==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER COMPLEX (IMMUNOGLOBULIN/HYDROLASE) 23-OCT-96 1KIR . COMPND 2 MOLECULE: MONOCLONAL ANTIBODY D1.3; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR B.A.FIELDS,R.J.POLJAK,R.A.MARIUZZA . 352 3 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15222.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 233 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 98 27.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 30 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 37 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 0 0 1 0 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 . 4 1 6 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 1 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 0 118 0, 0.0 2,-0.6 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 162.6 25.1 -0.6 -2.1 2 2 A I - 0 0 33 93,-0.4 2,-0.3 90,-0.2 88,-0.1 -0.846 360.0-156.6 -90.2 120.9 27.7 1.8 -0.9 3 3 A V - 0 0 82 -2,-0.6 23,-2.3 94,-0.0 2,-0.5 -0.750 4.6-140.1 -97.3 147.8 27.3 4.8 -3.1 4 4 A L E -A 25 0A 10 94,-0.5 2,-0.7 -2,-0.3 96,-0.3 -0.966 5.5-156.8-113.3 126.7 30.3 7.2 -3.6 5 5 A T E -A 24 0A 63 19,-3.1 19,-2.2 -2,-0.5 2,-0.3 -0.930 17.9-169.1-105.4 106.2 29.6 11.0 -3.8 6 6 A Q E -A 23 0A 21 -2,-0.7 17,-0.2 17,-0.2 94,-0.1 -0.746 13.7-122.9 -98.4 137.0 32.5 12.6 -5.8 7 7 A S E +A 22 0A 55 15,-2.4 15,-2.7 -2,-0.3 2,-0.1 -0.996 65.3 17.6-150.2 152.9 33.1 16.3 -6.0 8 8 A P - 0 0 52 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.654 55.9-148.3 -89.0 176.2 33.4 18.6 -7.6 9 9 A A S S+ 0 0 75 93,-0.2 94,-2.8 1,-0.2 2,-0.3 0.899 83.0 14.1 -67.6 -41.3 32.1 17.8 -11.1 10 10 A S E -d 103 0B 62 92,-0.3 2,-0.3 75,-0.0 94,-0.2 -0.926 61.2-166.8-134.0 157.8 34.6 20.1 -12.9 11 11 A L E -d 104 0B 37 92,-2.3 94,-3.3 -2,-0.3 2,-0.5 -0.976 6.2-159.5-149.2 127.8 37.8 21.9 -12.0 12 12 A S E +d 105 0B 72 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.957 30.6 154.5-109.5 126.7 39.5 24.6 -14.0 13 13 A A E -d 106 0B 0 92,-2.4 94,-2.5 -2,-0.5 2,-0.3 -0.980 35.6-123.4-150.8 163.9 43.1 24.9 -13.1 14 14 A S > - 0 0 36 -2,-0.3 3,-2.1 92,-0.2 64,-0.3 -0.729 