==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-AUG-08 2W05 . COMPND 2 MOLECULE: CELL DIVISION PROTEIN KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.ANDERSON,D.M.ANDREWS,A.J.BARKER,C.A.BRASSINGTON,J.BREED, . 276 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13903.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 173 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 14.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 17 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 71 25.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 3 0 1 1 0 0 1 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 1 0 0 3 1 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 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 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 43 0, 0.0 3,-2.3 0, 0.0 61,-0.0 0.000 360.0 360.0 360.0 -17.9 -13.0 30.5 -3.5 2 2 A E T 3 + 0 0 162 1,-0.3 22,-0.0 3,-0.0 0, 0.0 0.649 360.0 63.5 -63.4 -11.6 -13.2 30.8 -7.3 3 3 A N T 3 S+ 0 0 82 21,-0.1 21,-1.8 20,-0.1 22,-0.6 0.456 97.2 71.3 -91.4 -1.1 -10.5 33.5 -6.9 4 4 A F E < -A 23 0A 23 -3,-2.3 2,-0.5 19,-0.3 19,-0.2 -0.844 59.3-156.1-121.1 156.2 -8.0 31.0 -5.6 5 5 A Q E -A 22 0A 88 17,-2.1 17,-2.5 -2,-0.3 2,-0.3 -0.979 25.6-129.3-127.5 115.4 -5.8 28.2 -6.8 6 6 A K E -A 21 0A 110 -2,-0.5 15,-0.3 15,-0.2 3,-0.1 -0.493 25.2-179.7 -66.9 124.6 -4.6 25.6 -4.3 7 7 A V E - 0 0 66 13,-3.6 2,-0.3 1,-0.4 14,-0.2 0.838 62.0 -32.3 -91.9 -42.6 -0.9 25.1 -4.6 8 8 A E E -A 20 0A 117 12,-1.7 12,-3.7 0, 0.0 2,-0.9 -0.957 64.5 -90.3-172.4 159.2 -0.4 22.5 -1.9 9 9 A K E -A 19 0A 117 -2,-0.3 10,-0.3 10,-0.3 3,-0.1 -0.718 39.3-178.6 -84.1 108.0 -1.6 21.4 1.4 10 10 A I E - 0 0 77 8,-1.2 2,-0.2 -2,-0.9 9,-0.2 0.996 57.0 -21.1 -66.8 -79.0 0.4 23.2 4.1 11 11 A G E -A 18 0A 30 7,-0.6 7,-1.8 2,-0.0 2,-0.2 -0.573 59.2-160.9-124.3-170.8 -0.9 21.9 7.4 12 12 A E + 0 0 143 5,-0.2 5,-0.2 -2,-0.2 3,-0.2 -0.804 35.1 65.4-155.5-169.7 -3.9 20.2 8.9 13 13 A G S > S+ 0 0 44 -2,-0.2 3,-1.2 1,-0.2 2,-0.5 0.352 75.0 35.3 67.5 163.6 -5.9 19.5 12.0 14 14 A T T 3 S+ 0 0 93 1,-0.3 -1,-0.2 21,-0.0 22,-0.1 -0.442 123.3 18.9 65.3-111.5 -7.8 21.4 14.6 15 15 A Y T 3 S- 0 0 35 -2,-0.5 21,-1.4 -3,-0.2 2,-0.3 0.591 127.2 -77.8 -68.3 -12.2 -9.7 24.4 13.1 16 16 A G E < - B 0 35A 16 -3,-1.2 2,-0.4 19,-0.2 19,-0.2 -0.988 63.6 -40.5 150.3-159.3 -9.4 22.8 9.7 17 17 A V E - B 0 34A 23 17,-1.4 17,-3.0 -2,-0.3 2,-0.5 -0.871 44.7-148.8-109.5 142.2 -7.0 22.3 6.8 18 18 A V E -AB 11 33A 33 -7,-1.8 -8,-1.2 -2,-0.4 -7,-0.6 -0.928 14.3-175.0-114.5 131.1 -4.5 24.8 5.5 19 19 A Y E -AB 9 32A 56 13,-3.3 13,-3.6 -2,-0.5 2,-0.5 -0.907 27.8-126.2-122.9 150.1 -3.4 25.2 1.9 20 20 A K E +AB 8 31A 47 -12,-3.7 -13,-3.6 -2,-0.3 -12,-1.7 -0.801 47.0 170.9 -87.3 135.9 -0.8 27.3 0.1 21 21 A A E -AB 6 30A 0 9,-2.5 9,-3.1 -2,-0.5 2,-0.4 -0.977 30.4-133.6-147.8 160.7 -2.7 29.0 -2.7 22 22 A R E -AB 5 29A 105 -17,-2.5 -17,-2.1 -2,-0.3 2,-0.9 -0.929 27.9-115.4-118.7 139.7 -2.4 31.7 -5.3 23 23 A N E > -A 4 0A 24 5,-2.7 4,-3.2 -2,-0.4 -19,-0.3 -0.625 22.8-143.9 -74.2 107.9 -5.0 34.4 -6.1 24 24 A K T 4 S+ 0 0 135 -21,-1.8 -1,-0.2 -2,-0.9 -20,-0.1 0.668 96.4 38.9 -45.4 -21.8 -6.0 33.5 -9.7 25 25 A L T 4 S+ 0 0 146 -22,-0.6 -1,-0.2 3,-0.1 -21,-0.1 0.906 129.3 21.9 -94.9 -61.9 -6.3 37.3 -10.4 26 26 A T T 4 S- 0 0 90 2,-0.1 -2,-0.2 1,-0.0 3,-0.1 0.741 90.3-130.8 -81.1 -25.2 -3.4 39.0 -8.6 27 27 A G < + 0 0 23 -4,-3.2 -3,-0.1 1,-0.3 2,-0.1 0.536 51.8 157.2 84.4 4.0 -1.1 36.0 -8.3 28 28 A E - 0 0 101 -5,-0.2 -5,-2.7 -6,-0.1 2,-0.4 -0.423 39.5-131.3 -64.4 133.7 -0.7 36.9 -4.7 29 29 A V E +B 22 0A 50 -7,-0.2 45,-0.6 -2,-0.1 2,-0.3 -0.760 37.1 162.6 -92.6 133.9 0.4 33.9 -2.6 30 30 A V E -BC 21 73A 0 -9,-3.1 -9,-2.5 -2,-0.4 2,-0.6 -0.851 42.6-106.5-140.9 175.0 -1.6 33.2 0.6 31 31 A A E -BC 20 72A 12 41,-2.3 41,-3.1 -2,-0.3 2,-0.6 -0.950 34.4-157.7-107.2 123.8 -2.4 30.7 3.2 32 32 A L E -BC 19 71A 2 -13,-3.6 -13,-3.3 -2,-0.6 2,-0.5 -0.921 6.0-166.0-108.7 121.3 -5.9 29.4 2.8 33 33 A K E -BC 18 70A 17 37,-2.9 37,-2.6 -2,-0.6 2,-0.8 -0.920 8.7-156.4-112.6 122.6 -7.6 27.9 5.8 34 34 A K E -BC 17 69A 66 -17,-3.0 -17,-1.4 -2,-0.5 35,-0.2 -0.841 17.9-148.7 -99.1 105.3 -10.8 25.8 5.5 35 35 A I E BC 16 68A 41 33,-2.5 33,-0.5 -2,-0.8 -19,-0.2 -0.401 360.0 360.0 -72.0 147.2 -12.6 25.9 8.9 36 36 A R 0 0 125 -21,-1.4 -1,-0.1 -22,-0.1 -20,-0.1 0.955 360.0 360.0 -81.3 360.0 -14.7 22.9 10.0 37 ! 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 38 46 A S > 0 0 109 0, 0.0 4,-1.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 177.9 -23.1 33.6 14.0 39 47 A T H > + 0 0 113 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.871 360.0 56.1 -53.1 -42.8 -21.0 34.3 17.0 40 48 A A H > S+ 0 0 48 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.938 102.6 56.7 -56.4 -48.9 -17.9 33.0 15.3 41 49 A I H > S+ 0 0 42 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.902 109.6 42.6 -50.0 -51.4 -18.3 35.4 12.4 42 50 A R H X S+ 0 0 166 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.888 116.0 50.1 -66.4 -36.5 -18.3 38.5 