==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 27-SEP-12 4HB9 . COMPND 2 MOLECULE: SIMILARITIES WITH PROBABLE MONOOXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PHOTORHABDUS LUMINESCENS; . AUTHOR P.SAMPATHKUMAR,S.C.ALMO,NEW YORK STRUCTURAL GENOMICS RESEARC . 376 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17721.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 257 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 15.7 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 . 3 0.8 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 . 1 0.3 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 . 26 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 28.7 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+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 0 2 0 1 1 2 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 1 2 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 PARALLEL BRIDGES PER LADDER . 0 1 2 2 1 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 1 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 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 0 A S 0 0 155 0, 0.0 24,-0.0 0, 0.0 335,-0.0 0.000 360.0 360.0 360.0 -47.9 24.2 38.1 39.4 2 1 A X - 0 0 37 1,-0.1 24,-0.8 141,-0.1 2,-0.6 -0.302 360.0-144.8 -38.8 123.0 26.0 38.6 36.0 3 2 A H E -a 26 0A 25 22,-0.1 140,-2.6 24,-0.0 141,-1.5 -0.930 8.5-155.1-107.1 119.7 23.7 36.8 33.6 4 3 A V E -ab 27 144A 0 22,-2.7 24,-2.4 -2,-0.6 2,-0.5 -0.833 5.1-160.2 -95.8 126.2 25.5 35.0 30.8 5 4 A G E -ab 28 145A 0 139,-3.1 141,-3.1 -2,-0.5 2,-0.5 -0.947 5.6-165.2-105.5 129.7 23.5 34.4 27.6 6 5 A I E -ab 29 146A 0 22,-2.9 24,-3.3 -2,-0.5 2,-0.7 -0.956 12.0-147.5-116.6 126.8 24.7 31.7 25.2 7 6 A I E S+ab 30 147A 8 139,-2.8 141,-2.2 -2,-0.5 24,-0.2 -0.884 71.8 32.2 -91.4 116.1 23.4 31.4 21.7 8 7 A G - 0 0 7 22,-3.0 2,-0.6 -2,-0.7 23,-0.2 0.512 58.3-142.3 106.9 115.3 23.4 27.7 20.8 9 8 A A + 0 0 2 4,-0.1 -1,-0.1 20,-0.1 2,-0.1 -0.482 64.4 122.4 -96.1 56.5 22.9 24.4 22.7 10 9 A G S > S- 0 0 18 -2,-0.6 4,-1.9 138,-0.4 5,-0.3 -0.135 84.5 -66.8 -95.3-159.8 25.6 22.6 20.7 11 10 A I H > S+ 0 0 9 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.946 133.4 38.0 -58.6 -53.0 28.8 21.0 22.0 12 11 A G H > S+ 0 0 7 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.917 115.2 51.0 -65.8 -46.4 30.4 24.1 23.2 13 12 A G H > S+ 0 0 0 135,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.879 112.1 45.6 -65.7 -41.3 27.4 26.0 24.6 14 13 A T H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.931 113.1 49.9 -68.1 -44.0 26.2 23.1 26.7 15 14 A C H X S+ 0 0 0 -4,-1.7 4,-2.2 -5,-0.3 -2,-0.2 0.939 111.9 