==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 08-SEP-09 3JQX . COMPND 2 MOLECULE: COLH PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM HISTOLYTICUM; . AUTHOR J.SAKON,S.T.L.PHILOMINATHAN,R.BAUER,O.MATSUSHITA . 358 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17016.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 241 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 146 40.8 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 . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 49 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 3.9 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 . 6 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 . 1 3 3 0 3 1 7 4 0 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 0 2 4 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 1 863 A Y 0 0 258 0, 0.0 17,-0.1 0, 0.0 163,-0.1 0.000 360.0 360.0 360.0 76.0 -20.1 -2.2 14.7 2 864 A P - 0 0 41 0, 0.0 2,-0.2 0, 0.0 18,-0.2 -0.268 360.0-130.3 -67.8 145.9 -17.6 -3.1 11.9 3 865 A I - 0 0 29 16,-2.2 18,-0.4 1,-0.1 163,-0.1 -0.560 19.3-171.2 -89.8 160.1 -14.8 -0.5 11.0 4 866 A G S S+ 0 0 3 161,-0.3 23,-2.2 1,-0.3 232,-0.4 0.262 76.7 30.0-124.0 -0.4 -13.9 0.8 7.5 5 867 A T B S-a 27 0A 24 21,-0.3 -1,-0.3 230,-0.2 23,-0.2 -0.992 86.4 -97.0-156.0 154.7 -10.8 2.6 8.7 6 868 A E - 0 0 23 21,-1.8 2,-0.5 -2,-0.3 33,-0.1 -0.351 31.1-145.7 -71.8 160.3 -8.0 2.4 11.2 7 869 A K - 0 0 134 8,-0.1 -1,-0.0 -2,-0.1 11,-0.0 -0.928 31.3-105.3-133.3 101.9 -8.5 4.6 14.4 8 870 A E S S+ 0 0 77 -2,-0.5 2,-0.1 2,-0.1 29,-0.0 -0.463 99.3 50.0 -72.3 144.8 -5.2 6.0 15.8 9 871 A P + 0 0 100 0, 0.0 28,-0.1 0, 0.0 -2,-0.0 0.508 67.1 135.6 -75.4 133.6 -3.5 5.3 18.2 10 872 A N + 0 0 0 26,-0.3 28,-2.4 -2,-0.1 7,-0.2 -0.101 23.9 129.6-132.9 31.5 -3.6 1.6 17.2 11 873 A N + 0 0 67 26,-0.2 2,-0.3 5,-0.1 26,-0.1 0.258 68.0 33.3 -80.1 11.2 0.1 1.1 17.9 12 874 A S S S- 0 0 37 26,-0.1 3,-0.5 24,-0.1 4,-0.2 -0.952 87.7-104.4-154.6 166.7 -0.4 -2.1 20.0 13 875 A K S > S+ 0 0 35 -2,-0.3 3,-0.9 1,-0.2 -1,-0.1 0.809 120.0 58.9 -59.0 -35.7 -2.7 -5.1 20.2 14 876 A E T 3 S+ 0 0 166 1,-0.3 -1,-0.2 -3,-0.0 -3,-0.0 0.745 114.6 36.6 -70.8 -24.8 -4.5 -3.5 23.3 15 877 A T T 3 S+ 0 0 61 -3,-0.5 -1,-0.3 2,-0.1 -2,-0.2 0.328 87.5 145.3-107.3 13.9 -5.3 -0.5 21.1 16 878 A A < - 0 0 15 -3,-0.9 2,-0.4 -4,-0.2 23,-0.3 -0.118 50.3-119.7 -49.6 138.5 -6.0 -2.5 17.8 17 879 A S B -f 39 0B 9 21,-2.4 23,-1.7 -7,-0.2 3,-0.1 -0.674 54.4 -40.3 -75.2 132.0 -8.7 -1.1 15.5 18 880 A G - 