14.5 43 51 A E H < S+ 0 0 70 -4,-2.1 4,-0.5 -5,-0.2 -2,-0.2 0.912 111.9 46.4 -67.5 -43.7 -15.4 37.2 16.6 44 52 A I H >X S+ 0 0 21 -4,-3.4 4,-0.9 1,-0.2 3,-0.8 0.873 110.5 54.4 -66.2 -37.5 -13.3 36.3 13.5 45 53 A S H >< S+ 0 0 48 -4,-2.2 3,-0.8 -5,-0.3 4,-0.3 0.887 100.4 58.2 -64.6 -39.1 -14.1 39.7 12.0 46 54 A L G >< S+ 0 0 115 -4,-1.8 3,-0.5 1,-0.3 4,-0.3 0.702 100.7 61.6 -63.8 -16.8 -12.8 41.5 15.1 47 55 A L G X4 S+ 0 0 20 -3,-0.8 3,-1.5 -4,-0.5 -1,-0.3 0.842 86.9 68.4 -77.4 -34.6 -9.6 39.7 14.3 48 56 A K G << S+ 0 0 71 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.608 102.2 49.7 -60.1 -10.1 -9.1 41.3 10.9 49 57 A E G < S+ 0 0 77 -3,-0.5 2,-2.2 -4,-0.3 -1,-0.3 0.591 84.7 90.4-101.6 -17.8 -8.5 44.5 12.9 50 58 A L < + 0 0 11 -3,-1.5 2,-0.4 -4,-0.3 -1,-0.1 -0.492 62.5 165.7 -80.1 69.9 -6.0 43.0 15.3 51 59 A N + 0 0 69 -2,-2.2 5,-0.1 6,-0.1 -3,-0.0 -0.776 5.0 146.5 -96.8 132.0 -3.0 43.9 13.0 52 60 A H > - 0 0 45 3,-0.5 3,-2.2 -2,-0.4 54,-0.0 -0.973 56.3-113.3-158.3 147.3 0.6 43.8 14.2 53 61 A P T 3 S+ 0 0 92 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.804 119.2 48.0 -54.6 -29.2 3.9 42.9 12.6 54 62 A N T 3 S+ 0 0 8 80,-0.1 81,-2.7 48,-0.1 2,-0.5 0.130 97.4 80.9-101.0 21.5 4.2 39.8 14.8 55 63 A I B < S-e 135 0B 7 -3,-2.2 -3,-0.5 79,-0.3 81,-0.2 -0.990 92.0-112.5-124.9 119.1 0.6 38.6 14.1 56 64 A V - 0 0 9 79,-2.9 2,-0.1 -2,-0.5 81,-0.1 -0.320 45.2-113.5 -52.7 119.2 0.1 36.6 10.9 57 65 A K - 0 0 88 -4,-0.1 16,-2.4 1,-0.1 2,-0.9 -0.366 17.6-141.5 -64.0 129.4 -2.1 39.1 9.0 58 66 A L E -D 72 0A 12 -11,-0.2 14,-0.2 14,-0.2 3,-0.1 -0.812 21.6-178.6 -91.4 103.0 -5.7 37.9 8.3 59 67 A L E - 0 0 42 12,-1.7 2,-0.3 -2,-0.9 13,-0.2 0.964 57.9 -7.0 -69.5 -54.8 -6.3 39.2 4.8 60 68 A D E -D 71 0A 89 11,-1.5 11,-2.8 2,-0.0 2,-0.5 -0.963 48.6-142.8-145.2 161.2 -9.9 38.1 4.3 61 69 A V E -D 70 0A 27 -2,-0.3 2,-0.6 9,-0.2 9,-0.2 -0.975 21.0-167.4-125.4 111.4 -12.8 36.1 5.7 62 70 A I E -D 69 0A 39 7,-3.3 7,-3.1 -2,-0.5 2,-0.6 -0.890 5.6-176.8-108.6 112.1 -14.9 34.3 3.2 63 71 A H E +D 68 0A 105 -2,-0.6 2,-0.3 5,-0.2 5,-0.2 -0.922 20.8 147.1-108.7 114.5 -18.2 32.8 4.3 64 72 A T E > -D 67 0A 50 3,-2.7 3,-1.9 -2,-0.6 -2,-0.0 -0.989 60.6 -0.0-151.2 139.4 -20.0 30.8 1.7 65 73 A E T 3 S- 0 0 143 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.884 127.2 -57.6 51.6 44.7 -22.3 27.8 1.5 66 74 A N T 3 S+ 0 0 97 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.680 116.5 120.6 62.0 17.2 -22.1 27.4 5.3 67 75 A K E < - D 0 64A 75 -3,-1.9 -3,-2.7 2,-0.0 2,-0.5 -0.914 