50.0 -59.0 -46.2 29.6 22.4 28.1 16 15 A L H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.905 107.9 52.1 -56.6 -46.4 30.0 26.1 28.9 17 16 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.923 109.3 50.4 -63.6 -39.5 26.7 26.3 30.7 18 17 A H H X S+ 0 0 5 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.925 111.8 48.5 -57.7 -45.5 27.6 23.3 32.8 19 18 A G H X S+ 0 0 0 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.913 111.0 48.3 -63.9 -45.4 30.9 25.0 33.7 20 19 A L H <>S+ 0 0 0 -4,-2.7 5,-2.7 2,-0.2 3,-0.5 0.917 110.4 52.1 -63.7 -42.6 29.3 28.3 34.6 21 20 A R H ><5S+ 0 0 122 -4,-2.4 3,-1.8 1,-0.2 -1,-0.2 0.919 104.6 57.5 -58.1 -41.6 26.7 26.6 36.8 22 21 A K H 3<5S+ 0 0 135 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.849 108.8 45.7 -56.3 -34.1 29.5 24.8 38.6 23 22 A H T 3<5S- 0 0 88 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.303 122.9-104.9 -96.7 9.5 31.1 28.2 39.5 24 23 A G T < 5S+ 0 0 69 -3,-1.8 2,-0.3 1,-0.3 -3,-0.2 0.660 70.3 146.1 82.3 21.2 27.7 29.6 40.6 25 24 A I < - 0 0 10 -5,-2.7 2,-0.3 -6,-0.1 -1,-0.3 -0.707 51.9-118.3 -95.9 138.3 27.1 31.8 37.5 26 25 A K E +a 3 0A 110 -24,-0.8 -22,-2.7 -2,-0.3 2,-0.4 -0.593 43.2 174.7 -75.5 131.7 23.7 32.5 36.2 27 26 A V E -a 4 0A 13 -2,-0.3 2,-0.4 -24,-0.2 -22,-0.2 -1.000 20.3-175.3-146.9 139.5 23.4 31.2 32.6 28 27 A T E -a 5 0A 15 -24,-2.4 -22,-2.9 -2,-0.4 2,-0.5 -0.992 12.3-152.3-131.4 142.1 20.8 30.8 29.9 29 28 A I E -ac 6 113A 0 83,-2.3 85,-3.5 -2,-0.4 2,-0.5 -0.961 3.0-157.5-113.0 134.8 21.1 29.1 26.5 30 29 A Y E -ac 7 114A 6 -24,-3.3 -22,-3.0 -2,-0.5 2,-0.4 -0.951 15.8-174.8-112.4 119.3 19.0 30.1 23.5 31 30 A E - 0 0 19 83,-2.6 86,-2.8 -2,-0.5 85,-0.3 -0.947 25.1-147.6-121.4 133.1 18.7 27.4 20.9 32 31 A R S S+ 0 0 172 -2,-0.4 86,-0.2 84,-0.3 -1,-0.1 0.830 77.1 74.3 -69.3 -34.1 17.1 27.6 17.5 33 32 A N S S- 0 0 86 84,-0.1 83,-2.1 1,-0.1 84,-0.3 -0.274 87.6-102.3 -77.3 164.8 15.9 24.0 17.4 34 33 A S - 0 0 62 2,-0.2 -1,-0.1 81,-0.2 -2,-0.0 -0.411 36.3-106.2 -75.7 162.3 13.1 22.3 19.2 35 34 A A S S+ 0 0 65 -2,-0.1 2,-0.5 1,-0.1 -1,-0.1 0.764 110.0 50.3 -64.3 -29.3 13.9 20.1 22.3 36 35 A A S S- 0 0 82 185,-0.0 -2,-0.2 186,-0.0 2,-0.2 -0.955 82.5-146.7-111.4 126.0 13.2 16.9 20.3 37 36 A S - 0 0 85 -2,-0.5 185,-0.2 1,-0.1 3,-0.1 -0.542 8.3-145.3 -85.7 158.9 14.9 16.6 16.9 38 37 A S S S+ 0 0 107 1,-0.2 2,-0.4 -2,-0.2 -1,-0.1 0.835 87.3 33.7 -84.8 -41.0 13.3 14.8 14.0 39 38 A I S S- 0 0 80 180,-0.1 -1,-0.2 182,-0.0 180,-0.2 -0.908 77.9-137.1-118.5 141.2 16.5 13.4 12.6 40 39 A L - 0 0 10 178,-2.9 2,-0.1 -2,-0.4 178,-0.1 -0.696 32.2-101.2 -90.4 149.3 19.5 12.2 14.6 41 40 A P - 0 0 40 0, 0.0 58,-0.3 0, 0.0 -1,-0.1 -0.482 27.9-145.1 -61.1 145.0 23.0 13.0 13.5 42 41 A G + 0 0 6 -2,-0.1 2,-0.2 172,-0.1 238,-0.0 0.339 64.5 79.6 -95.9 5.3 24.6 10.0 11.8 43 42 A Y - 0 0 89 171,-0.1 55,-2.6 133,-0.0 56,-0.4 -0.660 64.7-126.4-121.8 168.6 28.1 10.4 12.9 44 43 A G E -E 97 0B 5 53,-0.3 2,-0.4 -2,-0.2 53,-0.3 -0.629 14.0-141.9-106.2 162.4 30.6 9.9 15.7 45 44 A I E -E 96 0B 15 51,-3.2 51,-2.2 -2,-0.2 2,-0.6 -0.987 8.2-144.8-125.4 136.4 33.0 12.2 17.5 46 45 A H E -E 95 0B 50 -2,-0.4 2,-0.5 49,-0.2 49,-0.2 -0.932 17.3-148.9-101.0 121.6 36.4 11.3 18.7 47 46 A I E -E 94 0B 1 47,-3.9 47,-2.4 -2,-0.6 2,-0.1 -0.782 13.9-166.8 -94.8 127.2 37.3 13.0 22.0 48 47 A N > - 0 0 26 -2,-0.5 4,-2.8 45,-0.2 5,-0.2 -0.321 44.0 -78.3-101.6-170.4 41.0 13.8 22.6 49 48 A S H > S+ 0 0 86 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.833 129.5 49.9 -63.8 -30.2 42.8 14.9 25.8 50 49 A F H > S+ 0 0 84 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.939 114.2 44.0 -72.5 -45.6 41.5 18.5 25.6 51 50 A G H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.886 113.3 52.1 -61.8 -42.0 37.9 17.5 25.1 52 51 A K H X S+ 0 0 78 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.918 110.8 46.3 -63.4 -46.5 38.2 14.9 27.8 53 52 A Q H X S+ 0 0 91 -4,-2.1 4,-2.8 -5,-0.2 5,-0.2 0.914 111.4 52.6 -63.5 -42.7 39.5 17.3 30.4 54 53 A A H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 5,-0.3 0.945 112.6 44.8 -58.4 -46.7 36.9 19.9 29.4 55 54 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.908 114.4 47.5 -64.7 -43.6 34.1 17.4 30.0 56 55 A Q H < S+ 0 0 92 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.886 116.6 43.6 -69.3 -36.3 35.5 16.0 33.2 57 56 A E H < S+ 0 0 81 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.702 124.0 33.4 -81.3 -22.2 36.1 19.5 34.7 58 57 A C H < S+ 0 0 3 -4,-1.8 -36,-0.2 -5,-0.2 -2,-0.2 0.803 99.1 82.8-101.1 -36.4 32.7 21.0 33.6 59 58 A L S < S- 0 0 8 -4,-2.3 46,-0.1 -5,-0.3 -44,-0.0 -0.464 83.1-108.2 -76.0 142.8 30.1 18.2 33.7 60 59 A P > - 0 0 57 0, 0.0 4,-2.3 0, 0.0 3,-0.4 -0.316 40.4-105.9 -56.3 152.8 28.3 17.1 36.9 61 60 A A H > S+ 0 0 77 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.849 119.6 56.4 -56.7 -36.3 29.6 13.8 38.0 62 61 A E H > S+ 0 0 125 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.919 109.8 45.5 -66.7 -37.6 26.5 11.9 36.9 63 62 A N H > S+ 0 0 3 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.920 111.8 52.6 -66.2 -42.6 26.9 13.3 33.3 64 63 A W H X S+ 0 0 19 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.946 108.7 49.2 -61.2 -45.2 30.6 12.4 33.4 65 64 A L H X S+ 0 0 107 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.893 109.4 52.7 -61.9 -37.3 