==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 05-NOV-11 3UIQ . 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) . 41280.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 623 69.1 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 . 62 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 80 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 306 34.0 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 2 0 2 1 5 1 1 0 0 0 0 0 0 0 0 0 0 1 0 1 2 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 0 115 0, 0.0 2,-0.2 0, 0.0 23,-0.1 0.000 360.0 360.0 360.0 128.2 -36.7 -17.8 36.3 2 2 A K - 0 0 117 100,-0.1 18,-0.0 1,-0.1 2,-0.0 -0.578 360.0-105.4 -75.4 146.7 -35.6 -14.2 36.6 3 3 A E - 0 0 75 -2,-0.2 2,-0.3 100,-0.1 99,-0.2 -0.321 36.8-173.4 -69.5 153.1 -34.4 -12.6 33.4 4 4 A F E -A 20 0A 0 16,-1.6 16,-3.2 97,-0.1 2,-0.0 -0.982 22.9-115.2-146.4 145.7 -30.7 -11.9 32.7 5 5 A Y E -A 19 0A 0 -2,-0.3 14,-0.3 14,-0.2 3,-0.1 -0.316 17.6-172.8 -69.5 155.3 -28.9 -10.1 29.9 6 6 A L E S- 0 0 0 12,-3.4 349,-0.4 1,-0.5 2,-0.3 0.674 73.1 -7.1-108.9 -54.5 -26.5 -11.8 27.5 7 7 A T E -A 18 0A 1 11,-1.5 11,-2.2 347,-0.1 -1,-0.5 -0.968 59.1-163.8-139.7 156.7 -25.1 -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 11.4 173.4-141.1 142.3 -25.8 -5.1 25.5 9 9 A E E -A 16 0A 10 7,-1.8 7,-2.3 -2,-0.3 2,-0.5 -0.991 27.0-135.1-142.4 150.2 -24.8 -2.5 22.9 10 10 A Q E +A 15 0A 58 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.954 23.2 175.9-100.7 124.6 -25.4 1.2 22.2 11 11 A I E > -A 14 0A 38 3,-2.8 3,-1.8 -2,-0.5 2,-0.2 -0.882 63.4 -62.4-125.7 99.2 -26.1 1.9 18.5 12 12 A G T 3 S- 0 0 51 -2,-0.4 -1,-0.1 1,-0.3 53,-0.0 -0.450 119.7 -12.0 60.5-125.5 -26.9 5.5 18.1 13 13 A D T 3 S+ 0 0 47 -2,-0.2 2,-0.3 52,-0.1 -1,-0.3 0.335 123.8 83.0 -89.9 8.7 -30.1 6.3 20.0 14 14 A S E < -A 11 0A 12 -3,-1.8 -3,-2.8 18,-0.2 2,-0.5 -0.863 64.5-145.3-114.3 145.9 -30.9 2.6 20.6 15 15 A I E -AB 10 31A 0 16,-2.8 16,-3.0 -2,-0.3 2,-0.6 -0.944 16.7-158.0 -98.0 128.2 -29.9 -0.0 23.1 16 16 A F E -AB 9 30A 40 -7,-2.3 -7,-1.8 -2,-0.5 2,-0.4 -0.956 16.9-178.0-107.3 119.7 -29.7 -3.5 21.5 17 17 A E E -AB 8 29A 0 12,-2.7 12,-2.3 -2,-0.6 2,-0.4 -0.972 21.2-162.2-125.0 131.8 -29.9 -6.2 24.1 18 18 A R E +AB 7 28A 2 -11,-2.2 -12,-3.4 -2,-0.4 -11,-1.5 -0.918 33.0 157.8-102.2 138.9 -29.8 -9.9 23.9 19 19 A Y E -AB 5 27A 21 8,-2.3 8,-2.7 -2,-0.4 2,-0.5 -0.969 46.8-109.1-154.0 165.3 -31.2 -11.6 27.0 20 20 A I E -AB 4 26A 2 -16,-3.2 -16,-1.6 -2,-0.3 6,-0.2 -0.928 41.7-143.0 -99.1 122.5 -32.7 -14.7 28.5 21 21 A D > - 0 0 19 4,-3.0 3,-2.4 -2,-0.5 -17,-0.0 -0.157 33.4 -86.1 -81.0 179.0 -36.5 -14.1 29.2 22 22 A S T 3 S+ 0 0 55 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.632 128.4 54.3 -63.9 -12.3 -38.5 -15.4 32.2 23 23 A N T 3 S- 0 0 120 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.326 121.0-103.9-103.4 5.8 -39.2 -18.6 30.3 24 24 A G S < S+ 0 0 14 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.583 77.2 135.2 84.9 12.3 -35.5 -19.4 29.6 25 25 A R - 0 0 161 1,-0.0 -4,-3.0 -4,-0.0 2,-0.4 -0.722 58.1-118.4 -96.0 142.9 -35.6 -18.3 26.0 26 26 A E E +B 20 0A 68 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.658 42.5 169.7 -76.6 129.5 -33.1 -16.2 24.1 27 27 A R E -B 19 0A 118 -8,-2.7 -8,-2.3 -2,-0.4 2,-0.4 -0.858 23.5-146.6-133.6 165.0 -34.6 -13.0 22.8 28 28 A T E +B 18 0A 68 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.994 18.6 177.0-134.3 141.8 -33.4 -9.7 21.3 29 29 A R E -B 17 0A 79 -12,-2.3 -12,-2.7 -2,-0.4 2,-0.5 -0.990 24.2-142.3-142.9 154.7 -34.8 -6.3 21.7 30 30 A E E -B 16 0A 118 -2,-0.3 2,-0.4 -14,-0.2 -14,-0.2 -0.977 24.0-168.6-114.7 125.8 -34.1 -2.7 20.6 31 31 A V E -B 15 0A 43 -16,-3.0 -16,-2.8 -2,-0.5 2,-1.9 -0.968 25.7-142.2-123.5 129.1 -34.9 -0.1 23.3 32 32 A E - 0 0 164 -2,-0.4 -18,-0.2 -18,-0.2 2,-0.1 -0.501 37.2-166.5 -84.1 67.9 -35.1 3.7 22.8 33 33 A Y - 0 0 28 -2,-1.9 32,-0.3 1,-0.1 59,-0.1 -0.354 13.5-149.1 -66.7 129.0 -33.5 4.2 26.2 34 34 A K - 0 0 111 -2,-0.1 29,-0.1 30,-0.1 2,-0.1 -0.885 19.0-149.5-100.3 110.2 -33.7 7.7 27.6 35 35 A P - 0 0 1 0, 0.0 27,-2.6 0, 0.0 2,-0.4 -0.402 1.4-142.6 -79.7 156.6 -30.7 8.3 29.8 36 36 A S E +C 61 0B 29 25,-0.2 2,-0.3 49,-0.1 25,-0.2 -0.926 18.8 176.0-110.9 144.5 -30.5 10.6 32.8 37 37 A L E -C 60 0B 2 23,-2.3 23,-3.5 -2,-0.4 2,-0.3 -0.814 19.0-129.5-131.8 178.9 -27.6 12.8 33.9 38 38 A F E -CD 59 83B 26 45,-2.5 45,-2.2 -2,-0.3 2,-0.3 -0.943 14.6-169.0-138.1 149.8 -27.3 15.3 36.7 39 39 A A E -C 58 0B 10 19,-1.8 19,-3.1 -2,-0.3 43,-0.1 -0.968 36.7-101.4-130.6 150.9 -26.2 18.8 37.6 40 40 A H E -C 57 0B 82 41,-0.4 17,-0.2 -2,-0.3 10,-0.0 -0.404 44.2-172.0 -62.5 146.0 -25.6 20.5 40.9 41 41 A C - 0 0 20 15,-1.6 4,-0.1 -2,-0.1 -1,-0.0 -0.916 33.2 -70.1-137.6 164.9 -28.6 22.7 42.0 42 42 A P - 0 0 84 0, 0.0 -1,-0.0 0, 0.0 15,-0.0 -0.199 43.8-118.5 -57.3 148.3 -29.2 25.3 44.8 43 43 A E S S+ 0 0 124 1,-0.2 2,-2.5 3,-0.1 14,-0.1 0.798 102.0 80.5 -58.8 -32.2 -29.6 23.9 48.3 44 44 A S S S+ 0 0 117 2,-0.1 2,-0.3 12,-0.1 -1,-0.2 -0.363 75.7 117.1 -75.6 62.2 -33.2 25.1 48.6 45 45 A Q - 0 0 112 -2,-2.5 13,-0.0 -4,-0.1 -2,-0.0 -0.811 69.1-134.2-126.3 165.6 -34.6 22.2 46.6 46 46 A A + 0 0 107 -2,-0.3 2,-0.2 2,-0.0 -2,-0.1 -0.258 57.9 144.9-107.1 42.4 -36.9 19.2 47.0 47 47 A T - 0 0 36 1,-0.1 11,-0.1 2,-0.1 -2,-0.1 -0.489 45.1-160.2 -86.7 151.9 -34.5 16.8 45.3 48 48 A K S S+ 0 0 123 -2,-0.2 2,-0.5 9,-0.1 -1,-0.1 0.479 70.7 86.9-100.4 -7.8 -34.0 13.2 46.1 49 49 A Y E +E 57 0B 39 8,-0.5 8,-2.7 329,-0.1 2,-0.3 -0.830 50.4 172.3-104.1 130.1 -30.6 13.0 44.4 50 50 A F E -Ef 56 378B 86 327,-1.4 329,-2.3 -2,-0.5 -10,-0.0 -0.960 29.6-119.5-131.3 148.3 -27.3 13.9 46.1 51 51 A D E > - f 0 379B 9 4,-2.9 3,-2.0 -2,-0.3 329,-0.2 -0.178 45.5 -90.2 -75.7 179.3 -23.7 13.6 44.9 52 52 A I T 3 S+ 0 0 8 327,-0.8 -1,-0.1 1,-0.3 328,-0.1 0.732 129.8 52.9 -68.9 -17.9 -21.2 11.5 46.9 53 53 A Y T 3 S- 0 0 135 2,-0.1 -1,-0.3 376,-0.0 -2,-0.0 0.259 122.7-104.8 -95.5 7.3 -20.3 14.6 49.0 54 54 A G S < S+ 0 0 49 -3,-2.0 -2,-0.1 1,-0.3 -5,-0.0 0.594 71.6 144.3 79.6 11.5 -23.9 15.3 49.9 55 55 A K - 0 0 108 1,-0.1 -4,-2.9 -15,-0.0 -1,-0.3 -0.700 55.4-107.3 -82.1 135.1 -24.4 18.2 47.5 56 56 A P E - E 0 50B 10 0, 0.0 -15,-1.6 0, 0.0 2,-0.3 -0.297 37.3-165.4 -67.6 145.2 -27.9 18.3 46.0 57 57 A C E -CE 40 49B 0 -8,-2.7 -8,-0.5 -17,-0.2 2,-0.4 -0.945 15.8-139.0-129.1 148.3 -28.4 17.5 42.3 58 58 A T E -C 39 0B 53 -19,-3.1 -19,-1.8 -2,-0.3 2,-0.4 -0.912 24.8-128.2-104.2 136.7 -31.2 17.9 39.7 59 59 A R E -C 38 0B 112 -2,-0.4 2,-0.5 -21,-0.2 -21,-0.2 -0.678 16.5-157.2 -83.1 133.5 -31.9 15.0 37.4 60 60 A K E -C 37 0B 82 -23,-3.5 -23,-2.3 -2,-0.4 2,-0.5 -0.966 4.2-157.4-111.9 118.4 -31.9 15.8 33.7 61 61 A L E -C 36 0B 95 -2,-0.5 2,-0.3 -25,-0.2 -25,-0.2 -0.845 13.8-148.1 -97.3 123.2 -33.9 13.3 31.5 62 62 A F - 0 0 22 -27,-2.6 3,-0.1 -2,-0.5 4,-0.0 -0.696 19.4-133.3 -99.4 145.8 -32.9 13.3 27.9 63 63 A A S S- 0 0 65 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.799 90.6 -11.3 -58.6 -31.8 -35.0 12.6 24.8 64 64 A N S > S- 0 0 26 -29,-0.1 4,-1.6 1,-0.1 -1,-0.1 -0.968 74.1 -95.7-161.1 173.0 -32.2 10.3 23.6 65 65 A M H > S+ 0 0 0 -32,-0.3 4,-2.2 -2,-0.3 5,-0.2 0.848 118.9 56.1 -68.8 -34.6 -28.6 9.2 24.2 66 66 A R H > S+ 0 0 145 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.911 105.8 52.3 -63.6 -39.9 -27.1 11.6 21.6 67 67 A D H > S+ 0 0 55 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.908 109.5 49.8 -59.0 -43.4 -28.8 14.5 23.4 68 68 A A H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.908 111.8 47.6 -62.0 -44.5 -27.2 13.4 26.7 69 