==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GLYCOSYLTRANSFERASE 07-OCT-96 1TCM . COMPND 2 MOLECULE: CYCLODEXTRIN GLYCOSYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CIRCULANS; . AUTHOR R.M.A.KNEGTEL,B.W.DIJKSTRA . 1372 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45558.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 859 62.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 88 6.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 236 17.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 16 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 122 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 141 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 192 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 0.9 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 5 1 0 0 0 5 1 4 3 1 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 7 6 3 6 0 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 PARALLEL BRIDGES PER LADDER . 17 4 13 7 2 6 0 4 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 . 8 6 6 1 3 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 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 A 0 0 55 0, 0.0 544,-0.1 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 168.7 36.6 40.2 24.8 2 2 A P > - 0 0 55 0, 0.0 3,-2.3 0, 0.0 6,-0.2 -0.227 360.0-112.4 -64.0 153.0 38.0 38.6 27.9 3 3 A D T 3 S+ 0 0 0 1,-0.3 11,-0.2 516,-0.2 8,-0.1 0.698 119.1 63.8 -58.5 -18.3 35.9 36.1 29.8 4 4 A T T 3 S+ 0 0 45 395,-0.1 -1,-0.3 3,-0.0 2,-0.2 0.228 83.0 117.0 -89.3 10.9 35.9 38.8 32.5 5 5 A S S X S- 0 0 26 -3,-2.3 3,-1.7 1,-0.1 124,-0.0 -0.553 74.2-127.9 -87.2 149.6 34.0 41.2 30.3 6 6 A V T 3 S+ 0 0 28 1,-0.3 -1,-0.1 -2,-0.2 -3,-0.0 0.733 107.0 71.7 -59.2 -24.7 30.5 42.6 30.8 7 7 A S T 3 S+ 0 0 58 -5,-0.1 2,-1.3 1,-0.1 -1,-0.3 0.733 71.1 98.6 -65.5 -25.3 29.8 41.3 27.3 8 8 A N < + 0 0 0 -3,-1.7 3,-0.4 -6,-0.2 -1,-0.1 -0.497 39.9 167.6 -72.2 92.3 29.8 37.7 28.5 9 9 A K S S+ 0 0 63 -2,-1.3 244,-2.4 1,-0.2 -1,-0.2 0.742 73.4 58.9 -74.5 -23.3 26.2 36.8 28.9 10 10 A Q S S+ 0 0 27 242,-0.2 2,-0.4 495,-0.2 -1,-0.2 0.672 100.6 57.5 -81.2 -19.3 27.0 33.0 29.2 11 11 A N + 0 0 1 -3,-0.4 -1,-0.1 1,-0.1 308,-0.1 -0.949 41.2 155.7-122.1 133.2 29.3 33.2 32.2 12 12 A F > + 0 0 0 -2,-0.4 3,-2.0 393,-0.1 -1,-0.1 0.374 50.4 99.9-129.2 -4.5 28.6 34.6 35.7 13 13 A S T 3 S+ 0 0 0 1,-0.3 306,-0.0 305,-0.1 393,-0.0 0.834 84.9 51.4 -54.1 -36.4 31.1 32.7 37.9 14 14 A T T 3 S+ 0 0 1 -11,-0.2 -1,-0.3 341,-0.1 384,-0.2 0.476 102.7 80.9 -81.5 -2.3 33.4 35.7 37.9 15 15 A D < - 0 0 2 -3,-2.0 2,-0.4 383,-0.1 -3,-0.1 -0.424 69.2-139.6 -99.0 175.9 30.6 38.0 39.0 16 16 A V - 0 0 2 -2,-0.1 56,-1.5 339,-0.1 57,-1.4 -0.945 25.1-146.8-135.4 105.2 28.9 38.9 42.3 17 17 A I E -ab 73 357A 0 339,-2.6 341,-0.6 -2,-0.4 2,-0.5 -0.533 4.5-153.8 -80.2 147.1 25.2 39.3 41.9 18 18 A Y E -ab 74 358A 0 55,-2.2 57,-0.9 339,-0.2 2,-0.5 -0.918 12.3-145.6-122.4 100.1 23.1 41.7 43.9 19 19 A Q E -ab 75 359A 6 339,-1.4 341,-2.7 -2,-0.5 2,-0.5 -0.546 20.7-171.7 -70.2 115.8 19.5 40.6 44.3 20 20 A I - 0 0 2 55,-2.0 2,-1.3 -2,-0.5 57,-0.4 -0.937 25.0-148.8-115.8 123.3 17.3 43.7 44.4 21 21 A F > - 0 0 2 -2,-0.5 3,-2.8 1,-0.2 55,-0.1 -0.757 25.7-147.0 -87.0 96.8 13.6 43.8 45.2 22 22 A T G >> S+ 0 0 0 -2,-1.3 3,-1.2 1,-0.3 4,-0.6 0.766 91.0 51.3 -31.3 -52.5 12.9 46.8 42.9 23 23 A D G 34 S+ 0 0 2 74,-0.5 29,-1.5 1,-0.2 -1,-0.3 0.692 111.4 48.7 -67.6 -19.1 10.1 48.3 45.0 24 24 A R G <4 S+ 0 0 0 -3,-2.8 354,-1.6 27,-0.1 -1,-0.2 -0.042 103.4 61.9-112.7 34.1 12.2 48.2 48.2 25 25 A F T <4 S- 0 0 9 -3,-1.2 2,-0.4 352,-0.2 -2,-0.1 0.671 105.7 -16.6-116.0 -81.3 15.4 49.8 47.0 26 26 A S < - 0 0 22 -4,-0.6 27,-1.9 27,-0.3 2,-1.0 -0.989 42.3-148.5-142.6 130.5 15.4 53.4 45.6 27 27 A D + 0 0 61 -2,-0.4 25,-0.2 25,-0.2 27,-0.1 -0.794 29.0 161.8 -96.1 91.1 12.5 55.7 44.5 28 28 A G + 0 0 26 -2,-1.0 -1,-0.2 1,-0.2 24,-0.1 0.614 67.8 37.4 -87.3 -13.9 14.2 57.8 41.8 29 29 A N > - 0 0 46 22,-0.3 3,-0.7 1,-0.1 -1,-0.2 -0.849 57.2-170.2-144.2 103.1 11.0 59.1 40.1 30 30 A P G > S+ 0 0 94 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.690 78.5 80.7 -63.8 -20.4 7.9 59.9 42.2 31 31 A A G 3 S+ 0 0 84 1,-0.3 80,-0.0 80,-0.0 -2,-0.0 0.918 89.9 48.4 -52.2 -52.6 5.9 60.2 39.0 32 32 A N G < S+ 0 0 30 -3,-0.7 -1,-0.3 79,-0.1 81,-0.1 0.315 82.1 131.5 -75.6 8.6 5.3 56.5 38.6 33 33 A