==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 06-DEC-05 2FA4 . COMPND 2 MOLECULE: THIOREDOXIN II; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR R.BAO,Y.J.TANG,C.Z.ZHOU,Y.CHEN . 208 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10149.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 163 78.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 13.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 . 27 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 63 30.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 0 0 2 1 1 0 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 0 0 1 1 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 . 0 0 0 0 1 3 0 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 . 0 0 0 2 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 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 0 177 0, 0.0 2,-0.6 0, 0.0 52,-0.4 0.000 360.0 360.0 360.0 153.8 28.8 0.3 -3.4 2 2 A V - 0 0 21 50,-0.1 2,-0.6 52,-0.0 52,-0.3 -0.941 360.0-143.9-116.4 108.9 25.2 -0.5 -2.1 3 3 A T E -a 54 0A 79 50,-1.8 52,-1.6 -2,-0.6 2,-0.3 -0.651 13.0-132.3 -80.1 118.6 23.6 2.5 -0.4 4 4 A Q E -a 55 0A 51 -2,-0.6 2,-0.4 50,-0.2 52,-0.2 -0.539 16.0-135.0 -67.0 124.7 21.4 1.6 2.6 5 5 A L E -a 56 0A 3 50,-3.8 52,-0.6 -2,-0.3 56,-0.1 -0.735 22.2-177.6 -82.0 128.1 18.0 3.3 2.5 6 6 A K + 0 0 104 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.507 59.6 14.7-107.8 -7.8 17.1 4.8 5.9 7 7 A S S > S- 0 0 42 1,-0.1 4,-2.3 54,-0.1 -1,-0.1 -0.974 77.4-100.6-157.0 170.0 13.7 6.2 5.4 8 8 A A H > S+ 0 0 31 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.918 120.3 57.4 -59.0 -43.7 10.7 6.3 3.1 9 9 A S H > S+ 0 0 91 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.900 107.5 45.0 -52.0 -52.4 12.0 9.6 1.8 10 10 A E H > S+ 0 0 83 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.946 111.4 55.3 -58.9 -45.8 15.4 8.1 0.7 11 11 A Y H X S+ 0 0 24 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.918 110.1 44.5 -51.6 -53.8 13.6 5.2 -0.9 12 12 A D H X S+ 0 0 93 -4,-2.7 4,-1.3 2,-0.2 -1,-0.2 0.832 111.7 49.6 -64.7 -40.0 11.4 7.4 -3.0 13 13 A S H >< S+ 0 0 81 -4,-2.0 3,-1.0 -5,-0.2 -1,-0.2 0.968 107.6 57.4 -64.9 -46.0 14.1 9.7 -4.2 14 14 A A H 3< S+ 0 0 7 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.843 107.7 49.8 -44.2 -40.4 16.1 6.6 -5.1 15 15 A L H >< S+ 0 0 15 -4,-1.5 2,-2.2 1,-0.2 67,-0.8 0.746 88.9 78.8 -76.4 -29.9 13.2 5.5 -7.3 16 16 A A T << + 