==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 06-OCT-10 3P4L . COMPND 2 MOLECULE: NEOGENIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.YANG,A.P.WEST JR.,P.J.BJORKMAN . 198 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11504.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 105 53.0 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 . 72 36.4 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 . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 2.0 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 . 11 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 6.1 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 . 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 . 0 2 0 4 2 2 1 1 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 2 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 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 1 852 A L 0 0 176 0, 0.0 84,-0.3 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 137.7 -21.8 17.5 7.7 2 853 A P - 0 0 106 0, 0.0 84,-0.2 0, 0.0 2,-0.2 -0.539 360.0-130.8 -81.0 140.2 -18.3 16.2 6.7 3 854 A M - 0 0 11 82,-2.0 84,-0.4 -2,-0.2 76,-0.1 -0.565 32.4 -96.1 -84.8 154.9 -15.2 18.1 7.7 4 855 A M - 0 0 107 -2,-0.2 23,-0.2 82,-0.1 82,-0.1 -0.474 43.0-121.7 -67.0 131.7 -12.5 18.9 5.2 5 856 A P - 0 0 45 0, 0.0 21,-0.3 0, 0.0 73,-0.1 -0.447 35.0 -92.8 -76.2 154.7 -9.8 16.2 5.4 6 857 A P - 0 0 3 0, 0.0 84,-0.4 0, 0.0 2,-0.2 -0.281 46.9-163.4 -59.3 152.5 -6.3 17.5 6.1 7 858 A V E +A 24 0A 60 17,-2.2 17,-2.9 1,-0.1 82,-0.1 -0.790 57.4 41.3-130.6 174.5 -4.1 18.2 3.1 8 859 A G E - 0 0 50 -2,-0.2 2,-0.2 15,-0.2 -1,-0.1 0.806 69.3-177.7 57.4 34.9 -0.4 18.7 2.3 9 860 A V E - 0 0 23 81,-0.2 2,-0.4 -3,-0.1 14,-0.2 -0.447 3.0-175.9 -67.9 129.7 0.7 15.9 4.7 10 861 A Q E -A 22 0A 131 12,-2.6 12,-2.2 -2,-0.2 2,-0.6 -0.970 21.7-147.3-132.3 146.7 4.5 15.6 4.8 11 862 A A E -A 21 0A 26 -2,-0.4 2,-0.6 82,-0.3 10,-0.2 -0.956 12.5-166.6-114.5 113.2 6.9 13.2 6.4 12 863 A S E -A 20 0A 61 8,-2.7 8,-2.8 -2,-0.6 2,-0.5 -0.888 16.5-139.1-101.8 117.3 10.2 14.7 7.5 13 864 A I E +A 19 0A 42 -2,-0.6 6,-0.2 6,-0.2 3,-0.1 -0.628 28.2 168.7 -79.8 121.4 12.9 12.1 8.4 14 865 A L - 0 0 89 4,-2.3 2,-0.3 -2,-0.5 5,-0.2 