==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 02-FEB-10 3LNI . COMPND 2 MOLECULE: CADHERIN-1; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR O.HARRISON,X.JIN,L.SHAPIRO . 418 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22124.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 246 58.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 114 27.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 40 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 . 2 0 0 2 0 0 2 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 . 2 2 6 2 0 4 2 0 2 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 . 2 4 2 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 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 0 214 0, 0.0 26,-0.3 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 163.0 -11.7 5.6 32.5 2 2 A W - 0 0 44 24,-0.1 2,-0.5 88,-0.1 24,-0.1 -0.514 360.0-134.0 -86.9 163.7 -7.9 5.0 32.4 3 3 A V + 0 0 86 22,-0.6 22,-0.4 -2,-0.2 88,-0.0 -0.969 35.6 159.8-120.7 112.8 -5.4 7.3 30.8 4 4 A I - 0 0 59 -2,-0.5 3,-0.1 20,-0.1 20,-0.1 -0.885 16.9-167.2-139.9 108.3 -2.9 5.4 28.6 5 5 A P - 0 0 30 0, 0.0 89,-0.2 0, 0.0 2,-0.1 -0.275 42.7 -73.6 -81.7 171.7 -0.7 6.9 25.9 6 6 A P - 0 0 81 0, 0.0 2,-0.5 0, 0.0 89,-0.1 -0.436 48.7-157.1 -60.4 139.1 1.4 5.1 23.2 7 7 A I E +a 95 0A 8 87,-1.1 89,-2.9 -2,-0.1 2,-0.3 -0.992 16.7 169.7-123.3 125.9 4.5 3.5 24.6 8 8 A S E -a 96 0A 39 -2,-0.5 89,-0.2 87,-0.2 87,-0.0 -0.941 9.4-174.9-128.3 159.6 7.5 2.6 22.6 9 9 A C E -a 97 0A 4 87,-2.4 89,-2.1 -2,-0.3 2,-0.1 -0.955 25.2-123.0-149.7 129.2 11.0 1.5 23.5 10 10 A P E > -a 98 0A 13 0, 0.0 3,-0.6 0, 0.0 55,-0.4 -0.484 30.5-117.8 -70.8 145.7 14.0 0.9 21.2 11 11 A E T 3 S+ 0 0 3 87,-2.4 55,-0.2 1,-0.2 60,-0.0 -0.351 90.3 30.0 -70.8 162.5 15.7 -2.5 21.3 12 12 A N T 3 S+ 0 0 45 53,-2.5 338,-0.2 1,-0.2 -1,-0.2 0.684 76.7 167.7 62.7 26.9 19.3 -3.0 22.4 13 13 A E < - 0 0 31 -3,-0.6 336,-0.2 50,-0.1 2,-0.2 -0.405 14.3-165.0 -68.8 142.1 19.4 -0.1 24.8 14 14 A K + 0 0 57 334,-2.2 2,-0.2 -2,-0.1 -1,-0.0 -0.540 40.6 72.2-108.6-174.2 22.4 0.1 27.2 15 15 A G S S- 0 0 49 -2,-0.2 2,-0.2 2,-0.0 333,-0.1 -0.517 90.8 -17.3 105.2-167.9 23.0 2.2 30.3 16 16 A E S S- 0 0 179 -2,-0.2 