==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA REPAIR 10-JUL-01 1H7U . COMPND 2 MOLECULE: MISMATCH REPAIR ENDONUCLEASE PMS2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.GUARNE,M.S.JUNOP,W.YANG . 608 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28938.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 432 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 123 20.2 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 . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 45 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 160 26.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.0 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 1 0 1 2 1 4 0 1 1 0 2 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 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 PARALLEL BRIDGES PER LADDER . 3 1 4 1 4 7 2 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 0 0 2 0 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 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 31 A V 0 0 84 0, 0.0 2,-0.2 0, 0.0 10,-0.1 0.000 360.0 360.0 360.0 73.0 33.7 68.0 42.0 2 32 A V + 0 0 16 61,-0.1 3,-0.1 9,-0.0 4,-0.0 -0.762 360.0 126.6-143.8 77.4 34.3 70.8 39.4 3 33 A L S S+ 0 0 118 1,-0.2 2,-0.3 -2,-0.2 3,-0.1 0.527 70.3 18.5-116.0 -17.6 36.7 72.7 41.6 4 34 A S S > S- 0 0 9 1,-0.1 4,-1.3 -3,-0.1 -1,-0.2 -0.911 80.0-106.9-146.2 169.4 39.7 73.1 39.1 5 35 A L H > S+ 0 0 0 -2,-0.3 4,-1.8 2,-0.2 5,-0.2 0.934 121.0 50.4 -67.5 -42.9 40.2 72.8 35.4 6 36 A S H > S+ 0 0 2 1,-0.2 4,-2.4 124,-0.2 5,-0.2 0.916 108.0 50.5 -60.5 -44.8 42.0 69.5 35.9 7 37 A T H > S+ 0 0 35 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.828 109.9 53.4 -65.7 -25.4 39.2 68.0 38.0 8 38 A A H X S+ 0 0 2 -4,-1.3 4,-1.2 2,-0.2 -1,-0.2 0.859 112.5 41.9 -74.5 -36.1 36.8 69.1 35.3 9 39 A V H X S+ 0 0 1 -4,-1.8 4,-2.9 2,-0.2 5,-0.2 0.818 111.9 54.3 -79.2 -33.8 38.7 67.3 32.5 10 40 A K H X S+ 0 0 61 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.905 108.0 51.0 -66.8 -40.9 39.4 64.2 34.6 11 41 A E H X S+ 0 0 54 -4,-1.5 4,-1.7 -5,-0.2 -1,-0.2 0.904 113.4 44.6 -61.6 -43.9 35.7 63.8 35.3 12 42 A L H X S+ 0 0 3 -4,-1.2 4,-1.9 2,-0.2 -2,-0.2 0.907 113.5 49.4 -67.2 -45.9 34.9 64.1 31.6 13 43 A V H X S+ 0 0 5 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.895 110.1 51.8 -62.7 -40.2 37.7 61.7 30.5 14 44 A E H X S+ 0 0 36 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.895 105.2 55.8 -65.6 -36.5 36.6 59.2 33.1 15 45 A N H X S+ 0 0 73 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.918 109.1 47.4 -59.7 -42.7 33.1 59.4 31.7 16 46 A S H <>S+ 0 0 3 -4,-1.9 5,-2.0 2,-0.2 3,-0.3 0.929 111.3 49.6 -64.6 -45.2 34.4 58.5 28.3 17 47 A L H ><5S+ 0 0 39 -4,-2.4 3,-2.1 1,-0.2 -2,-0.2 0.936 110.8 50.0 -59.0 -47.0 36.5 55.6 29.6 18 48 A D H 3<5S+ 0 0 112 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.745 103.6 60.8 -62.6 -25.4 33.5 54.2 31.6 19 49 A A T 3<5S- 0 0 23 -4,-1.2 24,-2.1 -3,-0.3 -1,-0.3 0.434 120.4-111.6 -82.2 1.2 31.5 54.5 28.4 20 50 A G T < 5 + 0 0 48 -3,-2.1 -3,-0.2 22,-0.2 -2,-0.1 0.760 54.6 172.8 75.3 26.4 33.9 52.1 26.8 21 51 A A < - 0 0 3 -5,-2.0 -1,-0.2 1,-0.1 3,-0.1 -0.326 27.3-174.9 -67.4 148.3 35.5 54.6 24.4 22 52 A T S S+ 0 0 42 1,-0.3 127,-3.4 126,-0.1 2,-0.4 0.432 80.6 49.2-115.2 -14.9 38.5 53.6 22.3 23 53 A N E +a 149 0A 4 125,-0.2 18,-1.5 -7,-0.1 2,-0.4 -0.998 62.4 173.4-127.6 127.6 38.8 57.2 20.9 24 54 A I E -aB 150 40A 1 125,-2.8 127,-1.9 -2,-0.4 2,-0.5 -0.923 6.8-175.1-136.7 107.9 38.7 60.2 23.2 25 55 A D E -aB 151 39A 10 14,-3.5 14,-3.6 -2,-0.4 2,-0.5 -0.927 6.1-162.9-110.1 124.3 39.4 63.6 21.6 26 56 A L E -aB 152 38A 3 125,-2.6 127,-1.7 -2,-0.5 2,-0.5 -0.913 2.9-166.9-107.8 120.2 39.7 66.6 23.8 27 57 A K E -aB 153 37A 40 10,-3.4 10,-3.3 -2,-0.5 2,-0.4 -0.923 8.1-175.7-108.3 132.6 39.4 70.1 22.2 28 58 A L E -aB 154 36A 2 125,-1.8 127,-1.8 -2,-0.5 2,-0.4 -0.965 11.2-164.0-128.0 143.9 40.4 73.2 24.2 29 59 A K E > >S-aB 155 35A 51 6,-2.1 5,-2.0 -2,-0.4 6,-1.3 -0.993 80.4 -1.2-126.5 133.5 40.2 76.9 23.4 30 60 A D G > 5S- 0 0 65 125,-3.1 3,-1.8 -2,-0.4 -1,-0.2 0.904 134.4 -54.8 54.2 45.2 42.1 79.5 25.4 31 61 A Y G 3 5S- 0 0 54 1,-0.3 -1,-0.3 124,-0.2 5,-0.1 0.790 104.8 -54.8 59.3 31.0 43.5 76.7 27.6 32 62 A G G < 5S+ 0 0 0 -3,-0.7 80,-0.5 3,-0.3 -1,-0.3 0.329 116.8 112.1 88.8 -8.0 39.9 75.6 28.4 33 63 A V T < 5S+ 0 0 18 -3,-1.8 -3,-0.2 1,-0.2 79,-0.2 0.854 91.9 25.1 -64.8 -35.7 38.9 78.9 29.6 34 64 A D S - 0 0 65 -2,-0.4 3,-1.5 29,-0.1 4,-0.2 -0.603 27.9-118.2 -87.4 146.9 19.8 56.2 25.4 47 77 A E G > S+ 0 0 123 1,-0.3 3,-1.9 -2,-0.2 4,-0.5 0.825 108.3 67.4 -57.5 -36.3 16.8 58.5 25.3 48 78 A E G 3 S+ 0 0 147 