==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 20-JAN-11 3QEX . COMPND 2 MOLECULE: DNA POLYMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE RB69; . AUTHOR S.XIA,W.H.KONIGSBERG,J.WANG . 901 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41421.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 627 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 121 13.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.8 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 . 61 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 83 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 308 34.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.0 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 2 2 0 2 2 3 1 1 2 1 5 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 3 RESIDUES PER ALPHA HELIX . 0 2 1 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 PARALLEL BRIDGES PER LADDER . 3 5 2 3 4 3 2 1 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 0 1 1 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 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 M 0 0 105 0, 0.0 2,-0.2 0, 0.0 23,-0.1 0.000 360.0 360.0 360.0 160.0 36.9 -17.7 -36.1 2 2 A K - 0 0 127 1,-0.1 2,-0.1 21,-0.1 18,-0.0 -0.563 360.0-114.7 -73.2 139.7 35.4 -14.2 -36.6 3 3 A E - 0 0 64 -2,-0.2 2,-0.3 100,-0.1 99,-0.3 -0.388 33.5-174.7 -73.8 152.9 34.3 -12.6 -33.4 4 4 A F E -A 20 0A 0 16,-1.4 16,-3.0 97,-0.1 2,-0.1 -0.990 23.8-113.3-146.8 147.5 30.6 -11.8 -32.6 5 5 A Y E -A 19 0A 0 -2,-0.3 14,-0.3 14,-0.2 3,-0.1 -0.358 17.6-172.4 -73.5 155.5 28.8 -10.0 -29.8 6 6 A L E S- 0 0 1 12,-3.4 349,-0.4 1,-0.5 2,-0.3 0.702 73.0 -7.8-106.2 -55.1 26.4 -11.8 -27.4 7 7 A T E -A 18 0A 2 11,-1.5 11,-2.2 347,-0.1 -1,-0.5 -0.971 59.5-163.2-140.4 154.2 25.0 -8.8 -25.6 8 8 A V E +A 17 0A 0 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.997 11.5 172.8-139.0 142.0 25.7 -5.1 -25.4 9 9 A E E -A 16 0A 12 7,-2.0 7,-2.6 -2,-0.3 2,-0.6 -0.994 27.5-135.6-142.9 149.8 24.7 -2.4 -22.9 10 10 A Q E +A 15 0A 54 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.951 24.0 176.1 -99.6 123.9 25.4 1.2 -22.1 11 11 A I E > -A 14 0A 38 3,-2.9 3,-1.9 -2,-0.6 2,-0.2 -0.922 64.0 -58.2-127.0 104.1 26.0 1.8 -18.4 12 12 A G T 3 S- 0 0 21 -2,-0.5 53,-0.0 1,-0.3 -1,-0.0 -0.432 120.7 -15.5 57.7-124.6 26.9 5.5 -17.8 13 13 A D T 3 S+ 0 0 46 -2,-0.2 2,-0.4 52,-0.1 -1,-0.3 0.253 123.5 86.0 -93.6 12.5 30.0 6.2 -19.9 14 14 A S E < -A 11 0A 12 -3,-1.9 -3,-2.9 