==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 01-MAY-12 4EYE . COMPND 2 MOLECULE: PROBABLE OXIDOREDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM ABSCESSUS; . AUTHOR T.E.EDWARDS,J.ABENDROTH,SEATTLE STRUCTURAL GENOMICS CENTER F . 622 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25520.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 454 73.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 66 10.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 13.2 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 . 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 . 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 . 46 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 79 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 22.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 3.1 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 1 1 7 3 2 2 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 6 4 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 . 6 2 2 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 0 2 0 0 0 0 0 0 0 0 1 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 -3 A G 0 0 123 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 158.3 57.4 32.8 -7.1 2 -2 A P - 0 0 88 0, 0.0 26,-0.1 0, 0.0 2,-0.1 0.760 360.0-135.9 -66.3 -28.0 59.2 30.2 -4.9 3 -1 A G - 0 0 50 22,-0.1 23,-2.3 24,-0.1 2,-0.3 -0.148 18.7 -93.5 89.9 166.0 56.5 29.9 -2.0 4 0 A S E -A 25 0A 84 21,-0.3 2,-0.3 -2,-0.1 21,-0.2 -0.863 29.3-175.4-126.2 160.1 57.1 29.8 1.8 5 1 A M E -A 24 0A 15 19,-2.4 19,-2.3 -2,-0.3 2,-0.2 -0.885 34.8 -93.7-140.0 163.8 57.6 27.3 4.6 6 2 A K E +A 23 0A 57 -2,-0.3 93,-1.9 17,-0.2 2,-0.3 -0.603 50.2 155.3 -81.9 146.2 58.0 27.4 8.4 7 3 A A E -AB 22 98A 0 15,-1.8 15,-3.0 -2,-0.2 2,-0.5 -0.961 46.1-110.6-159.9 158.9 61.4 27.6 10.0 8 4 A I E -A 21 0A 1 89,-2.5 2,-0.4 -2,-0.3 13,-0.2 -0.902 41.0-167.8 -92.8 127.3 63.2 28.7 13.1 9 5 A Q E -A 20 0A 36 11,-2.8 11,-2.4 -2,-0.5 2,-0.6 -0.976 22.5-132.0-125.7 125.8 65.3 31.7 12.2 10 6 A A E -AC 19 63A 1 53,-3.2 53,-1.6 -2,-0.4 9,-0.2 -0.718 24.0-179.7 -71.5 119.3 68.0 33.4 