==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION/DNA 06-SEP-06 2I9T . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR C.R ESCALANTE,L.SHEN,D.THANOS,A.K.AGGARWAL . 587 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30504.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 350 59.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 162 27.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 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 . 57 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 0 0 0 1 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 0 0 0 PARALLEL BRIDGES PER LADDER . 8 5 8 3 9 1 2 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 4 1 2 1 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 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 17 A H 0 0 244 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 151.9 68.4 10.0 76.6 2 18 A A - 0 0 75 1,-0.1 2,-0.0 157,-0.0 157,-0.0 -0.459 360.0-118.7 -68.0 132.3 67.6 12.4 73.8 3 19 A P - 0 0 37 0, 0.0 2,-0.3 0, 0.0 46,-0.2 -0.341 34.5-153.3 -69.5 152.3 64.1 14.0 74.1 4 20 A Y - 0 0 134 44,-1.1 2,-0.4 155,-0.1 46,-0.1 -0.925 16.1-115.4-136.2 158.4 61.6 13.3 71.3 5 21 A V - 0 0 12 155,-0.4 2,-0.4 -2,-0.3 42,-0.2 -0.701 29.8-168.5 -89.1 135.6 58.5 14.7 69.5 6 22 A E E -A 46 0A 81 40,-2.5 40,-2.5 -2,-0.4 2,-0.7 -0.985 17.3-138.5-131.6 125.5 55.3 12.7 69.8 7 23 A I E +A 45 0A 33 -2,-0.4 38,-0.2 38,-0.2 3,-0.2 -0.707 25.4 169.8 -82.4 113.3 52.1 13.2 67.7 8 24 A I E S+ 0 0 53 36,-1.7 2,-0.2 -2,-0.7 37,-0.2 0.471 73.4 35.5-102.7 -4.0 49.1 12.9 69.9 9 25 A E E S-A 44 0A 9 35,-1.3 35,-1.2 24,-0.0 -1,-0.2 -0.664 78.6-152.9-150.2 90.4 46.5 14.1 67.5 10 26 A Q - 0 0 41 -3,-0.2 23,-3.4 -2,-0.2 24,-0.4 -0.114 30.1-101.9 -56.7 157.9 47.1 13.1 63.8 11 27 A P B -C 32 0B 1 0, 0.0 21,-0.3 0, 0.0 2,-0.1 -0.589 48.9 -95.8 -79.3 148.5 45.6 15.4 61.1 12 28 A K - 0 0 50 19,-4.6 4,-0.1 -2,-0.2 21,-0.1 -0.467 31.4-140.1 -67.5 140.3 42.4 13.9 59.7 13 29 A Q S S+ 0 0 55 154,-0.1 155,-2.3 -2,-0.1 2,-0.3 0.818 71.7 18.4 -71.7 -34.5 43.3 12.0 56.6 14 30 A R S S+ 0 0 31 153,-0.2 3,-0.1 1,-0.1 155,-0.1 -0.913 90.5 56.4-139.5 165.7 40.3 13.0 54.4 15 31 A G S S+ 0 0 18 1,-0.4 2,-0.2 153,-0.3 -1,-0.1 -0.281 77.3 96.1 113.7 -49.9 37.5 15.5 53.9 16 32 A M - 0 0 31 -4,-0.1 154,-1.8 152,-0.1 2,-0.4 -0.513 63.9-144.4 -75.3 145.8 39.4 18.7 53.8 17 33 A R - 0 0 95 152,-0.2 2,-0.2 153,-0.2 85,-0.1 -0.918 19.3-111.0-115.4 139.8 40.2 20.1 50.3 18 34 A F - 0 0 1 -2,-0.4 2,-0.4 85,-0.1 85,-0.2 -0.453 38.4-140.8 -65.6 133.4 43.3 21.9 49.4 19 35 A R E -d 103 0C 73 83,-1.7 85,-0.8 -2,-0.2 2,-0.1 -0.817 4.1-125.3-107.8 141.1 42.5 25.5 48.6 20 36 A Y E > -d 104 0C 82 -2,-0.4 3,-1.4 83,-0.2 4,-0.1 -0.412 29.6-110.7 -74.8 154.2 43.8 27.8 45.9 21 37 A K G > S+ 0 0 141 83,-0.5 3,-1.7 1,-0.3 -1,-0.1 0.910 115.5 59.5 -49.1 -49.6 45.3 31.2 46.8 22 38 A C G 3 S+ 0 0 117 1,-0.3 -1,-0.3 3,-0.0 3,-0.1 0.725 84.1 77.8 -55.2 -27.6 42.4 33.0 45.2 23 39 A E G < S- 0 0 63 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.508 106.3-114.5 -66.1 1.3 39.8 31.4 47.5 24 40 A G < - 0 0 31 -3,-1.7 3,-0.3 1,-0.1 -1,-0.2 -0.197 23.9 -71.3 97.3 172.8 41.0 33.8 50.2 25 41 A R S > S+ 0 0 165 1,-0.2 2,-2.1 -3,-0.1 3,-0.6 0.852 116.4 71.3 -75.5 -37.8 42.7 34.0 53.5 26 42 A S T 3 + 0 0 125 1,-0.2 -1,-0.2 -3,-0.1 3,-0.1 -0.295 59.5 124.2 -78.4 55.2 39.7 32.5 55.4 27 43 A A T 3 - 0 0 39 -2,-2.1 -1,-0.2 -3,-0.3 2,-0.2 0.868 66.5-122.0 -81.6 -39.9 40.2 29.0 53.9 28 44 A G < - 0 0 54 -3,-0.6 2,-0.2 71,-0.1 -1,-0.2 -0.516 19.0 -73.8 121.6 169.9 40.4 27.2 57.2 29 45 A S - 0 0 36 -2,-0.2 72,-0.2 69,-0.1 69,-0.1 -0.623 42.6-106.7-101.7 159.8 42.6 24.9 59.3 30 46 A I - 0 0 0 70,-1.6 70,-0.2 -2,-0.2 2,-0.2 -0.787 42.5-136.6 -87.8 126.5 43.5 21.2 58.9 31 47 A P - 0 0 27 0, 0.0 -19,-4.6 0, 0.0 11,-0.3 -0.500 14.8-103.3 -85.8 154.3 41.6 19.2 61.6 32 48 A G B > -C 11 0B 0 9,-0.6 3,-1.8 -21,-0.3 9,-0.3 -0.374 27.3-119.2 -73.8 151.5 42.8 16.3 63.7 33 49 A E T 3 S+ 0 0 78 -23,-3.4 -1,-0.1 1,-0.3 -21,-0.1 0.899 114.0 55.9 -55.9 -45.1 41.8 12.8 63.0 34 50 A R T 3 S+ 0 0 175 -24,-0.4 -1,-0.3 8,-0.1 5,-0.1 0.482 88.9 108.0 -69.3 -1.8 40.1 12.4 66.3 35 51 A S < + 0 0 31 -3,-1.8 2,-0.3 5,-0.1 5,-0.2 0.005 44.4 170.7 -65.8-179.4 37.9 15.4 65.5 36 52 A T - 0 0 80 3,-2.7 5,-0.1 1,-0.1 -1,-0.1 -0.923 51.4 -72.9-170.2-169.7 34.2 15.1 64.6 37 53 A D S S+ 0 0 149 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.0 0.897 131.9 32.3 -70.5 -39.6 31.1 17.2 64.1 38 54 A T S S+ 0 0 113 