N < - 0 0 33 -3,-1.6 6,-0.1 -4,-0.1 78,-0.0 -0.443 61.8-119.5 -65.9 130.5 4.2 56.0 42.2 34 34 A P - 0 0 29 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.311 34.2-140.3 -64.6 153.0 1.0 54.1 42.6 35 35 A T > + 0 0 125 3,-0.1 3,-1.3 4,-0.0 4,-0.2 -0.456 49.1 10.4-109.8-176.0 -1.7 56.0 44.3 36 36 A G G > S- 0 0 60 1,-0.2 3,-1.8 2,-0.2 0, 0.0 -0.038 121.5 -7.4 50.7-145.0 -4.5 55.5 46.9 37 37 A A G 3 S+ 0 0 68 1,-0.3 -1,-0.2 11,-0.1 3,-0.0 0.229 128.0 65.1 -68.7 14.0 -4.7 52.3 48.9 38 38 A A G < S+ 0 0 14 -3,-1.3 11,-1.4 10,-0.1 2,-0.3 0.500 93.0 71.3-111.9 -8.0 -1.9 50.6 47.0 39 39 A F B < -g 49 0B 53 -3,-1.8 2,-0.2 9,-0.2 11,-0.2 -0.854 47.2-179.8-116.4 147.7 0.8 53.0 48.1 40 40 A D > - 0 0 25 9,-2.7 3,-1.9 -2,-0.3 5,-0.1 -0.750 8.9-166.9-144.9 88.1 2.7 53.6 51.4 41 41 A G T 3 S+ 0 0 38 1,-0.3 -1,-0.1 -2,-0.2 9,-0.0 0.824 89.9 50.6 -42.1 -48.7 5.3 56.4 51.1 42 42 A T T 3 S- 0 0 99 1,-0.1 -1,-0.3 0, 0.0 8,-0.1 0.690 99.2-135.9 -66.8 -22.3 6.9 55.5 54.4 43 43 A a < + 0 0 8 -3,-1.9 334,-0.3 6,-0.2 -2,-0.1 0.846 64.6 133.5 65.8 29.7 7.1 51.8 53.4 44 44 A T + 0 0 113 1,-0.2 2,-0.9 332,-0.1 -1,-0.1 0.783 59.2 61.6 -80.3 -31.7 5.9 51.1 56.9 45 45 A N S > S- 0 0 66 -5,-0.1 3,-1.9 1,-0.1 2,-0.8 -0.859 77.7-157.8 -98.3 98.4 3.4 48.6 55.7 46 46 A L T 3 S+ 0 0 26 -2,-0.9 328,-0.1 1,-0.3 -1,-0.1 0.112 85.0 58.7 -66.9 25.7 5.6 46.0 54.1 47 47 A R T 3 S+ 0 0 90 -2,-0.8 48,-0.4 47,-0.1 -1,-0.3 0.365 93.2 70.3-134.3 2.2 2.7 44.8 51.9 48 48 A L S < S- 0 0 19 -3,-1.9 2,-0.6 46,-0.1 -9,-0.2 -0.061 98.3 -71.1 -99.7-156.7 1.8 47.9 50.0 49 49 A Y B -g 39 0B 18 -11,-1.4 -9,-2.7 1,-0.1 -6,-0.2 -0.924 39.2-175.2-107.2 120.7 3.7 49.8 47.2 50 50 A a - 0 0 1 -2,-0.6 -1,-0.1 -11,-0.2 -23,-0.1 0.729 43.9-110.2 -87.5 -24.8 6.8 51.6 48.4 51 51 A G + 0 0 2 1,-0.3 -22,-0.3 -19,-0.1 -23,-0.2 0.355 56.7 156.8 112.6 -6.4 7.8 53.4 45.2 52 52 A G + 0 0 2 -29,-1.5 -1,-0.3 -25,-0.2 2,-0.3 -0.252 18.7 167.7 -54.7 133.9 11.0 51.5 44.2 53 53 A D > - 0 0 0 -27,-1.9 4,-1.5 -31,-0.1 -27,-0.3 -0.889 51.4 -98.8-144.7 170.6 11.6 51.9 40.5 54 54 A W H > S+ 0 0 0 58,-2.8 4,-1.9 -2,-0.3 5,-0.2 0.892 117.0 61.5 -58.5 -41.4 14.2 51.4 37.8 55 55 A Q H > S+ 0 0 54 57,-0.5 