==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 30-JUL-01 1JOQ . COMPND 2 MOLECULE: STAPHYLOCOCCAL NUCLEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR J.WANG,D.M.TRUCKSES,F.ABILDGAARD,Z.DZAKULA,Z.ZOLNAI, . 149 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9864.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 95 63.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 22.8 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 . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 2.7 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 . 19 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 26 17.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 0 0 0 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 1 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 A 0 0 158 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -51.8 25.5 -16.3 -12.9 2 2 A T - 0 0 116 1,-0.1 2,-0.1 0, 0.0 0, 0.0 -0.733 360.0 -94.9-101.5 152.0 23.4 -13.5 -14.4 3 3 A S - 0 0 119 -2,-0.3 2,-0.4 1,-0.0 -1,-0.1 -0.422 45.8-172.7 -64.0 131.2 21.3 -11.0 -12.4 4 4 A T + 0 0 132 -2,-0.1 2,-0.2 -3,-0.0 -1,-0.0 -0.978 10.5 163.1-131.4 125.2 17.7 -12.2 -12.1 5 5 A K - 0 0 170 -2,-0.4 2,-0.4 2,-0.1 3,-0.1 -0.469 35.6 -98.5-122.4-163.6 14.9 -10.2 -10.6 6 6 A K S S- 0 0 146 -2,-0.2 3,-0.1 0, 0.0 -2,-0.0 -0.951 74.4 -24.0-124.4 143.9 11.0 -10.4 -10.7 7 7 A L S S- 0 0 72 -2,-0.4 2,-0.7 1,-0.1 -2,-0.1 0.050 99.9 -58.3 48.4-169.4 8.6 -8.4 -12.8 8 8 A H - 0 0 130 68,-0.4 68,-0.5 -3,-0.1 2,-0.5 -0.897 53.3-161.6-110.0 112.1 9.9 -5.0 -14.1 9 9 A K E -A 75 0A 59 -2,-0.7 66,-0.2 66,-0.1 -2,-0.0 -0.786 10.3-174.6 -94.4 128.8 11.0 -2.6 -11.3 10 10 A E E -A 74 0A 42 64,-2.0 64,-2.2 -2,-0.5 -2,-0.0 -0.940 24.0-114.2-124.4 147.1 11.3 1.1 -12.3 11 11 A P E -A 73 0A 77 0, 0.0 2,-0.3 0, 0.0 17,-0.2 -0.248 34.9-179.1 -71.9 160.4 12.5 4.1 -10.3 12 12 A A - 0 0 22 60,-1.6 60,-0.4 15,-0.1 2,-0.4 -0.888 23.3-110.9-149.8 179.9 10.2 6.9 -9.3 13 13 A T E -D 26 0B 73 13,-1.1 2,-1.2 -2,-0.3 13,-1.2 -0.941 22.0-124.1-123.3 145.0 10.3 10.2 -7.4 14 14 A L E +D 25 0B 52 -2,-0.4 11,-0.2 11,-0.2 3,-0.1 -0.693 41.4 159.0 -87.5 97.5 8.7 11.2 -4.1 15 15 A I E - 0 0 76 9,-1.6 2,-0.2 -2,-1.2 10,-0.2 0.959 68.2 -34.9 -83.2 -61.1 6.5 14.2 -4.9 16 16 A K E -D 24 0B 139 8,-1.8 8,-1.8 0, 0.0 2,-0.2 -0.706 54.3-138.3-166.9 110.0 4.0 14.1 -1.9 17 17 A A E -D 23 0B 28 6,-0.3 6,-0.3 -2,-0.2 