0 0 90 -4,-1.3 -1,-0.2 -3,-1.0 -4,-0.0 -0.476 63.9 108.3 -78.1 70.4 12.7 8.8 -9.2 17 17 A S T 3 - 0 0 51 -2,-2.2 3,-0.5 3,-0.2 -1,-0.2 0.611 62.3-153.3-123.2 -22.5 15.7 8.0 -11.5 18 18 A G S < S+ 0 0 32 -3,-0.6 2,-3.0 1,-0.2 3,-0.1 0.781 70.7 5.6 49.6 130.3 14.0 7.1 -14.9 19 19 A D S S+ 0 0 141 1,-0.1 2,-0.3 3,-0.0 -1,-0.2 0.020 105.4 105.5 64.9 -38.4 15.6 4.8 -17.5 20 20 A K S S- 0 0 88 -2,-3.0 61,-0.5 -3,-0.5 2,-0.4 -0.578 81.0-118.5 -69.6 128.9 18.3 4.1 -14.9 21 21 A L E -b 51 0A 1 29,-0.6 31,-2.5 -2,-0.3 2,-0.5 -0.653 28.9-163.3 -71.7 127.8 17.9 0.6 -13.4 22 22 A V E -bC 52 79A 2 57,-2.7 57,-3.5 -2,-0.4 2,-0.5 -0.990 4.4-169.4-115.9 122.1 17.3 0.9 -9.6 23 23 A V E -bC 53 78A 1 29,-2.6 31,-2.3 -2,-0.5 2,-0.5 -0.956 0.6-167.2-116.7 123.2 17.8 -2.3 -7.6 24 24 A V E -bC 54 77A 0 53,-2.5 53,-2.4 -2,-0.5 2,-0.8 -0.945 10.0-152.6-116.1 125.5 16.7 -2.6 -3.9 25 25 A D E -bC 55 76A 8 29,-2.5 31,-2.6 -2,-0.5 2,-0.7 -0.832 8.3-161.1 -96.1 105.2 17.7 -5.4 -1.6 26 26 A F E +bC 56 75A 0 49,-3.1 49,-2.1 -2,-0.8 2,-0.2 -0.795 30.5 155.1 -85.4 111.5 15.1 -5.9 1.2 27 27 A F E -b 57 0A 30 29,-1.9 31,-2.5 -2,-0.7 32,-0.3 -0.777 36.0-136.7-129.5 177.8 16.9 -7.9 3.9 28 28 A A - 0 0 2 -2,-0.2 3,-0.3 29,-0.2 7,-0.1 -0.943 21.0-128.6-134.2 157.0 16.8 -8.6 7.7 29 29 A T S S+ 0 0 87 -2,-0.3 -1,-0.1 1,-0.2 6,-0.1 0.850 112.3 49.9 -75.6 -32.8 19.7 -8.8 10.1 30 30 A W S S+ 0 0 156 -3,-0.1 2,-0.5 4,-0.0 -1,-0.2 0.628 88.0 108.5 -77.0 -15.9 18.5 -12.2 11.4 31 31 A a > - 0 0 10 -3,-0.3 4,-1.5 1,-0.1 -3,-0.1 -0.546 50.0-167.1 -74.4 113.2 18.3 -13.5 7.8 32 32 A G H >> S+ 0 0 36 -2,-0.5 4,-2.2 2,-0.2 3,-0.5 0.963 87.5 48.1 -62.5 -60.2 21.0 -16.1 6.9 33 33 A P H 3> S+ 0 0 17 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.870 107.7 59.4 -52.7 -39.1 20.5 -16.2 3.1 34 34 A a H 3> S+ 0 0 6 1,-0.2 4,-1.2 2,-0.2 3,-0.3 0.929 107.5 45.3 -49.5 -50.8 20.5 -12.4 3.1 35 35 A K H << S+ 0 0 127 -4,-1.5 -1,-0.2 -3,-0.5 -3,-0.1 0.848 111.1 53.1 -60.8 -42.2 24.0 -12.5 4.7 36 36 A M H < S+ 0 0 146 -4,-2.2 4,-0.4 1,-0.2 -1,-0.2 0.752 114.1 41.6 -66.7 -26.9 25.2 -15.2 2.2 37 37 A I H X S+ 0 0 2 -4,-1.5 4,-2.3 -3,-0.3 -1,-0.2 0.663 91.5 86.7 -94.3 -18.5 24.1 -13.1 -0.8 38 38 A A H X S+ 0 0 46 -4,-1.2 4,-1.8 1,-0.2 -2,-0.1 0.820 89.6 48.1 -55.3 -44.0 25.3 -9.7 0.4 39 39 A P H > S+ 0 0 77 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.905 111.3 52.0 -60.2 -44.6 28.9 -10.0 -0.9 40 40 A M H > S+ 0 0 57 -4,-0.4 4,-2.4 1,-0.2 -2,-0.2 