==== 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 1KIP . 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) . 15459.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 230 65.3 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 . 99 28.1 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 . 29 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 11.4 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 . 6 1.7 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 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 . 3 2 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 0 124 0, 0.0 2,-0.5 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 169.7 24.9 -0.7 -1.9 2 2 A I - 0 0 31 93,-0.5 2,-0.3 90,-0.1 88,-0.1 -0.857 360.0-159.4 -92.6 123.7 27.6 1.7 -1.0 3 3 A V - 0 0 82 -2,-0.5 23,-2.2 94,-0.1 2,-0.5 -0.796 6.1-141.5-101.6 146.0 27.3 4.8 -3.2 4 4 A L E -A 25 0A 12 94,-0.5 2,-0.7 -2,-0.3 96,-0.4 -0.977 5.6-157.9-118.0 123.8 30.1 7.2 -3.7 5 5 A T E -A 24 0A 55 19,-2.4 19,-2.3 -2,-0.5 2,-0.4 -0.907 16.4-169.3 -96.5 105.5 29.6 11.0 -3.9 6 6 A Q E -A 23 0A 21 -2,-0.7 17,-0.2 17,-0.2 3,-0.1 -0.813 12.3-128.2-101.7 137.4 32.4 12.6 -5.8 7 7 A S E +A 22 0A 54 15,-2.2 15,-3.0 -2,-0.4 2,-0.1 -0.988 67.9 25.4-144.9 152.7 33.0 16.4 -6.0 8 8 A P - 0 0 53 0, 0.0 -1,-0.2 0, 0.0 95,-0.1 0.640 57.5-150.0 -92.1 166.7 33.5 18.6 -7.7 9 9 A A S S+ 0 0 71 93,-0.2 94,-1.9 1,-0.1 2,-0.3 0.809 85.1 2.8 -56.9 -36.1 31.9 17.7 -11.1 10 10 A S E -d 103 0B 60 92,-0.2 2,-0.3 75,-0.0 94,-0.2 -0.974 62.4-166.8-147.1 161.6 34.6 19.9 -12.9 11 11 A L E -d 104 0B 34 92,-2.3 94,-3.3 -2,-0.3 2,-0.5 -0.980 8.9-153.7-150.7 134.9 37.6 21.9 -11.9 12 12 A S E +d 105 0B 72 -2,-0.3 2,-0.3 92,-0.2 94,-0.2 -0.984 29.7 159.9-113.6 130.4 39.5 24.5 -14.1 13 13 A A E -d 106 0B 0 92,-2.9 94,-1.8 -2,-0.5 2,-0.3 -0.961 34.4-122.5-146.8 165.9 43.1 24.9 -13.1 14 14 A S > - 0 0 35 -2,-0.3 3,-1.8 92,-0.2 64,-0.2 -0.700 44.7 -86.3-105.4 160.2 46.3 26.2 -14.4 15 15 A V T 3 S+ 0 0 76 -2,-0.3 64,-0.2 1,-0.3 -1,-0.1 -0.349 115.9 33.0 -64.9 138.8 49.5 24.2 -14.7 16 16 A