==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 19-OCT-10 3APM . COMPND 2 MOLECULE: PROTEIN-ARGININE DEIMINASE TYPE-4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.HORIKOSHI,H.TACHIWANA,K.SAITO,A.OSAKABE,M.SATO,M.YAMADA,S. . 559 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27255.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 359 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 125 22.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 9 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 59 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 62 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 1 0 1 0 2 0 0 1 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 2 2 2 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 PARALLEL BRIDGES PER LADDER . 3 2 7 1 4 2 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 5 3 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 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 2 A A 0 0 123 0, 0.0 2,-0.3 0, 0.0 21,-0.1 0.000 360.0 360.0 360.0-128.0 -33.4 -14.0 22.7 2 3 A Q + 0 0 154 19,-0.2 21,-1.9 23,-0.0 2,-0.3 -0.928 360.0 141.0-140.7 161.5 -35.8 -11.1 21.8 3 4 A G - 0 0 33 -2,-0.3 21,-0.2 19,-0.2 2,-0.1 -0.969 35.3 -60.9-175.8-167.8 -36.8 -9.3 18.6 4 5 A T - 0 0 71 -2,-0.3 21,-2.7 241,-0.1 2,-0.5 -0.252 40.6-105.7 -96.3-178.2 -39.2 -7.5 16.2 5 6 A L E -a 25 0A 82 19,-0.2 2,-0.5 -2,-0.1 21,-0.2 -0.924 24.4-170.0-120.4 114.0 -42.4 -8.3 14.1 6 7 A I E -a 26 0A 11 19,-2.9 21,-3.2 -2,-0.5 2,-0.6 -0.847 5.6-161.2-102.9 127.2 -42.5 -8.9 10.3 7 8 A R E -a 27 0A 146 -2,-0.5 2,-0.2 19,-0.2 21,-0.1 -0.925 9.6-166.9-110.8 117.2 -45.8 -9.1 8.5 8 9 A V - 0 0 0 19,-1.5 84,-0.1 -2,-0.6 3,-0.1 -0.671 4.0-171.7-101.5 157.5 -45.8 -10.8 5.1 9 10 A T - 0 0 35 3,-0.6 82,-0.5 82,-0.4 22,-0.1 -1.000 36.4-133.4-149.0 146.1 -48.6 -10.7 2.5 10 11 A P S S+ 0 0 38 0, 0.0 79,-0.2 0, 0.0 -1,-0.1 0.791 103.4 76.4 -65.8 -23.4 -49.4 -12.4 -0.9 11 12 A E S S- 0 0 165 1,-0.1 78,-0.1 -3,-0.1 20,-0.0 0.964 114.2 -25.7 -46.6 -77.5 -50.2 -8.8 -1.9 12 13 A Q S S- 0 0 127 79,-0.1 -3,-0.6 78,-0.0 79,-0.3 -0.676 75.9 -84.6-131.0-176.3 -46.7 -7.6 -2.3 13 14 A P - 0 0 51 0, 0.0 2,-0.3 0, 0.0 79,-0.2 -0.645 34.9-139.4 -95.6 157.4 -43.2 -8.4 -1.0 14 15 A T E -d 92 0B 33 77,-1.6 79,-3.8 -2,-0.2 2,-0.3 -0.839 7.0-156.6-115.3 150.9 -41.6 -7.2 2.2 15 16 A