==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ALLERGEN 02-NOV-04 1XWV . COMPND 2 MOLECULE: DER F II; . SOURCE 2 ORGANISM_SCIENTIFIC: DERMATOPHAGOIDES FARINAE; . AUTHOR B.R.JOHANNESSEN,L.K.SKOV,J.S.KASTRUP,O.KRISTENSEN,C.BOLWIG, . 258 2 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14568.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 175 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 100 38.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.6 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 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 2 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 PARALLEL BRIDGES PER LADDER . 8 2 2 0 2 0 2 2 2 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 . 0 2 2 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 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 95 0, 0.0 17,-2.4 0, 0.0 20,-0.2 0.000 360.0 360.0 360.0-178.0 -1.1 19.8 9.6 2 2 A Q B -A 17 0A 102 15,-0.2 21,-2.8 20,-0.0 2,-0.3 -0.508 360.0-161.6 -69.6 140.0 1.9 19.2 7.3 3 3 A V B -d 23 0B 16 13,-2.4 2,-0.4 19,-0.2 13,-0.4 -0.885 20.1-103.3-125.9 158.5 4.6 17.1 9.0 4 4 A D + 0 0 82 19,-2.8 2,-0.3 -2,-0.3 119,-0.3 -0.630 42.7 168.2 -81.9 129.1 8.3 16.4 8.5 5 5 A V - 0 0 53 -2,-0.4 2,-0.5 117,-0.1 117,-0.2 -0.937 32.8-122.6-136.0 159.5 9.3 13.1 6.9 6 6 A K E -E 121 0C 148 115,-2.9 115,-3.1 -2,-0.3 2,-0.4 -0.893 28.2-129.6-103.4 131.7 12.5 11.7 5.5 7 7 A D E -E 120 0C 54 -2,-0.5 113,-0.3 113,-0.2 111,-0.0 -0.661 22.2-177.1 -86.5 128.5 12.3 10.5 1.8 8 8 A a S S+ 0 0 51 111,-2.0 112,-0.2 -2,-0.4 2,-0.1 0.027 71.7 32.8-113.3 27.2 13.6 7.0 1.1 9 9 A A S S- 0 0 40 110,-0.4 109,-0.1 108,-0.1 -2,-0.1 -0.212 120.6 -47.4-141.4-120.3 13.2 6.9 -2.6 10 10 A N S S- 0 0 117 107,-0.1 -2,-0.0 -2,-0.1 108,-0.0 -0.109 79.8 -90.0-122.1 39.2 13.5 9.8 -5.1 11 11 A N S S+ 0 0 101 108,-0.2 31,-0.1 1,-0.1 107,-0.1 0.760 75.8 144.2 65.0 27.7 11.5 12.6 -3.6 12 12 A E + 0 0 16 29,-0.1 30,-2.2 105,-0.1 2,-0.4 0.831 50.7 84.7 -65.9 -31.1 8.3 11.6 -5.3 13 13 A I E + B 0 41A 31 28,-0.2 28,-0.3 106,-0.2 3,-0.1 -0.586 54.5 179.6 -75.8 127.8 6.3 12.7 -2.2 14 