==== 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 TRANSFERASE 26-APR-07 2YXD . COMPND 2 MOLECULE: PROBABLE COBALT-PRECORRIN-6Y C(15)-METHYLTRANSFER . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR B.PADMANABHAN,Y.BESSHO,S.YOKOYAMA,RIKEN STRUCTURAL . 360 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16291.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 274 76.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 11.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 15.0 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 . 3 0.8 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 . 42 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.7 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 2 0 0 2 0 0 2 2 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 2 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 . 1 0 0 0 0 4 3 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 0 0 0 0 0 0 0 0 0 0 0 0 1 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 4 A X 0 0 72 0, 0.0 209,-0.1 0, 0.0 210,-0.1 0.000 360.0 360.0 360.0-140.3 67.2 18.1 45.9 2 5 A I + 0 0 14 208,-0.1 47,-0.1 206,-0.1 206,-0.1 -0.033 360.0 173.9 162.8 -44.7 67.0 20.8 43.0 3 6 A P - 0 0 22 0, 0.0 205,-0.0 0, 0.0 204,-0.0 0.686 18.4-155.2 -16.8 155.4 63.5 21.4 41.2 4 7 A D S > S+ 0 0 21 2,-0.1 3,-0.6 1,-0.1 41,-0.0 0.607 83.7 58.5-112.2 -22.6 62.9 24.1 38.6 5 8 A E T 3 S+ 0 0 152 1,-0.2 -1,-0.1 3,-0.0 0, 0.0 0.617 96.4 68.7 -86.4 -13.2 59.2 25.1 38.6 6 9 A E T 3 S+ 0 0 89 2,-0.1 2,-0.3 0, 0.0 -1,-0.2 0.178 80.7 97.5 -96.5 23.4 59.5 26.1 42.3 7 10 A F S < S- 0 0 19 -3,-0.6 2,-0.6 8,-0.0 37,-0.1 -0.856 77.6-121.8-111.1 142.1 61.7 29.1 41.5 8 11 A I - 0 0 46 -2,-0.3 65,-0.2 61,-0.2 2,-0.2 -0.704 37.4-173.6 -93.9 117.7 60.3 32.6 41.2 9 12 A R - 0 0 69 -2,-0.6 2,-0.3 35,-0.0 6,-0.0 -0.544 12.1-162.7-108.1 176.3 61.1 34.0 37.8 10 13 A R B > -A 13 0A 39 3,-0.5 3,-2.1 -2,-0.2 59,-0.1 -0.864 32.1 -99.8-163.9 124.6 60.7 37.4 36.2 11 14 A E T 3 S+ 0 0 110 -2,-0.3 0, 0.0 1,-0.2 0, 0.0 -0.036 108.8 25.7 -42.6 143.8 60.7 38.5 32.6 12 15 A G T 3 S+ 0 0 91 1,-0.1 -1,-0.2 54,-0.0 54,-0.1 0.105 104.5 95.9 84.4 -18.6 64.1 40.1 31.5 13 16 A V B < S-A 10 0A 27 -3,-2.1 -3,-0.5 52,-0.1 -1,-0.1 -0.913 70.4-135.8-110.3 121.1 66.0 38.1 34.2 14 17 A P - 0 0 85 0, 0.0 29,-0.9 0, 0.0 2,-0.4 -0.399 12.4-159.9 -76.7 151.7 67.6 34.7 33.3 15 18 A I - 0 0 56 27,-0.2 2,-0.4 28,-0.1 -6,-0.0 -1.000 22.8-120.4-132.1 129.0 67.5 