69 A S H X S+ 0 0 47 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.894 110.8 51.1 -64.3 -42.2 -23.8 13.1 25.1 70 70 A Q H X S+ 0 0 93 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.868 107.9 54.2 -62.5 -36.1 -24.1 16.5 23.5 71 71 A W H X S+ 0 0 25 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.920 103.8 53.8 -64.0 -46.0 -25.1 18.0 26.9 72 72 A I H X S+ 0 0 33 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.936 109.6 50.5 -51.2 -47.6 -21.9 16.5 28.5 73 73 A K H X S+ 0 0 101 -4,-1.8 4,-2.1 1,-0.2 3,-0.3 0.927 110.3 47.1 -56.0 -52.6 -19.9 18.4 25.7 74 74 A R H X S+ 0 0 129 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.825 106.4 58.7 -63.4 -32.0 -21.7 21.7 26.3 75 75 A M H X>S+ 0 0 16 -4,-2.4 5,-3.0 2,-0.2 4,-2.3 0.865 107.3 47.3 -66.1 -35.5 -21.1 21.4 30.1 76 76 A E H <5S+ 0 0 140 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.889 109.6 54.0 -66.2 -41.6 -17.4 21.2 29.4 77 77 A D H <5S+ 0 0 128 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.856 115.5 39.4 -57.9 -38.4 -17.8 24.2 27.0 78 78 A I H <5S- 0 0 118 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.820 115.2-119.4 -80.2 -34.4 -19.4 26.1 30.0 79 79 A G T <5 + 0 0 61 -4,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.795 66.4 128.2 97.4 38.1 -17.0 24.6 32.5 80 80 A L < - 0 0 102 -5,-3.0 -1,-0.3 -6,-0.1 2,-0.2 -0.946 63.6 -98.4-127.8 146.6 -19.4 22.8 34.8 81 81 A E - 0 0 45 -2,-0.3 2,-0.7 1,-0.1 -41,-0.4 -0.394 25.4-155.5 -66.1 129.0 -19.5 19.2 36.1 82 82 A A - 0 0 6 -2,-0.2 -43,-0.2 -43,-0.1 2,-0.2 -0.925 22.9-159.8-104.9 104.6 -21.8 16.8 34.2 83 83 A L B +D 38 0B 1 -45,-2.2 -45,-2.5 -2,-0.7 2,-0.1 -0.478 37.4 51.3 -91.4 155.8 -22.6 14.1 36.8 84 84 A G S S- 0 0 6 296,-2.0 2,-0.7 -47,-0.2 -47,-0.1 -0.397 93.8 -36.7 111.3 171.0 -23.9 10.5 36.3 85 85 A M - 0 0 6 -49,-0.2 6,-0.1 1,-0.2 -49,-0.1 -0.582 46.6-175.3 -74.3 109.8 -23.1 7.4 34.4 86 86 A D + 0 0 82 -2,-0.7 2,-1.1 1,-0.1 -1,-0.2 0.620 69.6 80.8 -84.5 -17.4 -21.9 8.5 30.9 87 87 A D S >> S- 0 0 24 1,-0.2 3,-1.2 -3,-0.0 4,-1.2 -0.801 71.8-165.4 -86.7 96.4 -21.7 4.9 29.6 88 88 A F H 3> S+ 0 0 2 -2,-1.1 4,-2.7 1,-0.3 -1,-0.2 0.753 78.7 60.5 -67.2 -26.5 -25.4 4.7 28.9 89 89 A K H 3> S+ 0 0 35 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.816 102.4 53.7 -71.1 -27.3 -25.5 0.9 28.5 90 90 A L H <> S+ 0 0 2 -3,-1.2 4,-2.0 2,-0.2 -1,-0.2 0.866 110.8 46.7 -67.8 -38.2 -24.3 0.5 32.1 91 91 A A H X S+ 0 0 12 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.899 110.2 53.4 -68.5 -42.1 -27.2 