==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-FEB-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 20-DEC-10 3Q2N . COMPND 2 MOLECULE: CADHERIN-1; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR O.J.HARRISON,X.JIN,L.SHAPIRO . 426 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22802.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 259 60.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 117 27.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 42 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 3 0 0 1 0 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 PARALLEL BRIDGES PER LADDER . 2 4 6 2 2 3 1 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 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 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 25 0, 0.0 240,-3.0 0, 0.0 241,-0.2 0.000 360.0 360.0 360.0 108.5 -51.8 -28.3 4.5 2 2 A W E -A 240 0A 9 89,-0.3 91,-2.6 238,-0.2 2,-0.4 -0.381 360.0-142.7 -69.8 146.0 -50.5 -25.0 6.0 3 3 A V E -Ab 239 93A 20 236,-2.4 236,-0.8 89,-0.2 91,-0.2 -0.938 20.5-130.5-111.9 134.4 -51.9 -23.8 9.3 4 4 A I - 0 0 4 89,-2.2 91,-0.2 -2,-0.4 3,-0.1 -0.457 27.3 -97.9 -93.1 142.6 -52.3 -20.1 9.4 5 5 A P - 0 0 18 0, 0.0 90,-0.2 0, 0.0 -1,-0.1 -0.417 64.7 -83.5 -47.1 139.1 -51.0 -18.0 12.4 6 6 A P - 0 0 77 0, 0.0 2,-0.5 0, 0.0 90,-0.2 -0.180 36.5-136.6 -58.7 143.1 -54.1 -17.4 14.6 7 7 A I E -c 96 0A 12 88,-2.5 90,-2.1 -3,-0.1 2,-0.4 -0.901 21.9-141.3-104.1 123.4 -56.5 -14.6 13.7 8 8 A S E +c 97 0A 80 -2,-0.5 90,-0.2 88,-0.2 88,-0.0 -0.702 26.2 170.2 -88.0 133.8 -57.5 -12.8 16.9 9 9 A C E -c 98 0A 1 88,-2.3 90,-2.0 -2,-0.4 2,-0.1 -0.938 29.6-129.4-143.7 123.3 -61.0 -11.5 17.4 10 10 A P E > -c 99 0A 53 0, 0.0 3,-0.5 0, 0.0 56,-0.3 -0.388 24.2-111.1 -73.6 148.7 -62.1 -10.2 20.8 11 11 A E T 3 S+ 0 0 0 88,-2.7 56,-0.2 1,-0.2 88,-0.0 -0.170 92.3 29.1 -73.6 170.4 -65.3 -11.4 22.6 12 12 A N T 3 S+ 0 0 54 54,-3.9 -1,-0.2 1,-0.1 55,-0.1 0.775 74.9 176.8 46.1 39.8 -68.3 -9.2 23.1 13 13 A E < - 0 0 45 -3,-0.5 2,-0.3 51,-0.1 -1,-0.1 -0.277 9.9-161.0 -61.8 159.2 -67.9 -7.0 20.1 14 14 A K + 0 0 177 2,-0.1 2,-0.3 50,-0.1 -1,-0.0 -0.842 39.6 37.1-134.8 167.6 -70.7 -4.4 19.6 15 15 A G S S+ 0 0 63 -2,-0.3 2,-0.3 2,-0.0 -2,-0.0 -0.727 94.6 10.9 101.1-140.2 -72.1 -2.2 16.8 16 16 A E S S- 0 0 165 -2,-0.3 -2,-0.1 2,-0.0 0, 0.0 -0.643 76.9-122.0 -87.9 139.2 -72.5 -3.0 13.1 17 17 A F S S+ 0 0 52 -2,-0.3 2,-0.2 46,-0.1 46,-0.1 -0.974 75.7 45.4-131.6 152.9 -72.0 -6.4 11.7 18 18 A P S S- 0 0 65 0, 0.0 2,-0.4 0, 0.0 45,-0.2 0.464 72.0-165.8 -80.6 168.6 -70.6 -8.2 9.9 19 19 A K E -G 62 0B 57 43,-2.3 43,-2.7 -2,-0.2 2,-0.3 -0.963 20.8-113.7-126.7 142.0 -67.0 -6.9 10.6 20 20 A N E +G 61 0B 96 -2,-0.4 41,-0.2 41,-0.2 3,-0.1 -0.504 33.9 168.4 -70.4 131.0 -63.8 -7.5 8.6 21 21 A L E - 0 0 35 39,-2.6 2,-0.3 1,-0.3 -1,-0.2 0.820 58.9 -28.3 -93.1 -59.7 -61.1 -9.6 10.2 22 22 A V E -G 60 0B 27 38,-1.0 38,-2.7 36,-0.1 2,-0.5 -0.988 51.7-115.1-172.7 134.9 -58.5 -10.4 7.6 23 23 A Q E -G 59 0B 77 -2,-0.3 2,-0.4 36,-0.2 36,-0.3 -0.773 23.6-166.8 -92.5 124.9 -58.0 -11.0 3.9 24 24 A I + 0 0 0 34,-2.9 2,-0.3 -2,-0.5 194,-0.1 -0.957 21.1 167.3-116.3 137.9 -57.0 -14.5 2.8 25 25 A K E -I 217 0C 60 192,-0.8 192,-3.3 -2,-0.4 2,-0.5 -0.996 37.0-127.6-160.8 131.7 -55.8 -14.7 -0.8 26 26 A S E > -I 216 0C 0 -2,-0.3 3,-1.2 190,-0.3 190,-0.2 -0.820 15.8-146.9 -89.8 129.5 -54.0 -16.8 -3.5 27 27 A N T 3 S+ 0 0 55 188,-2.9 3,-0.3 -2,-0.5 4,-0.1 0.268 93.1 75.2 -74.3 12.0 -51.2 -15.1 -5.3 28 28 A R T >> + 0 0 81 187,-0.3 4,-1.4 1,-0.2 3,-0.9 0.315 59.5 107.0-102.1 10.6 -52.2 -17.0 -8.3 29 29 A D T <4 S+ 0 0 49 -3,-1.2 5,-0.2 1,-0.2 -1,-0.2 0.479 74.9 56.2 -74.5 -1.3 -55.2 -14.8 -9.0 30 30 A K T 34 S+ 0 0 190 -3,-0.3 -1,-0.2 3,-0.1 -2,-0.1 0.694 103.7 54.3 -91.3 -24.5 -53.4 -13.2 -12.0 31 31 A E T <4 S- 0 0 167 -3,-0.9 2,-0.3 1,-0.2 -2,-0.2 0.873 128.3 -14.4 -66.8 -40.5 -52.9 -16.6 -13.7 32 32 A T S < S- 0 0 45 -4,-1.4 -1,-0.2 51,-0.0 2,-0.0 -0.976 85.1 -72.1-155.8 164.5 -56.6 -17.5 -13.4 33 33 A K - 0 0 140 -2,-0.3 2,-0.4 -3,-0.1 50,-0.2 -0.344 47.3-157.7 -57.6 140.9 -59.9 -16.6 -11.8 34 34 A V - 0 0 13 -5,-0.2 2,-0.5 22,-0.2 48,-0.2 -0.990 10.6-168.4-131.0 127.4 -60.0 -17.5 -8.1 35 35 A F E -D 81 0A 52 46,-3.0 46,-2.6 -2,-0.4 2,-0.2 -0.962 14.4-149.5-116.1 128.5 -63.1 -18.0 -6.0 36 36 A Y E +D 80 0A 6 19,-3.3 2,-0.3 -2,-0.5 44,-0.2 -0.608 21.9 159.8 -96.5 150.1 -62.9 -18.2 -2.2 37 37 A S E -D 