==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 07-JAN-04 1S1X . COMPND 2 MOLECULE: REVERSE TRANSCRIPTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR J.REN,C.E.NICHOLS,P.P.CHAMBERLAIN,D.K.STAMMERS . 943 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45792.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 624 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 41 4.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 130 13.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 7 0.7 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 . 75 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 92 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 251 26.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.6 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 1 4 1 0 1 0 1 0 3 1 3 2 0 2 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 1 4 1 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 . 7 2 6 3 1 4 4 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 1 4 2 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 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 2 A I 0 0 117 0, 0.0 112,-0.1 0, 0.0 111,-0.1 0.000 360.0 360.0 360.0-132.8 5.8 -50.0 46.8 2 3 A S - 0 0 7 110,-1.7 205,-0.2 205,-0.1 204,-0.1 -0.744 360.0-159.0-102.3 145.3 8.1 -50.3 43.7 3 4 A P + 0 0 89 0, 0.0 2,-0.3 0, 0.0 204,-0.1 -0.218 43.1 133.7-112.0 42.3 10.7 -52.9 42.8 4 5 A I - 0 0 18 202,-0.2 -2,-0.1 1,-0.1 153,-0.1 -0.701 69.7 -88.3 -96.9 146.1 13.0 -51.1 40.3 5 6 A E - 0 0 144 -2,-0.3 -1,-0.1 1,-0.1 111,-0.1 -0.258 51.9-125.4 -47.5 118.4 16.8 -51.1 40.3 6 7 A T - 0 0 21 109,-0.1 109,-0.1 1,-0.1 -1,-0.1 -0.311 23.2-106.8 -68.9 157.2 17.7 -48.1 42.5 7 8 A V - 0 0 16 107,-0.4 2,-0.7 1,-0.1 109,-0.3 -0.725 27.7-116.1 -90.8 130.0 20.1 -45.4 41.2 8 9 A P - 0 0 67 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.484 40.2-176.9 -68.9 108.8 23.7 -45.1 42.5 9 10 A V - 0 0 7 -2,-0.7 2,-0.3 107,-0.1 588,-0.0 -0.785 8.0-179.3-108.9 151.2 24.0 -41.7 44.3 10 11 A K - 0 0 147 -2,-0.3 70,-1.4 587,-0.1 2,-0.2 -0.991 30.9-107.0-147.5 146.6 27.1 -40.1 45.9 11 12 A L B -A 79 0A 28 -2,-0.3 68,-0.3 68,-0.2 3,-0.2 -0.479 56.6 -80.2 -74.3 144.1 27.8 -36.8 47.7 12 13 A K S S- 0 0 63 66,-1.5 -1,-0.2 -2,-0.2 68,-0.1 -0.083 73.8 -74.4 -40.3 141.3 29.7 -34.2 45.9 13 14 A P S S- 0 0 129 0, 0.0 2,-2.6 0, 0.0 -1,-0.1 -0.066 114.9 -3.9 -42.3 137.9 33.4 -35.2 46.1 14 15 A G S S+ 0 0 83 -3,-0.2 -2,-0.1 1,-0.1 -3,-0.1 -0.375 106.7 108.3 75.5 -68.9 34.7 -34.5 49.5 15 16 A M - 0 0 65 -2,-2.6 