0.720 60.9 -29.0-102.7 -27.1 14.8 13.1 11.5 15 866 A S S S- 0 0 28 3,-1.7 82,-1.6 82,-0.0 -1,-0.2 -0.868 80.1 -65.6-164.1-164.7 16.7 9.9 12.3 16 867 A H S S+ 0 0 55 -2,-0.3 55,-0.2 80,-0.2 80,-0.1 0.587 133.1 22.6 -76.2 -9.3 16.7 6.1 12.1 17 868 A D S S+ 0 0 51 1,-0.1 50,-2.4 52,-0.1 2,-0.4 0.360 111.7 72.8-138.6 8.9 13.7 6.0 14.5 18 869 A T + 0 0 19 47,-0.2 -4,-2.3 48,-0.2 -3,-1.7 -0.992 42.8 172.7-136.0 131.4 11.9 9.4 14.3 19 870 A I E -AB 13 64A 0 45,-2.3 45,-2.8 -2,-0.4 2,-0.5 -0.999 21.2-145.0-134.4 131.5 9.8 11.0 11.6 20 871 A R E -AB 12 63A 110 -8,-2.8 -8,-2.7 -2,-0.4 2,-0.4 -0.857 14.2-155.3 -98.7 129.6 7.9 14.3 12.1 21 872 A I E +AB 11 62A 0 41,-3.4 41,-2.3 -2,-0.5 2,-0.3 -0.862 15.5 175.7-105.0 137.2 4.5 14.6 10.3 22 873 A T E +AB 10 61A 34 -12,-2.2 -12,-2.6 -2,-0.4 2,-0.3 -0.930 2.9 162.8-135.6 159.9 3.0 17.9 9.3 23 874 A W E - 0 0 16 37,-1.5 2,-0.3 -2,-0.3 -15,-0.2 -0.957 29.8-112.2-162.7 176.1 -0.1 19.0 7.4 24 875 A A E -A 7 0A 28 -17,-2.9 -17,-2.2 -2,-0.3 2,-0.5 -0.894 10.4-152.1-119.1 151.3 -2.5 21.8 6.6 25 876 A D > - 0 0 0 -2,-0.3 3,-2.1 -19,-0.2 7,-0.1 -0.912 6.9-166.3-124.2 102.2 -6.2 22.2 7.6 26 877 A N T 3 S+ 0 0 110 -2,-0.5 -1,-0.1 -21,-0.3 4,-0.1 0.523 83.3 71.3 -68.3 -6.1 -7.8 24.4 4.9 27 878 A S T 3 S+ 0 0 54 -23,-0.2 -1,-0.3 2,-0.1 -3,-0.0 0.598 91.8 73.2 -83.0 -9.9 -10.9 24.9 7.1 28 879 A L S < S- 0 0 18 -3,-2.1 6,-0.1 1,-0.1 -4,-0.0 -0.580 98.9 -93.5 -95.0 164.0 -8.6 27.2 9.2 29 880 A P > - 0 0 68 0, 0.0 3,-2.3 0, 0.0 -4,-0.2 -0.228 47.4 -93.6 -68.1 169.9 -7.4 30.6 8.2 30 881 A K T 3 S+ 0 0 211 1,-0.3 -2,-0.0 2,-0.1 -4,-0.0 0.769 125.4 65.6 -57.9 -25.6 -4.1 30.9 6.4 31 882 A H T 3 S- 0 0 114 2,-0.1 -1,-0.3 1,-0.1 -3,-0.0 0.670 99.0-142.2 -71.4 -11.7 -2.4 31.6 9.8 32 883 A Q < + 0 0 50 -3,-2.3 2,-0.4 1,-0.2 28,-0.1 0.728 43.7 151.7 59.1 26.8 -3.4 28.1 10.7 33 884 A K - 0 0 135 26,-0.0 2,-0.5 -4,-0.0 -1,-0.2 -0.720 40.1-134.4 -89.9 141.0 -4.2 28.8 14.3 34 885 A I + 0 0 47 -2,-0.4 -6,-0.0 24,-0.2 24,-0.0 -0.812 28.7 168.9 -95.9 128.9 -6.8 26.7 16.0 35 886 A T + 0 0 133 -2,-0.5 2,-0.2 0, 0.0 -1,-0.1 0.061 60.3 57.4-125.6 19.2 -9.5 28.4 18.1 36 887 A D S S- 0 0 60 2,-0.1 -2,-0.0 0, 0.0 45,-0.0 -0.742 94.6 -90.2-135.8-172.6 -11.8 25.4 18.7 37 888 A S