14.3 11 7 A Q + 0 0 93 7,-2.7 2,-0.3 -2,-0.6 -1,-0.1 0.333 67.9 9.8-106.3 3.4 67.2 37.1 14.1 12 8 A S S S- 0 0 43 6,-0.2 3,-0.2 3,-0.2 41,-0.1 -0.934 78.2-107.1-160.1 176.7 70.1 38.1 16.3 13 9 A L S S+ 0 0 53 -2,-0.3 4,-0.0 1,-0.2 -3,-0.0 -0.090 83.3 112.1-101.7 37.4 73.3 36.6 17.8 14 10 A S S > S- 0 0 69 1,-0.3 3,-0.5 2,-0.0 38,-0.2 0.271 81.5-116.9 -91.1 12.2 71.7 36.7 21.3 15 11 A G G > S- 0 0 1 36,-2.7 3,-2.0 -3,-0.2 -1,-0.3 -0.526 73.0 -16.2 83.4-158.9 71.5 32.8 21.5 16 12 A P G > S+ 0 0 7 0, 0.0 3,-2.0 0, 0.0 -1,-0.2 0.778 128.3 69.0 -51.1 -35.6 68.2 30.9 21.8 17 13 A E G < S+ 0 0 56 -3,-0.5 -2,-0.1 1,-0.3 279,-0.1 0.767 95.3 56.4 -55.0 -30.7 66.3 34.1 22.8 18 14 A G G < S+ 0 0 9 -3,-2.0 -7,-2.7 33,-0.1 2,-0.4 0.387 82.3 110.5 -84.0 5.8 66.8 35.4 19.3 19 15 A L E < -A 10 0A 2 -3,-2.0 2,-0.4 -9,-0.2 -9,-0.2 -0.697 45.6-174.5 -89.8 132.9 65.1 32.5 17.6 20 16 A V E -A 9 0A 50 -11,-2.4 -11,-2.8 -2,-0.4 2,-0.6 -0.978 25.9-133.7-129.9 134.1 61.8 33.1 15.9 21 17 A Y E +A 8 0A 81 -2,-0.4 -13,-0.2 -13,-0.2 2,-0.2 -0.804 56.0 136.1 -83.9 116.6 59.4 30.6 14.3 22 18 A T E -A 7 0A 37 -15,-3.0 -15,-1.8 -2,-0.6 2,-0.3 -0.826 55.3 -76.3-154.3 178.7 58.5 32.3 11.1 23 19 A D E +A 6 0A 85 -2,-0.2 2,-0.3 -17,-0.2 -17,-0.2 -0.755 45.4 169.8 -94.6 142.5 58.0 32.0 7.3 24 20 A V E -A 5 0A 24 -19,-2.3 -19,-2.4 -2,-0.3 2,-0.1 -0.912 43.0 -72.4-142.6 163.8 60.9 31.7 5.0 25 21 A E E -A 4 0A 128 -2,-0.3 -21,-0.3 -21,-0.2 -22,-0.1 -0.400 46.5-120.8 -59.5 133.3 61.5 31.0 1.3 26 22 A T - 0 0 14 -23,-2.3 -1,-0.1 1,-0.1 75,-0.1 -0.669 30.3-120.0 -75.2 129.2 61.0 27.3 0.3 27 23 A P - 0 0 40 0, 0.0 -1,-0.1 0, 0.0 -24,-0.1 0.768 37.6-140.8 -45.8 -54.5 64.3 26.1 -1.2 28 24 A G - 0 0 42 -26,-0.1 47,-0.0 2,-0.0 -25,-0.0 0.426 17.8 -85.1 94.1 129.0 63.4 25.0 -4.7 29 25 A A + 0 0 78 2,-0.0 5,-0.1 6,-0.0 73,-0.0 -0.230 50.5 171.7 -60.3 152.1 64.5 22.2 -7.0 30 26 A G > - 0 0 26 3,-0.5 3,-1.4 1,-0.0 5,-0.1 -0.978 47.0-101.6-165.1 158.9 67.7 22.6 -9.0 31 27 A P T 3 S+ 0 0 127 0, 0.0 -2,-0.0 0, 0.0 47,-0.0 0.673 121.0 31.5 -71.5 -15.5 70.0 20.6 -11.2 32 28 A N T 3 S+ 0 0 118 45,-0.1 2,-0.3 44,-0.1 -3,-0.0 -0.030 106.4 84.7-126.9 31.2 72.6 20.1 -8.4 33 29 A V < - 0 0 43 -3,-1.4 2,-0.5 71,-0.2 -3,-0.5 -0.966 56.8-150.7-132.9 150.3 70.4 20.1 -5.2 34 30 A V E -D 103 0B 0 69,-2.6 69,-2.5 -2,-0.3 2,-0.5 -0.989 16.0-152.2-114.3 124.8 68.4 17.5 -3.3 35 31 A V E -DE 102 75B 4 40,-2.0 39,-2.8 -2,-0.5 40,-1.4 -0.899 13.0-164.5-100.5 129.5 65.4 18.9 -1.5 36 32 A V E -DE 101 73B 0 65,-2.7 65,-2.1 -2,-0.5 2,-0.7 -0.952 21.1-133.9-115.8 130.0 64.4 16.9 1.6 37 33 A D E -DE 100 72B 31 35,-3.1 35,-1.8 -2,-0.4 2,-0.3 -0.777 37.2-129.0 -76.3 113.9 61.1 17.1 3.5 38 34 A V E + E 0 71B 5 61,-1.9 33,-0.3 -2,-0.7 3,-0.1 -0.518 39.3 166.3 -78.0 124.6 62.5 17.3 7.0 39 35 A K E S+ 0 0 103 31,-2.8 2,-0.3 1,-0.4 32,-0.2 0.586 76.4 15.0-102.6 -26.4 60.9 14.8 9.5 40 36 A A E - E 0 70B 3 30,-2.0 30,-2.0 77,-0.1 2,-0.5 -0.940 64.0-162.9-148.2 132.1 63.5 15.3 12.2 41 37 A A E -FE 313 69B 0 272,-2.4 272,-2.3 -2,-0.3 28,-0.2 -0.970 24.0-129.3-112.1 123.6 66.2 18.1 12.7 42 38 A G E -F 312 0B 0 26,-2.1 2,-0.5 -2,-0.5 26,-0.5 -0.427 7.4-143.3 -71.6 144.0 69.0 17.4 15.0 43 39 A V + 0 0 3 268,-2.1 268,-0.5 -2,-0.1 2,-0.3 -0.934 32.5 168.5 -99.0 123.2 70.0 19.9 17.8 44 40 A C > - 0 0 5 -2,-0.5 4,-1.7 266,-0.1 3,-0.4 -0.926 48.5-102.5-131.9 167.7 73.8 19.9 18.2 45 41 A F H > S+ 0 0 112 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.880 118.0 56.4 -59.6 -41.8 76.3 22.1 20.0 46 42 A P H > S+ 0 0 34 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.911 103.9 54.9 -57.9 -37.2 77.4 23.9 16.8 47 43 A D H > S+ 0 0 0 -3,-0.4 4,-1.8 1,-0.2 -2,-0.2 0.946 110.6 44.9 -56.8 -52.5 73.8 25.0 16.2 48 44 A Y H X S+ 0 0 34 -4,-1.7 4,-0.8 1,-0.2 -1,-0.2 0.921 112.0 51.2 -58.2 -47.4 73.7 26.5 19.6 49 45 A L H ><>S+ 0 0 30 -4,-2.6 5,-2.9 1,-0.2 3,-0.9 0.889 107.2 55.4 -57.5 -40.1 77.1 28.2 19.2 50 46 A M H ><5S+ 0 0 3 -4,-2.6 3,-1.6 1,-0.3 -1,-0.2 0.883 99.8 58.8 -64.1 -38.0 75.9 29.6 15.9 51 47 A T H 3<5S+ 0 0 0 -4,-1.8 -36,-2.7 1,-0.3 -1,-0.3 0.740 111.9 41.9 -63.2 -20.7 72.9 31.2 17.6 52 48 A K T <<5S- 0 0 58 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.312 113.5-115.0-101.3 3.0 75.4 33.1 19.9 53 49 A G T < 