43.0 -85.9-107.0 158.1 46.5 26.1 -14.4 15 15 A V T 3 S+ 0 0 76 -2,-0.3 64,-0.2 1,-0.3 3,-0.1 -0.383 118.2 32.9 -59.7 133.7 49.8 24.2 -14.7 16 16 A G T 3 S+ 0 0 44 62,-2.4 61,-0.3 1,-0.4 -1,-0.3 0.179 92.4 118.2 101.0 -21.3 51.5 24.6 -11.4 17 17 A E < - 0 0 59 -3,-2.1 61,-3.1 61,-0.2 2,-0.4 -0.416 58.9-133.7 -76.7 160.3 48.4 24.6 -9.2 18 18 A T - 0 0 70 59,-0.2 2,-0.3 58,-0.2 58,-0.2 -0.918 28.6-175.8-113.1 131.5 47.6 22.1 -6.6 19 19 A V E - B 0 75A 9 56,-1.9 56,-2.8 -2,-0.4 2,-0.4 -0.934 15.2-146.3-129.6 165.2 44.0 20.6 -6.6 20 20 A T E - B 0 74A 73 -2,-0.3 2,-0.4 54,-0.2 54,-0.2 -0.991 7.1-170.4-136.3 131.8 41.9 18.2 -4.5 21 21 A I E - B 0 73A 0 52,-2.7 52,-2.4 -2,-0.4 2,-0.3 -0.927 15.4-157.8-118.8 140.2 39.2 15.8 -5.5 22 22 A T E -AB 7 72A 37 -15,-2.7 -15,-2.4 -2,-0.4 2,-0.4 -0.897 15.2-167.6-125.8 153.0 37.1 14.1 -3.0 23 23 A a E -AB 6 71A 0 48,-2.6 48,-2.7 -2,-0.3 2,-0.5 -0.993 8.5-162.7-133.0 125.0 34.9 11.0 -2.7 24 24 A R E -AB 5 70A 120 -19,-2.2 -19,-3.1 -2,-0.4 2,-0.3 -0.964 13.4-145.3-109.7 128.5 32.6 10.5 0.3 25 25 A A E -A 4 0A 5 44,-2.7 -21,-0.2 -2,-0.5 4,-0.0 -0.732 12.7-135.8 -93.9 143.5 31.4 6.9 0.8 26 26 A S S S+ 0 0 79 -23,-2.3 2,-0.3 -2,-0.3 -22,-0.1 0.487 91.9 12.7 -75.5 -3.1 27.8 6.2 2.1 27 27 A G S S- 0 0 24 -24,-0.2 2,-0.2 41,-0.1 -1,-0.0 -0.952 105.0 -69.1-162.4 162.9 29.3 3.6 4.4 28 28 A N - 0 0 73 -2,-0.3 41,-0.2 1,-0.1 40,-0.1 -0.387 38.8-179.3 -66.5 122.7 32.8 2.6 5.7 29 29 A I > - 0 0 0 39,-1.7 3,-2.4 -2,-0.2 62,-0.3 0.164 36.1-130.1-107.0 9.1 34.9 1.1 2.9 30 30 A H T 3 - 0 0 48 38,-0.3 3,-0.1 1,-0.3 39,-0.1 0.723 65.4 -55.5 48.9 42.3 37.9 0.5 5.1 31 31 A N T 3 S+ 0 0 50 37,-0.3 2,-1.6 1,-0.2 -1,-0.3 0.562 97.5 132.9 71.3 6.8 40.5 2.0 2.8 32 32 A Y < + 0 0 15 -3,-2.4 59,-2.6 18,-0.2 2,-0.4 -0.648 37.9 127.1 -86.3 73.7 39.6 -0.2 -0.2 33 33 A L E -E 90 0B 0 -2,-1.6 18,-2.8 57,-0.2 2,-0.3 -0.999 36.5-173.4-137.0 134.8 39.5 2.8 -2.5 34 34 A A E -E 89 0B 1 55,-2.1 55,-1.8 -2,-0.4 2,-0.4 -0.911 11.7-145.1-124.9 157.2 41.3 3.4 -5.8 35 35 A W E -EF 88 48B 0 13,-2.6 12,-3.0 -2,-0.3 13,-1.4 -0.937 13.4-167.4-125.5 141.0 41.6 6.3 -8.2 36 36 A Y E -EF 87 46B 0 51,-2.4 51,-1.9 -2,-0.4 2,-0.4 -0.958 11.7-147.3-124.9 150.9 41.8 6.3 -12.0 37 37 A Q E -EF 86 45B 14 8,-2.6 8,-2.0 -2,-0.3 2,-0.4 -0.924 12.7-170.8-112.9 140.1 42.7 8.8 -14.7 38 38 A Q E -E 85 0B 19 47,-2.3 47,-2.7 -2,-0.4 2,-0.2 -0.992 6.8-160.7-132.5 119.6 41.1 8.8 -18.1 39 39 A K > - 0 0 81 4,-0.4 3,-2.5 -2,-0.4 45,-0.1 -0.658 49.9 -53.4 -97.8 163.0 42.4 11.0 -20.9 40 40 A Q T 3 S- 0 0 195 1,-0.3 -1,-0.2 -2,-0.2 3,-0.1 -0.040 123.4 -15.9 -38.8 110.0 40.5 12.0 -24.1 41 41 A G T 3 S+ 0 0 80 1,-0.2 -1,-0.3 -3,-0.1 2,-0.3 0.766 109.2 118.0 58.0 36.6 39.3 8.7 -25.6 42 42 A K < - 0 0 133 -3,-2.5 -1,-0.2 1,-0.0 3,-0.1 -0.793 69.1 -97.2-123.5 167.2 41.6 6.4 -23.6 43 43 A S - 0 0 38 -2,-0.3 -4,-0.4 1,-0.1 173,-0.1 -0.433 53.9 -86.0 -79.9 158.7 40.8 3.6 -21.1 44 44 A P - 0 0 6 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.264 43.7-150.1 -61.6 154.6 40.9 4.4 -17.4 45 45 A Q E -F 37 0B 99 -8,-2.0 -8,-2.6 -3,-0.1 2,-0.1 -0.985 15.2-118.2-132.2 127.1 44.3 4.1 -15.8 46 46 A L E +F 36 0B 15 -2,-0.4 -10,-0.3 165,-0.3 3,-0.1 -0.362 37.2 163.4 -64.7 136.5 45.0 3.2 -12.3 47 47 A L E + 0 0 2 -12,-3.0 8,-3.0 1,-0.4 2,-0.4 0.750 64.2 10.1-115.0 -47.0 46.8 5.8 -10.2 48 48 A V E -FG 35 54B 0 -13,-1.4 -13,-2.6 6,-0.3 -1,-0.4 -0.991 59.0-176.6-142.5 139.9 46.3 4.9 -6.6 49 49 A Y E > + G 0 53B 26 4,-2.7 4,-2.4 -2,-0.4 3,-0.3 -0.909 67.9 28.2-134.2 160.0 44.9 2.0 -4.8 50 50 A S T 4 S- 0 0 24 159,-0.4 2,-2.3 -2,-0.3 -16,-0.2 0.891 121.5 -78.0 55.6 41.2 44.3 1.1 -1.1 51 51 A T T 4 S+ 0 0 1 -18,-2.8 -1,-0.3 1,-0.2 21,-0.1 -0.264 126.3 28.7 70.1 -46.5 43.8 4.9 -0.5 52 52 A T T 4 S+ 0 0 84 -2,-2.3 2,-0.6 -3,-0.3 12,-0.3 0.402 87.8 106.5-124.5 -7.1 47.5 5.9 -0.5 53 53 A T E < -G 49 0B 36 -4,-2.4 -4,-2.7 10,-0.1 2,-0.2 -0.757 57.7-141.5 -89.7 123.2 49.5 3.6 -2.7 54 54 A L E -G 48 0B 50 -2,-0.6 -6,-0.3 -6,-0.2 2,-0.1 -0.485 18.6-121.0 -76.7 143.1 50.7 4.8 -6.0 55 55 A A > - 0 0 16 -8,-3.0 3,-1.6 -2,-0.2 -1,-0.1 -0.423 48.2 -78.6 -74.3 161.2 50.6 2.5 -9.0 56 56 A D T 3 S+ 0 0 157 1,-0.2 -1,-0.2 -2,-0.1 0, 0.0 -0.277 118.0 18.2 -61.2 147.6 54.0 1.9 -10.6 57 57 A G T 3 S+ 0 0 86 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.302 91.2 