==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA BINDING PROTEIN/DNA 03-DEC-01 1KIX . COMPND 2 MOLECULE: 5'-D(*T*TP*TP*TP*GP*GP*GP*G)-3'; . SOURCE 2 SYNTHETIC: YES; . AUTHOR O.B.PEERSEN,J.A.RUGGLES,S.C.SCHULTZ . 446 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22354.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 290 65.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 117 26.2 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 . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.1 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-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 . 48 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 51 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 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 1 0 1 0 0 1 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 1 4 2 5 2 4 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 . 1 1 0 0 1 1 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 36 A Y 0 0 145 0, 0.0 2,-0.4 0, 0.0 145,-0.0 0.000 360.0 360.0 360.0 119.9 101.1 162.9 116.2 2 37 A E - 0 0 171 145,-0.0 16,-0.5 17,-0.0 2,-0.3 -0.908 360.0-151.3-110.4 134.3 97.9 162.7 118.2 3 38 A Y - 0 0 34 -2,-0.4 2,-0.3 14,-0.1 16,-0.2 -0.809 6.1-162.2-108.3 145.4 94.6 161.6 116.7 4 39 A V - 0 0 38 14,-2.5 16,-0.3 -2,-0.3 2,-0.2 -0.914 24.8-111.6-122.9 149.5 91.0 162.6 117.6 5 40 A E >> - 0 0 80 -2,-0.3 3,-1.8 14,-0.1 4,-0.8 -0.527 35.0-109.0 -79.7 147.9 87.7 160.9 116.7 6 41 A L G >4 S+ 0 0 0 14,-0.3 3,-0.7 1,-0.3 -1,-0.1 0.805 115.7 47.0 -43.5 -47.4 85.4 162.8 114.4 7 42 A A G 34 S+ 0 0 28 1,-0.2 -1,-0.3 56,-0.0 55,-0.0 0.634 115.6 47.3 -76.0 -12.2 82.7 163.7 117.0 8 43 A K G <4 S+ 0 0 143 -3,-1.8 -1,-0.2 2,-0.1 -2,-0.2 0.442 78.0 122.6-107.2 -2.3 85.3 164.8 119.5 9 44 A A S << S- 0 0 6 -4,-0.8 2,-0.1 -3,-0.7 10,-0.0 -0.360 72.5-105.3 -61.3 139.3 87.5 167.0 117.2 10 45 A S - 0 0 68 1,-0.1 2,-1.6 5,-0.1 82,-0.2 -0.427 28.6-116.5 -68.0 138.6 87.6 170.6 118.5 11 46 A L S S+ 0 0 97 -2,-0.1 2,-0.3 -3,-0.1 -1,-0.1 -0.595 75.3 96.2 -80.9 89.7 85.5 173.1 116.6 12 47 A T - 0 0 45 -2,-1.6 80,-1.9 80,-0.2 -2,-0.0 -0.977 61.3-147.9-167.0 158.4 88.3 175.4 115.3 13 48 A S S S+ 0 0 88 -2,-0.3 78,-0.1 78,-0.2 80,-0.1 0.023 91.2 75.5-119.1 21.7 90.5 176.2 112.3 14 49 A A S S+ 0 0 76 1,-0.2 -1,-0.0 2,-0.0 77,-0.0 0.824 88.7 49.2 -99.4 -48.6 93.3 177.4 114.5 15 50 A Q S S- 0 0 135 -5,-0.1 -1,-0.2 1,-0.0 -3,-0.1 -0.866 88.3-122.5-101.4 123.9 94.8 174.2 115.9 16 51 A P - 0 0 39 0, 0.0 2,-0.3 0, 0.0 75,-0.2 -0.395 30.4-162.8 -64.2 131.4 95.6 171.5 113.4 17 52 A Q E -A 90 0A 24 73,-2.4 73,-3.4 -2,-0.1 2,-0.3 -0.801 5.8-155.0-116.9 158.7 93.9 168.2 114.1 18 53 A H E + 0 0 24 -16,-0.5 -14,-2.5 -2,-0.3 2,-0.3 -0.966 18.7 161.3-132.8 148.3 94.6 164.6 112.8 19 54 A F E -A 87 0A 0 68,-2.0 68,-2.5 -2,-0.3 2,-0.4 -0.989 34.3-131.5-161.2 166.8 92.3 161.6 112.4 20 55 A Y E +A 86 0A 10 -2,-0.3 2,-0.3 -16,-0.3 -14,-0.3 -0.973 39.2 166.6-120.7 136.0 91.6 158.2 110.9 21 56 A A E -A 85 0A 0 64,-2.5 64,-3.0 -2,-0.4 2,-0.5 -0.965 37.6-109.3-150.0 165.9 88.2 157.7 109.4 22 57 A V E -AB 84 44A 0 22,-2.9 22,-2.5 -2,-0.3 2,-0.3 -0.871 31.8-137.4-100.4 125.7 86.1 155.5 107.2 23 58 A V E + B 0 43A 2 60,-2.5 59,-2.6 -2,-0.5 20,-0.2 -0.639 28.0 169.2 -82.7 134.3 85.2 156.9 103.8 24 59 A I E S+ 0 0 1 18,-3.1 2,-0.3 1,-0.4 19,-0.2 0.415 70.2 13.8-122.0 -4.5 81.6 156.3 102.7 25 60 A D E + B 0 42A 1 17,-1.1 17,-2.2 55,-0.1 -1,-0.4 -0.940 60.5 170.3-167.1 146.5 81.6 158.6 99.6 26 61 A A E - B 0 41A 0 -2,-0.3 15,-0.2 15,-0.2 210,-0.2 -0.942 24.2-136.4-163.1 138.2 84.1 160.5 97.5 27 62 A T - 0 0 2 13,-2.1 51,-0.4 -2,-0.3 229,-0.2 -0.428 41.8 -98.2 -84.7 168.3 84.2 162.4 94.3 28 63 A F - 0 0 5 227,-2.3 12,-0.3 208,-0.1 2,-0.1 -0.508 55.2 -86.7 -80.1 157.4 87.0 161.8 91.8 29 64 A P + 0 0 2 0, 0.0 2,-0.3 0, 0.0 10,-0.2 -0.481 62.9 178.2 -65.8 140.3 89.7 164.5 92.2 30 65 A Y E -C 38 0A 51 8,-2.1 8,-2.9 -2,-0.1 2,-0.5 -0.994 36.4-109.3-149.3 154.6 88.8 167.5 90.0 31 66 A K E +C 37 0A 95 -2,-0.3 6,-0.2 6,-0.2 3,-0.1 -0.690 31.1 172.1 -80.3 121.2 89.8 171.0 88.9 32 67 A T E - 0 0 58 4,-2.4 2,-0.3 -2,-0.5 -1,-0.2 0.722 69.5 -9.8-100.1 -28.8 87.5 173.5 90.4 33 68 A N E > S-C 36 0A 105 3,-1.5 3,-1.5 0, 0.0 -1,-0.3 -0.871 99.2 -55.7-153.5-178.9 89.4 176.6 89.3 34 69 A Q T 3 S- 0 0 133 1,-0.3 3,-0.0 -2,-0.3 -2,-0.0 -0.507 124.6 -1.7 -70.3 136.5 92.8 177.4 87.9 35 70 A E T 3 S+ 0 0 118 -2,-0.2 2,-0.3 1,-0.1 -1,-0.3 0.749 114.8 104.3 54.3 28.2 95.6 176.0 90.0 36 71 A R E < +C 33 0A 70 -3,-1.5 -4,-2.4 34,-0.1 -3,-1.5 -0.819 45.4 179.3-145.1 104.7 93.0 174.7 92.5 37 72 A Y E -CD 31 69A 55 32,-3.2 32,-2.1 -2,-0.3 2,-0.3 -0.721 6.8-165.2-104.1 153.7 91.9 171.0 92.8 38 73 A I E -CD 30 68A 18 -8,-2.9 -8,-2.1 -2,-0.3 2,-0.4 -0.989 18.2-170.9-142.5 146.9 89.4 169.4 95.1 39 74 A C E - D 0 67A 0 28,-1.8 28,-2.7 -2,-0.3 2,-0.4 -0.966 17.7-158.4-134.7 116.8 88.2 166.0 96.5 40 75 A S E + D 0 66A 32 -2,-0.4 -13,-2.1 -12,-0.3 2,-0.3 -0.835 16.3 178.2-100.9 132.8 85.0 165.9 98.5 41 76 A L E -BD 26 65A 0 24,-3.2 24,-2.5 -2,-0.4 2,-0.5 -0.889 27.9-142.2-133.4 161.3 84.3 163.1 100.9 42 77 A K E -BD 25 64A 32 -17,-2.2 -18,-3.1 -2,-0.3 -17,-1.1 -0.990 31.3-174.6-120.0 128.1 81.8 161.8 103.5 43 78 A I E -BD 23 63A 0 20,-3.5 20,-2.9 -2,-0.5 2,-0.3 -0.930 13.2-176.7-130.5 154.1 83.4 160.1 106.5 44 79 A V E +B 22 0A 0 -22,-2.5 -22,-2.9 -2,-0.3 5,-0.2 -0.909 3.2 175.2-139.7 163.6 82.3 158.2 109.6 45 80 A D B > -I 48 0B 3 3,-2.3 3,-2.2 -2,-0.3 -24,-0.1 -0.945 54.6 -76.0-158.9 170.4 83.9 156.7 112.6 46 81 A P T 3 S+ 0 0 52 0, 0.0 3,-0.2 0, 0.0 -25,-0.0 0.729 130.9 47.5 -48.0 -23.1 82.8 154.9 115.9 47 82 A T T 3 S+ 0 0 43 1,-0.3 2,-0.3 0, 0.0 -42,-0.0 0.580 122.2 30.2 -94.9 -11.4 81.8 158.3 117.3 48 83 A L B < S+I 45 0B 14 -3,-2.2 -3,-2.3 2,-0.0 2,-0.3 -0.834 79.9 128.3-151.9 106.1 79.9 159.5 114.3 49 84 A Y - 0 0 47 -2,-0.3 2,-0.3 -5,-0.2 13,-0.2 -0.996 55.4 -93.2-158.9 159.9 78.0 157.2 111.9 50 85 A L + 0 0 0 -2,-0.3 117,-0.2 1,-0.1 7,-0.1 -0.577 31.2 179.5 -77.3 132.7 74.7 156.4 110.2 51 86 A K + 0 0 94 -2,-0.3 -1,-0.1 115,-0.1 2,-0.1 0.444 39.3 112.6-115.3 -1.6 72.5 153.9 112.0 52 87 A Q - 0 0 35 115,-0.2 114,-0.7 1,-0.1 115,-0.6 -0.417 49.0-157.9 -73.7 147.6 69.4 153.5 109.8 53 88 A Q S S- 0 0 79 1,-0.4 2,-0.3 112,-0.1 -1,-0.1 0.704 79.6 -3.2 -94.0 -24.4 68.7 150.2 108.1 54 89 A K S S+ 0 0 146 2,-0.1 -1,-0.4 112,-0.0 2,-0.1 -0.978 105.2 37.1-161.0 157.0 66.5 151.8 105.5 55 90 A G S S- 0 0 22 -2,-0.3 115,-1.7 -3,-0.1 116,-0.3 -0.379 95.7 -8.0 92.7-173.9 65.1 155.2 104.6 56 91 A A - 0 0 76 113,-0.2 2,-0.4 114,-0.2 -2,-0.1 -0.142 65.4-128.0 -59.1 148.6 66.7 158.7 104.9 