3,-0.1 -0.491 18.7-175.6 -71.4 137.4 2.5 11.1 -0.1 18 18 A I E - 0 0 73 4,-1.5 5,-0.2 -2,-0.2 -1,-0.2 0.864 60.4 -5.4 -98.6 -68.9 -1.2 11.6 0.6 19 19 A D E > S-D 22 0B 35 3,-1.2 3,-0.5 43,-0.1 -1,-0.2 -0.366 82.2 -89.5-112.8-164.4 -2.4 8.6 2.7 20 20 A G T 3 S+ 0 0 1 1,-0.2 83,-0.1 -2,-0.1 89,-0.1 0.863 128.4 32.3 -78.8 -34.6 -0.7 5.3 3.9 21 21 A D T 3 S+ 0 0 0 1,-0.1 15,-1.2 14,-0.1 2,-0.3 -0.007 117.8 63.2-109.6 30.2 -1.8 3.4 0.8 22 22 A T E < +DE 19 35B 9 -3,-0.5 -4,-1.5 13,-0.2 -3,-1.2 -0.918 53.8 159.3-154.6 124.5 -1.6 6.4 -1.6 23 23 A V E -DE 17 34B 1 11,-2.1 11,-2.3 -2,-0.3 2,-0.6 -0.990 34.5-128.9-148.8 138.0 1.4 8.5 -2.6 24 24 A K E +DE 16 33B 94 -8,-1.8 -8,-1.8 -2,-0.3 -9,-1.6 -0.754 37.8 168.6 -89.4 119.7 2.1 10.8 -5.6 25 25 A L E -DE 14 32B 0 7,-1.6 7,-1.8 -2,-0.6 2,-0.4 -0.753 34.4-108.8-123.2 172.9 5.4 10.0 -7.3 26 26 A M E -DE 13 31B 78 -13,-1.2 -13,-1.1 -2,-0.2 2,-0.4 -0.855 29.1-173.6-105.0 137.1 7.1 11.0 -10.6 27 27 A Y S S- 0 0 33 3,-1.0 -15,-0.1 -2,-0.4 -2,-0.0 -0.950 70.3 -32.0-132.9 116.9 7.4 8.5 -13.4 28 28 A K S S- 0 0 164 -2,-0.4 -1,-0.1 1,-0.3 -16,-0.0 0.895 130.8 -41.8 43.9 42.3 9.4 9.3 -16.6 29 29 A G S S+ 0 0 51 1,-0.1 -1,-0.3 0, 0.0 -3,-0.1 0.922 118.6 116.6 74.1 42.2 8.3 12.9 -16.1 30 30 A Q - 0 0 129 2,-0.0 -3,-1.0 0, 0.0 2,-0.8 -0.757 52.6-154.4-148.1 98.5 4.8 12.0 -15.1 31 31 A P E +E 26 0B 91 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.591 33.0 157.9 -73.2 106.7 3.5 12.9 -11.6 32 32 A M E -E 25 0B 64 -7,-1.8 -7,-1.6 -2,-0.8 2,-0.6 -0.788 43.8-107.8-126.4 172.0 0.7 10.3 -10.9 33 33 A T E -E 24 0B 34 -2,-0.3 55,-2.0 -9,-0.2 2,-0.3 -0.883 31.6-163.3-105.1 119.1 -1.0 9.0 -7.8 34 34 A F E -Ef 23 88B 4 -11,-2.3 -11,-2.1 -2,-0.6 2,-0.5 -0.781 1.4-157.8-101.0 144.4 -0.1 5.3 -6.9 35 35 A R E -Ef 22 89B 24 53,-1.8 55,-0.6 -2,-0.3 -13,-0.2 -0.971 28.3-107.3-123.7 128.9 -2.2 3.2 -4.5 36 36 A L > - 0 0 7 -15,-1.2 3,-0.6 -2,-0.5 2,-0.3 -0.207 40.1-129.4 -50.2 135.1 -0.9 0.2 -2.7 37 37 A L T 3 S+ 0 0 17 1,-0.2 3,-0.1 53,-0.1 -1,-0.1 -0.637 82.6 16.6 -90.9 150.1 -2.5 -2.9 -4.2 38 38 A L T 3 S+ 0 0 1 75,-0.5 74,-0.8 -2,-0.3 2,-0.3 0.789 108.5 97.6 64.9 26.0 -4.2 -5.7 -2.2 39 39 A V E < -H 111 0C 2 -3,-0.6 2,-0.3 72,-0.3 72,-0.2 -0.993 47.4-173.8-144.3 152.1 -4.5 -3.3 0.8 40 40 A D E -H 110 0C 20 70,-1.7 70,-1.7 -2,-0.3 -3,-0.0 -0.834 15.9-148.5-148.6 106.5 -7.1 -1.1 2.4 41 41 A T - 0 0 0 -2,-0.3 68,-0.2 68,-0.2 