18,-0.2 2,-0.5 -0.891 64.9-144.6-116.7 142.7 30.8 2.6 -20.5 15 15 A I E -AB 10 31A 0 16,-2.8 16,-2.9 -2,-0.4 2,-0.6 -0.925 17.6-157.6 -94.0 126.8 29.8 0.0 -23.0 16 16 A F E -AB 9 30A 36 -7,-2.6 -7,-2.0 -2,-0.5 2,-0.4 -0.955 17.0-177.9-105.2 121.2 29.5 -3.4 -21.4 17 17 A E E -AB 8 29A 0 12,-2.7 12,-2.3 -2,-0.6 2,-0.5 -0.978 21.8-162.7-126.7 128.9 29.8 -6.2 -24.0 18 18 A R E +AB 7 28A 2 -11,-2.2 -12,-3.4 -2,-0.4 -11,-1.5 -0.915 33.6 158.6-100.3 136.5 29.7 -9.9 -23.7 19 19 A Y E -AB 5 27A 16 8,-2.3 8,-2.9 -2,-0.5 2,-0.5 -0.962 46.0-110.4-152.2 166.1 31.1 -11.5 -26.8 20 20 A I E -AB 4 26A 2 -16,-3.0 -16,-1.4 -2,-0.3 6,-0.2 -0.926 40.7-143.9-101.1 122.9 32.7 -14.6 -28.4 21 21 A D > - 0 0 7 4,-2.8 3,-2.2 -2,-0.5 -17,-0.0 -0.163 33.2 -86.5 -81.7 180.0 36.4 -14.1 -29.2 22 22 A S T 3 S+ 0 0 57 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.647 128.8 53.4 -64.0 -14.8 38.5 -15.4 -32.1 23 23 A N T 3 S- 0 0 118 2,-0.1 -1,-0.3 0, 0.0 -21,-0.1 0.334 120.9-105.8-100.6 3.8 39.1 -18.6 -30.2 24 24 A G S < S+ 0 0 12 -3,-2.2 2,-0.3 1,-0.3 -2,-0.1 0.586 75.8 135.5 83.9 12.6 35.4 -19.3 -29.6 25 25 A R - 0 0 162 1,-0.0 -4,-2.8 0, 0.0 2,-0.4 -0.697 58.3-115.8 -93.8 145.1 35.5 -18.3 -25.9 26 26 A E E +B 20 0A 69 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.652 42.5 172.4 -76.7 130.6 33.0 -16.2 -24.1 27 27 A R E -B 19 0A 126 -8,-2.9 -8,-2.3 -2,-0.4 2,-0.4 -0.875 22.6-147.5-132.2 162.9 34.5 -12.9 -22.8 28 28 A T E +B 18 0A 78 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.995 18.7 178.1-132.2 141.7 33.2 -9.7 -21.2 29 29 A R E -B 17 0A 68 -12,-2.3 -12,-2.7 -2,-0.4 2,-0.5 -0.997 24.8-144.6-143.6 149.5 34.7 -6.2 -21.6 30 30 A E E -B 16 0A 119 -2,-0.3 2,-0.5 -14,-0.2 -14,-0.2 -0.967 24.8-170.6-110.2 121.1 34.0 -2.7 -20.5 31 31 A V E -B 15 0A 45 -16,-2.9 -16,-2.8 -2,-0.5 2,-2.1 -0.962 25.9-140.5-120.9 127.3 34.9 -0.1 -23.2 32 32 A E - 0 0 167 -2,-0.5 -18,-0.2 -18,-0.2 2,-0.2 -0.509 36.5-163.7 -82.4 70.4 35.0 3.7 -22.6 33 33 A Y - 0 0 26 -2,-2.1 32,-0.3 -20,-0.1 59,-0.1 -0.361 13.1-151.6 -67.2 126.3 33.4 4.2 -26.0 34 34 A K - 0 0 108 -2,-0.2 29,-0.1 30,-0.1 2,-0.1 -0.886 19.4-152.9 -99.4 108.1 33.7 7.7 -27.5 35 35 A P - 0 0 1 0, 0.0 27,-2.3 0, 0.0 2,-0.4 -0.397 1.1-142.5 -80.6 158.5 30.7 8.3 -29.7 36 36 A S E +C 61 0B 29 25,-0.2 2,-0.2 49,-0.1 49,-0.2 -0.950 18.4 175.7-116.8 141.5 30.5 10.6 -32.7 37 37 A L E -C 60 0B 2 23,-2.0 23,-3.4 -2,-0.4 2,-0.3 -0.752 20.1-128.1-128.1-178.3 27.5 12.8 -33.8 38 38 A F E -CD 