==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 31-MAR-03 1OWW . COMPND 2 MOLECULE: FIBRONECTIN FIRST TYPE III MODULE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.GAO,D.CRAIG,O.LEQUIN,I.D.CAMPBELL,V.VOGEL,K.SCHULTEN . 93 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5914.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 50 53.8 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 . 36 38.7 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 . 1 1.1 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-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 . 1 1.1 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 . 10 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 2.2 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 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 . 0 0 1 1 1 0 0 1 0 1 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 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 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 S 0 0 55 0, 0.0 25,-0.1 0, 0.0 29,-0.1 0.000 360.0 360.0 360.0 144.6 10.4 -3.2 -3.9 2 2 A G - 0 0 13 73,-0.2 81,-0.1 23,-0.1 83,-0.1 -0.317 360.0 -14.1 100.9-179.5 7.8 -2.8 -1.2 3 3 A P - 0 0 96 0, 0.0 82,-0.1 0, 0.0 2,-0.1 -0.307 68.8-128.0 -62.2 133.1 7.8 -1.5 2.3 4 4 A V - 0 0 9 69,-0.3 2,-1.2 1,-0.1 20,-0.2 -0.348 20.3-109.6 -81.0 155.3 11.2 -1.0 3.9 5 5 A E E +A 23 0A 121 18,-2.3 18,-1.1 -2,-0.1 2,-0.3 -0.729 53.3 165.8 -94.5 89.0 12.2 -2.5 7.2 6 6 A V E -A 22 0A 23 -2,-1.2 2,-0.3 16,-0.2 16,-0.2 -0.825 13.3-170.1-115.6 140.2 12.4 0.7 9.2 7 7 A F E -A 21 0A 121 14,-1.7 2,-1.2 -2,-0.3 14,-0.7 -0.812 35.3-101.2-130.5 166.1 12.6 0.9 13.0 8 8 A I + 0 0 96 -2,-0.3 2,-0.3 12,-0.1 12,-0.1 -0.781 56.0 164.1 -91.0 90.5 12.4 3.4 15.7 9 9 A T + 0 0 45 -2,-1.2 2,-0.1 12,-0.1 12,-0.0 -0.780 17.3 169.9-106.4 154.8 16.1 3.8 16.5 10 10 A E - 0 0 71 -2,-0.3 3,-0.1 8,-0.1 10,-0.1 -0.520 14.1-172.5-169.2 82.7 17.5 6.6 18.5 11 11 A T - 0 0 84 8,-0.4 2,-0.4 1,-0.2 -2,-0.0 -0.323 53.4 -54.8 -80.8 166.7 21.2 5.9 19.3 12 12 A P S S+ 0 0 140 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.279 95.6 108.1 -61.1 106.1 23.0 8.3 21.7 13 13 A S S S- 0 0 72 -2,-0.4 -3,-0.0 4,-0.1 5,-0.0 -0.656 76.0 -53.6-151.2-163.9 22.6 11.8 20.1 14 14 A Q > - 0 0 115 -2,-0.2 3,-0.6 1,-0.1 -1,-0.1 -0.462 43.0-123.1 -83.4 157.4 20.6 14.9 20.9 15 15 A P T 3 S+ 0 0 42 0, 0.0 51,-0.1 0, 0.0 -1,-0.1 0.525 115.0 60.7 -82.2 -5.6 16.8 14.7 21.5 16 16 A N T 3 S+ 0 0 51 49,-0.1 47,-1.4 75,-0.1 46,-0.3 0.530 101.0 67.5 -91.2 -15.4 16.5 17.2 