==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 21-FEB-12 4DTX . COMPND 2 MOLECULE: DNA POLYMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE RB69; . AUTHOR S.XIA,J.WANG,W.H.KONIGSBERG . 901 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41832.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 624 69.3 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 . 119 13.2 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 . 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 . 62 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 79 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 310 34.4 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 3 2 0 2 2 3 1 1 1 2 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 . 4 4 2 3 4 3 3 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 . 3 5 0 0 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 0 102 0, 0.0 2,-0.2 0, 0.0 23,-0.1 0.000 360.0 360.0 360.0 160.7 36.9 17.9 36.4 2 2 A K - 0 0 121 100,-0.1 2,-0.1 1,-0.1 18,-0.0 -0.566 360.0-115.0 -73.5 140.6 35.5 14.4 36.9 3 3 A E - 0 0 66 -2,-0.2 2,-0.3 100,-0.1 99,-0.2 -0.420 33.8-174.1 -76.0 154.2 34.4 12.8 33.7 4 4 A F E -A 20 0A 0 16,-1.5 16,-2.7 -2,-0.1 2,-0.0 -0.994 23.5-112.0-147.6 147.9 30.8 11.9 32.9 5 5 A Y E -A 19 0A 0 -2,-0.3 14,-0.3 14,-0.2 3,-0.1 -0.323 18.2-173.8 -70.9 155.6 28.9 10.1 30.1 6 6 A L E S- 0 0 0 12,-3.2 349,-0.4 1,-0.5 2,-0.3 0.691 72.5 -9.3-108.2 -55.0 26.5 11.8 27.7 7 7 A T E -A 18 0A 3 11,-1.5 11,-2.2 347,-0.1 -1,-0.5 -0.968 59.0-164.2-141.3 156.9 25.1 8.8 25.8 8 8 A V E +A 17 0A 0 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.998 10.6 173.9-142.9 142.7 25.8 5.1 25.6 9 9 A E E -A 16 0A 12 7,-1.9 7,-2.5 -2,-0.3 2,-0.5 -0.994 26.8-134.6-143.5 150.3 24.8 2.5 23.1 10 10 A Q E +A 15 0A 54 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.946 23.6 176.2 -99.8 125.2 25.4 -1.2 22.3 11 11 A I E > -A 14 0A 38 3,-2.8 3,-1.8 -2,-0.5 2,-0.2 -0.909 63.4 -60.8-127.3 102.4 26.1 -1.8 18.6 12 12 A G T 3 S- 0 0 21 -2,-0.4 53,-0.1 1,-0.3 -1,-0.0 -0.421 121.1 -12.1 57.3-123.2 26.9 -5.5 18.0 13 13 A D T 3 S+ 0 0 43 -2,-0.2 2,-0.4 52,-0.1 -1,-0.3 0.281 123.3 83.4 -92.3 12.8 30.1 -6.2 20.0 14 14 A S E < -A 11 0A 11 -3,-1.8 -3,-2.8 18,-0.2 2,-0.5 -0.892 64.0-144.9-119.1 144.9 30.9 -2.5 20.7 15 15 A I E -AB 10 31A 0 16,-2.7 16,-2.9 -2,-0.4 2,-0.6 -0.943 18.4-158.2 -96.3 125.1 29.9 0.1 23.2 16 16 A F E -AB 9 30A 37 -7,-2.5 -7,-1.9 -2,-0.5 2,-0.4 -0.945 