==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 05-MAR-12 4ALO . COMPND 2 MOLECULE: H1 APOCRUSTACYANIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMARUS AMERICANUS; . AUTHOR M.FERRARI,C.FOLLI,E.PINCOLINI,T.S.MCCLINTOCK,M.ROESSLE,R.BER . 362 2 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17855.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 247 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 136 37.6 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 . 8 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 . 33 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 1 0 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 1 0 4 7 3 0 0 3 3 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 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 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 0 140 0, 0.0 184,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 110.4 -14.5 11.3 -19.1 2 2 A K + 0 0 160 182,-0.1 3,-0.1 1,-0.1 0, 0.0 0.489 360.0 95.8 -92.7 -6.7 -15.7 13.0 -15.9 3 3 A I + 0 0 83 181,-0.2 -1,-0.1 1,-0.2 2,-0.1 -0.954 56.9 14.9-158.2 161.6 -13.6 10.6 -13.8 4 4 A P > - 0 0 47 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 0.737 37.1-159.9 -99.1 162.8 -11.3 9.5 -12.3 5 5 A D T 3 S+ 0 0 89 1,-0.3 37,-0.1 -3,-0.1 -2,-0.0 0.337 90.0 68.3 -83.2 8.6 -8.6 12.0 -11.3 6 6 A F T 3 S+ 0 0 25 124,-0.1 125,-1.0 35,-0.1 2,-0.5 0.454 83.1 82.4-100.0 -3.5 -6.0 9.3 -10.9 7 7 A V E < -A 130 0A 29 -3,-1.4 123,-0.3 123,-0.2 121,-0.0 -0.894 67.7-177.5 -96.4 130.5 -6.0 8.7 -14.6 8 8 A V E -A 129 0A 36 121,-3.9 121,-2.2 -2,-0.5 -3,-0.0 -0.983 26.0-106.6-137.8 136.1 -3.7 11.3 -16.2 9 9 A P E S+A 128 0A 87 0, 0.0 119,-0.2 0, 0.0 118,-0.1 -0.098 81.2 26.7 -54.9 156.1 -2.6 12.1 -19.8 10 10 A G S S- 0 0 40 117,-1.6 2,-0.2 2,-0.0 -2,-0.2 -0.112 98.7 -61.4 77.8 178.4 0.8 11.3 -21.1 11 11 A K S S- 0 0 162 1,-0.2 118,-0.2 112,-0.1 3,-0.1 -0.556 73.5 -64.0 -95.9 164.2 3.1 8.5 -19.9 12 12 A a - 0 0 20 116,-0.2 -1,-0.2 -2,-0.2 111,-0.1 -0.196 66.2-105.8 -47.4 131.2 4.5 8.1 -16.4 13 13 A A - 0 0 38 144,-0.2 2,-0.5 1,-0.1 -1,-0.1 -0.109 28.4-107.4 -59.1 154.0 6.8 11.0 -15.6 14 14 A S + 0 0 114 1,-0.1 -1,-0.1 -3,-0.1 -3,-0.0 -0.767 37.4 174.6 -84.2 126.7 10.6 10.6 -15.5 15 15 A V - 0 0 18 -2,-0.5 5,-0.2 142,-0.0 -1,-0.1 0.252 49.3-108.9-120.1 11.1 11.8 10.7 -11.9 16 16 A T >> + 0 0 96 3,-0.1 4,-1.8 1,-0.1 3,-0.6 0.953 47.1 178.7 58.5 52.9 15.6 10.0 -12.2 17 17 A R H 3> S+ 0 0 96 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.807 72.0 57.4 -55.6 -39.6 15.2 6.5 -10.7 18 18 A N H 3> S+ 0 0 120 