==== 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 28-AUG-09 2WQZ . COMPND 2 MOLECULE: NEUROLIGIN 4, X-LINKED; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR I.P.FABRICHNY,P.LEONE,G.SULZENBACHER,D.COMOLETTI,M.T.MILLER, . 1443 9 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 59546.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 913 63.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 79 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 169 11.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 169 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 140 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 261 18.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 1.5 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 4 6 2 4 4 4 2 1 0 1 1 1 3 0 0 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 2 2 3 3 3 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 . 9 7 6 11 2 4 1 0 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 . 2 2 0 2 0 1 1 0 0 0 0 2 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 36 A D 0 0 215 0, 0.0 3,-0.1 0, 0.0 7,-0.0 0.000 360.0 360.0 360.0 42.4 -6.9 -47.9 -26.8 2 37 A D + 0 0 151 2,-0.0 2,-2.7 3,-0.0 3,-0.1 0.182 360.0 50.7-148.0 -71.5 -8.2 -51.1 -25.1 3 38 A D S > S- 0 0 104 1,-0.2 4,-3.3 2,-0.1 5,-0.4 -0.409 78.9-168.3 -73.4 70.3 -8.2 -51.2 -21.2 4 39 A K H > S+ 0 0 180 -2,-2.7 4,-0.5 2,-0.2 -1,-0.2 0.717 70.7 25.1 -36.3 -61.5 -10.0 -47.8 -21.3 5 40 A L H >> S+ 0 0 137 2,-0.2 3,-2.8 1,-0.2 4,-1.5 0.993 127.4 40.3 -68.0 -75.4 -9.8 -46.8 -17.6 6 41 A A H 3> S+ 0 0 41 1,-0.3 4,-0.8 2,-0.2 -2,-0.2 0.712 119.5 48.1 -52.2 -27.9 -6.7 -48.6 -16.2 7 42 A A H 3< S+ 0 0 23 -4,-3.3 -1,-0.3 1,-0.2 -2,-0.2 0.545 113.5 46.3 -92.0 -10.4 -4.8 -47.9 -19.4 8 43 A A H << S+ 0 0 55 -3,-2.8 -2,-0.2 -4,-0.5 -1,-0.2 0.457 100.4 70.2 -99.8 -8.0 -5.7 -44.2 -19.4 9 44 A Q H < S+ 0 0 102 -4,-1.5 15,-1.3 1,-0.4 -2,-0.2 0.918 122.9 8.7 -70.8 -46.2 -4.8 -44.0 -15.7 10 45 A Y S < S- 0 0 100 -4,-0.8 -1,-0.4 13,-0.2 13,-0.1 -0.943 99.2-133.8-134.4 114.0 -1.2 -44.4 -16.6 11 46 A P - 0 0 12 0, 0.0 11,-0.6 0, 0.0 2,-0.2 0.264 1.2-133.0 -68.9-174.0 -0.7 -44.2 -20.4 12 47 A V E -A 21 0A 51 9,-0.2 2,-0.5 -5,-0.1 9,-0.2 -0.676 23.5-174.0-144.2 88.9 1.3 -46.3 -22.8 13 48 A V E -A 20 0A 14 7,-1.8 7,-2.5 -2,-0.2 2,-0.7 -0.740 21.0-133.5 -94.2 119.2 3.5 -44.4 -25.3 14 49 A N E -A 19 0A 95 -2,-0.5 5,-0.3 5,-0.2 2,-0.1 -0.565 26.2-175.1 -69.3 108.8 5.4 -46.2 -28.1 15 50 A T E > -A 18 0A 10 3,-3.3 3,-0.6 -2,-0.7 185,-0.0 -0.407 40.6-112.8 -85.2 174.2 8.9 -45.0 -28.3 16 51 A N T 3 S+ 0 0 111 1,-0.2 3,-0.1 -2,-0.1 -1,-0.1 0.606 123.2 53.8 -75.3 -15.3 11.3 -46.1 -31.0 17 52 A Y T 3 S- 0 0 36 1,-0.3 45,-1.1 44,-0.1 2,-0.3 