14 A K E + 0 0 107 26,-3.1 2,-0.3 -2,-0.4 27,-0.2 0.719 64.4 3.4 -99.8 -29.6 5.6 16.4 -2.2 15 15 A K E - B 0 40A 77 25,-1.4 25,-2.5 2,-0.0 2,-0.4 -0.958 55.2-163.5-159.7 138.9 3.6 16.9 1.0 16 16 A V E - B 0 39A 12 -13,-0.4 -13,-2.4 -2,-0.3 2,-0.4 -0.996 10.9-173.8-128.2 134.0 2.6 14.8 3.9 17 17 A M E -AB 2 38A 56 21,-3.3 21,-2.5 -2,-0.4 2,-0.4 -0.963 5.6-169.7-125.8 144.7 -0.2 15.8 6.4 18 18 A V E > - B 0 37A 8 -17,-2.4 3,-2.3 -2,-0.4 19,-0.2 -0.981 30.9-114.5-137.7 121.5 -1.2 14.1 9.6 19 19 A D T 3 S+ 0 0 107 17,-2.5 17,-0.3 -2,-0.4 3,-0.1 -0.341 101.7 10.6 -56.9 123.5 -4.4 15.1 11.5 20 20 A G T 3 S+ 0 0 84 1,-0.3 8,-0.3 -2,-0.1 2,-0.3 0.380 110.9 98.6 90.0 -4.2 -3.4 16.5 14.9 21 21 A b < - 0 0 8 -3,-2.3 2,-0.3 -20,-0.2 -3,-0.3 -0.809 51.5-159.5-118.0 160.7 0.3 16.8 14.1 22 22 A H > - 0 0 76 -2,-0.3 3,-2.3 4,-0.2 -19,-0.2 -0.984 41.9 -59.2-146.6 133.1 2.6 19.6 13.0 23 23 A G B 3 S-d 3 0B 16 -21,-2.8 -19,-2.8 -2,-0.3 -1,-0.0 -0.057 111.7 -22.1 40.9-123.2 6.1 19.9 11.4 24 24 A S T 3 S+ 0 0 67 -21,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.213 102.9 123.6-101.1 13.5 8.8 18.3 13.3 25 25 A D S < S- 0 0 22 -3,-2.3 -21,-0.1 1,-0.1 -3,-0.1 -0.292 82.3 -83.7 -68.1 157.7 6.9 18.3 16.6 26 26 A P - 0 0 32 0, 0.0 2,-0.8 0, 0.0 -4,-0.2 -0.483 47.6-136.3 -62.3 137.1 6.4 15.0 18.3 27 27 A b E -j 125 0D 12 97,-2.6 99,-2.5 -6,-0.1 2,-0.5 -0.877 16.0-143.5-103.8 105.8 3.4 13.5 16.6 28 28 A I E -j 126 0D 40 -2,-0.8 2,-0.6 -8,-0.3 99,-0.2 -0.574 12.7-166.2 -77.6 122.1 1.1 12.0 19.2 29 29 A I E -j 127 0D 24 97,-3.9 99,-2.4 -2,-0.5 2,-0.7 -0.940 10.8-150.9-108.3 114.7 -0.7 8.9 18.2 30 30 A H E > -j 128 0D 82 -2,-0.6 3,-1.2 97,-0.2 64,-0.2 -0.768 18.9-130.6 -88.2 112.2 -3.5 8.1 20.7 31 31 A R T 3 S+ 0 0 50 97,-2.4 65,-0.3 -2,-0.7 62,-0.0 -0.324 90.5 34.6 -63.0 144.8 -4.0 4.4 20.8 32 32 A G T 3 S+ 0 0 36 62,-2.3 -1,-0.2 1,-0.3 64,-0.2 0.517 106.2 90.7 89.0 6.0 -7.6 3.3 20.4 33 33 A K S < S- 0 0 120 -3,-1.2 61,-2.2 62,-0.1 -1,-0.3 -0.935 83.9 -86.2-135.6 161.0 -8.4 6.1 18.0 34 34 A P E - C 0 93A 93 0, 0.0 2,-0.5 0, 0.0 59,-0.2 -0.357 34.1-160.3 -66.4 136.8 -8.4 7.0 14.3 35 35 A F E - C 