==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 11-AUG-03 1Q5Y . COMPND 2 MOLECULE: NICKEL RESPONSIVE REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR E.R.SCHREITER,M.D.SINTCHAK,Y.GUO,P.T.CHIVERS,R.T.SAUER, . 329 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13485.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 274 83.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 127 38.6 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 . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 . 34 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 0 0 0 1 0 0 5 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 2 0 0 0 8 0 0 1 3 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 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 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 50 A T 0 0 117 0, 0.0 55,-3.6 0, 0.0 56,-0.4 0.000 360.0 360.0 360.0 116.9 9.5 58.1 33.1 2 51 A Q E +A 55 0A 92 53,-0.3 80,-3.3 54,-0.1 2,-0.3 -0.592 360.0 109.2 -94.2 167.1 10.0 54.4 32.3 3 52 A G E -AB 54 81A 3 51,-1.0 51,-2.3 78,-0.3 2,-0.3 -0.989 56.0 -74.2 167.6-159.8 11.9 53.1 29.3 4 53 A F E -AB 53 80A 24 76,-2.5 76,-3.1 -2,-0.3 2,-0.3 -0.799 32.6-168.5-121.6 167.7 14.9 51.4 27.9 5 54 A A E -AB 52 79A 0 47,-2.0 47,-2.7 -2,-0.3 2,-0.5 -0.985 18.3-138.9-153.4 159.9 18.5 52.6 27.4 6 55 A V E -AB 51 78A 6 72,-2.4 72,-2.2 -2,-0.3 2,-0.5 -0.976 21.7-173.5-120.7 117.5 21.6 51.4 25.6 7 56 A L E +AB 50 77A 0 43,-2.8 43,-3.3 -2,-0.5 2,-0.3 -0.956 6.4 179.1-113.3 125.5 24.9 51.9 27.6 8 57 A S E +AB 49 76A 1 68,-2.6 68,-2.7 -2,-0.5 2,-0.3 -0.932 7.2 154.6-128.8 154.1 28.2 51.1 25.9 9 58 A Y E -A 48 0A 0 39,-1.9 39,-2.7 -2,-0.3 2,-0.4 -0.965 30.4-129.1-168.1 162.3 31.8 51.4 27.1 10 59 A V E +AB 47 73A 5 63,-2.6 63,-3.1 -2,-0.3 2,-0.3 -0.964 30.0 161.7-122.9 139.4 35.3 50.0 26.5 11 60 A Y E -A 46 0A 14 35,-2.0 35,-3.1 -2,-0.4 2,-0.5 -0.976 42.0-104.9-150.6 162.7 37.6 48.6 29.1 12 61 A E E > -A 45 0A 70 59,-0.4 3,-1.3 -2,-0.3 7,-0.2 -0.800 23.6-149.2 -88.2 124.6 40.7 46.5 29.5 13 62 A H T 3 S+ 0 0 19 31,-1.4 6,-0.1 -2,-0.5 -1,-0.1 0.769 92.5 67.8 -67.0 -21.3 39.8 43.0 30.8 14 63 A E T 3 S+ 0 0 77 30,-0.4 2,-2.3 1,-0.2 -1,-0.2 0.693 75.7 87.3 -75.0 -17.4 43.2 42.6 32.6 15 64 A K <> + 0 0 89 -3,-1.3 4,-2.3 1,-0.2 5,-0.2 -0.587 67.0 179.7 -72.4 80.9 42.1 45.3 34.9 16 65 A R H > + 0 0 58 -2,-2.3 4,-2.1 1,-0.2 5,-0.2 0.839 69.6 52.0 -62.8 -34.7 40.5 42.6 37.0 17 66 A D H > S+ 0 0 131 -3,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.967 111.2 48.0 -72.6 -40.5 39.1 44.8 39.8 18 67 A L H > S+ 0 0 26 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.951 112.0 49.5 -55.4 -50.5 37.4 