==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 30-MAY-13 4BQ9 . COMPND 2 MOLECULE: NEOGENIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR C.H.BELL,E.HEALEY,S.VAN ERP,B.BISHOP,C.TANG,R.J.C.GILBERT, . 392 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21840.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 210 53.6 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 . 150 38.3 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 . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 1.8 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 . 19 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), 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 . 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 . 1 1 2 8 4 4 1 3 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 4 0 2 0 0 0 1 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 1 883 A T 0 0 140 0, 0.0 2,-0.3 0, 0.0 86,-0.2 0.000 360.0 360.0 360.0 123.8 58.0 -29.7 -37.6 2 884 A P - 0 0 124 0, 0.0 2,-0.2 0, 0.0 86,-0.2 -0.445 360.0-145.5 -76.5 133.1 59.2 -28.6 -34.1 3 885 A M - 0 0 14 84,-2.0 86,-0.5 -2,-0.3 78,-0.1 -0.497 22.3-112.0 -84.3 144.9 60.9 -25.2 -33.2 4 886 A M - 0 0 103 -2,-0.2 23,-0.1 84,-0.1 77,-0.1 -0.559 40.4-117.5 -77.4 137.7 63.6 -24.6 -30.6 5 887 A P - 0 0 44 0, 0.0 21,-0.3 0, 0.0 75,-0.1 -0.350 35.5 -81.3 -77.6 165.2 62.3 -22.5 -27.6 6 888 A P - 0 0 5 0, 0.0 86,-0.6 0, 0.0 2,-0.2 -0.193 48.0-155.8 -62.1 151.5 63.6 -19.0 -26.5 7 889 A V E +A 24 0A 47 17,-2.2 17,-2.9 1,-0.2 84,-0.1 -0.718 62.3 33.5-121.9 171.9 66.8 -18.8 -24.4 8 890 A G E S- 0 0 36 -2,-0.2 2,-0.3 15,-0.2 -1,-0.2 0.852 72.0-173.6 44.9 48.1 68.3 -16.4 -21.9 9 891 A V E + 0 0 3 -3,-0.2 209,-0.4 14,-0.2 2,-0.3 -0.594 7.4 179.2 -73.0 127.7 64.9 -15.3 -20.5 10 892 A Q E -A 22 0A 42 12,-2.6 12,-2.1 -2,-0.3 2,-0.4 -0.987 23.5-142.8-135.8 150.2 65.3 -12.4 -18.0 11 893 A A E -A 21 0A 11 84,-0.3 2,-0.5 -2,-0.3 205,-0.3 -0.887 9.5-164.7-109.7 138.6 63.1 -10.2 -15.9 12 894 A S E -A 20 0A 25 8,-1.6 8,-2.6 -2,-0.4 2,-0.8 -0.986 18.4-136.9-123.0 117.4 63.8 -6.4 -15.2 13 895 A I E +A 19 0A 17 -2,-0.5 6,-0.2 201,-0.4 200,-0.2 -0.665 33.2 163.4 -80.8 109.8 62.0 -4.8 -12.3 14 896 A L - 0 0 89 4,-1.5 2,-0.2 -2,-0.8 5,-0.2 0.847 59.7 -27.1 -90.5 -45.4 60.8 -1.4 -13.6 15 897 A S S S- 0 0 30 3,-2.0 84,-1.5 84,-0.0 -1,-0.1 -0.736 76.4 -72.5-150.9-163.2 58.1 -0.5 -10.9 16 898 A H S S+ 0 0 59 82,-0.3 57,-0.2 -2,-0.2 82,-0.2 0.562 132.8 25.4 -80.3 -12.6 55.5 -1.8 -8.4 17 899 A D S S+ 0 0 57 1,-0.1 52,-2.0 54,-0.1 2,-0.4 0.429 113.2 70.4-129.4 -2.8 53.3 -2.9 -11.3 18 900 A T + 0 0 16 49,-0.2 -3,-2.0 50,-0.1 -4,-1.5 -0.980 44.0 176.3-131.5 136.9 55.7 -3.5 -14.3 19 901 A I E -AB 13 66A 0 47,-2.0 47,-3.0 -2,-0.4 2,-0.6 -0.995 21.9-140.9-133.9 131.3 58.4 -6.0 -15.3 20 902 A R E -AB 12 65A 106 -8,-2.6 -8,-1.6 -2,-0.3 2,-0.4 -0.873 15.5-160.3 -98.2 119.7 60.3 -6.1 -18.6 21 903 A I E +AB 11 64A 0 43,-3.3 43,-2.5 -2,-0.6 2,-0.3 -0.818 13.1 177.1 -99.4 133.5 61.0 -9.6 -20.0 22 904 A T E +AB 10 63A 27 -12,-2.1 -12,-2.6 -2,-0.4 2,-0.3 -0.993 3.5 163.6-139.0 145.0 63.8 -10.1 -22.5 23 905 A W E - 0 0 13 39,-1.1 2,-0.2 -2,-0.3 -15,-0.2 -0.927 27.3-117.5-152.3 172.6 65.1 -13.2 -24.3 24 906 A A E -A 7 0A 27 -17,-2.9 -17,-2.2 -2,-0.3 2,-0.4 -0.741 11.5-143.4-115.4 162.9 67.2 -14.6 -27.2 25 907 A D > - 0 0 0 -2,-0.2 3,-1.6 -19,-0.2 7,-0.1 -0.953 2.9-163.6-130.5 107.3 66.4 -16.8 -30.2 26 908 A N T 3 S+ 0 0 111 -2,-0.4 4,-0.1 -21,-0.3 -1,-0.1 0.494 89.1 65.8 -70.0 -4.0 69.1 -19.2 -31.3 27 909 A S T 3 S+ 0 0 50 -23,-0.1 -1,-0.3 2,-0.1 -24,-0.0 0.249 95.5 73.2 -98.8 9.7 67.5 -19.7 -34.7 28 910 A L S < S- 0 0 16 -3,-1.6 -3,-0.1 1,-0.1 6,-0.1 -0.918 96.3 -93.2-119.6 146.8 68.2 -16.0 -35.5 29 911 A P > - 0 0 72 0, 0.0 3,-3.8 0, 0.0 -4,-0.1 -0.120 47.6 -94.1 -60.3 156.1 71.7 -14.4 -36.3 30 912 A K T 3 S+ 0 0 213 1,-0.3 -5,-0.1 2,-0.1 -2,-0.0 0.774 128.7 58.8 -38.2 -36.6 73.8 -13.0 -33.5 31 913 A H T 3 S- 0 0 128 1,-0.1 -1,-0.3 2,-0.1 0, 0.0 0.562 101.7-139.7 -69.4 -18.1 72.3 -9.5 -34.3 32 914 A Q < + 0 0 46 -3,-3.8 2,-0.3 1,-0.2 -2,-0.1 0.623 33.7 171.7 64.1 26.5 68.7 -11.0 -33.7 33 915 A K - 0 0 139 -4,-0.1 2,-0.8 1,-0.1 -1,-0.2 -0.492 28.9-139.6 -67.9 119.8 66.9 -9.2 -36.6 34 916 A I + 0 0 65 -2,-0.3 -1,-0.1 1,-0.2 -6,-0.0 -0.745 40.6 152.5 -82.1 108.6 63.3 -10.6 -37.0 35 917 A T + 0 0 104 -2,-0.8 -1,-0.2 0, 0.0 -2,-0.0 0.574 51.7 77.8-107.8 -17.5 62.8 -10.9 -40.8 36 918 A D S S- 0 0 69 1,-0.1 -2,-0.0 2,-0.0 47,-0.0 0.117 93.0-103.1 -81.3-169.5 60.2 -13.8 -40.6 37 919 A S S S+ 0 0 90 2,-0.0 47,-0.3 0, 0.0 -1,-0.1 0.401 75.0 136.3 -94.0 -6.4 56.5 -14.0 -39.7 38 920 A R - 0 0 16 45,-0.2 2,-0.3 1,-0.0 45,-0.3 -0.070 33.7-169.6 -51.7 140.2 57.4 -15.4 -36.2 39 921 A Y E -C 82 0B 94 43,-2.5 43,-1.1 45,-0.1 2,-0.3 -1.000 12.9-139.1-137.2 135.6 55.7 -14.3 -33.0 40 922 A Y E -CD 81 59B 0 19,-2.7 19,-2.8 -2,-0.3 2,-0.4 -0.691 8.5-153.7 -93.2 145.2 56.5 -14.8 -29.3 41 923 A T E -CD 80 58B 17 39,-2.2 39,-1.5 -2,-0.3 2,-0.4 -0.981 8.8-160.3-118.7 128.4 53.9 -15.6 -26.7 42 924 A V E -CD 79 57B 0 15,-3.0 15,-1.8 -2,-0.4 2,-0.3 -0.943 7.2-171.1-110.7 132.2 54.8 -14.6 -23.0 43 925 A R E +CD 78 56B 49 35,-2.4 35,-1.6 -2,-0.4 2,-0.3 -0.885 6.0 177.0-120.3 153.1 52.9 -16.2 -20.1 44 926 A W E +CD 77 55B 18 11,-2.2 11,-3.0 -2,-0.3 2,-0.3 -0.988 8.0 168.9-155.7 148.3 53.1 -15.3 -16.4 45 927 A K E -C 76 0B 34 31,-1.3 31,-2.6 -2,-0.3 2,-0.3 -0.953 46.0 -88.4-151.7 160.8 51.5 -16.2 -13.1 46 928 A T E -C 75 0B 35 -2,-0.3 29,-0.3 29,-0.2 6,-0.1 -0.655 37.2-127.9 -75.8 133.0 52.2 -15.5 -9.4 47 929 A N S S+ 0 0 28 27,-1.9 -1,-0.1 -2,-0.3 28,-0.1 0.863 84.5 77.8 -47.6 -45.9 54.7 -18.0 -8.0 48 930 A I S S+ 0 0 130 26,-0.4 2,-0.2 3,-0.0 -1,-0.1 -0.946 80.9 38.5-120.1 133.2 52.3 -18.8 -5.1 49 931 A P S S- 0 0 87 0, 0.0 3,-0.2 0, 0.0 -3,-0.0 0.641 80.3-143.0 -70.4 165.2 49.7 -20.6 -5.1 50 932 A A S S+ 0 0 79 1,-0.2 2,-1.3 -2,-0.2 -2,-0.0 0.951 94.0 57.8 -63.8 -46.0 51.1 -23.3 -7.5 51 933 A N S S+ 0 0 145 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.670 74.2 127.7 -91.6 81.0 47.7 -23.7 -9.2 52 934 A T - 0 0 41 -2,-1.3 2,-0.3 -3,-0.2 -7,-0.0 -0.868 64.4-100.0-124.0 153.3 47.0 -20.1 -10.5 53 935 A K - 0 0 173 -2,-0.3 2,-0.3 1,-0.1 -7,-0.2 -0.653 32.0-119.4 -85.9 140.1 46.1 -19.4 -14.1 54 936 A Y - 0 0 76 -2,-0.3 2,-0.3 -9,-0.1 -9,-0.2 -0.564 21.0-152.6 -73.3 131.1 48.7 -18.1 -16.6 55 937 A K E -D 44 0B 120 -11,-3.0 -11,-2.2 -2,-0.3 2,-0.3 -0.692 24.1-168.5 -95.1 155.1 47.9 -14.7 -18.1 56 938 A N E -D 43 0B 105 -2,-0.3 2,-0.3 -13,-0.2 -13,-0.2 -0.960 20.6-176.0-149.3 168.3 49.5 -14.2 -21.6 57 939 A A E -D 42 0B 16 -15,-1.8 -15,-3.0 -2,-0.3 2,-0.3 -0.977 22.8-120.7-158.5 155.9 50.4 -11.8 -24.5 58 940 A N E -D 41 0B 101 -2,-0.3 2,-0.3 -17,-0.2 -17,-0.2 -0.855 24.7-176.7-107.9 140.7 52.0 -11.8 -28.0 59 941 A A E -D 40 0B 10 -19,-2.8 -19,-2.7 -2,-0.3 5,-0.1 -0.994 27.6-162.7-138.5 141.6 55.1 -9.8 -29.2 60 942 A T S S+ 0 0 111 -2,-0.3 2,-0.2 -21,-0.2 -26,-0.1 0.275 82.2 72.4 -99.5 2.9 56.9 -9.4 -32.6 61 