0 0 14 -2,-0.4 23,-0.1 21,-0.2 2,-0.1 -0.990 48.9 -72.6 179.2-173.1 -11.6 -3.4 14.9 19 881 A P - 0 0 25 0, 0.0 -16,-2.2 0, 0.0 2,-0.4 0.510 50.5-165.2 -81.8 154.4 -13.5 -5.5 14.4 20 882 A I - 0 0 1 20,-1.6 22,-0.4 -18,-0.2 -16,-0.1 -0.864 9.9-170.4 -96.3 135.4 -12.8 -6.1 10.7 21 883 A V > - 0 0 36 -2,-0.4 3,-1.6 -18,-0.4 92,-0.3 -0.908 30.3 -91.7-128.0 153.3 -15.4 -8.1 8.8 22 884 A P T 3 S+ 0 0 48 0, 0.0 92,-0.2 0, 0.0 90,-0.0 -0.324 109.1 26.7 -61.0 146.4 -15.6 -9.8 5.3 23 885 A G T 3 S+ 0 0 63 90,-0.5 91,-0.1 1,-0.1 89,-0.0 0.369 101.1 90.3 86.0 -5.0 -17.1 -7.5 2.6 24 886 A I S < S- 0 0 31 -3,-1.6 -3,-0.4 89,-0.2 214,-0.1 -0.861 70.8-144.8-125.9 97.6 -16.1 -4.2 4.3 25 887 A P - 0 0 9 0, 0.0 2,-0.5 0, 0.0 87,-0.2 -0.309 9.9-141.5 -62.3 146.8 -12.7 -3.0 3.2 26 888 A V E - B 0 111A 0 85,-2.6 85,-3.3 209,-0.1 2,-0.3 -0.943 13.1-157.0-113.2 126.6 -10.5 -1.2 5.8 27 889 A S E +aB 5 110A 2 -23,-2.2 -21,-1.8 -2,-0.5 2,-0.3 -0.746 25.3 139.9 -99.3 149.2 -8.4 1.8 4.8 28 890 A G E - B 0 109A 9 81,-1.7 81,-2.3 -2,-0.3 2,-0.3 -0.953 36.9-126.3-165.7-173.2 -5.4 3.1 6.6 29 891 A T E - B 0 108A 8 -2,-0.3 2,-0.8 79,-0.3 3,-0.1 -0.980 12.8-138.4-144.1 130.2 -2.0 4.5 6.1 30 892 A I E - B 0 107A 0 77,-3.3 77,-2.9 -2,-0.3 3,-0.1 -0.858 26.1-158.6 -83.7 107.1 1.4 3.4 7.5 31 893 A E - 0 0 93 -2,-0.8 2,-0.3 75,-0.2 -1,-0.1 0.734 60.8 -39.5 -65.5 -28.2 2.7 7.0 8.2 32 894 A N S > S- 0 0 80 3,-0.1 3,-2.0 74,-0.1 69,-0.2 -0.854 81.9 -69.6 176.8 174.6 6.4 6.1 8.2 33 895 A T T 3 S+ 0 0 60 71,-0.6 68,-0.2 1,-0.3 72,-0.1 0.695 127.3 63.1 -64.0 -19.1 8.3 3.1 9.6 34 896 A S T 3 S+ 0 0 95 66,-0.1 2,-0.8 2,-0.0 -1,-0.3 0.555 82.3 95.0 -79.1 -10.7 7.6 4.1 13.2 35 897 A D < - 0 0 11 -3,-2.0 66,-0.4 66,-0.1 2,-0.4 -0.769 57.0-170.9 -83.2 112.1 3.8 3.7 12.7 36 898 A Q - 0 0 54 -2,-0.8 2,-0.6 64,-0.1 -26,-0.3 -0.876 7.3-157.4 -97.7 130.1 2.7 0.2 13.8 37 899 A D E - G 0 99B 0 62,-3.0 62,-3.1 -2,-0.4 2,-0.4 -0.938 10.0-174.5-114.8 112.7 -1.0 -0.6 12.8 38 900 A Y E + G 0 98B 42 -28,-2.4 -21,-2.4 -2,-0.6 2,-0.3 -0.900 5.5 173.9-106.9 140.1 -2.9 -3.3 14.8 39 901 A F E -fG 17 97B 0 58,-1.9 58,-1.9 -2,-0.4 2,-0.3 -0.835 11.9-153.8-128.5 164.2 -6.3 -4.6 13.9 40 902 A Y E - G 0 96B 45 -23,-1.7 -20,-1.6 -2,-0.3 2,-0.3 -0.984 9.9-179.6-140.7 158.7 -8.5 -7.3 15.2 41 903 A F E - G 0 95B 0 54,-2.4 54,-2.9 -2,-0.3 2,-0.5 -0.943 24.5-122.3-148.1 162.3 -11.3 -9.5 14.0 42 904 A D E - G 0 94B 42 -22,-0.4 2,-0.5 -2,-0.3 52,-0.2 -0.946 8.1-152.7-118.7 129.6 -13.4 -12.2 15.7 43 905 A V E + G 0 