2,-0.3 1,-0.0 -1,-0.1 0.127 44.5-176.3 -41.5 156.0 31.5 -32.9 50.9 16 17 A D - 0 0 60 -3,-0.1 63,-0.1 63,-0.0 -1,-0.0 -0.960 27.4-122.4-154.7 147.4 29.4 -34.7 53.5 17 18 A G + 0 0 12 -2,-0.3 39,-0.5 1,-0.2 58,-0.1 -0.570 44.0 152.7-104.6 72.9 26.0 -33.8 55.1 18 19 A P - 0 0 59 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.910 47.7 -4.9 -61.5 -63.6 26.4 -33.7 58.9 19 20 A K + 0 0 142 36,-0.2 2,-0.5 2,-0.0 38,-0.1 -0.790 28.9 158.1-166.1 124.6 24.1 -31.4 60.9 20 21 A V - 0 0 47 36,-1.5 54,-0.0 -2,-0.3 0, 0.0 -0.961 54.0-122.2-127.4 104.0 21.4 -28.8 61.0 21 22 A K - 0 0 152 -2,-0.5 2,-0.1 1,-0.1 -2,-0.0 0.050 28.0 -91.2 -50.2 157.2 19.8 -29.2 64.4 22 23 A Q - 0 0 23 36,-0.1 -1,-0.1 1,-0.1 105,-0.1 -0.428 30.3-125.4 -73.9 144.5 16.1 -29.9 65.1 23 24 A W - 0 0 164 36,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 -0.702 27.9-129.3 -92.5 85.9 13.6 -27.1 65.6 24 25 A P - 0 0 97 0, 0.0 2,-0.2 0, 0.0 106,-0.0 -0.036 33.7-163.8 -39.0 120.2 11.9 -27.8 68.9 25 26 A L - 0 0 22 1,-0.2 104,-0.1 2,-0.0 35,-0.0 -0.626 22.5 -86.4-109.4 167.8 8.2 -27.6 68.2 26 27 A T > - 0 0 80 -2,-0.2 4,-1.6 1,-0.1 -1,-0.2 0.136 44.6-104.7 -57.6-178.0 5.0 -27.2 70.3 27 28 A E H > S+ 0 0 156 2,-0.2 4,-0.8 1,-0.2 5,-0.1 0.743 117.7 61.2 -85.1 -26.3 3.3 -30.3 71.7 28 29 A E H > S+ 0 0 126 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.807 114.1 35.3 -69.5 -31.0 0.5 -30.2 69.2 29 30 A K H > S+ 0 0 55 2,-0.2 4,-1.3 3,-0.1 5,-0.4 0.877 106.0 64.9 -89.0 -45.5 3.0 -30.6 66.3 30 31 A I H X S+ 0 0 4 -4,-1.6 4,-0.5 1,-0.3 -2,-0.2 0.773 116.2 34.7 -49.2 -26.1 5.5 -33.0 68.0 31 32 A K H X S+ 0 0 120 -4,-0.8 4,-1.5 2,-0.2 -1,-0.3 0.680 108.3 63.0-101.7 -24.2 2.7 -35.5 68.0 32 33 A A H X S+ 0 0 15 -4,-0.5 4,-0.7 -3,-0.2 -2,-0.2 0.533 113.4 39.9 -76.6 -7.0 1.0 -34.5 64.7 33 34 A L H X S+ 0 0 0 -4,-1.3 4,-2.0 2,-0.2 5,-0.2 0.660 106.6 61.7-106.2 -35.8 4.3 -35.6 63.1 34 35 A V H X S+ 0 0 33 -4,-0.5 4,-1.5 -5,-0.4 -2,-0.2 0.854 109.1 47.2 -58.6 -33.0 4.7 -38.6 65.4 35 36 A E H >X S+ 0 0 149 -4,-1.5 4,-1.7 2,-0.2 3,-0.5 0.997 110.1 45.4 -70.4 -71.2 1.4 -39.8 63.8 36 37 A I H 3X S+ 0 0 17 -4,-0.7 4,-1.7 1,-0.2 -2,-0.2 0.787 115.4 52.8 -43.3 -35.3 2.0 -39.2 60.1 37 38 A C H 3X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.913 98.6 57.1 -73.1 -45.9 5.4 -40.8 60.5 38 39 A T H X S+ 0 0 111 -4,-1.7 3,-2.1 1,-0.2 4,-1.7 0.987 107.2 41.7 -54.1 -74.9 2.3 -44.3 59.0 40 41 A M H 3X>S+ 0 0 10 -4,-1.7 5,-1.0 1,-0.3 4,-0.9 0.831 106.7 68.7 -44.4 -36.7 5.0 -44.1 56.4 41 42 A E H 3<5S+ 0 0 46 