0 92A 43 57,-3.1 57,-3.0 -2,-0.1 2,-0.4 -0.979 10.3-166.2-118.6 126.0 -5.2 8.2 12.8 36 36 A T E + C 0 91A 34 -2,-0.5 -17,-2.5 -17,-0.3 2,-0.3 -0.956 11.7 167.9-122.6 131.5 -5.5 10.1 9.5 37 37 A L E -BC 18 90A 52 53,-2.3 53,-2.3 -2,-0.4 2,-0.3 -0.899 12.9-165.3-133.3 165.6 -2.8 11.1 7.0 38 38 A E E -BC 17 89A 48 -21,-2.5 -21,-3.3 -2,-0.3 2,-0.4 -0.979 6.1-174.5-151.9 134.2 -2.6 12.4 3.5 39 39 A A E -BC 16 88A 19 49,-2.9 49,-2.8 -2,-0.3 2,-0.4 -0.998 13.1-151.8-136.8 137.9 0.3 12.6 1.1 40 40 A L E +BC 15 87A 40 -25,-2.5 -26,-3.1 -2,-0.4 -25,-1.4 -0.890 27.6 164.3-104.6 135.9 0.6 14.1 -2.3 41 41 A F E -BC 13 86A 5 45,-2.0 45,-2.9 -2,-0.4 2,-0.5 -0.994 36.6-120.0-151.2 153.7 3.1 12.5 -4.7 42 42 A D E - C 0 85A 53 -30,-2.2 2,-0.3 -2,-0.3 43,-0.2 -0.832 35.2-119.0 -95.6 130.7 4.0 12.5 -8.4 43 43 A A - 0 0 4 41,-2.5 40,-3.2 -2,-0.5 41,-0.1 -0.525 19.9-163.0 -70.7 129.9 3.8 9.1 -10.1 44 44 A N + 0 0 55 -2,-0.3 2,-0.3 38,-0.2 -1,-0.1 0.229 69.6 18.1 -99.2 13.2 7.2 8.0 -11.4 45 45 A Q S S- 0 0 13 36,-0.1 2,-0.6 2,-0.1 38,-0.1 -0.967 83.9 -96.4-168.9 166.4 5.9 5.3 -13.7 46 46 A N + 0 0 96 -2,-0.3 2,-0.4 35,-0.2 35,-0.2 -0.871 55.6 173.6 -94.6 124.9 2.8 4.1 -15.5 47 47 A T B -L 80 0E 4 33,-2.2 33,-2.6 -2,-0.6 -2,-0.1 -0.993 45.1-160.7-147.0 141.7 1.4 1.4 -13.3 48 48 A K S S+ 0 0 166 -2,-0.4 2,-0.3 31,-0.3 -1,-0.1 0.729 86.9 49.1 -82.1 -25.6 -1.6 -0.9 -13.0 49 49 A T - 0 0 66 31,-0.1 64,-0.5 29,-0.1 2,-0.3 -0.816 52.4-177.2-119.7 157.7 -0.8 -1.5 -9.3 50 50 A A - 0 0 1 -2,-0.3 22,-1.3 62,-0.2 23,-0.7 -0.893 16.9-173.3-150.8 112.7 0.0 0.5 -6.2 51 51 A K E -FG 71 111C 112 60,-2.5 60,-2.5 -2,-0.3 2,-0.4 -0.967 18.0-137.2-122.0 129.5 0.8 -1.5 -3.0 52 52 A I E - G 0 110C 19 18,-2.1 2,-0.5 -2,-0.4 58,-0.2 -0.668 18.9-175.8 -82.5 125.6 1.4 -0.1 0.5 53 53 A E E - G 0 109C 96 56,-3.4 56,-3.9 -2,-0.4 2,-0.4 -0.991 9.6-173.6-123.0 120.8 4.3 -1.7 2.5 54 54 A I E - G 0 108C 53 -2,-0.5 2,-0.4 54,-0.2 11,-0.3 -0.941 12.5-176.2-121.6 140.6 4.7 -0.6 6.1 55 55 A K E - G 0 107C 114 52,-2.7 52,-2.9 -2,-0.4 2,-0.4 -0.988 6.1-177.0-130.0 138.1 7.3 -1.2 8.7 56 56 A A E -HG 63 106C 8 7,-0.7 7,-2.7 -2,-0.4 