==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 31-AUG-11 3TM5 . COMPND 2 MOLECULE: CRYSTAL STRUCTURE OF TRM14; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR M.FISLAGE,M.ROOVERS,I.TUSZYNSKA,J.M.BUJNICKI,L.DROOGMANS,W.V . 738 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34555.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 525 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 66 8.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 114 15.4 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 1 0.1 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 . 63 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 186 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.2 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 0 4 0 3 1 1 4 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 2 0 2 2 0 2 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 3 7 2 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 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 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 M 0 0 90 0, 0.0 46,-2.4 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 149.5 74.6 36.5 60.7 2 2 A K E -A 46 0A 95 79,-0.3 79,-2.6 44,-0.2 2,-0.4 -0.919 360.0-173.8-121.2 135.9 72.3 33.9 62.2 3 3 A F E -AB 45 80A 2 42,-2.4 42,-3.2 -2,-0.4 2,-0.7 -0.984 19.0-144.0-126.2 134.4 69.8 34.1 65.0 4 4 A L E -AB 44 79A 5 75,-2.9 75,-2.3 -2,-0.4 2,-0.5 -0.920 23.3-165.9 -91.5 117.6 67.7 31.4 66.7 5 5 A L E -AB 43 78A 0 38,-2.8 38,-2.8 -2,-0.7 2,-0.3 -0.925 3.7-158.5-107.5 123.7 64.3 33.0 67.5 6 6 A T E +AB 42 77A 15 71,-2.2 70,-3.5 -2,-0.5 71,-0.7 -0.715 21.3 147.8-105.4 152.3 62.0 31.2 69.9 7 7 A T E - B 0 75A 8 34,-2.0 68,-0.1 -2,-0.3 5,-0.1 -0.893 53.6 -49.6-159.0-174.8 58.3 31.4 70.5 8 8 A A > - 0 0 4 66,-0.5 3,-1.3 -2,-0.3 33,-0.3 -0.426 67.1 -97.5 -64.3 146.2 55.4 29.2 71.5 9 9 A Q T 3 S+ 0 0 58 344,-0.3 344,-1.8 1,-0.2 -1,-0.1 -0.453 109.2 25.4 -58.8 137.3 55.0 25.9 69.6 10 10 A G T 3 S+ 0 0 11 342,-0.2 -1,-0.2 -2,-0.1 4,-0.1 0.586 104.4 80.3 78.9 8.9 52.5 26.3 66.8 11 11 A I <> + 0 0 0 -3,-1.3 4,-2.5 2,-0.1 5,-0.2 0.175 51.4 113.1-123.7 20.7 52.8 30.0 66.3 12 12 A E H > S+ 0 0 6 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.898 77.7 51.4 -59.2 -41.7 56.0 30.0 64.2 13 13 A D H > S+ 0 0 53 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.869 111.8 47.4 -64.0 -39.3 54.3 31.3 61.1 14 14 A I H > S+ 0 0 15 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.895 112.9 48.9 -68.2 -38.3 52.7 34.2 63.0 15 15 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.923 108.1 55.6 -70.5 -34.8 