59 83B 27 45,-2.5 45,-2.2 -2,-0.2 2,-0.3 -0.958 14.9-168.3-139.5 148.5 27.2 15.3 -36.6 39 39 A A E -C 58 0B 13 19,-1.9 19,-3.0 -2,-0.3 43,-0.1 -0.956 39.2 -98.0-127.6 153.0 26.2 18.8 -37.4 40 40 A H E -C 57 0B 81 41,-0.4 17,-0.3 -2,-0.3 10,-0.0 -0.388 44.7-165.7 -63.2 147.5 25.7 20.5 -40.8 41 41 A C - 0 0 31 15,-1.9 6,-0.0 4,-0.1 -1,-0.0 -0.939 31.8 -70.8-135.9 156.3 28.7 22.5 -41.9 42 42 A P > - 0 0 80 0, 0.0 3,-1.2 0, 0.0 -1,-0.0 -0.162 38.0-130.8 -50.6 140.8 29.4 25.2 -44.6 43 43 A E T 3 S+ 0 0 125 1,-0.2 14,-0.1 13,-0.0 -2,-0.0 0.800 103.7 62.7 -61.7 -33.9 29.3 23.8 -48.2 44 44 A S T 3 S+ 0 0 122 2,-0.1 -1,-0.2 0, 0.0 2,-0.2 0.649 90.2 86.1 -69.1 -17.3 32.7 25.5 -49.0 45 45 A Q S < S- 0 0 121 -3,-1.2 2,-0.4 1,-0.1 -4,-0.1 -0.565 83.9-108.4 -91.6 152.2 34.5 23.5 -46.4 46 46 A A + 0 0 104 -2,-0.2 2,-0.3 10,-0.0 -2,-0.1 -0.635 49.1 143.9 -87.0 128.8 36.0 20.0 -46.9 47 47 A T - 0 0 46 -2,-0.4 11,-0.1 11,-0.1 -6,-0.0 -0.975 44.5-146.4-151.7 161.6 34.5 16.9 -45.4 48 48 A K S S+ 0 0 125 -2,-0.3 2,-0.5 9,-0.1 10,-0.1 0.465 78.8 86.9-106.1 -5.6 33.9 13.2 -46.2 49 49 A Y E +E 57 0B 40 8,-0.5 8,-2.7 329,-0.0 2,-0.3 -0.830 51.5 171.1-100.9 130.4 30.6 13.1 -44.3 50 50 A F E -Ef 56 378B 74 327,-1.3 329,-2.0 -2,-0.5 -10,-0.0 -0.979 30.3-119.8-133.9 146.7 27.3 14.0 -45.9 51 51 A D E > - f 0 379B 8 4,-2.9 3,-2.1 -2,-0.3 329,-0.2 -0.176 47.0 -88.2 -75.5 179.0 23.7 13.6 -44.8 52 52 A I T 3 S+ 0 0 5 327,-0.8 -1,-0.1 1,-0.3 328,-0.1 0.692 129.6 53.8 -67.5 -15.3 21.2 11.5 -46.9 53 53 A Y T 3 S- 0 0 139 2,-0.1 -1,-0.3 376,-0.0 -2,-0.0 0.304 122.7-102.8 -97.6 4.6 20.4 14.6 -49.0 54 54 A G S < S+ 0 0 44 -3,-2.1 -2,-0.1 1,-0.3 -5,-0.0 0.598 73.0 143.9 84.2 12.7 24.0 15.3 -49.9 55 55 A K - 0 0 113 1,-0.1 -4,-2.9 -15,-0.0 -1,-0.3 -0.722 54.5-109.7 -85.1 133.1 24.5 18.2 -47.4 56 56 A P E - E 0 50B 6 0, 0.0 -15,-1.9 0, 0.0 2,-0.3 -0.296 36.0-167.1 -67.5 144.3 28.0 18.3 -45.8 57 57 A C E -CE 40 49B 0 -8,-2.7 -8,-0.5 -17,-0.3 2,-0.4 -0.936 16.2-137.3-127.8 150.8 28.4 17.5 -42.1 58 58 A T E -C 39 0B 54 -19,-3.0 -19,-1.9 -2,-0.3 2,-0.4 -0.895 24.9-126.7-103.7 140.8 31.2 17.9 -39.6 59 59 A R E -C 38 0B 114 -2,-0.4 2,-0.6 -21,-0.2 -21,-0.2 -0.716 17.2-156.7 -86.6 133.5 31.9 15.0 -37.2 60 60 A K E -C 37 0B 82 -23,-3.4 -23,-2.0 -2,-0.4 2,-0.5 -0.952 3.7-158.1-113.2 115.6 31.9 15.8 -33.5 61 61 A L E -C 36 0B 96 -2,-0.6 2,-0.3 -25,-0.2 -25,-0.2 -0.802 12.4-151.2 -92.7 127.6 33.9 13.4 -31.3 62 62 A F - 0 0 22 -27,-2.3 3,-0.1 -2,-0.5 4,-0.0 -0.775 20.7-131.8-104.1 146.7 32.8 13.4 -27.6 63 63 A A S S- 0 0 66 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.764 90.9 -9.7 -60.9 -27.8 35.0 12.6 -24.6 64 64 A N S > S- 0 0 39 -29,-0.1 4,-1.5 1,-0.1 3,-0.2 -0.973 75.2 -95.6-164.1 170.1 32.2 10.3 -23.4 65 65 A M H > S+ 0 0 0 -32,-0.3 4,-2.2 -2,-0.3 5,-0.2 0.834 118.6 56.3 -66.5 -34.5 28.6 9.2 -24.1 66 66 A R H > S+ 0 0 153 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.885 104.9 52.9 -64.7 -38.4 27.1 11.6 -21.5 67 67 A D H > S+ 0 0 71 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.900 109.5 49.5 -61.3 -41.2 28.7 14.5 -23.2 68 68 A A H X S+ 0 0 0 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.913 110.8 48.6 -63.8 -45.5 27.1 13.4 -26.5 69 69 A S H X S+ 0 0 47 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.897 111.5 50.5 -61.8 -41.2 23.7 13.1 -25.0 70 70 A Q H X S+ 0 0 93 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.856 107.0 54.9 -64.8 -36.0 24.1 16.6 -23.4 71 71 A W H X S+ 0 0 26 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.908 104.0 53.8 -64.3 -43.0 25.1 18.0 -26.8 72 72 A I H X S+ 0 0 34 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.935 108.9 50.4 -54.6 -47.2 21.9 16.6 -28.4 73 73 A K H X S+ 0 0 123 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.913 111.1 47.1 -56.9 -48.2 19.9 18.4 -25.6 74 74 A R H X S+ 0 0 129 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.852 107.4 56.9 -66.5 -34.6 21.7 21.8 -26.2 75 75 A M H X>S+ 0 0 16 -4,-2.5 5,-2.9 2,-0.2 4,-2.3 0.868 107.9 48.4 -62.6 -36.7 21.2 21.4 -30.0 76 76 A E H <5S+ 0 0 146 -4,-1.8 -2,-0.2 3,-0.2 -1,-0.2 0.900 109.2 53.5 -65.4 -42.8 17.4 21.2 -29.3 77 77 A D H <5S+ 0 0 130 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.872 114.4 41.2 -58.0 -40.0 17.7 24.3 -27.1 78 78 A I H <5S- 0 0 122 -4,-2.2 -2,-0.2 2,-0.1 -1,-0.2 0.859 115.4-116.5 -76.6 -37.5 19.4 26.2 -29.9 79 79 A G T <5 + 0 0 63 -4,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.753 68.2 128.4 102.5 36.6 17.0 24.8 -32.6 80 80 A L < - 0 0 100 -5,-2.9 -1,-0.3 -6,-0.1 2,-0.2 -0.942 63.0-101.5-126.8 146.6 19.5 22.8 -34.7 81 81 A E - 0 0 35 -2,-0.3 2,-0.7 1,-0.1 -41,-0.4 -0.431 24.1-155.1 -67.2 128.0 19.5 19.2 -36.0 82 82 A A - 0 0 5 -2,-0.2 -43,-0.2 -43,-0.1 2,-0.1 -0.914 23.5-160.2-103.3 103.1 21.8 16.9 -34.1 83 83 A L B +D 38 0B 1 -45,-2.2 -45,-2.5 -2,-0.7 2,-0.1 -0.429 37.0 52.7 -88.8 158.1 22.5 14.1 -36.7 84 84 A G S S- 0 0 5 296,-2.0 2,-0.8 -47,-0.2 -47,-0.1 -0.387 93.3 -37.2 112.0 170.8 23.8 10.6 -36.2 85 85 A M - 0 0 5 -49,-0.2 6,-0.1 1,-0.2 -49,-0.1 -0.590 47.4-176.0 -72.8 107.5 23.1 7.4 -34.3 86 86 A D + 0 0 84 -2,-0.8 2,-1.1 1,-0.1 -1,-0.2 0.615 68.9 80.5 -84.4 -16.2 21.9 8.5 -30.9 87 87 A D S >> S- 0 0 25 1,-0.2 4,-1.2 -3,-0.0 3,-1.1 -0.805 71.8-165.8 -86.8 95.5 21.6 5.0 -29.6 88 88 A F H 3> S+ 0 0 2 -2,-1.1 4,-2.8 1,-0.3 -1,-0.2 0.777 78.7 61.9 -64.5 -28.4 25.3 4.7 -28.8 89 89 A K H 3> S+ 0 0 35 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.864 102.7 52.1 -67.1 -30.6 25.4 0.9 -28.4 90 90 A L H <> S+ 0 0 2 -3,-1.1 4,-2.0 2,-0.2 -1,-0.2 0.886 110.6 48.1 -66.1 -38.5 24.2 0.5 -32.0 91 91 A A H X S+ 0 0 10 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.913 110.1 52.7 -67.1 -41.5 27.1 2.8 -33.1 92 92 A Y H X S+ 0 0 6 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.938 110.5 46.7 -56.7 -49.2 29.4 0.7 -30.9 93 93 A L H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.879 110.5 53.4 -62.0 -38.8 28.3 -2.5 -32.6 94 94 A S H < S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.867 114.5 41.1 -64.4 -38.1 28.6 -0.9 -36.0 95 95 A D H < S+ 0 0 86 -4,-2.1 3,-0.5 1,-0.1 -2,-0.2 0.851 119.1 44.0 -74.5 -40.1 32.2 0.1 -35.2 96 96 A T H < S+ 0 0 46 -4,-2.6 2,-0.2 1,-0.2 -2,-0.2 0.783 122.6 36.4 -80.5 -28.8 33.3 -3.1 -33.5 97 97 A Y < + 0 0 1 -4,-2.4 2,-1.9 -5,-0.2 -1,-0.2 -0.546 67.3 163.4-125.0 64.4 31.6 -5.5 -36.1 98 98 A N + 0 0 83 -3,-0.5 2,-0.3 -2,-0.2 -4,-0.1 -0.362 57.5 60.2 -85.3 58.6 32.1 -3.7 -39.4 99 99 A Y S S- 0 0 63 -2,-1.9 2,-0.5 -5,-0.0 -3,-0.0 -0.949 103.9 -68.3-166.1 165.8 31.4 -6.9 -41.5 100 100 A E - 0 0 162 -2,-0.3 2,-0.3 1,-0.1 250,-0.1 -0.562 61.9-120.0 -65.6 118.7 28.5 -9.3 -42.1 101 101 A I - 0 0 19 -2,-0.5 2,-0.6 248,-0.4 -97,-0.1 -0.454 24.7-165.4 -69.6 125.8 28.3 -11.2 -38.8 102 102 A K - 0 0 167 -2,-0.3 2,-0.3 -99,-0.3 -100,-0.1 -0.972 17.8-170.0-105.5 114.5 28.8 -14.9 -38.9 103 103 A Y - 0 0 43 -2,-0.6 2,-0.6 -99,-0.0 3,-0.1 -0.780 21.3-144.3-109.5 155.8 27.6 -16.4 -35.6 104 104 A D > - 0 0 48 -2,-0.3 3,-1.8 1,-0.1 4,-0.3 -0.945 6.9-162.8-118.8 104.7 28.0 -19.8 -34.2 105 105 A H G > S+ 0 0 117 -2,-0.6 3,-1.3 1,-0.3 -1,-0.1 0.746 85.1 69.6 -60.2 -25.9 24.8 -20.7 -32.2 106 106 A T G 3 S+ 0 0 78 1,-0.3 -1,-0.3 -3,-0.1 -3,-0.0 0.690 99.0 50.3 -68.7 -17.6 26.6 -23.6 -30.4 107 107 A K G < S+ 0 0 76 -3,-1.8 2,-0.6 2,-0.1 -1,-0.3 0.463 91.0 93.6 -94.7 -7.6 28.6 -20.9 -28.5 108 108 A I S < S- 0 0 0 -3,-1.3 2,-0.9 -4,-0.3 