47,-0.1 2,-0.0 -2,-0.0 -0.479 75.7-114.9 -78.1 141.9 21.5 1.8 33.7 17 17 A F S S+ 0 0 58 -2,-0.2 2,-0.2 45,-0.1 45,-0.2 -0.877 81.2 49.5-121.4 151.8 18.4 -0.3 34.2 18 18 A P S S- 0 0 68 0, 0.0 2,-0.4 0, 0.0 44,-0.2 0.607 70.6-165.8 -75.2 170.3 15.6 -0.1 35.0 19 19 A K E -E 61 0B 36 42,-2.3 42,-2.0 -2,-0.2 44,-0.1 -0.986 21.1-114.4-124.0 132.5 14.5 2.8 32.8 20 20 A N E +E 60 0B 93 -2,-0.4 40,-0.2 40,-0.2 3,-0.1 -0.307 32.4 171.8 -59.1 142.0 11.2 4.7 33.2 21 21 A L E - 0 0 23 38,-2.8 2,-0.3 1,-0.4 39,-0.2 0.667 59.8 -29.6-112.6 -71.8 8.6 4.5 30.5 22 22 A V E -E 59 0B 6 37,-0.6 37,-3.1 35,-0.1 2,-0.6 -0.965 56.4-112.5-146.8 155.9 5.4 6.3 31.6 23 23 A Q E -E 58 0B 78 -2,-0.3 2,-0.3 35,-0.2 35,-0.3 -0.875 28.3-147.0 -95.7 123.3 3.5 6.9 34.8 24 24 A I + 0 0 0 33,-3.9 2,-0.3 -2,-0.6 -20,-0.1 -0.714 25.3 174.4 -88.6 138.2 0.2 5.1 35.2 25 25 A K - 0 0 133 -22,-0.4 -22,-0.6 -2,-0.3 2,-0.3 -0.973 23.5-165.8-146.0 152.7 -2.6 6.8 37.1 26 26 A S - 0 0 22 -2,-0.3 7,-0.1 2,-0.2 -24,-0.1 -0.989 30.9-125.1-138.1 147.1 -6.2 6.7 38.2 27 27 A N 0 0 166 -2,-0.3 -25,-0.0 -26,-0.3 -2,-0.0 0.453 360.0 360.0 -69.9 -1.2 -8.4 9.5 39.7 28 28 A R 0 0 153 2,-0.1 5,-0.2 59,-0.0 -2,-0.2 0.084 360.0 360.0-104.7 360.0 -9.3 7.4 42.7 29 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 30 31 A E 0 0 178 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 107.5 -10.3 8.1 46.7 31 32 A T - 0 0 76 0, 0.0 2,-0.6 0, 0.0 50,-0.0 -0.693 360.0 -65.2-123.3-178.0 -8.1 5.7 48.8 32 33 A K - 0 0 115 -2,-0.2 50,-1.0 1,-0.0 2,-0.3 -0.643 58.3-154.5 -74.2 116.7 -4.5 4.5 48.6 33 34 A V E -B 81 0A 11 -2,-0.6 2,-0.5 -5,-0.2 48,-0.2 -0.688 10.3-152.6 -99.4 141.9 -4.2 2.6 45.3 34 35 A F E -B 80 0A 72 46,-2.3 46,-2.4 -2,-0.3 2,-0.3 -0.973 14.9-151.2-113.9 125.7 -1.7 -0.2 44.5 35 36 A Y E +B 79 0A 23 19,-2.9 2,-0.3 -2,-0.5 44,-0.2 -0.714 19.8 166.5 -95.4 146.6 -0.8 -0.7 40.8 36 37 A S E -B 78 0A 55 42,-1.5 42,-2.5 -2,-0.3 2,-0.4 -0.971 22.1-135.5-150.5 163.3 0.3 -3.9 39.1 37 38 A I E -B 77 0A 19 -2,-0.3 2,-0.3 40,-0.2 40,-0.2 -0.974 13.2-169.0-127.2 142.6 0.8 -5.3 35.7 38 39 A T E +B 76 0A 46 38,-2.6 38,-2.1 -2,-0.4 2,-0.2 -0.859 37.0 67.3-120.2 160.9 -0.2 -8.5 34.0 39 40 A G S >>>S- 0 0 11 -2,-0.3 3,-2.4 