G T 3 S+ 0 0 46 62,-2.9 61,-0.4 1,-0.3 -1,-0.3 0.304 93.2 119.1 96.5 -12.6 51.5 24.4 -11.4 17 17 A E < - 0 0 62 -3,-1.8 61,-3.3 61,-0.3 2,-0.4 -0.443 60.5-129.1 -86.2 160.3 48.4 24.6 -9.2 18 18 A T - 0 0 71 58,-0.2 2,-0.3 59,-0.2 58,-0.2 -0.924 29.7-178.1-107.3 131.5 47.4 22.1 -6.6 19 19 A V E - B 0 75A 9 56,-2.1 56,-2.6 -2,-0.4 2,-0.4 -0.885 14.9-149.9-126.8 169.8 43.9 20.6 -6.7 20 20 A T E - B 0 74A 68 -2,-0.3 2,-0.4 54,-0.2 54,-0.2 -0.995 5.1-168.3-143.6 129.1 41.9 18.2 -4.6 21 21 A I E - B 0 73A 0 52,-2.7 52,-2.6 -2,-0.4 2,-0.3 -0.897 15.5-157.6-117.0 140.1 39.1 15.8 -5.6 22 22 A T E -AB 7 72A 40 -15,-3.0 -15,-2.2 -2,-0.4 2,-0.4 -0.886 14.7-171.1-123.0 155.8 36.9 14.1 -3.0 23 23 A a E -AB 6 71A 0 48,-2.5 48,-2.8 -2,-0.3 2,-0.5 -0.978 9.1-162.0-142.8 125.8 34.8 11.0 -2.8 24 24 A R E -AB 5 70A 117 -19,-2.3 -19,-2.4 -2,-0.4 2,-0.3 -0.967 13.1-141.2-114.6 124.4 32.6 10.4 0.2 25 25 A A E -A 4 0A 4 44,-3.0 -21,-0.2 -2,-0.5 4,-0.1 -0.646 10.7-138.8 -86.9 142.7 31.3 6.8 0.8 26 26 A S S S+ 0 0 81 -23,-2.2 2,-0.3 -2,-0.3 -1,-0.1 0.583 91.8 20.3 -73.3 -6.7 27.8 6.1 2.0 27 27 A G S S- 0 0 23 -24,-0.2 2,-0.2 41,-0.1 -2,-0.1 -0.949 104.7 -74.6-152.5 165.0 29.3 3.4 4.3 28 28 A N - 0 0 76 -2,-0.3 41,-0.2 1,-0.2 -2,-0.1 -0.494 40.0-179.7 -66.8 128.7 32.7 2.5 5.7 29 29 A I > - 0 0 0 39,-1.7 3,-2.2 -2,-0.2 62,-0.2 0.239 35.2-132.5-110.9 3.7 34.8 1.1 2.9 30 30 A H T 3 - 0 0 71 38,-0.4 39,-0.1 1,-0.3 3,-0.1 0.799 65.5 -53.2 47.6 48.4 37.7 0.6 5.2 31 31 A N T 3 S+ 0 0 40 37,-0.4 2,-1.9 1,-0.2 -1,-0.3 0.520 97.9 133.5 71.2 2.7 40.3 2.1 2.8 32 32 A Y < + 0 0 9 -3,-2.2 59,-2.7 18,-0.2 2,-0.4 -0.576 36.9 127.8 -85.7 73.3 39.4 -0.1 -0.2 33 33 A L E -E 90 0B 1 -2,-1.9 18,-2.8 57,-0.2 2,-0.3 -0.999 36.7-172.8-137.7 131.8 39.4 2.9 -2.5 34 34 A A E -E 89 0B 0 55,-2.6 55,-2.1 -2,-0.4 2,-0.4 -0.892 11.7-145.3-118.9 157.7 41.1 3.4 -5.8 35 35 A W E -EF 88 48B 0 13,-2.7 12,-2.9 -2,-0.3 13,-1.4 -0.955 13.7-165.7-126.1 139.2 41.5 6.4 -8.1 36 36 A Y E -EF 87 46B 0 51,-2.9 51,-1.8 -2,-0.4 2,-0.5 -0.954 12.2-146.0-125.4 146.8 41.7 6.3 -11.9 37 37 A Q E -EF 86 45B 15 