47.1 37.3 19 68 A A H X S+ 0 0 6 -4,-2.3 4,-2.2 1,-0.2 5,-0.2 0.899 109.9 49.7 -60.0 -39.7 35.9 44.2 35.4 20 69 A S H X S+ 0 0 4 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.904 110.0 53.7 -66.1 -37.3 34.5 42.5 38.5 21 70 A R H X S+ 0 0 54 -4,-2.1 4,-2.6 -5,-0.2 5,-0.2 0.916 106.7 50.9 -57.3 -48.7 33.1 45.9 39.5 22 71 A I H X S+ 0 0 10 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.927 115.3 40.3 -62.3 -46.9 31.3 46.3 36.2 23 72 A V H X S+ 0 0 28 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.920 115.3 51.6 -69.9 -40.3 29.6 42.8 36.3 24 73 A S H X S+ 0 0 42 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.901 106.9 53.2 -66.0 -38.9 28.8 43.0 40.0 25 74 A T H X S+ 0 0 34 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.918 108.5 51.0 -60.8 -38.8 27.2 46.3 39.6 26 75 A Q H < S+ 0 0 2 -4,-1.4 7,-0.3 -5,-0.2 -1,-0.2 0.887 110.6 48.3 -67.2 -35.5 25.0 44.9 36.9 27 76 A H H >< S+ 0 0 4 -4,-2.1 3,-1.4 1,-0.2 -1,-0.2 0.869 108.7 53.3 -71.8 -33.0 24.0 42.0 39.1 28 77 A H H 3< S+ 0 0 59 -4,-2.7 3,-0.2 1,-0.3 -2,-0.2 0.907 122.3 31.3 -64.4 -40.2 23.3 44.3 42.0 29 78 A H T >X S+ 0 0 81 -4,-2.2 3,-1.7 -5,-0.2 4,-0.9 -0.327 80.1 138.4-103.4 41.8 21.0 46.2 39.6 30 79 A H G X4 + 0 0 60 -3,-1.4 3,-0.6 1,-0.3 -1,-0.2 0.825 64.6 66.4 -65.0 -23.1 20.1 43.1 37.7 31 80 A D G 34 S+ 0 0 115 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.813 103.4 45.9 -58.5 -33.7 16.5 44.4 37.6 32 81 A L G <4 S+ 0 0 9 -3,-1.7 21,-2.3 -6,-0.2 2,-0.5 0.628 100.6 84.1 -85.3 -15.7 17.7 47.2 35.4 33 82 A S E << +C 52 0A 18 -4,-0.9 19,-0.2 -3,-0.6 3,-0.1 -0.735 43.4 172.1 -98.4 127.7 19.8 44.9 33.2 34 83 A V E - 0 0 26 17,-2.9 2,-0.3 -2,-0.5 -1,-0.2 0.901 66.8 -44.6 -88.4 -58.6 18.2 43.1 30.3 35 84 A A E -C 51 0A 0 16,-0.9 16,-2.7 172,-0.1 2,-0.4 -0.955 49.2-132.7-166.2 161.4 21.4 41.6 28.6 36 85 A T E -CD 50 206A 1 170,-2.6 170,-3.4 -2,-0.3 2,-0.4 -0.995 8.1-149.3-129.9 134.4 24.8 42.7 27.6 37 86 A L E -CD 49 205A 0 12,-2.7 12,-2.6 -2,-0.4 2,-0.4 -0.868 18.0-165.8 -98.3 130.6 26.7 42.1 24.3 38 87 A H E -CD 48 204A 7 166,-3.0 166,-2.6 -2,-0.4 2,-0.5 -0.983 10.8-170.6-124.6 132.5 30.5 41.8 24.6 39 88 A V E -C 47 0A 6 8,-3.0 8,-2.7 -2,-0.4 2,-1.5 -0.994 19.0-147.6-121.9 121.8 33.0 42.0 21.8 40 89 A H E -C 46 0A 15 -2,-0.5 6,-0.2 6,-0.2 161,-0.1 -0.738 26.0-178.2 -80.7 87.6 36.6 41.1 22.6 41 90 A I - 0 0 29 -2,-1.5 2,-0.2 4,-0.9 -1,-0.2 0.838 59.1 -15.4 -71.8 -26.0 37.7 43.6 20.0 42 91 A N S S- 0 0 56 3,-1.4 -1,-0.0 -3,-0.1 154,-0.0 -0.872 88.2 -73.6-157.9-175.4 41.5 42.9 20.5 43 92 A H S S+ 0 0 98 -2,-0.2 152,-0.1 1,-0.2 154,-0.1 0.853 128.0 26.5 -58.8 -33.7 43.8 41.1 23.0 44 93 A D S S+ 0 0 102 -32,-0.1 -31,-1.4 -31,-0.1 -30,-0.4 0.797 109.2 65.5 -99.2 -34.6 43.4 43.9 25.5 45 94 A D E -A 12 0A 19 -33,-0.2 -3,-1.4 -32,-0.1 -4,-0.9 -0.746 51.5-160.6-110.3 145.9 40.1 45.7 25.1 46 95 A C E -AC 11 40A 0 -35,-3.1 -35,-2.0 -2,-0.3 2,-0.5 -0.944 6.2-155.6-117.1 136.7 36.5 44.8 25.5 47 96 A L E -AC 10 39A 0 -8,-2.7 -8,-3.0 -2,-0.4 2,-0.4 -0.974 19.6-173.7-107.3 123.5 33.5 46.6 24.0 48 97 A E E -AC 9 38A 22 -39,-2.7 -39,-1.9 -2,-0.5 2,-0.5 -0.967 14.6-167.3-123.0 140.6 30.3 46.1 26.0 49 98 A I E -AC 8 37A 0 -12,-2.6 -12,-2.7 -2,-0.4 2,-0.5 -0.983 9.8-166.0-125.5 113.5 26.8 47.1 25.2 50 99 A A E -AC 7 36A 0 -43,-3.3 -43,-2.8 -2,-0.5 2,-0.6 -0.895 11.0-148.7-102.6 126.0 24.3 46.8 28.0 51 100 A V E -AC 6 35A 0 -16,-2.7 -17,-2.9 -2,-0.5 -16,-0.9 -0.853 23.1-167.8 -90.8 124.6 20.5 47.1 27.4 52 101 A L E -AC 5 33A 0 -47,-2.7 -47,-2.0 -2,-0.6 2,-0.4 -0.796 9.9-169.3-113.0 153.0 18.9 48.6 30.4 53 102 A K E +A 4 0A 96 -21,-2.3 2,-0.3 -2,-0.3 -49,-0.2 -0.987 39.4 60.7-144.2 132.0 15.2 48.8 31.3 54 103 A G E S-A 3 0A 9 -51,-2.3 -51,-1.0 -2,-0.4 2,-0.1 -0.971 86.6 -7.6 154.8-163.0 13.5 50.8 34.1 55 104 A D E > -A 2 0A 62 -2,-0.3 4,-2.4 -53,-0.2 -53,-0.3 -0.479 62.2-129.9 -58.8 132.5 12.8 54.3 35.4 56 105 A M H > S+ 0 0 12 -55,-3.6 4,-2.4 1,-0.2 5,-0.2 0.766 106.1 54.7 -63.0 -27.1 15.0 56.7 33.4 57 106 A G H > S+ 0 0 40 -56,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.952 111.3 44.8 -69.6 -44.8 16.4 58.3 36.6 58 107 A D H > S+ 0 0 87 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.893 113.0 51.4 -61.0 -41.9 17.5 55.0 37.9 59 108 A V H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.936 112.4 45.7 -65.6 -41.3 18.9 54.0 34.4 60 109 A Q H X S+ 0 0 91 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.870 111.1 51.6 -71.2 -37.3 20.9 57.2 34.2 61 110 A H H X S+ 0 0 137 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.938 112.9 47.1 -59.1 -46.4 22.2 57.0 37.7 62 111 A F H X S+ 0 0 9 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.953 110.7 50.7 -59.5 -50.1 23.4 53.5 37.0 63 112 A A H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.923 108.3 54.4 -56.9 -37.7 25.0 54.4 33.7 64 113 A D H X S+ 0 0 101 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.922 102.8 54.9 -61.3 -44.5 26.8 57.3 35.5 65 114 A D H < S+ 0 0 70 -4,-2.0 3,-0.5 1,-0.2 -1,-0.2 0.948 114.0 42.0 -58.8 -44.7 28.3 55.0 38.0 66 115 A V H >< S+ 0 0 10 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.919 114.9 47.3 -62.8 -47.8 29.7 52.8 35.2 67 116 A I H 3< S+ 0 0 54 -4,-2.8 8,-0.2 1,-0.3 -1,-0.2 0.621 107.2 58.8 -75.0 -12.6 30.9 55.6 32.9 68 117 A A T 3< S+ 0 0 86 -4,-1.4 2,-0.5 -3,-0.5 -1,-0.3 0.040 79.1 