==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 11-APR-11 3RHC . COMPND 2 MOLECULE: GLUTAREDOXIN-C5, CHLOROPLASTIC; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR T.RORET,J.COUTURIER,P.TSAN,J.P.JACQUOT,N.ROUHIER,C.DIDIERJEA . 203 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12015.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 164 80.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 8.9 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 . 1 0.5 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 . 19 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 40.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.5 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 1 1 0 0 0 1 1 2 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 3 A S > 0 0 108 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 156.3 4.0 -8.3 -29.2 2 4 A F H > + 0 0 106 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.872 360.0 52.9 -50.5 -43.5 2.4 -10.2 -26.4 3 5 A G H > S+ 0 0 32 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.918 109.9 48.0 -67.4 -41.1 0.1 -7.3 -25.6 4 6 A S H > S+ 0 0 74 2,-0.2 4,-2.4 3,-0.2 -2,-0.2 0.904 112.6 48.7 -52.5 -49.8 -1.0 -7.1 -29.2 5 7 A R H X S+ 0 0 134 -4,-2.6 4,-3.2 2,-0.2 5,-0.2 0.967 112.4 47.9 -63.1 -46.2 -1.6 -10.9 -29.3 6 8 A M H X S+ 0 0 14 -4,-3.1 4,-1.8 1,-0.3 -1,-0.2 0.922 110.9 51.0 -60.0 -44.2 -3.5 -10.7 -26.1 7 9 A E H X S+ 0 0 33 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.3 0.916 112.1 49.1 -58.1 -35.4 -5.6 -7.8 -27.5 8 10 A E H X S+ 0 0 115 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.894 104.9 56.9 -74.9 -39.9 -6.2 -10.0 -30.6 9 11 A S H X S+ 0 0 58 -4,-3.2 4,-2.9 1,-0.2 -1,-0.2 0.882 108.4 48.6 -55.3 -36.6 -7.3 -13.0 -28.5 10 12 A I H X S+ 0 0 4 -4,-1.8 4,-2.5 -5,-0.2 5,-0.2 0.955 108.3 50.4 -72.1 -50.6 -10.0 -10.9 -26.9 11 13 A R H X S+ 0 0 141 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.906 115.2 47.7 -47.6 -43.6 -11.4 -9.4 -30.1 12 14 A K H X S+ 0 0 129 -4,-2.1 4,-2.7 2,-0.2 3,-0.3 0.949 110.7 47.8 -62.4 -57.1 -11.5 -13.0 -31.4 13 15 A T H X S+ 0 0 38 -4,-2.9 4,-1.2 1,-0.2 -2,-0.2 0.868 113.8 50.1 -50.7 -39.6 -13.2 -14.5 -28.2 14 16 A V H < S+ 0 0 11 -4,-2.5 65,-0.4 2,-0.2 -1,-0.2 0.794 113.2 43.1 -74.9 -35.5 -15.8 -11.7 -28.3 15 17 A T H < S+ 0 0 108 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.870 115.8 50.9 -76.1 -38.4 -16.7 -12.1 -32.1 16 18 A E H < S+ 0 0 135 -4,-2.7 2,-0.3 -5,-0.2 -2,-0.2 0.702 105.9 55.5 -71.0 -26.7 -16.8 -15.9 -31.8 17 19 A N S < S- 0 0 52 -4,-1.2 62,-0.4 -5,-0.2 61,-0.2 -0.827 70.4-134.9-118.9 151.3 -19.2 -16.4 -28.7 18 20 A T S S+ 0 0 59 -2,-0.3 60,-4.4 1,-0.3 2,-0.4 0.985 95.0 13.8 -64.4 -56.4 -22.7 -15.1 -27.9 19 21 A V E -A 77 0A 2 24,-0.3 26,-3.7 58,-0.2 2,-0.4 -0.986 65.7-177.1-125.0 128.7 -21.8 -14.0 -24.4 20 22 A V E -Ab 76 45A 1 56,-2.9 56,-3.3 -2,-0.4 2,-0.5 -0.994 4.2-172.6-122.3 134.2 -18.4 -13.5 -22.9 21 23 A I E -Ab 75 46A 0 24,-2.6 26,-2.5 -2,-0.4 2,-0.5 -0.976 15.5-150.9-130.7 113.7 -17.9 -12.5 -19.3 22 24 A Y E +Ab 74 47A 5 52,-3.4 52,-2.3 -2,-0.5 2,-0.2 -0.815 41.3 163.7 -85.9 132.1 -14.5 -11.6 -17.8 23 25 A S E - b 0 48A 0 24,-3.5 26,-3.5 -2,-0.5 2,-0.3 -0.726 42.9-134.6-145.5 164.8 -14.9 -12.6 -14.2 24 26 A K > - 0 0 36 24,-0.2 3,-1.7 -2,-0.2 6,-0.2 -0.986 23.9-135.7-132.6 134.6 -13.4 -13.5 -10.7 25 27 A T T 3 S+ 0 0 67 -2,-0.3 6,-0.1 1,-0.3 -1,-0.0 0.766 102.2 53.3 -61.7 -23.7 -14.6 -16.5 -8.8 26 28 A W T 3 S+ 0 0 135 1,-0.1 2,-0.7 4,-0.0 -1,-0.3 0.505 87.3 102.4 -92.4 4.0 -14.8 -14.7 -5.5 27 29 A C <> - 0 0 27 -3,-1.7 4,-2.4 1,-0.1 3,-0.4 -0.794 52.7-162.6-100.0 107.8 -17.0 -11.8 -6.8 28 30 A S H > S+ 0 0 56 -2,-0.7 4,-2.3 2,-0.2 -1,-0.1 0.822 95.0 56.1 -38.5 -47.0 -20.7 -11.6 -6.1 29 31 A Y H > S+ 0 0 44 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.906 110.1 46.8 -62.1 -38.1 -21.3 -9.0 -8.9 30 32 A C H >> S+ 0 0 0 -3,-0.4 4,-2.0 2,-0.2 3,-0.6 0.929 109.7 51.9 -64.8 -46.3 -19.7 -11.6 -11.3 31 33 A T H 3X S+ 0 0 66 -4,-2.4 4,-3.4 1,-0.2 -2,-0.2 0.902 108.4 55.6 -55.6 -39.8 -21.8 -14.4 -9.9 32 34 A E H 3X S+ 0 0 78 -4,-2.3 4,-1.2 1,-0.2 -1,-0.2 0.758 107.7 43.6 -67.4 -36.4 -24.8 -12.2 -10.5 33 35 A V H X S+ 0 0 33 -4,-2.0 4,-1.5 1,-0.2 3,-1.2 0.957 111.2 48.0 -62.5 -54.1 -23.4 -15.2 -14.7 35 37 A T H 3X S+ 0 0 50 -4,-3.4 4,-2.3 1,-0.3 -1,-0.2 0.834 106.9 59.1 -53.2 -35.8 -26.6 -16.2 -12.9 36 38 A L H 3< S+ 0 0 21 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.743 104.7 47.0 -70.7 -26.0 -28.5 -13.8 -15.0 37 39 A F H X<>S+ 0 0 0 -3,-1.2 5,-2.4 -4,-0.9 3,-0.5 0.774 109.6 56.5 -85.7 -28.8 -27.6 -15.4 -18.3 38 40 A K H ><5S+ 0 0 83 -4,-1.5 3,-3.1 1,-0.2 -2,-0.2 0.959 99.7 55.9 -63.4 -53.4 -28.4 -18.8 -16.8 39 41 A R T 3<5S+ 0 0 211 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.619 107.3 55.3 -55.5 -10.2 -31.9 -17.7 -16.0 40 42 A L T < 5S- 0 0 51 -3,-0.5 -1,-0.3 2,-0.2 -2,-0.2 0.265 116.9-112.4-101.9 11.4 -32.1 -16.9 -19.7 41 43 A G T < 5S+ 0 0 79 -3,-3.1 2,-0.4 1,-0.3 -3,-0.2 0.727 77.8 130.5 60.9 19.4 -31.1 -20.4 -21.0 42 44 A V < - 0 0 26 -5,-2.4 -1,-0.3 -6,-0.1 -2,-0.2 -0.841 49.4-152.6 -97.5 139.7 -27.8 -18.8 -22.2 43 45 A Q - 0 0 144 -2,-0.4 -24,-0.3 -3,-0.1 -25,-0.2 -0.948 20.5-154.6-112.9 105.2 -24.5 -20.4 -21.4 44 46 A P - 0 0 4 0, 0.0 2,-0.6 0, 0.0 -24,-0.2 -0.447 21.7-111.6 -73.8 146.1 -21.8 -17.6 -21.4 45 47 A L E -b 20 0A 71 -26,-3.7 -24,-2.6 -2,-0.1 2,-0.5 -0.769 41.6-157.2 -74.4 124.2 -18.2 -18.1 -22.1 46 48 A V E -b 21 0A 41 -2,-0.6 2,-0.7 -26,-0.2 -24,-0.2 -0.914 17.1-170.2-114.6 115.5 -16.6 -17.3 -18.7 47 49 A V E -b 22 0A 31 -26,-2.5 -24,-3.5 -2,-0.5 2,-0.9 -0.935 10.9-157.1-109.2 111.9 -13.0 -16.3 -18.1 48 50 A E E > -b 23 0A 35 -2,-0.7 3,-1.5 -26,-0.2 -24,-0.2 -0.836 2.8-163.2 -88.4 105.1 -12.2 -16.3 -14.5 49 51 A L G > S+ 0 0 2 -26,-3.5 3,-1.3 -2,-0.9 7,-0.2 0.758 84.1 60.8 -64.0 -32.4 -9.2 -13.9 -14.3 50 52 A D G 3 S+ 0 0 43 -27,-0.3 3,-0.4 1,-0.3 -1,-0.3 0.553 99.0 59.7 -72.3 -9.3 -8.0 -15.1 -10.8 51 53 A Q G < S+ 0 0 138 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.320 91.2 71.2-100.7 4.4 -7.5 -18.6 -12.2 52 54 A L S X S- 0 0 56 -3,-1.3 3,-2.1 1,-0.3 -1,-0.2 0.126 86.3-143.7-108.4 16.0 -4.9 -17.4 -14.8 53 55 A G T > S- 0 0 51 -3,-0.4 3,-1.0 1,-0.3 -1,-0.3 -0.332 77.9 -8.1 58.8-131.8 -1.9 -16.6 -12.5 54 56 A P T 3> S+ 0 0 108 0, 0.0 4,-1.1 0, 0.0 -1,-0.3 0.607 130.8 69.8 -70.3 -10.2 -0.0 -13.5 -13.8 55 57 A Q H <> S+ 0 0 86 -3,-2.1 4,-2.6 2,-0.2 5,-0.2 0.762 84.9 68.5 -81.2 -22.8 -2.1 -13.5 -17.0 56 58 A G H <> S+ 0 0 1 -3,-1.0 4,-2.2 -7,-0.2 -1,-0.2 0.966 103.1 41.5 -57.9 -55.0 -5.3 -12.4 -15.1 57 59 A P H > S+ 0 0 66 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.824 113.9 55.2 -65.7 -32.1 -4.0 -8.9 -14.3 58 60 A Q H X S+ 0 0 74 -4,-1.1 4,-2.4 2,-0.2 -2,-0.2 0.945 107.7 48.5 -59.0 -48.8 -2.6 -8.6 -17.8 59 61 A L H X S+ 0 0 13 -4,-2.6 4,-4.1 1,-0.2 5,-0.3 0.917 109.2 53.5 -57.1 -44.5 -6.0 -9.5 -19.3 60 62 A Q H X S+ 0 0 24 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.935 110.1 46.6 -59.7 -44.3 -7.5 -6.9 -17.1 61 63 A K H X S+ 0 0 123 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.835 113.9 48.7 -66.7 -29.9 -5.1 -4.2 -18.4 62 64 A V H X S+ 0 0 18 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.919 108.4 52.6 -76.6 -39.3 -5.7 -5.3 -21.9 63 65 A L H X>S+ 0 0 2 -4,-4.1 4,-3.2 1,-0.2 5,-0.6 0.933 110.4 50.0 -58.7 -40.4 -9.5 -5.2 -21.5 64 66 A E H X5S+ 0 0 89 -4,-2.1 4,-1.6 -5,-0.3 -1,-0.2 0.885 108.7 51.4 -66.8 -37.1 -9.1 -1.7 -20.2 65 67 A R H <5S+ 0 0 197 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.899 116.6 41.3 -63.8 -38.0 -7.0 -0.8 -23.1 66 68 A L H <5S+ 0 0 44 -4,-2.4 -2,-0.2 3,-0.1 -1,-0.2 0.938 135.1 11.8 -69.1 -49.1 -9.7 -2.1 -25.5 67 69 A T H <5S- 0 0 40 -4,-3.2 -3,-0.2 