H E +d 93 0B 120 -2,-0.3 2,-0.3 77,-0.2 79,-0.2 -0.883 21.2 165.5-119.8 152.8 -38.1 -6.1 3.0 16 17 A A E -d 94 0B 21 77,-1.8 79,-2.0 -2,-0.3 2,-0.4 -0.951 33.7-124.5-169.8 148.5 -36.5 -6.1 6.5 17 18 A V E -d 95 0B 21 -2,-0.3 2,-0.4 77,-0.2 79,-0.2 -0.764 23.1-168.4 -95.9 139.5 -33.4 -5.9 8.4 18 19 A C E -d 96 0B 1 77,-2.7 79,-2.1 -2,-0.4 2,-0.4 -0.997 13.2-143.2-130.9 125.1 -32.4 -8.7 10.8 19 20 A V E > -d 97 0B 7 -2,-0.4 3,-1.6 77,-0.2 79,-0.2 -0.723 30.0-106.3 -87.5 134.9 -29.6 -8.2 13.3 20 21 A L T 3 S+ 0 0 42 77,-2.5 79,-0.3 -2,-0.4 3,-0.1 -0.433 104.9 24.5 -64.8 128.8 -27.5 -11.3 13.9 21 22 A G T 3 S+ 0 0 68 1,-0.4 -1,-0.2 43,-0.4 -19,-0.2 -0.008 97.5 108.7 108.4 -26.7 -28.3 -12.8 17.3 22 23 A T < - 0 0 22 -3,-1.6 2,-0.8 -21,-0.1 -1,-0.4 -0.488 69.9-122.9 -85.3 154.3 -31.8 -11.4 17.6 23 24 A L - 0 0 42 -21,-1.9 2,-0.5 -2,-0.2 40,-0.2 -0.857 26.4-157.0 -98.6 108.6 -35.0 -13.5 17.4 24 25 A T E - B 0 62A 2 38,-2.0 38,-2.3 -2,-0.8 2,-0.3 -0.771 5.5-146.6 -93.1 124.3 -37.2 -12.1 14.6 25 26 A Q E -aB 5 61A 100 -21,-2.7 -19,-2.9 -2,-0.5 2,-0.4 -0.695 9.7-155.5 -92.1 140.2 -40.9 -12.9 14.8 26 27 A L E -aB 6 60A 15 34,-2.0 2,-0.7 -2,-0.3 34,-0.6 -0.944 6.9-151.2-119.7 133.3 -43.0 -13.5 11.7 27 28 A D E +a 7 0A 45 -21,-3.2 -19,-1.5 -2,-0.4 32,-0.1 -0.900 24.7 162.6-105.7 112.1 -46.8 -13.0 11.3 28 29 A I + 0 0 6 -2,-0.7 -1,-0.1 30,-0.2 26,-0.0 0.851 61.8 56.5 -98.3 -41.0 -48.2 -15.3 8.6 29 30 A C S S+ 0 0 30 1,-0.2 2,-3.2 26,-0.1 -1,-0.1 0.792 82.1 85.7 -67.0 -30.8 -52.0 -15.6 8.9 30 31 A S 0 0 73 26,-0.1 -1,-0.2 -21,-0.0 -3,-0.1 -0.260 360.0 360.0 -70.5 60.2 -52.8 -11.9 8.7 31 32 A S 0 0 95 -2,-3.2 -22,-0.1 -22,-0.1 -2,-0.1 0.191 360.0 360.0 -87.1 360.0 -52.9 -12.0 4.9 32 ! 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 33 39 A S 0 0 66 0, 0.0 48,-2.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 146.5 -52.5 -24.4 4.8 34 40 A F E -E 80 0B 0 18,-3.0 2,-0.3 46,-0.2 46,-0.2 -0.867 360.0-146.7-137.4 170.5 -49.0 -22.8 4.1 35 41 A S E -E 79 0B 26 44,-1.3 44,-2.5 -2,-0.3 2,-0.5 -0.991 8.5-144.9-139.6 145.7 -45.3 -23.7 3.5 36 42 A I E +E 78 0B 46 -2,-0.3 2,-0.4 42,-0.2 42,-0.2 -0.952 22.3 166.5-118.3 120.6 -42.0 -22.0 4.3 37 43 A N E +E 77 0B 105 40,-2.0 40,-2.8 -2,-0.5 2,-0.3 -0.998 14.4 168.4-131.8 126.3 -39.1 -22.1 2.0 38 44 A A E -E 76 0B 33 -2,-0.4 38,-0.2 38,-0.2 6,-0.1 -0.949 37.5 -75.8-142.9 