31.4 35.3 16 19 A T - 0 0 45 -2,-0.4 5,-0.1 1,-0.1 26,-0.0 -0.528 38.4-114.0 -57.4 121.5 70.0 28.5 35.0 17 20 A K > - 0 0 95 -2,-0.4 4,-2.4 1,-0.1 3,-0.2 -0.233 25.7-109.6 -59.4 150.3 68.1 25.3 33.9 18 21 A E H > S+ 0 0 16 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.807 115.1 52.0 -52.3 -43.3 68.0 22.5 36.4 19 22 A E H > S+ 0 0 3 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.951 110.6 49.3 -68.4 -40.1 70.2 20.1 34.6 20 23 A I H > S+ 0 0 16 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.957 110.7 49.5 -59.5 -49.4 72.9 22.8 34.2 21 24 A R H X S+ 0 0 0 -4,-2.4 4,-3.3 1,-0.2 5,-0.3 0.918 107.4 55.3 -62.7 -33.8 72.8 23.7 37.9 22 25 A A H X S+ 0 0 9 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.948 113.7 41.3 -60.3 -44.3 73.0 20.0 38.9 23 26 A V H X S+ 0 0 3 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.944 116.9 47.2 -69.6 -45.3 76.3 19.8 36.8 24 27 A S H X S+ 0 0 0 -4,-3.1 4,-1.1 1,-0.2 3,-0.2 0.932 110.7 52.2 -66.0 -45.4 77.7 23.1 38.0 25 28 A I H >X S+ 0 0 12 -4,-3.3 3,-0.9 -5,-0.3 4,-0.7 0.921 107.9 52.5 -52.6 -48.9 76.9 22.4 41.7 26 29 A G H >< S+ 0 0 7 -4,-1.8 3,-1.1 -5,-0.3 -1,-0.2 0.871 103.7 56.5 -56.2 -40.3 78.7 19.1 41.4 27 30 A K H 3< S+ 0 0 0 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.738 99.4 61.6 -65.4 -27.4 81.8 20.8 40.0 28 31 A L H << S- 0 0 0 -4,-1.1 -1,-0.2 -3,-0.9 -2,-0.2 0.723 88.3-152.1 -72.9 -22.1 82.0 23.1 43.0 29 32 A N << - 0 0 80 -3,-1.1 2,-0.2 -4,-0.7 -3,-0.1 0.954 24.7-160.3 48.8 59.1 82.5 20.1 45.5 30 33 A L + 0 0 13 -5,-0.4 2,-0.3 2,-0.0 -1,-0.2 -0.529 18.4 176.4 -81.7 134.9 80.9 22.1 48.2 31 34 A N > - 0 0 77 -2,-0.2 3,-2.8 151,-0.0 24,-0.6 -0.898 46.3 -91.5-132.5 170.6 81.3 21.3 51.9 32 35 A K T 3 S+ 0 0 140 1,-0.3 22,-0.1 -2,-0.3 -2,-0.0 0.632 120.5 53.7 -57.5 -22.1 80.1 23.0 55.2 33 36 A D T 3 S+ 0 0 119 21,-0.1 2,-0.4 22,-0.1 -1,-0.3 0.334 82.5 114.0 -96.0 9.7 83.2 25.1 55.6 34 37 A D < - 0 0 9 -3,-2.8 21,-1.8 19,-0.2 22,-1.3 -0.679 46.6-164.1 -89.7 135.1 83.1 26.7 52.1 35 38 A V E -b 56 0B 21 -2,-0.4 64,-2.9 20,-0.2 65,-1.9 -0.993 23.1-167.8-116.4 116.6 82.5 30.4 51.8 36 39 A V E -bc 57 100B 0 20,-2.2 22,-2.5 -2,-0.5 2,-0.5 -0.876 22.1-148.5-119.8 135.9 81.5 31.0 48.2 37 40 A V E -bc 58 101B 0 63,-2.1 65,-2.2 -2,-0.4 2,-0.6 -0.910 13.5-161.2 -95.8 131.7 81.1 34.0 46.0 38 41 A D E -bc 59 102B 5 20,-3.5 22,-1.6 -2,-0.5 65,-0.2 -0.894 14.3-167.7-119.8 103.5 78.5 33.7 43.3 39 42 A V E +bc 60 103B 4 63,-2.6 65,-1.9 -2,-0.6 22,-0.2 -0.523 41.0 54.9 -92.1 153.0 79.0 36.2 40.6 40 43 A G S S- 0 0 14 20,-1.0 2,-0.7 -2,-0.2 65,-0.2 0.561 81.5 -92.3 95.3 125.9 76.8 37.2 37.8 41 44 A C + 0 0 48 63,-0.1 2,-0.1 2,-0.1 20,-0.1 -0.541 62.5 136.2 -88.1 104.7 73.3 38.5 38.0 42 45 A G - 0 0 20 -2,-0.7 28,-0.4 24,-0.1 -27,-0.2 -0.315 66.7 -80.8-125.8-158.5 70.6 35.8 37.7 43 46 A S - 0 0 2 -29,-0.9 30,-0.3 -2,-0.1 -35,-0.2 0.454 69.5 -95.9 -95.2 -7.2 67.4 34.8 39.3 44 47 A G S > S+ 0 0 3 29,-0.1 4,-2.3 28,-0.1 5,-0.3 0.427 86.2 122.9 109.1 -1.8 68.8 33.1 42.3 45 48 A G H > S+ 0 0 4 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.948 83.7 35.6 -63.0 -52.1 68.7 29.4 41.2 46 49 A X H > S+ 0 0 8 2,-0.2 4,-1.9 1,-0.2 5,-0.3 0.881 113.0 61.3 -67.0 -40.0 72.4 28.7 41.6 47 50 A T H > S+ 0 0 4 2,-0.2 4,-3.5 1,-0.2 3,-0.3 0.957 107.5 43.5 -51.5 -57.5 72.6 31.0 44.8 48 51 A V H X S+ 0 0 2 -4,-2.3 4,-2.8 1,-0.3 5,-0.2 0.960 113.1 50.7 -55.2 -53.0 70.1 28.8 46.7 49 52 A E H < S+ 0 0 4 -4,-1.8 4,-0.3 -5,-0.3 -1,-0.3 0.843 115.8 42.8 -58.5 -31.6 71.6 25.6 45.6 50 53 A I H >X S+ 0 0 0 -4,-1.9 3,-1.4 -3,-0.3 4,-0.7 0.883 111.8 54.1 -79.2 -39.6 75.0 26.9 46.7 51 54 A A H >< S+ 0 0 3 -4,-3.5 3,-1.3 1,-0.3 -2,-0.2 0.938 102.5 58.8 -59.1 -39.9 73.7 28.4 49.9 52 55 A K T 3< S+ 0 0 97 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.687 111.7 39.6 -68.7 -15.3 72.1 25.0 50.9 53 56 A R T <4 S+ 0 0 56 -3,-1.4 -1,-0.3 -4,-0.3 2,-0.2 0.371 110.4 47.3-115.4 1.1 75.5 23.2 50.8 54 57 A C S << S- 0 0 5 -3,-1.3 -22,-0.2 -4,-0.7 -19,-0.1 -0.797 82.6 -96.8-137.5 179.1 78.1 25.6 52.3 55 58 A K S S- 0 0 124 -21,-1.8 2,-0.3 -24,-0.6 -20,-0.2 0.907 96.4 -19.3 -63.8 -49.4 79.0 28.0 55.2 56 59 A F E -b 35 0B 58 -22,-1.3 -20,-2.2 -6,-0.1 2,-0.4 -0.960 58.0-150.7-161.6 145.7 78.0 31.3 53.5 57 60 A V E -bd 36 82B 0 24,-2.8 26,-2.1 -2,-0.3 2,-0.6 -0.986 4.8-152.6-124.5 135.8 77.4 32.7 50.0 58 61 A Y E -bd 37 83B 39 -22,-2.5 -20,-3.5 -2,-0.4 2,-1.0 -0.907 11.5-157.6 -97.2 115.7 77.9 36.1 48.5 59 62 A A E -bd 38 84B 0 24,-2.1 26,-2.6 -2,-0.6 2,-0.6 -0.787 8.5-168.8 -96.9 103.3 75.6 36.8 45.7 60 63 A I E +bd 39 85B 2 -22,-1.6 -20,-1.0 -2,-1.0 2,-0.4 -0.797 17.3 160.5 -92.5 116.6 77.1 39.5 43.6 61 64 A D E - d 0 86B 2 24,-1.4 26,-1.8 -2,-0.6 -2,-0.0 -0.992 26.9-161.3-137.9 136.0 74.5 40.8 41.1 62 65 A Y + 0 0 61 -2,-0.4 2,-0.4 24,-0.2 26,-0.1 0.302 66.3 74.5-104.5 8.0 74.8 44.2 39.3 63 66 A L S > S- 0 0 46 1,-0.1 4,-2.0 24,-0.1 3,-0.5 -0.977 72.4-134.2-128.8 