110.1-107.8 15.2 32.6 57.5 35.7 69 118 A Q S X S- 0 0 35 -3,-1.3 3,-2.3 -5,-0.0 2,-0.1 -0.848 78.4-112.0 -96.3 128.0 34.9 54.7 36.7 70 119 A R T 3 S+ 0 0 100 -2,-0.5 3,-0.1 1,-0.3 -2,-0.1 -0.343 106.9 34.8 -55.5 129.4 38.6 55.2 35.9 71 120 A G T 3 S+ 0 0 16 1,-0.4 2,-0.6 -2,-0.1 -59,-0.4 0.112 89.2 111.1 106.1 -24.3 39.5 52.7 33.2 72 121 A V < - 0 0 17 -3,-2.3 -1,-0.4 -6,-0.1 2,-0.3 -0.780 49.7-172.7 -85.1 124.3 36.1 52.9 31.5 73 122 A R E +B 10 0A 54 -63,-3.1 -63,-2.6 -2,-0.6 -3,-0.0 -0.817 55.5 15.2-114.8 157.9 36.5 54.6 28.1 74 123 A H E S- 0 0 82 -2,-0.3 -1,-0.2 -65,-0.2 -66,-0.1 0.789 76.2-175.7 55.8 28.3 34.2 55.8 25.4 75 124 A G E + 0 0 29 -8,-0.2 2,-0.4 -3,-0.2 -66,-0.2 -0.336 6.3 174.2 -58.7 133.4 31.2 55.6 27.8 76 125 A H E -B 8 0A 60 -68,-2.7 -68,-2.6 -2,-0.0 2,-0.4 -0.996 18.8-163.1-148.7 138.5 28.0 56.4 26.0 77 126 A L E -B 7 0A 43 -2,-0.4 2,-0.5 -70,-0.2 -70,-0.2 -0.988 4.3-171.2-126.7 132.6 24.3 56.3 26.9 78 127 A Q E -B 6 0A 19 -72,-2.2 -72,-2.4 -2,-0.4 2,-0.4 -0.990 19.2-151.9-117.9 111.9 21.2 56.4 24.5 79 128 A C E -B 5 0A 48 -2,-0.5 -74,-0.2 -74,-0.2 -2,-0.0 -0.767 13.7-173.3 -91.1 135.0 18.0 56.9 26.4 80 129 A L E -B 4 0A 14 -76,-3.1 -76,-2.5 -2,-0.4 3,-0.1 -0.722 13.2-167.9-125.4 76.0 14.8 55.5 25.1 81 130 A P E -B 3 0A 58 0, 0.0 -78,-0.3 0, 0.0 -26,-0.1 -0.296 41.1 -75.8 -65.9 153.3 12.0 56.7 27.3 82 131 A K - 0 0 160 -80,-3.3 2,-0.2 1,-0.1 -80,-0.0 -0.234 49.6-139.7 -52.8 132.4 8.5 55.2 27.0 83 132 A E 0 0 82 -3,-0.1 -1,-0.1 1,-0.1 -3,-0.0 -0.509 360.0 360.0 -87.9 157.2 6.7 56.4 23.9 84 133 A D 0 0 243 -2,-0.2 -1,-0.1 0, 0.0 0, 0.0 -0.372 360.0 360.0 -90.9 360.0 3.0 57.2 23.9 85 !* 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 86 50 B T 0 0 127 0, 0.0 55,-3.2 0, 0.0 56,-0.4 0.000 360.0 360.0 360.0 136.2 40.5 55.3 9.4 87 51 B Q E +H 140 0B 106 53,-0.3 80,-3.0 54,-0.1 2,-0.3 -0.605 360.0 116.9 -99.5 161.3 39.2 52.0 10.7 88 52 B G E -HI 139 166B 7 51,-1.9 51,-2.4 78,-0.3 2,-0.3 -0.984 51.8 -74.6 172.6-161.3 37.3 51.2 13.9 89 53 B F E -HI 138 165B 27 76,-2.1 76,-3.2 -2,-0.3 2,-0.3 -0.789 34.8-173.1-118.7 164.5 34.1 49.9 15.5 90 54 B A E -HI 137 164B 0 47,-1.9 47,-2.7 -2,-0.3 2,-0.5 -0.977 21.0-136.5-155.1 160.3 30.7 51.4 15.9 91 55 B V E -HI 136 163B 3 72,-2.5 72,-2.9 -2,-0.3 2,-0.6 -0.979 19.7-170.4-121.3 114.4 27.4 50.7 17.6 92 56 B L E +HI 135 162B 0 43,-3.0 43,-3.3 -2,-0.5 2,-0.3 -0.934 11.2 176.9-105.2 118.1 24.3 51.3 15.4 93 57 B S E +HI 134 161B 2 68,-2.8 68,-2.4 -2,-0.6 2,-0.3 -0.909 6.6 153.1-121.2 158.0 21.0 51.1 17.3 94 58 B Y E -H 133 0B 0 39,-1.8 39,-2.7 -2,-0.3 2,-0.4 -0.966 32.2-125.9-170.7 163.9 17.4 51.7 16.1 95 59 B V E +HI 132 158B 4 63,-2.8 