==== 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 24-AUG-07 2R2B . COMPND 2 MOLECULE: FAB, ANTIBODY FRAGMENT (IGG1K), LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR C.L.BROOKS,S.V.EVANS . 431 4 4 3 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19425.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 275 63.8 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 . 171 39.7 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 . 38 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 11 2.6 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 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 . 5 3 6 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 . 1 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 0 167 0, 0.0 2,-0.6 0, 0.0 101,-0.0 0.000 360.0 360.0 360.0 157.0 -15.9 11.1 57.0 2 2 A I - 0 0 5 97,-0.2 2,-0.5 94,-0.1 94,-0.1 -0.959 360.0-145.0-104.7 125.0 -12.4 12.7 57.1 3 3 A V - 0 0 68 -2,-0.6 23,-1.7 2,-0.0 2,-0.5 -0.782 10.8-161.1 -96.0 125.7 -11.6 14.3 53.8 4 4 A M E -A 25 0A 14 -2,-0.5 2,-0.4 99,-0.3 101,-0.2 -0.918 9.9-177.5-110.3 131.3 -8.0 14.1 52.6 5 5 A S E -A 24 0A 62 19,-2.5 19,-3.2 -2,-0.5 2,-0.3 -0.989 5.6-162.8-133.0 134.6 -6.8 16.5 49.9 6 6 A Q E -A 23 0A 26 -2,-0.4 17,-0.2 17,-0.2 87,-0.0 -0.859 14.2-122.4-117.8 151.9 -3.4 16.7 48.3 7 7 A S E S+A 22 0A 57 15,-2.0 15,-3.2 -2,-0.3 2,-0.2 -0.988 75.7 25.3-145.3 150.4 -1.6 19.3 46.3 8 8 A P - 0 0 46 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 0.729 64.1-147.0 -75.3 173.9 -0.3 19.8 43.7 9 9 A S S S- 0 0 94 1,-0.3 99,-2.6 -2,-0.2 2,-0.3 0.894 81.1 -13.4 -64.7 -41.3 -2.1 17.2 41.5 10 10 A S E +d 108 0B 62 97,-0.2 -1,-0.3 81,-0.0 2,-0.3 -0.983 64.8 169.1-157.2 157.3 1.1 16.9 39.5 11 11 A L E -d 109 0B 49 97,-1.9 99,-2.9 -2,-0.3 2,-0.4 -0.953 23.0-133.3-161.9 164.5 4.5 18.6 39.0 12 12 A A E -d 110 0B 48 -2,-0.3 2,-0.3 97,-0.2 99,-0.3 -0.989 21.4-177.8-127.1 138.0 7.9 17.9 37.3 13 13 A V E -d 111 0B 8 97,-2.1 99,-1.9 -2,-0.4 2,-0.2 -0.983 26.1-117.0-135.4 144.1 11.3 18.5 38.9 14 14 A S E > -d 112 0B 32 -2,-0.3 3,-2.2 97,-0.2 70,-0.2 -0.535 46.1 -88.0 -78.6 147.2 14.9 18.1 37.6 15 15 A A T 3 S+ 0 0 66 97,-0.7 70,-0.2 1,-0.3 -1,-0.1 -0.255 116.1 27.7 -50.1 136.4 17.2 15.6 39.2 16 16 A G T 3 S+ 0 0 52 68,-3.2 