==== 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 REPLICATION 29-JUN-06 2HII . COMPND 2 MOLECULE: PCNA1 (SSO0397); . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS; . AUTHOR J.M.PASCAL,O.V.TSODIKOV,T.ELLENBERGER . 1470 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 66188.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1141 77.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 0.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 617 42.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 22 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 4 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 . 159 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 120 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 208 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.4 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 4 2 2 4 0 2 4 0 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 8 4 7 24 20 27 16 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 . 0 1 0 0 0 0 0 4 6 2 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 1 A X 0 0 178 0, 0.0 92,-0.1 0, 0.0 61,-0.1 0.000 360.0 360.0 360.0 -11.6 14.2 14.6 -47.8 2 2 A F + 0 0 3 90,-0.1 91,-2.4 1,-0.1 2,-0.4 0.327 360.0 167.4 -51.0 126.5 14.1 17.9 -45.7 3 3 A K E -AB 61 92A 47 58,-2.0 58,-2.7 89,-0.2 2,-0.4 -0.995 15.8-178.6-140.1 132.7 16.0 18.0 -42.4 4 4 A I E -AB 60 91A 0 87,-1.9 87,-2.6 -2,-0.4 2,-0.4 -0.998 1.8-178.2-129.4 126.4 17.1 20.7 -39.9 5 5 A V E -AB 59 90A 15 54,-2.1 53,-2.4 -2,-0.4 54,-0.9 -0.962 4.5-173.7-125.9 115.5 19.0 20.1 -36.7 6 6 A Y E - B 0 89A 0 83,-2.8 83,-2.9 -2,-0.4 51,-0.1 -0.904 26.9-131.5-108.6 132.9 19.8 23.2 -34.5 7 7 A P S S+ 0 0 50 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.670 90.5 40.4 -60.8 -22.0 22.1 22.6 -31.5 8 8 A N > - 0 0 21 80,-0.1 4,-2.2 1,-0.1 80,-0.2 -0.908 56.9-167.3-138.2 109.9 19.8 24.4 -28.9 9 9 A A H > S+ 0 0 8 78,-2.9 4,-1.9 -2,-0.4 5,-0.1 0.855 91.5 51.7 -60.6 -42.7 16.0 24.2 -28.7 10 10 A K H > S+ 0 0 81 77,-0.3 4,-1.6 75,-0.3 3,-0.4 0.977 111.3 47.3 -61.2 -51.6 15.5 27.1 -26.3 11 11 A D H > S+ 0 0 23 1,-0.2 4,-1.2 2,-0.2 3,-0.3 0.891 108.5 56.6 -56.0 -40.4 17.5 29.4 -28.5 12 12 A F H X S+ 0 0 2 -4,-2.2 4,-1.7 1,-0.2 3,-0.3 0.893 108.3 46.4 -58.6 -41.0 15.6 28.3 -31.6 13 13 A F H X S+ 0 0 16 -4,-1.9 