29.9 8.8 34.4 66 65 A A H X S+ 0 0 41 -4,-1.8 4,-2.2 -5,-0.2 -1,-0.2 0.887 108.6 51.3 -64.2 -38.6 27.3 8.5 31.6 67 66 A F H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.925 109.3 48.7 -60.0 -48.6 30.0 9.7 29.2 68 67 A E H < S+ 0 0 95 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.903 113.2 49.5 -59.5 -42.1 32.5 7.1 30.4 69 68 A E H < S+ 0 0 150 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.860 115.1 42.2 -63.7 -40.7 29.8 4.5 30.1 70 69 A A H < S+ 0 0 13 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.789 102.6 77.9 -82.8 -28.7 28.8 5.4 26.5 71 70 A S < - 0 0 9 -4,-2.2 2,-0.3 -5,-0.2 25,-0.2 -0.271 58.8-161.6 -80.8 166.5 32.2 6.0 25.0 72 71 A R E -F 95 0B 120 23,-1.6 23,-3.8 -2,-0.0 2,-0.2 -0.942 30.9 -94.7-137.9 156.1 34.8 3.4 23.8 73 72 A Y E -F 94 0B 181 -2,-0.3 2,-0.3 21,-0.2 21,-0.2 -0.537 34.5-162.4 -72.1 137.6 38.5 3.6 23.2 74 73 A I E -F 93 0B 14 19,-2.5 19,-1.9 -2,-0.2 121,-0.1 -0.961 26.0-106.7-126.9 148.4 39.6 4.4 19.6 75 74 A G - 0 0 21 119,-1.6 18,-0.2 -2,-0.3 2,-0.2 0.183 17.2-148.6 -91.5 178.8 43.1 3.7 18.6 76 75 A G + 0 0 33 1,-0.1 -1,-0.1 16,-0.1 3,-0.1 -0.527 62.8 84.3-118.1-166.0 46.6 4.8 17.7 77 76 A Q - 0 0 150 -2,-0.2 -1,-0.1 1,-0.2 118,-0.1 0.773 67.3-154.4 74.0 32.7 49.3 3.3 15.3 78 77 A S - 0 0 40 -3,-0.1 2,-0.2 1,-0.1 119,-0.2 -0.070 10.6-143.7 -43.6 126.3 47.8 5.0 12.2 79 78 A R E -g 197 0C 30 117,-2.5 119,-2.3 111,-0.1 2,-0.4 -0.649 9.1-151.9-102.3 151.7 48.7 2.9 9.2 80 79 A F E +gH 198 89C 64 9,-3.0 8,-3.5 -2,-0.2 9,-1.5 -0.986 18.6 171.0-126.9 128.7 49.6 4.1 5.7 81 80 A Y E -gH 199 87C 28 117,-3.0 119,-3.5 -2,-0.4 6,-0.2 -0.928 30.0-123.2-127.8 158.4 49.1 2.0 2.5 82 81 A N > - 0 0 29 4,-2.1 3,-0.8 -2,-0.3 6,-0.1 -0.190 48.2 -91.3 -80.3-173.0 49.3 2.6 -1.2 83 82 A E T 3 S+ 0 0 12 117,-0.4 183,-2.4 1,-0.2 186,-0.1 0.431 121.9 61.6 -85.5 3.0 46.2 1.8 -3.2 84 83 A R T 3 S- 0 0 162 181,-0.2 -1,-0.2 2,-0.1 3,-0.1 -0.128 121.4 -97.5-118.3 33.1 47.3 -1.8 -3.9 85 84 A X S < S+ 0 0 117 -3,-0.8 2,-0.6 1,-0.2 -2,-0.1 0.623 75.3 146.2 65.9 14.3 47.2 -2.9 -0.3 86 85 A R - 0 0 157 1,-0.0 -4,-2.1 2,-0.0 2,-0.2 -0.789 50.7-126.1 -86.8 119.1 51.0 -2.4 0.2 87 86 A L E +H 81 0C 82 -2,-0.6 -6,-0.3 -6,-0.2 3,-0.1 -0.461 31.9 174.7 -61.2 124.0 51.9 -1.2 3.8 88 87 A L E - 0 0 68 -8,-3.5 2,-0.3 1,-0.4 -7,-0.2 0.781 61.8 -13.0 -98.2 -41.4 54.0 2.0 3.5 89 88 A A E H 80 0C 44 -9,-1.5 -9,-3.0 1,-0.0 -1,-0.4 -0.976 360.0 360.0-164.9 150.9 54.3 3.0 7.2 90 89 A V 0 0 117 -2,-0.3 -13,-0.1 -11,-0.2 -1,-0.0 0.294 360.0 360.0-137.3 360.0 52.8 2.3 10.6 91 ! 