163.6 -36.1 -19.8 2.5 39 45 A S > - 0 0 16 36,-2.2 3,-1.8 -2,-0.3 35,-0.1 -0.050 49.0-109.2 -50.1 149.7 -32.5 -19.0 1.5 40 46 A P T 3 S+ 0 0 131 0, 0.0 -1,-0.1 0, 0.0 34,-0.1 0.881 117.1 55.8 -50.7 -44.3 -29.7 -21.2 2.9 41 47 A G T 3 S+ 0 0 19 24,-0.1 24,-1.1 2,-0.1 2,-0.6 0.618 94.2 81.3 -67.1 -13.1 -28.4 -18.4 5.2 42 48 A V B < -G 64 0C 10 -3,-1.8 2,-0.8 22,-0.2 22,-0.2 -0.859 66.0-156.3-103.1 118.8 -31.8 -18.1 6.9 43 49 A V - 0 0 85 20,-1.4 2,-0.7 -2,-0.6 20,-0.4 -0.821 13.1-174.8 -93.1 110.6 -32.8 -20.5 9.6 44 50 A V + 0 0 24 -2,-0.8 2,-0.4 18,-0.2 18,-0.2 -0.915 7.4 171.4-111.5 107.8 -36.6 -20.7 9.8 45 51 A D E -C 61 0A 100 16,-1.5 16,-1.7 -2,-0.7 2,-0.3 -0.958 5.9-177.0-118.1 133.7 -37.9 -22.8 12.6 46 52 A I E -C 60 0A 8 -2,-0.4 2,-0.4 14,-0.2 14,-0.2 -0.916 9.3-156.4-127.1 153.6 -41.6 -23.0 13.6 47 53 A A E C 59 0A 59 12,-1.5 12,-1.8 -2,-0.3 4,-0.1 -0.996 360.0 360.0-136.9 130.7 -43.4 -24.8 16.4 48 54 A H 0 0 174 -2,-0.4 10,-0.2 10,-0.2 9,-0.0 0.116 360.0 360.0 -26.3 360.0 -47.1 -25.8 16.6 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 66 A S 0 0 81 0, 0.0 2,-0.3 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 134.6 -41.9 -26.4 10.7 51 67 A T - 0 0 17 -4,-0.1 -15,-0.1 1,-0.1 -17,-0.0 -0.976 360.0-140.2-157.0 161.1 -45.7 -27.1 10.1 52 68 A W + 0 0 132 -2,-0.3 -18,-3.0 -17,-0.1 2,-0.2 0.719 61.9 111.9-100.2 -25.8 -48.3 -26.6 7.5 53 69 A P - 0 0 73 0, 0.0 2,-2.7 0, 0.0 5,-0.1 -0.329 65.2-136.4 -56.6 118.7 -51.5 -25.6 9.4 54 70 A L + 0 0 60 -2,-0.2 -2,-0.0 3,-0.0 3,-0.0 -0.332 54.6 142.5 -75.2 60.6 -52.5 -22.0 8.8 55 71 A D > - 0 0 84 -2,-2.7 3,-2.6 1,-0.1 -27,-0.1 -0.915 54.7-139.9-109.0 125.1 -53.2 -21.4 12.5 56 72 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -28,-0.1 0.745 101.4 69.8 -52.2 -25.9 -52.3 -18.0 14.2 57 73 A G T 3 S+ 0 0 42 2,-0.1 2,-0.3 -3,-0.0 -3,-0.0 0.498 79.1 105.2 -71.9 -1.8 -51.2 -20.0 17.2 58 74 A V < - 0 0 16 -3,-2.6 2,-0.5 -10,-0.2 -30,-0.2 -0.606 66.4-140.8 -81.9 139.5 -48.3 -21.2 15.1 59 75 A E E - C 0 47A 101 -12,-1.8 -12,-1.5 -2,-0.3 2,-0.5 -0.900 18.3-177.1-108.6 122.2 -44.8 -19.7 15.8 60 76 A V E -BC 26 46A 6 -34,-0.6 -34,-2.0 -2,-0.5 2,-0.4 -0.962 4.8-177.1-120.0 128.0 -42.4 -18.8 13.0 61 77 A T E -BC 25 45A 35 -16,-1.7 -16,-1.5 -2,-0.5 2,-0.3 -0.976 9.1-164.0-130.2 135.7 -38.9 -17.4 13.7 62 78 A L E +B 24 0A 1 -38,-2.3 -38,-2.0 -2,-0.4 2,-0.2 -0.793 