0.910 107.1 52.4 -56.8 -48.4 27.5 -11.2 -4.3 41 41 A I H X S+ 0 0 6 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.879 107.7 51.7 -56.4 -43.6 25.2 -8.2 -4.5 42 42 A E H X S+ 0 0 43 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.932 108.5 51.5 -56.9 -47.0 28.2 -5.9 -3.9 43 43 A K H X S+ 0 0 135 -4,-2.3 4,-2.2 1,-0.2 3,-0.2 0.918 108.7 51.4 -52.1 -47.4 30.1 -7.6 -6.7 44 44 A F H X S+ 0 0 3 -4,-2.4 4,-3.3 1,-0.2 -1,-0.2 0.875 104.7 56.4 -62.2 -37.6 27.1 -7.0 -9.0 45 45 A A H < S+ 0 0 12 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.874 108.2 48.1 -62.2 -37.6 27.1 -3.3 -8.1 46 46 A E H < S+ 0 0 140 -4,-1.6 3,-0.4 -3,-0.2 -2,-0.2 0.934 116.6 43.1 -65.4 -49.2 30.7 -3.0 -9.2 47 47 A Q H < S+ 0 0 115 -4,-2.2 2,-1.5 1,-0.2 -2,-0.2 0.937 112.3 51.0 -62.3 -50.0 30.0 -4.8 -12.5 48 48 A Y >< + 0 0 31 -4,-3.3 3,-2.0 1,-0.2 -1,-0.2 -0.487 61.4 160.6 -97.4 70.5 26.7 -3.2 -13.4 49 49 A S T 3 + 0 0 91 -2,-1.5 -1,-0.2 -3,-0.4 -2,-0.1 0.683 66.5 72.7 -65.3 -16.3 27.7 0.5 -13.1 50 50 A D T 3 S+ 0 0 108 -3,-0.2 -29,-0.6 2,-0.0 2,-0.3 0.589 94.9 63.4 -72.4 -7.2 24.8 1.5 -15.2 51 51 A A E < S- b 0 21A 8 -3,-2.0 2,-0.6 -6,-0.2 -29,-0.2 -0.904 78.9-128.9-123.3 145.5 22.4 0.6 -12.3 52 52 A A E - b 0 22A 17 -31,-2.5 -29,-2.6 -2,-0.3 2,-0.4 -0.854 25.7-155.7 -95.2 121.2 22.0 2.1 -8.8 53 53 A F E + b 0 23A 9 -2,-0.6 -50,-1.8 -52,-0.4 2,-0.3 -0.790 18.7 164.6-101.4 142.3 22.1 -0.4 -6.0 54 54 A Y E -ab 3 24A 49 -31,-2.3 -29,-2.5 -2,-0.4 2,-0.3 -0.928 20.5-150.7-145.6 164.9 20.5 0.0 -2.6 55 55 A K E -ab 4 25A 73 -52,-1.6 -50,-3.8 -2,-0.3 2,-0.4 -0.982 5.8-163.2-138.4 152.4 19.5 -2.0 0.5 56 56 A L E -ab 5 26A 0 -31,-2.6 -29,-1.9 -2,-0.3 2,-0.7 -0.995 19.3-133.1-140.2 126.2 16.7 -1.5 3.0 57 57 A D E >> - b 0 27A 8 -52,-0.6 4,-2.6 -2,-0.4 3,-2.0 -0.736 13.6-149.2 -78.3 113.0 16.5 -3.2 6.4 58 58 A V T 34 S+ 0 0 11 -31,-2.5 7,-0.2 -2,-0.7 -1,-0.1 0.763 96.2 54.4 -55.8 -26.3 12.8 -4.4 6.8 59 59 A D T 34 S+ 0 0 88 -32,-0.3 -1,-0.3 2,-0.2 3,-0.1 0.583 114.1 40.5 -83.6 -9.4 12.9 -3.9 10.6 60 60 A E T <4 S+ 0 0 96 -3,-2.0 -2,-0.2 1,-0.1 3,-0.2 0.771 128.1 28.6-101.9 -42.7 14.0 -0.3 10.2 61 61 A V S >X S+ 0 0 2 -4,-2.6 4,-1.5 1,-0.2 3,-0.6 -0.382 73.5 151.5-118.6 54.2 11.9 0.8 7.3 62 62 A S H 3> + 0 0 47 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.809 68.0 60.5 -46.7 -44.8 8.9 -1.6 7.9 63 63 A D H 3> S+ 0 0 76 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.899 107.2 45.5 -55.8 -47.7 6.3 0.8 