==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-JUL-11 3SWR . COMPND 2 MOLECULE: DNA (CYTOSINE-5)-METHYLTRANSFERASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.HASHIMOTO,X.CHENG . 966 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44976.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 559 57.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 136 14.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.5 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 . 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 . 84 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 108 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 133 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.1 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 3 1 3 2 1 3 0 2 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 3 4 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 PARALLEL BRIDGES PER LADDER . 8 3 7 6 1 1 1 3 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 . 3 3 1 0 0 1 0 0 0 0 0 0 0 0 0 1 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 1 601 A R 0 0 141 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 142.8 -12.7 -0.1 57.8 2 602 A Q - 0 0 118 3,-0.0 2,-0.2 1,-0.0 0, 0.0 0.945 360.0 -41.5 -63.6 -50.6 -13.3 0.8 61.5 3 603 A T S S- 0 0 77 69,-0.0 2,-0.4 2,-0.0 -1,-0.0 -0.534 89.2 -52.5-149.6-144.4 -9.6 0.3 62.4 4 604 A I + 0 0 44 -2,-0.2 2,-2.0 -3,-0.1 3,-0.5 -0.433 58.8 177.1-106.5 56.3 -6.9 -2.3 61.6 5 605 A R S S- 0 0 89 -2,-0.4 3,-0.1 1,-0.3 69,-0.1 -0.387 81.5 -41.8 -64.7 81.5 -9.0 -5.4 62.4 6 606 A H S S+ 0 0 17 -2,-2.0 -1,-0.3 66,-0.2 2,-0.3 0.739 100.1 164.1 65.9 23.9 -6.4 -8.0 61.4 7 607 A S - 0 0 40 -3,-0.5 67,-0.4 65,-0.2 -1,-0.2 -0.557 33.8-168.3 -78.5 134.0 -5.7 -5.8 58.4 8 608 A T - 0 0 49 -2,-0.3 -1,-0.1 65,-0.1 31,-0.1 -0.112 23.0-169.9-110.0 32.2 -2.6 -6.4 56.4 9 609 A R 0 0 76 29,-0.1 31,-0.1 1,-0.1 29,-0.0 0.152 360.0 360.0 -27.3 123.1 -3.0 -3.2 54.4 10 610 A E 0 0 63 29,-0.8 29,-1.2 74,-0.1 -1,-0.1 -0.654 360.0 360.0-121.6 360.0 -0.5 -3.0 51.5 11 ! 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 12 615 A P 0 0 147 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-115.6 2.3 14.7 41.6 13 616 A T + 0 0 118 2,-0.1 2,-0.4 0, 0.0 0, 0.0 0.521 360.0 101.2 -93.3 -10.0 -1.2 13.6 42.5 14 617 A K S S- 0 0 134 1,-0.1 599,-0.1 3,-0.0 2,-0.0 -0.608 76.0-125.4 -79.8 130.4 -2.4 15.9 39.7 15 618 A A - 0 0 8 -2,-0.4 2,-0.6 597,-0.1 599,-0.1 -0.350 28.3-102.1 -71.9 154.9 -3.4 14.1 36.4 16 619 A T + 0 0 15 597,-0.1 2,-0.3 -2,-0.0 605,-0.2 -0.703 58.1 167.2 -79.8 120.2 -1.8 15.2 33.2 17 620 A T - 0 0 36 -2,-0.6 2,-0.3 604,-0.1 601,-0.1 -0.860 36.3-124.4-133.6 164.7 -4.4 17.3 31.5 18 621 A T > - 0 0 5 -2,-0.3 4,-2.9 1,-0.1 5,-0.2 -0.742 37.8-108.6-102.9 159.0 -4.8 19.7 28.6 19 622 A K H > S+ 0 0 117 218,-0.4 4,-2.0 -2,-0.3 5,-0.1 0.818 118.6 52.5 -57.4 -31.4 -6.3 23.1 29.2 20 623 A L H > S+ 0 0 28 218,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.966 113.6 40.2 -69.8 -52.7 -9.5 22.1 27.5 21 624 A V H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.922 115.2 52.8 -61.8 -45.1 -10.1 19.0 29.5 22 625 A Y H X S+ 0 0 116 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.947 110.3 47.1 -55.2 -52.7 -9.0 20.6 32.7 23 626 A Q H X S+ 0 0 96 -4,-2.0 4,-0.9 -5,-0.2 -1,-0.2 0.776 107.5 56.7 -62.7 -29.8 -11.4 23.6 32.3 24 627 A I H < S+ 0 0 14 -4,-1.6 4,-0.3 1,-0.2 3,-0.2 0.920 115.8 36.8 -67.4 -42.8 -14.3 21.3 31.4 25 628 A F H >< S+ 0 0 1 -4,-1.9 3,-0.7 1,-0.2 -2,-0.2 0.719 105.6 68.3 -82.8 -21.7 -13.9 19.4 34.7 26 629 A D H 3< S+ 0 0 77 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.800 86.9 69.9 -67.9 -28.6 -12.9 22.4 36.8 27 630 A T T 3< S+ 0 0 109 -4,-0.9 3,-0.3 -3,-0.2 -1,-0.2 0.797 89.1 81.4 -58.2 -33.0 -16.5 23.9 36.5 28 631 A F S < S- 0 0 32 -3,-0.7 169,-0.0 -4,-0.3 -3,-0.0 -0.417 90.9 -0.1 -90.9 156.7 -18.0 21.2 38.7 29 632 A F S S- 0 0 71 -2,-0.1 -1,-0.2 1,-0.1 579,-0.1 0.897 76.4-143.6 37.2 71.6 -18.4 20.6 42.4 30 633 A A - 0 0 72 -3,-0.3 -1,-0.1 1,-0.1 575,-0.1 -0.293 7.5-142.8 -61.2 140.9 -16.6 23.6 43.8 31 634 A E S S+ 0 0 85 574,-0.1 2,-0.6 2,-0.0 -1,-0.1 0.647 82.3 80.7 -78.9 -18.7 -14.6 23.1 47.0 32 635 A Q 0 0 85 1,-0.1 -2,-0.1 573,-0.0 -1,-0.0 -0.832 360.0 360.0 -95.7 120.0 -15.5 26.5 48.3 33 636 A I 0 0 155 -2,-0.6 -1,-0.1 0, 0.0 -2,-0.0 0.546 360.0 360.0 -47.6 360.0 -19.0 26.7 49.9 34 ! 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 35 646 A N 0 0 122 0, 0.0 2,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 45.9 -5.4 9.1 50.0 36 647 A A - 0 0 88 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.485 360.0 -85.7 -82.2 151.1 -3.6 6.3 48.0 37 648 A F - 0 0 54 -2,-0.2 2,-0.5 1,-0.1 -1,-0.1 -0.242 41.7-155.1 -56.3 134.6 -5.2 3.0 47.2 38 649 A K - 0 0 128 -3,-0.1 48,-0.3 48,-0.0 2,-0.1 -0.963 14.5-125.3-120.7 120.4 -4.9 0.4 50.0 39 650 A R - 0 0 109 -29,-1.2 -29,-0.8 -2,-0.5 46,-0.2 -0.379 25.4-160.8 -64.3 132.3 -5.0 -3.4 49.2 40 651 A R B -A 84 0A 149 44,-2.0 44,-2.1 -31,-0.1 2,-0.4 -0.524 17.4-115.2-103.5 175.3 -7.6 -5.3 51.2 41 652 A R - 0 0 60 42,-0.2 2,-1.0 -2,-0.2 42,-0.1 -0.888 23.8-115.5-114.3 146.8 -7.7 -9.1 51.8 42 653 A C > - 0 0 39 -2,-0.4 2,-3.8 40,-0.2 3,-1.2 -0.704 20.6-147.3 -82.9 103.4 -10.4 -11.4 50.5 43 654 A G T 3 S+ 0 0 52 -2,-1.0 -1,-0.1 1,-0.2 3,-0.0 -0.293 83.7 71.0 -68.5 63.2 -12.1 -12.8 53.6 44 655 A V T 3 + 0 0 29 -2,-3.8 -1,-0.2 858,-0.0 857,-0.1 0.502 64.0 96.3-145.2 -38.0 -12.7 -16.1 51.8 45 656 A C S <> S- 0 0 6 -3,-1.2 4,-1.6 1,-0.1 3,-0.3 -0.150 88.5-101.3 -61.0 161.0 -9.5 -18.1 51.2 46 657 A E T 4 S+ 0 0 37 1,-0.2 4,-0.3 2,-0.2 -1,-0.1 0.409 121.4 56.9 -66.3 5.1 -8.7 -20.8 53.7 47 658 A V T 4 S+ 0 0 27 2,-0.2 3,-0.4 31,-0.1 -1,-0.2 0.819 103.0 48.3 -99.8 -47.6 -6.1 -18.4 55.3 48 659 A C T 4 S+ 0 0 7 -3,-0.3 -2,-0.2 -6,-0.3 -5,-0.1 0.818 109.7 57.2 -61.2 -29.4 -8.5 -15.6 56.1 49 660 A Q S < S+ 0 0 45 -4,-1.6 -1,-0.2 2,-0.1 -2,-0.2 0.853 82.8 109.3 -69.1 -35.6 -10.7 -18.2 57.6 50 661 A Q S S- 0 0 74 -3,-0.4 2,-0.3 -4,-0.3 -3,-0.1 -0.064 73.2-122.6 -44.0 135.8 -7.9 -19.3 59.9 51 662 A P - 0 0 48 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.698 34.6 -93.5 -87.3 136.2 -8.5 -18.4 63.6 52 663 A E - 0 0 103 -2,-0.3 26,-0.0 1,-0.2 22,-0.0 -0.256 34.9-156.7 -49.0 113.5 -5.9 -16.2 65.4 53 664 A C - 0 0 72 -2,-0.1 -1,-0.2 1,-0.1 -3,-0.0 0.854 14.9-145.0 -65.3 -35.6 -3.7 -18.8 67.0 54 665 A G S S+ 0 0 37 2,-0.0 -1,-0.1 1,-0.0 -2,-0.1 0.786 71.0 100.1 74.7 28.6 -2.5 -16.4 69.7 55 666 A K + 0 0 90 0, 0.0 2,-0.3 0, 0.0 -1,-0.0 -0.069 64.4 68.9-136.5 35.3 1.0 -17.9 69.8 56 667 A C S > S- 0 0 32 1,-0.0 4,-3.0 0, 0.0 5,-0.3 -0.981 93.9 -90.1-150.4 159.9 3.3 -15.6 67.7 57 668 A K T 4 S+ 0 0 91 -2,-0.3 4,-0.1 1,-0.2 18,-0.0 0.703 122.5 52.6 -41.1 -27.1 4.8 -12.1 67.7 58 669 A A T >4 S+ 0 0 20 2,-0.2 3,-2.4 1,-0.1 -1,-0.2 0.986 115.6 30.7 -75.8 -74.4 1.6 -11.0 65.9 59 670 A C G >4 S+ 0 0 8 1,-0.3 3,-1.1 2,-0.2 6,-0.7 0.770 118.3 59.6 -57.0 -27.1 -1.3 -12.2 68.0 60 671 A K G 3< S+ 0 0 50 -4,-3.0 -1,-0.3 1,-0.2 -2,-0.2 0.560 101.7 54.9 -78.9 -7.7 0.9 -11.8 71.0 61 672 A D G < S+ 0 0 31 -3,-2.4 9,-0.6 -5,-0.3 10,-0.4 0.105 97.5 83.6-110.0 19.1 1.3 -8.1 70.2 62 673 A M S < S- 0 0 34 -3,-1.1 7,-0.1 3,-0.3 10,-0.0 -0.666 89.1-106.7-115.9 172.4 -2.5 -7.4 70.1 63 674 A V S > S+ 0 0 77 -2,-0.2 3,-0.9 1,-0.2 4,-0.3 0.913 113.3 59.8 -65.6 -45.2 -5.1 -6.7 72.8 64 675 A K T 3 S+ 0 0 95 1,-0.3 2,-0.7 2,-0.1 -1,-0.2 0.903 111.7 39.7 -49.9 -49.6 -6.8 -10.1 72.7 65 676 A F T 3 S- 0 0 38 -6,-0.7 -1,-0.3 1,-0.1 -3,-0.3 -0.540 130.4 -79.6-104.1 65.4 -3.5 -11.9 73.6 66 677 A G S < S+ 0 0 68 -3,-0.9 2,-0.3 -2,-0.7 -3,-0.2 0.901 91.0 91.9 39.6 96.5 -2.1 -9.5 76.3 67 678 A G S S- 0 0 46 -4,-0.3 2,-0.3 -6,-0.1 -1,-0.1 -0.980 71.6 -73.4 173.1 178.4 -0.5 -6.6 74.5 68 