56.1 34.9 64.6 16 16 A K H X S+ 0 0 71 -4,-2.9 4,-2.3 2,-0.2 3,-0.2 0.961 107.6 46.1 -57.5 -58.9 57.7 34.9 61.1 17 17 A R H X S+ 0 0 160 -4,-2.0 4,-2.2 1,-0.3 5,-0.2 0.900 112.9 53.1 -50.7 -46.8 55.3 37.5 59.6 18 18 A E H X S+ 0 0 25 -4,-1.9 4,-1.3 1,-0.2 -1,-0.3 0.906 109.4 47.8 -52.0 -46.9 55.9 39.5 62.8 19 19 A V H X S+ 0 0 0 -4,-2.6 4,-2.2 -3,-0.2 -2,-0.2 0.903 110.9 50.8 -69.3 -34.1 59.7 39.3 62.3 20 20 A S H X S+ 0 0 24 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.950 106.0 52.3 -66.1 -54.6 59.6 40.3 58.6 21 21 A L H X S+ 0 0 87 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.855 113.5 48.1 -52.0 -35.8 57.5 43.4 59.0 22 22 A L H < S+ 0 0 15 -4,-1.3 4,-0.5 -5,-0.2 3,-0.5 0.939 114.3 41.0 -74.4 -48.5 60.0 44.5 61.6 23 23 A L H >X>S+ 0 0 0 -4,-2.2 5,-1.3 1,-0.2 3,-1.1 0.821 105.5 65.5 -73.1 -34.0 63.3 43.9 59.8 24 24 A K H ><5S+ 0 0 134 -4,-3.1 3,-1.1 1,-0.3 -1,-0.2 0.851 95.5 59.7 -50.3 -36.9 61.9 45.2 56.5 25 25 A K T 3<5S+ 0 0 158 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.751 100.5 55.5 -67.8 -26.5 61.7 48.6 58.2 26 26 A L T <45S- 0 0 55 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.639 112.6-119.9 -74.9 -21.5 65.4 48.5 58.8 27 27 A G T <<5 + 0 0 63 -3,-1.1 -3,-0.2 -4,-0.6 2,-0.1 0.517 62.1 149.9 92.6 8.3 66.1 48.0 55.1 28 28 A I < - 0 0 18 -5,-1.3 2,-0.3 1,-0.1 -1,-0.2 -0.391 46.8-133.3 -84.0 143.7 67.8 44.6 55.7 29 29 A S + 0 0 70 20,-0.2 19,-1.8 -2,-0.1 2,-0.3 -0.746 45.5 145.2 -87.0 148.1 68.0 41.6 53.5 30 30 A F E -C 47 0A 33 -2,-0.3 2,-0.3 17,-0.2 17,-0.3 -0.978 35.8-143.4-172.1 157.2 67.1 38.4 55.4 31 31 A Q E -C 46 0A 106 15,-2.6 15,-3.2 -2,-0.3 2,-0.4 -0.995 11.8-153.8-144.6 146.9 65.5 35.1 55.2 32 32 A I E -C 45 0A 17 -2,-0.3 2,-0.5 13,-0.2 13,-0.2 -0.961 2.4-162.7-129.8 123.6 63.5 33.1 57.8 33 33 A E E -C 44 0A 96 11,-2.1 11,-2.0 -2,-0.4 2,-0.4 -0.840 17.7-137.2-104.5 127.2 63.0 29.3 58.2 34 34 A E E S+C 43 0A 78 -2,-0.5 4,-0.2 1,-0.3 9,-0.2 -0.679 84.1 0.3 -80.0 137.4 60.1 28.0 60.3 35 35 A K S > S- 0 0 87 7,-2.3 3,-2.1 -2,-0.4 -1,-0.3 0.948 84.5-143.0 54.7 60.8 61.0 25.1 62.6 36 36 A P G > S+ 0 0 13 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.272 83.7 1.7 -51.1 134.3 64.7 24.8 61.6 37 37 A L G 3 S- 0 0 81 1,-0.3 -2,-0.1 -3,-0.1 3,-0.1 0.777 130.3 -67.6 61.4 27.2 65.6 21.1 61.6 38 38 A G G < S+ 0 0 52 -3,-2.1 -1,-0.3 -4,-0.2 2,-0.3 0.381 96.0 140.3 75.5 -7.3 62.0 20.2 62.4 39 39 A I < - 0 0 7 -3,-2.1 3,-0.4 -4,-0.1 -1,-0.2 -0.564 44.9-134.5 -76.9 132.9 62.2 21.7 65.9 40 40 A E S S+ 0 0 86 -2,-0.3 -31,-0.2 1,-0.2 3,-0.1 -0.510 81.3 37.0 -86.6 153.9 59.1 23.5 67.1 41 41 A G S S+ 0 0 7 -33,-0.3 -34,-2.0 1,-0.3 2,-0.3 0.694 101.8 105.1 77.3 24.8 58.9 26.9 68.8 42 42 A R E -A 6 0A 5 -3,-0.4 -7,-2.3 -36,-0.2 2,-0.3 -0.989 46.6-174.0-140.5 147.9 61.8 28.1 66.7 43 43 A L E -AC 5 34A 0 -38,-2.8 -38,-2.8 -2,-0.3 2,-0.7 -0.989 18.4-145.9-132.0 137.7 62.8 30.3 63.7 44 44 A L E -AC 4 33A 24 -11,-2.0 -11,-2.1 -2,-0.3 2,-0.5 -0.946 20.5-162.0-101.6 111.3 66.2 30.5 62.2 45 45 A L E -AC 3 32A 0 -42,-3.2 -42,-2.4 -2,-0.7 2,-0.5 -0.845 7.4-168.6 -92.8 125.8 66.8 34.1 61.0 46 46 A E E +AC 2 31A 63 -15,-3.2 -15,-2.6 -2,-0.5 2,-0.3 -0.967 20.8 160.2-109.6 119.1 69.6 34.8 58.4 47 47 A A E - C 0 30A 10 -46,-2.4 2,-0.3 -2,-0.5 -17,-0.2 -0.889 41.4-116.3-126.1 159.7 70.3 38.5 57.9 48 48 A E - 0 0 102 -19,-1.8 -20,-0.0 -2,-0.3 -2,-0.0 -0.706 54.0 -90.0 -74.9 149.3 73.0 40.7 56.6 49 49 A K - 0 0 72 -2,-0.3 2,-0.8 1,-0.1 -20,-0.2 -0.229 40.7-118.6 -49.1 144.1 74.5 42.9 59.3 50 50 A A E -H 62 0B 8 12,-0.5 12,-2.7 -22,-0.1 2,-0.3 -0.838 38.8-178.2-103.0 102.8 72.7 46.2 59.6 51 51 A Y E +H 61 0B 122 -2,-0.8 2,-0.3 10,-0.2 10,-0.2 -0.796 10.3 167.4-102.7 146.0 75.1 49.1 58.9 52 52 A Y E -H 60 0B 98 8,-1.9 8,-2.7 -2,-0.3 2,-0.5 -0.850 39.9-103.7-133.9 179.2 74.6 52.8 58.9 53 53 A V E -H 59 0B 109 -2,-0.3 6,-0.2 6,-0.2 -2,-0.0 -0.944 42.6-149.2-107.5 126.9 76.9 55.8 58.8 54 54 A D > - 0 0 15 4,-2.4 3,-1.7 -2,-0.5 5,-0.0 -0.007 32.8 -81.9 -91.0-171.7 77.3 57.5 62.2 55 55 A E T 3 S+ 0 0 159 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.782 129.0 52.9 -64.6 -22.7 78.0 61.0 63.5 56 56 A K T 3 S- 0 0 134 2,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.425 122.9-105.2 -89.1 -0.0 81.7 60.6 62.9 57 57 A G S < S+ 0 0 56 -3,-1.7 2,-0.4 1,-0.2 -2,-0.1 0.712 79.1 136.4 79.4 22.8 81.1 59.6 59.3 58 58 A R - 0 0 154 1,-0.0 -4,-2.4 0, 0.0 -1,-0.2 -0.867 63.7-107.8-112.1 135.4 81.9 55.9 60.2 59 59 A K E -H 53 0B 143 -2,-0.4 2,-0.3 -6,-0.2 -6,-0.2 -0.291 46.6-178.3 -46.5 127.0 80.2 52.6 59.3 60 60 A R E -H 52 0B 107 -8,-2.7 -8,-1.9 -6,-0.0 2,-0.2 -0.996 24.1-118.0-138.8 144.9 78.5 51.4 62.5 61 61 A E E -H 51 0B 101 -2,-0.3 2,-0.5 -10,-0.2 -10,-0.2 -0.537 15.2-145.5 -82.9 143.7 76.5 48.3 63.3 62 62 A L E -H 50 0B 62 -12,-2.7 -12,-0.5 -2,-0.2 2,-0.3 -0.952 28.0-117.4-102.6 122.7 72.8 48.4 64.3 63 63 A S > - 0 0 52 -2,-0.5 4,-1.3 1,-0.2 5,-0.0 -0.437 27.7-174.7 -63.1 118.4 72.0 45.6 66.9 64 64 A I H > S+ 0 0 10 -2,-0.3 4,-2.3 2,-0.2 5,-0.3 0.849 86.0 55.0 -83.1 -35.1 69.5 43.3 65.3 65 65 A S H > S+ 0 0 15 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.963 110.2 45.3 -60.8 -48.3 69.1 41.4 68.6 66 66 A T H > S+ 0 0 67 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.912 