18.6 17 17 A S < - 0 0 6 -3,-0.6 44,-0.2 44,-0.2 -4,-0.1 -0.778 64.7-168.2-102.6 150.0 18.2 14.7 16.4 18 18 A H E - B 0 60A 0 42,-1.0 42,-2.1 -2,-0.3 2,-1.1 -0.798 6.0-161.2-139.3 94.4 16.6 11.4 15.4 19 19 A P E - B 0 59A 16 0, 0.0 -8,-0.4 0, 0.0 40,-0.2 -0.709 18.9-176.4 -78.2 101.4 18.9 8.9 13.8 20 20 A I E - B 0 58A 2 38,-1.8 38,-1.9 -2,-1.1 2,-0.3 -0.550 7.6-160.9 -90.6 156.7 16.5 6.5 12.0 21 21 A Q E -AB 7 57A 91 -14,-0.7 -14,-1.7 36,-0.2 2,-0.3 -0.985 7.0-174.4-139.8 146.4 17.8 3.4 10.2 22 22 A W E -A 6 0A 0 34,-2.4 2,-0.4 -2,-0.3 -16,-0.2 -0.895 16.4-139.8-135.1 161.7 16.0 1.4 7.6 23 23 A N E -A 5 0A 56 -18,-1.1 -18,-2.3 -2,-0.3 -2,-0.0 -0.997 23.3-132.2-132.6 127.7 16.9 -1.9 5.9 24 24 A A - 0 0 52 -2,-0.4 -20,-0.0 -20,-0.2 32,-0.0 -0.251 18.2-105.9 -81.2 160.0 16.2 -2.3 2.2 25 25 A P - 0 0 40 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 -0.197 35.7-107.2 -67.3 173.9 14.6 -5.2 0.2 26 26 A Q S S+ 0 0 197 -25,-0.1 -2,-0.1 2,-0.1 2,-0.0 0.897 93.9 79.3 -80.2 -42.4 16.7 -7.5 -1.9 27 27 A P S S- 0 0 80 0, 0.0 2,-0.7 0, 0.0 3,-0.4 -0.377 77.1-134.2 -66.6 148.1 15.7 -6.3 -5.4 28 28 A S S S+ 0 0 103 1,-0.2 -2,-0.1 50,-0.0 50,-0.0 -0.499 74.8 112.9 -99.0 58.5 17.4 -3.1 -6.7 29 29 A H + 0 0 68 -2,-0.7 49,-0.9 48,-0.1 2,-0.5 0.396 60.4 80.8-104.4 -5.9 14.1 -1.7 -7.9 30 30 A I E +C 77 0B 21 -3,-0.4 47,-0.2 47,-0.2 3,-0.1 -0.902 50.5 165.4-106.7 131.3 14.3 1.0 -5.3 31 31 A S E + 0 0 47 45,-2.7 -1,-0.2 -2,-0.5 46,-0.2 0.752 55.6 23.3-104.0 -84.2 16.5 4.0 -6.1 32 32 A K E - 0 0 103 44,-0.5 44,-0.8 45,-0.3 2,-0.4 -0.296 59.5-144.6 -88.9 167.3 16.0 6.9 -3.8 33 33 A Y E -CD 75 51B 11 18,-2.0 18,-2.5 42,-0.2 2,-0.4 -0.991 9.7-168.3-126.0 139.3 14.6 7.3 -0.3 34 34 A I E -CD 74 50B 11 40,-2.8 40,-1.7 -2,-0.4 2,-0.5 -0.976 6.4-161.4-115.0 136.3 12.5 10.3 0.8 35 35 A L E +CD 73 49B 0 14,-1.7 14,-2.6 -2,-0.4 2,-0.3 -0.986 12.3 178.5-111.5 133.6 11.9 10.7 4.5 36 36 A R E -CD 72 48B 64 36,-2.6 36,-2.4 -2,-0.5 2,-0.3 -0.935 2.2-176.4-128.7 154.8 9.1 13.0 5.4 37 37 A W E -CD 71 47B 14 10,-2.0 10,-2.0 -2,-0.3 34,-0.2 -0.988 10.0-176.3-153.4 144.5 7.9 13.7 8.9 38 38 A R E -C 70 0B 34 32,-2.2 32,-2.7 -2,-0.3 2,-0.5 -0.985 38.8-108.5-142.5 134.0 5.1 15.7 10.5 39 39 A P E > -C 69 0B 29 0, 0.0 2,-1.5 0, 0.0 3,-0.8 -0.631 36.8-124.7 -72.3 116.7 4.6 16.2 14.2 40 40 A K T 3 S+ 0 0 103 28,-1.0 28,-0.2 -2,-0.5 3,-0.1 -0.498 91.3 80.8 -69.9 85.0 1.5 14.0 15.0 41 41 A N T 3 S+ 0 0 120 -2,-1.5 -1,-0.2 1,-1.1 2,-0.2 0.202 100.7 17.3-147.5 -67.8 -0.7 16.7 16.6 42 42 A S < - 0 0 78 -3,-0.8 -1,-1.1 3,-0.1 -4,-0.0 -0.589 68.4-133.8-103.3 170.3 -2.1 18.5 13.5 43 43 A V S S+ 0 0 102 -2,-0.2 3,-0.1 -3,-0.1 -3,-0.1 -0.456 70.7 110.5-119.8 53.4 -2.2 17.2 10.0 44 44 A G S S- 0 0 39 1,-0.3 2,-0.1 0, 0.0 0, 0.0 0.395 71.1 -11.1-100.3-131.5 -0.9 20.5 8.5 45 45 A R - 0 0 243 1,-0.0 -1,-0.3 -7,-0.0 2,-0.3 -0.427 67.0-176.3 -79.8 148.5 2.4 21.5 6.9 46 46 A W - 0 0 83 -2,-0.1 2,-0.2 -8,-0.1 -8,-0.2 -0.885 19.0-116.6-148.5 169.9 5.3 19.1 7.1 47 47 A K E -D 37 0B 128 -10,-2.0 -10,-2.0 -2,-0.3 2,-0.3 -0.683 22.9-178.4-112.3 159.1 9.0 18.6 6.2 48 48 A E E -D 36 0B 108 -2,-0.2 2,-0.3 -12,-0.2 -12,-0.2 -0.979 8.4-166.9-151.6 160.7 10.9 16.3 4.0 49 49 A A E -D 35 0B 18 -14,-2.6 -14,-1.7 -2,-0.3 2,-0.5 -0.912 21.0-129.5-137.4 163.7 14.4 15.4 2.9 50 50 A T E -D 34 0B 85 -2,-0.3 -16,-0.2 -16,-0.2 -2,-0.0 -0.990 23.1-168.8-120.4 125.2 15.8 13.3 0.1 51 51 A I E -D 33 0B 3 -18,-2.5 -18,-2.0 -2,-0.5 7,-0.1 -0.920 25.7-110.2-114.1 136.5 18.4 10.7 1.1 52 52 A P - 0 0 60 0, 0.0 3,-0.4 0, 0.0 -20,-0.1 -0.166 24.8-114.3 -64.2 163.7 20.5 8.8 -1.5 53 53 A G S S+ 0 0 41 1,-0.2 -21,-0.1 3,-0.1 -23,-0.1 0.633 112.1 58.7 -76.3 -18.4 20.0 5.1 -2.2 54 54 A H S S+ 0 0 148 2,-0.0 2,-0.4 0, 0.0 -1,-0.2 0.752 93.3 77.4 -83.3 -25.2 23.4 4.1 -1.0 55 55 A L - 0 0 75 -3,-0.4 -4,-0.1 1,-0.1 3,-0.0 -0.735 55.0-179.1 -88.4 131.6 22.7 5.5 2.5 56 56 A N + 0 0 75 -2,-0.4 -34,-2.4 -32,-0.0 2,-0.3 0.186 66.3 49.8-113.7 8.8 20.4 3.3 4.5 57 57 A S E -B 21 0A 51 -36,-0.2 2,-0.3 2,-0.0 -36,-0.2 -0.957 61.0-172.2-146.4 157.7 20.2 5.6 7.5 58 58 A Y E -B 20 0A 74 -38,-1.9 -38,-1.8 -2,-0.3 2,-0.6 -0.988 22.1-134.7-154.1 151.3 19.6 9.3 8.2 59 59 A T E -B 19 0A 53 -2,-0.3 2,-0.9 -40,-0.2 -2,-0.0 -0.956 17.2-156.3-108.6 114.0 19.7 11.8 11.0 60 60 A I E -B 18 0A 0 -42,-2.1 -42,-1.0 -2,-0.6 2,-0.2 -0.831 25.5-179.0 -92.0 102.3 16.6 13.9 11.1 61 61 A K + 0 0 127 -2,-0.9 -44,-0.2 -44,-0.2 -2,-0.0 -0.636 47.9 53.3-106.5 162.3 17.8 17.0 12.9 62 62 A G S S+ 0 0 53 -46,-0.3 2,-0.2 -2,-0.2 -1,-0.2 0.926 76.7 138.4 79.9 52.5 16.1 20.2 13.9 63 63 A L - 0 0 16 -47,-1.4 -1,-0.2 -3,-0.1 -46,-0.0 -0.642 55.2-106.7-118.1 173.1 13.2 18.6 15.8 64 64 A K - 0 0 105 -2,-0.2 3,-0.5 1,-0.0 2,-0.1 -0.759 35.9-117.7 -98.1 147.3 11.5 19.3 19.0 65 65 A P S S+ 0 0 76 0, 0.0 27,-0.2 0, 0.0 3,-0.1 -0.470 88.5 20.6 -78.6 161.0 12.1 17.1 22.1 66 66 A G S S+ 0 0 61 1,-0.2 2,-0.3 -2,-0.1 26,-0.2 0.682 96.1 116.8 59.6 30.3 9.4 15.0 23.8 67 67 A V E - E 0 91B 24 24,-0.7 24,-2.3 -3,-0.5 2,-0.4 -0.889 62.0-123.4-128.4 154.6 7.0 14.9 20.8 68 68 A V E - E 0 90B 49 -2,-0.3 -28,-1.0 -28,-0.2 2,-0.4 -0.821 25.0-167.1 -96.5 135.7 5.6 12.2 18.6 69 69 A Y E -CE 39 89B 8 20,-2.5 20,-2.1 -2,-0.4 2,-0.4 -0.925 17.8-138.4-113.9 147.4 6.1 12.5 14.8 70 70 A E E -CE 38 88B 32 -32,-2.7 -32,-2.2 -2,-0.4 2,-0.4 -0.894 32.5-166.8 -95.9 136.5 4.3 10.5 12.2 71 71 A G E -CE 37 87B 0 16,-1.6 16,-2.0 -2,-0.4 2,-0.4 -0.956 16.5-166.3-132.6 146.4 7.0 9.5 9.6 72 72 A Q E -CE 36 86B 36 -36,-2.4 -36,-2.6 -2,-0.4 2,-0.7 -1.000 8.8-158.7-136.7 133.5 6.9 8.1 6.2 73 73 A L E -CE 35 85B 0 12,-1.8 12,-1.3 -2,-0.4 2,-0.5 -0.933 16.9-166.7-112.6 100.1 9.8 6.6 4.3 74 74 A I E -CE 34 84B 8 -40,-1.7 -40,-2.8 -2,-0.7 2,-0.6 -0.804 4.9-155.7 -94.8 129.3 8.7 6.8 0.6 75 75 A S E -CE 33 83B 0 8,-2.0 8,-2.8 -2,-0.5 2,-0.3 -0.932 7.5-148.6-113.5 113.8 11.0 4.8 -1.6 76 76 A I E - E 0 82B 33 -44,-0.8 -45,-2.7 -2,-0.6 -44,-0.5 -0.603 14.1-141.3 -89.4 142.7 11.1 6.0 -5.3 77 77 A Q E -C 30 0B 17 4,-2.1 2,-1.8 -2,-0.3 -45,-0.3 -0.138 42.4 -60.6 -92.5-175.6 11.6 3.4 -7.9 78 78 A Q S S- 0 0 112 -49,-0.9 3,-0.1 1,-0.2 -1,-0.1 -0.534 102.4 -55.3 -74.8 78.2 13.5 3.3 -11.2 79 79 A Y S S+ 0 0 244 -2,-1.8 -1,-0.2 1,-0.2 3,-0.1 0.644 129.2 79.6 60.1 21.8 11.7 6.2 -13.0 80 80 A G S S- 0 0 61 1,-0.4 -1,-0.2 0, 0.0 -4,-0.0 0.316 90.2 -17.1-119.3-118.9 8.5 4.3 -12.4 81 81 A H - 0 0 127 -3,-0.1 -4,-2.1 -5,-0.1 -1,-0.4 0.032 56.4-129.5 -81.3-171.6 6.2 4.0 -9.4 82 82 A Q E -E 76 0B 97 -6,-0.2 2,-0.3 -3,-0.1 -6,-0.2 -0.979 10.6-144.2-144.7 146.5 7.0 4.8 -5.8 83 83 A E E -E 75 0B 39 -8,-2.8 -8,-2.0 -2,-0.3 2,-0.4 -0.710 12.8-144.1-105.2 156.2 6.4 2.6 -2.7 84 84 A V E -E 74 0B 72 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.990 11.5-170.9-129.5 135.8 5.4 4.0 0.7 85 85 A T E -E 73 0B 9 -12,-1.3 -12,-1.8 -2,-0.4 2,-0.3 -0.974 16.9-163.7-118.6 133.4 6.4 2.7 4.1 86 86 A R E +E 72 0B 193 -2,-0.4 2,-0.3 -14,-0.2 -14,-0.2 -0.949 23.7 127.9-129.2 147.8 4.5 4.3 7.0 87 87 A F E -E 71 0B 42 -16,-2.0 -16,-1.6 -2,-0.3 2,-0.3 -0.897 42.2-118.0-166.1-176.1 5.2 4.4 10.8 88 88 A D E -E 70 0B 88 -18,-0.3 2,-0.3 -2,-0.3 -18,-0.2 -0.951 23.4-170.8-134.6 156.7 5.5 6.8 13.7 89 89 A F E -E 69 0B 1 -20,-2.1 -20,-2.5 -2,-0.3 2,-0.4 -0.941 13.4-135.4-138.1 165.2 8.5 7.5 15.9 90 90 A T E -E 68 0B 68 -2,-0.3 2,-0.4 -22,-0.2 -22,-0.2 -0.941 1.9-154.9-119.7 143.9 9.0 9.4 19.0 91 91 A T E -E 67 0B 2 -24,-2.3 -24,-0.7 -2,-0.4 2,-0.3 -0.958 26.3-179.4-109.0 135.1 11.7 11.9 20.0 92 92 A T 0 0 86 -2,-0.4 -2,-0.0 -26,-0.2 -24,-0.0 -0.961 360.0 360.0-139.7 149.5 12.2 12.0 23.7 93 93 A S 0 0 142 -2,-0.3 -1,-0.1 -77,-0.0 -77,-0.0 0.558 360.0 360.0-126.6 360.0 14.4 13.9 26.1