==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 11-FEB-11 3QP3 . COMPND 2 MOLECULE: TITIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.SAUER,A.KOLODZIEJCZYK,M.WILMANNS . 298 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15617.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 190 63.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 15 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 125 41.9 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 . 12 4.0 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 . 29 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 7.0 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+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 . 0 0 0 3 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 3 0 3 0 9 0 0 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 3 1 0 0 0 0 1 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 G > 0 0 96 0, 0.0 3,-1.2 0, 0.0 4,-0.4 0.000 360.0 360.0 360.0 160.5 25.4 -14.0 16.0 2 2 A P T 3 + 0 0 109 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.692 360.0 41.5 -65.8 -19.5 21.8 -14.0 15.0 3 3 A F T > S+ 0 0 142 1,-0.1 3,-0.9 2,-0.1 32,-0.0 0.245 83.0 100.0-112.3 10.9 21.2 -10.5 16.6 4 4 A T T < S+ 0 0 75 -3,-1.2 -1,-0.1 1,-0.2 0, 0.0 0.855 84.4 49.0 -66.0 -34.8 24.5 -8.9 15.4 5 5 A L T 3 S+ 0 0 133 -4,-0.4 -1,-0.2 -3,-0.1 30,-0.1 0.452 83.3 120.3 -86.4 -0.7 22.7 -7.1 12.5 6 6 A D < + 0 0 19 -3,-0.9 2,-0.3 28,-0.1 -3,-0.1 -0.388 39.9 170.4 -60.4 140.9 19.9 -5.8 14.8 7 7 A H E -A 35 0A 52 28,-2.4 28,-1.1 29,-0.1 80,-0.2 -0.991 38.0 -92.0-153.9 154.2 19.8 -2.0 14.8 8 8 A A E - 0 0 38 -2,-0.3 81,-0.1 79,-0.3 27,-0.1 -0.287 67.0 -73.4 -63.1 155.1 17.6 0.8 16.0 9 9 A P E - 0 0 11 0, 0.0 2,-0.5 0, 0.0 25,-0.2 -0.168 48.8-157.2 -52.9 141.6 15.0 2.1 13.5 10 10 A R E -A 33 0A 116 23,-2.4 23,-2.8 -3,-0.1 2,-0.8 -0.966 5.8-151.0-128.2 112.4 16.5 4.1 10.7 11 11 A I E +A 32 0A 19 -2,-0.5 21,-0.2 21,-0.2 3,-0.1 -0.753 19.7 172.9 -87.1 110.4 14.3 6.6 8.8 12 12 A T E S+ 0 0 72 19,-1.5 2,-0.4 -2,-0.8 -1,-0.2 0.638 71.4 38.2 -95.3 -16.6 15.7 6.8 5.2 13 13 A L E S-A 31 0A 92 18,-1.3 18,-1.9 0, 0.0 -1,-0.3 -0.968 80.0-155.0-135.4 119.0 12.9 8.9 3.8 14 14 A R - 0 0 137 -2,-0.4 15,-0.1 16,-0.2 16,-0.1 -0.595 23.8 -97.0-100.3 155.6 11.4 11.6 5.9 15 15 A M - 0 0 16 -2,-0.2 2,-0.5 