16.8-177.8-103.1 122.7 29.7 3.5 21.6 17 17 A E E -AB 8 29A 0 12,-2.6 12,-2.3 -2,-0.6 2,-0.4 -0.972 21.5-162.1-126.6 130.8 29.9 6.2 24.2 18 18 A R E +AB 7 28A 2 -11,-2.2 -12,-3.2 -2,-0.4 -11,-1.5 -0.931 32.9 158.4-101.8 138.5 29.8 10.0 24.0 19 19 A Y E -AB 5 27A 16 8,-2.3 8,-2.9 -2,-0.4 2,-0.5 -0.957 46.1-110.7-152.3 166.8 31.3 11.7 27.1 20 20 A I E -AB 4 26A 2 -16,-2.7 -16,-1.5 -2,-0.3 6,-0.2 -0.935 41.1-143.5-101.5 123.7 32.8 14.8 28.6 21 21 A D > - 0 0 3 4,-2.7 3,-2.1 -2,-0.5 -17,-0.1 -0.130 33.4 -86.0 -83.0-178.5 36.5 14.2 29.4 22 22 A S T 3 S+ 0 0 56 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.662 128.7 53.6 -64.8 -14.2 38.5 15.4 32.4 23 23 A N T 3 S- 0 0 117 2,-0.1 -1,-0.3 0, 0.0 -21,-0.1 0.352 121.1-105.1 -99.7 3.3 39.3 18.7 30.5 24 24 A G S < S+ 0 0 10 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.614 75.7 136.4 83.7 14.4 35.6 19.4 29.8 25 25 A R - 0 0 164 1,-0.0 -4,-2.7 0, 0.0 2,-0.4 -0.721 57.3-117.9 -95.6 144.4 35.7 18.4 26.1 26 26 A E E +B 20 0A 70 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.668 43.0 170.5 -76.6 129.2 33.1 16.3 24.3 27 27 A R E -B 19 0A 121 -8,-2.9 -8,-2.3 -2,-0.4 2,-0.4 -0.865 23.9-146.0-131.1 165.7 34.6 13.0 23.0 28 28 A T E +B 18 0A 76 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.994 18.4 178.4-132.0 142.9 33.4 9.8 21.4 29 29 A R E -B 17 0A 69 -12,-2.3 -12,-2.6 -2,-0.4 2,-0.5 -0.995 23.3-144.9-142.0 151.4 34.8 6.3 21.9 30 30 A E E -B 16 0A 118 -2,-0.3 2,-0.4 -14,-0.2 -14,-0.2 -0.974 24.4-169.8-111.7 124.7 34.2 2.8 20.7 31 31 A V E -B 15 0A 44 -16,-2.9 -16,-2.7 -2,-0.5 2,-1.9 -0.965 26.1-141.4-123.1 129.6 35.0 0.1 23.4 32 32 A E - 0 0 165 -2,-0.4 2,-0.2 -18,-0.2 -18,-0.2 -0.543 36.5-163.6 -84.6 71.8 35.1 -3.6 22.9 33 33 A Y - 0 0 27 -2,-1.9 32,-0.3 -20,-0.1 59,-0.1 -0.392 13.3-150.6 -68.2 126.3 33.6 -4.2 26.3 34 34 A K - 0 0 111 -2,-0.2 29,-0.1 30,-0.1 2,-0.1 -0.875 20.5-152.9 -96.2 108.6 33.9 -7.7 27.7 35 35 A P - 0 0 1 0, 0.0 27,-2.5 0, 0.0 2,-0.4 -0.401 1.0-142.2 -82.5 160.2 30.9 -8.3 30.0 36 36 A S E +C 61 0B 31 25,-0.2 2,-0.2 49,-0.1 25,-0.2 -0.963 18.3 176.0-117.9 141.2 30.7 -10.6 33.0 37 37 A L E -C 60 0B 2 23,-2.1 23,-3.5 -2,-0.4 2,-0.3 -0.749 19.9-126.3-129.3-177.8 27.8 -12.8 34.1 38 38 A F E -CD 59 83B 26 45,-2.5 45,-2.2 -2,-0.2 2,-0.3 -0.948 14.7-168.7-138.8 147.2 27.4 -15.3 36.9 39 39 A A E -C 58 0B 12 19,-1.8 19,-2.9 -2,-0.3 43,-0.1 -0.968 38.0-101.0-127.6 150.8 26.5 -18.8 37.8 40 40 A H E -C 57 0B 80 41,-0.4 17,-0.3 -2,-0.3 10,-0.0 -0.387 45.3-167.4 -62.5 144.9 25.9 -20.5 41.2 41 41 A C - 0 0 20 15,-1.9 4,-0.1 4,-0.1 6,-0.0 -0.871 27.9 -71.5-133.0 169.4 28.9 -22.5 42.3 42 42 A P > - 0 0 74 0, 0.0 3,-0.8 0, 0.0 -1,-0.0 -0.283 37.3-123.8 -64.7 147.8 29.7 -25.1 45.0 43 43 A E T 3 S+ 0 0 142 1,-0.3 2,-0.3 13,-0.0 -2,-0.0 0.760 108.7 64.4 -59.1 -29.6 30.0 -24.0 48.6 44 44 A S T 3 S+ 0 0 124 2,-0.1 2,-0.4 1,-0.0 -1,-0.3 -0.150 85.0 95.7 -89.5 38.0 33.5 -25.5 48.8 45 45 A Q S < S- 0 0 92 -3,-0.8 2,-0.2 -2,-0.3 -4,-0.1 -0.962 77.2-121.5-137.2 118.2 34.8 -23.0 46.2 46 46 A A + 0 0 108 -2,-0.4 2,-0.3 10,-0.0 -2,-0.1 -0.356 48.6 146.1 -61.0 116.9 36.5 -19.7 47.1 47 47 A T - 0 0 41 -2,-0.2 11,-0.1 11,-0.1 -2,-0.0 -0.974 45.9-151.4-143.6 158.9 34.7 -16.7 45.6 48 48 A K S S+ 0 0 127 -2,-0.3 2,-0.5 9,-0.1 10,-0.1 0.435 76.2 91.4-103.4 -4.0 34.1 -13.1 46.6 49 49 A Y + 0 0 41 8,-0.5 8,-2.4 329,-0.1 2,-0.3 -0.804 50.6 172.6 -97.9 127.5 30.8 -13.0 44.7 50 50 A F E -Ef 56 378C 80 327,-1.4 329,-2.1 -2,-0.5 -10,-0.0 -0.978 29.1-123.0-130.0 144.0 27.5 -13.9 46.4 51 51 A D E > - f 0 379C 10 4,-2.9 3,-2.0 -2,-0.3 329,-0.2 -0.189 46.5 -89.4 -72.7 177.6 23.9 -13.6 45.2 52 52 A I T 3 S+ 0 0 6 327,-0.8 -1,-0.1 1,-0.3 328,-0.1 0.677 128.7 53.9 -69.9 -15.2 21.4 -11.6 47.3 53 53 A Y T 3 S- 0 0 140 2,-0.1 -1,-0.3 376,-0.0 -2,-0.0 0.297 122.4-103.2 -96.8 3.5 20.5 -14.6 49.4 54 54 A G S < S+ 0 0 43 -3,-2.0 -2,-0.1 1,-0.3 -5,-0.0 0.548 73.6 141.1 86.8 8.6 24.2 -15.3 50.3 55 55 A K - 0 0 114 1,-0.1 -4,-2.9 -15,-0.0 -1,-0.3 -0.702 55.4-109.1 -84.6 136.3 24.8 -18.2 47.9 56 56 A P B -E 50 0C 7 0, 0.0 -15,-1.9 0, 0.0 2,-0.3 -0.284 35.3-167.9 -68.1 147.5 28.3 -18.3 46.2 57 57 A C E -C 40 0B 0 -8,-2.4 -8,-0.5 -17,-0.3 2,-0.4 -0.977 16.5-135.5-134.4 146.9 28.7 -17.5 42.5 58 58 A T E -C 39 0B 48 -19,-2.9 -19,-1.8 -2,-0.3 2,-0.4 -0.847 24.8-126.4 -99.5 140.7 31.4 -17.8 39.9 59 59 A R E -C 38 0B 113 -2,-0.4 2,-0.5 -21,-0.2 -21,-0.2 -0.715 17.8-157.6 -86.0 132.4 32.1 -14.9 37.5 60 60 A K E -C 37 0B 83 -23,-3.5 -23,-2.1 -2,-0.4 2,-0.5 -0.953 4.1-158.0-111.5 118.4 32.1 -15.7 33.8 61 61 A L E -C 36 0B 95 -2,-0.5 2,-0.3 -25,-0.2 -25,-0.2 -0.836 11.8-150.2 -98.3 125.7 34.0 -13.3 31.6 62 62 A F - 0 0 22 -27,-2.5 3,-0.1 -2,-0.5 4,-0.0 -0.678 20.3-131.9-100.2 151.1 33.0 -13.3 27.9 63 63 A A S S- 0 0 66 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.723 90.7 -10.7 -67.7 -22.2 35.1 -12.5 24.9 64 64 A N S > S- 0 0 41 -29,-0.1 4,-1.5 1,-0.1 -1,-0.2 -0.972 