14,-0.1 -0.485 13.7-137.3 -76.1 148.1 -6.4 1.3 5.3 42 42 A P S S+ 0 0 5 0, 0.0 13,-0.2 0, 0.0 -1,-0.1 0.750 102.1 59.3 -74.7 -27.2 -9.2 2.0 7.8 43 43 A E S S+ 0 0 57 11,-0.2 2,-0.2 8,-0.1 8,-0.1 0.934 83.1 89.6 -70.3 -43.5 -8.3 5.7 7.9 44 44 A T + 0 0 14 1,-0.1 6,-0.2 6,-0.1 2,-0.2 -0.339 54.7 179.3 -55.8 117.4 -8.8 6.2 4.2 45 45 A K + 0 0 135 -2,-0.2 -1,-0.1 1,-0.1 6,-0.1 -0.456 32.4 128.6-120.2 60.8 -12.5 7.1 3.9 46 46 A H S S+ 0 0 141 -2,-0.2 -1,-0.1 4,-0.1 2,-0.1 0.949 70.3 42.3 -77.9 -49.8 -12.9 7.7 0.1 47 47 A P S S- 0 0 64 0, 0.0 3,-0.5 0, 0.0 0, 0.0 -0.195 107.8 -88.0 -86.5 179.5 -16.0 5.4 -0.3 48 48 A K S S+ 0 0 212 1,-0.2 -3,-0.0 -2,-0.1 -2,-0.0 0.635 110.3 91.3 -67.9 -8.2 -19.0 5.2 2.0 49 49 A K + 0 0 143 1,-0.0 -1,-0.2 -5,-0.0 -4,-0.1 0.977 67.4 177.0 -50.3 -65.5 -17.0 2.5 4.0 50 50 A G - 0 0 24 -3,-0.5 2,-0.6 -6,-0.2 -4,-0.1 -0.172 44.7 -45.2 83.5 175.9 -15.5 5.1 6.3 51 51 A V - 0 0 51 1,-0.2 -8,-0.1 -8,-0.1 -6,-0.1 -0.708 47.9-150.4 -84.8 120.6 -13.2 4.3 9.3 52 52 A E - 0 0 135 -2,-0.6 -1,-0.2 1,-0.1 -9,-0.0 0.983 63.5 -67.9 -52.1 -69.3 -14.5 1.3 11.3 53 53 A K S S+ 0 0 161 0, 0.0 -1,-0.1 0, 0.0 -10,-0.0 0.166 120.5 76.1-178.8 32.9 -13.0 2.4 14.6 54 54 A Y + 0 0 63 -12,-0.1 -11,-0.2 2,-0.0 85,-0.1 0.207 50.2 166.7-136.7 12.3 -9.2 2.1 14.4 55 55 A G + 0 0 39 -13,-0.2 -4,-0.0 -12,-0.1 53,-0.0 -0.052 20.9 174.2 -37.2 95.0 -8.4 5.2 12.3 56 56 A P - 0 0 23 0, 0.0 3,-0.2 0, 0.0 2,-0.1 0.077 45.6 -86.9 -90.1-158.2 -4.6 5.1 13.0 57 57 A E > + 0 0 154 1,-0.2 4,-1.8 2,-0.1 3,-0.4 -0.344 64.5 145.6-113.6 52.7 -1.9 7.4 11.5 58 58 A A H > + 0 0 0 1,-0.2 4,-1.8 2,-0.2 5,-0.5 0.955 69.8 61.1 -54.5 -50.0 -1.1 5.3 8.3 59 59 A S H > S+ 0 0 43 1,-0.3 4,-1.5 -3,-0.2 -1,-0.2 0.915 105.0 49.2 -44.1 -45.9 -0.4 8.5 6.3 60 60 A A H > S+ 0 0 48 -3,-0.4 4,-2.0 2,-0.2 5,-0.5 0.927 105.4 58.9 -62.2 -41.5 2.4 9.2 8.8 61 61 A F H X S+ 0 0 52 -4,-1.8 4,-1.7 -3,-0.3 -2,-0.2 0.978 113.3 35.3 -51.3 -62.7 3.7 5.6 8.4 62 62 A T H X S+ 0 0 2 -4,-1.8 4,-1.7 2,-0.2 5,-0.5 0.743 111.5 70.1 -65.6 -18.7 4.3 6.1 4.6 63 63 A K H X S+ 0 0 91 -4,-1.5 4,-1.8 -5,-0.5 -2,-0.2 1.000 110.8 25.1 -62.3 -68.2 5.3 9.7 5.4 64 64 A K H X S+ 0 0 155 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.773 119.5 67.0 -68.6 -22.2 8.6 9.0 7.1 65 65 A M H >X S+ 0 0 44 -4,-1.7 4,-1.5 -5,-0.5 3,-0.6 0.998 112.2 25.6 -61.5 -71.8 8.8 5.7 5.2 66 66 A V H 3< S+ 0 0 2 