67,-0.5 1,-0.3 -1,-0.3 0.219 99.4 107.5 93.2 -12.9 19.0 17.2 42.2 17 17 A E S < S- 0 0 105 -3,-2.2 67,-2.7 67,-0.2 -1,-0.3 -0.401 72.5 -98.5 -94.4 173.1 16.3 19.7 43.0 18 18 A K - 0 0 140 65,-0.2 2,-0.4 64,-0.2 64,-0.2 -0.664 27.3-157.3 -95.6 147.3 13.9 19.8 45.9 19 19 A V E - B 0 81A 2 62,-2.8 62,-2.7 -2,-0.3 2,-0.4 -0.981 8.5-175.8-123.7 133.2 10.2 18.6 45.8 20 20 A T E + B 0 80A 79 -2,-0.4 2,-0.3 60,-0.2 60,-0.2 -0.999 8.9 167.0-127.1 130.7 7.5 19.8 48.2 21 21 A M E - B 0 79A 2 58,-2.2 58,-2.5 -2,-0.4 2,-0.3 -0.981 17.4-144.0-141.1 156.4 4.0 18.5 48.3 22 22 A S E -AB 7 78A 41 -15,-3.2 -15,-2.0 -2,-0.3 2,-0.4 -0.800 10.8-162.0-127.9 164.8 1.2 18.8 50.7 23 23 A a E -AB 6 77A 1 54,-2.5 54,-2.9 -2,-0.3 2,-0.4 -0.988 10.6-164.7-146.9 121.8 -1.7 16.9 52.3 24 24 A K E -AB 5 76A 105 -19,-3.2 -19,-2.5 -2,-0.4 2,-0.4 -0.914 4.3-156.4-111.0 139.3 -4.6 18.5 54.2 25 25 A S E -A 4 0A 3 50,-2.3 -21,-0.2 -2,-0.4 4,-0.1 -0.915 20.0-136.0-110.3 146.5 -7.1 16.7 56.4 26 26 A S S S+ 0 0 68 -23,-1.7 2,-0.3 -2,-0.4 -22,-0.1 0.640 95.0 33.4 -71.3 -15.1 -10.7 18.1 57.1 27 27 A Q S S- 0 0 89 -24,-0.2 -1,-0.1 47,-0.1 -25,-0.0 -0.983 101.6 -90.0-137.0 148.9 -10.1 17.2 60.8 28 28 A S - 0 0 55 -2,-0.3 47,-0.2 1,-0.1 -2,-0.1 -0.330 27.1-158.4 -56.3 135.4 -7.0 17.3 63.0 29 29 A L + 0 0 0 45,-2.4 9,-2.4 -4,-0.1 2,-0.8 0.206 53.4 120.8-100.4 11.9 -5.2 13.9 63.0 30 30 A L B -J 37 0C 70 7,-0.2 2,-0.4 8,-0.1 7,-0.3 -0.698 57.2-145.7 -83.4 108.5 -3.4 14.6 66.3 31 30AA N > - 0 0 29 5,-2.9 4,-1.7 -2,-0.8 5,-0.5 -0.640 2.6-152.4 -76.5 125.2 -4.4 11.8 68.8 32 30BA S T 4 S+ 0 0 106 -2,-0.4 -1,-0.1 2,-0.2 -2,-0.0 0.789 90.2 49.9 -73.1 -28.6 -4.6 13.4 72.2 33 30CA R T 4 S+ 0 0 187 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.920 123.8 26.7 -77.9 -43.4 -3.7 10.2 74.1 34 30DA T T 4 S- 0 0 33 2,-0.2 -2,-0.2 0, 0.0 -1,-0.2 0.593 96.2-136.1 -94.1 -15.7 -0.6 9.2 72.1 35 30EA R < + 0 0 196 -4,-1.7 2,-0.3 1,-0.2 -3,-0.2 0.741 63.9 118.9 64.4 29.6 0.3 12.8 71.0 36 30FA K - 0 0 65 -5,-0.5 -5,-2.9 -7,-0.1 2,-0.5 -0.886 67.7-119.8-123.1 153.9 1.0 11.6 67.5 37 31 A N B -J 30 0C 17 19,-0.4 2,-1.9 -2,-0.3 -7,-0.2 -0.841 21.3-139.5 -91.3 125.0 -0.5 12.6 64.1 38 32 A Y + 0 0 20 -9,-2.4 59,-2.1 -2,-0.5 60,-0.5 -0.524 59.1 125.4 -90.2 74.4 -2.0 9.5 62.4 39 33 A L E -E 96 0B 