63,-3.0 -2,-0.3 2,-0.3 -0.958 30.2 168.4-123.7 136.8 13.8 50.8 16.9 96 60 B Y E -H 131 0B 6 35,-2.2 35,-2.7 -2,-0.4 2,-0.6 -0.985 38.5-109.9-148.5 159.0 11.3 49.4 14.4 97 61 B E E > -H 130 0B 90 59,-0.4 3,-1.6 -2,-0.3 33,-0.2 -0.852 22.4-152.0 -88.3 117.1 7.9 47.8 14.2 98 62 B H T 3 S+ 0 0 20 31,-1.1 3,-0.4 -2,-0.6 6,-0.2 0.747 93.2 60.0 -67.2 -24.7 8.3 44.1 13.2 99 63 B E T 3 S+ 0 0 82 30,-0.5 2,-0.8 1,-0.2 -1,-0.3 0.706 91.2 66.3 -74.6 -13.7 4.9 44.1 11.6 100 64 B K S X S+ 0 0 50 -3,-1.6 3,-0.8 1,-0.2 -1,-0.2 -0.252 80.3 153.6 -95.8 52.5 5.8 46.8 9.2 101 65 B R T 3> + 0 0 15 -2,-0.8 4,-1.8 -3,-0.4 -1,-0.2 -0.065 42.9 82.0-105.2 19.4 8.2 44.3 7.7 102 66 B D H 3> S+ 0 0 89 2,-0.2 4,-2.9 3,-0.1 -1,-0.3 0.849 106.7 57.2 -56.2 -39.0 9.1 44.6 4.1 103 67 B L H <> S+ 0 0 20 -3,-0.8 4,-2.8 2,-0.2 -2,-0.2 0.935 102.2 47.1 -44.7 -58.0 11.2 46.9 6.4 104 68 B A H > S+ 0 0 6 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.912 113.3 49.9 -60.6 -38.6 12.5 44.1 8.7 105 69 B S H X S+ 0 0 49 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.918 111.8 48.8 -63.6 -40.0 13.4 42.1 5.6 106 70 B R H X S+ 0 0 43 -4,-2.9 4,-2.7 1,-0.2 5,-0.3 0.883 109.2 52.9 -65.1 -37.8 15.1 45.1 4.1 107 71 B I H X S+ 0 0 4 -4,-2.8 4,-1.5 -5,-0.2 -1,-0.2 0.942 113.7 40.5 -68.3 -42.3 17.0 45.7 7.3 108 72 B V H X S+ 0 0 14 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.930 114.8 54.2 -69.0 -39.5 18.4 42.2 7.6 109 73 B S H X S+ 0 0 31 -4,-2.6 4,-2.4 -5,-0.3 -2,-0.2 0.924 106.5 49.4 -66.2 -39.0 19.1 42.0 3.9 110 74 B T H X S+ 0 0 37 -4,-2.7 4,-1.4 1,-0.2 -1,-0.2 0.894 109.3 52.7 -68.4 -32.8 21.1 45.2 3.8 111 75 B Q H < S+ 0 0 3 -4,-1.5 7,-0.3 -5,-0.3 -1,-0.2 0.906 110.9 48.6 -62.9 -36.3 23.2 43.9 6.7 112 76 B H H >< S+ 0 0 1 -4,-2.1 3,-1.6 1,-0.2 -2,-0.2 0.879 106.1 55.0 -72.1 -36.0 23.8 40.7 4.7 113 77 B H H 3< S+ 0 0 122 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.843 121.2 32.9 -62.9 -30.0 24.8 42.7 1.6 114 78 B H T >X S+ 0 0 80 -4,-1.4 3,-2.2 -5,-0.2 4,-0.6 -0.243 77.3 141.2-112.2 39.1 27.4 44.4 3.8 115 79 B H G X4 + 0 0 58 -3,-1.6 3,-0.8 1,-0.3 -1,-0.1 0.745 61.5 71.0 -66.3 -16.9 28.1 41.5 6.1 116 80 B D G 34 S+ 0 0 123 1,-0.2 -1,-0.3 -3,-0.2 22,-0.1 0.833 100.1 48.0 -62.1 -29.3 31.9 42.4 6.1 117 81 B L G <4 S+ 0 0 7 -3,-2.2 21,-2.4 -6,-0.2 2,-0.4 0.657 97.4 91.0 -82.9 -16.3 30.9 45.4 8.2 118 82 B S E << +J 137 0B 23 -3,-0.8 19,-0.2 -4,-0.6 3,-0.1 -0.669 38.6 168.6 -88.8 129.5 28.8 43.4 10.6 119 83 B V E - 0 0 21 17,-3.0 2,-0.3 -2,-0.4 -1,-0.2 0.856 68.5 -48.4 -89.9 -64.6 30.1 41.8 13.8 120 84 B A E -J 136 0B 0 16,-0.8 16,-2.8 169,-0.1 2,-0.4 -0.964 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