2,-0.2 -2,-0.2 0.520 92.2-118.7-120.2 -15.9 -12.8 -0.9 -23.8 68 70 A G S < S-AC 19 80A 0 3,-2.7 3,-2.0 -2,-0.4 -58,-0.2 -0.981 72.4 -17.7-119.7 121.5 -22.9 -9.9 -25.8 78 80 A C T 3 S- 0 0 40 -60,-4.4 -60,-0.1 -2,-0.5 -59,-0.1 0.758 128.5 -49.0 61.8 29.9 -22.9 -10.7 -29.6 79 81 A G T 3 S+ 0 0 31 -65,-0.4 2,-0.4 -62,-0.4 -1,-0.3 0.299 117.8 109.3 92.0 -11.9 -19.6 -9.1 -30.2 80 82 A K E < -C 77 0A 119 -3,-2.0 -3,-2.7 -66,-0.1 2,-0.5 -0.841 69.4-122.6-105.2 143.3 -20.6 -5.9 -28.4 81 83 A H E +C 76 0A 73 -2,-0.4 -5,-0.2 -5,-0.2 3,-0.1 -0.687 35.9 162.1 -84.1 125.8 -19.3 -4.5 -25.0 82 84 A I - 0 0 24 -7,-2.7 2,-0.2 -2,-0.5 -6,-0.1 0.659 33.5-171.4 -91.8 -30.5 -22.1 -4.0 -22.5 83 85 A G + 0 0 3 -8,-0.5 -8,-2.8 4,-0.1 -1,-0.2 -0.734 26.7 39.5-115.8 -14.7 -19.9 -3.9 -20.3 84 86 A G S > S- 0 0 10 -2,-0.2 4,-1.5 -10,-0.2 5,-0.2 -0.177 73.4-100.4 -88.7-178.2 -20.5 -3.9 -16.4 85 87 A C H > S+ 0 0 8 -12,-0.2 4,-2.5 2,-0.2 5,-0.2 0.898 122.3 43.5 -68.8 -41.1 -22.9 -5.7 -13.9 86 88 A T H > S+ 0 0 94 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.839 113.9 53.4 -78.7 -24.7 -25.2 -2.7 -13.4 87 89 A D H > S+ 0 0 71 2,-0.2 4,-1.0 3,-0.2 -1,-0.2 0.785 113.5 41.9 -67.3 -36.0 -25.1 -2.1 -17.2 88 90 A T H < S+ 0 0 0 -4,-1.5 -2,-0.2 2,-0.2 -3,-0.2 0.845 115.6 50.2 -77.5 -42.6 -26.1 -5.7 -18.0 89 91 A V H >X S+ 0 0 23 -4,-2.5 3,-1.4 1,-0.2 4,-0.5 0.925 112.8 45.5 -61.1 -43.0 -28.7 -5.7 -15.2 90 92 A K H 3X S+ 0 0 132 -4,-2.1 4,-1.9 1,-0.3 3,-0.5 0.829 110.0 55.3 -73.0 -28.6 -30.2 -2.4 -16.5 91 93 A L H 3< S+ 0 0 36 -4,-1.0 6,-0.8 1,-0.2 -1,-0.3 0.296 108.8 48.6 -84.5 9.9 -30.2 -3.6 -20.0 92 94 A N H <4 S+ 0 0 41 -3,-1.4 -1,-0.2 4,-0.2 -2,-0.2 0.350 108.3 50.9-130.6 -6.1 -32.2 -6.7 -19.0 93 95 A R H < S+ 0 0 207 -4,-0.5 -2,-0.2 -3,-0.5 -3,-0.1 0.830 110.4 48.7 -87.0 -58.0 -34.9 -4.9 -17.0 94 96 A K S < S- 0 0 137 -4,-1.9 -3,-0.1 1,-0.1 -2,-0.1 0.513 115.0-132.8 -55.0 -2.0 -35.5 -2.6 -20.0 95 97 A G >> + 0 0 20 1,-0.1 4,-1.0 -5,-0.1 3,-0.8 0.446 69.5 126.8 67.0 6.3 -35.5 -6.0 -21.7 96 98 A D H 3> + 0 0 82 1,-0.2 4,-1.7 2,-0.2 -4,-0.2 0.480 65.9 64.3 -78.2 -0.8 -33.2 -5.1 -24.6 97 99 A L H 3> S+ 0 0 0 -6,-0.8 4,-1.2 2,-0.2 -1,-0.2 0.756 93.7 57.6 -88.0 -34.0 -31.0 -8.1 -23.9 98 100 A E H <4 S+ 0 0 126 -3,-0.8 -2,-0.2 2,-0.2 4,-0.1 0.945 113.6 44.0 -57.1 -48.6 -33.7 -10.7 -24.7 99 101 A L H >< S+ 0 0 125 -4,-1.0 3,-3.8 1,-0.2 -2,-0.2 0.987 110.5 48.1 -61.1 -69.3 -33.8 -9.0 -28.1 100 102 A M H 3< S+ 0 0 40 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.685 99.8 69.9 -54.4 -18.2 -30.1 -8.5 -29.0 101 103 A L T 3< S+ 0 0 22 -4,-1.2 2,-0.6 1,-0.1 -1,-0.3 0.649 77.9 111.1 -67.6 -10.0 -29.5 -12.2 -28.0 102 104 A A < 0 0 84 -3,-3.8 -1,-0.1 1,-0.5 -4,-0.0 -0.876 360.0 360.0-115.4 102.8 -31.5 -12.9 -31.2 103 105 A E 0 0 182 -2,-0.6 -1,-0.5 0, 0.0 -2,-0.1 0.544 360.0 360.0 -94.1 360.0 -29.4 -14.1 -32.8 104 !