79 0A 36 42,-1.3 42,-2.8 -2,-0.2 2,-0.4 -0.961 22.2-143.5-154.2 165.9 -64.9 -20.2 0.3 38 38 A I E -D 78 0A 20 -2,-0.3 2,-0.3 40,-0.2 40,-0.2 -0.970 12.5-171.3-128.0 152.2 -64.6 -21.5 3.9 39 39 A T E +D 77 0A 43 38,-2.6 38,-2.5 -2,-0.4 2,-0.2 -0.930 34.2 68.1-133.5 164.9 -65.9 -24.7 5.6 40 40 A G E >>>S-D 76 0A 6 -2,-0.3 3,-2.6 36,-0.2 5,-2.1 -0.610 87.5 -30.2 122.2 177.5 -66.0 -26.0 9.1 41 41 A Q B 345S+n 45 0D 132 34,-0.5 34,-0.4 1,-0.3 7,-0.1 -0.623 132.9 29.9 -76.3 117.4 -67.7 -25.4 12.5 42 42 A G T 345S+ 0 0 0 3,-2.7 9,-2.8 -2,-0.6 8,-0.5 0.043 127.2 45.2 113.0 -15.6 -68.4 -21.7 12.5 43 43 A A T <45S- 0 0 11 -3,-2.6 6,-1.5 2,-0.3 -2,-0.2 0.688 133.4 -8.2-121.9 -73.4 -68.8 -21.5 8.7 44 44 A D T <5S+ 0 0 86 -4,-1.2 4,-0.2 4,-0.2 -3,-0.2 0.324 128.0 55.0-110.0 2.8 -70.9 -24.2 7.1 45 45 A K B S- 0 0 48 0, 0.0 3,-0.9 0, 0.0 -5,-0.4 0.264 100.2-164.4 -81.5 121.5 -72.5 -22.8 14.6 48 48 A V T 3 + 0 0 97 1,-0.2 -4,-0.2 -4,-0.2 -5,-0.2 -0.477 62.3 12.3 -70.3 135.9 -73.2 -22.0 10.9 49 49 A G T 3 S+ 0 0 23 -6,-1.5 -1,-0.2 2,-0.3 -6,-0.2 0.519 76.0 123.3 91.9 -1.6 -72.5 -18.5 9.7 50 50 A V S < S+ 0 0 0 -3,-0.9 13,-2.9 -8,-0.5 14,-0.4 0.938 85.7 29.7 -63.1 -39.1 -70.4 -17.0 12.4 51 51 A F E S-H 62 0B 2 -9,-2.8 2,-0.3 11,-0.2 -2,-0.3 -0.903 72.4-179.7-118.0 142.8 -67.7 -16.4 9.8 52 52 A I E -H 61 0B 61 9,-1.8 9,-3.5 -2,-0.4 2,-0.4 -0.951 16.5-140.8-135.8 161.0 -68.2 -15.7 6.1 53 53 A I E -H 60 0B 23 -2,-0.3 2,-0.4 7,-0.2 7,-0.2 -0.985 24.2-117.1-128.4 125.1 -65.8 -15.1 3.2 54 54 A E >> - 0 0 82 5,-2.4 4,-2.8 -2,-0.4 3,-0.5 -0.428 29.5-139.5 -59.5 114.6 -66.3 -12.6 0.4 55 55 A R T 34 S+ 0 0 136 -2,-0.4 -19,-3.3 1,-0.3 -1,-0.2 0.718 92.4 33.6 -54.6 -27.0 -66.4 -15.0 -2.6 56 56 A E T 34 S+ 0 0 149 -21,-0.2 -1,-0.3 3,-0.1 -22,-0.2 0.701 127.7 28.9-110.6 -27.5 -64.3 -12.8 -4.9 57 57 A T T <4 S- 0 0 63 -3,-0.5 -2,-0.2 2,-0.1 -1,-0.1 0.596 92.5-125.4-112.2 -20.7 -61.9 -11.0 -2.7 58 58 A G < + 0 0 0 -4,-2.8 -34,-2.9 1,-0.3 2,-0.5 0.627 47.7 159.1 82.4 12.3 -61.3 -13.3 0.2 59 59 A W E -G 23 0B 94 -36,-0.3 -5,-2.4 -5,-0.2 2,-0.4 -0.628 33.6-143.2 -64.3 120.1 -62.1 -10.9 3.0 60 60 A L E -GH 22 53B 0 -38,-2.7 -39,-2.6 -2,-0.5 -38,-1.0 -0.734 24.3-173.0 -85.2 126.2 -62.9 -13.0 