1 -2,-1.9 18,-3.2 57,-0.2 2,-0.3 -0.992 35.0-177.0-139.6 122.0 -0.8 10.4 59.0 40 34 A A E -E 95 0B 2 55,-2.5 55,-2.0 -2,-0.4 2,-0.4 -0.889 16.5-140.9-122.2 155.3 1.3 8.3 56.7 41 35 A W E -EF 94 54B 0 13,-2.8 12,-3.0 -2,-0.3 13,-1.5 -0.952 16.0-169.4-117.1 133.4 2.9 8.8 53.2 42 36 A Y E -EF 93 52B 0 51,-3.1 51,-2.5 -2,-0.4 2,-0.5 -0.928 10.7-148.4-119.1 144.5 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 -0.955 9.6-169.7-112.7 127.1 5.0 6.0 47.2 44 38 A Q E -E 91 0B 18 47,-2.9 47,-2.5 -2,-0.5 3,-0.1 -0.900 7.0-161.8-120.2 103.9 3.6 4.2 44.2 45 39 A K > - 0 0 27 -2,-0.6 3,-2.4 4,-0.4 45,-0.2 -0.420 45.4 -71.2 -77.9 156.7 6.1 3.8 41.3 46 40 A P T 3 S+ 0 0 45 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.229 119.4 1.9 -56.4 130.5 4.6 3.0 37.9 47 41 A G T 3 S+ 0 0 89 1,-0.2 2,-0.2 -3,-0.1 -2,-0.1 0.511 113.7 105.4 72.2 9.3 3.3 -0.6 37.7 48 42 A Q S < S- 0 0 111 -3,-2.4 -1,-0.2 1,-0.1 3,-0.1 -0.711 74.3-102.5-115.0 166.6 4.1 -1.2 41.4 49 43 A S - 0 0 26 -2,-0.2 -4,-0.4 1,-0.1 284,-0.1 -0.476 53.0 -87.8 -75.2 155.5 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 -0.350 43.2-151.8 -60.8 150.1 2.3 1.4 47.1 51 45 A K E -F 43 0B 98 -8,-2.2 -8,-2.8 279,-0.1 2,-0.2 -0.990 18.4-113.7-126.2 133.8 5.3 1.4 49.5 52 46 A L E +F 42 0B 7 -2,-0.4 -10,-0.2 277,-0.4 3,-0.1 -0.486 40.6 162.3 -66.6 130.4 5.3 2.9 53.0 53 47 A L E + 0 0 1 -12,-3.0 8,-2.6 1,-0.4 2,-0.3 0.766 62.1 8.1-108.0 -53.2 7.7 5.9 53.3 54 48 A I E -FG 41 60B 1 -13,-1.5 -13,-2.8 6,-0.2 -1,-0.4 -0.974 60.0-179.3-137.0 140.5 6.7 7.9 56.4 55 49 A Y E > + G 0 59B 14 4,-2.5 4,-2.5 -2,-0.3 3,-0.4 -0.916 67.2 34.5-139.4 169.6 4.3 7.4 59.3 56 50 A W T 4 S- 0 0 22 270,-0.5 2,-2.0 -2,-0.3 -19,-0.4 0.852 124.1 -79.5 50.9 37.7 3.2 9.3 62.4 57 51 A A T 4 S+ 0 0 2 -18,-3.2 -1,-0.3 1,-0.2 21,-0.1 -0.185 126.4 28.0 68.9 -41.6 3.7 12.3 60.1 58 52 A S T 4 S+ 0 0 80 -2,-2.0 2,-0.6 -3,-0.4 12,-0.2 0.420 83.9 110.4-133.2 -0.2 7.5 12.4 60.5 59 53 A T E < -G 55 0B 54 -4,-2.5 -4,-2.5 10,-0.1 2,-0.5 -0.750 57.0-145.5 -86.0 118.0 8.9 8.9 61.2 60 54 A R E -G 54 0B 86 -2,-0.6 -6,-0.2 -6,-0.2 3,-0.1 -0.714 20.4-121.1 -86.1 123.4 10.9 7.6 58.2 61 55 A E > - 0 0 42 -8,-2.6 3,-1.9 -2,-0.5 -1,-0.1 -0.261 37.9 -89.2 -63.5 147.7 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 -0.355 