2.7 33.2 92 92 A Y H X S+ 0 0 7 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.936 110.6 46.5 -53.7 -48.9 -29.5 0.7 31.0 93 93 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.892 110.1 53.6 -65.1 -38.4 -28.4 -2.5 32.7 94 94 A S H < S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.901 114.0 41.5 -61.1 -42.8 -28.7 -0.9 36.1 95 95 A D H < S+ 0 0 86 -4,-2.3 3,-0.5 1,-0.2 -2,-0.2 0.854 119.1 43.9 -69.6 -39.6 -32.3 0.1 35.4 96 96 A T H < S+ 0 0 46 -4,-2.4 2,-0.2 1,-0.3 -2,-0.2 0.767 122.4 35.9 -82.3 -28.8 -33.4 -3.2 33.7 97 97 A Y < + 0 0 2 -4,-2.3 2,-1.7 -5,-0.2 -1,-0.3 -0.577 67.7 162.6-125.5 65.7 -31.7 -5.6 36.2 98 98 A N + 0 0 92 -3,-0.5 2,-0.3 -2,-0.2 -4,-0.1 -0.381 56.5 62.6 -86.7 58.5 -32.2 -3.8 39.5 99 99 A Y S S- 0 0 47 -2,-1.7 2,-0.4 -5,-0.0 -3,-0.0 -0.948 103.6 -69.5-167.4 160.9 -31.5 -6.9 41.6 100 100 A E - 0 0 166 -2,-0.3 2,-0.3 1,-0.1 250,-0.1 -0.498 61.8-122.2 -61.5 118.6 -28.6 -9.4 42.2 101 101 A I - 0 0 21 248,-0.4 2,-0.6 -2,-0.4 -1,-0.1 -0.496 24.9-167.0 -73.7 124.0 -28.4 -11.2 38.9 102 102 A K - 0 0 169 -2,-0.3 2,-0.3 -99,-0.2 -100,-0.1 -0.961 16.5-170.2-105.4 116.4 -28.8 -15.0 39.0 103 103 A Y - 0 0 40 -2,-0.6 2,-0.6 -99,-0.0 -100,-0.1 -0.742 20.5-142.3-108.4 157.4 -27.6 -16.4 35.7 104 104 A D > - 0 0 45 -2,-0.3 3,-1.6 1,-0.1 4,-0.3 -0.955 7.3-162.3-120.9 108.3 -28.0 -19.9 34.2 105 105 A H G > S+ 0 0 118 -2,-0.6 3,-1.2 1,-0.3 -1,-0.1 0.745 84.9 69.9 -67.3 -23.7 -24.8 -20.8 32.3 106 106 A T G 3 S+ 0 0 77 1,-0.3 -1,-0.3 3,-0.1 0, 0.0 0.718 99.8 50.0 -67.7 -19.7 -26.6 -23.7 30.4 107 107 A K G < S+ 0 0 76 -3,-1.6 2,-0.6 2,-0.1 -1,-0.3 0.488 91.2 93.1 -91.8 -10.2 -28.7 -21.0 28.5 108 108 A I S < S- 0 0 0 -3,-1.2 2,-0.9 -4,-0.3 33,-0.0 -0.784 76.6-133.5 -91.6 121.9 -25.6 -19.0 27.5 109 109 A R - 0 0 37 -2,-0.6 102,-2.8 100,-0.2 103,-1.9 -0.635 25.0-173.8 -79.3 105.7 -24.2 -19.9 24.1 110 110 A V E -g 212 0C 26 -2,-0.9 31,-1.8 101,-0.2 2,-0.4 -0.903 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48.5 726 726 A K E +U 710 0F 37 -16,-3.4 -16,-2.3 -2,-0.5 2,-0.5 -0.914 18.9 174.1-100.6 103.7 9.5 -22.2 48.6 727 727 A I E -U 709 0F 6 -2,-0.8 2,-0.4 -18,-0.2 -18,-0.2 -0.956 7.8-171.9-114.6 122.8 11.8 -20.3 46.3 728 728 A M E -U 708 0F 75 -20,-2.9 -20,-2.0 -2,-0.5 2,-0.6 -0.957 62.9 -12.8-117.5 134.7 11.1 -16.7 45.5 729 729 A G S S+ 0 0 35 -2,-0.4 -22,-0.1 -22,-0.2 -20,-0.1 0.039 93.4 125.2 77.3 -28.1 12.8 -14.4 42.9 730 730 A L S > S- 0 0 0 -2,-0.6 3,-2.7 -22,-0.4 4,-0.2 -0.146 80.4 -96.1 -65.3 164.0 15.7 -16.8 42.2 731 