6.3 64 64 A V H <> S+ 0 0 7 -3,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.852 112.0 52.2 -63.8 -38.5 8.2 0.7 3.0 65 65 A A H <>S+ 0 0 7 -4,-1.5 5,-2.7 2,-0.2 -2,-0.2 0.910 111.9 46.1 -65.7 -40.1 8.5 -3.1 3.2 66 66 A Q H <5S+ 0 0 153 -4,-2.9 3,-0.4 3,-0.2 -2,-0.2 0.840 114.2 47.0 -70.1 -38.0 4.7 -3.5 3.8 67 67 A K H <5S+ 0 0 171 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.829 111.7 50.0 -76.6 -29.0 3.9 -1.1 1.0 68 68 A A T <5S- 0 0 13 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.492 114.0-124.5 -81.3 -3.4 6.3 -2.8 -1.4 69 69 A E T 5 + 0 0 149 -3,-0.4 2,-0.7 1,-0.2 -3,-0.2 0.952 45.8 170.7 57.9 57.9 4.7 -6.1 -0.3 70 70 A V < + 0 0 20 -5,-2.7 -1,-0.2 1,-0.1 -2,-0.1 -0.868 12.0 159.4-100.5 114.8 7.8 -7.8 0.8 71 71 A S + 0 0 53 -2,-0.7 123,-0.4 1,-0.2 2,-0.3 0.231 62.1 38.8-120.5 9.4 6.9 -11.1 2.7 72 72 A S S S- 0 0 3 121,-0.1 18,-0.2 -46,-0.1 -1,-0.2 -0.963 85.7 -91.9-156.6 151.4 10.3 -13.0 2.4 73 73 A M S S+ 0 0 33 119,-0.3 119,-0.3 -2,-0.3 18,-0.2 -0.926 95.5 28.2-129.1 143.5 14.0 -12.0 2.6 74 74 A P S S+ 0 0 0 0, 0.0 16,-2.4 0, 0.0 2,-0.5 0.595 73.2 170.3 -80.4 151.6 16.0 -11.3 0.8 75 75 A T E -CD 26 89A 1 -49,-2.1 -49,-3.1 14,-0.2 2,-0.6 -0.988 16.1-160.8-123.9 121.0 13.8 -9.7 -1.8 76 76 A L E -CD 25 88A 1 12,-2.4 12,-2.7 -2,-0.5 2,-0.4 -0.889 9.0-165.0 -98.1 119.7 15.4 -7.8 -4.6 77 77 A I E -CD 24 87A 0 -53,-2.4 -53,-2.5 -2,-0.6 2,-0.5 -0.868 7.0-149.3-109.0 140.2 13.1 -5.4 -6.4 78 78 A F E -CD 23 86A 1 8,-3.3 7,-3.4 -2,-0.4 8,-1.3 -0.944 16.9-175.6-113.4 118.5 13.9 -3.8 -9.8 79 79 A Y E +CD 22 84A 10 -57,-3.5 -57,-2.7 -2,-0.5 2,-0.3 -0.897 10.8 175.6-113.6 145.4 12.6 -0.4 -10.6 80 80 A K E > S+ D 0 83A 65 3,-2.8 3,-1.1 -2,-0.4 -59,-0.1 -0.944 76.7 1.8-147.5 126.5 12.8 1.7 -13.8 81 81 A G T 3 S- 0 0 48 -61,-0.5 -65,-0.1 -2,-0.3 3,-0.1 0.838 130.7 -59.6 67.3 33.2 11.1 5.0 -14.2 82 82 A G T 3 S+ 0 0 37 -67,-0.8 2,-0.3 1,-0.2 -1,-0.2 0.372 117.7 106.4 78.8 -4.0 9.7 4.9 -10.7 83 83 A K E < S-D 80 0A 164 -3,-1.1 -3,-2.8 -68,-0.1 2,-0.5 -0.838 77.8-108.2-114.7 143.2 7.9 1.6 -11.5 84 84 A E E +D 79 0A 78 -2,-0.3 -5,-0.3 -5,-0.2 3,-0.1 -0.582 31.2 178.8 -68.4 119.5 8.6 -2.0 -10.5 85 85 A V E - 0 0 69 -7,-3.4 2,-0.3 -2,-0.5 -6,-0.2 0.840 63.8 -39.6 -87.4 -41.7 9.8 -3.9 -13.5 86 86 A T E -D 78 0A 55 -8,-1.3 -8,-3.3 2,-0.0 -1,-0.4 -0.950 53.2-144.0-166.0-179.6 10.3 -7.2 -11.6 87 87 A R E -D 77 0A 29 -2,-0.3 2,-0.5 -10,-0.3 -10,-0.2 -0.981 9.0-140.9-154.7 158.1 11.6 -8.7 -8.4 88 88 A V E -D 76 0A 9 -12,-2.7 -12,-2.4 -2,-0.3 2,-1.0 -0.954 11.4-158.0-125.7 112.2 13.4 -11.8 -7.1 89 89 A V E +D 75 0A 2 -2,-0.5 -14,-0.2 114,-0.4 2,-0.1 -0.775 63.7 34.4 -89.8 97.8 12.2 -13.3 -3.9 90 90 A G S S- 0 0 0 -16,-2.4 2,-2.3 -2,-1.0 101,-0.2 -0.431 95.2 -78.6 135.7 152.4 15.2 -15.3 -2.6 91 91 A A + 0 0 12 99,-2.5 100,-0.1 -18,-0.2 -2,-0.1 -0.531 69.5 148.3 -78.6 71.2 19.0 -15.5 -2.3 92 92 A N > - 0 0 17 -2,-2.3 4,-2.8 1,-0.2 5,-0.2 -0.880 29.6-171.7-115.7 93.7 19.2 -16.7 -5.8 93 93 A P H > S+ 0 0 51 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.893 84.9 48.0 -50.7 -52.3 22.5 -15.4 -7.4 94 94 A A H > S+ 0 0 74 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.891 113.4 45.9 -59.3 -45.4 21.7 -16.6 -10.9 95 95 A A H > S+ 0 0 27 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.916 114.7 48.3 -67.4 -41.6 18.2 -15.1 -10.9 96 96 A I H X S+ 0 0 1 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.949 111.9 48.7 -60.9 -47.9 19.4 -11.8 -9.4 97 97 A K H X S+ 0 0 85 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.918 113.4 46.7 -59.4 -49.7 22.3 -11.5 -11.9 98 98 A Q H X S+ 0 0 127 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.896 109.8 54.4 -57.8 -46.5 20.0 -12.2 -14.9 99 99 A A H X S+ 0 0 11 -4,-2.5 4,-0.8 -5,-0.2 -2,-0.2 0.889 114.3 41.3 -55.2 -42.7 17.4 -9.7 -13.6 100 100 A I H >X S+ 0 0 0 -4,-2.2 3,-0.8 2,-0.2 4,-0.8 0.972 116.0 47.4 -68.1 -56.4 20.1 -6.9 -13.4 101 101 A A H >< S+ 0 0 41 -4,-2.9 3,-0.5 1,-0.2 -2,-0.2 0.892 114.9 46.6 -51.7 -47.0 21.9 -7.7 -16.7 102 102 A S H 3< S+ 0 0 77 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.640 117.4 40.4 -75.9 -15.6 18.7 -7.9 -18.7 103 103 A N H << 0 0 37 -3,-0.8 -1,-0.2 -4,-0.8 -2,-0.2 0.298 360.0 360.0-115.3 4.9 17.0 -4.7 -17.3 104 104 A V << 0 0 83 -4,-0.8 -53,-0.1 -3,-0.5 -3,-0.1 0.002 360.0 360.0 -59.7 360.0 20.0 -2.4 -17.3 105 !* 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 0.0 106 1 B M 0 0 161 0, 0.0 2,-0.5 0, 0.0 52,-0.5 0.000 360.0 360.0 360.0 135.3 2.0 -34.2 -5.9 107 2 B V - 0 0 22 50,-0.1 2,-0.3 52,-0.1 52,-0.2 -0.828 360.0-164.4 -93.4 126.2 3.3 -33.2 -2.4 108 3 B T E -e 159 0B 72 50,-1.5 52,-1.8 -2,-0.5 2,-0.2 -0.844 17.4-103.7-117.2 155.1 5.0 -36.1 -0.6 109 4 B Q E -e 160 0B 80 -2,-0.3 2,-0.6 50,-0.2 52,-0.2 -0.452 11.7-153.0 -76.4 141.9 6.0 -36.8 3.0 110 5 B L + 0 0 6 50,-2.2 52,-0.4 -2,-0.2 56,-0.1 -0.970 19.3 177.0-108.5 110.6 9.5 -36.6 4.4 111 6 B K + 0 0 115 -2,-0.6 