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.879 107.8 48.9 -63.4 -37.2 18.8 5.5 -10.9 19 19 A K H <> S+ 0 0 106 -3,-0.6 4,-2.3 2,-0.2 -2,-0.2 0.936 112.6 45.7 -66.5 -50.5 19.8 8.6 -8.9 20 20 A L H X S+ 0 0 19 -4,-1.8 4,-3.0 1,-0.2 5,-0.3 0.941 113.5 50.4 -57.5 -48.5 17.3 8.0 -6.1 21 21 A W H X S+ 0 0 74 -4,-2.8 4,-1.5 70,-0.2 -1,-0.2 0.857 110.5 49.9 -59.9 -38.0 18.2 4.3 -6.0 22 22 A A H < S+ 0 0 66 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.885 116.1 41.9 -68.1 -40.4 21.9 5.2 -5.8 23 23 A E H < S+ 0 0 101 -4,-2.3 -2,-0.2 1,-0.2 4,-0.2 0.868 118.7 43.3 -72.2 -40.2 21.3 7.6 -2.9 24 24 A Q H >< S+ 0 0 11 -4,-3.0 3,-0.9 -5,-0.2 4,-0.5 0.739 96.7 72.4 -83.1 -26.2 18.8 5.5 -1.0 25 25 A T G >< S+ 0 0 58 -4,-1.5 3,-0.9 1,-0.3 4,-0.3 0.873 94.1 51.4 -66.0 -41.9 20.4 2.1 -1.1 26 26 A P G 3 S+ 0 0 101 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.663 120.4 38.6 -68.4 -14.1 23.3 2.7 1.4 27 27 A N G X S+ 0 0 64 -3,-0.9 3,-2.7 -4,-0.2 4,-0.5 0.352 78.1 117.5-109.7 0.3 20.7 4.0 3.8 28 28 A R G X S+ 0 0 19 -3,-0.9 3,-1.7 -4,-0.5 4,-0.3 0.806 70.5 64.5 -39.0 -37.9 18.0 1.5 3.0 29 29 A N G > S+ 0 0 107 -4,-0.3 3,-1.6 1,-0.3 -1,-0.3 0.821 92.2 58.1 -57.2 -39.5 18.3 0.4 6.6 30 30 A M G < S+ 0 0 90 -3,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.459 91.8 72.3 -78.0 1.1 17.0 3.6 8.1 31 31 A Y G < S+ 0 0 0 -3,-1.7 -1,-0.3 -4,-0.5 -2,-0.2 0.636 79.4 97.4 -81.8 -18.7 13.8 3.2 6.2 32 32 A A < + 0 0 27 -3,-1.6 2,-0.2 -4,-0.3 25,-0.2 -0.160 61.0 55.4 -63.1 166.1 12.9 0.4 8.5 33 33 A G E S-B 56 0A 28 23,-2.7 23,-2.6 2,-0.1 2,-0.5 -0.606 94.7 -27.4 106.9-167.4 10.6 1.2 11.4 34 34 A V E -B 55 0A 31 21,-0.2 2,-0.4 -2,-0.2 21,-0.2 -0.747 50.6-178.0 -94.0 127.1 7.1 2.7 11.8 35 35 A W E -B 54 0A 0 19,-2.3 19,-4.1 -2,-0.5 2,-0.4 -0.981 13.9-149.0-120.9 136.6 5.7 5.1 9.3 36 36 A Y E -BC 53 137A 42 101,-3.8 101,-3.0 -2,-0.4 2,-0.9 -0.830 23.0-118.9-101.8 142.3 2.3 6.8 9.6 37 37 A Q E + C 0 136A 4 15,-2.4 15,-0.2 -2,-0.4 99,-0.2 -0.720 33.8 175.5 -81.6 106.3 0.4 7.7 6.5 38 38 A F E - 0 0 24 97,-2.1 129,-2.8 -2,-0.9 2,-0.3 0.909 64.4 -16.9 -78.8 -44.1 -0.0 11.5 6.7 39 39 A A E -DC 166 135A 6 96,-1.5 96,-3.0 127,-0.3 -1,-0.3 -0.987 58.9-173.5-157.4 153.9 -1.7 12.0 3.3 40 40 A L E -DC 165 134A 18 125,-1.8 125,-2.8 -2,-0.3 94,-0.2 -0.991 27.7-111.4-144.0 159.3 -2.3 10.2 -0.0 41 41 A T E -D 164 0A 0 92,-1.8 123,-0.2 -2,-0.3 -35,-0.1 -0.521 69.6 -56.9 -81.3 160.9 -3.8 10.8 -3.5 42 42 A N - 0 0 84 121,-0.6 -1,-0.2 -2,-0.2 91,-0.1 -0.004 64.3-174.9 -43.3 131.0 -7.0 9.0 -4.4 43 43 A N > - 0 0 20 -3,-0.1 3,-0.8 1,-0.1 -1,-0.1 -0.889 