75.0 -95.3-168.4 169.9 32.3 -10.2 23.6 65 65 A M H > S+ 0 0 0 -32,-0.3 4,-2.3 -2,-0.3 5,-0.2 0.827 118.5 56.5 -68.5 -32.9 28.7 -9.2 24.3 66 66 A R H > S+ 0 0 147 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.909 105.3 52.4 -64.4 -41.3 27.3 -11.6 21.7 67 67 A D H > S+ 0 0 74 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.895 109.4 50.2 -59.4 -41.4 28.9 -14.5 23.5 68 68 A A H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.921 110.6 48.7 -62.2 -46.4 27.3 -13.4 26.7 69 69 A S H X S+ 0 0 42 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.901 110.6 50.6 -60.3 -43.3 23.9 -13.1 25.2 70 70 A Q H X S+ 0 0 93 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.837 107.2 54.9 -65.2 -32.9 24.2 -16.6 23.6 71 71 A W H X S+ 0 0 23 -4,-1.7 4,-2.6 2,-0.2 5,-0.2 0.934 104.1 53.4 -66.9 -44.6 25.2 -18.0 27.0 72 72 A I H X S+ 0 0 32 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.936 109.2 50.3 -52.1 -47.8 22.1 -16.6 28.6 73 73 A K H X S+ 0 0 117 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.916 111.1 47.4 -58.5 -46.4 20.1 -18.5 25.9 74 74 A R H X S+ 0 0 134 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.866 107.4 56.3 -64.4 -37.3 21.9 -21.8 26.5 75 75 A M H X>S+ 0 0 16 -4,-2.6 5,-2.6 2,-0.2 4,-2.6 0.899 108.3 48.5 -61.1 -39.1 21.4 -21.5 30.3 76 76 A E H <5S+ 0 0 146 -4,-2.0 -2,-0.2 3,-0.2 -1,-0.2 0.919 109.0 53.3 -62.6 -44.2 17.6 -21.2 29.6 77 77 A D H <5S+ 0 0 131 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.830 114.5 41.6 -58.0 -34.6 17.9 -24.3 27.3 78 78 A I H <5S- 0 0 120 -4,-2.0 -2,-0.2 2,-0.1 -1,-0.2 0.841 114.8-118.2 -81.4 -36.4 19.6 -26.1 30.2 79 79 A G T <5 + 0 0 62 -4,-2.6 2,-0.3 1,-0.3 -3,-0.2 0.765 67.2 128.6 100.5 36.6 17.2 -24.7 32.8 80 80 A L < - 0 0 101 -5,-2.6 -1,-0.3 -6,-0.1 2,-0.2 -0.931 63.4 -99.8-125.8 147.9 19.6 -22.8 35.1 81 81 A E - 0 0 34 -2,-0.3 2,-0.7 1,-0.1 -41,-0.4 -0.444 24.9-156.1 -67.7 128.2 19.7 -19.3 36.4 82 82 A A - 0 0 6 -2,-0.2 -43,-0.2 -43,-0.1 2,-0.1 -0.917 23.4-159.2-102.9 103.5 22.0 -16.9 34.5 83 83 A L B +D 38 0B 1 -45,-2.2 -45,-2.5 -2,-0.7 2,-0.1 -0.458 37.3 48.7 -89.9 157.3 22.8 -14.2 37.1 84 84 A G S S- 0 0 6 296,-2.0 2,-0.8 -47,-0.2 -47,-0.1 -0.400 94.0 -34.5 110.5 173.6 24.0 -10.6 36.6 85 85 A M - 0 0 6 -49,-0.2 6,-0.1 1,-0.2 -49,-0.1 -0.582 46.8-177.1 -75.2 106.3 23.2 -7.4 34.6 86 86 A D + 0 0 86 -2,-0.8 2,-1.1 1,-0.1 -1,-0.2 0.600 68.5 81.7 -84.2 -14.2 22.1 -8.6 31.2 87 87 A D S >> S- 0 0 25 1,-0.2 4,-1.2 