==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-FEB-06 2DEO . COMPND 2 MOLECULE: 441AA LONG HYPOTHETICAL NFED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR H.YOKOYAMA,I.MATSUI . 399 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18601.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 305 76.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 17.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 4.0 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 0.5 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 . 35 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 29.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 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 0 0 2 2 3 3 3 0 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 4 0 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 PARALLEL BRIDGES PER LADDER . 5 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 0 0 0 0 0 0 0 1 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 20 A A 0 0 123 0, 0.0 2,-0.2 0, 0.0 180,-0.0 0.000 360.0 360.0 360.0 88.9 22.6 57.9 43.7 2 21 A K - 0 0 72 177,-0.0 2,-0.4 180,-0.0 179,-0.2 -0.760 360.0 -53.4-152.6-166.0 21.3 60.7 46.0 3 22 A N E -a 181 0A 58 177,-2.8 179,-2.7 -2,-0.2 2,-0.4 -0.718 51.0-131.6 -85.7 137.6 21.2 62.6 49.4 4 23 A I E -a 182 0A 18 -2,-0.4 31,-3.1 29,-0.3 32,-0.9 -0.694 17.4-169.3 -96.0 137.2 20.5 60.7 52.5 5 24 A V E -ab 183 36A 0 177,-2.7 179,-2.7 -2,-0.4 2,-0.3 -0.994 14.4-150.5-120.0 125.1 18.1 61.5 55.2 6 25 A Y E -ab 184 37A 6 30,-1.9 32,-3.5 -2,-0.5 2,-0.4 -0.718 7.6-163.0 -93.2 144.5 18.3 59.5 58.5 7 26 A V E +ab 185 38A 2 177,-2.0 179,-2.6 -2,-0.3 2,-0.3 -0.991 14.2 167.5-128.9 128.2 15.2 58.8 60.6 8 27 A A E -ab 186 39A 2 30,-2.7 32,-3.8 -2,-0.4 2,-0.2 -0.994 23.7-135.7-142.8 149.5 15.3 57.6 64.3 9 28 A Q E - b 0 40A 76 177,-0.5 32,-0.2 -2,-0.3 2,-0.2 -0.587 13.4-177.1-101.4 160.6 12.9 57.3 67.2 10 29 A I E + b 0 41A 5 30,-1.4 32,-1.5 -2,-0.2 2,-0.2 -0.633 18.2 172.0-158.4 86.6 13.4 58.3 70.8 11 30 A K E + b 0 42A 162 30,-0.2 32,-0.2 -2,-0.2 30,-0.0 -0.595 36.8 25.7 -97.7 162.0 10.4 57.4 72.9 12 31 A G S S- 0 0 26 30,-1.0 33,-0.1 -2,-0.2 30,-0.1 0.014 97.6 -16.4 81.5 174.7 10.1 57.5 76.6 13 32 A Q - 0 0 118 186,-0.1 2,-0.6 1,-0.1 5,-0.1 -0.122 65.7-119.5 -53.4 144.7 11.6 59.4 79.6 14 33 A I + 0 0 4 3,-0.1 35,-0.5 29,-0.1 2,-0.2 -0.803 44.7 159.0 -94.3 122.2 14.9 61.3 78.9 15 34 A T >> - 0 0 43 -2,-0.6 4,-1.0 33,-0.1 3,-0.5 -0.692 59.7 -81.7-130.5-175.5 17.8 60.1 81.1 16 35 A S H 3> S+ 0 0 99 1,-0.3 4,-0.6 -2,-0.2 34,-0.0 0.765 127.6 58.4 -62.9 -20.8 21.5 60.1 81.1 17 36 A Y H >> S+ 0 0 48 1,-0.2 3,-1.7 2,-0.2 4,-0.9 0.927 92.1 67.5 -73.8 -40.9 21.3 57.2 78.8 18 37 A T H X> S+ 0 0 7 -3,-0.5 4,-1.8 1,-0.3 3,-1.1 0.885 89.1 63.7 -45.0 -50.6 19.3 59.0 76.2 19 38 A Y H 3X S+ 0 0 75 -4,-1.0 4,-3.2 1,-0.3 -1,-0.3 0.891 97.2 59.3 -41.4 -44.3 22.2 61.3 75.4 20 39 A D H S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.3 5,-0.6 0.961 112.2 52.6 -48.2 -48.9 21.3 60.9 70.1 23 42 A D H X5S+ 0 0 50 -4,-3.2 4,-2.1 -5,-0.3 -1,-0.3 0.939 109.8 47.1 -55.7 -44.0 24.9 60.7 70.0 24 43 A R H X5S+ 0 0 70 -4,-2.3 4,-3.2 -5,-0.2 -2,-0.2 0.976 117.8 39.8 -57.9 -60.6 24.9 57.4 68.2 25 44 A Y H X5S+ 0 0 1 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.934 117.8 47.3 -52.1 -58.6 22.2 58.4 65.6 26 45 A I H X5S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.3 -1,-0.2 0.882 112.8 52.9 -54.5 -36.9 23.6 61.9 65.0 27 46 A T H X<>S+ 0 0 0 -4,-2.8 5,-2.0 1,-0.2 3,-1.1 0.888 110.2 50.2 -47.8 -51.0 24.2 60.7 60.2 30 49 A E H ><5S+ 0 0 27 -4,-2.6 3,-2.1 1,-0.3 -1,-0.2 0.950 106.4 56.4 -56.9 -47.3 27.3 62.9 60.4 31 50 A Q H 3<5S+ 0 0 142 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.647 111.3 41.2 -64.8 -13.4 29.5 60.2 59.1 32 51 A D T <<5S- 0 0 32 -3,-1.1 -1,-0.3 -4,-0.8 -28,-0.2 0.249 109.8-119.7-115.1 13.9 27.6 59.7 56.0 33 52 A N T < 5 - 0 0 134 -3,-2.1 -29,-0.3 -4,-0.3 -3,-0.2 0.949 40.7-164.4 46.1 56.1 27.0 63.5 55.4 34 53 A A < - 0 0 7 -5,-2.0 -29,-0.2 1,-0.2 3,-0.1 -0.301 29.0-125.6 -66.4 152.3 23.3 63.1 55.5 35 54 A E S S- 0 0 36 -31,-3.1 2,-0.3 1,-0.3 -30,-0.2 0.747 86.6 -39.9 -69.6 -21.9 21.2 66.0 54.2 36 55 A A E -b 5 0A 0 -32,-0.9 -30,-1.9 27,-0.1 2,-0.4 -0.975 55.4-119.4 176.4 172.6 19.7 65.8 57.6 37 56 A I E -bc 6 65A 0 27,-1.6 29,-3.2 -2,-0.3 2,-0.5 -0.993 16.9-153.3-138.7 137.3 18.4 63.5 60.4 38 57 A I E -bc 7 66A 0 -32,-3.5 -30,-2.7 -2,-0.4 2,-0.7 -0.895 2.1-160.6-110.0 133.4 15.0 63.3 61.8 39 58 A I E -bc 8 67A 0 27,-2.4 29,-2.9 -2,-0.5 2,-0.8 -0.949 13.3-146.0-111.9 117.0 14.4 62.2 65.3 40 59 A E E -bc 9 68A 13 -32,-3.8 -30,-1.4 -2,-0.7 2,-0.6 -0.760 28.8-157.4 -80.6 119.1 10.8 61.1 65.8 41 60 A L E +b 10 0A 0 27,-3.7 2,-0.5 -2,-0.8 -30,-0.2 -0.866 30.5 166.2-113.9 114.8 10.4 62.3 69.3 42 61 A D E +b 11 0A 28 -32,-1.5 -30,-1.0 -2,-0.6 34,-0.2 -0.907 12.9 165.2-122.7 106.1 7.9 61.1 71.8 43 62 A T B -l 76 0B 0 32,-3.1 34,-2.0 -2,-0.5 37,-0.3 -0.768 20.7-176.4-132.0 89.2 8.8 62.3 75.4 44 63 A P + 0 0 57 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.644 34.7 173.0 -49.7 -28.9 6.1 62.0 78.2 45 64 A G - 0 0 5 30,-0.1 33,-0.1 1,-0.1 -32,-0.1 -0.261 30.4-171.8 62.1-117.1 8.6 63.7 80.4 46 65 A G S S- 0 0 45 -2,-0.2 -1,-0.1 -3,-0.2 56,-0.0 0.908 76.0 -40.4 76.1 85.7 7.8 64.8 83.9 47 66 A R S S+ 0 0 239 1,-0.1 2,-0.2 2,-0.0 31,-0.1 0.788 83.9 150.6 20.9 100.5 10.9 66.8 84.9 48 67 A A - 0 0 29 -33,-0.0 2,-0.1 -35,-0.0 -33,-0.1 -0.685 27.0-155.0-131.9-177.9 14.1 65.2 83.7 49 68 A D + 0 0 94 -35,-0.5 -33,-0.1 -2,-0.2 29,-0.0 -0.567 58.8 103.9-175.3 103.6 17.5 66.5 82.8 50 69 A A S >> S+ 0 0 4 -2,-0.1 3,-1.9 -35,-0.1 4,-0.9 0.119 70.7 99.2-143.2 -24.4 20.1 65.0 80.5 51 70 A X H 3> + 0 0 6 1,-0.3 4,-3.3 2,-0.2 3,-0.5 0.715 65.6 59.7 -33.1 -60.8 18.8 67.7 78.1 52 71 A X H 3> S+ 0 0 49 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.805 109.4 47.1 -48.3 -34.2 21.3 70.4 78.4 53 72 A N H <> S+ 0 0 86 -3,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.827 112.2 49.1 -76.5 -38.3 24.0 67.9 77.2 54 73 A I H X S+ 0 0 0 -4,-0.9 4,-2.7 -3,-0.5 -2,-0.2 0.934 108.8 53.5 -66.6 -49.3 21.9 66.6 74.3 55 74 A V H X S+ 0 0 0 -4,-3.3 4,-2.6 1,-0.3 5,-0.3 0.936 107.0 50.1 -57.4 -43.3 21.1 70.2 73.2 56 75 A Q H X S+ 0 0 87 -4,-1.5 4,-2.7 -5,-0.3 -1,-0.3 0.952 108.7 55.4 -59.7 -39.2 24.8 71.0 73.1 57 76 A R H < S+ 0 0 27 -4,-1.7 4,-0.3 1,-0.2 -2,-0.2 0.915 111.1 43.0 -57.6 -45.2 25.2 67.8 71.0 58 77 A I H >< S+ 0 0 0 -4,-2.7 3,-2.2 2,-0.2 -1,-0.2 0.967 111.7 52.3 -63.0 -55.4 22.6 69.0 68.5 59 78 A Q H 3< S+ 0 0 65 -4,-2.6 111,-0.4 1,-0.3 -2,-0.2 0.834 115.1 43.7 -51.5 -38.9 23.9 72.6 68.3 60 79 A Q T 3< S+ 0 0 128 -4,-2.7 -1,-0.3 -5,-0.3 -2,-0.2 0.480 87.6 125.3 -86.5 -4.1 27.4 71.2 67.6 61 80 A S < - 0 0 0 -3,-2.2 109,-0.6 -4,-0.3 4,-0.1 -0.172 61.3-139.0 -53.2 146.4 26.0 68.6 65.1 62 81 A K S S+ 0 0 144 -36,-0.1 -1,-0.1 107,-0.1 107,-0.1 0.391 86.5 39.4 -93.2 4.4 27.7 68.7 61.8 63 82 A I S S- 0 0 10 -5,-0.2 -27,-0.1 -30,-0.0 -28,-0.1 -0.979 102.1 -81.7-144.7 153.2 24.3 68.2 59.9 64 83 A P - 0 0 7 0, 0.0 -27,-1.6 0, 0.0 2,-0.6 -0.223 36.7-152.4 -55.6 139.9 20.8 69.6 60.6 65 84 A V E -c 37 0A 0 -29,-0.2 24,-1.1 -4,-0.1 23,-1.0 -0.975 5.6-161.9-118.4 122.5 18.7 67.8 63.2 66 85 A I E -cd 38 89A 0 -29,-3.2 -27,-2.4 -2,-0.6 2,-0.6 -0.925 7.9-150.4-105.2 117.4 15.0 68.0 62.7 67 86 A I E -cd 39 90A 0 22,-2.2 24,-2.3 -2,-0.6 2,-0.6 -0.778 15.2-170.1 -85.5 121.6 13.1 67.2 65.9 68 87 A Y E -cd 40 91A 0 -29,-2.9 -27,-3.7 -2,-0.6 2,-1.8 -0.938 18.2-144.0-116.2 113.3 9.8 65.7 64.7 69 88 A V E - d 0 92A 0 22,-2.3 24,-2.0 -2,-0.6 -27,-0.1 -0.586 45.9-174.5 -80.0 95.5 7.3 65.3 67.5 70 89 A Y + 0 0 12 -2,-1.8 5,-0.1 22,-0.2 -2,-0.1 -0.938 31.8 44.9-141.1 158.4 5.8 