36,-0.2 5,-1.6 -0.475 87.7 -39.3 122.2 169.5 0.8 -10.2 30.6 40 41 A Q B 345S+g 44 0C 130 34,-0.4 34,-0.3 1,-0.3 7,-0.1 -0.522 131.0 33.2 -66.4 121.6 3.7 -11.8 28.8 41 42 A G T 345S+ 0 0 0 3,-2.5 9,-2.8 -2,-0.3 8,-0.6 0.174 124.6 47.9 105.2 -15.9 6.7 -9.6 29.6 42 43 A A T <45S- 0 0 9 -3,-2.4 6,-3.0 2,-0.3 -2,-0.2 0.593 133.1 -10.8-114.5 -85.3 5.3 -8.9 33.2 43 44 A D T <5S+ 0 0 84 -4,-1.0 -3,-0.2 4,-0.2 4,-0.2 0.367 127.7 60.5-103.9 -1.0 4.0 -11.9 35.2 44 45 A K B S- 0 0 50 0, 0.0 3,-1.0 0, 0.0 -2,-0.2 0.256 101.0-158.4 -79.0 113.8 9.3 -13.5 29.7 47 48 A V T 3 + 0 0 101 1,-0.2 -4,-0.2 -4,-0.2 -5,-0.1 -0.331 62.9 5.8 -64.6 133.6 8.7 -12.6 33.4 48 49 A G T 3 S+ 0 0 22 -6,-3.0 -1,-0.2 2,-0.3 -6,-0.2 0.604 77.4 126.3 73.9 14.4 9.7 -9.2 34.7 49 50 A V S < S+ 0 0 3 -3,-1.0 13,-2.6 -8,-0.6 14,-0.4 0.881 85.8 33.6 -63.6 -37.7 10.9 -7.5 31.5 50 51 A F E S+F 61 0B 2 -9,-2.8 -2,-0.3 11,-0.2 2,-0.3 -0.965 75.8 176.0-118.6 135.7 8.4 -4.8 32.5 51 52 A I E -F 60 0B 64 9,-2.4 9,-2.9 -2,-0.4 2,-0.3 -0.889 16.0-147.3-128.6 161.7 7.7 -3.8 36.2 52 53 A I E -F 59 0B 24 -2,-0.3 2,-0.6 7,-0.2 7,-0.2 -0.983 26.5-113.9-127.3 140.4 5.5 -1.1 37.8 53 54 A E > - 0 0 67 5,-2.2 4,-2.4 -2,-0.3 -18,-0.2 -0.680 28.8-139.5 -71.2 118.7 6.1 0.8 41.0 54 55 A R T 4 S+ 0 0 181 -2,-0.6 -19,-2.9 1,-0.2 -1,-0.2 0.805 95.4 27.5 -56.2 -32.3 3.3 -0.5 43.2 55 56 A E T 4 S+ 0 0 100 -21,-0.2 -1,-0.2 1,-0.1 -22,-0.2 0.726 126.4 40.6-101.9 -23.5 2.6 3.0 44.8 56 57 A T T 4 S- 0 0 56 2,-0.1 -2,-0.2 -21,-0.1 3,-0.1 0.732 90.7-132.4 -97.8 -28.4 3.7 5.5 42.1 57 58 A G < + 0 0 0 -4,-2.4 -33,-3.9 1,-0.3 2,-0.6 0.584 48.4 156.1 81.6 10.0 2.5 3.8 38.9 58 59 A W E -E 23 0B 70 -35,-0.3 -5,-2.2 -5,-0.2 2,-0.4 -0.626 32.5-149.9 -72.1 113.8 5.8 4.3 37.2 59 60 A L E -EF 22 52B 0 -37,-3.1 -38,-2.8 -2,-0.6 -37,-0.6 -0.750 23.2-179.9 -85.0 134.8 6.0 1.7 34.4 60 61 A K E -EF 20 51B 31 -9,-2.9 -9,-2.4 -2,-0.4 2,-0.4 -0.963 29.5-133.2-141.0 152.7 9.6 0.6 33.7 61 62 A V E -EF 19 50B 2 -42,-2.0 -42,-2.3 -2,-0.3 -11,-0.2 -0.872 14.4-163.2-105.3 138.4 11.7 -1.8 31.5 62 63 A T + 0 0 39 -13,-2.6 -12,-0.1 -2,-0.4 -45,-0.1 0.556 64.4 13.8-102.8 -9.0 14.4 -3.8 33.3 63 64 A Q S S- 0 0 92 -14,-0.4 -50,-0.1 -44,-0.1 -1,-0.1 -0.970 91.5 -69.2-159.9 163.1 16.7 -5.0 30.5 64 65 A P - 0 0 64 0, 0.0 2,-0.2 0, 0.0 -53,-0.1 -0.309 51.3-135.2 -60.9 144.5 17.5 -4.5 26.8 65 66 A L - 0 0 6 -55,-0.4 -53,-2.5 -4,-0.0 2,-0.4 -0.582 6.8-148.4 -99.8 164.5 14.8 -5.6 24.4 66 67 A D >> - 0 0 70 4,-0.2 4,-2.3 -55,-0.2 3,-1.2 -0.936 2.6-164.3-133.6 105.6 15.2 -7.6 21.2 67 68 A R T 34 S+ 0 0 40 -2,-0.4 30,-0.1 1,-0.3 -1,-0.1 0.770 90.2 59.5 -60.9 -31.4 12.5 -6.7 18.5 68 69 A E T 34 S+ 0 0 54 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.648 110.8 42.5 -78.5 -13.3 13.3 -9.9 16.5 69 70 A A T <4 S- 0 0 73 -3,-1.2 2,-0.3 1,-0.3 -2,-0.2 0.889 139.9 -3.7 -86.3 -56.4 12.3 -11.9 19.6 70 71 A I < + 0 0 53 -4,-2.3 -1,-0.3 1,-0.1 -4,-0.2 -0.964 58.1 178.4-140.6 118.6 9.2 -9.8 20.6 71 72 A A S S+ 0 0 39 -2,-0.3 26,-2.7 1,-0.3 2,-0.3 0.596 74.0 30.6 -94.9 -12.7 8.3 -6.7 18.7 72 73 A K E - C 0 96A 126 24,-0.2 2,-0.4 -5,-0.1 -1,-0.3 -0.968 62.6-160.1-154.2 125.6 5.1 -5.9 20.7 73 74 A Y E - C 0 95A 14 22,-2.3 22,-2.4 -2,-0.3 2,-0.5 -0.894 4.6-158.9-107.2 140.8 4.0 -6.5 24.3 74 75 A I E + C 0 94A 77 -2,-0.4 -34,-0.4 -34,-0.3 2,-0.3 -0.949 24.8 164.3-121.3 106.0 0.4 -6.4 25.5 75 76 A L E - C 0 93A 0 18,-2.8 18,-3.7 -2,-0.5 2,-0.4 -0.747 26.9-140.5-116.7 162.8 0.1 -5.8 29.2 76 77 A Y E -BC 38 92A 88 -38,-2.1 -38,-2.6 -2,-0.3 2,-0.3 -0.995 11.0-144.8-124.3 135.5 -2.7 -4.8 31.5 77 78 A S E -BC 37 91A 0 14,-2.6 14,-1.7 -2,-0.4 2,-0.3 -0.754 14.8-160.2 -95.6 147.1 -2.5 -2.4 34.4 78 79 A H E -B 36 0A 48 -42,-2.5 -42,-1.5 -2,-0.3 2,-0.4 -0.909 8.1-158.2-126.7 151.2 -4.5 -3.0 37.6 79 80 A A E +B 35 0A 1 9,-0.4 8,-2.9 -2,-0.3 9,-0.8 -0.966 17.3 176.0-134.8 112.9 -5.5 -0.6 40.4 80 81 A V E -BD 34 86A 46 -46,-2.4 -46,-2.3 -2,-0.4 6,-0.3 -0.971 23.8-129.4-126.1 129.9 -6.5 -2.1 43.8 81 82 A S E > -B 33 0A 15 4,-2.7 3,-1.6 -2,-0.4 -48,-0.2 -0.226 32.7-104.6 -67.6 164.3 -7.3 -0.3 47.0 82 83 A S T 3 S+ 0 0 73 -50,-1.0 -1,-0.1 1,-0.3 -49,-0.1 0.714 121.3 60.6 -62.3 -21.5 -5.7 -1.2 50.4 83 84 A N T 3 S- 0 0 153 2,-0.2 -1,-0.3 1,-0.0 -2,-0.0 0.587 122.0-104.1 -84.6 -8.2 -8.9 -3.0 51.3 84 85 A G S < S+ 0 0 50 -3,-1.6 2,-0.4 1,-0.3 -2,-0.1 0.533 78.3 123.3 104.8 8.7 -8.5 -5.4 48.4 85 86 A E - 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