114.7 26.1 -57.4 133.8 13.7 1.8 57.9 63 57 A G T 3 S+ 0 0 79 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.263 90.0 123.3 97.1 -12.6 15.3 1.5 54.4 64 58 A V S < S- 0 0 13 -3,-1.9 -1,-0.3 -11,-0.1 -11,-0.0 -0.704 72.1-100.7 -83.9 129.1 13.7 4.7 53.1 65 59 A P > - 0 0 41 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.138 23.4-122.5 -49.6 141.5 16.3 7.2 51.7 66 60 A D T 3 S+ 0 0 129 1,-0.3 16,-0.1 -3,-0.0 -2,-0.0 0.684 104.5 76.2 -54.6 -22.6 17.2 10.1 54.0 67 61 A R T 3 S+ 0 0 27 14,-0.1 15,-2.1 16,-0.1 2,-0.6 0.653 79.1 82.3 -71.5 -12.2 16.1 12.6 51.3 68 62 A F E < +C 81 0A 2 -3,-1.9 2,-0.4 13,-0.2 13,-0.2 -0.845 59.5 174.0 -95.2 123.2 12.4 11.9 52.1 69 63 A T E -C 80 0A 59 11,-2.5 11,-2.6 -2,-0.6 2,-0.4 -0.992 17.6-156.0-134.0 126.8 11.2 13.9 55.1 70 64 A G E +C 79 0A 3 -2,-0.4 2,-0.3 -12,-0.2 9,-0.2 -0.811 23.1 162.9 -99.3 142.3 7.6 14.2 56.5 71 65 A S E +C 78 0A 50 7,-2.4 7,-2.4 -2,-0.4 2,-0.2 -0.899 19.3 74.6-146.5 174.0 6.5 17.2 58.5 72 66 A G E -C 77 0A 41 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.473 45.5-135.6 111.2 176.2 3.4 19.0 59.7 73 67 A S E > +C 76 0A 65 3,-1.7 3,-1.8 -2,-0.2 2,-0.8 -0.966 60.3 6.6-167.2 156.9 0.7 18.5 62.3 74 68 A G T 3 S- 0 0 13 -2,-0.3 -45,-2.4 1,-0.3 -47,-0.1 -0.505 129.7 -10.3 73.6-105.9 -3.0 18.7 62.9 75 69 A T T 3 S+ 0 0 48 -2,-0.8 -50,-2.3 -47,-0.2 2,-0.4 0.410 124.6 66.5-106.3 -5.8 -4.7 19.3 59.5 76 70 A D E < +BC 24 73A 75 -3,-1.8 -3,-1.7 -52,-0.2 2,-0.3 -0.972 54.5 172.0-134.5 126.9 -1.6 20.1 57.4 77 71 A F E -BC 23 72A 1 -54,-2.9 -54,-2.5 -2,-0.4 2,-0.4 -0.912 11.8-158.1-133.6 154.0 1.2 17.9 56.3 78 72 A T E -BC 22 71A 40 -7,-2.4 -7,-2.4 -2,-0.3 2,-0.5 -0.994 8.4-159.4-136.8 135.8 4.2 18.0 54.0 79 73 A L E -BC 21 70A 0 -58,-2.5 -58,-2.2 -2,-0.4 2,-0.4 -0.982 18.9-170.3-111.0 126.5 6.4 15.5 52.2 80 74 A T E -BC 20 69A 26 -11,-2.6 -11,-2.5 -2,-0.5 2,-0.6 -0.953 9.5-167.5-117.3 131.4 9.7 17.0 51.1 81 75 A I E -BC 19 68A 0 -62,-2.7 -62,-2.8 -2,-0.4 3,-0.4 -0.979 10.4-161.9-116.9 114.8 12.2 15.2 48.8 82 76 A T S S+ 0 0 59 -15,-2.1 -64,-0.2 -2,-0.6 -65,-0.1 -0.670 72.6 10.1 -87.4 155.6 15.7 16.9 48.7 83 77 A S S S- 0 0 77 -67,-0.5 -1,-0.2 -2,-0.3 -65,-0.2 0.889 90.9-145.9 45.4 53.4 18.1 16.1 45.9 84 78 A V - 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