57 92 A G - 0 0 14 -7,-0.1 2,-0.7 -6,-0.1 -1,-0.1 -0.790 20.3-114.7-101.4 142.9 70.0 159.2 106.6 58 93 A D > - 0 0 86 -2,-0.4 3,-2.7 1,-0.2 4,-0.1 -0.660 19.4-149.5 -77.0 113.1 70.5 161.8 109.4 59 94 A A G > S+ 0 0 44 -2,-0.7 3,-0.7 1,-0.3 -1,-0.2 0.691 95.2 61.5 -56.7 -19.9 73.0 164.3 108.0 60 95 A S G 3 S+ 0 0 68 1,-0.2 -1,-0.3 38,-0.1 -11,-0.1 0.452 89.8 72.1 -87.6 2.1 74.3 164.9 111.5 61 96 A D G < S+ 0 0 41 -3,-2.7 2,-0.3 -13,-0.1 -1,-0.2 0.302 101.4 35.6 -99.8 10.0 75.4 161.3 111.8 62 97 A Y S < S- 0 0 19 -3,-0.7 37,-0.4 -13,-0.2 2,-0.3 -0.953 73.9-136.5-150.7 162.0 78.3 161.5 109.4 63 98 A A E -D 43 0A 0 -20,-2.9 -20,-3.5 -2,-0.3 2,-0.3 -0.797 12.5-131.0-121.0 166.1 80.9 164.2 108.6 64 99 A T E -De 42 100A 18 35,-2.4 37,-2.7 -2,-0.3 2,-0.4 -0.741 11.1-157.5-114.3 164.6 82.3 165.6 105.4 65 100 A L E -De 41 101A 0 -24,-2.5 -24,-3.2 -2,-0.3 2,-0.5 -0.988 1.5-164.7-143.8 129.3 85.9 166.2 104.4 66 101 A V E -De 40 102A 14 35,-2.7 37,-1.6 -2,-0.4 2,-0.4 -0.965 8.8-161.9-119.0 115.5 87.2 168.6 101.7 67 102 A L E -De 39 103A 1 -28,-2.7 -28,-1.8 -2,-0.5 2,-0.4 -0.817 6.5-160.6 -98.2 134.5 90.7 168.1 100.5 68 103 A Y E +De 38 104A 57 35,-2.9 37,-3.3 -2,-0.4 38,-0.8 -0.941 18.5 155.9-118.1 140.2 92.4 170.9 98.6 69 104 A A E -D 37 0A 0 -32,-2.1 -32,-3.2 -2,-0.4 3,-0.1 -0.935 42.9-131.1-150.6 167.3 95.5 170.8 96.4 70 105 A K S S+ 0 0 100 -2,-0.3 2,-0.3 -34,-0.2 -35,-0.1 0.413 92.7 41.9-104.6 -0.2 97.0 172.8 93.5 71 106 A R S > S- 0 0 144 1,-0.1 3,-1.5 -34,-0.1 4,-0.2 -0.992 79.9-122.9-144.8 147.2 97.5 169.7 91.3 72 107 A F G > S+ 0 0 64 -2,-0.3 3,-2.1 1,-0.3 -1,-0.1 0.921 106.7 62.7 -52.1 -51.1 95.5 166.7 90.5 73 108 A E G 3 S+ 0 0 132 1,-0.3 -1,-0.3 -3,-0.1 0, 0.0 0.494 92.3 65.2 -57.9 -7.3 98.2 164.2 91.6 74 109 A D G < S+ 0 0 45 -3,-1.5 -1,-0.3 2,-0.1 -2,-0.2 0.534 89.6 78.4 -95.6 -4.5 98.1 165.4 95.2 75 110 A L S < S- 0 0 9 -3,-2.1 2,-0.2 -4,-0.2 61,-0.1 -0.704 84.0-108.1-103.0 155.2 94.5 164.3 95.9 76 111 A P - 0 0 0 0, 0.0 2,-0.6 0, 0.0 -9,-0.1 -0.527 14.2-144.7 -82.8 146.1 93.4 160.7 96.6 77 112 A I - 0 0 56 -2,-0.2 2,-0.6 -49,-0.1 -49,-0.1 -0.952 21.3-163.4-108.5 111.3 91.5 158.5 94.2 78 113 A I + 0 0 4 -2,-0.6 -52,-0.1 -51,-0.4 3,-0.1 -0.882 20.1 