5S+ 0 0 17 -3,-1.6 -3,-0.2 -4,-0.2 -2,-0.1 0.791 87.3 114.4 62.7 30.9 77.9 34.0 17.1 54 50 A E < + 0 0 119 -5,-2.9 -4,-0.2 -6,-0.1 2,-0.2 0.259 39.9 107.5-115.3 8.5 80.5 31.7 18.9 55 51 A Y S S- 0 0 54 -6,-0.5 -8,-0.0 2,-0.3 4,-0.0 -0.586 85.0-108.0 -87.8 154.4 80.9 29.0 16.4 56 52 A Q S S+ 0 0 178 -2,-0.2 2,-0.6 1,-0.1 -1,-0.1 0.836 115.1 52.0 -49.9 -36.3 84.1 28.7 14.3 57 53 A L S S- 0 0 81 2,-0.0 2,-0.8 0, 0.0 -2,-0.3 -0.912 86.3-145.7-103.5 122.7 82.0 29.9 11.3 58 54 A K - 0 0 122 -2,-0.6 2,-0.3 -4,-0.1 -8,-0.1 -0.783 12.5-165.2 -92.2 107.9 80.1 33.1 12.1 59 55 A M - 0 0 40 -2,-0.8 4,-0.1 -9,-0.2 -4,-0.1 -0.744 15.4-135.4 -89.3 140.7 76.8 33.2 10.3 60 56 A E - 0 0 115 -2,-0.3 -50,-0.0 2,-0.1 -48,-0.0 -0.868 38.8 -76.7 -95.9 129.3 75.1 36.6 10.2 61 57 A P S S+ 0 0 41 0, 0.0 -50,-0.2 0, 0.0 2,-0.1 -0.260 103.3 58.3 -61.3 154.8 71.4 36.9 11.0 62 58 A P S S+ 0 0 89 0, 0.0 2,-0.3 0, 0.0 -51,-0.2 0.452 80.6 130.6 -79.0 141.6 68.9 36.4 9.8 63 59 A F B -C 10 0A 10 -53,-1.6 -53,-3.2 -51,-0.1 -51,-0.1 -0.992 56.3-119.6-153.2 150.7 69.6 32.6 9.2 64 60 A V - 0 0 20 -2,-0.3 31,-3.1 -55,-0.2 32,-0.3 -0.818 35.9-147.0 -88.0 113.3 68.0 29.2 9.8 65 61 A P + 0 0 0 0, 0.0 32,-2.8 0, 0.0 -57,-0.2 -0.255 45.9 99.8 -70.4 166.7 70.2 27.1 12.1 66 62 A G - 0 0 1 27,-0.3 30,-2.3 30,-0.3 -23,-0.1 0.400 34.5-168.6 122.0 115.9 70.6 23.4 11.9 67 63 A I S S+ 0 0 33 -25,-0.3 25,-1.9 28,-0.2 2,-0.4 0.724 71.6 59.1 -93.1 -28.6 73.2 21.2 10.5 68 64 A E E + G 0 91B 0 -26,-0.5 -26,-2.1 23,-0.2 2,-0.3 -0.930 56.7 163.2-119.2 128.1 71.6 17.7 10.6 69 65 A T E -EG 41 90B 3 21,-2.4 21,-3.0 -2,-0.4 2,-0.3 -0.960 15.3-170.2-137.8 155.9 68.3 16.5 9.0 70 66 A A E +EG 40 89B 0 -30,-2.0 -31,-2.8 -2,-0.3 -30,-2.0 -0.990 36.6 97.5-140.9 141.8 66.5 13.3 8.2 71 67 A G E -EG 38 88B 0 17,-2.4 17,-1.9 -2,-0.3 2,-0.4 -0.845 67.1 -41.8 179.3-138.6 63.4 12.9 6.1 72 68 A V E -EG 37 87B 44 -35,-1.8 -35,-3.1 -2,-0.2 2,-0.2 -0.960 51.2-113.1-128.6 131.3 62.1 12.1 2.6 73 69 A V E +E 36 0B 3 13,-3.0 12,-3.1 -2,-0.4 -37,-0.3 -0.496 28.7 178.0 -64.4 130.8 63.5 13.2 -0.6 74 70 A R E S+ 0 0 116 -39,-2.8 2,-0.3 1,-0.4 -38,-0.2 0.804 