==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CARBOHYDRATE-BINDING PROTEIN 18-MAR-11 3R50 . COMPND 2 MOLECULE: IPOMOELIN; . SOURCE 2 ORGANISM_SCIENTIFIC: IPOMOEA BATATAS; . AUTHOR K.L.LIU,W.C.CHANG,S.T.JENG,Y.S.CHENG . 764 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29164.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 547 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 401 52.5 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 . 9 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 11 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 5 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 83 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 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 . 1 3 0 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 PARALLEL BRIDGES PER LADDER . 3 4 2 4 11 15 1 3 7 4 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 2 3 0 0 1 0 1 0 1 0 0 1 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 2 A A 0 0 64 0, 0.0 2,-0.1 0, 0.0 245,-0.0 0.000 360.0 360.0 360.0 -5.5 45.1 121.6 121.7 2 3 A L - 0 0 74 1,-0.1 2,-1.4 429,-0.1 429,-0.2 -0.209 360.0-149.7 -50.0 113.4 46.1 117.9 122.2 3 4 A Q E -a 431 0A 6 427,-1.8 429,-1.7 -2,-0.1 2,-1.1 -0.684 17.7-176.0 -86.2 84.8 43.3 115.9 123.8 4 5 A L E -a 432 0A 42 -2,-1.4 169,-1.5 167,-0.3 429,-0.2 -0.770 36.5-112.1 -86.5 101.6 45.3 113.4 125.7 5 6 A A - 0 0 3 427,-1.6 2,-0.3 -2,-1.1 429,-0.3 0.053 27.8-137.0 -36.9 129.0 42.6 111.1 127.1 6 7 A A - 0 0 6 163,-0.2 316,-3.1 317,-0.2 2,-0.2 -0.693 20.7-129.0 -91.7 148.4 42.2 111.4 130.8 7 8 A H E -E 321 0B 21 -2,-0.3 2,-0.4 314,-0.2 314,-0.2 -0.527 12.1-155.1-101.8 162.8 41.6 108.2 132.8 8 9 A S E -E 320 0B 6 312,-2.6 312,-2.0 -2,-0.2 285,-0.1 -0.997 32.2-108.6-131.1 136.3 39.2 106.9 135.4 9 10 A D - 0 0 3 -2,-0.4 142,-0.1 310,-0.2 167,-0.0 -0.249 34.2 -98.6 -67.6 150.0 40.1 104.2 137.9 10 11 A A E -S 150 0C 13 140,-0.8 140,-1.9 309,-0.1 2,-0.3 -0.167 41.4-141.0 -57.6 157.5 38.9 100.6 137.9 11 12 A R E -ST 149 317C 22 306,-2.0 306,-2.4 138,-0.2 2,-0.5 -0.948 14.0-158.0-129.3 149.0 36.0 99.8 140.3 12 13 A S E -ST 148 316C 0 136,-2.4 136,-2.6 -2,-0.3 304,-0.2 -0.994 52.7 -59.4-124.5 118.4 35.0 96.9 142.5 13 14 A G E - 0 0 4 302,-3.3 134,-0.2 -2,-0.5 2,-0.1 -0.600 19.6-130.5 101.9-156.3 31.3 96.8 143.4 14 15 A P E - 0 0 10 0, 0.0 2,-0.3 0, 0.0 133,-0.3 0.441 38.7-175.8 -80.6 162.6 29.1 98.3 144.6 15 16 A V E +S 146 0C 12 131,-2.6 131,-2.2 -3,-0.2 2,-0.4 -0.868 46.3 45.0-118.4 154.0 27.6 95.7 147.0 16 17 A G E S-S 145 0C 15 -2,-0.3 143,-0.4 129,-0.2 2,-0.3 -0.965 94.4 -44.4 119.9-131.2 24.5 96.2 149.1 17 18 A S - 0 0 10 127,-2.3 143,-0.2 -2,-0.4 121,-0.2 -0.963 58.4 -82.3-142.9 158.3 21.3 