -11,-0.0 -0.735 71.5-102.7 -85.2 130.7 13.8 4.8 53.1 65 59 A P > - 0 0 46 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.224 24.2-122.3 -52.8 143.0 16.4 7.2 51.7 66 60 A D T 3 S+ 0 0 124 1,-0.3 16,-0.1 15,-0.0 -2,-0.0 0.628 104.0 79.2 -59.8 -16.1 17.2 10.2 54.1 67 61 A R T 3 S+ 0 0 27 16,-0.1 15,-2.0 14,-0.1 2,-0.5 0.686 78.9 80.9 -66.6 -17.5 16.2 12.6 51.3 68 62 A F E < +C 81 0A 3 -3,-1.9 2,-0.4 13,-0.2 13,-0.2 -0.824 60.6 173.7 -94.0 122.8 12.4 11.9 52.1 69 63 A T E -C 80 0A 60 11,-2.5 11,-2.7 -2,-0.5 2,-0.4 -0.991 17.6-156.2-135.0 127.4 11.2 13.9 55.1 70 64 A G E +C 79 0A 3 -2,-0.4 2,-0.3 -12,-0.3 9,-0.2 -0.812 23.0 162.3-100.4 141.9 7.7 14.2 56.4 71 65 A S E +C 78 0A 48 7,-2.5 7,-2.3 -2,-0.4 2,-0.2 -0.887 19.0 75.0-146.4 176.1 6.6 17.2 58.5 72 66 A G E -C 77 0A 41 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.454 45.8-134.6 108.2 176.4 3.5 19.0 59.7 73 67 A S E > +C 76 0A 65 3,-1.7 3,-1.9 -2,-0.2 2,-0.7 -0.974 60.0 6.2-166.5 156.8 0.8 18.6 62.3 74 68 A G T 3 S- 0 0 13 -2,-0.3 -45,-2.4 1,-0.3 -47,-0.1 -0.478 129.4 -9.8 71.9-107.1 -3.0 18.7 62.9 75 69 A T T 3 S+ 0 0 49 -2,-0.7 -50,-2.2 -47,-0.2 2,-0.4 0.403 124.9 65.3-103.6 -4.4 -4.6 19.3 59.5 76 70 A D E < +BC 24 73A 73 -3,-1.9 -3,-1.7 -52,-0.2 2,-0.3 -0.982 54.8 171.6-135.3 128.2 -1.6 20.1 57.3 77 71 A F E -BC 23 72A 1 -54,-2.8 -54,-2.5 -2,-0.4 2,-0.4 -0.923 11.7-158.8-135.5 153.7 1.3 17.9 56.3 78 72 A T E -BC 22 71A 39 -7,-2.3 -7,-2.5 -2,-0.3 2,-0.5 -0.993 8.5-158.4-137.1 137.6 4.2 18.1 53.9 79 73 A L E -BC 21 70A 0 -58,-2.4 -58,-2.1 -2,-0.4 2,-0.4 -0.987 18.6-168.9-112.6 126.8 6.5 15.6 52.2 80 74 A T E -BC 20 69A 27 -11,-2.7 -11,-2.5 -2,-0.5 2,-0.5 -0.946 9.3-166.9-115.1 133.0 9.8 17.0 51.1 81 75 A I E -BC 19 68A 0 -62,-2.6 -62,-2.9 -2,-0.4 3,-0.4 -0.982 10.2-163.3-116.6 115.4 12.3 15.3 48.8 82 76 A T S S+ 0 0 58 -15,-2.0 -64,-0.2 -2,-0.5 -65,-0.1 -0.686 72.4 10.6 -90.4 155.5 15.7 16.9 48.7 83 77 A S S S- 0 0 75 -67,-0.5 -1,-0.2 -2,-0.3 -65,-0.2 0.894 90.6-147.3 45.6 53.6 18.2 16.1 45.9 84 78 A V - 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