93B 2 50,-3.2 50,-1.8 -2,-0.5 74,-0.2 -0.877 16.6 175.2 -93.7 124.0 -13.7 -15.8 14.6 44 906 A I + 0 0 123 -2,-0.5 -1,-0.1 72,-0.4 73,-0.1 0.741 69.0 21.8-103.2 -31.1 -17.1 -17.1 15.7 45 907 A T S S- 0 0 90 71,-0.4 -1,-0.4 46,-0.1 44,-0.1 -0.996 96.1 -90.1-135.3 141.1 -17.0 -20.6 14.1 46 908 A P + 0 0 71 0, 0.0 2,-0.3 0, 0.0 44,-0.2 -0.051 69.9 115.2 -44.0 144.3 -14.0 -22.6 12.9 47 909 A G E -C 89 0A 12 42,-1.7 42,-2.5 69,-0.1 2,-0.2 -0.915 65.1 -62.5 167.3 167.9 -13.0 -22.0 9.3 48 910 A E E -C 88 0A 84 -2,-0.3 68,-2.5 40,-0.2 2,-0.4 -0.509 42.8-160.7 -69.6 139.3 -10.5 -20.7 6.8 49 911 A V E -CD 87 115A 0 38,-2.7 38,-1.8 66,-0.2 2,-0.4 -0.997 2.9-163.5-125.6 131.1 -9.6 -17.0 7.1 50 912 A K E -CD 86 114A 89 64,-3.2 64,-2.9 -2,-0.4 2,-0.4 -0.972 2.2-167.0-119.5 136.4 -8.0 -15.1 4.1 51 913 A I E +CD 85 113A 0 34,-2.7 34,-1.7 -2,-0.4 2,-0.4 -0.970 7.1 178.9-122.5 130.6 -6.3 -11.7 4.4 52 914 A D E -CD 84 112A 53 60,-2.4 60,-2.4 -2,-0.4 2,-0.6 -0.989 4.9-172.1-131.5 120.4 -5.3 -9.4 1.5 53 915 A I E -CD 83 111A 1 30,-2.4 30,-2.3 -2,-0.4 2,-0.5 -0.944 14.6-148.2-116.3 108.8 -3.7 -6.1 2.1 54 916 A N E -CD 82 110A 43 56,-2.4 56,-1.4 -2,-0.6 2,-0.7 -0.659 12.0-139.2 -75.9 123.3 -3.3 -3.9 -1.0 55 917 A K E - D 0 109A 8 26,-2.8 54,-0.2 -2,-0.5 4,-0.1 -0.756 20.8-178.0 -86.1 116.8 -0.2 -1.8 -0.8 56 918 A L + 0 0 36 52,-3.3 2,-0.3 -2,-0.7 53,-0.2 0.061 64.5 37.8-106.8 24.2 -1.2 1.6 -2.1 57 919 A G S S- 0 0 4 51,-0.3 2,-0.2 303,-0.2 50,-0.1 -0.902 93.1 -85.8-152.6 179.4 2.2 3.2 -1.8 58 920 A Y S S+ 0 0 23 48,-0.4 48,-0.5 -2,-0.3 47,-0.3 -0.598 73.8 79.0 -91.0 154.9 5.9 2.2 -2.3 59 921 A G S S- 0 0 8 182,-0.4 2,-0.6 -2,-0.2 45,-0.3 -0.594 78.5 -74.2 134.7 164.8 7.9 0.5 0.5 60 922 A G E +H 103 0B 5 43,-3.9 43,-1.7 -2,-0.2 42,-1.4 -0.884 56.9 154.1 -98.8 117.2 8.4 -2.8 2.3 61 923 A A E +H 101 0B 3 -2,-0.6 2,-0.3 40,-0.3 40,-0.2 -0.894 11.7 171.0-135.7 167.7 5.6 -3.8 4.6 62 924 A T E -H 100 0B 31 38,-2.1 38,-2.0 -2,-0.3 2,-0.3 -0.965 16.4-139.0-165.5 167.1 4.3 -7.1 5.9 63 925 A W E -H 99 0B 0 -2,-0.3 13,-2.5 36,-0.2 2,-0.4 -0.978 4.7-161.0-139.8 157.6 1.9 -8.5 8.4 64 926 A V E -HI 98 75B 8 34,-1.7 34,-3.8 -2,-0.3 2,-0.5 -0.991 15.4-141.1-130.5 142.2 1.6 -11.2 11.0 65 927 A V E -HI 97 74B 0 9,-3.0 8,-2.8 -2,-0.4 9,-1.2 -0.898 19.1-167.2-101.8 128.1 -1.7 -12.6 12.5 66 928 A Y E -HI 96 72B 52 30,-2.8 30,-2.5 -2,-0.5 6,-0.2 -0.873 12.6-139.8-111.1 147.5 -1.8 -13.5 16.2 67 929 A D > - 0 0 27 4,-2.1 3,-1.4 -2,-0.3 28,-0.1 -0.247 47.3 -83.6 -85.1-174.8 -4.3 -15.4 