8.8 175.0-110.7 155.5 -36.1 -16.2 11.4 63 79 A T - 0 0 44 -20,-0.4 -20,-1.4 -2,-0.3 -43,-0.1 -0.768 28.0-129.0-162.1 109.5 -32.5 -15.6 12.4 64 80 A M B -G 42 0C 15 -2,-0.2 -43,-0.4 -22,-0.2 -22,-0.2 -0.206 8.7-155.5 -58.7 151.0 -29.9 -14.7 9.8 65 81 A K S S+ 0 0 140 -24,-1.1 2,-0.3 1,-0.3 -1,-0.1 0.871 73.1 11.4 -92.6 -53.4 -26.7 -16.8 9.8 66 82 A V S S- 0 0 94 -25,-0.2 -1,-0.3 -46,-0.0 2,-0.2 -0.915 88.4 -86.5-132.2 155.1 -24.4 -14.2 8.3 67 83 A A - 0 0 24 -2,-0.3 30,-0.2 -3,-0.1 87,-0.1 -0.372 52.7-116.3 -57.2 117.1 -24.2 -10.5 7.5 68 84 A S - 0 0 6 28,-1.2 -1,-0.1 -2,-0.2 3,-0.1 -0.236 11.1-138.8 -54.4 142.7 -25.7 -10.1 4.0 69 85 A G S S+ 0 0 63 1,-0.1 87,-0.5 86,-0.1 2,-0.3 0.753 84.6 3.4 -75.4 -24.4 -23.2 -8.8 1.5 70 86 A S S > S- 0 0 60 85,-0.2 3,-1.2 86,-0.1 26,-0.2 -0.957 100.9 -64.0-153.0 166.2 -25.9 -6.5 0.0 71 87 A T T 3 S+ 0 0 77 -2,-0.3 24,-0.1 1,-0.2 23,-0.1 -0.273 117.2 9.3 -56.5 138.7 -29.5 -5.5 0.6 72 88 A G T 3 S+ 0 0 20 -56,-0.2 -1,-0.2 21,-0.1 23,-0.2 0.727 75.6 146.2 63.5 28.8 -31.9 -8.4 0.2 73 89 A D < + 0 0 46 -3,-1.2 2,-0.4 21,-0.2 22,-0.1 0.853 66.5 47.2 -61.0 -40.1 -29.4 -11.3 -0.1 74 90 A Q E S- F 0 94B 32 20,-1.3 20,-3.3 -35,-0.1 2,-0.3 -0.844 70.5-175.6-107.2 142.6 -31.7 -13.7 1.6 75 91 A K E - F 0 93B 108 -2,-0.4 -36,-2.2 18,-0.3 2,-0.4 -0.836 13.2-155.6-130.0 168.2 -35.4 -14.2 0.9 76 92 A V E -EF 38 92B 2 16,-1.6 16,-0.9 -2,-0.3 2,-0.5 -0.970 9.1-160.6-145.4 126.8 -38.2 -16.2 2.3 77 93 A Q E -EF 37 91B 76 -40,-2.8 -40,-2.0 -2,-0.4 2,-0.6 -0.944 5.1-153.1-115.2 136.7 -41.2 -17.2 0.4 78 94 A I E -EF 36 90B 0 12,-3.0 12,-3.0 -2,-0.5 2,-0.7 -0.938 10.6-147.3-108.6 120.4 -44.5 -18.3 2.0 79 95 A S E -EF 35 89B 27 -44,-2.5 -44,-1.3 -2,-0.6 2,-0.6 -0.806 10.0-160.2 -93.9 114.0 -46.6 -20.6 -0.1 80 96 A Y E +EF 34 88B 30 8,-2.9 8,-2.4 -2,-0.7 2,-0.3 -0.826 33.6 125.5 -93.4 121.7 -50.3 -20.1 0.5 81 97 A Y E + 0 0 76 -48,-2.6 -2,-0.0 -2,-0.6 8,-0.0 -0.919 14.5 135.6-159.1-176.0 -52.5 -23.0 -0.5 82 98 A G E > + F 0 85B 21 3,-0.6 3,-1.4 -2,-0.3 2,-1.1 -0.990 56.5 28.6 164.1-155.3 -55.1 -25.6 0.4 83 99 A P T 3 S- 0 0 131 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.102 125.7 -40.4 -40.2 76.0 -58.4 -27.4 -0.6 84 100 A K T 3 S+ 0 0 190 -2,-1.1 -3,-0.0 1,-0.2 0, 0.0 0.873 101.4 126.8 66.0 47.0 -58.0 -27.3 -4.4 85 101 A T E < - 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