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 92 104 A Q 0 0 149 0, 0.0 -17,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 101.0 44.2 6.6 22.5 93 105 A R E - F 0 74B 123 -19,-1.9 -19,-2.5 -18,-0.2 2,-0.5 -0.342 360.0-110.3 -96.0 175.0 41.0 8.7 22.0 94 106 A L E -EF 47 73B 20 -47,-2.4 -47,-3.9 -21,-0.2 2,-0.5 -0.937 27.6-154.9-109.0 130.6 37.4 8.3 23.2 95 107 A S E +EF 46 72B 6 -23,-3.8 -23,-1.6 -2,-0.5 2,-0.3 -0.872 23.7 154.7-110.8 128.5 34.8 7.4 20.6 96 108 A I E -E 45 0B 0 -51,-2.2 -51,-3.2 -2,-0.5 117,-0.3 -0.976 43.9-102.0-145.9 156.2 31.1 8.3 21.1 97 109 A S E > -E 44 0B 0 -2,-0.3 4,-2.1 -53,-0.3 -53,-0.3 -0.549 27.9-126.4 -75.2 150.0 28.1 9.0 18.8 98 110 A R H > S+ 0 0 58 -55,-2.6 4,-2.7 115,-0.3 5,-0.2 0.916 111.0 56.0 -57.8 -41.4 27.2 12.6 18.4 99 111 A T H > S+ 0 0 5 -56,-0.4 4,-2.1 -58,-0.3 -1,-0.2 0.941 110.0 43.3 -61.6 -45.4 23.6 11.7 19.5 100 112 A E H > S+ 0 0 42 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.896 112.4 52.8 -64.5 -43.0 24.8 10.2 22.8 101 113 A L H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.930 110.5 48.1 -59.5 -44.2 27.2 13.0 23.5 102 114 A K H X S+ 0 0 37 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.900 109.9 51.4 -63.9 -42.6 24.4 15.6 23.0 103 115 A E H X S+ 0 0 87 -4,-2.1 4,-1.3 -5,-0.2 -1,-0.2 0.910 113.0 46.7 -59.9 -40.5 22.0 13.7 25.3 104 116 A I H < S+ 0 0 17 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.903 113.4 47.6 -67.2 -44.5 24.7 13.6 28.0 105 117 A L H < S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.865 112.1 50.9 -62.4 -37.1 25.5 17.3 27.5 106 118 A N H >< S+ 0 0 28 -4,-2.8 3,-2.3 -5,-0.2 -1,-0.2 0.770 85.0 104.5 -73.8 -23.5 21.8 18.2 27.6 107 119 A K T 3< S+ 0 0 105 -4,-1.3 -44,-0.1 1,-0.3 -3,-0.0 -0.345 88.4 17.8 -63.1 130.4 21.1 16.3 30.8 108 120 A G T 3 S+ 0 0 39 -2,-0.1 -1,-0.3 -45,-0.0 3,-0.2 0.321 109.4 83.6 92.5 -10.9 20.8 18.7 33.7 109 121 A L X> + 0 0 0 -3,-2.3 4,-2.4 1,-0.1 3,-2.0 0.160 48.1 115.7-107.9 16.9 20.1 21.7 31.4 110 122 A A T 34 S+ 0 0 68 1,-0.3 -1,-0.1 2,-0.2 -3,-0.1 0.834 87.3 36.4 -59.9 -33.4 16.4 21.2 30.9 111 123 A N T 34 S+ 0 0 161 -3,-0.2 -1,-0.3 1,-0.1 -2,-0.1 0.237 115.8 56.3-105.2 14.0 15.5 24.5 32.6 112 124 A T T <4 S+ 0 0 8 -3,-2.0 -83,-2.3 1,-0.1 2,-0.5 0.698 91.8 76.1-104.1 -37.6 18.7 26.3 31.2 113 125 A I E < -c 29 0A 5 -4,-2.4 2,-0.7 -85,-0.2 -83,-0.2 -0.715 65.0-157.7 -85.6 123.8 18.1 25.7 27.5 114 126 A Q E -c 30 0A 75 -85,-3.5 -83,-2.6 -2,-0.5 3,-0.4 -0.907 20.2-151.7-100.0 108.0 15.4 27.9 25.9 115 127 A W + 0 0 65 -2,-0.7 -81,-0.2 1,-0.2 -83,-0.2 -0.316 68.7 29.5 -80.8 160.6 14.3 26.0 22.8 116 128 A N S S+ 0 0 89 -83,-2.1 2,-0.6 -85,-0.3 -84,-0.3 0.819 81.2 133.5 60.7 37.2 12.9 27.6 19.6 117 129 A K - 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