==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 02-NOV-12 4HUF . COMPND 2 MOLECULE: RIBONUCLEASE H; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS HALODURANS; . AUTHOR PATRA A.,EGLI M. . 265 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14035.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 173 65.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 14.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.5 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 . 0 0.0 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 . 2 0.8 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 . 20 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 30.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.3 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 0 0 0 1 1 0 0 0 0 0 0 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 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 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 2 0 1 1 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 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 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 61 A E 0 0 140 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 134.6 -4.9 14.8 14.9 2 62 A E - 0 0 159 1,-0.0 2,-0.2 0, 0.0 0, 0.0 -0.772 360.0 -97.3-115.9 157.8 -4.2 18.3 13.8 3 63 A I - 0 0 25 -2,-0.3 2,-0.9 1,-0.1 3,-0.1 -0.467 23.5-144.3 -69.7 133.4 -1.6 20.0 11.5 4 64 A I - 0 0 77 -2,-0.2 24,-0.1 1,-0.2 -1,-0.1 -0.881 15.0-171.1 -94.8 103.2 1.4 21.6 13.1 5 65 A W S S+ 0 0 129 -2,-0.9 2,-2.1 1,-0.2 24,-0.6 0.823 74.1 73.7 -67.6 -32.9 1.9 24.7 10.9 6 66 A E S S+ 0 0 104 22,-0.1 2,-0.3 -3,-0.1 -1,-0.2 -0.552 87.2 93.9 -80.5 77.6 5.3 25.5 12.5 7 67 A S S S- 0 0 1 -2,-2.1 21,-2.2 60,-0.2 22,-0.4 -0.891 73.9-107.2-154.7 177.8 7.0 22.6 10.8 8 68 A L E -Ab 27 69A 1 60,-2.4 62,-3.1 -2,-0.3 2,-0.4 -0.965 26.8-159.7-119.4 137.2 9.0 21.6 7.7 9 69 A S E -Ab 26 70A 0 17,-2.8 17,-2.9 -2,-0.4 2,-0.3 -0.948 6.6-167.1-119.1 139.6 7.5 19.5 4.9 10 70 A V E +A 25 0A 0 60,-2.3 62,-0.5 -2,-0.4 2,-0.3 -0.888 11.6 162.2-121.4 156.4 9.5 17.4 2.4 11 71 A D E -A 24 0A 9 13,-1.6 13,-1.9 -2,-0.3 2,-0.3 -0.973 28.3-119.6-163.8 166.2 8.6 15.7 -0.9 12 72 A V E -A 23 0A 5 -2,-0.3 2,-0.6 11,-0.2 121,-0.4 -0.832 7.9-148.0-112.9 142.9 10.2 14.2 -4.0 13 73 A G E -A 22 0A 1 9,-2.5 9,-1.8 -2,-0.3 2,-0.3 -0.969 27.1-169.4-107.0 117.7 9.8 15.1 -7.6 14 74 A S E -A 21 0A 1 -2,-0.6 235,-2.3 7,-0.2 2,-0.3 -0.712 27.6-162.9-103.7 152.3 10.3 12.0 -9.7 15 75 A Q E >S-Ac 20 249A 19 5,-1.8 5,-1.3 1,-0.6 235,-0.2 -0.767 82.3 -25.8-124.3 82.7 10.7 11.5 -13.5 16 76 A G T 5S- 0 0 7 233,-2.8 -1,-0.6 -2,-0.3 3,-0.2 0.019 83.7 -82.4 91.3 156.1 9.8 7.8 -13.4 17 77 A N T 5S+ 0 0 73 1,-0.5 2,-0.2 233,-0.2 27,-0.1 -0.862 130.2 21.6-137.0 102.5 10.2 5.2 -10.7 18 78 A P T 5S+ 0 0 72 0, 0.0 -1,-0.5 0, 0.0 2,-0.3 0.572 118.2 93.4 -72.1 160.6 13.0 4.4 -10.8 19 79 A G E 5S- D 0 43A 10 24,-2.5 24,-2.0 -3,-0.2 -3,-0.2 -0.954 78.7 -17.0 176.1-164.0 14.1 7.5 -12.6 20 80 A I E < -A 15 0A 29 -5,-1.3 -5,-1.8 -2,-0.3 2,-0.4 -0.386 62.3-159.0 -64.8 138.1 15.4 11.0 -11.9 21 81 A V E +AD 14 40A 0 19,-2.3 19,-3.1 -7,-0.2 2,-0.3 -0.982 20.4 160.1-124.4 127.5 15.0 12.0 -8.3 22 82 A E E -A 13 0A 39 -9,-1.8 -9,-2.5 -2,-0.4 2,-0.3 -0.932 11.7-176.1-132.4 164.4 15.0 15.5 -6.8 23 83 A Y E -AD 12 37A 0 14,-1.0 14,-2.7 -2,-0.3 2,-0.3 -0.986 6.6-170.1-151.2 165.3 13.6 16.7 -3.4 24 84 A K E -AD 11 36A 26 -13,-1.9 -13,-1.6 -2,-0.3 2,-0.4 -0.987 16.2-138.4-152.5 162.7 13.0 19.8 -1.4 25 85 A G E -AD 10 35A 0 10,-2.5 9,-2.6 -2,-0.3 10,-1.5 -0.990 26.4-178.2-124.2 133.3 12.0 20.9 2.1 26 86 A V E -AD 9 33A 3 -17,-2.9 -17,-2.8 -2,-0.4 2,-0.4 -0.896 38.0 -94.5-130.8 156.5 9.7 23.8 2.6 27 87 A D E > -A 8 0A 17 5,-2.5 4,-2.6 -2,-0.3 -19,-0.2 -0.596 34.0-143.4 -65.8 122.8 8.2 25.8 5.5 28 88 A T T 4 S+ 0 0 1 -21,-2.2 -1,-0.2 -2,-0.4 -22,-0.1 0.836 96.6 39.4 -61.7 -33.3 4.7 24.1 6.0 29 89 A K T 4 S+ 0 0 115 -24,-0.6 -1,-0.2 -22,-0.4 -23,-0.1 0.947 130.0 23.1 -81.2 -51.9 3.1 27.5 6.8 30 90 A T T 4 S- 0 0 89 -25,-0.2 -2,-0.2 2,-0.1 3,-0.1 0.684 89.6-129.0 -96.6 -21.9 4.8 29.9 4.3 31 91 A G < + 0 0 27 -4,-2.6 -3,-0.1 1,-0.3 2,-0.0 0.426 49.5 159.0 84.7 -1.9 6.0 27.6 1.5 32 92 A E - 0 0 117 -6,-0.1 -5,-2.5 1,-0.1 2,-0.7 -0.330 45.5-122.3 -55.2 128.2 9.5 29.1 1.7 33 93 A V E +D 26 0A 68 -7,-0.2 -7,-0.3 1,-0.2 3,-0.1 -0.691 33.1 177.8 -78.3 117.5 11.9 26.7 0.2 34 94 A L E - 0 0 35 -9,-2.6 2,-0.3 -2,-0.7 -8,-0.2 0.774 64.3 -4.4 -92.7 -33.5 14.5 25.8 2.9 35 95 A F E -D 25 0A 18 -10,-1.5 -10,-2.5 2,-0.0 -1,-0.3 -0.975 59.1-169.0-157.7 156.7 16.6 23.3 1.0 36 96 A E E -D 24 0A 122 -2,-0.3 2,-0.5 -12,-0.2 -12,-0.2 -0.990 14.3-145.2-146.4 144.0 16.7 21.5 -2.4 37 97 A R E -D 23 0A 87 -14,-2.7 -14,-1.0 -2,-0.3 3,-0.1 -0.973 27.7-126.3-110.8 125.6 18.6 18.7 -3.9 38 98 A E E - 0 0 168 -2,-0.5 -17,-0.1 1,-0.2 -15,-0.0 -0.261 51.1 -63.1 -65.5 158.5 19.3 19.0 -7.6 39 99 A P E - 0 0 73 0, 0.0 -17,-0.2 0, 0.0 -1,-0.2 -0.143 44.1-150.6 -52.6 126.6 18.3 16.1 -9.8 40 100 A I E -D 21 0A 3 -19,-3.1 -19,-2.3 -3,-0.1 3,-0.1 -0.866 22.0-127.2 -96.5 128.1 20.0 12.7 -9.2 41 101 A P E