1,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.967 121.2 48.1 -79.3 -61.0 30.8 17.9 67.8 39 55 A T - 0 0 68 -5,-0.1 -3,-2.7 1,-0.0 2,-0.5 -0.623 68.9-158.8 -84.6 140.9 34.4 18.0 68.8 40 56 A K + 0 0 152 -2,-0.3 -5,-0.1 -5,-0.2 -3,-0.1 -0.789 19.6 177.9-123.3 88.2 36.8 20.1 66.7 41 57 A T - 0 0 36 -2,-0.5 -9,-0.6 -9,-0.3 -5,-0.0 -0.157 12.2-154.6 -83.1 178.4 40.4 18.9 67.2 42 58 A H - 0 0 53 -11,-0.3 56,-0.2 -31,-0.1 -8,-0.1 -0.981 39.9 -72.6-150.6 154.6 43.7 20.1 65.6 43 59 A P - 0 0 1 0, 0.0 54,-2.8 0, 0.0 2,-0.3 -0.278 60.1-176.4 -50.9 130.3 47.1 18.5 65.0 44 60 A T E -AB 9 96A 17 -35,-1.2 -36,-1.7 52,-0.3 -35,-1.3 -0.987 12.7-168.0-136.8 145.1 48.9 18.3 68.4 45 61 A I E -AB 7 95A 0 50,-4.1 50,-3.2 -2,-0.3 2,-0.4 -0.882 11.2-149.7-130.4 162.4 52.3 17.2 69.6 46 62 A K E -AB 6 94A 10 -40,-2.5 -40,-2.5 -2,-0.3 48,-0.2 -1.000 3.8-161.1-132.0 129.9 54.0 16.4 72.9 47 63 A I - 0 0 8 46,-2.1 -42,-0.1 -2,-0.4 47,-0.1 -0.087 25.9-172.3-101.5 33.7 57.7 17.0 73.4 48 64 A N + 0 0 41 1,-0.2 -44,-1.1 45,-0.1 3,-0.1 0.161 65.7 43.7 -28.5 131.2 57.8 14.6 76.4 49 65 A G S S+ 0 0 70 -46,-0.2 -1,-0.2 1,-0.0 2,-0.2 0.686 111.8 53.5 97.2 22.8 61.2 14.8 78.1 50 66 A Y + 0 0 44 -46,-0.1 -3,-0.2 -47,-0.0 -1,-0.0 -0.726 40.8 168.7 176.5 131.7 61.5 18.6 78.0 51 67 A T + 0 0 59 -2,-0.2 3,-0.1 -3,-0.1 -3,-0.1 0.493 52.7 99.9-127.4 -13.3 59.4 21.5 79.1 52 68 A G S S- 0 0 34 1,-0.1 -2,-0.0 98,-0.1 36,-0.0 0.286 83.7 -55.0 -60.3-163.8 61.7 24.5 78.8 53 69 A P + 0 0 63 0, 0.0 97,-0.3 0, 0.0 2,-0.3 -0.198 66.6 135.2 -73.4 166.8 61.8 27.0 75.9 54 70 A G - 0 0 8 34,-0.4 34,-1.7 95,-0.1 2,-0.3 -0.985 42.5-102.2 173.2-175.9 62.2 26.1 72.3 55 71 A T E -FG 87 148D 37 93,-2.9 93,-2.7 32,-0.3 2,-0.4 -0.991 22.0-154.0-137.3 144.7 61.1 26.6 68.7 56 72 A V E -FG 86 147D 1 30,-3.2 30,-2.2 -2,-0.3 2,-0.4 -0.968 5.9-170.7-126.7 132.7 58.9 24.6 66.3 57 73 A R E -FG 85 146D 61 89,-2.0 89,-3.1 -2,-0.4 2,-0.4 -0.967 3.1-170.4-122.2 131.7 58.8 24.4 62.5 58 74 A I E +FG 84 145D 0 26,-2.4 26,-2.7 -2,-0.4 2,-0.3 -0.938 15.1 157.5-119.8 138.1 56.2 22.7 60.4 59 75 A S E - G 0 144D 0 85,-1.3 85,-1.8 -2,-0.4 2,-0.4 -0.933 37.4 -96.1-150.1 174.4 56.3 22.0 56.7 60 76 A L E + G 0 143D 4 22,-0.3 10,-2.8 -2,-0.3 2,-0.3 -0.836 35.3 173.6-104.1 133.8 55.0 19.8 