25.7-172.6-144.1 108.6 -6.5 5.2 -4.0 44 44 A P T 3 S+ 0 0 2 0, 0.0 263,-1.9 0, 0.0 264,-0.2 0.537 87.9 56.2 -75.6 -6.6 -9.0 2.4 -4.9 45 45 A Y T 3 S+ 0 0 34 261,-0.2 2,-0.5 262,-0.1 260,-0.1 0.554 77.5 104.5-102.1 -11.5 -6.8 -0.3 -3.3 46 46 A Q < + 0 0 28 -3,-0.8 -3,-0.1 1,-0.2 261,-0.0 -0.604 37.5 174.9 -77.6 119.9 -6.4 1.1 0.2 47 47 A L + 0 0 65 -2,-0.5 2,-0.8 1,-0.1 25,-0.7 0.660 61.5 80.1 -96.6 -17.6 -8.6 -0.8 2.7 48 48 A I E + E 0 71A 6 23,-0.2 23,-0.2 1,-0.2 4,-0.1 -0.809 55.6 177.8 -94.7 111.9 -7.3 0.9 5.8 49 49 A E E + 0 0 68 21,-1.3 119,-0.4 -2,-0.8 2,-0.3 0.938 56.9 20.6 -81.7 -50.2 -9.1 4.2 6.1 50 50 A K E S+ E 0 70A 75 20,-2.1 20,-2.1 1,-0.2 3,-0.2 -0.797 112.0 23.1-123.6 160.6 -7.8 5.8 9.3 51 51 A b E S- 0 0 3 117,-2.9 2,-0.3 -2,-0.3 -1,-0.2 0.773 73.9-168.6 64.0 29.1 -4.9 5.6 11.7 52 52 A V E + 0 0 1 116,-0.4 -15,-2.4 -15,-0.2 2,-0.5 -0.348 10.5 175.1 -63.6 114.6 -2.7 4.1 9.0 53 53 A R E -BE 36 68A 15 15,-2.3 15,-2.2 -2,-0.3 2,-0.6 -0.982 14.0-159.2-130.0 116.5 0.4 2.9 10.6 54 54 A N E -BE 35 67A 7 -19,-4.1 -19,-2.3 -2,-0.5 2,-0.7 -0.869 1.3-159.2-109.6 113.8 3.0 0.9 8.6 55 55 A E E -BE 34 66A 78 11,-3.8 11,-2.6 -2,-0.6 2,-0.5 -0.805 12.5-167.5 -95.4 115.6 5.5 -1.3 10.3 56 56 A Y E -BE 33 65A 5 -23,-2.6 -23,-2.7 -2,-0.7 2,-0.4 -0.862 7.4-174.3-105.8 126.3 8.6 -2.0 8.2 57 57 A S E - E 0 64A 68 7,-2.9 7,-2.3 -2,-0.5 2,-0.4 -0.960 13.4-147.7-115.9 141.7 11.2 -4.7 8.9 58 58 A F E - E 0 63A 49 -2,-0.4 5,-0.2 5,-0.2 -29,-0.0 -0.909 16.2-172.1-116.0 132.6 14.4 -5.1 6.9 59 59 A D - 0 0 110 3,-2.2 4,-0.1 -2,-0.4 -1,-0.1 0.299 66.3 -87.1-102.5 8.1 16.3 -8.3 6.1 60 60 A G S S+ 0 0 44 2,-0.4 3,-0.1 1,-0.1 -31,-0.1 0.159 121.2 24.9 104.8 -16.5 19.3 -6.7 4.5 61 61 A E S S+ 0 0 150 1,-0.5 2,-0.2 -33,-0.1 -1,-0.1 0.486 120.3 31.4-141.6 -47.4 17.8 -6.5 1.0 62 62 A Q - 0 0 84 22,-0.1 -3,-2.2 23,-0.0 -1,-0.5 -0.668 68.1-127.3-110.9 170.4 13.9 -6.5 1.1 63 63 A F E -EF 58 83A 5 20,-3.6 20,-2.4 -2,-0.2 2,-0.4 -0.928 8.0-156.7-112.6 145.8 11.3 -5.2 3.5 64 64 A V E -EF 57 82A 65 -7,-2.3 -7,-2.9 -2,-0.4 2,-0.4 -0.927 21.5-158.2-108.8 145.1 8.4 -7.0 5.1 65 65 A I E -EF 56 81A 2 16,-2.3 16,-2.1 -2,-0.4 2,-0.5 -0.959 20.6-164.0-128.8 142.3 5.5 -4.8 6.3 66 66 A T E -EF 55 80A 37 -11,-2.6 -11,-3.8 -2,-0.4 2,-0.4 -0.986 17.9-168.3-118.9 119.0 2.6 -4.9 8.7 67 67 A S E +EF 54 79A 4 12,-2.9 12,-3.0 -2,-0.5 2,-0.3 -0.906 11.1 172.6-110.1 133.8 0.0 -2.2 8.1 68 68 A T E +EF 53 78A 3 -15,-2.2 -15,-2.3 -2,-0.4 2,-0.3 -0.909 15.9 102.2-135.5 163.7 -2.7 -1.5 10.6 69 69 A G E - F 0 77A 1 8,-1.2 8,-2.4 -2,-0.3 2,-0.6 -0.975 69.5 -42.6 159.5-161.5 -5.6 0.9 11.3 