S S+ 0 0 93 -2,-0.2 45,-0.2 2,-0.0 43,-0.0 0.286 72.1 132.8 -89.1 12.5 -11.8 22.0 20.2 38 889 A R - 0 0 20 43,-0.1 2,-0.3 20,-0.1 43,-0.2 -0.157 33.8-168.9 -61.0 156.9 -10.9 20.0 17.0 39 890 A Y E -C 80 0B 87 41,-2.4 41,-2.4 19,-0.0 2,-0.3 -0.992 13.1-135.5-148.0 145.4 -8.2 17.4 17.1 40 891 A Y E -CD 79 57B 0 17,-2.9 17,-2.3 -2,-0.3 2,-0.4 -0.664 9.1-150.2 -96.7 156.1 -6.3 15.5 14.5 41 892 A T E -CD 78 56B 14 37,-2.0 37,-2.3 -2,-0.3 2,-0.4 -0.999 8.9-159.0-127.2 132.5 -5.5 11.8 14.5 42 893 A V E -CD 77 55B 0 13,-2.8 13,-1.6 -2,-0.4 2,-0.4 -0.911 8.6-169.9-110.8 134.6 -2.4 10.5 12.7 43 894 A R E +CD 76 54B 49 33,-2.5 33,-1.8 -2,-0.4 2,-0.3 -0.945 7.8 173.1-125.1 149.1 -2.2 6.9 11.7 44 895 A W E +CD 75 53B 13 9,-2.0 9,-2.3 -2,-0.4 2,-0.3 -0.997 6.2 157.2-152.2 155.6 0.9 5.0 10.4 45 896 A K E -C 74 0B 41 29,-1.3 29,-2.7 -2,-0.3 2,-0.2 -0.975 40.7 -97.6-165.6 168.7 2.0 1.6 9.5 46 897 A T E -C 73 0B 22 -2,-0.3 27,-0.2 5,-0.2 -2,-0.0 -0.641 21.9-138.2 -90.3 152.5 4.6 -0.3 7.4 47 898 A N 0 0 76 25,-0.7 -1,-0.1 -2,-0.2 26,-0.1 0.182 360.0 360.0 -94.4 16.9 3.5 -1.6 4.0 48 899 A I 0 0 151 24,-0.2 -1,-0.1 0, 0.0 -2,-0.1 -0.148 360.0 360.0 -56.4 360.0 5.4 -4.7 5.0 49 ! 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 50 903 A T 0 0 109 0, 0.0 2,-0.2 0, 0.0 -5,-0.0 0.000 360.0 360.0 360.0 126.7 -0.1 -4.9 9.3 51 904 A K - 0 0 190 1,-0.1 -5,-0.2 -6,-0.0 2,-0.1 -0.535 360.0 -98.3 -94.3 163.1 -2.3 -2.7 11.4 52 905 A Y - 0 0 86 -2,-0.2 2,-0.3 -7,-0.1 -7,-0.2 -0.400 19.7-151.5 -79.9 152.2 -2.1 1.1 12.1 53 906 A K E -D 44 0B 128 -9,-2.3 -9,-2.0 -2,-0.1 2,-0.3 -0.787 27.1-174.9-108.6 155.8 -0.6 2.8 15.1 54 907 A N E -D 43 0B 105 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.975 19.5-178.8-151.2 168.4 -2.2 6.1 15.9 55 908 A A E -D 42 0B 17 -13,-1.6 -13,-2.8 -2,-0.3 2,-0.2 -0.962 23.7-122.7-160.4 157.5 -2.0 9.2 18.1 56 909 A N E -D 41 0B 94 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.682 24.0-175.2-106.4 161.2 -4.0 12.4 18.5 57 910 A A E -D 40 0B 12 -17,-2.3 -17,-2.9 -2,-0.2 5,-0.1 -0.985 29.9-162.1-154.4 144.2 -2.8 16.0 18.2 58 911 A T S S+ 0 0 100 -2,-0.3 2,-0.3 -19,-0.2 -24,-0.2 0.080 82.8 75.3-109.8 21.5 -4.1 19.5 18.7 59 912 A T S S- 0 0 77 2,-0.4 2,-0.4 -19,-0.1 -19,-0.2 -0.835 93.7-113.9-121.8 160.1 -1.2 20.9 16.7 60 913 A L S S+ 0 0 34 -2,-0.3 -37,-1.5 -28,-0.1 2,-0.3 -0.200 98.2 54.3 -91.0 41.7 -0.7 20.7 12.9 61 914 A S E -B 22 0A 22 -2,-0.4 -2,-0.4 -39,-0.2 2,-0.3 -0.965 62.1-163.1-164.6 156.1 2.2 18.4 13.4 62 915 A Y E -B 21 0A 65 -41,-2.3 -41,-3.4 -2,-0.3 2,-0.7 -0.967 15.3-140.0-150.1 132.8 3.0 15.1 15.2 63 916 A L E -B 20 0A 81 -2,-0.3 2,-0.6 -43,-0.2 -43,-0.2 -0.861 15.5-159.6 -97.9 114.3 6.4 13.6 16.1 64 917 A V E +B 19 0A 0 -45,-2.8 -45,-2.3 -2,-0.7 2,-0.2 -0.848 19.0 172.5 -95.7 119.2 6.5 9.8 15.6 65 918 A T + 0 0 89 -2,-0.6 -47,-0.2 -47,-0.2 -2,-0.0 -0.645 48.3 51.8-116.4 173.9 9.3 8.2 17.6 66 919 A G S S+ 0 0 70 -2,-0.2 -48,-0.2 1,-0.2 -1,-0.1 0.770 72.2 147.1 71.5 26.4 10.2 4.5 18.3 67 920 A L - 0 0 17 -50,-2.4 -1,-0.2 -3,-0.2 -51,-0.0 -0.388 50.3-103.3 -88.3 173.7 10.3 3.5 14.7 68 921 A K > - 0 0 136 -2,-0.1 3,-0.7 1,-0.1 28,-0.3 -0.756 39.8-100.0 -97.8 145.5 12.6 0.9 13.1 69 922 A P T 3 S+ 0 0 24 0, 0.0 29,-0.2 0, 0.0 62,-0.2 -0.168 99.4 10.1 -62.2 153.3 15.7 1.8 11.0 70 923 A N T 3 S+ 0 0 74 27,-2.4 2,-0.4 61,-0.2 27,-0.1 0.830 96.2 139.3 45.8 45.8 15.6 1.6 7.3 71 924 A T < - 0 0 15 -3,-0.7 25,-2.1 26,-0.2 2,-0.5 -0.966 50.1-134.2-127.3 134.0 11.8 1.1 7.2 72 925 A L E - E 0 95B 71 -2,-0.4 -25,-0.7 23,-0.2 2,-0.3 -0.707 25.5-172.4 -85.8 123.9 9.1 2.6 5.0 73 926 A Y E -CE 46 94B 15 21,-3.2 21,-2.3 -2,-0.5 2,-0.5 -0.899 17.7-142.9-117.5 149.3 6.0 3.9 6.7 74 927 A E E -CE 45 93B 35 -29,-2.7 -29,-1.3 -2,-0.3 2,-0.4 -0.947 23.5-168.7-109.0 125.4 2.7 5.2 5.2 75 928 A F E +CE 44 92B 0 17,-3.2 17,-2.2 -2,-0.5 2,-0.3 -0.932 12.3 165.1-119.6 142.0 1.2 8.2 7.1 76 929 A S E -C 43 0B 0 -33,-1.8 -33,-2.5 -2,-0.4 2,-0.3 -0.975 16.5-148.6-149.6 161.2 -2.3 9.9 6.9 77 930 A V E -C 42 0B 0 -2,-0.3 12,-2.2 13,-0.3 2,-0.3 -0.974 10.0-177.1-137.8 145.9 -4.3 12.3 9.0 78 931 A M E -C 41 0B 28 -37,-2.3 -37,-2.0 -2,-0.3 2,-0.3 -0.849 17.7-134.3-131.4 171.7 -7.9 13.0 9.8 79 932 A V E -C 40 0B 0 8,-0.3 7,-2.0 -2,-0.3 2,-0.4 -0.956 14.7-171.3-129.9 148.8 -9.7 15.7 11.9 80 933 A T E +CF 39 85B 19 -41,-2.4 -41,-2.4 -2,-0.3 2,-0.3 -0.988 8.3 173.7-137.0 143.0 -12.5 15.4 14.4 81 934 A K E > - 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