4,-4.0 -3,-0.4 5,-0.3 0.730 97.2 68.8 -80.6 -18.1 12.3 29.2 -30.0 14 14 A S H X S+ 0 0 21 -4,-1.6 4,-1.6 -3,-0.3 -1,-0.2 0.912 106.0 45.4 -58.2 -40.2 13.6 32.6 -28.9 15 15 A F H X S+ 0 0 0 -4,-1.2 4,-1.7 -3,-0.3 5,-0.3 0.972 114.7 46.1 -59.8 -58.0 13.6 33.2 -32.7 16 16 A I H X S+ 0 0 4 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.879 110.5 52.6 -58.1 -42.3 10.1 31.7 -33.2 17 17 A N H < S+ 0 0 71 -4,-4.0 -1,-0.2 1,-0.2 -2,-0.2 0.918 107.8 53.7 -59.7 -40.9 8.6 33.6 -30.2 18 18 A S H >< S+ 0 0 13 -4,-1.6 3,-0.6 -5,-0.3 -1,-0.2 0.836 113.2 39.2 -66.5 -37.6 9.9 36.9 -31.6 19 19 A I H 3< S+ 0 0 4 -4,-1.7 3,-0.3 1,-0.2 4,-0.2 0.737 116.3 52.1 -86.8 -18.8 8.3 36.5 -35.0 20 20 A T T 3< S+ 0 0 3 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.124 73.6 119.7-100.9 21.0 5.1 35.0 -33.7 21 21 A N S < S+ 0 0 56 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.1 0.809 89.6 15.3 -50.1 -42.1 4.6 37.8 -31.2 22 22 A V S S+ 0 0 107 -3,-0.3 2,-0.4 1,-0.3 -1,-0.2 0.601 132.8 35.2-115.9 -20.2 1.2 39.0 -32.6 23 23 A T - 0 0 56 -4,-0.2 -1,-0.3 2,-0.1 0, 0.0 -1.000 62.0-147.2-135.4 140.0 0.2 36.0 -34.7 24 24 A D S S+ 0 0 66 -2,-0.4 48,-2.7 -3,-0.1 2,-0.3 0.590 74.6 97.7 -80.1 -10.0 0.8 32.3 -34.1 25 25 A S E -J 71 0B 49 46,-0.2 2,-0.3 47,-0.1 46,-0.2 -0.619 54.9-178.2 -80.9 137.6 1.0 31.6 -37.9 26 26 A I E -J 70 0B 3 44,-2.6 44,-2.7 -2,-0.3 2,-0.6 -0.993 25.1-150.9-143.3 142.0 4.5 31.5 -39.3 27 27 A I E -J 69 0B 43 -2,-0.3 11,-0.6 11,-0.3 2,-0.3 -0.942 18.5-168.8-111.9 107.3 6.2 31.1 -42.7 28 28 A L E -JK 68 37B 4 40,-2.5 40,-2.4 -2,-0.6 2,-0.5 -0.759 8.2-150.0 -91.6 143.6 9.7 29.4 -42.5 29 29 A N E -JK 67 36B 0 7,-1.6 7,-1.6 -2,-0.3 2,-0.6 -0.962 7.0-164.6-119.0 124.1 12.0 29.4 -45.5 30 30 A F E +JK 66 35B 1 36,-3.4 36,-2.4 -2,-0.5 2,-0.2 -0.931 28.4 152.1-107.2 118.3 14.5 26.7 -46.3 31 31 A T E > - K 0 34B 16 3,-2.6 3,-0.9 -2,-0.6 33,-0.0 -0.734 60.2 -79.9-134.4-178.3 17.0 27.7 -48.9 32 32 A E T 3 S+ 0 0 138 1,-0.2 22,-0.1 -2,-0.2 3,-0.1 0.845 127.5 43.8 -51.5 -39.6 20.6 27.2 -50.2 33 33 A D T 3 S- 0 0 107 1,-0.2 21,-1.7 20,-0.1 2,-0.4 0.564 120.4 -96.8 -91.1 -9.5 22.0 29.5 -47.5 34 34 A G E < -KL 31 53B 2 -3,-0.9 -3,-2.6 19,-0.3 2,-0.4 -0.982 60.7 -24.2 133.8-145.0 20.0 28.3 -44.6 35 35 A I E +KL 30 52B 3 17,-2.6 17,-3.1 -2,-0.4 2,-0.3 -0.870 50.2 166.2-115.4 140.3 16.8 