70 70 A I E -EF 50 76A 27 -20,-2.1 -20,-2.1 -2,-0.3 -21,-1.3 -0.875 53.5-139.0-101.9 124.7 -9.3 1.2 11.1 71 71 A A E > -E 48 0A 12 4,-3.7 3,-1.6 -2,-0.6 -23,-0.2 -0.007 36.0 -89.5 -66.9 178.8 -11.0 -0.2 8.0 72 72 A Y T 3 S+ 0 0 126 -25,-0.7 -1,-0.1 1,-0.3 -24,-0.1 0.672 125.4 60.1 -69.2 -16.9 -13.9 1.6 6.2 73 73 A D T 3 S- 0 0 117 2,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.466 121.6-103.5 -87.2 -2.9 -16.4 -0.3 8.3 74 74 A G S < S+ 0 0 56 -3,-1.6 2,-0.2 1,-0.3 -2,-0.1 0.450 84.3 122.8 92.2 2.4 -15.0 1.2 11.6 75 75 A N S S- 0 0 102 1,-0.1 -4,-3.7 -5,-0.0 -1,-0.3 -0.647 70.1 -95.3-100.5 154.8 -13.2 -2.0 12.5 76 76 A L E -F 70 0A 85 -6,-0.3 2,-0.3 -2,-0.2 -6,-0.2 -0.368 45.5-174.7 -59.3 138.2 -9.6 -2.9 13.1 77 77 A L E -F 69 0A 49 -8,-2.4 -8,-1.2 -2,-0.1 2,-0.4 -0.997 15.7-164.7-143.6 139.2 -7.7 -4.2 10.1 78 78 A K E -F 68 0A 78 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.982 7.9-174.0-121.9 129.0 -4.2 -5.6 9.5 79 79 A R E -F 67 0A 16 -12,-3.0 -12,-2.9 -2,-0.4 2,-0.3 -0.990 14.5-143.9-124.6 130.1 -2.7 -6.0 6.1 80 80 A N E +F 66 0A 47 -2,-0.4 18,-1.9 -14,-0.2 2,-0.3 -0.639 28.0 167.1 -84.4 145.0 0.6 -7.7 5.3 81 81 A G E -FG 65 97A 1 -16,-2.1 -16,-2.3 -2,-0.3 2,-0.3 -0.874 22.1-142.6-145.8 178.1 2.8 -6.3 2.6 82 82 A K E -FG 64 96A 51 14,-2.4 14,-2.2 -2,-0.3 2,-0.4 -0.988 1.7-161.2-147.1 152.1 6.3 -6.5 1.1 83 83 A L E +FG 63 95A 1 -20,-2.4 -20,-3.6 -2,-0.3 12,-0.2 -0.954 30.4 147.5-138.1 113.1 8.8 -4.0 -0.4 84 84 A Y E - 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0 0 24 -2,-0.2 -4,-1.2 -3,-0.1 2,-0.5 -0.347 33.2 -92.8-112.6-168.2 -1.2 -6.7 -6.6 102 102 A A E -HI 96 284A 1 182,-2.6 182,-2.4 -6,-0.2 -6,-0.2 -0.962 41.9-178.4-113.0 129.5 2.4 -5.5 -6.9 103 103 A A E -H 95 0A 9 -8,-2.6 -8,-2.7 -2,-0.5 2,-0.1 -0.869 34.7 -96.0-123.0 155.5 3.1 -2.0 -8.1 104 104 A P E -H 94 0A 17 0, 0.0 2,-0.4 0, 0.0 -10,-0.2 -0.465 41.5-167.8 -64.4 142.3 6.2 0.0 -8.8 105 105 A L E -H 93 0A 1 -12,-2.7 -12,-1.8 15,-0.1 2,-0.4 -0.988 8.3-177.7-135.3 129.0 7.2 2.2 -5.9 106 106 A V E -J 119 0A 13 13,-2.8 13,-2.8 -2,-0.4 2,-0.8 -0.941 22.9-140.1-119.3 141.8 9.7 5.0 -5.9 107 107 A I E -J 118 0A 0 -2,-0.4 11,-0.2 11,-0.2 3,-0.2 -0.926 16.1-171.7-100.4 107.9 10.8 7.1 -3.0 108 108 A L E - 0 0 21 9,-2.1 2,-0.3 -2,-0.8 -1,-0.2 0.803 68.9 -12.8 -67.2 -32.8 11.1 10.6 -4.4 109 109 A E E +J 117 0A 59 8,-1.0 8,-2.9 -3,-0.1 2,-0.3 -0.921 64.6 164.5-170.3 139.1 12.6 11.9 -1.2 110 110 A T E -J 116 0A 22 -2,-0.3 6,-0.2 6,-0.2 -79,-0.0 -0.969 28.0-163.0-157.7 149.7 13.2 11.0 2.4 111 111 A D - 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