33,-0.0 -0.798 75.9-134.3 -93.3 120.7 25.6 -18.9 -27.4 109 109 A R - 0 0 36 -2,-0.6 102,-2.7 100,-0.2 103,-1.9 -0.629 25.1-174.4 -78.0 106.5 24.2 -19.9 -24.0 110 110 A V E -g 212 0C 17 -2,-0.9 31,-2.0 101,-0.2 2,-0.4 -0.914 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<> S+ 0 0 12 -3,-1.8 4,-2.6 2,-0.1 -2,-0.2 0.443 99.8 98.8-122.5 -4.5 -20.1 -23.6 -10.1 859 859 A K H X S+ 0 0 51 -4,-1.5 4,-2.9 1,-0.2 5,-0.2 0.907 84.7 50.1 -53.7 -50.8 -19.5 -26.1 -13.0 860 860 A D H X S+ 0 0 100 -4,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.888 112.9 47.4 -57.1 -41.7 -22.5 -28.2 -12.3 861 861 A D H > S+ 0 0 59 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.891 111.1 50.5 -68.4 -41.7 -24.8 -25.1 -12.2 862 862 A V H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 3,-0.2 0.957 111.9 48.5 -58.7 -50.4 -23.3 -23.8 -15.5 863 863 A L H < S+ 0 0 67 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.882 113.1 47.4 -56.4 -42.5 -23.8 -27.2 -17.1 864 864 A H H < S+ 0 0 118 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.826 120.7 36.6 -68.6 -32.3 -27.4 -27.3 -15.9 865 865 A W H < S+ 0 0 57 -4,-1.9 -29,-2.9 -3,-0.2 -2,-0.2 0.468 79.9 130.3-106.6 -4.6 -28.3 -23.7 -17.0 866 866 A M B < -A 835 0J 0 -4,-1.8 2,-1.3 -31,-0.2 -31,-0.3 -0.253 59.2-129.8 -47.7 130.4 -26.3 -23.4 -20.3 867 867 A D > + 0 0 27 -33,-2.5 4,-2.3 1,-0.2 5,-0.1 -0.692 32.0 173.7 -93.0 89.9 -28.6 -22.1 -23.0 868 868 A Y H > S+ 0 0 51 -2,-1.3 4,-2.5 1,-0.2 5,-0.2 0.837 76.5 57.3 -63.0 -36.2 -28.0 -24.5 -25.9 869 869 A T H > S+ 0 0 91 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.939 111.4 40.9 -62.5 -47.8 -30.8 -22.9 -28.0 870 870 A V H > S+ 0 0 48 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.930 113.6 54.5 -65.1 -46.0 -29.1 -19.4 -27.9 871 871 A L H X S+ 0 0 5 -4,-2.3 4,-2.4 1,-0.2 5,-0.4 0.917 111.5 44.8 -52.4 -49.9 -25.6 -20.9 -28.4 872 872 A L H X>S+ 0 0 9 -4,-2.5 5,-2.6 1,-0.2 4,-1.9 0.928 114.2 48.1 -63.8 -48.5 -26.7 -22.7 -31.5 873 873 A E H <>S+ 0 0 98 -4,-2.3 5,-2.6 3,-0.2 -2,-0.2 0.931 118.6 38.9 -58.7 -47.1 -28.6 -19.8 -33.0 874 874 A K H <5S+ 0 0 101 -4,-2.9 -2,-0.2 3,-0.2 -1,-0.2 0.894 126.8 29.1 -74.7 -43.3 -25.8 -17.3 -32.4 875 875 A T H <5S+ 0 0 17 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.2 0.736 135.4 16.2 -94.2 -25.4 -22.7 -19.3 -33.2 876 876 A F T X5S+ 0 0 0 -4,-1.9 4,-2.5 -5,-0.4 -3,-0.2 0.805 122.6 42.2-115.1 -59.4 -24.0 -21.8 -35.8 877 877 A I H > S+ 0 0 11 