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.858 105.8 38.0 -53.1 -40.5 7.1 -46.3 58.8 42 43 A K H <<5S+ 0 0 169 -3,-2.1 -1,-0.2 -4,-1.1 -2,-0.2 0.922 107.3 60.9 -78.2 -48.0 4.8 -49.2 58.0 43 44 A E H <5S- 0 0 99 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.661 116.6-117.1 -54.8 -12.4 4.2 -48.5 54.3 44 45 A G T <5S+ 0 0 37 -4,-0.9 -3,-0.2 -5,-0.3 -1,-0.2 0.287 85.3 118.6 91.9 -8.4 7.9 -49.0 54.3 45 46 A K S + 0 0 38 -2,-0.1 3,-0.8 86,-0.1 -1,-0.1 -0.112 45.5 111.1 139.8 -37.7 19.4 -44.4 65.0 51 52 A P T 3 S- 0 0 101 0, 0.0 2,-0.1 0, 0.0 -2,-0.0 0.765 105.9 -15.1 -32.0 -48.8 21.9 -47.4 65.0 52 53 A E T 3 S+ 0 0 165 69,-0.0 69,-0.0 1,-0.0 -3,-0.0 -0.472 92.1 132.0-162.9 79.4 24.7 -45.2 63.5 53 54 A N < + 0 0 17 -3,-0.8 -4,-0.0 1,-0.1 69,-0.0 -0.783 17.1 166.6-146.1 103.0 23.6 -41.9 62.0 54 55 A P + 0 0 78 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 0.618 59.2 92.4 -81.9 -19.0 25.3 -38.5 62.6 55 56 A Y + 0 0 27 -36,-0.1 2,-0.2 66,-0.1 -36,-0.2 -0.308 53.2 174.7 -76.1 159.2 23.5 -36.7 59.8 56 57 A N - 0 0 10 -39,-0.5 -36,-1.5 66,-0.1 69,-0.3 -0.762 22.3-162.7-174.0 129.6 20.2 -34.9 60.3 57 58 A T E -c 125 0B 6 67,-1.8 69,-1.0 66,-0.3 2,-0.3 -0.822 34.1-110.8-109.9 147.2 17.7 -32.6 58.5 58 59 A P E -c 126 0B 5 0, 0.0 13,-2.3 0, 0.0 2,-0.3 -0.617 26.0-145.6 -81.3 135.2 15.1 -30.5 60.4 59 60 A V E -E 70 0C 0 67,-0.7 -36,-0.3 -2,-0.3 2,-0.3 -0.724 14.5-169.5 -98.5 148.2 11.4 -31.4 60.2 60 61 A F E -E 69 0C 44 9,-3.3 9,-1.6 -2,-0.3 2,-0.4 -0.799 14.1-140.2-127.8 170.4 8.5 -28.9 60.2 61 62 A A E -E 68 0C 5 -2,-0.3 2,-0.3 7,-0.2 7,-0.2 -0.975 19.3-168.1-137.2 120.0 4.8 -29.1 60.6 62 63 A I E -E 67 0C 80 5,-2.9 5,-2.0 -2,-0.4 -2,-0.0 -0.852 38.5 -74.5-116.0 149.1 2.4 -26.9 58.5 63 64 A K 0 0 178 -2,-0.3 -1,-0.1 3,-0.2 0, 0.0 -0.040 360.0 360.0 -35.5 113.2 -1.3 -26.2 58.7 64 65 A K 0 0 188 -3,-0.0 -1,-0.1 3,-0.0 -3,-0.0 -0.406 360.0 360.0 -61.5 360.0 -3.3 -29.2 57.5 65 ! 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 66 71 A W 0 0 81 0, 0.0 2,-0.3 0, 0.0 -3,-0.2 0.000 360.0 360.0 360.0 159.6 -1.3 -31.3 60.3 67 72 A R E -E 62 0C 122 -5,-2.0 -5,-2.9 -31,-0.0 2,-0.3 -0.977 360.0-123.8-135.0 148.2 1.2 -32.1 57.5 68 73 A K E -E 61 0C 23 -2,-0.3 2,-0.3 -7,-0.2 -7,-0.2 -0.720 19.5-177.1-102.5 146.5 5.0 -32.5 57.5 69 74 A L E -E 60 0C 95 -9,-1.6 -9,-3.3 -2,-0.3 2,-0.4 -0.949 11.5-153.7-131.4 146.1 7.8 -30.8 55.6 70 75 A V E -E 59 0C 12 75,-0.3 2,-1.2 -2,-0.3 -11,-0.2 -0.990 12.9-134.3-130.2 136.0 11.6 -31.6 55.7 71 76 A D > + 0 0 26 -13,-2.3 3,-0.7 -2,-0.4 4,-0.4 -0.618 38.0 153.1 -92.1 82.7 14.6 -29.3 55.0 72 77 A F T 3> + 0 0 2 -2,-1.2 4,-3.6 1,-0.2 5,-0.3 0.482 42.2 115.6 -81.8 -2.4 17.1 -31.2 52.8 73 78 A R H 3> S+ 0 0 187 1,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.800 85.5 39.3 -32.2 -39.9 18.0 -27.7 51.6 74 79 A E H <> S+ 0 0 73 -3,-0.7 4,-0.7 2,-0.2 3,-0.3 0.957 113.6 51.5 -75.4 -59.6 21.3 -28.7 53.3 75 80 A L H >4 S+ 0 0 6 -4,-0.4 3,-1.5 1,-0.2 4,-0.3 0.903 108.6 55.2 -44.2 -50.4 21.3 -32.3 52.1 76 81 A N H >< S+ 0 0 34 -4,-3.6 3,-2.2 1,-0.3 -1,-0.2 0.895 100.2 54.7 -53.3 -51.9 20.7 -31.1 48.5 77 82 A K H 3< S+ 0 0 95 -4,-1.2 -1,-0.3 -5,-0.3 -2,-0.2 0.592 111.6 46.7 -64.4 -7.6 23.7 -28.7 48.2 78 83 A R T << S+ 0 0 60 -3,-1.5 -66,-1.5 -4,-0.7 2,-0.3 0.332 94.5 100.2-111.4 3.6 26.0 -31.6 49.3 79 84 A T B < S-A 11 0A 0 -3,-2.2 -68,-0.2 -4,-0.3 3,-0.1 -0.716 83.8-102.2 -91.6 139.2 24.4 -34.0 46.8 80 85 A Q - 0 0 30 -70,-1.4 2,-0.2 -2,-0.3 -1,-0.1 -0.042 41.0-103.9 -52.7 161.7 26.0 -34.7 43.5 81 86 A D - 0 0 73 516,-0.1 2,-0.2 -70,-0.1 -1,-0.1 -0.623 40.3-156.4 -86.8 150.9 24.5 -33.0 40.5 82 87 A F - 0 0 26 -2,-0.2 2,-0.9 517,-0.1 515,-0.2 -0.622 34.4 -70.6-119.9-178.2 22.4 -35.2 38.2 83 88 A W - 0 0 60 513,-3.3 3,-0.1 -2,-0.2 517,-0.1 -0.662 67.9-107.9 -76.3 109.8 21.2 -35.2 34.6 84 89 A E - 0 0 87 -2,-0.9 2,-0.6 515,-0.2 -1,-0.1 0.232 23.9-110.9 -35.7 150.4 18.8 -32.2 34.4 85 90 A V - 0 0 48 1,-0.1 -1,-0.1 -3,-0.1 67,-0.1 -0.781 47.9 -98.3 -86.6 125.1 15.0 -32.7 34.1 86 91 A Q + 0 0 84 -2,-0.6 -1,-0.1 1,-0.2 -3,-0.0 -0.219 47.0 173.2 -48.2 113.6 14.1 -31.5 30.6 87 92 A L + 0 0 121 2,-0.1 2,-0.6 0, 0.0 -1,-0.2 0.440 57.6 95.6 -99.9 -4.5 12.8 -28.0 31.2 88 93 A G S S- 0 0 26 -3,-0.0 0, 0.0 587,-0.0 0, 0.0 -0.758 71.3-164.4 -80.2 125.3 12.7 -27.7 27.4 89 94 A I - 0 0 50 -2,-0.6 586,-0.2 1,-0.0 587,-0.1 -0.901 23.1 -92.0-129.6 154.5 9.0 -28.5 26.9 90 95 A P - 0 0 7 0, 0.0 585,-0.1 0, 0.0 584,-0.1 -0.207 36.4-148.8 -51.9 129.7 6.5 -29.6 24.2 91 96 A H > - 0 0 29 1,-0.1 3,-2.5 285,-0.1 4,-0.1 -0.882 19.8-122.6-106.4 136.0 4.7 -26.6 22.6 92 97 A P G > S+ 0 0 0 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 0.859 106.1 67.5 -40.7 -47.9 1.1 -27.2 21.3 93 98 A A G 3 S+ 0 0 2 1,-0.3 251,-0.1 219,-0.1 218,-0.0 0.618 99.5 51.1 -52.4 -16.1 1.9 -26.1 17.7 94 99 A G G < S+ 0 0 1 -3,-2.5 -1,-0.3 218,-0.1 2,-0.3 0.156 86.0 109.8-111.5 19.4 4.1 -29.2 17.3 95 100 A L < - 0 0 41 -3,-2.2 218,-3.3 -4,-0.1 2,-0.5 -0.652 64.7-125.8 -97.2 152.5 1.7 -31.9 18.4 96 101 A K B -f 313 0D 95 -2,-0.3 218,-0.1 216,-0.2 -2,-0.1 -0.848 34.0-106.7-100.4 126.7 0.0 -34.5 16.2 97 102 A K - 0 0 114 216,-0.5 134,-0.2 -2,-0.5 2,-0.2 -0.226 40.9-171.4 -53.2 131.1 -3.8 -34.7 16.4 98 103 A K - 0 0 35 132,-3.1 88,-0.2 131,-0.1 3,-0.1 -0.597 31.6-126.2-115.1 178.6 -5.0 -37.7 18.3 99 104 A K S S+ 0 0 140 86,-3.1 2,-0.3 1,-0.4 87,-0.2 0.676 92.2 2.7 -98.4 -24.1 -8.5 -39.1 18.7 100 105 A S E -G 185 0E 29 85,-1.0 85,-1.5 130,-0.2 -1,-0.4 -0.982 57.5-162.3-156.6 158.5 -8.2 -39.2 22.5 101 106 A V E -G 184 0E 30 -2,-0.3 83,-0.3 83,-0.2 2,-0.3 -0.903 10.5-168.2-151.0 116.3 -5.8 -38.2 25.2 102 107 A T E -G 183 0E 14 81,-3.5 81,-2.7 -2,-0.3 2,-0.4 -0.678 9.5-147.6-101.3 157.0 -6.0 -39.5 28.7 103 108 A I E -G 182 0E 9 114,-0.5 2,-0.6 -2,-0.3 114,-0.3 -0.996 5.1-162.4-128.1 135.2 -4.1 -38.1 31.6 104 109 A L - 0 0 1 77,-2.3 2,-1.2 -2,-0.4 77,-0.5 -0.934 5.1-158.7-119.0 106.1 -3.0 -40.3 34.5 105 110 A D - 0 0 63 -2,-0.6 3,-0.2 1,-0.2 75,-0.2 -0.711 7.4-174.6 -85.1 96.7 -2.1 -38.4 37.6 106 111 A V + 0 0 7 73,-1.4 2,-0.8 -2,-1.2 -1,-0.2 0.872 16.4 172.3 -58.4 -35.8 0.2 -40.8 39.5 107 112 A G + 0 0 26 72,-0.8 2,-1.7 -3,-0.1 3,-0.3 -0.534 61.2 55.4 66.3-107.3 0.2 -38.4 42.4 108 113 A D S S+ 0 0 98 -2,-0.8 101,-0.4 -3,-0.2 -1,-0.1 -0.357 74.7 123.2 -59.2 81.1 2.0 -40.4 45.1 109 114 A A >> + 0 0 3 -2,-1.7 3,-4.2 99,-0.1 4,-1.2 0.851 55.9 55.6-108.7 -64.7 5.2 -41.2 43.1 110 115 A Y G >4 S+ 0 0 26 -3,-0.3 33,-0.6 1,-0.3 3,-0.6 0.872 108.9 54.8 -39.1 -47.9 8.5 -40.1 44.7 111 116 A F G 34 S+ 0 0 43 1,-0.2 -1,-0.3 31,-0.1 -2,-0.1 0.413 103.8 57.6 -71.1 2.3 7.5 -42.2 47.7 112 117 A S G <4 S+ 0 0 11 -3,-4.2 -110,-1.7 -111,-0.1 -1,-0.2 0.766 90.2 81.4 -99.8 -33.7 7.0 -45.2 45.4 113 118 A V S << S- 0 0 5 -4,-1.2 30,-2.3 -3,-0.6 41,-0.1 -0.619 83.2-118.3 -82.1 127.9 10.6 -45.3 44.1 114 119 A P B -I 142 0F 15 0, 0.0 -107,-0.4 0, 0.0 28,-0.3 -0.224 23.3-129.5 -62.0 145.9 13.4 -46.9 46.1 115 120 A L - 0 0 1 26,-2.7 2,-2.3 -109,-0.1 -109,-0.1 -0.696 37.7 -88.9 -97.2 150.3 16.3 -44.8 47.3 116 121 A D >> - 0 0 20 -109,-0.3 3,-4.9 -2,-0.3 4,-0.6 -0.363 41.3-147.1 -59.8 79.1 19.9 -46.0 46.7 117 122 A E H >> S+ 0 0 95 -2,-2.3 3,-1.3 1,-0.3 4,-0.5 0.668 95.7 63.8 -12.7 -58.3 20.1 -47.9 50.0 118 123 A D H 34 S+ 0 0 112 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.791 109.7 39.7 -42.1 -36.3 23.8 -47.0 50.2 119 124 A F H X4 S+ 0 0 3 -3,-4.9 3,-1.0 1,-0.1 -1,-0.3 0.583 86.6 93.8 -94.5 -16.8 22.7 -43.3 50.5 120 125 A R H X< S+ 0 0 60 -3,-1.3 3,-3.1 -4,-0.6 4,-0.4 0.820 73.8 68.2 -49.6 -41.1 19.6 -43.5 52.8 121 126 A K G >< S+ 0 0 79 -4,-0.5 3,-2.4 1,-0.3 -1,-0.2 0.921 91.1 63.7 -44.5 -51.0 21.6 -42.8 56.0 122 127 A Y G < S+ 0 0 37 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.573 92.6 65.0 -52.9 -10.9 22.2 -39.3 54.7 123 128 A T G < S+ 0 0 0 -3,-3.1 -1,-0.3 -4,-0.2 -66,-0.3 0.638 70.6 135.4 -91.5 -11.7 18.4 -38.7 54.9 124 129 A A < + 0 0 0 -3,-2.4 -67,-1.8 -4,-0.4 15,-0.3 0.030 23.2 162.7 -41.3 135.0 18.1 -39.0 58.7 125 130 A F E -cD 57 138B 0 13,-2.0 13,-2.0 -69,-0.3 2,-0.3 -0.834 22.7-127.5-144.1 176.8 16.0 -36.3 60.4 126 131 A T E -cD 58 137B 27 -69,-1.0 -67,-0.7 -2,-0.3 11,-0.2 -0.967 3.3-138.3-141.8 155.5 14.3 -36.0 63.9 127 132 A I - 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0 0 2 -4,-0.1 4,-1.7 -5,-0.1 3,-1.3 -0.611 58.0-105.7 -75.5 106.2 46.4 15.0 2.3 537 543 A G T 34 S+ 0 0 1 -2,-0.8 2,-2.9 265,-0.6 271,-0.2 0.257 98.8 9.5 -28.8 146.9 44.6 17.9 0.7 538 544 A G T 3> S+ 0 0 0 1,-0.2 4,-2.0 -3,-0.1 -1,-0.3 -0.161 125.1 64.5 71.7 -48.8 41.4 19.1 2.4 539 545 A N H <> S+ 0 0 1 -2,-2.9 4,-2.0 -3,-1.3 -1,-0.2 0.872 98.7 49.9 -72.7 -39.4 42.1 16.8 5.3 540 546 A E H < S+ 0 0 58 -4,-1.7 4,-0.2 1,-0.2 -1,-0.2 0.757 111.1 56.0 -68.5 -22.7 45.3 18.6 6.4 541 547 A Q H >> S+ 0 0 55 -5,-0.3 4,-1.3 2,-0.2 3,-1.0 0.943 110.9 37.4 -73.4 -54.3 43.0 21.7 6.2 542 548 A V H 3X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.3 -2,-0.2 0.817 108.3 67.2 -67.9 -29.4 40.2 20.6 8.5 543 549 A D H 3< S+ 0 0 31 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.718 103.2 47.8 -62.3 -19.9 43.0 19.0 10.6 544 550 A K H X4 S+ 0 0 141 -3,-1.0 3,-0.8 -4,-0.2 -1,-0.2 0.842 111.3 46.9 -88.6 -39.4 44.0 22.5 11.2 545 551 A L H 3< S+ 0 0 57 -4,-1.3 3,-0.2 1,-0.2 -2,-0.2 0.852 108.4 53.5 -73.2 -35.7 40.6 24.0 12.1 546 552 A V T 3< S+ 0 0 3 -4,-2.6 -98,-0.3 1,-0.2 -1,-0.2 0.036 110.2 54.2 -88.1 27.2 39.6 21.2 14.6 547 553 A S < 0 0 76 -3,-0.8 -1,-0.2 -5,-0.1 -107,-0.0 -0.519 360.0 360.0-160.5 79.3 42.8 21.8 16.4 548 554 A A 0 0 118 -3,-0.2 -3,-0.1 -2,-0.1 -2,-0.0 -0.299 360.0 360.0-122.0 360.0 43.2 25.5 17.4 549 !* 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 0.0 550 6 B E 0 0 222 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 148.1 43.7 -53.9 28.9 551 7 B T - 0 0 65 105,-0.1 107,-0.1 108,-0.0 109,-0.0 -0.776 360.0-144.4-156.2 108.8 42.9 -50.2 29.7 552 8 B V - 0 0 71 -2,-0.2 107,-0.5 1,-0.1 2,-0.2 -0.587 34.0-120.5 -72.2 119.9 45.3 -47.3 30.2 553 9 B P - 0 0 91 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.421 31.2-162.6 -64.4 127.1 43.7 -45.1 32.9 554 10 B V - 0 0 4 -2,-0.2 2,-0.3 105,-0.1 74,-0.0 -0.828 4.5-163.3-112.2 153.8 43.1 -41.6 31.5 