71.3 1.4 -94.9 -47.6 61.2 15.6 -2.6 75 71 A S E +E 35 0B 25 -40,-1.4 -40,-2.0 8,-0.1 -1,-0.4 -0.981 62.4 166.8-142.9 156.8 63.6 16.2 -5.6 76 72 A A - 0 0 21 -2,-0.3 -42,-0.2 -42,-0.2 3,-0.1 -0.967 37.8 -93.8-162.5 148.6 67.0 15.1 -6.7 77 73 A P > - 0 0 23 0, 0.0 3,-1.6 0, 0.0 5,-0.5 -0.334 46.2 -93.5 -70.3 155.2 69.1 15.4 -9.9 78 74 A E T 3 S+ 0 0 182 1,-0.3 5,-0.0 2,-0.1 0, 0.0 -0.347 111.1 19.2 -59.4 136.4 69.3 12.6 -12.6 79 75 A G T 3 S+ 0 0 86 1,-0.1 -1,-0.3 -3,-0.1 0, 0.0 0.436 89.4 108.0 81.6 -1.6 72.2 10.3 -12.0 80 76 A S S < S- 0 0 39 -3,-1.6 -2,-0.1 2,-0.3 3,-0.1 0.655 84.5-128.4 -75.3 -17.7 72.7 11.2 -8.3 81 77 A G S S+ 0 0 78 1,-0.3 2,-0.4 -4,-0.3 -3,-0.1 0.602 75.3 115.3 74.4 12.3 71.3 7.8 -7.5 82 78 A I - 0 0 27 -5,-0.5 -1,-0.3 4,-0.0 -2,-0.3 -0.948 47.0-168.7-113.7 136.7 68.8 9.6 -5.2 83 79 A K > - 0 0 41 -2,-0.4 3,-2.5 -3,-0.1 -10,-0.3 -0.947 32.6 -90.9-127.5 148.4 65.1 9.5 -5.9 84 80 A P T 3 S+ 0 0 88 0, 0.0 -10,-0.2 0, 0.0 3,-0.1 -0.196 115.3 32.2 -49.0 136.8 61.9 11.2 -4.6 85 81 A G T 3 S+ 0 0 50 -12,-3.1 -11,-0.1 1,-0.3 2,-0.1 0.154 85.4 134.7 93.9 -18.2 60.5 9.1 -1.7 86 82 A D < - 0 0 65 -3,-2.5 -13,-3.0 -14,-0.1 2,-0.7 -0.397 58.6-126.9 -65.4 138.4 63.9 7.9 -0.5 87 83 A R E +G 72 0B 87 -15,-0.2 24,-2.4 24,-0.1 2,-0.3 -0.798 46.0 170.9 -84.6 117.7 64.4 8.1 3.2 88 84 A V E -GH 71 110B 4 -17,-1.9 -17,-2.4 -2,-0.7 2,-0.3 -0.883 37.5-136.2-133.9 156.5 67.7 10.1 3.7 89 85 A M E -GH 70 109B 1 20,-3.2 20,-2.6 -2,-0.3 2,-0.3 -0.868 30.9-170.1-103.2 146.1 70.0 11.8 6.1 90 86 A A E -GH 69 108B 0 -21,-3.0 -21,-2.4 -2,-0.3 2,-0.4 -0.982 11.5-165.4-140.1 145.7 71.3 15.2 5.1 91 87 A F E +G 68 0B 42 16,-1.7 2,-0.3 -2,-0.3 13,-0.2 -1.000 17.4 150.0-133.1 144.8 73.9 17.7 6.4 92 88 A N - 0 0 40 -25,-1.9 4,-0.1 -2,-0.4 11,-0.1 -0.925 53.8-105.6-152.6 173.9 74.6 21.3 5.6 93 89 A F S S+ 0 0 116 -2,-0.3 -27,-0.3 1,-0.1 2,-0.3 0.848 100.1 0.3 -74.6 -27.9 76.0 24.4 7.4 94 90 A I S S+ 0 0 44 -29,-0.1 -28,-0.1 -27,-0.1 -1,-0.1 -0.838 97.4 65.9-143.6 173.1 72.5 25.9 7.8 95 91 A G + 0 0 18 -31,-3.1 -29,-0.2 -2,-0.3 -28,-0.2 0.270 58.6 118.7 98.4 -2.4 68.9 25.4 7.1 96 92 A