* 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 0.0 105 6 B S > 0 0 93 0, 0.0 4,-1.3 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 159.2 -4.6 -15.8 19.7 106 7 B R H > + 0 0 213 1,-0.2 4,-0.6 2,-0.2 5,-0.0 0.579 360.0 57.6 -66.8 -16.2 -3.4 -12.2 19.0 107 8 B M H > S+ 0 0 24 2,-0.2 4,-2.2 3,-0.1 -1,-0.2 0.878 101.8 54.0 -81.8 -37.8 -6.0 -11.8 16.2 108 9 B E H > S+ 0 0 70 1,-0.3 4,-2.9 2,-0.2 -2,-0.2 0.880 108.8 48.9 -59.2 -42.3 -8.9 -12.6 18.4 109 10 B E H X S+ 0 0 111 -4,-1.3 4,-2.2 2,-0.2 -1,-0.3 0.811 109.4 53.8 -64.1 -34.7 -7.9 -9.8 20.8 110 11 B S H X S+ 0 0 61 -4,-0.6 4,-2.4 2,-0.2 -2,-0.2 0.930 113.4 40.9 -70.4 -43.7 -7.5 -7.5 17.9 111 12 B I H X S+ 0 0 6 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.975 113.8 51.5 -65.1 -59.0 -11.1 -8.2 16.7 112 13 B R H X S+ 0 0 152 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.872 117.0 43.3 -46.8 -41.4 -12.6 -8.2 20.2 113 14 B K H X S+ 0 0 133 -4,-2.2 4,-1.0 2,-0.2 -1,-0.2 0.880 112.9 48.3 -72.0 -43.0 -10.9 -4.8 20.8 114 15 B T H X S+ 0 0 28 -4,-2.4 4,-0.7 1,-0.2 -2,-0.2 0.909 115.1 48.3 -64.3 -36.7 -11.6 -3.1 17.4 115 16 B V H >< S+ 0 0 9 -4,-2.8 3,-0.7 1,-0.2 65,-0.7 0.926 111.6 43.3 -74.1 -49.2 -15.2 -4.1 17.7 116 17 B T H 3< S+ 0 0 110 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.641 116.6 51.5 -72.2 -11.3 -16.1 -3.0 21.3 117 18 B E H 3< S+ 0 0 142 -4,-1.0 2,-0.3 -5,-0.1 -1,-0.2 0.467 106.3 54.3-108.7 -10.9 -14.2 0.3 20.7 118 19 B N S << S- 0 0 59 -4,-0.7 62,-0.6 -3,-0.7 3,-0.2 -0.988 72.1-138.2-125.1 144.9 -15.8 1.5 17.4 119 20 B T S S+ 0 0 73 -2,-0.3 60,-2.9 1,-0.3 2,-0.4 0.965 94.9 18.9 -60.4 -56.0 -19.5 1.9 16.7 120 21 B V E -D 178 0B 2 58,-0.2 26,-3.0 24,-0.2 2,-0.4 -0.978 68.2-175.8-118.2 124.3 -19.3 0.3 13.3 121 22 B V E -De 177 146B 0 56,-2.1 56,-2.3 -2,-0.4 2,-0.5 -0.965 5.0-167.3-114.9 132.3 -16.4 -1.9 12.1 122 23 B I E -De 176 147B 0 24,-2.6 26,-2.8 -2,-0.4 2,-0.6 -0.965 9.1-156.9-121.8 112.6 -16.4 -3.2 8.5 123 24 B Y E +De 175 148B 3 52,-2.7 52,-2.3 -2,-0.5 26,-0.2 -0.841 42.3 155.3 -82.0 123.0 -13.9 -6.0 7.6 124 25 B S E - e 0 149B 0 24,-3.0 26,-2.7 -2,-0.6 27,-0.4 -0.665 48.2-120.0-143.7 174.8 -13.6 -5.4 4.0 125 26 B K > - 0 0 39 24,-0.2 3,-1.7 -2,-0.2 6,-0.1 -0.993 23.4-137.0-133.5 132.3 -11.6 -5.6 0.6 126 27 B T T 3 S+ 0 0 63 -2,-0.4 -1,-0.1 