0.184 130.7 -74.7-105.3 11.6 13.2 -47.8 -28.1 18 53 A G E < -A 15 0A 13 -3,-0.6 -3,-3.3 43,-0.2 2,-0.5 -0.889 66.4 -47.0 135.7-163.3 10.0 -49.6 -26.9 19 54 A K E -A 14 0A 78 45,-0.4 47,-0.7 -5,-0.3 2,-0.4 -0.942 47.7-161.2-101.9 133.8 6.7 -48.8 -25.1 20 55 A I E -Ab 13 66A 1 -7,-2.5 -7,-1.8 -2,-0.5 2,-0.6 -0.939 7.5-149.4-110.5 139.9 6.9 -46.7 -22.0 21 56 A R E -Ab 12 67A 54 45,-1.9 47,-2.2 -2,-0.4 -9,-0.2 -0.953 25.9-178.6-107.2 118.9 4.1 -46.7 -19.4 22 57 A G - 0 0 1 -11,-0.6 2,-0.3 -2,-0.6 16,-0.2 0.228 22.6-100.2 -98.2-144.0 3.9 -43.4 -17.7 23 58 A L E -C 37 0B 47 14,-2.2 14,-3.6 -13,-0.1 2,-0.4 -0.948 15.0-144.6-156.7 119.4 1.8 -41.8 -15.0 24 59 A R E +C 36 0B 107 -15,-1.3 12,-0.2 -2,-0.3 -16,-0.0 -0.741 27.5 169.6 -86.8 137.2 -1.1 -39.3 -15.1 25 60 A T E -C 35 0B 42 10,-1.6 10,-2.5 -2,-0.4 2,-0.1 -0.985 21.7-142.7-147.7 133.1 -1.2 -36.8 -12.2 26 61 A P - 0 0 87 0, 0.0 7,-0.1 0, 0.0 125,-0.0 -0.277 22.0-116.5 -84.1-177.7 -3.4 -33.7 -11.6 27 62 A L - 0 0 23 5,-0.4 5,-0.2 2,-0.2 438,-0.1 -0.888 12.6-125.8-119.4 152.0 -2.3 -30.4 -10.1 28 63 A P S S+ 0 0 99 0, 0.0 437,-0.1 0, 0.0 -1,-0.1 0.813 79.4 98.4 -62.3 -37.0 -3.5 -28.7 -6.8 29 64 A N S S- 0 0 39 435,-0.5 3,-0.5 1,-0.1 -2,-0.2 -0.046 74.5-130.1 -53.2 155.6 -4.4 -25.3 -8.5 30 65 A E S S+ 0 0 177 1,-0.2 2,-1.2 3,-0.0 -1,-0.1 0.962 102.3 41.2 -74.9 -56.9 -8.0 -24.6 -9.4 31 66 A I S S+ 0 0 128 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.467 99.1 96.0 -91.4 62.0 -7.6 -23.5 -13.0 32 67 A L - 0 0 23 -2,-1.2 -5,-0.4 -3,-0.5 124,-0.1 -0.916 60.3-145.3-158.1 125.0 -5.0 -26.1 -13.9 33 68 A G - 0 0 31 -2,-0.3 122,-0.1 1,-0.2 -4,-0.1 -0.067 30.4 -84.3 -83.3 178.9 -5.5 -29.4 -15.6 34 69 A P - 0 0 36 0, 0.0 86,-1.2 0, 0.0 87,-0.3 -0.216 37.4-150.5 -70.8 174.4 -3.8 -32.7 -15.2 35 70 A V E -CD 25 119B 0 -10,-2.5 -10,-1.6 84,-0.2 2,-0.2 -0.955 15.6-123.1-150.1 131.0 -0.6 -33.6 -16.9 36 71 A E E -CD 24 118B 45 82,-2.7 82,-2.7 -2,-0.3 2,-0.4 -0.542 31.8-157.6 -69.1 136.5 0.7 -37.0 -18.1 37 72 A Q E -CD 23 117B 18 -14,-3.6 -14,-2.2 -2,-0.2 2,-0.2 -0.986 22.5-178.9-125.4 130.9 4.2 -37.7 -16.5 38 73 A Y - 0 0 0 78,-2.3 78,-0.4 -2,-0.4 3,-0.3 -0.558 23.1-176.1-122.1 64.2 6.9 -40.1 -17.8 39 74 A L + 0 0 21 29,-0.3 31,-0.7 -2,-0.2 76,-0.1 -0.232 59.5 19.7 -67.8 149.3 9.5 -39.6 -15.2 40 75 A G S S+ 0 0 8 1,-0.2 -1,-0.2 29,-0.2 75,-0.2 0.932 77.8 163.4 58.9 54.7 12.9 -41.4 -15.5 41 76 A V E -E 114 0B 1 73,-2.8 73,-3.2 -3,-0.3 2,-0.4 -0.790 35.3-119.7 -99.9 145.9 12.9 -42.2 -19.2 42 77 A P E +E 113 0B 9 0, 0.0 71,-0.2 0, 0.0 3,-0.1 -0.765 31.6 170.4 -95.0 132.0 16.2 -43.1 -21.0 43 78 A Y + 0 0 0 69,-1.1 2,-0.3 -2,-0.4 70,-0.1 0.336 69.4 14.1-114.5 2.7 17.7 -41.0 -23.9 44 79 A A S S- 0 0 4 68,-0.7 16,-0.3 14,-0.2 