2,-0.0 3,-1.2 -0.802 71.1-166.3 -88.3 93.6 21.8 -5.0 29.9 88 88 A F H 3> S+ 0 0 2 -2,-1.1 4,-2.6 1,-0.3 -1,-0.2 0.763 78.1 61.2 -64.1 -28.6 25.5 -4.7 29.1 89 89 A K H 3> S+ 0 0 36 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.864 102.7 52.3 -67.4 -30.4 25.5 -0.9 28.7 90 90 A L H <> S+ 0 0 4 -3,-1.2 4,-2.0 2,-0.2 -1,-0.2 0.878 110.8 48.3 -68.1 -36.7 24.4 -0.5 32.3 91 91 A A H X S+ 0 0 13 -4,-1.2 4,-2.2 2,-0.2 -2,-0.2 0.909 109.5 53.1 -67.5 -42.1 27.2 -2.7 33.4 92 92 A Y H X S+ 0 0 8 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.938 110.4 46.7 -56.9 -48.8 29.6 -0.7 31.2 93 93 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.888 110.2 53.9 -61.9 -38.7 28.5 2.6 32.9 94 94 A S H < S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.871 113.9 41.1 -63.4 -38.3 28.8 1.0 36.3 95 95 A D H < S+ 0 0 88 -4,-2.2 3,-0.4 1,-0.1 -2,-0.2 0.813 119.8 44.1 -74.3 -36.7 32.5 -0.1 35.6 96 96 A T H < S+ 0 0 47 -4,-2.3 2,-0.3 1,-0.2 -2,-0.2 0.796 122.4 35.3 -83.0 -31.8 33.4 3.2 33.9 97 97 A Y < + 0 0 2 -4,-2.6 2,-1.7 -5,-0.2 -1,-0.2 -0.581 68.5 163.2-123.0 66.6 31.8 5.6 36.4 98 98 A N + 0 0 82 -3,-0.4 2,-0.3 -2,-0.3 -4,-0.1 -0.420 56.7 58.7 -87.7 62.0 32.3 3.8 39.7 99 99 A Y S S- 0 0 61 -2,-1.7 2,-0.5 -5,-0.0 -2,-0.0 -0.938 105.1 -66.0-169.1 167.8 31.5 6.9 41.9 100 100 A E - 0 0 157 -2,-0.3 2,-0.3 1,-0.1 250,-0.1 -0.582 61.5-120.7 -68.7 120.8 28.7 9.4 42.4 101 101 A I - 0 0 18 -2,-0.5 2,-0.6 248,-0.4 -97,-0.1 -0.461 24.6-166.1 -69.4 127.2 28.4 11.2 39.1 102 102 A K - 0 0 173 -2,-0.3 2,-0.3 -99,-0.2 -100,-0.1 -0.973 17.5-170.0-109.7 113.2 28.9 15.0 39.3 103 103 A Y - 0 0 44 -2,-0.6 2,-0.5 243,-0.0 -100,-0.1 -0.728 21.2-143.5-108.7 157.6 27.7 16.4 36.0 104 104 A D > - 0 0 49 -2,-0.3 3,-1.9 1,-0.1 4,-0.3 -0.940 6.9-162.5-121.7 102.7 28.0 19.9 34.5 105 105 A H G > S+ 0 0 121 -2,-0.5 3,-1.4 1,-0.3 -1,-0.1 0.768 85.1 69.8 -60.2 -26.2 24.9 20.9 32.5 106 106 A T G 3 S+ 0 0 82 1,-0.3 -1,-0.3 3,-0.1 0, 0.0 0.690 98.9 50.1 -66.2 -17.6 26.7 23.7 30.7 107 107 A K G < S+ 0 0 68 -3,-1.9 2,-0.6 2,-0.1 -1,-0.3 0.451 90.9 93.8 -96.0 -7.8 28.7 21.1 28.8 108 108 A I S < S- 0 0 0 -3,-1.4 2,-0.9 -4,-0.3 33,-0.0 -0.802 75.8-133.8 -93.6 121.4 25.7 19.0 27.7 109 109 A R - 0 0 37 -2,-0.6 102,-2.9 100,-0.2 103,-1.9 -0.626 25.2-174.4 -80.6 106.6 24.3 20.0 24.3 110 110 A V E -g 212 0D 18 -2,-0.9 31,-1.9 101,-0.2 2,-0.4 -0.901 5.2-164.3-103.1 118.5 20.5 20.3 24.6 111 111 A A E -gH 213 140D 0 101,-3.2 103,-3.0 -2,-0.6 