143.4 71.2 44.7 38.1 64 67 A D H > S+ 0 0 111 -2,-0.4 4,-2.6 1,-0.2 5,-0.2 0.887 102.3 54.8 -59.8 -45.7 68.1 45.6 40.0 65 68 A G H > S+ 0 0 37 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.872 110.3 46.7 -54.4 -40.9 65.8 43.0 38.5 66 69 A A H > S+ 0 0 4 -3,-0.5 4,-3.9 2,-0.2 5,-0.3 0.907 109.9 52.3 -71.0 -44.7 68.1 40.2 39.4 67 70 A I H X S+ 0 0 23 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.945 110.1 51.2 -56.1 -46.6 68.7 41.4 42.9 68 71 A E H X S+ 0 0 89 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.949 113.8 41.0 -60.5 -49.8 65.0 41.5 43.4 69 72 A V H X S+ 0 0 4 -4,-2.3 4,-3.2 2,-0.2 5,-0.3 0.948 113.8 52.1 -68.9 -43.4 64.2 38.0 42.2 70 73 A T H X S+ 0 0 0 -4,-3.9 4,-3.9 -28,-0.4 -1,-0.2 0.939 108.7 52.7 -54.7 -47.5 67.2 36.5 43.9 71 74 A K H X S+ 0 0 109 -4,-2.8 4,-2.7 -5,-0.3 -1,-0.2 0.942 109.7 48.4 -49.7 -50.5 66.0 38.1 47.1 72 75 A Q H X S+ 0 0 77 -4,-2.5 4,-3.4 2,-0.2 -2,-0.2 0.962 112.7 47.5 -61.5 -48.3 62.5 36.6 46.6 73 76 A N H X S+ 0 0 0 -4,-3.2 4,-2.0 -30,-0.3 -2,-0.2 0.957 109.2 53.6 -56.7 -44.6 64.0 33.2 46.0 74 77 A L H <>S+ 0 0 14 -4,-3.9 5,-2.9 -5,-0.3 3,-0.3 0.918 112.4 45.5 -53.3 -44.9 66.2 33.6 49.0 75 78 A A H ><5S+ 0 0 69 -4,-2.7 3,-2.2 1,-0.2 -1,-0.2 0.956 108.3 58.6 -59.4 -48.6 63.0 34.3 51.0 76 79 A K H 3<5S+ 0 0 99 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.752 112.7 35.7 -59.0 -33.8 61.3 31.5 49.4 77 80 A F T 3<5S- 0 0 59 -4,-2.0 -1,-0.3 -3,-0.3 -2,-0.2 0.220 110.2-116.8-106.8 19.5 63.7 28.8 50.6 78 81 A N T < 5 + 0 0 131 -3,-2.2 2,-0.7 1,-0.2 -3,-0.2 0.891 48.2 176.9 52.9 49.6 64.4 30.4 53.9 79 82 A I < + 0 0 28 -5,-2.9 3,-0.2 -6,-0.2 -1,-0.2 -0.748 21.7 162.3 -87.5 119.6 68.1 31.0 53.2 80 83 A K + 0 0 197 -2,-0.7 -1,-0.1 1,-0.1 -2,-0.0 0.136 63.7 83.5-113.4 21.1 69.9 33.0 56.0 81 84 A N S S+ 0 0 35 -25,-0.1 -24,-2.8 1,-0.0 2,-0.4 0.208 80.8 81.2-101.0 8.0 73.3 31.8 54.6 82 85 A C E -d 57 0B 21 -26,-0.2 2,-0.6 -3,-0.2 -24,-0.2 -0.949 50.3-165.6-141.0 130.3 73.5 34.6 52.0 83 86 A Q E -d 58 0B 94 -26,-2.1 -24,-2.1 -2,-0.4 2,-0.4 -0.924 16.9-149.2-112.1 123.1 74.4 38.2 51.4 84 87 A I E -d 59 0B 39 -2,-0.6 2,-0.6 -26,-0.2 -24,-0.2 -0.695 13.8-164.8 -84.8 130.4 73.4 39.8 48.2 85 88 A I E -d 60 0B 23 -26,-2.6 -24,-1.4 -2,-0.4 2,-0.4 -0.955 11.3-142.8-123.0 113.9 75.9 42.5 47.2 86 89 A K E +d 61 0B 133 -2,-0.6 -24,-0.2 -26,-0.2 2,-0.2 -0.587 57.5 47.1 -76.1 127.9 74.8 44.9 44.6 87 90 A G S S- 0 0 24 -26,-1.8 2,-0.3 -2,-0.4 -24,-0.1 -0.740 