679 A S > - 0 0 69 -2,-0.3 2,-2.7 1,-0.0 3,-0.5 -0.764 37.3-120.6 -99.9 142.7 -0.6 -3.1 73.1 69 680 A G T 3 S+ 0 0 80 -2,-0.3 3,-0.2 1,-0.2 -7,-0.1 -0.351 80.5 111.9 -77.0 61.2 -2.4 -2.2 69.9 70 681 A R T 3 + 0 0 88 -2,-2.7 2,-1.3 -9,-0.6 -1,-0.2 0.877 66.2 50.2 -96.5 -61.0 0.9 -0.8 68.4 71 682 A S < - 0 0 57 -3,-0.5 -1,-0.2 -10,-0.4 -10,-0.1 -0.698 67.6-169.9 -83.6 93.9 1.8 -3.3 65.7 72 683 A K + 0 0 57 -2,-1.3 -66,-0.2 -3,-0.2 -1,-0.2 0.604 43.2 131.7 -60.4 -10.6 -1.5 -3.3 63.8 73 684 A Q - 0 0 68 1,-0.1 -65,-0.1 -67,-0.1 -12,-0.1 -0.165 58.3-123.8 -46.7 129.2 0.0 -6.2 61.8 74 685 A A - 0 0 18 -67,-0.4 4,-0.1 1,-0.2 -1,-0.1 -0.202 44.3 -58.5 -74.7 168.3 -2.5 -9.1 61.7 75 686 A C > - 0 0 6 -17,-0.2 3,-1.1 1,-0.1 -1,-0.2 -0.058 45.9-128.1 -44.0 144.3 -1.9 -12.7 62.9 76 687 A Q G > S+ 0 0 102 1,-0.3 3,-0.8 2,-0.1 -1,-0.1 0.778 107.7 63.8 -70.4 -26.5 1.0 -14.3 61.1 77 688 A E G 3 S+ 0 0 77 1,-0.2 -1,-0.3 -26,-0.0 -27,-0.1 0.195 96.6 62.9 -83.1 18.4 -1.1 -17.3 60.2 78 689 A R G < + 0 0 29 -3,-1.1 2,-1.8 -4,-0.1 -1,-0.2 -0.067 57.2 144.1-132.4 32.2 -3.3 -15.0 58.2 79 690 A R < - 0 0 136 -3,-0.8 -3,-0.1 1,-0.1 -31,-0.1 -0.571 49.8-137.6 -76.2 87.8 -0.9 -13.7 55.5 80 691 A C > - 0 0 12 -2,-1.8 3,-1.0 1,-0.2 -2,-0.1 -0.262 17.3-164.5 -53.2 115.9 -3.5 -13.6 52.7 81 692 A P T 3 S+ 0 0 78 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.670 89.8 58.4 -73.8 -19.6 -1.9 -15.0 49.4 82 693 A N T 3 S+ 0 0 13 -40,-0.1 -40,-0.2 2,-0.1 -2,-0.1 -0.058 73.0 158.4-101.8 30.4 -4.8 -13.3 47.5 83 694 A M < + 0 0 33 -3,-1.0 2,-0.3 -42,-0.1 -42,-0.2 -0.339 21.4 171.8 -55.7 127.9 -4.1 -9.8 48.7 84 695 A A B -A 40 0A 25 -44,-2.1 -44,-2.0 -46,-0.1 2,-0.3 -0.982 39.3-115.2-148.5 158.9 -5.7 -7.5 46.2 85 696 A M - 0 0 50 -2,-0.3 2,-1.7 -46,-0.2 -46,-0.1 -0.643 45.8-107.0 -84.2 140.0 -6.7 -4.0 45.2 86 697 A K - 0 0 107 -2,-0.3 2,-0.2 -48,-0.3 4,-0.1 -0.535 39.1-156.1 -74.1 90.9 -10.5 -3.4 45.0 87 698 A E - 0 0 49 -2,-1.7 -3,-0.0 1,-0.2 -1,-0.0 -0.469 17.0-135.6 -67.6 133.2 -10.8 -3.2 41.2 88 699 A A S S+ 0 0 7 1,-0.2 2,-4.8 -2,-0.2 -1,-0.2 0.575 79.7 111.1 -66.1 -8.2 -13.9 -1.2 40.3 89 700 A D + 0 0 39 1,-0.1 2,-0.4 2,-0.1 -1,-0.2 -0.199 45.9 120.1 -64.7 56.7 -14.5 -4.0 37.7 90 701 A D + 0 0 49 -2,-4.8 -1,-0.1 -4,-0.1 -2,-0.0 -0.762 33.0 169.4-129.0 83.8 -17.5 -4.9 39.9 91 702 A D > + 0 0 16 -2,-0.4 2,-2.7 1,-0.1 3,-1.3 0.215 40.2 132.2 -76.7 18.5 -20.8 -4.8 38.0 92 703 A E T 3 + 0 0 83 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 -0.389 48.2 72.9 -72.6 66.8 -22.0 -6.5 41.2 93 704 A E T 3 - 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