S+ 0 0 90 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.770 83.7 6.1 -59.2 -36.8 20.1 10.8 -12.5 42 102 A I E S+ 0 0 18 52,-0.2 56,-0.4 -22,-0.1 2,-0.3 -0.968 76.1 119.0-146.0 136.7 18.5 7.6 -11.2 43 103 A G E -D 19 0A 0 -24,-2.0 -24,-2.5 -2,-0.3 2,-0.3 -0.954 54.4 -91.7-166.8 178.4 16.9 6.5 -8.0 44 104 A T > - 0 0 16 -2,-0.3 4,-2.2 -26,-0.2 5,-0.2 -0.704 32.8-118.2 -96.8 157.4 13.6 5.3 -6.6 45 105 A N H > S+ 0 0 18 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.909 116.3 54.8 -57.6 -41.5 11.0 7.5 -5.2 46 106 A N H > S+ 0 0 60 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.905 106.5 49.6 -58.2 -45.7 11.4 5.8 -1.8 47 107 A M H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.910 111.0 51.2 -60.4 -41.4 15.1 6.5 -1.7 48 108 A G H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.911 108.9 49.1 -62.3 -41.5 14.4 10.1 -2.5 49 109 A E H X S+ 0 0 2 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.868 110.9 51.9 -66.5 -34.8 11.9 10.4 0.3 50 110 A F H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.940 110.8 46.4 -65.3 -49.6 14.4 8.9 2.7 51 111 A L H X S+ 0 0 6 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.867 109.2 56.6 -60.7 -38.0 17.1 11.3 1.7 52 112 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.914 108.3 45.7 -63.1 -42.5 14.7 14.2 2.0 53 113 A I H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.943 114.1 47.9 -64.5 -46.7 13.8 13.4 5.6 54 114 A V H X S+ 0 0 2 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.915 110.1 52.3 -63.7 -39.8 17.5 12.9 6.6 55 115 A H H X S+ 0 0 47 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.933 109.6 51.0 -58.2 -44.2 18.4 16.2 4.8 56 116 A G H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 5,-0.3 0.899 108.4 50.9 -57.6 -43.7 15.7 17.8 6.9 57 117 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.921 112.4 46.0 -63.0 -42.9 17.0 16.3 10.1 58 118 A R H X S+ 0 0 123 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.917 113.5 50.1 -66.1 -41.1 20.5 17.6 9.4 59 119 A Y H X S+ 0 0 43 -4,-2.7 4,-1.6 -5,-0.2 -2,-0.2 0.927 113.9 43.6 -59.9 -48.3 19.2 21.1 8.4 60 120 A L H <>S+ 0 0 4 -4,-2.8 5,-2.7 1,-0.2 4,-0.4 0.866 112.5 52.9 -71.4 -35.6 17.1 21.4 11.5 61 121 A K H ><5S+ 0 0 94 -4,-2.3 3,-1.1 -5,-0.3 -1,-0.2 0.917 106.9 52.2 -64.3 -42.3 19.9 20.1 13.8 62 122 A E H 3<5S+ 0 0 135 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.877 114.6 42.9 -60.1 -37.8 22.3 22.7 12.3 63 123 A R T 3<5S- 0 0 126 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.462 108.9-125.6 -86.6 -2.0 19.9 25.4 13.1 64 124 