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.845 117.7 64.9 -63.3 -30.2 9.2 7.1 1.6 67 67 A E H 3< S+ 0 0 110 -4,-1.8 -1,-0.2 -5,-0.5 -2,-0.2 0.905 114.1 31.1 -60.8 -37.7 10.7 10.3 3.1 68 68 A N H << S+ 0 0 123 -4,-1.8 2,-0.4 -3,-0.6 -1,-0.2 0.602 91.7 117.0 -94.7 -12.2 13.7 8.2 4.4 69 69 A A < - 0 0 11 -4,-1.5 3,-0.2 -5,-0.2 -3,-0.0 -0.379 55.4-156.3 -58.1 113.2 13.5 5.7 1.6 70 70 A K S S+ 0 0 163 -2,-0.4 2,-0.3 1,-0.2 -1,-0.2 0.773 83.7 21.7 -65.0 -21.2 16.9 6.2 -0.2 71 71 A K - 0 0 116 2,-0.0 24,-0.9 -3,-0.0 2,-0.6 -0.930 69.6-159.3-149.6 122.8 15.2 4.8 -3.3 72 72 A I E + B 0 94A 15 -60,-0.4 -60,-1.6 -2,-0.3 2,-0.3 -0.884 20.4 176.1-104.9 121.5 11.5 4.6 -4.2 73 73 A E E -AB 11 93A 44 20,-1.6 20,-1.5 -2,-0.6 2,-0.4 -0.761 16.7-150.5-119.5 168.4 10.6 2.0 -6.8 74 74 A V E -AB 10 92A 0 -64,-2.2 -64,-2.0 -2,-0.3 2,-0.5 -0.999 1.5-161.4-139.5 139.2 7.3 0.8 -8.3 75 75 A E E -AB 9 91A 5 16,-1.1 16,-1.8 -2,-0.4 -66,-0.1 -0.877 10.7-152.1-125.8 104.2 6.3 -2.6 -9.8 76 76 A F E - B 0 90A 26 -68,-0.5 -68,-0.4 -2,-0.5 14,-0.2 -0.460 19.5-132.1 -71.1 142.3 3.3 -2.8 -12.1 77 77 A D - 0 0 14 12,-0.6 41,-0.1 3,-0.3 -1,-0.1 -0.068 24.4-101.8 -81.9-169.8 1.6 -6.2 -12.0 78 78 A K S S+ 0 0 152 39,-0.5 40,-0.2 3,-0.0 -1,-0.1 0.674 101.6 74.9 -89.6 -16.9 0.5 -8.2 -15.1 79 79 A G S S- 0 0 20 38,-0.4 37,-0.1 1,-0.1 39,-0.0 0.382 107.3 -33.4 -70.4-144.6 -3.2 -7.2 -14.8 80 80 A Q - 0 0 144 1,-0.1 -3,-0.3 2,-0.1 -1,-0.1 -0.100 51.6-134.9 -66.9 175.3 -4.3 -3.7 -15.7 81 81 A R S S+ 0 0 152 1,-0.2 8,-1.8 -5,-0.1 2,-0.3 0.629 82.2 16.7-107.6 -19.2 -2.0 -0.7 -15.2 82 82 A T B S-G 88 0B 54 6,-0.2 6,-0.2 -48,-0.0 -1,-0.2 -0.903 75.6-115.5-143.8 172.7 -4.5 1.7 -13.7 83 83 A D > - 0 0 63 4,-1.3 3,-1.4 -2,-0.3 -2,-0.1 -0.288 49.6 -81.5-100.1-169.9 -8.0 1.6 -12.0 84 84 A K T 3 S+ 0 0 176 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.668 133.2 54.4 -69.1 -10.9 -11.2 3.2 -13.2 85 85 A Y T 3 S- 0 0 151 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.516 118.7-111.4 -98.3 -5.8 -10.0 6.4 -11.7 86 86 A G < + 0 0 37 -3,-1.4 -53,-0.2 1,-0.3 -2,-0.1 0.487 66.1 152.0 89.8 1.4 -6.7 6.3 -13.7 87 87 A R - 0 0 49 1,-0.1 -4,-1.3 -55,-0.1 2,-0.5 -0.344 49.9-115.5 -64.7 146.4 -4.7 5.7 -10.5 88 88 A G E -fG 34 82B 0 -55,-2.0 -53,-1.8 -6,-0.2 2,-0.6 -0.703 26.5-154.5 -86.1 128.8 -1.4 3.7 -11.1 89 89 A L E +f 35 0B 5 -8,-1.8 -12,-0.6 -2,-0.5 2,-0.3 -0.891 36.0 126.2-106.6 122.4 -1.4 0.3 -9.4 90 