97.8 147.8 18 19 A N - 0 0 56 141,-1.0 2,-0.3 -2,-0.3 143,-0.1 -0.219 48.0-170.4 -54.1 146.8 20.0 100.7 145.8 19 20 A G - 0 0 6 143,-0.1 143,-0.3 1,-0.1 121,-0.1 -0.849 35.8-102.6-138.9 169.4 19.7 104.0 147.6 20 21 A G S S+ 0 0 62 -2,-0.3 2,-0.4 1,-0.1 120,-0.2 0.867 102.0 37.0 -64.6 -39.4 18.3 107.4 147.1 21 22 A Q E S-U 139 0C 66 118,-2.0 118,-1.6 -3,-0.0 2,-0.3 -0.947 70.3-138.3-124.5 138.5 21.6 109.1 146.4 22 23 A F E -U 138 0C 4 -2,-0.4 2,-0.3 116,-0.2 116,-0.3 -0.619 28.6-169.9 -80.1 141.5 24.8 108.0 144.6 23 24 A W E -U 137 0C 0 114,-2.7 114,-2.5 -2,-0.3 2,-0.3 -0.964 10.0-177.0-134.2 156.1 27.9 109.1 146.4 24 25 A S E +UV 136 181C 0 157,-2.1 157,-2.9 -2,-0.3 2,-0.3 -0.962 8.8 173.7-155.1 134.5 31.6 109.1 145.4 25 26 A F E +UV 135 180C 0 110,-3.3 110,-2.7 -2,-0.3 155,-0.2 -0.837 12.5 154.5-147.3 104.0 34.9 110.0 147.2 26 27 A R E - V 0 179C 3 153,-2.7 153,-1.7 -2,-0.3 108,-0.2 -0.859 25.5-164.7-131.8 91.0 38.3 109.4 145.6 27 28 A P - 0 0 0 0, 0.0 150,-0.1 0, 0.0 4,-0.1 -0.386 27.8-120.7 -77.5 157.9 40.8 111.8 147.0 28 29 A V S S+ 0 0 18 189,-0.4 149,-0.1 148,-0.1 190,-0.1 0.911 99.5 51.1 -63.7 -44.9 44.3 112.6 145.5 29 30 A R S S- 0 0 98 1,-0.1 147,-0.0 26,-0.1 0, 0.0 -0.537 105.4 -85.1 -91.8 160.2 46.1 111.4 148.6 30 31 A P - 0 0 72 0, 0.0 26,-0.2 0, 0.0 2,-0.2 -0.169 45.6-100.5 -63.3 156.8 45.5 108.1 150.3 31 32 A L + 0 0 9 101,-0.3 50,-0.4 24,-0.1 24,-0.3 -0.527 45.7 162.5 -74.0 143.0 42.7 107.6 152.8 32 33 A N + 0 0 36 22,-2.7 47,-1.1 1,-0.3 2,-0.3 0.381 56.0 48.0-144.0 1.8 43.8 107.6 156.5 33 34 A K E +BC 54 78D 73 21,-1.8 21,-2.2 45,-0.2 2,-0.4 -0.951 51.6 178.5-148.9 126.9 40.8 108.2 158.7 34 35 A I E -BC 53 77D 0 43,-2.2 43,-3.4 -2,-0.3 2,-0.5 -0.997 9.2-163.7-130.3 128.6 37.5 106.5 158.7 35 36 A V E -BC 52 76D 22 17,-2.7 17,-3.0 -2,-0.4 2,-0.5 -0.959 3.0-161.5-115.1 118.3 34.7 107.4 161.2 36 37 A L E -BC 51 75D 0 39,-2.4 39,-2.3 -2,-0.5 2,-0.5 -0.879 7.8-157.6 -99.8 124.4 31.8 105.0 161.6 37 38 A S E -BC 50 74D 8 13,-2.8 12,-3.1 -2,-0.5 13,-1.7 -0.922 17.0-176.6-107.6 120.4 28.8 106.6 163.3 38 39 A F E -BC 48 73D 0 35,-3.4 34,-2.5 -2,-0.5 35,-1.2 -0.627 21.9-141.3-115.4 171.0 26.3 104.2 165.0 39 40 A S E S+B 47 0D 8 8,-1.1 8,-2.9 32,-0.2 2,-0.1 -0.715 72.7 26.6-118.9 169.3 23.0 104.1 166.8 40 41 A G E S-B 46 0D 30 -2,-0.3 6,-0.2 6,-0.2 -2,-0.1 -0.447 96.6 -72.3 74.7-148.1 22.2 101.9 169.8 41 42 A S - 0 0 33 4,-1.2 3,-0.3 -2,-0.1 32,-0.1 -0.996 26.1-112.2-151.6 153.6 25.1 100.8 172.0 42 43 A P S S+ 0 0 72 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.830 118.0 47.7 -50.4 -42.0 28.2 98.5 172.0 43 44 A D S S+ 0 0 141 2,-0.1 3,-0.1 -3,-0.0 -3,-0.0 0.862 124.8 29.2 -70.5 -38.5 26.6 96.2 174.7 44 45 A Q S S- 0 0 153 -3,-0.3 2,-0.5 1,-0.2 -4,-0.0 0.480 125.6 -40.5 -88.8-125.5 23.3 96.1 172.9 45 46 A T - 0 0 67 71,-0.1 -4,-1.2 2,-0.0 2,-0.6 -0.918 50.7-144.1-111.6 133.6 23.1 96.4 169.2 46 47 A L E -B 40 0D 23 -2,-0.5 2,-0.7 -6,-0.2 70,-0.7 -0.852 12.9-158.3 -96.1 122.6 25.2 98.8 167.2 47 48 A N E -B 39 0D 14 -8,-2.9 -8,-1.1 -2,-0.6 2,-0.2 -0.844 9.2-143.7-108.3 105.1 23.5 100.4 164.2 48 49 A L E +B 38 0D 1 -2,-0.7 95,-0.3 52,-0.5 -10,-0.3 -0.429 32.9 158.8 -63.2 121.6 25.7 101.8 161.5 49 50 A I E + 0 0 7 -12,-3.1 16,-1.4 1,-0.4 2,-0.3 0.672 58.0 8.7-118.3 -28.3 24.0 104.9 160.1 50 51 A S E -BD 37 64D 5 -13,-1.7 -13,-2.8 14,-0.3 -1,-0.4 -0.988 55.1-150.7-150.6 159.4 26.8 107.0 158.5 51 52 A I E -BD 36 63D 0 12,-2.5 12,-2.7 -2,-0.3 2,-0.6 -0.996 4.8-156.6-132.8 136.2 30.4 106.8 157.5 52 53 A T E -BD 35 62D 20 -17,-3.0 -17,-2.7 -2,-0.4 2,-0.4 -0.945 11.2-164.2-115.1 115.7 32.9 109.7 157.3 53 54 A F E -BD 34 61D 0 8,-2.2 8,-2.2 -2,-0.6 2,-0.4 -0.811 12.2-175.7 -98.5 142.1 35.9 109.1 155.0 54 55 A S E -BD 33 60D 17 -21,-2.2 -22,-2.7 -2,-0.4 -21,-1.8 -0.992 23.4-173.2-144.9 143.7 38.9 111.3 155.3 55 56 A S E > - D 0 59D 0 4,-2.8 4,-1.1 -2,-0.4 -24,-0.1 -0.979 52.6 -78.3-132.5 115.2 42.3 111.9 153.7 56 57 A N T 4 S+ 0 0 89 -2,-0.5 -27,-0.1 -26,-0.2 -2,-0.0 -0.319 102.8 32.5 -60.9 136.9 44.5 114.4 155.4 57 58 A P T 4 S- 0 0 72 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 0.609 126.3 -44.5-114.0 154.3 44.2 117.2 155.3 58 59 A T T 4 S+ 0 0 89 1,-0.2 2,-0.9 158,-0.1 -2,-0.2 0.102 91.1 123.6 69.3 -25.9 40.7 118.6 154.9 59 60 A D E < +D 55 0D 3 -4,-1.1 -4,-2.8 -2,-0.7 2,-0.3 -0.561 41.0 145.7 -68.7 104.5 39.6 116.1 152.2 60 61 A I E -DE 54 215D 36 155,-2.1 155,-2.9 -2,-0.9 2,-0.3 -0.989 28.7-178.3-145.9 154.2 36.5 114.6 153.9 61 62 A I E -D 53 0D 0 -8,-2.2 -8,-2.2 -2,-0.3 2,-0.4 -0.987 11.4-155.5-149.7 151.1 33.0 113.2 153.1 62 63 A T E -D 52 0D 27 -2,-0.3 121,-0.4 -10,-0.3 2,-0.4 -0.996 13.3-172.8-130.3 122.3 30.1 111.8 155.1 63 64 A V E +D 51 0D 0 -12,-2.7 -12,-2.5 -2,-0.4 80,-0.1 -0.927 55.3 12.1-120.1 146.0 27.6 109.4 153.6 64 65 A G E S+D 50 0D 1 -2,-0.4 78,-0.3 -14,-0.2 -14,-0.3 -0.321 80.4 95.8 81.7-177.4 24.4 108.2 155.2 65 66 A G + 0 0 23 76,-2.2 76,-0.2 -16,-1.4 -15,-0.1 0.537 41.6 125.6 76.4 6.2 23.1 109.9 158.4 66 67 A V + 0 0 60 74,-1.6 75,-0.2 -17,-0.2 -1,-0.1 0.650 53.7 93.6 -71.6 -13.7 20.7 112.2 156.6 67 68 A G S S- 0 0 17 74,-0.3 -18,-0.0 73,-0.2 73,-0.0 -0.309 86.6-114.4 -78.6 165.2 18.0 110.8 158.9 68 69 A P S S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.686 77.1 115.9 -69.9 -23.7 16.7 112.2 162.3 69 70 A E S S- 0 0 45 1,-0.1 2,-0.2 -20,-0.0 -2,-0.1 -0.287 70.1-121.6 -54.2 124.0 17.9 109.3 164.3 70 71 A P - 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