4,-2.5 1,-0.2 3,-0.5 0.930 101.9 49.1 -50.1 -56.1 15.2 55.0 37.9 56 56 A G H > S+ 0 0 0 -30,-0.5 4,-1.6 1,-0.3 -1,-0.2 0.903 108.3 56.1 -52.2 -42.9 16.3 54.9 41.5 57 57 A I H X S+ 0 0 0 -4,-1.5 4,-1.0 -31,-0.4 -1,-0.3 0.872 107.0 47.8 -58.2 -40.5 18.4 51.8 40.7 58 58 A I H >X S+ 0 0 14 -4,-1.9 4,-2.2 -3,-0.5 3,-0.7 0.917 107.3 58.6 -65.3 -42.1 20.2 53.8 38.0 59 59 A N H 3X S+ 0 0 77 -4,-2.5 4,-0.6 1,-0.3 -2,-0.2 0.823 106.1 47.0 -55.7 -36.0 20.7 56.5 40.5 60 60 A K H 3< S+ 0 0 27 -4,-1.6 6,-1.5 2,-0.2 5,-0.4 0.702 110.2 55.8 -79.5 -21.7 22.5 54.1 42.8 61 61 A I H X< S+ 0 0 0 -4,-1.0 3,-1.3 -3,-0.7 6,-0.5 0.976 112.2 37.0 -72.2 -60.9 24.6 52.9 39.9 62 62 A N H 3< S+ 0 0 101 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.588 110.3 65.5 -69.1 -13.3 26.1 56.2 38.8 63 63 A D T 3< S- 0 0 95 -4,-0.6 -1,-0.2 -5,-0.3 -2,-0.2 0.576 109.3-118.1 -87.9 -9.4 26.3 57.4 42.4 64 64 A G S <> S+ 0 0 26 -3,-1.3 4,-2.7 -4,-0.3 5,-0.3 0.155 83.7 110.6 98.0 -20.2 28.9 54.7 43.3 65 65 A Y H > S+ 0 0 7 -5,-0.4 4,-1.3 2,-0.2 -4,-0.2 0.929 88.2 35.4 -52.3 -51.1 27.1 52.8 46.0 66 66 A L H 4>S+ 0 0 0 -6,-1.5 5,-1.5 2,-0.2 4,-0.5 0.953 122.3 42.2 -68.4 -56.5 26.7 49.7 43.8 67 67 A T H >45S+ 0 0 40 -6,-0.5 3,-1.7 -7,-0.3 -2,-0.2 0.892 110.1 59.1 -59.7 -42.0 30.0 49.8 41.9 68 68 A G H 3<5S+ 0 0 34 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.914 99.1 57.9 -53.3 -45.6 31.9 50.7 45.1 69 69 A M T 3<5S- 0 0 0 -4,-1.3 -1,-0.3 -5,-0.3 326,-0.2 0.682 117.0-117.6 -58.6 -20.0 30.7 47.5 46.7 70 70 A G T < 5 + 0 0 15 -3,-1.7 2,-0.3 -4,-0.5 -3,-0.2 0.774 58.9 158.4 83.3 27.8 32.4 45.7 43.8 71 71 A V < - 0 0 5 -5,-1.5 -1,-0.3 1,-0.1 -54,-0.1 -0.678 21.1-176.4 -84.1 135.3 29.1 44.2 42.7 72 72 A T + 0 0 22 -56,-1.5 59,-2.9 -2,-0.3 2,-0.3 0.495 60.5 33.7-114.1 -5.3 29.1 43.2 39.0 73 73 A A E -ac 17 131A 0 -57,-1.4 -55,-2.2 57,-0.3 2,-0.5 -0.996 58.4-152.4-151.9 146.1 25.5 42.0 38.3 74 74 A I E -ac 18 132A 0 57,-3.2 59,-3.0 -2,-0.3 2,-0.7 -0.976 0.8-162.8-126.1 123.5 22.0 42.9 39.3 75 75 A W E -ac 19 133A 4 -57,-0.9 -55,-2.0 -2,-0.5 59,-0.2 -0.897 25.7-172.5-104.0 105.4 19.0 40.6 39.4 76 76 A I E - c 0 134A 1 57,-1.9 59,-1.2 -2,-0.7 -55,-0.1 -0.339 28.6 -77.5 -95.9 176.7 15.8 42.7 39.5 77 77 A S S S- 0 0 0 -57,-0.4 -1,-0.2 1,-0.2 22,-0.1 -0.362 71.1 -69.6 -69.8 151.5 12.1 42.1 40.0 78 78 A Q - 0 0 1 20,-0.3 -1,-0.2 1,-0.2 58,-0.1 -0.157 42.4-150.3 -45.7 120.5 10.1 40.9 37.0 79 79 A P + 0 0 1 0, 0.0 30,-1.7 0, 0.0 -1,-0.2 0.813 62.2 103.9 -66.3 -33.8 10.0 43.7 34.5 80 80 A V E S-H 108 0C 0 28,-0.2 2,-0.3 1,-0.1 28,-0.3 0.011 84.1 -85.9 -54.2 155.7 6.6 42.7 33.1 81 81 A E E -H 104 0C 13 26,-2.3 22,-2.4 23,-1.3 23,-1.8 -0.466 46.7-159.3 -68.7 120.2 3.2 44.3 33.8 82 82 A N E -H 102 0C 1 -2,-0.3 20,-0.2 20,-0.2 60,-0.1 -0.430 28.7 -79.4 -96.0 171.7 1.5 43.1 37.0 83 83 A I - 0 0 6 18,-2.0 13,-0.4 58,-0.1 -1,-0.1 -0.365 28.1-150.9 -69.8 149.0 -2.1 43.2 38.1 84 84 A Y + 0 0 118 11,-0.1 -1,-0.1 -2,-0.1 12,-0.0 0.688 57.2 115.3 -93.3 -23.0 -3.4 46.5 39.5 85 85 A S - 0 0 25 1,-0.1 2,-0.9 10,-0.1 11,-0.2 -0.066 65.0-133.2 -50.7 146.1 -6.0 45.0 41.9 86 86 A I - 0 0 56 66,-0.1 9,-0.2 9,-0.1 -1,-0.1 -0.767 28.7-158.5-104.7 82.6 -5.6 45.5 45.6 87 87 A I - 0 0 6 -2,-0.9 7,-3.0 7,-0.3 2,-0.4 -0.228 2.0-147.4 -59.8 150.7 -6.3 42.0 46.8 88 88 A N E -I 93 0D 74 5,-0.2 2,-0.7 2,-0.0 5,-0.3 -0.988 6.6-162.2-126.2 123.1 -7.4 41.5 50.4 89 89 A Y E > S-I 92 0D 73 3,-3.3 3,-1.7 -2,-0.4 -2,-0.0 -0.878 72.6 -42.1-111.4 105.3 -6.4 38.4 52.4 90 90 A S T 3 S- 0 0 138 -2,-0.7 -1,-0.1 1,-0.3 3,-0.1 0.779 128.6 -36.2 50.2 29.2 -8.5 37.8 55.5 91 91 A G T 3 S+ 0 0 49 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 -0.296 115.9 103.6 123.6 -50.8 -8.2 41.5 56.2 92 92 A V E < -I 89 0D 65 -3,-1.7 -3,-3.3 -4,-0.1 2,-0.5 -0.468 64.9-133.4 -71.0 137.0 -4.7 42.5 55.0 93 93 A N E -I 88 0D 66 -5,-0.3 -5,-0.2 -2,-0.2 2,-0.2 -0.776 28.5-173.9 -91.9 129.7 -4.4 44.4 51.7 94 94 A N - 0 0 21 -7,-3.0 -7,-0.3 -2,-0.5 2,-0.3 -0.721 6.5-164.2-119.3 170.7 -1.7 43.1 49.4 95 95 A T > - 0 0 3 -48,-0.4 3,-0.5 -2,-0.2 -9,-0.1 -0.913 37.6-106.2-146.9 172.9 -0.2 44.1 46.0 96 96 A A G > S+ 0 0 1 -13,-0.4 3,-1.2 -2,-0.3 -14,-0.1 0.015 75.9 122.7 -90.9 27.0 1.9 42.9 43.1 97 97 A Y G 3 + 0 0 4 1,-0.3 -74,-0.5 -50,-0.2 -1,-0.2 0.735 69.9 61.1 -57.3 -25.4 4.8 45.1 44.4 98 98 A H G < S- 0 0 19 -3,-0.5 -20,-0.3 -51,-0.1 -1,-0.3 0.804 107.7-129.4 -72.9 -31.9 6.7 41.8 44.4 99 99 A G S < S+ 0 0 0 -3,-1.2 38,-0.2 -22,-0.1 -2,-0.1 0.618 78.2 102.9 92.8 16.9 6.3 41.4 40.7 100 100 A Y + 0 0 28 1,-0.1 2,-1.7 36,-0.1 40,-0.2 0.707 56.2 82.5-101.1 -24.8 4.9 37.8 40.4 101 101 A W S S- 0 0 28 -18,-0.1 -18,-2.0 -6,-0.1 41,-0.3 -0.623 70.9-175.1 -83.0 84.7 1.3 38.5 39.8 102 102 A A E +H 82 0C 0 -2,-1.7 -20,-0.2 39,-1.6 3,-0.1 -0.562 30.0 169.5 -87.6 147.6 1.6 39.0 36.0 103 103 A R E S+ 0 0 42 -22,-2.4 55,-3.6 -2,-0.2 2,-0.3 0.572 79.3 21.1-121.5 -29.1 -1.2 40.1 33.6 104 104 A D E > -H 81 0C 0 -23,-1.8 3,-1.4 53,-0.2 -23,-1.3 -0.795 51.3-171.7-151.4 103.2 0.9 40.8 30.6 105 105 A F E 3 S+ 0 0 0 53,-0.4 54,-0.1 -2,-0.3 -25,-0.1 0.534 88.7 62.4 -69.1 -7.2 4.4 39.5 29.9 106 106 A K E 3 S+ 0 0 44 52,-0.1 2,-0.3 -25,-0.1 -1,-0.2 0.521 100.0 56.3 -96.9 -8.3 4.7 41.8 26.9 107 107 A K E < S- 0 0 66 -3,-1.4 -26,-2.3 -26,-0.1 -3,-0.1 -0.832 80.0-118.2-121.6 160.6 4.4 45.1 28.7 108 108 A T E -H 80 0C 17 -28,-0.3 -28,-0.2 -2,-0.3 -27,-0.2 -0.413 34.3 -97.4 -91.2 170.8 6.4 46.6 31.6 109 109 A N > - 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0 0 7 -341,-3.3 -339,-0.3 -2,-0.5 2,-0.2 -0.826 14.0-135.7 -99.4 111.1 61.7 -6.0 8.1 1046 359 B Y > - 0 0 2 -2,-0.7 3,-1.9 -34,-0.4 4,-0.2 -0.418 37.0 -97.7 -64.1 128.4 61.2 -9.1 5.7 1047 360 B Y T 3 S+ 0 0 0 -341,-2.8 -1,-0.1 1,-0.2 -342,-0.0 -0.150 108.7 31.4 -48.1 129.6 64.4 -11.2 5.5 1048 361 B G T > >S+ 0 0 0 -3,-0.1 5,-1.7 19,-0.1 3,-1.6 0.161 81.3 108.8 107.5 -20.1 66.5 -10.4 2.5 1049 362 B T G X 5S+ 0 0 4 -3,-1.9 3,-1.1 1,-0.3 -2,-0.1 0.809 79.0 54.9 -58.5 -32.3 65.6 -6.7 2.2 1050 363 B E G 3 5S+ 0 0 0 1,-0.2 25,-0.4 -4,-0.2 -1,-0.3 0.595 106.0 53.1 -77.0 -11.5 69.1 -5.8 3.3 1051 364 B Q G < 5S- 0 0 19 -3,-1.6 -1,-0.2 23,-0.1 -2,-0.2 0.176 116.3-115.5-105.9 11.8 70.4 -8.0 0.5 1052 365 B Y T < 5 - 0 0 14 -3,-1.1 -3,-0.2 1,-0.2 -2,-0.1 0.907 48.0-170.9 52.9 47.1 68.3 -6.1 -2.1 1053 366 B M < - 0 0 13 -5,-1.7 -33,-0.7 10,-0.0 2,-0.2 -0.385 7.2-170.9 -71.5 146.8 66.3 -9.3 -2.8 1054 367 B S + 0 0 48 -35,-0.1 9,-0.2 -2,-0.1 2,-0.2 -0.708 23.0 114.7-128.1 178.3 63.9 -9.4 -5.7 1055 368 B G - 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