2,-0.3 50,-0.1 -1,-0.1 0.132 57.7 21.7-104.7 16.0 9.2 -39.1 7.3 112 7 B S S > S- 0 0 41 1,-0.1 4,-1.8 54,-0.1 5,-0.1 -0.976 80.3-101.4-173.1 159.0 12.8 -39.0 8.6 113 8 B A H > S+ 0 0 26 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.845 120.2 53.1 -58.7 -37.8 16.1 -37.0 8.7 114 9 B S H > S+ 0 0 93 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.853 106.8 52.2 -65.6 -41.4 17.6 -39.2 5.9 115 10 B E H > S+ 0 0 87 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.911 109.8 49.6 -58.0 -42.7 14.6 -38.7 3.6 116 11 B Y H X S+ 0 0 19 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.916 109.4 50.8 -65.7 -42.6 15.0 -34.9 4.0 117 12 B D H < S+ 0 0 94 -4,-1.9 4,-0.4 1,-0.2 -1,-0.2 0.870 112.6 46.6 -63.6 -40.5 18.7 -35.0 3.2 118 13 B S H >< S+ 0 0 86 -4,-1.9 3,-0.9 1,-0.2 -1,-0.2 0.863 107.7 55.9 -66.3 -41.3 18.1 -37.0 0.1 119 14 B A H 3< S+ 0 0 11 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.796 106.1 52.8 -62.4 -29.2 15.3 -34.7 -1.1 120 15 B L T 3< S+ 0 0 19 -4,-1.4 2,-1.9 1,-0.2 -1,-0.2 0.614 86.0 85.2 -80.5 -16.9 17.6 -31.7 -0.8 121 16 B A < + 0 0 81 -3,-0.9 -1,-0.2 -4,-0.4 3,-0.1 -0.507 54.6 124.9 -85.5 67.1 20.2 -33.4 -3.0 122 17 B S > - 0 0 27 -2,-1.9 3,-2.3 1,-0.4 -1,-0.2 -0.072 62.8-134.3-119.8 28.1 18.5 -32.2 -6.2 123 18 B G T 3 S- 0 0 53 1,-0.3 63,-1.2 62,-0.1 -1,-0.4 -0.242 75.8 -19.0 54.7-133.3 21.3 -30.3 -8.0 124 19 B D T 3 S+ 0 0 137 61,-0.2 -1,-0.3 62,-0.1 2,-0.1 0.387 107.9 110.9 -86.5 2.8 20.0 -26.9 -9.2 125 20 B K S < S- 0 0 90 -3,-2.3 61,-0.6 1,-0.1 2,-0.3 -0.461 75.0-104.7 -76.8 152.5 16.3 -27.7 -9.1 126 21 B L E -F 185 0B 0 29,-0.3 31,-2.4 59,-0.1 2,-0.4 -0.592 31.2-164.7 -72.7 139.9 14.0 -26.0 -6.5 127 22 B V E -Fg 184 157B 0 57,-2.4 57,-3.0 -2,-0.3 2,-0.5 -0.987 2.7-163.4-124.2 124.1 12.9 -28.1 -3.4 128 23 B V E -Fg 183 158B 0 29,-3.3 31,-2.9 -2,-0.4 2,-0.5 -0.955 2.3-167.2-113.8 122.4 10.0 -26.8 -1.4 129 24 B V E -Fg 182 159B 0 53,-2.5 53,-2.6 -2,-0.5 2,-0.8 -0.955 8.6-155.0-113.6 119.0 9.4 -28.2 2.2 130 25 B D E -Fg 181 160B 8 29,-3.0 31,-3.3 -2,-0.5 2,-0.6 -0.837 9.8-156.2 -88.3 107.9 6.1 -27.4 4.0 131 26 B F E +Fg 180 161B 0 49,-3.2 49,-1.7 -2,-0.8 2,-0.2 -0.794 32.2 152.2 -89.3 119.4 6.7 -27.7 7.8 132 27 B F E - g 0 162B 29 29,-2.2 31,-2.7 -2,-0.6 32,-0.3 -0.800 36.9-138.7-139.5 174.3 3.4 -28.4 9.4 133 28 B A > - 0 0 1 -2,-0.2 3,-0.8 29,-0.2 6,-0.1 -0.937 26.7-121.7-134.0 155.8 1.7 -30.1 12.4 134 29 B T T 3 S+ 0 0 87 -2,-0.3 -1,-0.0 1,-0.2 