731 A E G > S+ 0 0 40 1,-0.3 3,-1.1 2,-0.2 6,-0.3 0.683 119.9 70.2 -60.3 -22.7 16.5 -17.9 38.6 732 732 A T G 3 S+ 0 0 12 1,-0.2 -1,-0.3 10,-0.1 10,-0.1 0.753 101.9 48.4 -59.9 -24.1 14.5 -21.2 39.1 733 733 A Q G < S+ 0 0 101 -3,-2.7 2,-0.4 9,-0.0 -1,-0.2 0.443 91.7 96.1 -99.3 -2.7 11.4 -19.0 39.2 734 734 A K X - 0 0 90 -3,-1.1 3,-1.3 -4,-0.2 8,-0.1 -0.786 63.9-146.8-101.0 131.2 12.1 -16.9 36.0 735 735 A S T 3 S+ 0 0 26 -2,-0.4 -1,-0.1 1,-0.2 4,-0.1 0.693 99.6 64.5 -63.0 -20.3 10.7 -17.7 32.6 736 736 A S T 3 S+ 0 0 39 45,-0.1 46,-1.7 2,-0.1 -1,-0.2 0.684 83.0 91.4 -76.7 -21.6 13.9 -16.3 31.1 737 737 A T S < S- 0 0 13 -3,-1.3 5,-0.1 -6,-0.3 43,-0.1 -0.590 92.3 -99.9 -75.9 134.1 16.0 -19.1 32.7 738 738 A P > - 0 0 1 0, 0.0 4,-2.4 0, 0.0 3,-0.3 -0.197 29.1-120.7 -55.7 144.8 16.6 -22.2 30.5 739 739 A K H > S+ 0 0 95 38,-0.4 4,-1.8 41,-0.3 40,-0.2 0.904 111.8 45.2 -54.7 -48.6 14.3 -25.1 31.4 740 740 A A H > S+ 0 0 13 38,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.793 113.3 52.1 -68.9 -27.8 17.1 -27.6 32.2 741 741 A V H > S+ 0 0 2 37,-0.6 4,-2.9 -3,-0.3 5,-0.2 0.835 105.0 53.7 -77.6 -37.7 18.9 -24.9 34.2 742 742 A Q H X S+ 0 0 27 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.933 112.2 47.5 -54.9 -47.1 15.8 -24.1 36.3 743 743 A K H X S+ 0 0 159 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.923 114.3 44.7 -63.1 -49.4 15.6 -27.9 37.1 744 744 A A H X S+ 0 0 1 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.914 114.0 48.7 -61.5 -47.8 19.4 -28.2 38.0 745 745 A L H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.877 109.7 53.6 -62.0 -37.0 19.4 -25.0 40.1 746 746 A K H X S+ 0 0 108 -4,-2.1 4,-3.0 -5,-0.2 -1,-0.2 0.915 109.5 47.5 -62.4 -43.9 16.3 -26.2 41.9 747 747 A E H X S+ 0 0 45 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.884 109.8 53.2 -65.0 -37.8 18.1 -29.5 42.7 748 748 A C H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.927 112.5 45.3 -58.8 -45.6 21.2 -27.6 43.9 749 749 A I H X S+ 0 0 0 -4,-2.4 4,-3.1 2,-0.2 5,-0.3 0.928 110.6 52.9 -64.4 -46.2 18.9 -25.6 46.2 750 750 A R H X S+ 0 0 58 -4,-3.0 4,-2.8 1,-0.2 5,-0.4 0.941 111.9 46.3 -52.9 -50.2 17.1 -28.7 47.4 751 751 A R H X>S+ 0 0 34 -4,-2.7 5,-3.4 2,-0.2 4,-2.3 0.913 112.7 50.0 -61.3 -45.0 20.4 -30.3 48.3 752 752 A M H <5S+ 0 0 0 -4,-2.4 -54,-2.4 3,-0.2 -2,-0.2 0.942 118.8 37.8 -54.7 -52.1 21.6 -27.1 50.0 753 753 A L H <5S+ 0 0 0 -4,-3.1 -54,-1.8 -56,-0.3 -2,-0.2 0.807 131.0 25.5 -73.6 -32.5 18.5 -26.8 52.1 754 754 A Q H <5S+ 0 0 27 -4,-2.8 -57,-0.8 -5,-0.3 -3,-0.2 0.753 134.8 16.8-106.0 -29.4 17.9 -30.5 52.9 755 755 A E T <5S- 0 0 76 -4,-2.3 -59,-0.6 -5,-0.4 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2,-0.3 0.407 95.0 17.9 -82.5 -1.3 27.9 -14.0 19.3 845 845 A C E -Y 834 0H 0 -11,-0.3 2,-0.3 -39,-0.1 -35,-0.1 -0.986 56.6-152.5-160.7 163.5 24.3 -15.2 19.6 846 846 A I E -Y 833 0H 0 -13,-2.4 -13,-2.4 -2,-0.3 2,-0.3 -0.993 9.4-164.8-141.7 145.6 21.1 -16.2 17.7 847 847 A A E +Y 832 0H 0 -40,-1.8 -15,-0.2 -2,-0.3 -36,-0.1 -0.957 8.1 175.4-130.9 148.7 17.4 -16.1 18.6 848 848 A W E -Y 831 0H 0 -17,-1.8 -17,-2.7 -2,-0.3 4,-0.1 -0.944 47.9 -60.8-146.8 165.7 14.3 -17.7 17.2 849 849 A P E > -Y 830 0H 21 0, 0.0 3,-0.9 0, 0.0 -19,-0.3 -0.215 58.8-118.7 -54.9 129.9 10.6 -17.9 18.0 850 850 A S T 3 S+ 0 0 15 -21,-2.4 -562,-0.1 1,-0.2 -21,-0.1 -0.276 95.3 34.1 -66.0 155.9 10.0 -19.5 21.4 851 851 A G T 3 S+ 0 0 30 1,-0.2 2,-0.3 -564,-0.1 -1,-0.2 0.515 107.2 94.4 75.2 6.2 8.0 -22.7 21.7 852 852 A T S < S- 0 0 53 -3,-0.9 2,-0.3 -4,-0.1 -1,-0.2 -0.901 78.4-114.0-130.4 155.0 9.4 -23.8 18.4 853 853 A E - 0 0 91 -2,-0.3 2,-0.1 -3,-0.1 3,-0.1 -0.673 48.5-104.5 -75.2 139.7 12.3 -25.9 16.9 854 854 A I - 0 0 2 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0 118 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.874 120.3 36.2 -64.2 -38.2 27.5 -27.2 15.9 865 865 A W H < S+ 0 0 51 -4,-2.2 -29,-2.8 -5,-0.1 -2,-0.2 0.532 80.0 131.1-102.0 -8.4 28.3 -23.7 17.0 866 866 A M B < -A 835 0J 2 -4,-2.0 2,-1.3 -31,-0.2 -31,-0.2 -0.196 59.1-130.4 -42.1 125.9 26.3 -23.4 20.3 867 867 A D > + 0 0 30 -33,-2.5 4,-2.0 1,-0.2 -1,-0.1 -0.679 31.8 174.4 -90.1 91.0 28.6 -22.0 22.9 868 868 A Y H > S+ 0 0 43 -2,-1.3 4,-2.3 1,-0.2 5,-0.2 0.802 75.8 57.4 -65.6 -32.5 28.1 -24.4 25.8 869 869 A T H > S+ 0 0 84 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.937 110.7 41.7 -66.1 -46.5 30.8 -22.8 28.0 870 870 A V H > S+ 0 0 48 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.902 113.5 54.7 -66.3 -41.2 29.2 -19.4 27.9 871 871 A L H X S+ 0 0 5 -4,-2.0 4,-2.5 2,-0.2 5,-0.4 0.927 111.5 43.5 -56.4 -50.9 25.8 -20.9 28.4 872 872 A L H X>S+ 0 0 11 -4,-2.3 5,-2.6 2,-0.2 4,-1.7 0.913 114.5 49.1 -63.6 -48.5 26.8 -22.7 31.5 873 873 A E H <>S+ 0 0 80 -4,-2.2 5,-2.6 3,-0.2 -2,-0.2 0.937 118.6 38.5 -55.5 -50.5 28.7 -19.8 33.0 874 874 A K H <5S+ 0 0 101 -4,-2.8 -2,-0.2 3,-0.2 -1,-0.2 0.876 126.2 29.5 -74.4 -42.4 25.9 -17.3 32.4 875 875 A T H <5S+ 0 0 18 -4,-2.5 -3,-0.2 -5,-0.3 -1,-0.2 0.723 134.9 16.7 -95.4 -22.3 22.8 -19.2 33.2 876 876 A F T X5S+ 