110.3 54.6 -58.9 -45.6 68.3 44.6 70.5 67 67 A Y H X S+ 0 0 44 -4,-1.3 4,-1.2 2,-0.2 -1,-0.2 0.912 114.3 40.4 -55.7 -47.4 65.9 45.7 67.8 68 68 A L H >X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 3,-0.6 0.946 112.6 53.9 -70.3 -48.3 63.9 42.4 68.1 69 69 A N H 3< S+ 0 0 29 -4,-3.4 -2,-0.2 -5,-0.3 -1,-0.2 0.913 113.7 44.3 -48.5 -43.0 64.2 42.2 71.8 70 70 A E H 3< S+ 0 0 146 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.738 125.1 26.1 -77.1 -28.1 62.6 45.7 72.1 71 71 A N H << S+ 0 0 81 -4,-1.2 2,-0.3 -3,-0.6 -2,-0.2 0.542 88.0 102.8-120.2 -17.2 59.8 45.5 69.5 72 72 A S < - 0 0 10 -4,-2.3 -57,-0.0 1,-0.1 -53,-0.0 -0.597 37.4-176.4 -74.1 142.2 58.6 41.9 69.1 73 73 A R S S+ 0 0 71 -2,-0.3 135,-0.3 -58,-0.1 -1,-0.1 0.580 82.2 45.7-105.8 -15.2 55.4 40.9 70.8 74 74 A L S S+ 0 0 0 -59,-0.1 -66,-0.5 134,-0.1 2,-0.1 0.608 89.4 91.3-101.5 -22.0 55.6 37.2 69.8 75 75 A L E -B 7 0A 0 -7,-0.1 -68,-0.3 1,-0.1 3,-0.1 -0.464 46.7-166.8 -84.9 152.1 59.1 36.0 70.5 76 76 A H E S+ 0 0 22 -70,-3.5 112,-2.8 1,-0.4 2,-0.3 0.809 74.4 3.6 -95.7 -46.3 60.4 34.5 73.7 77 77 A R E -B 6 0A 41 -71,-0.7 -71,-2.2 110,-0.2 2,-0.6 -0.992 51.9-150.2-146.9 142.0 64.2 34.7 73.1 78 78 A V E -B 5 0A 0 -2,-0.3 104,-1.8 -73,-0.2 105,-0.8 -0.982 26.5-178.2-112.8 117.7 66.6 36.1 70.5 79 79 A I E -BD 4 181A 0 -75,-2.3 -75,-2.9 -2,-0.6 2,-0.4 -0.982 28.0-131.3-121.8 128.5 69.7 34.0 70.4 80 80 A I E -BD 3 180A 31 100,-2.5 100,-2.2 -2,-0.4 2,-0.4 -0.626 37.0-127.6 -72.6 123.8 72.8 34.6 68.2 81 81 A E E + D 0 179A 26 -79,-2.6 -79,-0.3 -2,-0.4 98,-0.2 -0.668 36.4 172.1 -81.7 129.0 73.5 31.2 66.8 82 82 A I E S- 0 0 26 96,-2.3 2,-0.3 -2,-0.4 97,-0.2 0.842 74.0 -20.4 -93.9 -47.6 77.0 29.7 67.1 83 83 A A E - D 0 178A 13 95,-1.6 95,-2.2 26,-0.1 2,-0.4 -0.981 47.6-160.7-156.2 153.7 75.9 26.2 65.7 84 84 A S E + D 0 177A 34 -2,-0.3 2,-0.4 93,-0.2 93,-0.2 -0.972 28.8 162.9-132.7 118.4 72.8 24.0 65.1 85 85 A E E - D 0 176A 94 91,-2.6 91,-3.5 -2,-0.4 2,-0.4 -0.994 37.8-128.7-139.0 141.3 73.4 20.3 64.6 86 86 A K E - D 0 175A 102 -2,-0.4 2,-0.7 89,-0.2 89,-0.2 -0.728 16.7-160.9 -76.6 129.8 71.6 17.0 64.6 87 87 A F > - 0 0 10 87,-2.3 3,-1.6 -2,-0.4 4,-0.3 -0.939 23.5-137.3-105.2 95.4 73.4 14.4 66.8 88 88 A N T 3 S+ 0 0 123 -2,-0.7 87,-0.0 1,-0.2 -2,-0.0 -0.376 81.0 2.9 -48.0 123.4 71.9 11.2 65.4 89 89 A G T >> S+ 0 0 21 -2,-0.1 4,-0.7 1,-0.1 3,-0.5 0.615 86.6 134.1 75.8 18.2 71.0 8.8 68.2 90 90 A I T <4 + 0 0 2 -3,-1.6 42,-0.4 2,-0.2 3,-0.3 0.850 69.8 50.5 -65.0 -42.7 72.0 11.1 71.1 91 91 A E T 34 S+ 0 0 52 -4,-0.3 -1,-0.2 1,-0.2 4,-0.1 0.604 117.3 45.2 -76.3 -7.0 69.0 10.6 73.4 92 92 A