89.9 -30.6 140.3 169.3 77.6 45.9 42.3 88 91 A R >> - 0 0 119 -2,-0.2 4,-1.9 1,-0.1 3,-1.0 -0.493 46.0-139.8 -56.2 122.0 80.5 45.1 40.0 89 92 A A H 3> S+ 0 0 5 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.891 102.9 60.1 -50.6 -44.4 82.2 41.9 41.1 90 93 A E H 34 S+ 0 0 17 17,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.831 107.7 44.8 -61.6 -25.3 85.6 43.5 40.3 91 94 A D H <4 S+ 0 0 95 -3,-1.0 4,-0.3 2,-0.1 -1,-0.2 0.859 123.0 36.2 -82.1 -35.5 84.8 46.4 42.9 92 95 A V H >< S+ 0 0 20 -4,-1.9 3,-2.4 1,-0.1 4,-0.3 0.915 96.7 76.5 -83.2 -49.3 83.6 44.1 45.6 93 96 A L G >< S+ 0 0 0 -4,-3.0 3,-2.0 1,-0.3 -1,-0.1 0.776 88.3 59.7 -42.4 -43.8 85.7 41.0 45.3 94 97 A D G 3 S+ 0 0 90 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.864 100.8 58.0 -52.1 -35.3 88.8 42.5 47.0 95 98 A K G < S+ 0 0 179 -3,-2.4 -1,-0.3 -4,-0.3 2,-0.2 0.509 93.9 82.7 -78.0 -1.7 86.8 43.1 50.2 96 99 A L < - 0 0 21 -3,-2.0 2,-0.5 -4,-0.3 -59,-0.0 -0.687 61.9-144.7-114.4 159.6 85.7 39.5 50.9 97 100 A E + 0 0 159 -2,-0.2 2,-0.3 -61,-0.1 -2,-0.0 -0.976 46.2 128.7-121.7 114.1 87.1 36.5 52.5 98 101 A F - 0 0 9 -2,-0.5 -62,-0.2 1,-0.1 3,-0.1 -0.942 47.8-145.4-162.1 163.8 86.0 33.3 50.8 99 102 A N S S+ 0 0 61 -64,-2.9 24,-0.5 -2,-0.3 23,-0.4 0.447 74.8 44.3-122.7 -10.0 87.6 30.3 49.4 100 103 A K E -c 36 0B 12 -65,-1.9 -63,-2.1 22,-0.1 2,-0.4 -0.984 58.1-158.6-135.4 156.1 85.5 29.2 46.3 101 104 A A E -ce 37 124B 0 22,-1.6 24,-2.8 -2,-0.3 2,-0.4 -0.998 11.7-172.1-138.8 135.7 83.9 30.9 43.3 102 105 A F E -ce 38 125B 7 -65,-2.2 -63,-2.6 -2,-0.4 2,-0.5 -0.984 17.7-166.1-110.2 131.5 81.1 30.3 40.8 103 106 A I E +ce 39 126B 3 22,-2.2 24,-2.2 -2,-0.4 -63,-0.2 -0.965 16.2 159.3-121.8 118.4 80.9 32.7 38.0 104 107 A G - 0 0 12 -65,-1.9 -63,-0.1 -2,-0.5 -64,-0.1 -0.164 63.3 -4.7-107.3-153.5 78.0 33.0 35.7 105 108 A G S S+ 0 0 74 -65,-0.2 -65,-0.1 -2,-0.1 24,-0.1 0.527 88.0 143.8 11.7 -89.3 76.8 35.8 33.5 106 109 A T - 0 0 38 1,-0.1 2,-0.3 2,-0.1 3,-0.2 0.871 46.3-122.1 41.4 139.5 79.3 38.6 34.5 107 110 A K S S+ 0 0 62 1,-0.2 -17,-0.2 2,-0.1 5,-0.2 -0.806 90.0 25.1-101.2 151.1 81.3 41.6 32.8 108 111 A N > + 0 0 50 -2,-0.3 4,-2.7 3,-0.1 -1,-0.2 0.984 62.5 171.3 61.8 61.3 85.1 41.8 32.9 109 112 A I H > S+ 0 0 4 -3,-0.2 4,-3.0 2,-0.2 5,-0.2 0.855 78.8 57.4 -69.9 -30.0 85.8 38.1 33.3 110 113 A E H > S+ 0 0 71 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.971 108.5 44.1 -69.2 -47.7 89.4 39.0 32.7 111 114 A K H > S+ 0 0 86 