53.7-148.7-114.9 139.4 -18.3 27.1 4.8 68 76 A L E -CD 35 63A 22 -33,-0.5 -33,-2.5 -2,-0.4 2,-0.5 -0.933 13.4-175.2-113.8 123.2 -15.8 29.4 6.4 69 77 A Y E -CD 34 62A 23 -7,-3.1 -7,-3.3 -2,-0.5 2,-0.5 -0.961 8.2-159.1-118.2 129.3 -12.5 30.3 4.6 70 78 A L E -CD 33 61A 9 -37,-2.6 -37,-2.9 -2,-0.5 2,-0.6 -0.928 5.0-155.4-110.4 128.8 -9.8 32.4 6.2 71 79 A V E -CD 32 60A 3 -11,-2.8 -12,-1.7 -2,-0.5 -11,-1.5 -0.907 20.6-177.8-104.8 116.8 -7.2 34.0 3.9 72 80 A F E -CD 31 58A 34 -41,-3.1 -41,-2.3 -2,-0.6 -14,-0.2 -0.744 36.3 -95.3-115.4 163.7 -3.9 34.8 5.6 73 81 A E E -C 30 0A 52 -16,-2.4 2,-0.4 -2,-0.3 -43,-0.2 -0.475 53.8-117.1 -65.1 140.6 -0.6 36.4 4.8 74 82 A F - 0 0 38 -45,-0.6 2,-0.3 -2,-0.1 -1,-0.1 -0.748 31.9-176.3 -94.1 130.8 1.8 33.5 3.7 75 83 A L - 0 0 14 -2,-0.4 53,-0.1 1,-0.1 3,-0.1 -0.921 24.8-133.5-118.9 149.4 4.9 32.6 5.7 76 84 A H S S+ 0 0 96 51,-0.4 2,-0.3 -2,-0.3 52,-0.1 0.643 74.8 11.2 -80.2 -15.2 7.3 29.8 4.6 77 85 A Q E -F 127 0B 17 50,-1.0 50,-2.7 199,-0.0 2,-0.2 -0.997 59.9-129.3-162.2 152.6 7.9 27.8 7.7 78 86 A D E > -F 126 0B 45 -2,-0.3 4,-1.5 48,-0.2 48,-0.2 -0.599 33.6-111.3 -99.9 167.1 6.9 27.2 11.3 79 87 A L H > S+ 0 0 0 46,-2.6 4,-2.7 43,-1.2 5,-0.3 0.851 113.4 62.4 -63.8 -37.3 9.1 27.1 14.4 80 88 A K H > S+ 0 0 70 42,-0.9 4,-2.5 45,-0.3 3,-0.3 0.964 107.7 42.2 -52.4 -58.0 8.6 23.4 14.8 81 89 A K H > S+ 0 0 126 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.832 114.4 52.3 -59.3 -35.7 10.2 22.6 11.5 82 90 A F H < S+ 0 0 9 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.845 110.3 47.5 -71.1 -34.5 13.0 25.2 12.1 83 91 A M H >X S+ 0 0 21 -4,-2.7 3,-1.4 -3,-0.3 4,-1.0 0.901 110.5 51.4 -72.0 -42.0 13.8 23.7 15.5 84 92 A D H 3< S+ 0 0 95 -4,-2.5 3,-0.3 1,-0.3 4,-0.2 0.854 110.2 50.5 -61.4 -34.5 13.9 20.2 14.0 85 93 A A T 3< S+ 0 0 82 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.475 114.8 43.9 -82.2 -2.6 16.3 21.6 11.4 86 94 A S T X> S+ 0 0 17 -3,-1.4 4,-4.4 2,-0.1 3,-0.8 0.409 78.8 108.2-118.0 -4.0 18.4 23.1 14.1 87 95 A A T 3< S+ 0 0 50 -4,-1.0 -2,-0.1 -3,-0.3 -3,-0.1 0.801 73.0 59.7 -43.7 -41.4 18.5 20.2 16.5 88 96 A L T 34 S+ 0 0 172 -4,-0.2 -1,-0.2 1,-0.2 -2,-0.1 0.927 130.8 5.2 -58.6 -48.0 22.1 19.3 15.8 89 97 A T T <4 S- 0 0 113 -3,-0.8 -2,-0.2 1,-0.0 -1,-0.2 0.470 102.9-131.1-115.5 -6.7 23.5 22.7 16.9 90 98 A G < - 0 0 7 -4,-4.4 -3,-0.1 -7,-0.2 87,-0.1 0.249 39.0 -58.4 70.8 157.2 20.4 24.4 18.3 91 99 A I - 0 0 13 85,-0.5 5,-0.1 1,-0.1 -8,-0.0 -0.538 64.3-103.9 -72.7 134.0 19.2 27.9 17.5 92 100 A P >> - 0 0 81 0, 