G + 0 0 1 -30,-2.3 2,-2.1 -32,-0.3 -30,-0.3 0.785 59.7 71.3 -66.5 -34.2 68.0 22.3 9.2 97 93 A Y S S+ 0 0 0 -32,-2.8 -89,-2.5 -89,-0.2 2,-0.3 -0.453 88.9 88.5 -84.7 64.2 65.4 23.9 11.5 98 94 A A B S-B 7 0A 1 -2,-2.1 -91,-0.2 -91,-0.2 -60,-0.1 -0.964 88.0-108.4-157.1 160.2 62.9 24.0 8.6 99 95 A E S S+ 0 0 66 -93,-1.9 -61,-1.9 -2,-0.3 2,-0.3 0.791 106.5 20.7 -70.6 -30.5 60.1 22.0 6.9 100 96 A R E -D 37 0B 76 -94,-0.3 2,-0.3 -63,-0.2 -63,-0.2 -0.990 66.9-165.5-137.8 151.7 62.4 21.6 3.9 101 97 A V E -D 36 0B 5 -65,-2.1 -65,-2.7 -2,-0.3 2,-0.5 -0.988 11.8-146.6-136.5 141.0 66.1 21.7 3.3 102 98 A A E +D 35 0B 30 -2,-0.3 2,-0.3 -67,-0.2 -67,-0.2 -0.930 30.1 167.0-104.4 127.6 68.2 21.9 0.0 103 99 A V E -D 34 0B 4 -69,-2.5 -69,-2.6 -2,-0.5 -11,-0.1 -0.962 40.2 -92.8-140.8 161.3 71.6 20.2 0.2 104 100 A A > - 0 0 34 -2,-0.3 3,-2.3 -13,-0.2 -13,-0.2 -0.409 36.8-119.3 -70.0 147.2 74.3 19.0 -2.2 105 101 A P G > S+ 0 0 27 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.860 115.6 61.6 -55.6 -32.0 74.0 15.4 -3.5 106 102 A S G 3 S+ 0 0 85 1,-0.3 -2,-0.0 3,-0.0 -26,-0.0 0.633 98.3 59.1 -69.3 -12.4 77.3 14.7 -1.8 107 103 A N G < S+ 0 0 33 -3,-2.3 -16,-1.7 2,-0.0 2,-0.4 0.050 87.5 95.8-102.9 23.2 75.7 15.6 1.6 108 104 A I E < -H 90 0B 17 -3,-1.3 -18,-0.2 -18,-0.2 -20,-0.0 -0.946 48.2-178.4-117.3 135.9 73.0 12.9 1.4 109 105 A L E -H 89 0B 11 -20,-2.6 -20,-3.2 -2,-0.4 2,-0.3 -0.983 33.7-105.1-131.3 144.6 73.1 9.5 3.0 110 106 A P E -H 88 0B 78 0, 0.0 -22,-0.2 0, 0.0 -20,-0.0 -0.519 37.4-120.0 -68.6 130.3 70.6 6.6 2.9 111 107 A T - 0 0 13 -24,-2.4 -24,-0.1 -2,-0.3 6,-0.1 -0.523 30.8-109.1 -71.7 127.7 68.7 6.2 6.2 112 108 A P > - 0 0 2 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.301 24.2-131.8 -58.6 133.6 69.3 2.7 7.8 113 109 A P T 3 S+ 0 0 111 0, 0.0 -2,-0.1 0, 0.0 162,-0.0 0.751 102.5 62.5 -64.4 -19.2 66.0 0.8 7.4 114 110 A Q T 3 S+ 0 0 79 2,-0.0 2,-0.3 0, 0.0 -3,-0.0 0.640 96.1 76.8 -75.4 -14.0 66.1 -0.2 11.1 115 111 A L S < S- 0 0 5 -3,-1.8 2,-0.1 1,-0.0 168,-0.0 -0.714 71.3-134.9-104.2 146.3 65.9 3.4 12.3 116 112 A D > - 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