13,-0.1 -1,-0.1 -0.239 34.4-131.6 -62.3 153.1 8.0 13.2 5.8 16 16 A R - 0 0 66 13,-0.1 78,-0.1 78,-0.1 -1,-0.1 -0.954 11.8-131.7-114.9 119.7 7.6 16.5 3.9 17 17 A S + 0 0 71 -2,-0.5 2,-0.3 76,-0.2 79,-0.2 -0.396 45.2 159.5 -59.9 143.0 5.8 19.4 5.6 18 18 A H E -d 96 0B 53 77,-1.9 79,-2.4 -2,-0.0 2,-0.3 -0.985 39.4-103.8-162.4 168.5 3.3 20.8 3.1 19 19 A R E -d 97 0B 175 -2,-0.3 79,-0.2 77,-0.2 77,-0.0 -0.713 26.7-175.2 -98.2 151.0 0.2 22.8 2.3 20 20 A V E -d 98 0B 5 77,-2.2 79,-2.7 -2,-0.3 2,-0.1 -0.980 29.2-114.9-143.2 136.7 -3.2 21.4 1.4 21 21 A P E > -d 99 0B 47 0, 0.0 3,-2.2 0, 0.0 79,-0.2 -0.475 48.0 -91.1 -68.3 140.2 -6.3 23.4 0.4 22 22 A C T 3 S+ 0 0 48 77,-3.5 50,-0.2 1,-0.3 3,-0.1 -0.246 113.7 25.4 -50.4 130.3 -9.2 23.0 2.9 23 23 A G T 3 S+ 0 0 0 48,-3.0 263,-0.5 1,-0.4 47,-0.4 0.042 96.0 110.7 102.3 -26.3 -11.4 20.1 1.9 24 24 A Q < - 0 0 56 -3,-2.2 47,-2.6 47,-0.2 -1,-0.4 -0.367 68.3-118.5 -77.4 161.5 -8.8 18.1 0.0 25 25 A N - 0 0 22 45,-0.2 2,-0.3 44,-0.2 44,-0.2 -0.685 35.0-171.3 -89.7 153.9 -7.3 14.8 1.2 26 26 A T E - B 0 68A 14 42,-2.3 42,-2.4 -2,-0.3 2,-0.3 -0.953 9.4-146.9-145.8 162.4 -3.5 14.7 1.8 27 27 A R E - B 0 67A 121 -2,-0.3 2,-0.4 40,-0.2 40,-0.2 -0.977 5.9-157.3-136.0 146.5 -0.8 12.2 2.6 28 28 A F E - B 0 66A 2 38,-2.6 38,-2.6 -2,-0.3 2,-0.4 -0.947 18.9-167.6-113.5 144.2 2.5 11.9 4.5 29 29 A I E + B 0 65A 88 -2,-0.4 2,-0.3 36,-0.2 36,-0.2 -0.994 14.0 158.1-133.0 137.5 5.0 9.3 3.5 30 30 A L E - B 0 64A 0 34,-2.3 34,-2.9 -2,-0.4 2,-0.4 -0.963 25.5-139.5-146.5 168.5 8.1 8.0 5.2 31 31 A N E -AB 13 63A 31 -18,-1.9 -19,-1.5 -2,-0.3 -18,-1.3 -0.998 15.1-169.9-132.1 130.5 10.3 4.9 5.1 32 32 A V E -A 11 0A 10 30,-2.2 2,-0.5 -2,-0.4 -21,-0.2 -0.957 10.3-159.6-121.2 140.1 11.9 3.1 8.0 33 33 A Q E +A 10 0A 82 -23,-2.8 -23,-2.4 -2,-0.4 2,-0.3 -0.983 27.2 162.3-114.1 123.2 14.5 0.3 8.1 34 34 A S E - 0 0 21 -2,-0.5 -26,-0.1 -25,-0.2 4,-0.1 -0.981 31.8-133.4-150.0 128.6 14.5 -1.6 11.4 35 35 A K E S+A 7 0A 101 -28,-1.1 -28,-2.4 -2,-0.3 2,-0.2 -0.954 104.1 26.7-128.6 113.7 15.8 -4.9 12.7 36 36 A P S S- 0 0 58 0, 0.0 51,-0.1 0, 0.0 -29,-0.1 0.576 123.0 -93.0 -70.5 171.8 13.8 -6.3 14.2 37 37 A T - 0 0 125 -2,-0.2 2,-0.1 1,-0.1 -2,-0.1 -0.239 50.4-118.8 -55.1 137.4 10.8 -4.7 12.5 38 38 A A - 0 0 11 -4,-0.1 2,-0.3 47,-0.1 47,-0.2 -0.436 9.8-118.6 -86.9 149.6 9.7 -1.6 