145,-0.0 -0.920 87.0 -82.0-159.9 176.3 21.1 -42.7 -24.2 45 80 A S - 0 0 9 12,-3.1 12,-0.3 -2,-0.3 66,-0.1 -0.857 62.5 -85.9 -95.8 134.4 23.1 -45.8 -23.2 46 81 A P - 0 0 31 0, 0.0 2,-3.3 0, 0.0 5,-0.2 -0.003 33.6-130.0 -37.7 121.3 24.7 -45.7 -19.7 47 82 A P + 0 0 1 0, 0.0 6,-0.1 0, 0.0 2,-0.1 -0.333 61.7 154.2 -73.7 62.3 28.1 -44.0 -20.1 48 83 A T >> - 0 0 70 -2,-3.3 4,-0.9 3,-0.1 3,-0.5 -0.267 51.8 -33.9 -97.5 169.9 29.3 -47.0 -18.2 49 84 A G T 34 S+ 0 0 44 1,-0.2 -1,-0.0 2,-0.2 0, 0.0 0.253 139.0 19.1 21.4 -76.5 32.6 -48.9 -17.9 50 85 A E T 34 S+ 0 0 124 1,-0.1 -1,-0.2 3,-0.0 232,-0.0 0.973 122.4 55.9 -78.0 -62.3 33.8 -48.4 -21.4 51 86 A R T X4 S+ 0 0 82 -3,-0.5 3,-0.7 -5,-0.2 -2,-0.2 0.789 76.6 115.4 -41.9 -50.8 31.7 -45.4 -22.6 52 87 A R T 3< S+ 0 0 14 -4,-0.9 -4,-0.1 1,-0.3 120,-0.1 0.114 84.7 16.4 -16.2 132.0 32.9 -43.1 -19.7 53 88 A F T 3 S+ 0 0 5 118,-0.5 -1,-0.3 1,-0.2 129,-0.1 0.796 114.1 93.4 60.3 31.1 34.9 -40.2 -21.1 54 89 A Q S < S- 0 0 91 -3,-0.7 -1,-0.2 127,-0.1 127,-0.0 -0.972 88.3 -85.8-148.7 147.5 33.5 -40.9 -24.6 55 90 A P - 0 0 69 0, 0.0 2,-0.4 0, 0.0 130,-0.1 -0.117 55.5 -89.7 -62.0 163.3 30.5 -39.4 -26.4 56 91 A P - 0 0 15 0, 0.0 -4,-0.0 0, 0.0 136,-0.0 -0.575 33.1-155.8 -89.5 126.2 27.1 -41.0 -25.8 57 92 A E - 0 0 107 -2,-0.4 -12,-3.1 -12,-0.3 135,-0.0 -0.627 37.0 -82.1 -91.1 154.4 25.6 -43.8 -27.9 58 93 A P - 0 0 63 0, 0.0 -14,-0.2 0, 0.0 -1,-0.2 0.261 47.8 -97.6 -41.0 167.1 21.8 -44.4 -28.2 59 94 A P - 0 0 13 0, 0.0 -14,-0.2 0, 0.0 -16,-0.0 -0.385 39.4-115.2 -82.3 177.4 19.7 -46.3 -25.6 60 95 A S - 0 0 83 -16,-0.3 2,-0.3 -2,-0.1 -15,-0.0 0.432 28.7-104.2 -95.1-139.7 18.7 -49.9 -26.1 61 96 A S + 0 0 88 2,-0.0 2,-0.2 -43,-0.0 -43,-0.2 -0.958 26.4 176.8-161.1 143.6 15.4 -51.7 -26.6 62 97 A W - 0 0 55 -45,-1.1 2,-0.3 -2,-0.3 4,-0.1 -0.617 21.7-127.0-125.2-177.4 12.8 -53.8 -24.8 63 98 A T S S+ 0 0 137 -2,-0.2 2,-0.4 2,-0.2 -2,-0.0 -0.900 73.5 20.6-129.4 170.9 9.4 -55.3 -25.6 64 99 A G S S- 0 0 45 -2,-0.3 -45,-0.4 2,-0.0 2,-0.3 -0.656 112.1 -36.9 75.8-127.0 6.1 -55.1 -23.8 65 100 A I - 0 0 80 -2,-0.4 2,-0.4 -47,-0.1 -45,-0.2 -0.874 46.9-147.4-129.0 159.3 6.0 -52.0 -21.5 66 101 A R E -b 20 0A 78 -47,-0.7 -45,-1.9 -2,-0.3 2,-0.6 -0.958 23.1-124.5-131.9 117.4 8.6 -50.2 -19.3 67 102 A N E +b 21 0A 112 -2,-0.4 2,-0.7 -47,-0.2 -45,-0.2 -0.433 30.0 176.0 -63.7 107.0 7.6 -48.5 -16.1 68 103 A T + 0 0 2 -47,-2.2 -29,-0.3 -2,-0.6 -28,-0.1 -0.855 37.7 119.1-107.5 85.6 8.8 -44.9 -16.4 69 104 A T + 0 0 35 -2,-0.7 2,-0.3 1,-0.2 -29,-0.2 0.081 58.9 48.8-145.0 25.1 7.4 -43.6 -13.2 70 105 A Q S S- 0 0 157 -31,-0.7 -1,-0.2 -3,-0.1 2,-0.1 -0.881 85.0-100.3-162.2 141.5 10.2 -42.4 -11.0 71 106 A F - 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