18.3 68 930 A E T 3 S+ 0 0 104 26,-0.3 27,-0.1 1,-0.3 -1,-0.0 0.670 127.8 56.4 -65.8 -17.4 -5.3 -14.3 21.8 69 931 A N T 3 S- 0 0 116 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.069 119.5-103.3-106.1 25.2 -2.3 -16.1 23.3 70 932 A N S < S+ 0 0 115 -3,-1.4 2,-0.4 1,-0.2 -2,-0.1 0.721 74.7 141.6 62.9 23.2 0.3 -14.3 21.2 71 933 A N - 0 0 87 2,-0.0 -4,-2.1 0, 0.0 2,-0.4 -0.824 53.5-124.8 -88.8 139.9 0.9 -17.2 18.9 72 934 A A E +I 66 0B 37 -2,-0.4 -6,-0.2 -6,-0.2 3,-0.1 -0.701 32.5 172.4 -82.1 128.2 1.5 -16.4 15.2 73 935 A V E + 0 0 51 -8,-2.8 2,-0.3 -2,-0.4 15,-0.2 0.516 65.3 18.5-110.3 -12.0 -1.0 -18.2 13.1 74 936 A S E -I 65 0B 8 -9,-1.2 -9,-3.0 13,-0.1 -1,-0.3 -0.956 56.6-162.5-164.9 135.0 -0.3 -16.6 9.7 75 937 A Y E -I 64 0B 147 -2,-0.3 -11,-0.2 -11,-0.2 11,-0.2 -0.946 33.2-104.3-119.9 146.1 2.5 -14.5 8.0 76 938 A A - 0 0 19 -13,-2.5 2,-0.4 -2,-0.3 9,-0.2 -0.262 19.0-151.4 -66.6 148.5 2.1 -12.4 4.9 77 939 A T E -E 84 0A 98 7,-2.1 7,-2.8 -15,-0.0 2,-0.5 -0.998 16.1-142.0-114.1 124.7 3.3 -13.3 1.4 78 940 A D E -E 83 0A 80 -2,-0.4 5,-0.2 5,-0.2 -16,-0.0 -0.779 19.6-179.1 -82.6 118.7 4.2 -10.3 -0.8 79 941 A D - 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H 0 62B 63 -38,-2.0 -38,-2.1 -2,-0.4 2,-0.5 -0.985 41.4-122.3-147.7 170.6 4.1 -2.5 9.8 101 963 A M E - H 0 61B 3 -66,-0.4 -40,-0.3 -2,-0.3 3,-0.2 -0.955 15.9-173.2-114.3 120.4 6.6 -1.2 7.2 102 964 A F E S+ 0 0 119 -42,-1.4 2,-0.2 -2,-0.5 -41,-0.2 0.727 82.4 10.9 -84.0 -20.8 10.2 -2.4 7.7 103 965 A N E S+ H 0 60B 87 -43,-1.7 -43,-3.9 -71,-0.0 -1,-0.3 -0.743 97.0 85.7-160.1 102.4 11.5 -0.0 5.0 104 966 A G - 0 0 13 -45,-0.3 -71,-0.6 -3,-0.2 -45,-0.2 -0.937 56.9-127.1 178.8 170.0 9.5 2.8 3.4 105 967 A S S S- 0 0 90 -47,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.891 86.1 -3.6 -95.7 -51.2 8.4 6.4 3.7 106 968 A Y - 0 0 99 -48,-0.5 -48,-0.4 -74,-0.1 -1,-0.3 -0.923 60.9-176.2-154.1 118.8 4.6 6.5 3.4 107 969 A M E -B 30 0A 1 -77,-2.9 -77,-3.3 -2,-0.3 -50,-0.2 -0.824 8.6-170.3-129.3 102.6 2.1 3.7 2.7 108 970 A P E +B 29 0A 21 0, 0.0 -52,-3.3 0, 0.0 2,-0.3 -0.472 24.5 171.4 -70.9 157.3 -1.6 3.8 2.2 109 971 A Y E -BD 28 55A 3 -81,-2.3 -81,-1.7 -54,-0.2 2,-0.4 -0.953 29.2-138.8-156.8 173.2 -3.3 0.4 2.1 110 972 A R E -BD 27 54A 23 -56,-1.4 -56,-2.4 -2,-0.3 2,-0.5 -0.959 15.4-148.4-145.3 122.3 -6.6 -1.4 2.1 111 973 A I E -BD 26 53A 0 -85,-3.3 -85,-2.6 -2,-0.4 2,-0.4 -0.790 14.3-179.2 -95.5 130.2 -7.4 -4.5 4.1 112 974 A N E - 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