K T <4 S+ 0 0 170 -3,-0.5 -2,-0.2 39,-0.1 -1,-0.2 0.448 93.3 98.1-115.3 -7.2 69.6 6.9 72.8 93 93 A D S < S- 0 0 32 -4,-0.7 39,-0.2 -3,-0.3 2,-0.1 -0.456 87.7 -98.2 -68.4 153.6 73.4 7.2 73.4 94 94 A E >> - 0 0 135 -2,-0.1 4,-2.1 1,-0.1 3,-0.7 -0.398 41.0 -96.4 -78.9 156.8 74.5 6.3 76.9 95 95 A S H 3> S+ 0 0 41 1,-0.3 4,-2.1 37,-0.2 5,-0.2 0.839 122.3 39.7 -41.8 -49.9 75.1 9.1 79.4 96 96 A E H 3> S+ 0 0 147 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.797 111.6 54.0 -83.3 -24.9 78.9 9.3 78.8 97 97 A E H <> S+ 0 0 93 -3,-0.7 4,-1.4 2,-0.2 -1,-0.2 0.790 111.2 52.4 -69.5 -25.4 78.9 8.8 75.1 98 98 A A H X S+ 0 0 1 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.940 108.9 43.1 -73.2 -55.7 76.4 11.7 75.1 99 99 A L H X S+ 0 0 38 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.954 113.5 58.0 -55.3 -45.1 78.4 14.2 77.1 100 100 A K H X S+ 0 0 113 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.860 104.7 47.7 -45.3 -51.6 81.3 13.1 75.0 101 101 A R H X S+ 0 0 73 -4,-1.4 4,-0.9 1,-0.2 -1,-0.2 0.907 114.3 48.5 -64.0 -38.6 79.6 14.0 71.7 102 102 A I H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 3,-0.3 0.916 110.8 47.0 -64.8 -51.1 78.7 17.4 73.1 103 103 A K H X S+ 0 0 54 -4,-2.7 4,-3.6 1,-0.3 5,-0.2 0.926 112.3 49.2 -68.0 -46.1 82.1 18.4 74.5 104 104 A D H < S+ 0 0 79 -4,-1.8 4,-0.4 -5,-0.2 -1,-0.3 0.747 114.0 49.1 -60.8 -28.0 84.0 17.5 71.4 105 105 A F H < S+ 0 0 46 -4,-0.9 3,-0.4 -3,-0.3 4,-0.3 0.894 115.0 40.7 -78.7 -46.7 81.4 19.4 69.4 106 106 A V H >< S+ 0 0 2 -4,-2.8 3,-2.5 1,-0.2 5,-0.3 0.914 106.7 63.5 -70.4 -40.0 81.6 22.6 71.5 107 107 A S T 3< S+ 0 0 27 -4,-3.6 -1,-0.2 1,-0.3 -2,-0.2 0.738 101.5 54.8 -52.6 -26.8 85.3 22.4 71.9 108 108 A S T 3 S+ 0 0 88 -3,-0.4 -1,-0.3 -4,-0.4 -2,-0.2 0.623 86.5 102.0 -80.6 -18.4 85.5 22.8 68.1 109 109 A L S < S- 0 0 16 -3,-2.5 2,-2.9 -4,-0.3 3,-0.2 -0.490 78.7-127.2 -78.8 138.0 83.4 26.0 68.2 110 110 A P > + 0 0 58 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 -0.291 49.4 157.3 -74.6 59.3 85.2 29.3 67.8 111 111 A V G > + 0 0 1 -2,-2.9 3,-1.3 -5,-0.3 4,-0.3 0.658 58.6 72.7 -64.3 -18.0 83.5 30.5 71.0 112 112 A E G 3 S+ 0 0 28 1,-0.3 3,-0.3 -3,-0.2 -1,-0.3 0.659 87.6 63.0 -70.1 -16.2 86.2 33.1 71.6 113 113 A Q G < S+ 0 0 139 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.261 103.4 48.7 -93.7 13.6 84.9 35.2 68.7 114 114 A F S < S+ 0 0 72 -3,-1.3 2,-0.3 1,-0.3 -1,-0.2 0.382 114.8 36.5-132.0 -7.1 81.5 35.7 70.5 115 115 A V S S- 0 0 10 -4,-0.3 2,-0.4 -3,-0.3 -1,-0.3 -0.990 85.8-108.7-148.4 146.2 82.7 36.7 73.8 116 116 A K > - 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