6,-0.0 0.730 114.3 51.5 -67.5 -23.9 -1.4 -32.2 12.5 135 30 B W T 3 S+ 0 0 166 4,-0.0 2,-0.8 5,-0.0 -1,-0.2 0.461 83.9 113.3 -89.9 -6.2 -3.1 -29.8 15.0 136 31 B b <> - 0 0 5 -3,-0.8 4,-1.6 1,-0.2 -3,-0.1 -0.580 44.8-172.9 -84.2 103.9 -2.3 -26.7 12.8 137 32 B G H >> S+ 0 0 44 -2,-0.8 4,-1.9 1,-0.2 3,-0.6 0.963 85.7 48.1 -59.4 -54.3 -5.5 -25.1 11.4 138 33 B P H 3> S+ 0 0 58 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.792 106.5 61.1 -59.8 -31.8 -3.8 -22.6 9.0 139 34 B b H 3> S+ 0 0 4 2,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.900 107.0 44.4 -54.5 -48.6 -1.6 -25.5 7.7 140 35 B K H << S+ 0 0 138 -4,-1.6 3,-0.2 -3,-0.6 -1,-0.2 0.885 106.4 60.6 -66.2 -39.1 -4.8 -27.3 6.5 141 36 B M H < S+ 0 0 147 -4,-1.9 4,-0.3 1,-0.2 -1,-0.2 0.859 114.9 34.9 -53.2 -38.0 -6.3 -24.1 5.0 142 37 B I H X S+ 0 0 6 -4,-1.3 4,-2.1 -3,-0.2 3,-0.5 0.608 91.7 90.0 -99.6 -13.4 -3.3 -23.8 2.7 143 38 B A H X S+ 0 0 38 -4,-1.1 4,-2.0 -3,-0.2 -1,-0.2 0.831 86.1 53.4 -53.4 -44.6 -2.5 -27.5 1.9 144 39 B P H > S+ 0 0 90 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.892 110.6 48.0 -57.6 -39.5 -4.9 -27.6 -1.1 145 40 B M H > S+ 0 0 46 -3,-0.5 4,-2.7 -4,-0.3 -2,-0.2 0.874 109.5 51.6 -67.3 -40.7 -3.2 -24.6 -2.7 146 41 B I H X S+ 0 0 4 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.872 109.3 51.7 -62.7 -38.1 0.3 -26.1 -2.0 147 42 B E H X S+ 0 0 52 -4,-2.0 4,-1.0 -5,-0.2 -2,-0.2 0.914 110.1 48.5 -63.8 -43.1 -0.9 -29.3 -3.8 148 43 B K H >X S+ 0 0 134 -4,-2.1 4,-2.5 1,-0.2 3,-0.6 0.916 109.2 52.9 -61.5 -45.4 -2.1 -27.1 -6.7 149 44 B F H 3X S+ 0 0 12 -4,-2.7 4,-3.6 1,-0.2 -2,-0.2 0.886 103.5 58.5 -54.6 -41.1 1.4 -25.3 -6.8 150 45 B A H 3< S+ 0 0 10 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.803 110.5 42.3 -61.0 -31.1 3.1 -28.7 -7.0 151 46 B E H << S+ 0 0 127 -4,-1.0 3,-0.4 -3,-0.6 -2,-0.2 0.867 115.7 48.0 -84.7 -39.5 1.1 -29.4 -10.2 152 47 B Q H < S+ 0 0 102 -4,-2.5 2,-0.9 1,-0.2 -2,-0.2 0.922 114.6 46.3 -65.9 -44.3 1.6 -25.9 -11.7 153 48 B Y >< + 0 0 34 -4,-3.6 3,-1.6 1,-0.2 -1,-0.2 -0.633 64.8 162.9-102.8 74.2 5.4 -25.9 -11.0 154 49 B S T 3 + 0 0 94 -2,-0.9 -1,-0.2 -3,-0.4 -2,-0.1 0.488 68.0 68.2 -69.8 -7.7 6.5 -29.3 -12.2 155 50 B D T 3 S+ 0 0 111 -3,-0.1 -29,-0.3 2,-0.0 2,-0.3 0.607 96.5 62.9 -84.8 -14.2 10.2 -28.2 -12.3 156 51 B A S < S- 0 0 8 -3,-1.6 2,-0.5 -31,-0.1 -29,-0.2 -0.756 81.0-129.5-107.6 153.5 10.3 -27.9 -8.5 157 52 B A E - 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