8,-2.7 8,-1.5 -2,-0.4 2,-0.5 -0.917 13.4-172.9-105.7 132.6 42.7 8.8 -14.5 38 38 A Q E -E 85 0B 20 47,-2.7 47,-2.8 -2,-0.5 2,-0.2 -0.958 7.1-162.5-125.8 110.0 40.9 8.7 -17.9 39 39 A K > - 0 0 72 -2,-0.5 3,-1.9 4,-0.4 45,-0.1 -0.564 48.2 -64.0 -82.3 163.7 42.3 11.0 -20.7 40 40 A Q T 3 S- 0 0 197 1,-0.3 -1,-0.1 -2,-0.2 3,-0.1 -0.194 121.3 -3.5 -51.3 116.8 40.2 12.0 -23.7 41 41 A G T 3 S+ 0 0 83 1,-0.3 -1,-0.3 -3,-0.1 2,-0.3 0.726 109.8 106.3 70.6 24.8 39.5 8.8 -25.7 42 42 A K S < S- 0 0 133 -3,-1.9 -1,-0.3 3,-0.0 3,-0.1 -0.782 72.2-102.4-124.7 171.3 41.5 6.3 -23.6 43 43 A S - 0 0 31 -2,-0.3 -4,-0.4 1,-0.2 173,-0.1 -0.559 54.8 -76.5 -93.6 156.0 40.5 3.7 -21.1 44 44 A P - 0 0 4 0, 0.0 2,-0.4 0, 0.0 -6,-0.2 -0.085 45.8-151.9 -47.0 153.9 40.8 4.3 -17.3 45 45 A Q E -F 37 0B 106 -8,-1.5 -8,-2.7 -3,-0.1 2,-0.2 -0.979 17.4-116.9-136.4 124.9 44.3 4.1 -15.8 46 46 A L E +F 36 0B 16 -2,-0.4 -10,-0.2 165,-0.3 3,-0.1 -0.350 39.3 161.3 -62.4 130.8 45.0 3.1 -12.2 47 47 A L E + 0 0 4 -12,-2.9 8,-3.1 1,-0.4 2,-0.4 0.806 63.0 8.7-110.3 -48.4 46.6 5.9 -10.2 48 48 A V E -FG 35 54B 0 -13,-1.4 -13,-2.7 6,-0.3 -1,-0.4 -0.999 58.6-174.0-142.4 139.8 46.2 5.0 -6.5 49 49 A Y E > + G 0 53B 31 4,-2.9 4,-2.2 -2,-0.4 3,-0.5 -0.928 67.9 25.4-134.7 159.4 44.9 2.0 -4.7 50 50 A Y T 4 S- 0 0 30 159,-0.3 2,-2.0 -2,-0.3 -16,-0.2 0.894 122.8 -74.9 51.0 47.0 44.2 1.2 -1.0 51 51 A T T 4 S+ 0 0 1 -18,-2.8 -1,-0.2 1,-0.2 21,-0.1 -0.160 127.7 25.8 67.6 -38.5 43.7 4.9 -0.4 52 52 A T T 4 S+ 0 0 82 -2,-2.0 2,-0.6 -3,-0.5 12,-0.3 0.416 87.3 111.2-135.0 -6.6 47.2 6.1 -0.5 53 53 A T E < -G 49 0B 29 -4,-2.2 -4,-2.9 10,-0.1 2,-0.2 -0.718 56.5-141.1 -85.6 122.3 49.2 3.7 -2.6 54 54 A L E -G 48 0B 52 -2,-0.6 -6,-0.3 -6,-0.2 3,-0.1 -0.523 18.6-118.9 -79.3 141.6 50.6 4.9 -5.9 55 55 A A > - 0 0 14 -8,-3.1 3,-1.6 -2,-0.2 -1,-0.1 -0.355 46.3 -83.2 -72.4 160.8 50.5 2.6 -8.9 56 56 A D T 3 S+ 0 0 166 1,-0.3 -1,-0.1 -2,-0.1 0, 0.0 -0.340 117.9 20.5 -64.1 146.9 53.9 1.9 -10.4 57 57 A G T 3 S+ 0 0 84 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.231 92.3 125.8 81.4 -17.2 55.1 4.6 -12.8 58 58 A V < - 0 0 21 -3,-1.6 -1,-0.2 -11,-0.1 2,-0.1 -0.614 63.8-113.7 -77.7 130.7 52.7 7.1 -11.3 59 59 A P > - 0 0 49 0, 0.0 3,-2.4 0, 0.0 -1,-0.1 -0.334 15.6-117.8 -71.5 147.9 54.4 10.4 -10.2 60 60 A S T 3 S+ 0 0 111 1,-0.3 16,-0.0 -2,-0.1 -2,-0.0 0.479 101.7 85.4 -59.6 -7.3 54.7 11.5 -6.6 61 61 A R T 3 S+ 0 0 54 14,-0.1 15,-2.3 16,-0.1 2,-0.4 0.700 82.3 75.1 -72.1 -11.8 52.7 14.6 -7.3 62 62 A F E < +C 75 0A 6 -3,-2.4 2,-0.3 13,-0.2 13,-0.2 -0.768 58.8 162.4 -97.0 140.0 49.7 12.4 -6.7 63 63 A S E -C 74 0A 45 11,-1.7 11,-2.8 -2,-0.4 2,-0.3 -0.973 18.7-156.4-154.8 139.6 48.7 11.4 -3.2 64 64 A G E +C 73 0A 8 -2,-0.3 2,-0.3 -12,-0.3 9,-0.2 -0.783 16.3 168.2-113.6 164.3 45.5 10.0 -1.7 65 65 A S E +C 72 0A 65 7,-1.9 7,-2.5 -2,-0.3 2,-0.2 -0.962 17.3 95.7-162.6 169.9 44.2 10.1 1.8 66 66 A G E -C 71 0A 28 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.596 36.0-144.3 130.1 174.5 41.2 9.5 4.0 67 67 A S E > +C 70 0A 82 3,-1.3 3,-1.6 -2,-0.2 2,-0.7 -0.954 67.3 8.2-163.0 171.1 39.7 6.8 6.2 68 68 A G T 3 S- 0 0 24 -2,-0.3 -39,-1.7 1,-0.2 -37,-0.4 -0.326 131.3 -19.7 51.7 -97.5 36.3 5.5 7.1 69 69 A T T 3 S+ 0 0 58 -2,-0.7 -44,-3.0 -41,-0.2 2,-0.5 0.458 116.6 70.7-126.7 -3.4 34.1 7.5 4.6 70 70 A Q E < +BC 24 67A 106 -3,-1.6 -3,-1.3 -46,-0.2 2,-0.4 -0.977 55.4 178.6-119.3 127.3 35.8 10.6 3.1 71 71 A Y E -BC 23 66A 0 -48,-2.8 -48,-2.5 -2,-0.5 2,-0.3 -0.983 7.4-161.9-126.6 143.6 38.6 10.2 0.7 72 72 A S E -BC 22 65A 30 -7,-2.5 -7,-1.9 -2,-0.4 2,-0.5 -0.943 13.0-156.4-130.8 148.9 40.7 12.7 -1.3 73 73 A L E -BC 21 64A 0 -52,-2.6 -52,-2.7 -2,-0.3 2,-0.4 -0.992 19.0-166.1-118.1 124.4 43.0 12.8 -4.3 74 74 A K E -BC 20 63A 83 -11,-2.8 -11,-1.7 -2,-0.5 2,-0.5 -0.965 7.2-165.5-116.1 135.2 45.5 15.6 -4.2 75 75 A I E -BC 19 62A 0 -56,-2.6 -56,-2.1 -2,-0.4 2,-0.4 -0.983 9.6-158.3-118.6 118.4 47.5 16.7 -7.3 76 76 A N S S- 0 0 45 -15,-2.3 -58,-0.2 -2,-0.5 -59,-0.1 -0.844 72.1 -1.6 -98.3 135.8 50.4 19.0 -6.6 77 77 A S S S- 0 0 64 -2,-0.4 -1,-0.2 -61,-0.4 -59,-0.2 0.971 89.0-141.3 54.2 58.0 51.9 21.2 -9.3 78 78 A L - 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