A N T < 5 + 0 0 124 -3,-1.1 2,-0.3 -4,-0.4 -3,-0.2 0.857 54.3 161.1 56.2 40.1 19.0 24.0 16.5 65 125 A S < - 0 0 27 -5,-2.7 -1,-0.2 -6,-0.1 50,-0.2 -0.687 38.7-159.4 -94.1 142.6 15.3 24.0 15.5 66 126 A R + 0 0 189 -2,-0.3 -1,-0.1 50,-0.1 -5,-0.1 0.288 49.5 128.5-102.5 10.8 12.7 21.9 17.3 67 127 A K - 0 0 60 49,-0.1 -60,-0.2 -7,-0.1 2,-0.1 -0.352 58.4-120.6 -62.4 143.4 10.2 22.0 14.4 68 128 A P - 0 0 13 0, 0.0 -60,-2.4 0, 0.0 2,-0.4 -0.360 18.8-126.5 -79.3 165.2 8.8 18.6 13.3 69 129 A I E -be 8 118A 0 48,-2.4 50,-3.1 -62,-0.2 2,-0.5 -0.952 15.4-151.5-111.2 133.3 9.2 17.3 9.8 70 130 A Y E +be 9 119A 0 -62,-3.1 -60,-2.3 -2,-0.4 2,-0.3 -0.907 17.8 173.4-101.7 134.3 6.2 16.1 7.7 71 131 A S E - e 0 120A 0 48,-2.2 50,-2.5 -2,-0.5 -60,-0.1 -0.988 28.8-151.6-131.7 144.7 6.7 13.4 5.1 72 132 A N S S+ 0 0 45 -62,-0.5 2,-0.8 -2,-0.3 3,-0.1 0.368 74.6 95.1 -94.2 8.4 3.9 11.7 3.1 73 133 A S > - 0 0 12 1,-0.2 4,-2.3 -24,-0.1 5,-0.2 -0.809 48.6-176.9-104.0 100.1 6.0 8.6 2.7 74 134 A Q H > S+ 0 0 115 -2,-0.8 4,-2.1 1,-0.2 -1,-0.2 0.877 88.3 54.4 -59.8 -34.3 5.2 5.9 5.4 75 135 A T H > S+ 0 0 60 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.947 108.9 45.1 -64.7 -50.0 8.0 3.8 3.9 76 136 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.878 110.5 55.2 -62.9 -38.4 10.7 6.5 4.2 77 137 A I H X S+ 0 0 6 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.936 109.5 47.0 -58.4 -45.3 9.5 7.4 7.7 78 138 A K H X S+ 0 0 119 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.909 110.1 52.7 -64.3 -41.3 10.0 3.7 8.7 79 139 A W H <>S+ 0 0 21 -4,-2.3 5,-2.3 2,-0.2 4,-0.5 0.895 110.9 47.2 -61.8 -41.0 13.4 3.5 7.1 80 140 A V H ><5S+ 0 0 0 -4,-2.3 3,-1.0 3,-0.2 -2,-0.2 0.939 113.4 47.4 -67.2 -43.9 14.6 6.6 9.0 81 141 A K H 3<5S+ 0 0 114 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.877 115.5 45.6 -65.9 -34.9 13.3 5.3 12.3 82 142 A D T 3<5S- 0 0 86 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.556 104.7-133.5 -76.2 -10.3 14.9 1.9 11.6 83 143 A K T < 5S+ 0 0 70 -3,-1.0 2,-0.3 -4,-0.5 -3,-0.2 0.836 76.9 100.8 51.7 37.6 18.1 3.8 10.5 84 144 A K < - 0 0 110 -5,-2.3 2,-1.0 -6,-0.2 -2,-0.2 -0.894 65.8-147.3-154.0 116.0 18.1 1.4 7.5 85 145 A A - 0 0 1 -2,-0.3 2,-2.0 17,-0.1 -9,-0.1 -0.749 13.1-160.5 -86.6 102.4 16.9 2.1 3.9 86 146 A K + 0 0 162 -2,-1.0 2,-0.2 2,-0.0 -1,-0.1 -0.307 31.2 155.9 -84.5 57.5 15.5 -1.2 2.8 87 147 A S - 0 0 24 -2,-2.0 -2,-0.0 1,-0.1 0, 0.0 -0.581 37.1-158.7 -84.1 146.4 15.8 -0.4 -1.0 88 148 A T + 0 0 143 -2,-0.2 -1,-0.1 2,-0.1 3,-0.1 0.287 46.4 134.5-101.9 5.1 16.0 -3.2 -3.6 89 149 A