943 A T S S- 0 0 68 2,-0.3 2,-0.5 -21,-0.1 -21,-0.2 -0.768 92.7-112.9-116.8 160.0 59.9 -8.2 -30.6 62 944 A L S S+ 0 0 26 -2,-0.2 -39,-1.1 -30,-0.1 2,-0.3 -0.241 98.9 52.7 -89.0 42.0 62.5 -10.0 -28.3 63 945 A S E -B 22 0A 21 -2,-0.5 -2,-0.3 -41,-0.2 2,-0.3 -0.925 63.3-163.3-166.2 153.2 61.2 -8.1 -25.2 64 946 A Y E -B 21 0A 65 -43,-2.5 -43,-3.3 -2,-0.3 2,-0.8 -0.972 16.7-139.0-151.5 136.1 57.8 -7.6 -23.5 65 947 A L E -B 20 0A 88 -2,-0.3 2,-0.5 -45,-0.2 -45,-0.2 -0.858 20.0-155.5 -96.1 99.5 56.6 -5.1 -20.9 66 948 A V E +B 19 0A 0 -47,-3.0 -47,-2.0 -2,-0.8 2,-0.2 -0.716 22.3 177.3 -80.8 121.4 54.3 -7.0 -18.4 67 949 A T + 0 0 81 -2,-0.5 -49,-0.2 -49,-0.2 -1,-0.0 -0.677 46.2 49.5-120.2 175.3 51.9 -4.5 -16.7 68 950 A G S S+ 0 0 60 -2,-0.2 -50,-0.1 1,-0.2 2,-0.1 0.714 73.1 149.7 68.9 25.1 49.0 -4.5 -14.2 69 951 A L - 0 0 9 -52,-2.0 -1,-0.2 -3,-0.2 -53,-0.0 -0.453 50.7-103.6 -86.6 156.1 50.9 -6.6 -11.7 70 952 A K > - 0 0 147 -2,-0.1 3,-0.7 1,-0.1 28,-0.3 -0.532 39.8-102.5 -77.2 148.3 50.4 -6.4 -7.9 71 953 A P T 3 S+ 0 0 23 0, 0.0 29,-0.2 0, 0.0 62,-0.2 -0.382 104.1 14.1 -67.7 153.2 53.0 -4.5 -5.7 72 954 A N T 3 S+ 0 0 74 27,-2.3 2,-0.4 1,-0.2 27,-0.1 0.865 97.1 139.3 50.0 45.5 55.5 -6.7 -3.8 73 955 A T < - 0 0 24 -3,-0.7 25,-1.8 26,-0.2 2,-0.4 -0.983 48.1-138.9-127.2 132.0 54.5 -9.8 -5.8 74 956 A L E - E 0 97B 27 -2,-0.4 -27,-1.9 23,-0.3 -26,-0.4 -0.756 25.9-172.1 -89.6 128.6 56.7 -12.6 -7.2 75 957 A Y E -CE 46 96B 14 21,-2.9 21,-1.8 -2,-0.4 2,-0.4 -0.856 19.9-137.5-122.1 154.4 55.9 -13.8 -10.7 76 958 A E E -CE 45 95B 34 -31,-2.6 -31,-1.3 -2,-0.3 2,-0.4 -0.899 22.5-166.1-105.9 136.1 57.1 -16.7 -13.0 77 959 A F E +CE 44 94B 0 17,-3.2 17,-2.8 -2,-0.4 2,-0.3 -0.987 12.6 169.1-132.4 136.9 57.7 -16.0 -16.7 78 960 A S E -C 43 0B 0 -35,-1.6 -35,-2.4 -2,-0.4 2,-0.3 -0.960 14.1-156.5-138.9 150.8 58.1 -18.3 -19.8 79 961 A V E -C 42 0B 0 -2,-0.3 12,-3.3 13,-0.3 2,-0.3 -0.876 7.4-174.3-127.2 158.5 58.2 -17.5 -23.5 80 962 A M E -C 41 0B 26 -39,-1.5 -39,-2.2 -2,-0.3 2,-0.3 -0.958 16.5-133.1-147.6 156.9 57.5 -19.6 -26.7 81 963 A V E -C 40 0B 0 -2,-0.3 7,-1.3 8,-0.3 2,-0.3 -0.838 12.8-171.3-115.7 151.9 57.8 -18.9 -30.5 82 964 A T E -CF 39 87B 17 -43,-1.1 -43,-2.5 -2,-0.3 2,-0.6 -0.919 4.2-179.4-143.3 113.0 55.4 -19.6 -33.4 83 965 A K E > - 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