168.3-105.7 117.1 89.1 156.4 96.4 79 114 A H + 0 0 54 -2,-0.6 181,-3.1 1,-0.2 2,-0.5 0.795 60.2 56.0 -91.7 -35.7 87.5 153.3 94.8 80 115 A R E > -j 260 0C 52 179,-0.2 3,-1.7 153,-0.1 2,-0.3 -0.905 67.5-141.3-114.9 120.8 85.9 151.5 97.8 81 116 A A E 3 S+j 261 0C 2 179,-3.9 181,-1.5 -2,-0.5 -57,-0.2 -0.592 95.9 43.8 -70.2 132.4 83.4 152.8 100.3 82 117 A G T 3 S+ 0 0 0 -59,-2.6 -1,-0.2 1,-0.5 -58,-0.1 0.204 84.9 120.7 114.5 -14.7 84.6 151.2 103.6 83 118 A D < - 0 0 7 -3,-1.7 -60,-2.5 -60,-0.2 -1,-0.5 -0.375 61.8-113.7 -78.0 164.8 88.2 151.9 103.1 84 119 A I E -AF 22 114A 0 30,-2.4 30,-3.1 -62,-0.2 2,-0.4 -0.792 22.7-163.9-108.2 143.7 90.1 154.1 105.6 85 120 A I E -AF 21 113A 0 -64,-3.0 -64,-2.5 -2,-0.3 2,-0.5 -0.964 5.5-156.4-124.9 139.6 91.7 157.5 105.3 86 121 A R E -AF 20 112A 6 26,-2.6 26,-1.1 -2,-0.4 2,-0.4 -0.972 12.8-167.1-117.1 123.1 94.3 159.1 107.6 87 122 A V E -AF 19 111A 0 -68,-2.5 -68,-2.0 -2,-0.5 2,-0.5 -0.927 6.3-160.6-115.5 132.2 94.5 162.9 107.5 88 123 A H E S+ F 0 110A 11 22,-2.4 22,-1.6 -2,-0.4 -70,-0.2 -0.935 72.9 8.1-110.6 131.1 97.2 165.0 109.1 89 124 A R E S+ 0 0 98 -2,-0.5 15,-0.3 -72,-0.2 2,-0.3 0.993 80.0 161.3 66.6 68.8 96.6 168.7 109.8 90 125 A A E -A 17 0A 0 -73,-3.4 -73,-2.4 -3,-0.2 2,-0.3 -0.875 28.0-143.9-117.7 150.9 92.9 169.2 109.1 91 126 A T E -G 102 0A 44 11,-2.8 11,-2.9 -2,-0.3 2,-0.4 -0.731 12.7-142.4-107.1 161.9 90.6 172.0 110.3 92 127 A L E +G 101 0A 1 -80,-1.9 2,-0.3 -2,-0.3 9,-0.2 -0.984 26.2 156.3-129.0 136.7 87.0 171.6 111.3 93 128 A R E -G 100 0A 150 7,-1.6 7,-3.1 -2,-0.4 2,-0.5 -0.970 42.4-102.4-151.0 162.0 84.1 173.9 110.7 94 129 A L E +G 99 0A 107 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.780 39.9 171.6 -91.4 132.3 80.3 173.8 110.5 95 130 A Y E > -G 98 0A 129 3,-2.1 3,-2.0 -2,-0.5 -2,-0.0 -0.984 69.2 -14.5-142.0 127.4 78.9 173.8 107.0 96 131 A N T 3 S- 0 0 125 -2,-0.4 3,-0.1 1,-0.3 -1,-0.0 0.848 129.4 -53.9 47.6 37.8 75.2 173.2 106.1 97 132 A G T 3 S+ 0 0 65 1,-0.2 2,-0.3 -37,-0.0 -1,-0.3 0.607 116.7 103.6 77.2 14.4 74.8 171.8 109.6 98 133 A Q E < S- G 0 95A 27 -3,-2.0 -3,-2.1 -37,-0.0 2,-0.6 -0.911 79.9-101.5-129.2 156.5 77.6 169.2 109.5 99 134 A R E - 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