62.1 66.2 71 90 A P S > S- 0 0 48 0, 0.0 3,-3.6 0, 0.0 22,-0.1 0.507 87.8 -88.8 -84.4 169.7 3.6 59.7 66.3 72 91 A P T 3 S+ 0 0 86 0, 0.0 24,-0.2 0, 0.0 23,-0.2 -0.141 120.9 30.4 -47.5 133.0 0.1 61.0 66.8 73 92 A G T 3 S+ 0 0 61 22,-1.7 23,-0.1 1,-0.4 22,-0.1 0.214 92.2 132.9 97.1 -15.3 -0.4 61.1 70.5 74 93 A A < - 0 0 2 -3,-3.6 23,-0.9 -5,-0.1 -1,-0.4 -0.199 42.4-151.7 -65.1 166.9 3.3 61.8 71.1 75 94 A S E - m 0 97B 22 21,-0.2 -32,-3.1 -5,-0.1 2,-0.8 -0.995 14.1-151.7-138.3 136.4 4.3 64.5 73.5 76 95 A A E +lm 43 98B 1 21,-1.9 23,-1.0 -2,-0.3 2,-0.5 -0.910 39.3 179.3-105.2 103.5 7.4 66.7 73.5 77 96 A A E > - m 0 99B 1 -34,-2.0 3,-2.6 -2,-0.8 2,-0.4 -0.896 42.1 -52.5-125.3 139.3 7.5 67.4 77.1 78 97 A S T 3> S+ 0 0 30 21,-1.8 4,-1.5 -2,-0.5 5,-0.2 -0.263 138.5 28.9 50.0-101.9 9.7 69.3 79.5 79 98 A A H 3> S+ 0 0 0 -2,-0.4 4,-2.0 1,-0.2 -1,-0.3 0.857 123.7 54.9 -53.6 -34.1 13.0 67.7 78.6 80 99 A G H <> S+ 0 0 0 -3,-2.6 4,-2.9 -37,-0.3 -1,-0.2 0.986 101.6 53.8 -62.5 -57.9 11.7 67.2 75.1 81 100 A T H > S+ 0 0 4 18,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.743 107.8 52.0 -53.9 -26.6 10.7 70.7 74.4 82 101 A Y H X S+ 0 0 15 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.951 109.6 48.8 -73.2 -48.8 14.2 71.9 75.3 83 102 A I H >< S+ 0 0 0 -4,-2.0 3,-0.6 -5,-0.2 4,-0.5 0.963 116.2 43.9 -51.0 -50.9 15.8 69.5 72.9 84 103 A A H >< S+ 0 0 0 -4,-2.9 3,-3.5 1,-0.2 -2,-0.2 0.988 110.7 52.4 -59.0 -60.3 13.3 70.5 70.2 85 104 A L H 3< S+ 0 0 2 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.730 109.9 52.7 -52.1 -16.1 13.7 74.3 70.8 86 105 A G T << S+ 0 0 0 -4,-1.7 -1,-0.3 -3,-0.6 -2,-0.2 0.544 96.1 94.0 -97.9 -3.3 17.3 73.9 70.5 87 106 A S S < S- 0 0 0 -3,-3.5 -21,-0.1 -4,-0.5 3,-0.1 -0.315 83.0-110.9 -87.7 170.1 17.2 72.1 67.2 88 107 A H S S+ 0 0 0 -23,-1.0 78,-3.0 1,-0.2 2,-0.3 0.758 98.3 6.6 -65.3 -35.1 17.5 73.1 63.5 89 108 A L E -d 66 0A 1 -24,-1.1 -22,-2.2 76,-0.2 2,-0.6 -0.975 61.2-153.7-153.5 138.1 13.9 72.4 62.6 90 109 A I E +d 67 0A 0 -2,-0.3 57,-2.1 -24,-0.2 58,-1.9 -0.926 18.3 172.9-117.2 114.7 10.8 71.4 64.6 91 110 A A E -de 68 148A 0 -24,-2.3 -22,-2.3 -2,-0.6 2,-0.3 -0.753 10.8-162.4-108.7 165.6 8.0 69.6 62.8 92 111 A X E -de 69 149A 0 56,-2.0 58,-1.8 -2,-0.3 -22,-0.2 -0.993 13.6-134.2-146.5 141.0 5.0 68.1 64.6 93 112 A A > - 0 0 0 -24,-2.0 3,-1.0 -2,-0.3 -20,-0.2 -0.631 43.0 -90.0 -89.8 150.5 2.4 65.5 63.5 94 113 A P T 3 S+ 0 0 41 0, 0.0 -21,-0.1 0, 0.0 -1,-0.1 -0.313 112.6 33.2 -59.2 146.9 -1.2 66.2 64.1 95 114 A G T 3 S+ 0 0 55 1,-0.3 -22,-1.7 -23,-0.2 2,-0.2 0.661 96.6 109.0 82.6 14.9 -2.5 