90 A A E -B 76 0A 0 -55,-0.6 2,-0.5 -2,-0.6 -14,-0.3 -0.919 62.3-100.9-170.2 142.7 2.0 -1.2 -8.5 91 91 A Y E -B 75 0A 0 -16,-1.8 -16,-1.1 -2,-0.3 2,-0.2 -0.550 42.2-145.5 -71.3 118.8 3.7 -2.6 -5.4 92 92 A I E -B 74 0A 3 -2,-0.5 7,-1.7 -18,-0.2 8,-0.6 -0.558 16.9-169.9 -85.2 151.3 6.0 0.2 -4.1 93 93 A Y E -BC 73 98A 26 -20,-1.5 -20,-1.6 5,-0.2 2,-0.3 -0.900 9.8-166.9-135.1 165.3 9.4 -0.7 -2.5 94 94 A A E > S-BC 72 97A 6 3,-1.5 3,-0.5 -2,-0.3 -22,-0.2 -0.853 75.2 -14.6-157.8 117.9 12.0 1.3 -0.5 95 95 A D T 3 S- 0 0 86 -24,-0.9 3,-0.1 -2,-0.3 -23,-0.1 0.715 132.3 -50.8 63.4 14.9 15.6 0.2 0.3 96 96 A G T 3 S+ 0 0 67 1,-0.3 2,-0.4 -25,-0.3 -1,-0.2 0.753 113.0 123.0 93.1 26.5 14.5 -3.3 -0.7 97 97 A K E < -C 94 0A 108 -3,-0.5 -3,-1.5 3,-0.0 2,-0.9 -0.965 64.1-124.9-123.7 136.6 11.4 -3.3 1.5 98 98 A M E > -C 93 0A 18 -2,-0.4 4,-1.7 -5,-0.2 -5,-0.2 -0.654 15.4-159.5 -80.2 108.8 7.8 -3.9 0.3 99 99 A V H > S+ 0 0 0 -7,-1.7 4,-2.1 -2,-0.9 5,-0.3 0.915 91.9 56.9 -54.6 -41.0 5.8 -0.9 1.5 100 100 A N H > S+ 0 0 0 -8,-0.6 4,-1.8 1,-0.3 -1,-0.2 0.965 110.9 40.9 -56.6 -52.1 2.6 -3.0 1.1 101 101 A E H > S+ 0 0 47 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.731 109.2 65.8 -69.8 -17.4 3.9 -5.7 3.5 102 102 A A H X S+ 0 0 8 -4,-1.7 4,-1.4 2,-0.2 -2,-0.2 0.986 106.3 36.8 -68.4 -56.9 5.3 -3.0 5.7 103 103 A L H <>S+ 0 0 1 -4,-2.1 5,-1.8 1,-0.2 6,-0.5 0.935 119.9 49.1 -62.2 -43.3 1.9 -1.5 6.7 104 104 A V H ><5S+ 0 0 1 -4,-1.8 3,-0.6 -5,-0.3 -1,-0.2 0.796 107.6 57.0 -67.4 -23.5 0.4 -5.0 6.9 105 105 A R H 3<5S+ 0 0 108 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.804 107.2 47.1 -77.2 -26.7 3.4 -6.1 8.9 106 106 A Q T 3<5S- 0 0 73 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.367 117.2-113.8 -94.2 6.7 2.6 -3.4 11.5 107 107 A G T < 5S+ 0 0 0 -3,-0.6 32,-1.0 -4,-0.3 33,-0.3 0.975 84.7 114.5 62.8 52.9 -1.1 -4.3 11.6 108 108 A L < + 0 0 15 -5,-1.8 2,-0.4 1,-0.3 -4,-0.2 0.688 66.1 42.9-119.9 -44.3 -2.3 -1.0 10.1 109 109 A A S S- 0 0 2 -6,-0.5 2,-0.4 -68,-0.2 -1,-0.3 -0.847 75.4-136.1-107.6 142.6 -3.8 -1.8 6.7 110 110 A K E -H 40 0C 60 -70,-1.7 -70,-1.7 -2,-0.4 -6,-0.1 -0.786 26.2-111.0 -97.7 137.7 -6.1 -4.8 6.1 111 111 A V E +H 39 0C 25 -2,-0.4 2,-0.3 -72,-0.2 -72,-0.3 -0.335 62.9 118.5 -62.9 144.0 -5.5 -7.0 3.0 112 112 A A + 0 0 37 -74,-0.8 -1,-0.0 1,-0.2 0, 0.0 -0.983 21.5 84.4 178.0-173.2 -8.3 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