130.5 74.1 -12.0 55.2 4.6 -12.9 58 58 A V < - 0 0 13 -3,-1.6 -1,-0.2 -11,-0.1 -4,-0.1 -0.654 61.9-115.4 -78.7 119.5 52.7 7.1 -11.3 59 59 A P > - 0 0 52 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.165 15.7-116.5 -58.4 150.1 54.6 10.4 -10.4 60 60 A S T 3 S+ 0 0 112 1,-0.3 -2,-0.0 -6,-0.0 16,-0.0 0.549 102.1 82.9 -62.8 -14.3 54.9 11.6 -6.8 61 61 A R T 3 S+ 0 0 56 14,-0.1 15,-2.4 16,-0.1 2,-0.4 0.696 80.7 77.3 -67.3 -15.9 52.9 14.7 -7.4 62 62 A F E < +C 75 0A 6 -3,-1.9 2,-0.3 13,-0.2 13,-0.2 -0.795 61.4 171.2 -92.9 135.2 49.8 12.5 -6.9 63 63 A S E -C 74 0A 44 11,-2.3 11,-3.1 -2,-0.4 2,-0.3 -0.999 15.6-155.9-144.2 140.5 48.9 11.6 -3.3 64 64 A G E +C 73 0A 11 -2,-0.3 2,-0.3 -12,-0.3 9,-0.2 -0.849 17.9 161.7-117.8 151.3 45.9 9.9 -1.7 65 65 A S E +C 72 0A 65 7,-2.2 7,-3.0 -2,-0.3 2,-0.2 -0.930 14.7 105.0-155.3 173.3 44.5 10.1 1.7 66 66 A G E -C 71 0A 29 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.530 33.2-149.9 131.5 166.9 41.3 9.4 3.7 67 67 A S E > +C 70 0A 84 3,-1.5 3,-1.9 -2,-0.2 2,-0.7 -0.962 65.2 0.3-161.3 163.7 39.9 6.9 6.2 68 68 A G T 3 S- 0 0 25 -2,-0.3 -39,-1.7 1,-0.2 -37,-0.3 -0.294 132.2 -19.1 54.3 -95.3 36.5 5.5 7.1 69 69 A T T 3 S+ 0 0 59 -2,-0.7 -44,-2.7 -41,-0.2 2,-0.5 0.396 118.0 75.7-127.8 -0.4 34.2 7.5 4.6 70 70 A Q E < +BC 24 67A 99 -3,-1.9 -3,-1.5 -46,-0.2 2,-0.3 -0.979 57.0 178.8-118.1 124.7 36.0 10.6 3.4 71 71 A Y E -BC 23 66A 0 -48,-2.7 -48,-2.6 -2,-0.5 2,-0.4 -0.969 6.2-165.1-128.8 145.6 38.7 10.1 0.7 72 72 A S E -BC 22 65A 27 -7,-3.0 -7,-2.2 -2,-0.3 2,-0.5 -0.975 16.8-160.8-139.0 144.4 41.0 12.5 -1.3 73 73 A L E -BC 21 64A 0 -52,-2.4 -52,-2.7 -2,-0.4 2,-0.4 -0.979 19.2-166.7-116.7 125.4 43.2 12.7 -4.2 74 74 A K E -BC 20 63A 81 -11,-3.1 -11,-2.3 -2,-0.5 2,-0.5 -0.949 6.8-163.1-115.3 132.5 45.7 15.6 -4.2 75 75 A I E -BC 19 62A 0 -56,-2.8 -56,-1.9 -2,-0.4 2,-0.6 -0.983 10.3-153.9-114.9 118.7 47.7 16.7 -7.3 76 76 A N S S- 0 0 51 -15,-2.4 -58,-0.2 -2,-0.5 -59,-0.1 -0.862 73.2 -8.6 -96.1 121.6 50.7 19.0 -6.5 77 77 A S S S- 0 0 57 -2,-0.6 -1,-0.3 -61,-0.3 -59,-0.2 0.995 88.4-130.0 54.6 75.7 51.8 21.3 -9.3 78 78 A L - 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