555 11 B K - 0 0 129 -2,-0.3 74,-2.3 75,-0.1 2,-0.1 -0.981 20.4-112.6-141.1 151.4 42.4 -38.5 33.6 556 12 B L B -X 628 0M 10 -2,-0.3 72,-0.3 72,-0.2 3,-0.2 -0.398 55.7 -80.1 -74.7 154.3 41.1 -35.0 33.3 557 13 B K S > S- 0 0 65 70,-3.1 3,-2.7 1,-0.2 -1,-0.2 -0.318 75.5 -70.4 -55.6 135.5 43.4 -32.1 33.7 558 14 B P T 3 S- 0 0 128 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.102 117.5 -1.3 -31.8 124.6 43.9 -31.5 37.5 559 15 B G T 3 S+ 0 0 91 1,-0.2 2,-0.2 -3,-0.2 -2,-0.1 0.485 101.5 128.7 68.8 0.8 40.9 -30.2 39.3 560 16 B M < - 0 0 85 -3,-2.7 2,-0.3 67,-0.1 -1,-0.2 -0.563 45.5-148.9 -84.7 155.0 38.9 -30.1 36.0 561 17 B D - 0 0 75 -2,-0.2 3,-0.1 1,-0.1 -4,-0.1 -0.867 29.3 -74.6-124.0 158.3 35.5 -31.7 35.9 562 18 B G - 0 0 1 -2,-0.3 2,-0.2 1,-0.1 -1,-0.1 0.036 57.2 -89.9 -48.5 153.7 33.5 -33.4 33.1 563 19 B P - 0 0 0 0, 0.0 38,-3.4 0, 0.0 -1,-0.1 -0.443 32.6-175.4 -71.0 135.9 31.8 -31.5 30.2 564 20 B K B +y 601 0N 99 36,-0.3 2,-0.3 -2,-0.2 38,-0.2 -0.405 24.8 156.5-126.5 52.5 28.3 -30.3 30.7 565 21 B V - 0 0 45 36,-2.0 2,-0.1 1,-0.1 0, 0.0 -0.624 39.3-120.5 -83.2 137.0 27.6 -28.8 27.2 566 22 B K - 0 0 182 -2,-0.3 2,-0.6 1,-0.1 -1,-0.1 -0.415 22.0-113.1 -80.4 153.5 24.0 -28.5 26.0 567 23 B Q - 0 0 39 -2,-0.1 3,-0.1 36,-0.1 -1,-0.1 -0.744 22.5-142.0 -89.3 117.0 22.6 -30.1 23.0 568 24 B W - 0 0 62 -2,-0.6 36,-0.2 1,-0.1 2,-0.0 -0.365 38.6 -90.2 -70.4 157.9 21.5 -27.9 20.2 569 25 B P - 0 0 52 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.339 42.7-145.5 -69.4 152.4 18.4 -29.1 18.4 570 26 B L - 0 0 8 -196,-0.2 35,-0.0 -3,-0.1 3,-0.0 -0.834 18.4-101.9-120.9 159.7 18.5 -31.4 15.4 571 27 B T > - 0 0 21 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.354 36.1-115.2 -72.0 157.8 16.6 -31.9 12.3 572 28 B E H > S+ 0 0 67 -194,-2.3 4,-2.3 1,-0.2 5,-0.2 0.989 116.1 54.2 -50.7 -66.8 14.2 -34.8 12.3 573 29 B E H > S+ 0 0 107 -195,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.819 110.9 45.1 -33.0 -57.5 16.2 -36.5 9.5 574 30 B K H >> S+ 0 0 4 1,-0.2 4,-1.7 2,-0.2 3,-0.5 0.989 109.3 53.8 -56.8 -64.1 19.4 -36.3 11.6 575 31 B I H 3X S+ 0 0 18 -4,-2.5 4,-2.5 1,-0.3 3,-0.3 0.824 108.2 51.8 -38.2 -48.9 17.9 -37.4 14.9 576 32 B K H 3X S+ 0 0 125 -4,-2.3 4,-2.9 1,-0.2 -1,-0.3 0.945 105.3 53.4 -54.1 -55.4 16.5 -40.5 13.2 577 33 B A H S+ 0 0 14 -4,-2.3 6,-1.4 1,-0.2 5,-1.2 0.766 114.2 55.6 -55.5 -26.5 26.8 -49.3 18.3 586 42 B E H ><5S+ 0 0 61 -4,-2.2 3,-1.8 4,-0.2 -1,-0.2 0.954 105.9 47.5 -70.4 -53.3 24.7 -50.3 21.4 587 43 B K H 3<5S+ 0 0 160 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.921 