29.2 -42.8 36 36 A F E -KL 29 51B 14 -7,-1.6 -7,-1.6 -2,-0.4 2,-0.3 -0.978 9.0-175.1-152.0 144.8 15.0 32.6 -42.5 37 37 A S E -KL 28 50B 0 13,-1.7 13,-2.6 -2,-0.3 2,-0.3 -0.960 7.9-163.3-136.9 155.5 11.7 33.8 -41.4 38 38 A R E - L 0 49B 95 -11,-0.6 2,-0.3 -2,-0.3 -11,-0.3 -0.980 8.1-176.0-143.6 145.4 10.0 37.2 -41.5 39 39 A H E - L 0 48B 45 9,-2.2 9,-2.9 -2,-0.3 2,-0.4 -0.975 2.8-171.4-145.5 136.1 7.1 39.2 -40.0 40 40 A L E - L 0 47B 61 -2,-0.3 7,-0.2 7,-0.2 2,-0.1 -0.943 28.9-118.3-117.4 144.6 5.7 42.6 -40.5 41 41 A T > - 0 0 16 5,-1.6 3,-2.3 -2,-0.4 -2,-0.0 -0.426 33.2-108.9 -73.5 158.4 3.0 44.2 -38.3 42 42 A E T 3 S+ 0 0 168 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.784 123.0 53.0 -62.6 -25.4 -0.2 45.1 -40.1 43 43 A D T 3 S- 0 0 98 3,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.314 110.8-127.3 -89.6 7.4 0.7 48.8 -39.8 44 44 A K S < S+ 0 0 128 -3,-2.3 -2,-0.1 2,-0.1 202,-0.1 0.386 78.1 110.0 71.8 0.2 4.1 48.0 -41.4 45 45 A V + 0 0 23 1,-0.2 201,-2.4 200,-0.1 2,-0.6 0.770 68.9 49.4 -88.0 -25.6 6.2 49.7 -38.6 46 46 A L E - M 0 245B 12 199,-0.2 -5,-1.6 197,-0.0 2,-0.5 -0.944 62.4-179.4-117.6 118.5 7.8 46.7 -36.9 47 47 A X E -LM 40 244B 25 197,-2.5 197,-2.7 -2,-0.6 2,-0.5 -0.960 6.8-165.4-113.5 132.9 9.5 44.0 -39.0 48 48 A A E -LM 39 243B 5 -9,-2.9 -9,-2.2 -2,-0.5 2,-0.4 -0.974 7.5-175.7-119.0 126.1 11.1 41.0 -37.3 49 49 A I E -LM 38 242B 2 193,-3.5 193,-3.2 -2,-0.5 2,-0.4 -0.981 10.7-163.1-124.5 129.6 13.6 38.8 -39.2 50 50 A X E -LM 37 241B 0 -13,-2.6 -13,-1.7 -2,-0.4 2,-0.4 -0.897 11.0-176.6-105.3 140.6 15.3 35.5 -38.1 51 51 A R E +LM 36 240B 72 189,-2.6 189,-2.3 -2,-0.4 -15,-0.2 -0.977 8.9 178.3-140.1 123.1 18.3 34.3 -40.1 52 52 A I E -L 35 0B 2 -17,-3.1 -17,-2.6 -2,-0.4 5,-0.1 -0.939 21.3-144.2-124.8 105.2 20.2 31.0 -39.5 53 53 A P E >> -L 34 0B 47 0, 0.0 3,-1.5 0, 0.0 4,-0.5 -0.352 21.7-121.0 -65.0 150.4 23.1 30.3 -41.8 54 54 A K G >4 S+ 0 0 115 -21,-1.7 3,-1.4 1,-0.3 -20,-0.1 0.843 107.2 69.2 -64.9 -34.6 23.5 26.6 -42.7 55 55 A D G 34 S+ 0 0 137 1,-0.3 -1,-0.3 -22,-0.2 -21,-0.1 0.625 98.0 54.8 -57.5 -14.0 27.1 26.4 -41.3 56 56 A V G <4 S+ 0 0 35 -3,-1.5 -1,-0.3 3,-0.0 -2,-0.2 0.726 91.3 87.6 -93.3 -26.0 25.5 26.8 -37.9 57 57 A L << - 0 0 16 -3,-1.4 -51,-0.2 -4,-0.5 3,-0.2 -0.507 68.9-146.9 -74.3 143.5 23.1 23.9 -38.3 58 58 A S S S+ 0 0 79 -53,-2.4 