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.790 106.3 44.7 -55.5 -26.4 15.2 57.2 28.5 49 79 A N G < S+ 0 0 81 -3,-1.5 3,-0.3 1,-0.1 -1,-0.3 0.306 80.2 97.9-103.8 9.9 18.1 58.7 30.4 50 80 A F S X S+ 0 0 5 -3,-1.9 3,-1.9 1,-0.2 4,-0.4 0.972 88.9 46.1 -59.6 -52.8 18.4 62.2 28.8 51 81 A E T 3 S+ 0 0 137 -4,-0.5 -1,-0.2 1,-0.3 3,-0.2 0.675 111.9 56.0 -62.6 -17.1 16.5 63.8 31.6 52 82 A G T 3 S+ 0 0 22 -3,-0.3 3,-0.5 1,-0.2 -1,-0.3 0.330 78.9 90.4-100.1 8.0 18.6 61.9 34.0 53 83 A L S < S+ 0 0 26 -3,-1.9 2,-0.8 1,-0.3 9,-0.2 0.900 91.1 43.1 -69.3 -41.8 22.1 63.0 32.8 54 84 A T S S+ 0 0 11 -4,-0.4 -1,-0.3 37,-0.3 2,-0.2 -0.606 113.9 48.6-108.6 74.4 22.2 66.0 35.2 55 85 A L 0 0 113 -2,-0.8 6,-0.1 -3,-0.5 7,-0.1 -0.945 360.0 360.0 174.4 172.1 20.9 64.4 38.3 56 86 A K 0 0 167 -2,-0.2 3,-0.1 3,-0.1 -2,-0.0 0.253 360.0 360.0 73.4 360.0 21.3 61.2 40.8 57 ! 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 58 108 A G 0 0 105 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 114.9 29.5 62.0 43.0 59 109 A E + 0 0 89 1,-0.1 4,-0.4 -3,-0.1 3,-0.1 0.927 360.0 160.3 46.1 76.6 27.5 63.5 40.1 60 110 A A > + 0 0 4 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.351 60.0 79.4 -95.7 -4.3 29.6 66.2 38.5 61 111 A L H > S+ 0 0 27 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.896 97.9 46.6 -74.0 -35.2 27.8 66.3 35.2 62 112 A S H > S+ 0 0 38 1,-0.2 4,-1.0 2,-0.2 3,-0.4 0.876 109.7 55.5 -68.8 -38.0 25.0 68.4 36.9 63 113 A S H >> S+ 0 0 32 -4,-0.4 4,-1.7 1,-0.2 3,-1.1 0.927 100.2 58.1 -59.4 -48.4 27.7 70.5 38.5 64 114 A L H 3X S+ 0 0 3 -4,-2.0 4,-1.3 1,-0.3 -1,-0.2 0.822 103.6 53.5 -54.1 -32.4 29.2 71.4 35.2 65 115 A C H 3< S+ 0 0 0 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.803 106.4 52.4 -72.8 -27.6 25.8 72.8 34.1 66 116 A A H << S+ 0 0 43 -3,-1.1 -2,-0.2 -4,-1.0 -1,-0.2 0.792 118.1 37.0 -77.0 -26.8 25.8 75.0 37.2 67 117 A L H < S+ 0 0 25 -4,-1.7 46,-1.5 1,-0.1 47,-1.0 0.543 126.9 7.2-103.3 -8.6 29.2 76.4 36.3 68 118 A S S < S- 0 0 0 -4,-1.3 2,-0.7 -5,-0.2 43,-0.2 -0.960 82.1 -83.2-159.4 174.3 29.1 76.5 32.6 69 119 A D E -D 110 0A 57 41,-1.9 41,-2.9 -2,-0.3 2,-0.5 -0.815 48.7-161.8 -89.1 115.8 27.0 76.2 29.4 70 120 A V E -DE 109 87A 1 -2,-0.7 17,-2.1 17,-0.6 2,-0.4 -0.894 13.4-177.9-107.3 128.1 26.9 72.5 28.6 71 121 A T E -DE 108 86A 25 37,-1.9 37,-3.2 -2,-0.5 2,-0.4 -0.981 6.8-173.0-121.9 133.2 26.0 71.1 25.2 72 122 A I E -DE 107 85A 3 13,-2.6 13,-3.2 -2,-0.4 2,-0.4 -0.986 10.6-173.5-132.6 126.6 25.9 67.3 24.6 73 123 A S E +DE 106 84A 14 33,-2.1 33,-2.7 -2,-0.4 2,-0.3 -0.924 22.9 164.2-112.6 141.8 25.4 65.4 21.4 74 124 A T E -DE 105 83A 1 9,-2.5 9,-2.5 -2,-0.4 2,-0.3 -0.997 24.4-168.7-156.6 159.0 25.0 61.6 21.7 75 125 A C E -D 104 0A 13 29,-2.0 29,-2.1 -2,-0.3 2,-0.2 -0.926 12.0-151.3-154.4 125.7 23.9 58.4 20.0 76 126 A H > - 0 0 44 -31,-0.5 3,-1.1 -2,-0.3 -32,-0.1 -0.530 31.3-114.1 -90.2 158.8 23.4 54.9 21.4 77 127 A A T 3 S+ 0 0 76 -34,-0.5 -1,-0.1 1,-0.3 -33,-0.1 0.926 119.8 52.7 -57.6 -44.5 23.9 51.7 19.2 78 128 A S T 3 S+ 0 0 78 2,-0.0 -1,-0.3 -3,-0.0 2,-0.2 0.595 91.6 106.9 -66.1 -14.7 20.1 51.0 19.5 79 129 A A < - 0 0 37 -3,-1.1 3,-0.1 1,-0.1 24,-0.0 -0.467 56.8-159.6 -78.0 140.9 19.4 54.5 18.3 80 130 A K S S+ 0 0 204 1,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.830 85.1 12.6 -80.3 -36.3 18.0 55.3 14.9 81 131 A V S S- 0 0 75 19,-0.1 -1,-0.3 21,-0.0 -5,-0.2 -0.998 77.8-119.7-144.2 146.3 19.2 58.9 15.2 82 132 A G - 0 0 1 -2,-0.3 17,-2.8 17,-0.3 2,-0.3 -0.145 27.9-136.9 -73.4 177.9 21.5 60.8 17.5 83 133 A T E -EF 74 98A 13 -9,-2.5 -9,-2.5 15,-0.3 2,-0.5 -0.990 5.2-146.9-141.3 146.9 20.4 63.8 19.6 84 134 A R E -EF 73 97A 74 13,-2.8 13,-2.1 -2,-0.3 2,-0.4 -0.970 21.5-167.2-115.1 126.6 21.8 67.3 20.5 85 135 A L E -EF 72 96A 0 -13,-3.2 -13,-2.6 -2,-0.5 2,-0.5 -0.943 11.4-163.8-120.9 137.2 21.0 68.6 24.0 86 136 A M E -EF 71 95A 53 9,-1.6 8,-3.6 -2,-0.4 9,-1.2 -0.975 14.8-158.3-118.2 127.6 21.4 72.1 25.4 87 137 A F E -EF 70 93A 7 -17,-2.1 -17,-0.6 -2,-0.5 6,-0.2 -0.872 8.9-144.9-113.0 140.8 21.3 72.6 29.2 88 138 A D > - 0 0 51 4,-2.0 3,-1.7 -2,-0.4 4,-0.1 -0.392 45.4 -91.1 -86.8 173.4 20.5 75.6 31.4 89 139 A H T 3 S+ 0 0 70 1,-0.3 -21,-0.1 2,-0.1 -1,-0.1 0.657 123.6 63.4 -66.1 -12.5 22.4 76.0 34.7 90 140 A N T 3 S- 0 0 153 2,-0.1 -1,-0.3 -25,-0.1 3,-0.1 0.204 119.9-106.3 -95.3 18.9 19.8 74.1 36.7 91 141 A G S < S+ 0 0 11 -3,-1.7 -37,-0.3 1,-0.2 2,-0.2 0.610 74.6 142.6 70.0 15.0 20.6 71.0 34.6 92 142 A K - 0 0 148 -4,-0.1 -4,-2.0 -27,-0.1 2,-0.7 -0.558 59.2-109.0 -86.7 151.4 17.3 71.3 32.7 93 143 A I E +F 87 0A 34 -6,-0.2 -6,-0.2 -2,-0.2 3,-0.1 -0.729 35.5 176.4 -83.8 114.9 17.1 70.4 29.0 94 144 A I E + 