1,-0.3 23,-0.0 0.719 103.5 49.9 -59.8 -21.2 -10.7 -2.5 -1.3 127 28 B W T 3 S+ 0 0 129 -3,-0.0 2,-0.6 4,-0.0 -1,-0.3 0.448 87.2 105.3 -97.1 4.5 -11.7 -4.0 -4.6 128 29 B C <> - 0 0 26 -3,-1.7 4,-2.2 1,-0.1 -3,-0.2 -0.724 52.2-161.1-100.8 116.2 -15.2 -5.3 -3.5 129 30 B S H > S+ 0 0 56 -2,-0.6 4,-1.4 2,-0.2 -1,-0.1 0.835 95.0 56.0 -61.9 -36.7 -18.3 -3.5 -4.6 130 31 B Y H > S+ 0 0 53 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.941 109.1 48.4 -56.4 -45.9 -20.5 -5.1 -1.9 131 32 B C H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.922 110.0 51.5 -55.5 -47.1 -17.9 -3.6 0.7 132 33 B T H X S+ 0 0 66 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.809 107.3 53.9 -64.4 -24.8 -18.2 -0.3 -1.0 133 34 B E H X S+ 0 0 84 -4,-1.4 4,-1.9 -3,-0.3 -1,-0.2 0.939 109.7 45.8 -79.2 -45.5 -21.9 -0.4 -0.8 134 35 B V H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.900 112.1 50.8 -62.4 -40.5 -21.8 -1.0 3.0 135 36 B K H X S+ 0 0 35 -4,-2.9 4,-1.4 1,-0.2 -1,-0.2 0.923 111.4 50.6 -64.7 -39.3 -19.3 1.7 3.5 136 37 B T H X S+ 0 0 39 -4,-1.9 4,-1.4 -5,-0.2 -2,-0.2 0.848 106.6 53.0 -64.9 -33.1 -21.5 4.1 1.5 137 38 B L H >X S+ 0 0 15 -4,-1.9 4,-1.3 1,-0.2 3,-0.6 0.971 107.8 49.6 -73.6 -46.2 -24.7 3.3 3.5 138 39 B F H 3<>S+ 0 0 0 -4,-1.7 5,-1.0 1,-0.2 -1,-0.2 0.836 109.4 53.8 -54.1 -37.2 -23.1 4.1 6.9 139 40 B K H ><5S+ 0 0 112 -4,-1.4 3,-1.4 1,-0.2 -1,-0.2 0.809 102.3 56.1 -66.2 -34.7 -21.8 7.4 5.5 140 41 B R H <<5S+ 0 0 191 -4,-1.4 -1,-0.2 -3,-0.6 -2,-0.2 0.810 106.6 53.2 -66.8 -29.9 -25.3 8.4 4.3 141 42 B L T 3<5S- 0 0 43 -4,-1.3 -1,-0.3 2,-0.2 -2,-0.2 0.293 121.5-108.6 -87.3 6.5 -26.3 7.8 8.0 142 43 B G T < 5S+ 0 0 67 -3,-1.4 2,-0.3 1,-0.3 -3,-0.2 0.085 80.0 122.6 89.3 -26.6 -23.6 10.1 9.2 143 44 B V < - 0 0 28 -5,-1.0 -1,-0.3 -24,-0.0 -2,-0.2 -0.541 51.7-150.4 -69.7 129.9 -21.4 7.4 10.8 144 45 B Q - 0 0 147 -2,-0.3 -24,-0.2 -3,-0.1 2,-0.1 -0.930 28.0-145.3 -93.1 111.7 -17.8 7.2 9.6 145 46 B P - 0 0 13 0, 0.0 2,-0.9 0, 0.0 -24,-0.2 -0.447 14.6-111.8 -78.6 155.5 -17.1 3.5 10.0 146 47 B L E -e 121 0B 66 -26,-3.0 -24,-2.6 -2,-0.1 2,-0.5 -0.778 39.0-160.1 -77.8 108.2 -13.8 1.9 11.0 147 48 B V E -e 122 0B 52 -2,-0.9 2,-0.6 -26,-0.2 -24,-0.2 -0.803 13.0-169.0 -96.2 121.8 -12.8 -0.0 7.8 148 49 B V E -e 123 0B 30 -26,-2.8 -24,-3.0 -2,-0.5 2,-0.9 -0.951 13.0-153.9-105.1 109.7 -10.2 -2.9 8.1 149 50 B E E > -e 124 0B 30 -2,-0.6 3,-1.5 -26,-0.2 -24,-0.2 -0.747 2.2-160.8 -85.0 101.2 -9.2 -3.8 4.5 150 51 B L G > S+ 0 0 1 -26,-2.7 3,-1.1 -2,-0.9 7,-0.2 0.795 87.6 58.3 -57.1 -34.7 -8.1 -7.4 4.6 151 52 B D G 3 S+ 0 0 45 -27,-0.4 3,-0.3 