6.0 61 61 A K E -GH 20 52B 38 -9,-3.5 -9,-1.8 -2,-0.4 2,-0.4 -0.847 21.9-137.4-122.5 158.2 -65.8 -11.5 8.2 62 62 A V E -GH 19 51B 0 -43,-2.7 -43,-2.3 -2,-0.3 -11,-0.2 -0.917 9.8-165.4-112.0 143.6 -67.5 -12.1 11.5 63 63 A T + 0 0 43 -13,-2.9 -12,-0.1 -2,-0.4 -46,-0.1 0.425 61.5 15.6-110.7 2.5 -71.2 -11.8 11.6 64 64 A Q S S- 0 0 90 -14,-0.4 -51,-0.1 -45,-0.1 -1,-0.1 -0.995 85.8 -70.6-163.5 163.4 -72.0 -11.7 15.4 65 65 A P - 0 0 72 0, 0.0 2,-0.3 0, 0.0 -54,-0.1 -0.277 48.2-142.5 -55.4 140.9 -70.7 -11.1 19.0 66 66 A L - 0 0 5 -56,-0.3 -54,-3.9 6,-0.0 2,-0.4 -0.809 9.0-152.3-106.6 157.8 -68.5 -13.9 20.4 67 67 A D >> - 0 0 70 -2,-0.3 4,-2.4 -56,-0.2 3,-2.3 -0.893 1.5-164.0-128.7 102.2 -68.2 -15.4 23.9 68 68 A R T 34 S+ 0 0 40 -2,-0.4 -1,-0.1 1,-0.3 30,-0.1 0.811 90.8 62.6 -49.5 -32.0 -64.8 -16.8 24.8 69 69 A E T 34 S+ 0 0 55 1,-0.2 -1,-0.3 -3,-0.1 3,-0.1 0.660 111.5 36.7 -79.6 -11.4 -66.4 -18.7 27.7 70 70 A A T <4 S+ 0 0 75 -3,-2.3 2,-0.4 1,-0.3 -2,-0.2 0.809 137.5 4.5-100.0 -53.2 -68.6 -20.7 25.2 71 71 A I < + 0 0 68 -4,-2.4 -1,-0.3 1,-0.1 -4,-0.2 -0.980 59.9 177.5-136.3 129.0 -66.1 -21.2 22.3 72 72 A A + 0 0 44 -2,-0.4 26,-2.9 1,-0.3 2,-0.3 0.625 68.4 22.0-103.2 -14.5 -62.6 -20.1 22.5 73 73 A K E - E 0 97A 127 24,-0.2 2,-0.4 -5,-0.0 -1,-0.3 -0.969 61.2-158.7-157.4 134.7 -61.0 -21.2 19.2 74 74 A Y E - E 0 96A 19 22,-2.2 22,-2.8 -2,-0.3 2,-0.5 -0.957 3.9-157.7-120.6 141.5 -62.5 -22.0 15.8 75 75 A I E + E 0 95A 60 -2,-0.4 -34,-0.5 -34,-0.4 2,-0.3 -0.991 24.1 159.3-118.1 121.9 -60.9 -24.1 13.1 76 76 A L E -DE 40 94A 0 18,-3.1 18,-3.4 -2,-0.5 2,-0.4 -0.795 31.1-128.1-127.8 179.9 -62.1 -23.7 9.5 77 77 A Y E -DE 39 93A 81 -38,-2.5 -38,-2.6 -2,-0.3 2,-0.3 -0.992 13.6-148.5-131.5 137.4 -60.7 -24.4 6.1 78 78 A S E -DE 38 92A 1 14,-2.6 14,-1.5 -2,-0.4 2,-0.3 -0.810 12.7-158.7 -98.9 153.6 -60.4 -22.0 3.3 79 79 A H E -D 37 0A 48 -42,-2.8 -42,-1.3 -2,-0.3 2,-0.5 -0.975 10.9-161.1-132.6 144.6 -60.6 -23.0 -0.4 80 80 A A E +D 36 0A 2 9,-0.4 8,-3.4 -2,-0.3 9,-1.1 -0.948 21.3 170.2-128.8 108.3 -59.5 -21.5 -3.6 81 81 A V E -DF 35 87A 45 -46,-2.6 -46,-3.0 -2,-0.5 6,-0.2 -0.887 19.7-143.4-121.3 148.7 -61.2 -22.8 -6.8 82 82 A S > - 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