L - 0 0 22 1,-0.1 -2,-0.1 6,-0.0 -45,-0.0 -0.357 64.0-107.6 -62.4 131.4 17.5 -0.9 -6.2 90 150 A V - 0 0 90 1,-0.1 2,-0.8 -2,-0.1 -1,-0.1 -0.252 24.8-128.3 -59.6 142.8 20.4 -2.6 -8.0 91 151 A R + 0 0 143 -3,-0.1 2,-0.2 3,-0.1 -1,-0.1 -0.875 54.6 127.4 -94.9 107.1 23.9 -1.3 -7.1 92 152 A N S S- 0 0 68 -2,-0.8 4,-0.3 1,-0.0 3,-0.1 -0.809 75.8 -82.2-141.1-172.6 25.7 -0.5 -10.3 93 153 A E S > S+ 0 0 187 -2,-0.2 3,-1.0 1,-0.2 4,-0.4 0.885 127.1 56.0 -64.0 -35.7 27.6 2.5 -11.9 94 154 A E T 3 S+ 0 0 107 1,-0.2 3,-0.4 2,-0.1 4,-0.2 0.894 115.9 35.9 -61.4 -39.6 24.3 4.0 -13.0 95 155 A T T 3> S+ 0 0 2 1,-0.2 4,-2.1 -3,-0.1 -1,-0.2 0.245 86.1 107.9 -99.4 10.7 22.9 4.0 -9.4 96 156 A A H <> S+ 0 0 54 -3,-1.0 4,-2.0 -4,-0.3 -1,-0.2 0.870 77.6 49.5 -58.4 -40.3 26.2 4.8 -7.7 97 157 A L H > S+ 0 0 81 -4,-0.4 4,-2.5 -3,-0.4 5,-0.2 0.955 110.7 46.5 -68.3 -49.8 25.2 8.3 -6.8 98 158 A I H > S+ 0 0 1 -56,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.918 115.5 47.9 -61.2 -38.4 21.8 7.6 -5.2 99 159 A W H X S+ 0 0 18 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.858 108.2 54.5 -71.9 -32.7 23.3 4.7 -3.2 100 160 A K H X S+ 0 0 108 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.931 111.6 45.2 -62.9 -43.5 26.3 6.9 -2.1 101 161 A L H X S+ 0 0 16 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.908 114.3 47.9 -67.2 -40.1 23.8 9.4 -0.7 102 162 A V H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.2 5,-0.2 0.938 112.1 49.6 -66.3 -44.3 21.6 6.7 0.9 103 163 A D H X S+ 0 0 57 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.899 112.6 48.0 -60.3 -41.3 24.6 5.1 2.5 104 164 A E H X S+ 0 0 83 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.846 109.8 51.7 -68.0 -35.1 25.8 8.4 3.8 105 165 A A H X S+ 0 0 7 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.889 110.4 49.2 -70.5 -38.1 22.4 9.3 5.2 106 166 A E H X S+ 0 0 28 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.896 109.8 52.0 -61.3 -42.5 22.3 6.0 7.0 107 167 A E H X S+ 0 0 117 -4,-2.0 4,-0.7 -5,-0.2 -2,-0.2 0.909 108.5 51.2 -61.9 -40.6 25.8 6.7 8.3 108 168 A W H >X S+ 0 0 16 -4,-2.2 3,-1.3 1,-0.2 4,-0.6 0.951 110.0 48.9 -61.8 -46.8 24.5 10.0 9.6 109 169 A L H >< S+ 0 0 0 -4,-2.3 3,-0.6 1,-0.3 -1,-0.2 0.869 110.3 51.1 -63.0 -36.2 21.6 8.4 11.3 110 170 A N H 3< S+ 0 0 94 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.582 116.4 40.9 -80.1 -4.9 23.8 5.8 13.0 111 171 A T H << S+ 0 0 78 -3,-1.3 2,-0.3 -4,-0.7 -1,-0.2 0.272 111.2 55.0-123.4 7.9 26.2 8.5 14.3 112 172 A H << - 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