0 0 0 -4,-1.7 4,-2.4 -5,-0.4 -3,-0.2 0.801 122.2 42.8-117.2 -60.3 24.0 -21.7 35.8 877 877 A I H > S+ 0 0 13 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.916 115.5 51.2 -63.7 -41.5 23.4 -17.7 39.8 880 880 A L H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.913 107.7 52.8 -59.0 -44.9 24.8 -20.7 41.7 881 881 A E H X S+ 0 0 87 -4,-3.4 4,-2.2 1,-0.2 5,-0.3 0.883 109.3 51.1 -56.1 -40.9 27.8 -18.6 42.9 882 882 A G H X S+ 0 0 27 -4,-1.8 4,-1.5 -5,-0.3 -2,-0.2 0.915 111.9 45.4 -59.8 -47.0 25.2 -16.1 44.1 883 883 A F H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.908 116.5 44.8 -63.9 -46.2 23.2 -18.7 46.1 884 884 A T H <>S+ 0 0 1 -4,-2.9 5,-2.5 2,-0.2 4,-0.4 0.857 111.1 49.9 -73.5 -38.3 26.3 -20.3 47.6 885 885 A S H ><5S+ 0 0 69 -4,-2.2 3,-0.7 -5,-0.3 -1,-0.2 0.892 112.5 49.9 -67.2 -37.2 28.2 -17.1 48.6 886 886 A A H 3<5S+ 0 0 9 -4,-1.5 -2,-0.2 -5,-0.3 -1,-0.2 0.929 113.7 44.9 -62.9 -42.5 25.0 -15.9 50.3 887 887 A A T 3<5S- 0 0 0 -4,-1.9 -1,-0.2 -485,-0.2 -2,-0.2 0.410 114.4-120.2 -83.8 1.2 24.6 -19.2 52.1 888 888 A K T < 5S+ 0 0 133 -3,-0.7 2,-0.3 -4,-0.4 -3,-0.2 0.947 72.5 107.2 58.5 55.0 28.3 -19.2 53.0 889 889 A L < - 0 0 10 -5,-2.5 2,-0.4 -132,-0.0 -1,-0.2 -0.973 64.0-111.7-153.4 169.1 29.3 -22.4 51.3 890 890 A D - 0 0 70 -2,-0.3 -129,-0.2 1,-0.1 -130,-0.1 -0.874 3.4-160.1-111.7 134.4 31.2 -23.8 48.3 891 891 A Y S S+ 0 0 35 -2,-0.4 2,-0.4 1,-0.1 -126,-0.2 0.618 89.0 51.5 -81.4 -13.3 29.8 -25.6 45.3 892 892 A E S S- 0 0 108 -128,-0.1 2,-0.3 -127,-0.0 -1,-0.1 -0.986 97.9-107.7-123.7 136.8 33.3 -27.0 44.7 893 893 A K - 0 0 151 -2,-0.4 2,-0.1 -132,-0.1 3,-0.1 -0.439 33.2-137.2 -65.9 121.9 35.4 -28.8 47.3 894 894 A K - 0 0 107 -2,-0.3 -1,-0.1 1,-0.1 -4,-0.0 -0.481 30.7 -92.4 -75.8 149.8 38.3 -26.6 48.5 895 895 A A - 0 0 87 -2,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.286 48.2-176.4 -61.6 144.4 41.7 -28.3 48.9 896 896 A S > - 0 0 54 -3,-0.1 3,-1.1 1,-0.0 4,-0.2 -0.863 43.0-100.3-136.0 174.1 42.6 -29.6 52.4 897 897 A L G > S+ 0 0 151 -2,-0.3 3,-0.7 1,-0.2 -2,-0.0 0.703 116.2 67.3 -69.4 -19.1 45.6 -31.2 54.2 898 898 A F G > S+ 0 0 160 1,-0.2 3,-1.8 2,-0.1 -1,-0.2 0.770 75.5 86.7 -68.2 -27.9 43.9 -34.6 53.7 899 899 A D G < S+ 0 0 100 -3,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.730 78.2 64.2 -47.4 -32.5 44.4 -34.5 49.9 900 900 A M G < 0 0 168 -3,-0.7 -1,-0.3 -4,-0.2 -2,-0.1 0.095 360.0 360.0 -84.1 23.7 47.9 -36.0 50.2 901 901 A F < 0 0 210 -3,-1.8 -3,-0.0 0, 0.0 0, 0.0 -0.991 360.0 360.0-124.2 360.0 46.3 -39.2 51.6