1,-0.2 -1,-0.3 0.734 98.0 59.6 -66.7 -27.5 -6.2 -7.2 1.3 152 53 B Q G < S+ 0 0 136 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.226 88.5 84.0 -79.6 16.8 -3.9 -4.4 2.7 153 54 B L S X> S- 0 0 63 -3,-1.1 3,-1.5 1,-0.4 4,-1.0 -0.125 85.6-132.6-119.2 41.1 -2.7 -6.7 5.5 154 55 B G T >4 S- 0 0 58 -3,-0.3 3,-1.0 1,-0.3 -1,-0.4 -0.075 76.5 -25.5 46.8-147.3 0.1 -8.8 4.0 155 56 B P T 3> S+ 0 0 111 0, 0.0 4,-0.8 0, 0.0 -1,-0.3 0.574 132.9 75.2 -70.7 -8.8 -0.2 -12.6 4.7 156 57 B Q H <> S+ 0 0 103 -3,-1.5 4,-3.8 2,-0.2 5,-0.2 0.758 77.2 73.7 -71.3 -31.7 -2.3 -11.6 7.8 157 58 B G H S+ 0 0 89 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.874 114.7 52.9 -67.0 -30.0 -6.3 -14.3 5.1 159 60 B Q H >X S+ 0 0 99 -4,-0.8 4,-1.9 2,-0.2 3,-0.5 0.960 111.7 47.0 -61.1 -51.9 -5.3 -15.3 8.7 160 61 B L H 3X S+ 0 0 10 -4,-3.8 4,-2.5 1,-0.2 5,-0.2 0.917 107.0 56.5 -54.7 -46.6 -7.7 -12.5 9.9 161 62 B Q H 3< S+ 0 0 32 -4,-3.0 4,-0.5 1,-0.2 -1,-0.2 0.808 108.2 48.6 -59.9 -31.1 -10.5 -13.7 7.6 162 63 B K H S+ 0 0 63 -4,-0.5 4,-4.2 -5,-0.2 3,-0.5 0.921 107.9 47.5 -76.3 -39.9 -15.1 -17.0 10.5 166 67 B R H < S+ 0 0 225 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.1 0.908 118.1 40.8 -62.4 -42.2 -14.6 -18.9 13.8 167 68 B L T < S+ 0 0 58 -4,-2.1 -1,-0.2 1,-0.1 -2,-0.2 0.515 136.8 18.2 -79.4 -6.9 -16.0 -15.9 15.9 168 69 B T T 4 S- 0 0 30 -3,-0.5 -3,-0.2 -4,-0.4 -2,-0.2 0.563 89.5-128.1-141.6 -26.6 -18.8 -15.3 13.4 169 70 B G S < S+ 0 0 59 -4,-4.2 2,-0.5 1,-0.2 -4,-0.2 0.630 73.0 122.7 70.1 14.5 -19.2 -18.4 11.2 170 71 B Q + 0 0 25 -6,-0.7 -1,-0.2 1,-0.1 -3,-0.1 -0.943 36.9 175.2-116.4 120.8 -18.9 -16.0 8.2 171 72 B H + 0 0 136 -2,-0.5 -1,-0.1 -6,-0.1 -6,-0.1 0.694 58.7 84.7 -91.4 -23.6 -16.2 -16.5 5.6 172 73 B T S S- 0 0 78 2,-0.1 -2,-0.1 -7,-0.1 12,-0.0 -0.236 74.3 -95.1 -84.8 165.3 -17.4 -13.7 3.3 173 74 B V S S+ 0 0 28 1,-0.1 -49,-0.1 2,-0.1 2,-0.1 -0.922 91.7 53.4-115.7 151.8 -16.8 -10.0 3.2 174 75 B P - 0 0 2 0, 0.0 2,-0.6 0, 0.0 -50,-0.2 0.511 65.8-175.6 -77.4 147.8 -18.0 -7.5 4.0 175 76 B N E -D 123 0B 1 -52,-2.3 -52,-2.7 -2,-0.1 2,-0.4 -0.981 14.4-161.4-110.4 113.8 -18.2 -8.6 7.7 176 77 B V E -DF 122 184B 0 8,-3.5 7,-1.8 -2,-0.6 8,-1.2 -0.811 13.3-169.8-109.4 137.8 -20.1 -5.8 9.6 177 78 B F E -DF 121 182B 15 -56,-2.3 -56,-2.1 -2,-0.4 2,-0.4 -0.999 1.9-171.9-129.7 128.8 -20.2 -5.1 13.3 178 79 B V E > S-DF 120 181B 3 3,-3.4 3,-2.9 -2,-0.4 -58,-0.2 -0.991 72.4 -16.1-125.9 122.9 -22.6 -2.6 14.9 179 80 B C T 3 S- 0 0 52 -60,-2.9 -1,-0.2 -2,-0.4 -60,-0.1 0.910 130.0 -50.2 44.7 55.2 -22.3 -1.6 18.6 180 81 B G T 3 S+ 0 0 32 -65,-0.7 