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.938 115.5 50.9 -63.4 -43.1 -23.4 -17.8 -39.7 880 880 A L H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.904 107.0 53.6 -58.8 -43.2 -24.7 -20.8 -41.7 881 881 A E H X S+ 0 0 88 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.853 108.8 51.5 -57.1 -37.9 -27.7 -18.7 -42.8 882 882 A G H X S+ 0 0 27 -4,-1.5 4,-1.8 -5,-0.2 -2,-0.2 0.916 111.4 45.4 -64.2 -46.0 -25.2 -16.1 -44.1 883 883 A F H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.920 117.0 44.3 -63.2 -46.5 -23.2 -18.7 -46.0 884 884 A T H X>S+ 0 0 2 -4,-2.9 5,-2.6 2,-0.2 4,-0.7 0.879 111.6 50.6 -72.3 -40.3 -26.3 -20.4 -47.6 885 885 A S H ><5S+ 0 0 65 -4,-2.3 3,-0.7 -5,-0.2 -1,-0.2 0.918 113.0 48.3 -62.2 -41.8 -28.1 -17.2 -48.5 886 886 A A H 3<5S+ 0 0 10 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.919 114.7 45.0 -60.6 -43.5 -25.0 -15.9 -50.2 887 887 A A H 3<5S- 0 0 0 -4,-2.0 -1,-0.2 -485,-0.2 -484,-0.2 0.467 111.6-121.1 -82.4 -3.5 -24.6 -19.2 -52.0 888 888 A K T <<5S+ 0 0 137 -4,-0.7 2,-0.3 -3,-0.7 -3,-0.2 0.928 71.6 126.3 61.8 51.3 -28.3 -19.3 -53.0 889 889 A L < - 0 0 7 -5,-2.6 2,-0.5 -6,-0.1 -1,-0.2 -0.895 57.1-128.3-138.1 153.1 -28.7 -22.6 -51.1 890 890 A D - 0 0 75 -2,-0.3 -129,-0.2 1,-0.1 -130,-0.1 -0.945 5.6-163.7-111.8 131.2 -31.0 -24.0 -48.4 891 891 A Y S S+ 0 0 36 -2,-0.5 2,-0.4 1,-0.1 -126,-0.2 0.596 85.4 51.2 -83.4 -11.6 -29.7 -25.7 -45.3 892 892 A E S S- 0 0 106 -128,-0.1 2,-0.2 -127,-0.0 -1,-0.1 -0.993 98.8-106.6-125.3 135.5 -33.2 -27.1 -44.6 893 893 A K - 0 0 158 -2,-0.4 2,-0.1 -132,-0.1 3,-0.1 -0.400 34.4-135.1 -65.1 122.1 -35.2 -29.0 -47.3 894 894 A K - 0 0 151 -2,-0.2 -1,-0.1 1,-0.1 -4,-0.0 -0.460 29.4 -94.5 -73.7 148.0 -38.1 -26.8 -48.6 895 895 A A - 0 0 88 -2,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.296 48.9-178.1 -59.8 144.8 -41.6 -28.4 -49.1 896 896 A S > - 0 0 53 -3,-0.1 3,-1.1 1,-0.0 4,-0.1 -0.877 43.4 -98.8-138.9 173.7 -42.4 -29.8 -52.5 897 897 A L G > S+ 0 0 148 -2,-0.3 3,-1.2 1,-0.2 -2,-0.0 0.716 114.4 69.8 -67.8 -21.1 -45.2 -31.4 -54.4 898 898 A F G > S+ 0 0 167 1,-0.2 3,-2.4 2,-0.1 -1,-0.2 0.742 77.3 79.1 -68.2 -24.8 -43.7 -34.8 -53.9 899 899 A D G < S+ 0 0 104 -3,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.632 80.3 70.9 -56.7 -15.0 -44.5 -34.6 -50.1 900 900 A M G < 0 0 162 -3,-1.2 -1,-0.3 -4,-0.1 -2,-0.1 0.399 360.0 360.0 -84.1 1.6 -48.0 -35.6 -51.2 901 901 A F < 0 0 214 -3,-2.4 -3,-0.0 0, 0.0 0, 0.0 -0.960 360.0 360.0-118.4 360.0 -46.7 -39.1 -52.0