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-0.436 53.6 -82.2 -66.8 143.1 -14.8 23.7 15.0 855 855 A T >> - 0 0 28 1,-0.1 4,-1.6 -33,-0.1 3,-1.3 -0.131 35.5-120.6 -53.6 142.8 -14.3 24.0 11.3 856 856 A D H 3> S+ 0 0 130 1,-0.3 4,-0.7 2,-0.2 -1,-0.1 0.776 105.2 70.9 -57.2 -33.6 -16.1 27.1 9.6 857 857 A L H 34 S+ 0 0 100 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.853 118.3 16.1 -48.7 -44.2 -18.1 24.8 7.3 858 858 A I H <> S+ 0 0 13 -3,-1.3 4,-2.5 2,-0.1 -1,-0.2 0.502 99.7 94.6-114.5 -6.3 -20.3 23.5 10.2 859 859 A K H X S+ 0 0 48 -4,-1.6 4,-2.7 1,-0.2 5,-0.2 0.905 85.2 53.1 -54.8 -47.9 -19.6 26.0 13.0 860 860 A D H X S+ 0 0 118 -4,-0.7 4,-1.9 1,-0.2 -1,-0.2 0.912 112.3 44.7 -52.8 -48.8 -22.7 28.1 12.1 861 861 A D H > S+ 0 0 71 2,-0.2 4,-1.6 -4,-0.2 -1,-0.2 0.847 111.0 53.6 -67.6 -36.1 -25.0 25.0 12.2 862 862 A V H X S+ 0 0 0 -4,-2.5 4,-1.6 2,-0.2 3,-0.4 0.965 110.0 47.5 -62.4 -50.2 -23.4 23.7 15.5 863 863 A L H < S+ 0 0 64 -4,-2.7 3,-0.2 1,-0.2 -2,-0.2 0.889 112.7 49.5 -57.7 -41.1 -24.0 27.1 17.2 864 864 A H H < S+ 0 0 118 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.815 119.3 36.7 -68.6 -31.2 -27.6 27.2 16.0 865 865 A W H < S+ 0 0 60 -4,-1.6 -29,-2.8 -3,-0.4 -1,-0.2 0.460 80.0 130.9-106.7 -3.6 -28.4 23.7 17.1 866 866 A M B < -A 835 0K 0 -4,-1.6 2,-1.2 -31,-0.2 -31,-0.2 -0.244 58.3-130.2 -48.5 131.4 -26.5 23.4 20.4 867 867 A D > + 0 0 27 -33,-2.5 4,-2.2 1,-0.2 5,-0.1 -0.705 31.6 173.5 -95.0 89.2 -28.7 22.0 23.1 868 868 A Y H > S+ 0 0 43 -2,-1.2 4,-2.2 1,-0.2 -1,-0.2 0.795 76.2 57.2 -63.3 -34.6 -28.2 24.4 26.1 869 869 A T H > S+ 0 0 75 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.945 111.1 41.7 -64.2 -46.9 -30.9 22.8 28.2 870 870 A V H > S+ 0 0 49 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.915 112.9 54.5 -65.4 -44.7 -29.3 19.4 28.1 871 871 A L H X S+ 0 0 5 -4,-2.2 4,-2.4 1,-0.2 5,-0.4 0.929 111.0 45.3 -54.2 -49.5 -25.8 20.9 28.6 872 872 A L H X>S+ 0 0 14 -4,-2.2 5,-2.5 2,-0.2 4,-1.7 0.908 113.8 47.9 -62.8 -45.5 -26.9 22.7 31.8 873 873 A E H <>S+ 0 0 104 -4,-2.1 5,-2.4 3,-0.2 -2,-0.2 0.929 118.2 39.8 -63.7 -45.9 -28.8 19.7 33.3 874 874 A K H <5S+ 0 0 103 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.885 126.3 29.0 -72.4 -44.6 -25.9 17.3 32.7 875 875 A T H <5S+ 0 0 19 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.2 0.732 134.9 16.1 -94.8 -24.1 -22.8 19.3 33.5 876 876 A F T X5S+ 0 0 0 -4,-1.7 4,-2.3 -5,-0.4 -3,-0.2 0.799 122.2 43.2-116.1 -58.3 -24.1 