14.5 39 39 A E E -E 84 0B 136 45,-3.5 45,-2.9 -2,-0.1 2,-0.4 -0.668 33.9-149.3 -74.6 140.8 6.5 -0.7 16.2 40 40 A V E +E 83 0B 38 -2,-0.3 2,-0.4 43,-0.2 43,-0.2 -0.965 17.8 179.7-121.3 128.5 4.9 2.4 14.6 41 41 A K E -E 82 0B 88 41,-2.1 41,-2.6 -2,-0.4 2,-0.3 -0.989 12.4-152.6-126.7 137.7 2.8 5.0 16.4 42 42 A W E -E 81 0B 3 7,-0.4 7,-3.0 -2,-0.4 2,-0.3 -0.833 12.2-171.4-109.5 147.4 1.3 8.1 14.7 43 43 A Y E -EF 80 48B 55 37,-2.1 37,-2.3 -2,-0.3 2,-0.5 -0.991 18.5-158.3-138.6 144.2 0.4 11.3 16.5 44 44 A H E > S-EF 79 47B 37 3,-2.5 3,-1.9 -2,-0.3 35,-0.2 -0.984 88.0 -22.4-119.2 118.6 -1.4 14.6 15.7 45 45 A N T 3 S- 0 0 95 33,-2.8 -1,-0.1 -2,-0.5 34,-0.1 0.881 130.0 -47.1 45.3 48.2 -0.3 17.4 17.9 46 46 A G T 3 S+ 0 0 65 32,-0.2 2,-0.5 1,-0.2 -1,-0.3 0.179 115.5 111.2 90.7 -17.7 0.9 15.0 20.6 47 47 A V E < S-F 44 0B 71 -3,-1.9 -3,-2.5 1,-0.0 -1,-0.2 -0.805 73.6-112.8 -99.6 127.6 -2.2 12.8 20.6 48 48 A E E -F 43 0B 90 -2,-0.5 -5,-0.3 -5,-0.2 2,-0.3 -0.286 32.7-132.2 -61.3 132.1 -1.9 9.2 19.3 49 49 A L - 0 0 24 -7,-3.0 -7,-0.4 3,-0.0 2,-0.3 -0.629 18.0-162.1 -88.5 141.0 -3.9 8.6 16.0 50 50 A Q - 0 0 59 -2,-0.3 5,-0.2 1,-0.0 2,-0.0 -0.880 34.3 -91.7-115.8 153.6 -6.2 5.7 15.4 51 51 A E + 0 0 88 -2,-0.3 2,-0.3 3,-0.1 5,-0.2 -0.375 65.6 143.0 -53.0 133.5 -7.6 4.3 12.1 52 52 A S - 0 0 63 3,-3.0 188,-0.1 138,-0.0 189,-0.0 -0.932 68.8 -79.3-160.4-176.2 -10.9 6.0 11.4 53 53 A S S S+ 0 0 26 -2,-0.3 187,-0.2 1,-0.2 3,-0.1 0.747 132.9 38.9 -65.0 -21.1 -13.2 7.4 8.7 54 54 A K S S+ 0 0 42 1,-0.2 15,-2.6 185,-0.1 2,-0.5 0.733 117.3 46.9 -96.8 -31.4 -10.9 10.5 8.8 55 55 A I E +C 68 0A 10 13,-0.2 -3,-3.0 -5,-0.2 2,-0.4 -0.964 56.3 173.7-126.5 124.6 -7.4 8.9 9.3 56 56 A H E +C 67 0A 91 11,-2.2 11,-2.4 -2,-0.5 2,-0.3 -0.940 5.8 176.2-133.7 113.4 -6.0 6.0 7.3 57 57 A Y E -C 66 0A 62 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.866 7.0-166.1-114.5 154.8 -2.4 4.9 7.8 58 58 A T E -C 65 0A 49 7,-2.3 7,-1.7 -2,-0.3 2,-0.3 -0.871 9.4-163.0-132.6 166.3 -0.6 1.9 6.2 59 59 A N E +C 64 0A 82 -2,-0.3 2,-0.6 5,-0.2 5,-0.2 -0.832 12.4 171.1-156.7 103.7 2.6 0.1 6.8 60 60 A T E > S-C 63 0A 93 3,-2.3 3,-2.4 -2,-0.3 -2,-0.0 -0.930 76.3 -38.1-123.7 103.9 4.1 -2.2 4.2 61 61 A S T 3 S- 0 0 124 -2,-0.6 3,-0.1 1,-0.3 -1,-0.1 0.835 125.3 -41.1 52.2 38.5 7.6 -3.5 4.9 62 62 A G T 3 S+ 0 0 10 1,-0.3 -30,-2.2 -24,-0.1 2,-0.8 0.237 109.2 121.4 97.9 -15.5 8.7 -0.2 6.4 63 63 A V E < -BC 31 60A 68 -3,-2.4 -3,-2.3 -32,-0.2 2,-0.4 -0.763 47.4-166.9 -83.9 112.8 6.9 2.0 3.9 64 64 A L E -BC 30 59A 0 -34,-2.9 -34,-2.3 -2,-0.8 2,-0.4 -0.874 11.0-176.9-111.4 132.9 4.6 4.1 6.0 65 65 A T E -BC 29 58A 34 -7,-1.7 -7,-2.3 -2,-0.4 2,-0.5 -0.985 8.7-167.3-127.9 138.7 1.8 6.3 4.8 66 66 A L E -BC 28 57A 0 -38,-2.6 -38,-2.6 -2,-0.4 2,-0.5 -0.993 8.9-169.0-121.6 123.9 -0.6 8.5 6.6 67 67 A E E -BC 27 56A 25 -11,-2.4 -11,-2.2 -2,-0.5 2,-0.5 -0.944 6.1-167.0-110.9 133.7 -3.7 9.9 4.9 68 68 A I E -BC 26 55A 0 -42,-2.4 -42,-2.3 -2,-0.5 3,-0.3 -0.985 16.6-148.4-114.6 125.4 -5.9 12.6 6.3 69 69 A L + 0 0 13 -15,-2.6 -44,-0.2 -2,-0.5 3,-0.2 -0.655 67.1 2.3 -93.7 146.6 -9.3 13.1 4.5 70 70 A D S S- 0 0 14 -47,-0.4 -1,-0.2 -2,-0.3 -45,-0.2 0.910 86.2-142.3 53.2 59.5 -11.3 16.2 4.0 71 71 A C + 0 0 0 -47,-2.6 -48,-3.0 -3,-0.3 2,-0.2 -0.252 28.0 170.8 -65.6 129.8 -8.8 18.5 5.7 72 72 A H > - 0 0 79 -50,-0.2 3,-2.0 -3,-0.2 4,-0.4 -0.733 52.2 -82.2-126.4-179.3 -10.0 21.4 7.8 73 73 A T G > S+ 0 0 114 1,-0.3 3,-1.9 -2,-0.2 25,-0.2 0.854 125.3 60.2 -52.8 -40.1 -8.4 23.9 10.2 74 74 A D G 3 S+ 0 0 129 1,-0.3 -1,-0.3 3,-0.0 -3,-0.1 0.760 97.6 61.9 -59.2 -25.9 -8.4 21.4 13.0 75 75 A D G < S+ 0 0 17 -3,-2.0 -1,-0.3 2,-0.0 -2,-0.2 0.551 82.8 102.5 -81.5 -8.5 -6.2 19.1 10.9 76 76 A S < + 0 0 29 -3,-1.9 2,-0.3 -4,-0.4 21,-0.2 -0.245 57.9 53.2 -65.7 162.8 -3.4 21.6 10.7 77 77 A G E S- G 0 96B 19 19,-2.2 19,-2.7 -33,-0.0 2,-0.4 -0.744 89.5 -10.2 114.5-156.9 -0.3 21.2 12.9 78 78 A T E - G 0 95B 46 -2,-0.3 -33,-2.8 17,-0.2 2,-0.5 -0.694 43.6-169.5 -94.4 128.4 2.3 18.5 13.6 79 79 A Y E -EG 44 94B 1 15,-2.9 15,-2.1 -2,-0.4 2,-0.4 -0.959 14.7-172.2-110.0 131.3 2.1 14.9 12.5 80 80 A R E -EG 43 93B 97 -37,-2.3 -37,-2.1 -2,-0.5 2,-0.4 -0.984 16.2-162.2-132.0 131.0 4.6 12.6 14.1 81 81 A A E -EG 42 92B 0 11,-2.6 11,-2.3 -2,-0.4 2,-0.5 -0.936 10.4-165.0-108.0 135.7 5.6 9.0 13.4 82 82 A V E -EG 41 91B 17 -41,-2.6 -41,-2.1 -2,-0.4 2,-0.5 -0.982 0.9-164.0-125.3 119.7 7.5 7.2 16.1 83 83 A C E -EG 40 90B 0 7,-3.3 7,-2.4 -2,-0.5 2,-0.4 -0.914 13.0-175.8-110.3 127.0 9.2 4.0 15.3 84 84 A T E +EG 39 89B 47 -45,-2.9 -45,-3.5 -2,-0.5 2,-0.3 -0.966 16.1 152.9-131.9 134.1 10.4 1.7 18.1 85 85 A N E > - 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