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.937 115.0 49.0 -55.7 -47.5 89.4 41.3 35.7 112 115 A I H X S+ 0 0 0 -4,-2.7 4,-3.7 1,-0.2 5,-0.2 0.933 110.8 49.5 -62.9 -45.4 87.5 38.9 37.9 113 116 A I H X S+ 0 0 1 -4,-3.0 4,-3.0 1,-0.2 -1,-0.2 0.912 110.9 49.5 -63.0 -43.2 89.7 35.9 37.1 114 117 A E H X S+ 0 0 85 -4,-2.2 4,-2.7 -5,-0.2 -1,-0.2 0.927 114.3 45.1 -58.6 -48.1 92.9 38.0 37.8 115 118 A I H X S+ 0 0 25 -4,-2.5 4,-2.6 2,-0.2 6,-0.2 0.951 112.5 51.6 -59.8 -52.5 91.4 39.1 41.2 116 119 A L H <>S+ 0 0 0 -4,-3.7 5,-2.4 -5,-0.2 -2,-0.2 0.936 112.3 47.3 -47.5 -50.2 90.2 35.6 42.0 117 120 A D H ><5S+ 0 0 23 -4,-3.0 3,-1.9 1,-0.2 -2,-0.2 0.960 113.3 44.8 -59.6 -57.5 93.8 34.3 41.3 118 121 A K H 3<5S+ 0 0 137 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.746 106.8 61.4 -60.7 -23.9 95.6 36.9 43.3 119 122 A K T 3<5S- 0 0 71 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.428 117.0-117.3 -80.4 6.8 93.1 36.4 46.2 120 123 A K T < 5 + 0 0 161 -3,-1.9 2,-0.9 1,-0.2 -3,-0.2 0.801 53.1 167.2 61.9 31.3 94.3 32.8 46.2 121 124 A I < - 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P 0 348B 27 -189,-2.9 2,-0.4 -2,-0.4 9,-0.3 -0.473 28.5-165.2 -61.7 134.4 88.1 19.9 26.3 340 162 B K E - P 0 347B 112 7,-3.0 7,-2.2 -2,-0.1 2,-0.1 -0.995 18.3-124.7-125.0 125.3 91.4 18.2 25.5 341 163 B K E + P 0 346B 129 -2,-0.4 5,-0.2 5,-0.2 3,-0.1 -0.419 37.1 166.5 -68.0 140.4 94.6 20.3 25.5 342 164 B I E > - P 0 345B 52 3,-2.6 3,-1.7 -2,-0.1 -2,-0.0 -0.943 52.7 -90.0-147.4 161.6 96.7 20.1 22.3 343 165 B P T 3 S+ 0 0 141 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.859 126.7 44.4 -44.3 -47.3 99.6 22.0 20.9 344 166 B S T 3 S- 0 0 115 -3,-0.1 2,-0.3 1,-0.0 -3,-0.0 0.652 128.6 -85.3 -73.7 -14.4 97.3 24.5 19.1 345 167 B G E < S-P 342 0B 21 -3,-1.7 -3,-2.6 -5,-0.1 2,-0.3 -0.820 72.8 -27.8 150.8-117.2 95.0 24.9 22.0 346 168 B H E -P 341 0B 43 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.991 42.1-169.5-141.6 140.6 92.0 22.8 23.0 347 169 B X E -P 340 0B 89 -7,-2.2 -7,-3.0 -2,-0.3 2,-0.6 -0.835 25.0-122.2-116.5 167.2 89.6 20.6 21.2 348 170 B F E -P 339 0B 73 -2,-0.3 2,-0.6 -9,-0.3 -9,-0.2 -0.909 17.2-150.9-113.2 119.4 86.4 19.0 22.5 349 171 B L E -P 338 0B 67 -11,-2.6 -11,-1.8 -2,-0.6 2,-0.1 -0.792 20.1-130.3 -88.8 120.5 86.1 15.3 22.3 350 172 B A E -P 337 0B 67 -2,-0.6 2,-0.3 -13,-0.2 -13,-0.2 -0.342 16.2-160.9 -68.4 138.0 82.5 14.2 22.0 351 173 B K - 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