65.0 67.4 96 115 A T < - 0 0 4 -3,-1.0 -1,-0.3 -24,-0.2 2,-0.3 -0.602 54.1-138.3-113.7-179.0 0.8 65.6 69.3 97 116 A S E -m 75 0B 35 -23,-0.9 -21,-1.9 -2,-0.2 2,-0.3 -0.940 9.5-163.0-137.8 161.5 1.8 68.2 71.9 98 117 A I E +mN 76 135B 1 37,-1.6 37,-3.2 -2,-0.3 2,-0.4 -0.979 55.8 39.7-142.0 147.0 4.6 70.6 72.9 99 118 A G E S-mN 77 134B 0 -23,-1.0 -21,-1.8 -2,-0.3 -18,-0.4 -0.939 102.1 -7.0 121.7-143.6 5.3 72.3 76.1 100 119 A A S S- 0 0 16 33,-2.5 2,-0.3 -2,-0.4 -24,-0.1 -0.531 74.0-115.5 -87.6 155.6 4.8 71.1 79.7 101 120 A C 0 0 57 -2,-0.2 -1,-0.1 -26,-0.1 -56,-0.0 -0.687 360.0 360.0 -97.2 153.7 3.2 67.7 80.2 102 121 A R 0 0 271 -2,-0.3 -2,-0.0 -56,-0.0 -1,-0.0 -0.158 360.0 360.0 178.2 360.0 -0.1 67.2 82.0 103 ! 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 0.0 104 140 A T > 0 0 105 0, 0.0 2,-4.8 0, 0.0 4,-3.2 0.000 360.0 360.0 360.0 -61.4 13.1 78.4 87.6 105 141 A N T 4 + 0 0 157 1,-0.2 0, 0.0 2,-0.2 0, 0.0 -0.127 360.0 39.1 -67.9 48.5 14.5 81.9 87.3 106 142 A Y T > S+ 0 0 143 -2,-4.8 4,-2.2 0, 0.0 -1,-0.2 0.190 108.0 52.3-162.2 -59.3 17.0 80.0 85.4 107 143 A F H > S+ 0 0 67 2,-0.2 4,-3.3 1,-0.2 5,-0.2 0.909 114.2 51.4 -58.6 -37.7 15.3 77.3 83.3 108 144 A I H X S+ 0 0 21 -4,-3.2 4,-2.7 2,-0.2 5,-0.4 0.992 106.4 51.0 -60.1 -59.9 13.2 80.3 82.1 109 145 A A H > S+ 0 0 63 -5,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.877 115.1 47.5 -45.2 -34.3 16.3 82.2 81.3 110 146 A Y H X S+ 0 0 38 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.937 110.6 44.9 -77.1 -49.1 17.3 79.1 79.4 111 147 A I H X S+ 0 0 1 -4,-3.3 4,-2.7 2,-0.2 5,-0.2 0.976 115.0 52.6 -56.9 -51.2 14.1 78.3 77.4 112 148 A K H X S+ 0 0 62 -4,-2.7 4,-2.9 -5,-0.2 5,-0.2 0.928 110.3 48.3 -47.9 -48.1 14.0 82.0 76.6 113 149 A S H X S+ 0 0 41 -4,-1.8 4,-2.5 -5,-0.4 5,-0.2 0.972 109.7 49.4 -57.7 -58.3 17.6 81.7 75.4 114 150 A L H < S+ 0 0 2 -4,-2.9 4,-0.3 1,-0.2 -1,-0.2 0.848 113.5 49.7 -49.9 -38.4 17.0 78.6 73.2 115 151 A A H ><>S+ 0 0 0 -4,-2.7 5,-2.6 -5,-0.2 3,-1.5 0.955 109.7 48.1 -68.1 -51.5 14.0 80.4 71.7 116 152 A Q H ><5S+ 0 0 129 -4,-2.9 3,-1.8 1,-0.3 -2,-0.2 0.893 106.2 55.8 -58.5 -43.1 15.7 83.6 70.8 117 153 A E T 3<5S+ 0 0 88 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.607 114.5 40.1 -72.4 -2.4 18.7 82.2 69.2 118 154 A S T < 5S- 0 0 3 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.159 110.3-118.6-124.5 14.8 16.5 80.2 66.8 119 155 A G T < 5 + 0 0 59 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.804 67.8 139.4 54.2 30.5 14.1 83.0 66.2 120 156 A R S - 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