2,-0.4 1,-0.3 -52,-0.1 0.884 89.1 16.9 -75.9 -43.5 24.4 20.4 -37.3 59 59 A E E S+A 5 0A 100 -54,-0.9 -54,-2.1 2,-0.0 2,-0.4 -0.990 72.1 172.4-134.4 124.4 22.4 18.7 -39.9 60 60 A Y E +A 4 0A 54 -2,-0.4 2,-0.4 -56,-0.2 -56,-0.2 -0.980 2.9 164.0-137.2 125.3 20.8 20.4 -43.0 61 61 A S E +A 3 0A 40 -58,-2.7 -58,-2.0 -2,-0.4 2,-0.3 -0.989 0.8 162.1-138.8 130.4 19.1 18.8 -46.0 62 62 A I - 0 0 40 -2,-0.4 -2,-0.0 -60,-0.2 -31,-0.0 -0.984 25.7-159.3-142.7 139.6 16.8 20.3 -48.7 63 63 A D S S- 0 0 112 1,-0.4 -1,-0.1 -2,-0.3 3,-0.0 0.904 86.6 -8.6 -75.7 -44.1 15.8 18.9 -52.1 64 64 A S S S- 0 0 76 -34,-0.1 -1,-0.4 -33,-0.0 -34,-0.1 -0.978 92.0 -80.7-151.4 143.8 14.8 22.3 -53.4 65 65 A P + 0 0 58 0, 0.0 2,-0.3 0, 0.0 57,-0.3 -0.272 64.7 169.3 -46.5 127.1 14.4 25.7 -51.7 66 66 A T E -J 30 0B 9 -36,-2.4 -36,-3.4 55,-0.2 2,-0.3 -0.968 30.4-136.8-143.6 160.2 11.0 25.7 -50.1 67 67 A S E -JN 29 120B 12 53,-1.4 53,-2.1 -2,-0.3 2,-0.4 -0.832 10.9-158.3-112.6 156.9 8.7 27.5 -47.7 68 68 A V E -JN 28 119B 2 -40,-2.4 -40,-2.5 -2,-0.3 2,-0.5 -0.984 1.7-160.9-135.8 123.3 6.4 26.1 -44.9 69 69 A K E +JN 27 118B 112 49,-2.1 49,-1.9 -2,-0.4 2,-0.3 -0.925 27.5 159.8-101.6 123.6 3.4 27.9 -43.4 70 70 A L E -JN 26 117B 11 -44,-2.7 -44,-2.6 -2,-0.5 2,-0.6 -0.984 43.6-122.4-143.7 152.1 2.4 26.5 -40.0 71 71 A D E -J 25 0B 90 45,-0.5 4,-0.3 -2,-0.3 -46,-0.2 -0.869 27.0-177.9 -92.0 124.6 0.4 27.4 -36.9 72 72 A V > + 0 0 4 -48,-2.7 4,-2.9 -2,-0.6 5,-0.2 0.312 48.0 108.0-113.4 9.2 2.8 27.2 -34.0 73 73 A S H > S+ 0 0 27 2,-0.2 4,-2.3 1,-0.2 -1,-0.1 0.943 84.9 42.7 -49.6 -60.9 0.5 28.1 -31.1 74 74 A S H > S+ 0 0 29 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.953 113.4 50.0 -50.4 -61.1 0.5 24.5 -29.7 75 75 A V H > S+ 0 0 0 -4,-0.3 4,-2.2 1,-0.3 5,-0.2 0.901 110.4 52.3 -48.1 -46.3 4.2 23.8 -30.2 76 76 A K H X S+ 0 0 48 -4,-2.9 4,-1.3 1,-0.2 -1,-0.3 0.929 109.2 50.4 -56.8 -46.6 4.9 27.1 -28.4 77 77 A K H < S+ 0 0 114 -4,-2.3 4,-0.4 -5,-0.2 3,-0.2 0.917 113.2 43.4 -56.0 -50.2 2.7 26.0 -25.5 78 78 A I H >< S+ 0 0 2 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.825 108.2 55.5 -77.0 -30.5 4.2 22.6 -25.0 79 79 A L H >< S+ 0 0 14 -4,-2.2 3,-1.1 -5,-0.3 -1,-0.2 0.807 98.5 62.4 -71.5 -28.0 7.9 23.5 -25.3 80 80 A S T 3< S+ 0 0 89 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.720 105.1 49.6 -65.6 -21.0 7.5 26.1 -22.5 81 81 A K T < S+ 0 0 101 -3,-0.7 2,-1.5 -4,-0.4 558,-0.3 0.463 85.2 99.1 -94.0 -6.7 6.6 23.1 -20.4 82 82 A A < - 0 0 2 -3,-1.1 2,-1.1 -4,-0.2 -1,-0.1 -0.694 69.3-154.0 -80.8 88.3 9.7 21.3 -21.6 83 83 A S + 0 0 84 -2,-1.5 2,-0.3 548,-0.1 552,-0.1 -0.558 40.2 150.5 -64.8 98.3 11.9 22.0 -18.6 84 84 A S - 0 0 21 -2,-1.1 20,-0.1 1,-0.1 -2,-0.1 -0.994 37.6-177.2-147.7 147.5 15.1 21.8 -20.6 85 85 A K S S+ 0 0 162 -2,-0.3 -75,-0.3 -75,-0.0 -1,-0.1 0.849 82.7 4.2-103.7 -73.2 18.6 23.2 -20.6 86 86 A K S S+ 0 0 184 -77,-0.1 18,-0.0 -78,-0.1 -2,-0.0 0.306 82.3 148.7-110.7 0.3 20.8 22.1 -23.4 87 87 A A - 0 0 12 -79,-0.1 -78,-2.9 1,-0.1 -77,-0.3 0.027 40.2-131.2 -48.1 141.4 18.5 20.0 -25.6 88 88 A T - 0 0 45 15,-0.5 15,-0.8 -80,-0.2 2,-0.4 -0.420 17.8-135.5 -88.4 165.6 19.0 19.9 -29.4 89 89 A I E -BC 6 102A 0 -83,-2.9 -83,-2.8 13,-0.1 2,-0.4 -0.989 16.5-173.6-132.9 135.9 16.2 20.4 -32.0 90 90 A E E -BC 5 101A 22 11,-1.6 11,-2.2 -2,-0.4 2,-0.4 -0.945 7.7-171.7-121.6 139.2 15.2 18.6 -35.2 91 91 A L E +BC 4 100A 3 -87,-2.6 -87,-1.9 -2,-0.4 2,-0.4 -0.946 14.9 178.0-126.9 110.1 12.6 19.5 -37.8 92 92 A T E -B 3 0A 21 7,-1.9 7,-0.4 -2,-0.4 -89,-0.2 -0.896 35.5-102.6-108.5 143.6 12.1 16.7 -40.4 93 93 A E - 0 0 69 -91,-2.4 2,-0.3 -2,-0.4 5,-0.2 -0.337 36.9-159.5 -59.2 138.5 9.6 16.8 -43.2 94 94 A T - 0 0 28 3,-4.2 23,-0.1 21,-0.1 5,-0.1 -0.865 32.0-112.4-117.2 156.3 6.5 14.8 -42.6 95 95 A D S S+ 0 0 177 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 0.850 124.1 32.5 -53.1 -31.7 4.1 13.5 -45.3 96 96 A S S S- 0 0 68 2,-0.1 21,-1.5 22,-0.0 -1,-0.2 0.636 134.8 -71.6-100.1 -23.2 1.5 15.9 -43.7 97 97 A G E S- D 0 116A 7 19,-0.2 -3,-4.2 -5,-0.1 19,-0.2 -0.717 83.7 -0.8 170.3-114.0 3.9 18.6 -42.6 98 98 A L E - D 0 115A 1 17,-3.1 17,-0.8 -5,-0.2 2,-0.3 -0.567 34.7-158.9-111.7 174.4 6.6 18.9 -39.9 99 99 A K E - D 0 114A 64 -7,-0.4 -7,-1.9 15,-0.2 2,-0.6 -0.839 11.5-168.2-156.6 94.2 8.0 16.8 -37.1 100 100 A I E -CD 91 113A 4 13,-3.1 13,-5.0 -2,-0.3 2,-0.4 -0.854 10.5-173.4 -89.2 125.0 9.7 18.7 -34.3 101 101 A I E -CD 90 112A 5 -11,-2.2 -11,-1.6 -2,-0.6 2,-0.3 -0.981 6.4-176.9-126.8 127.1 11.7 16.4 -32.0 102 102 A I E -CD 89 111A 4 9,-2.9 9,-1.9 -2,-0.4 2,-0.4 -0.894 8.5-157.6-116.0 144.3 13.4 17.4 -28.8 103 103 A R E - 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