0 0 113 -8,-3.6 2,-0.3 -2,-0.7 -1,-0.2 0.907 69.6 11.4 -79.3 -49.5 16.6 73.7 27.1 95 145 A Q E -F 86 0A 77 -9,-1.2 -9,-1.6 2,-0.0 2,-0.3 -0.923 57.8-174.9-132.1 153.9 16.7 72.2 23.6 96 146 A K E +F 85 0A 83 -2,-0.3 -11,-0.2 -11,-0.2 -13,-0.0 -0.908 16.7 167.2-152.1 115.5 16.6 68.7 22.2 97 147 A T E -F 84 0A 48 -13,-2.1 -13,-2.8 -2,-0.3 -2,-0.0 -0.997 40.2-104.0-139.6 143.1 17.0 68.0 18.6 98 148 A P E +F 83 0A 105 0, 0.0 -15,-0.3 0, 0.0 -16,-0.1 -0.278 42.4 179.7 -57.5 147.3 17.6 65.0 16.3 99 149 A Y - 0 0 33 -17,-2.8 2,-0.4 -25,-0.1 -17,-0.3 -0.754 26.3-134.0-156.6 100.9 21.2 64.9 15.2 100 150 A P + 0 0 79 0, 0.0 354,-0.1 0, 0.0 -19,-0.1 -0.399 48.2 138.9 -65.0 122.0 22.8 62.3 13.0 101 151 A R - 0 0 23 -2,-0.4 3,-0.1 376,-0.1 376,-0.1 -0.985 53.6 -90.2-155.2 155.7 26.1 61.3 14.5 102 152 A P - 0 0 15 0, 0.0 -27,-0.1 0, 0.0 353,-0.1 -0.198 63.4 -73.1 -64.9 164.8 28.2 58.1 15.1 103 153 A R S S+ 0 0 114 -62,-0.1 2,-0.3 -29,-0.1 -27,-0.2 -0.311 97.7 61.7 -58.0 137.5 27.8 56.1 18.3 104 154 A G E S- D 0 75A 0 -29,-2.1 -29,-2.0 -61,-0.2 -59,-0.4 -0.878 76.7 -88.5 138.0-170.2 29.3 58.0 21.2 105 155 A T E -CD 40 74A 17 -65,-1.2 -65,-2.7 -2,-0.3 2,-0.4 -0.992 17.4-160.7-142.8 148.2 29.0 61.2 23.0 106 156 A T E -CD 39 73A 15 -33,-2.7 -33,-2.1 -2,-0.3 2,-0.5 -0.972 10.9-166.4-131.7 117.1 30.4 64.7 22.8 107 157 A V E -CD 38 72A 16 -69,-2.5 -69,-2.7 -2,-0.4 2,-0.5 -0.909 2.4-164.1-106.3 124.8 30.3 67.0 25.8 108 158 A S E -CD 37 71A 16 -37,-3.2 -37,-1.9 -2,-0.5 2,-0.7 -0.935 4.9-167.0-112.7 121.4 31.0 70.7 25.4 109 159 A V E -CD 36 70A 2 -73,-2.3 -73,-1.8 -2,-0.5 3,-0.4 -0.893 14.6-167.3-108.8 102.3 31.8 72.9 28.4 110 160 A Q E -CD 35 69A 91 -41,-2.9 -41,-1.9 -2,-0.7 4,-0.2 -0.724 62.5 -8.7 -93.0 136.9 31.5 76.6 27.3 111 161 A Q S > S- 0 0 70 -77,-2.2 3,-1.7 -2,-0.3 -1,-0.2 0.884 83.5-143.4 47.4 52.0 32.8 79.5 29.4 112 162 A L T 3 S+ 0 0 0 -80,-0.5 -44,-0.2 -3,-0.4 -1,-0.1 -0.100 76.9 9.5 -47.8 138.8 33.6 77.4 32.5 113 163 A F T > S+ 0 0 3 -46,-1.5 3,-1.6 -49,-0.2 7,-0.4 0.649 82.1 136.1 66.1 16.6 32.9 79.2 35.8 114 164 A S T < + 0 0 45 -3,-1.7 -46,-0.1 -47,-1.0 -2,-0.1 0.783 68.7 57.4 -67.9 -18.5 31.2 82.0 34.1 115 165 A T T 3 S+ 0 0 57 -48,-0.6 -1,-0.3 1,-0.2 -47,-0.1 0.519 102.2 57.7 -85.9 -7.8 28.5 81.9 36.7 116 166 A L <> - 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