53.9 61 77 A V E -HG 69 142D 0 81,-2.2 81,-2.0 -2,-0.4 6,-0.1 -0.937 38.4 -85.9-132.6 154.5 56.7 16.8 52.5 62 78 A T - 0 0 11 6,-2.1 79,-0.2 -2,-0.3 -1,-0.1 -0.012 35.1-119.7 -52.9 161.1 55.7 14.1 49.9 63 79 A K S S+ 0 0 58 77,-0.4 -1,-0.1 74,-0.1 4,-0.1 0.910 93.1 49.0 -72.1 -45.1 53.7 11.0 51.0 64 80 A D S S- 0 0 96 2,-0.1 4,-0.4 1,-0.1 -2,-0.1 -0.727 98.6 -57.9-103.6 149.8 56.3 8.5 50.0 65 81 A P S S+ 0 0 94 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.332 110.6 54.6 -66.6 145.1 60.1 8.3 50.6 66 82 A P S S- 0 0 74 0, 0.0 2,-1.8 0, 0.0 -4,-0.2 0.408 87.1-142.3 -73.7 136.0 62.3 10.1 50.1 67 83 A H + 0 0 33 -4,-0.1 58,-0.4 -6,-0.1 60,-0.2 -0.485 31.5 175.3 -73.6 84.9 60.3 12.7 51.9 68 84 A R - 0 0 33 -2,-1.8 -6,-2.1 -4,-0.4 -4,-0.1 -0.681 41.1 -81.2 -95.4 143.7 61.1 15.8 49.8 69 85 A P B -H 61 0D 2 0, 0.0 -8,-0.3 0, 0.0 -1,-0.1 -0.061 49.6-128.2 -42.5 131.2 59.6 19.3 50.3 70 86 A H - 0 0 1 -10,-2.8 -10,-0.2 72,-0.1 71,-0.1 -0.612 5.3-130.6 -89.7 144.9 56.2 19.5 48.7 71 87 A P S S+ 0 0 2 0, 0.0 -1,-0.1 0, 0.0 45,-0.1 0.815 84.4 87.0 -63.7 -29.7 55.2 22.3 46.2 72 88 A H S S- 0 0 2 33,-0.1 2,-0.3 1,-0.1 32,-0.2 -0.154 75.6-129.8 -63.3 170.5 52.0 23.1 48.1 73 89 A E E -E 103 0C 48 30,-2.3 30,-3.2 -14,-0.1 2,-0.5 -0.882 5.3-132.5-127.5 155.7 52.2 25.6 50.9 74 90 A L E +E 102 0C 2 8,-1.3 2,-0.3 -2,-0.3 8,-0.3 -0.912 33.9 179.5-102.6 130.0 51.2 26.0 54.6 75 91 A V E +E 101 0C 32 26,-2.3 26,-1.5 -2,-0.5 2,-0.3 -0.918 27.9 72.8-130.3 157.2 49.5 29.3 55.2 76 92 A G S > S+ 0 0 46 -2,-0.3 3,-2.1 3,-0.2 24,-0.1 -0.897 83.9 3.0 135.9-166.6 48.0 30.9 58.3 77 93 A K T 3 S+ 0 0 140 22,-0.4 22,-0.1 -2,-0.3 3,-0.1 -0.283 132.6 1.1 -55.8 128.7 49.2 32.3 61.6 78 94 A D T 3 S+ 0 0 88 1,-0.2 7,-1.6 6,-0.1 2,-0.3 0.547 99.1 133.0 70.0 9.3 53.1 32.4 61.7 79 95 A C E < +I 84 0D 29 -3,-2.1 2,-0.3 5,-0.2 5,-0.2 -0.658 23.2 161.1 -93.2 149.7 53.5 31.0 58.2 80 96 A R E > +I 83 0D 189 3,-2.5 3,-2.9 -2,-0.3 -6,-0.1 -0.961 62.5 8.5-162.2 148.0 55.8 32.4 55.6 81 97 A D T 3 S- 0 0 100 -2,-0.3 3,-0.1 1,-0.3 -6,-0.1 0.798 132.8 -55.4 45.6 31.8 57.5 31.2 52.4 82 98 A G T 3 S+ 0 0 5 -8,-0.3 -8,-1.3 1,-0.2 -22,-0.3 0.429 119.3 88.6 86.9 -0.5 55.3 28.1 52.7 83 99 A Y E < - 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