113.0 50.9 -52.8 -45.9 24.1 -53.8 20.2 588 44 B E T 3<5S- 0 0 97 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.453 115.9-116.0 -74.4 -1.2 27.9 -54.1 19.4 589 45 B G T < 5S+ 0 0 35 -3,-1.8 -3,-0.2 2,-0.3 -2,-0.1 0.329 81.3 123.5 84.5 -7.9 28.8 -52.9 22.8 590 46 B K S - 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0 0 62 319,-0.5 3,-0.3 -2,-0.2 4,-0.2 -0.706 23.5-158.0-146.8 85.6 27.6 -36.7 5.2 609 65 B K - 0 0 45 1,-0.2 2,-0.5 -2,-0.2 -1,-0.2 0.864 63.0 -21.3 -36.2 -90.1 31.3 -36.2 4.4 610 66 B K S S- 0 0 122 1,-0.2 -1,-0.2 318,-0.1 318,-0.0 -0.907 124.3 -18.5-138.6 113.7 31.7 -36.2 0.6 611 67 B D S S+ 0 0 156 -2,-0.5 2,-0.3 -3,-0.3 -1,-0.2 0.985 91.3 136.3 58.1 81.8 29.3 -37.8 -1.7 612 68 B S - 0 0 57 -4,-0.2 -1,-0.2 -3,-0.1 0, 0.0 -0.954 44.3-165.8-157.3 136.1 27.3 -40.1 0.7 613 69 B T S S+ 0 0 128 -2,-0.3 2,-0.3 2,-0.1 -1,-0.1 0.762 77.1 79.4 -91.6 -30.2 23.6 -40.9 1.2 614 70 B K S S- 0 0 153 1,-0.1 2,-0.1 -37,-0.0 -7,-0.0 -0.593 83.6-121.8 -82.8 137.8 24.3 -42.6 4.5 615 71 B W - 0 0 50 -2,-0.3 2,-0.4 -7,-0.1 -7,-0.2 -0.425 15.0-144.0 -78.8 151.7 24.8 -40.4 7.6 616 72 B R E -C 607 0P 44 -9,-2.8 -9,-2.5 -2,-0.1 2,-0.2 -0.969 18.3-123.6-120.3 129.3 27.8 -40.3 9.8 617 73 B K E -C 606 0P 14 -2,-0.4 2,-0.4 -11,-0.2 -11,-0.2 -0.487 31.0-170.2 -67.9 135.2 27.6 -39.8 13.6 618 74 B L E -C 605 0P 6 -13,-3.2 -13,-2.7 -2,-0.2 2,-0.5 -0.967 7.4-164.7-136.0 120.7 29.7 -36.8 14.7 619 75 B V E -C 604 0P 6 -2,-0.4 2,-1.4 70,-0.3 -15,-0.3 -0.897 16.3-141.6-110.0 131.3 30.5 -35.8 18.3 620 76 B D + 0 0 12 -17,-2.5 3,-0.5 -2,-0.5 4,-0.2 -0.601 29.4 165.8 -89.4 78.4 31.8 -32.4 19.3 621 77 B F > + 0 0 5 -2,-1.4 4,-3.7 1,-0.2 5,-0.3 0.194 34.3 121.6 -77.5 15.8 34.4 -33.3 22.1 622 78 B R H > S+ 0 0 37 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.910 77.9 42.1 -46.1 -54.1 36.0 -29.9 22.0 623 79 B E H > S+ 0 0 66 -3,-0.5 4,-0.7 2,-0.2 -1,-0.2 0.928 115.9 49.5 -61.6 -45.2 35.3 -29.2 25.6 624 80 B L H >> S+ 0 0 0 -4,-0.2 3,-1.0 2,-0.2 4,-0.8 0.930 111.4 49.3 -60.1 -46.6 36.2 -32.7 26.7 625 81 B N H >< S+ 0 0 28 -4,-3.7 3,-2.3 1,-0.3 -2,-0.2 0.975 108.2 53.0 -55.5 -56.6 39.5 -32.6 24.8 626 82 B K H 3< S+ 0 0 83 -4,-2.7 -1,-0.3 -5,-0.3 -2,-0.2 0.681 113.7 45.2 -54.7 -15.2 40.3 -29.3 26.4 627 83 B R H << S+ 0 0 64 -3,-1.0 -70,-3.1 -4,-0.7 2,-0.3 0.491 92.0 100.6-108.6 -1.4 39.7 -30.9 29.7 628 84 B T B << S-X 556 0M 0 -3,-2.3 -72,-0.2 -4,-0.8 -74,-0.0 -0.647 80.2-105.9 -87.5 138.9 41.6 -34.1 29.1 629 85 B Q - 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