2,-0.4 -62,-0.6 -1,-0.3 0.344 118.8 115.2 73.0 -5.8 -20.1 -4.6 19.3 181 82 B K E < -F 178 0B 161 -3,-2.9 -3,-3.4 -66,-0.1 2,-0.8 -0.815 69.0-122.4-106.8 139.8 -22.6 -6.9 17.6 182 83 B H E +F 177 0B 68 -2,-0.4 -5,-0.3 -5,-0.2 -3,-0.0 -0.614 28.8 174.0 -75.1 107.4 -22.1 -8.9 14.5 183 84 B I E - 0 0 30 -7,-1.8 2,-0.4 -2,-0.8 -6,-0.2 0.448 36.0-139.6 -94.7 0.2 -24.7 -7.9 11.9 184 85 B G E -F 176 0B 4 -8,-1.2 -8,-3.5 4,-0.1 -1,-0.3 -0.677 41.9 -12.5 89.1-127.9 -23.1 -10.1 9.1 185 86 B G S > S- 0 0 4 -2,-0.4 4,-1.8 -10,-0.2 -10,-0.1 0.050 75.0 -73.6-107.7-159.9 -22.8 -9.1 5.4 186 87 B C H > S+ 0 0 5 2,-0.2 4,-1.9 -12,-0.2 5,-0.1 0.925 124.1 38.5 -68.8 -48.4 -24.0 -6.5 2.8 187 88 B T H > S+ 0 0 75 2,-0.2 4,-3.6 1,-0.2 5,-0.2 0.906 114.1 55.8 -75.8 -38.9 -27.6 -7.6 2.2 188 89 B D H > S+ 0 0 62 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.946 113.8 41.5 -51.8 -47.4 -28.1 -8.4 5.8 189 90 B T H X S+ 0 0 0 -4,-1.8 4,-0.9 2,-0.2 -2,-0.2 0.771 114.0 51.5 -71.0 -30.7 -27.0 -4.7 6.5 190 91 B V H >X S+ 0 0 29 -4,-1.9 4,-1.8 2,-0.2 3,-0.8 0.952 105.7 56.3 -71.6 -40.8 -29.0 -3.4 3.6 191 92 B K H 3X S+ 0 0 109 -4,-3.6 4,-1.8 1,-0.3 3,-0.3 0.885 108.4 47.0 -53.4 -50.1 -32.1 -5.2 4.9 192 93 B L H 3X S+ 0 0 33 -4,-1.6 6,-1.4 1,-0.2 4,-1.4 0.695 110.7 53.1 -64.6 -26.0 -31.8 -3.4 8.3 193 94 B N H << S+ 0 0 51 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.826 106.4 49.0 -81.5 -31.2 -31.3 -0.1 6.6 194 95 B R H < S+ 0 0 196 -4,-1.8 -2,-0.2 -3,-0.3 -3,-0.1 0.913 115.0 47.6 -72.9 -43.8 -34.5 -0.2 4.4 195 96 B K H < S- 0 0 138 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.898 108.9-124.5 -46.7 -57.6 -36.5 -1.2 7.5 196 97 B G S >X S+ 0 0 34 -4,-1.4 4,-0.6 -5,-0.1 3,-0.6 0.275 78.9 120.0 110.7 -3.0 -35.1 1.5 9.7 197 98 B D T 34 + 0 0 79 -5,-0.4 4,-0.2 1,-0.2 -4,-0.2 0.570 65.0 67.7 -63.7 -12.9 -33.9 -1.0 12.3 198 99 B L T >> S+ 0 0 0 -6,-1.4 4,-1.8 1,-0.2 3,-0.9 0.856 94.2 50.9 -83.5 -37.8 -30.3 0.2 11.7 199 100 B E H <> S+ 0 0 114 -3,-0.6 4,-1.6 -7,-0.3 -1,-0.2 0.759 100.9 69.6 -65.5 -23.0 -30.6 3.8 13.2 200 101 B L H 3< S+ 0 0 117 -4,-0.6 4,-0.4 2,-0.2 -1,-0.2 0.584 105.8 34.9 -76.7 -16.5 -32.1 2.0 16.3 201 102 B M H <4 S+ 0 0 42 -3,-0.9 -1,-0.2 -4,-0.2 -2,-0.2 0.731 115.5 57.0 -96.5 -39.2 -28.8 0.5 17.3 202 103 B L H < S+ 0 0 35 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.2 0.711 98.8 61.8 -60.0 -24.8 -26.9 3.5 16.1 203 104 B A < 0 0 82 -4,-1.6 -1,-0.2 -5,-0.1 -3,-0.1 0.972 360.0 360.0 -62.8 -54.0 -29.1 5.7 18.5 204 105 B E 0 0 194 -4,-0.4 -2,-0.2 -5,-0.1 -3,-0.1 0.970 360.0 360.0 -63.1 360.0 -27.6 3.7 21.4