0.0 4,-2.0 0, 0.0 3,-1.3 -0.314 26.9-119.6 -59.2 137.9 21.8 30.6 18.4 93 101 A L H 3> S+ 0 0 71 1,-0.3 4,-3.2 2,-0.2 5,-0.3 0.871 111.9 57.2 -46.0 -50.4 21.0 32.6 21.6 94 102 A P H 3> S+ 0 0 65 0, 0.0 4,-1.5 0, 0.0 176,-0.4 0.861 111.2 44.4 -52.3 -36.5 20.7 35.9 19.8 95 103 A L H <> S+ 0 0 7 -3,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.838 111.9 51.3 -77.6 -35.0 18.1 34.4 17.5 96 104 A I H X S+ 0 0 6 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.957 112.7 46.8 -64.5 -48.5 16.2 32.8 20.4 97 105 A K H X S+ 0 0 12 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.840 111.5 51.4 -60.8 -38.2 16.2 36.1 22.3 98 106 A S H X S+ 0 0 3 -4,-1.5 4,-2.4 -5,-0.3 -1,-0.2 0.941 110.9 47.3 -66.4 -47.3 15.0 37.9 19.2 99 107 A Y H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.943 113.5 47.6 -60.2 -46.9 12.1 35.5 18.6 100 108 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.911 111.6 51.1 -59.9 -43.0 11.0 35.7 22.2 101 109 A F H X S+ 0 0 47 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.905 111.8 46.9 -61.8 -43.6 11.2 39.5 22.2 102 110 A Q H X S+ 0 0 11 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.871 111.8 49.7 -67.3 -40.4 9.1 39.7 19.1 103 111 A L H X S+ 0 0 0 -4,-2.4 4,-3.1 2,-0.2 -2,-0.2 0.892 109.3 51.9 -67.2 -38.8 6.5 37.3 20.3 104 112 A L H X S+ 0 0 0 -4,-2.4 4,-3.4 2,-0.2 5,-0.2 0.910 109.1 51.0 -63.2 -39.9 6.2 39.1 23.6 105 113 A Q H X S+ 0 0 76 -4,-1.8 4,-1.5 1,-0.2 -2,-0.2 0.940 111.6 48.1 -60.3 -45.7 5.7 42.3 21.6 106 114 A G H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.900 114.7 45.2 -61.5 -41.0 3.0 40.4 19.7 107 115 A L H X S+ 0 0 0 -4,-3.1 4,-3.0 1,-0.2 5,-0.3 0.913 106.5 57.5 -70.3 -41.3 1.4 39.2 22.9 108 116 A A H X S+ 0 0 26 -4,-3.4 4,-1.5 1,-0.2 -1,-0.2 0.853 109.7 49.3 -56.5 -33.2 1.6 42.6 24.6 109 117 A F H X S+ 0 0 48 -4,-1.5 4,-1.1 -5,-0.2 -1,-0.2 0.919 113.0 41.5 -73.6 -47.9 -0.5 43.9 21.7 110 118 A C H <>S+ 0 0 0 -4,-1.9 5,-3.0 1,-0.2 3,-0.3 0.897 115.4 52.8 -68.3 -38.4 -3.3 41.2 21.6 111 119 A H H ><5S+ 0 0 14 -4,-3.0 3,-2.1 1,-0.2 -1,-0.2 0.882 102.6 56.8 -64.0 -38.3 -3.4 41.3 25.4 112 120 A S H 3<5S+ 0 0 75 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.838 108.3 49.4 -62.4 -30.0 -3.9 45.1 25.4 113 121 A H T 3<5S- 0 0 109 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.151 121.5-110.2 -93.7 19.0 -6.9 44.5 23.2 114 122 A R T < 5S+ 0 0 171 -3,-2.1 2,-0.4 1,-0.2 -3,-0.2 0.780 76.9 132.3 59.3 29.4 -8.2 41.8 25.6 115 123 A V < - 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