2,-0.4 -1.000 6.6-169.7-138.3 138.4 7.1 0.0 12.3 57 57 A S E -HG 62 105C 22 48,-2.3 48,-2.2 -2,-0.4 2,-0.5 -0.998 5.4-162.0-128.9 128.3 9.6 -0.3 15.1 58 58 A L E > S-HG 61 104C 17 3,-2.7 3,-2.7 -2,-0.4 46,-0.2 -0.967 80.4 -20.7-112.5 121.0 8.8 0.6 18.6 59 59 A D T 3 S- 0 0 98 44,-2.6 -1,-0.2 -2,-0.5 45,-0.1 0.849 131.9 -48.9 47.4 40.5 11.9 1.1 20.9 60 60 A G T 3 S+ 0 0 64 43,-0.4 2,-0.6 1,-0.2 -1,-0.3 0.243 114.7 116.1 88.9 -13.2 13.8 -0.9 18.3 61 61 A L E < -H 58 0C 133 -3,-2.7 -3,-2.7 1,-0.0 -1,-0.2 -0.809 63.6-130.6 -97.1 121.8 11.4 -3.8 18.1 62 62 A E E -H 57 0C 138 -2,-0.6 2,-0.3 -5,-0.3 -5,-0.3 -0.409 30.6-170.5 -65.6 140.8 9.7 -4.4 14.8 63 63 A I E -H 56 0C 68 -7,-2.7 -7,-0.7 -2,-0.1 2,-0.5 -0.973 25.9-109.1-137.3 151.4 6.0 -4.8 15.1 64 64 A D - 0 0 132 -2,-0.3 -9,-0.1 -9,-0.1 -7,-0.0 -0.672 22.1-147.8 -82.0 123.2 3.2 -5.9 12.8 65 65 A V - 0 0 36 -2,-0.5 3,-0.4 -11,-0.3 -11,-0.1 -0.801 28.4-158.6 -93.6 97.8 0.9 -3.0 11.8 66 66 A P + 0 0 65 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.244 55.5 28.8 -76.5 161.0 -2.5 -4.8 11.4 67 67 A G S S+ 0 0 72 1,-0.2 2,-0.5 25,-0.1 26,-0.2 0.727 73.2 138.7 64.4 28.8 -5.6 -4.0 9.6 68 68 A I - 0 0 28 -3,-0.4 2,-1.0 24,-0.1 -1,-0.2 -0.917 52.3-134.7-107.2 127.0 -4.3 -1.9 6.7 69 69 A D - 0 0 70 -2,-0.5 5,-0.1 1,-0.2 -17,-0.1 -0.689 18.8-164.2 -76.4 106.3 -5.7 -2.5 3.2 70 70 A T + 0 0 61 -2,-1.0 -18,-2.1 1,-0.1 2,-1.1 0.442 62.1 95.1 -75.9 1.1 -2.5 -2.6 1.3 71 71 A N B > -F 51 0C 55 -20,-0.2 3,-2.4 1,-0.2 -20,-0.2 -0.737 48.9-179.1 -98.1 94.4 -4.2 -2.1 -2.1 72 72 A A G >> S+ 0 0 0 -22,-1.3 3,-1.8 -2,-1.1 4,-1.3 0.677 77.6 71.1 -63.4 -19.0 -4.0 1.5 -2.7 73 73 A c G 34 S+ 0 0 32 -23,-0.7 5,-0.3 1,-0.3 -1,-0.3 0.624 84.1 71.5 -73.4 -8.9 -5.9 1.1 -6.0 74 74 A H G <4 S+ 0 0 127 -3,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.604 116.5 20.8 -77.0 -9.8 -8.8 0.4 -3.7 75 75 A F T <4 S+ 0 0 80 -3,-1.8 2,-0.2 -4,-0.1 -2,-0.2 0.428 119.4 57.9-137.4 -1.9 -8.6 4.2 -3.0 76 76 A M S < S- 0 0 20 -4,-1.3 2,-1.2 -26,-0.1 12,-0.1 -0.752 91.8 -97.1-119.9 169.7 -6.7 5.9 -5.8 77 77 A K - 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