21.8 36.1 877 877 A I H > S+ 0 0 11 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.918 115.2 51.9 -63.5 -40.9 -23.5 17.7 40.1 880 880 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.924 106.3 53.8 -59.7 -43.5 -24.8 20.7 42.0 881 881 A E H X S+ 0 0 87 -4,-3.1 4,-2.1 1,-0.2 5,-0.2 0.878 108.5 51.4 -55.4 -40.0 -27.8 18.6 43.2 882 882 A G H X S+ 0 0 33 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.2 0.910 111.1 46.4 -62.1 -45.2 -25.3 16.1 44.4 883 883 A F H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.918 116.2 43.9 -62.8 -48.2 -23.3 18.7 46.4 884 884 A T H X>S+ 0 0 2 -4,-2.7 5,-2.6 2,-0.2 4,-0.5 0.847 111.2 51.8 -72.1 -38.0 -26.4 20.3 48.0 885 885 A S H ><5S+ 0 0 76 -4,-2.1 3,-0.8 -5,-0.3 -1,-0.2 0.921 111.8 48.6 -62.3 -43.5 -28.2 17.1 48.9 886 886 A A H 3<5S+ 0 0 10 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.933 114.5 45.1 -61.2 -43.9 -25.0 15.9 50.6 887 887 A A H 3<5S- 0 0 0 -4,-2.0 -1,-0.2 -485,-0.2 -2,-0.2 0.446 111.6-120.0 -83.0 0.9 -24.7 19.2 52.5 888 888 A K T <<5S+ 0 0 136 -3,-0.8 2,-0.3 -4,-0.5 -3,-0.2 0.925 72.5 122.5 60.6 48.7 -28.4 19.3 53.4 889 889 A L < - 0 0 13 -5,-2.6 2,-0.4 -6,-0.1 -1,-0.2 -0.909 57.9-127.2-133.8 159.3 -28.9 22.6 51.6 890 890 A D - 0 0 75 -2,-0.3 -129,-0.2 1,-0.1 -130,-0.1 -0.939 3.7-160.5-115.6 133.0 -31.2 23.9 48.8 891 891 A Y S S+ 0 0 39 -2,-0.4 2,-0.4 1,-0.1 -126,-0.2 0.575 87.0 50.8 -83.2 -9.6 -29.9 25.7 45.6 892 892 A E S S- 0 0 106 -128,-0.1 2,-0.2 -127,-0.0 -1,-0.1 -0.996 97.4-108.7-126.5 135.5 -33.4 27.1 45.1 893 893 A K - 0 0 162 -2,-0.4 2,-0.2 -132,-0.1 3,-0.1 -0.421 33.1-138.8 -64.9 124.5 -35.4 28.9 47.8 894 894 A K - 0 0 145 -2,-0.2 -1,-0.1 1,-0.1 -4,-0.0 -0.545 29.7 -90.0 -83.1 150.3 -38.4 26.8 49.0 895 895 A A - 0 0 84 -2,-0.2 2,-0.3 2,-0.0 -1,-0.1 -0.200 47.2-175.5 -58.1 145.0 -41.8 28.3 49.7 896 896 A S > - 0 0 51 -3,-0.1 3,-1.1 1,-0.0 4,-0.1 -0.888 42.5-102.3-135.1 169.6 -42.5 29.7 53.2 897 897 A L G > S+ 0 0 143 -2,-0.3 3,-1.0 1,-0.2 -2,-0.0 0.687 114.9 70.1 -66.1 -17.3 -45.5 31.2 55.1 898 898 A F G > S+ 0 0 165 1,-0.2 3,-2.6 2,-0.1 -1,-0.2 0.789 75.5 79.2 -70.8 -28.8 -43.9 34.7 54.5 899 899 A D G < S+ 0 0 101 -3,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.579 78.8 75.9 -52.2 -10.0 -44.6 34.6 50.8 900 900 A M G < 0 0 159 -3,-1.0 -1,-0.3 -4,-0.1 -2,-0.1 0.453 360.0 360.0 -84.1 -2.2 -48.1 35.5 51.9 901 901 A F < 0 0 213 -3,-2.6 -3,-0.0 0, 0.0 0, 0.0 -0.807 360.0 360.0-118.7 360.0 -46.9 39.1 52.5