==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/CELL CYCLE 02-OCT-12 4BCO . COMPND 2 MOLECULE: CYCLIN-DEPENDENT KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.J.HOLE,S.BAUMLI,S.WANG,J.A.ENDICOTT,M.E.M.NOBLE . 1083 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44199.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 726 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 85 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 2 0.2 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 . 50 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 136 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 418 38.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.4 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 7 2 1 5 0 2 2 0 4 1 3 1 5 6 0 2 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 4 2 1 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 . 2 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 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 0 A S > 0 0 64 0, 0.0 3,-1.0 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 145.2 -16.3 6.5 -31.9 2 1 A M G > + 0 0 36 1,-0.2 3,-1.7 2,-0.2 71,-0.0 0.698 360.0 78.4 -73.8 -17.9 -13.0 8.0 -33.0 3 2 A E G 3 S+ 0 0 115 1,-0.3 -1,-0.2 3,-0.1 22,-0.0 0.752 88.5 57.1 -64.0 -24.2 -13.9 7.7 -36.7 4 3 A N G < S+ 0 0 10 -3,-1.0 21,-3.3 20,-0.1 2,-0.5 0.533 94.5 82.9 -84.8 -3.8 -16.1 10.8 -36.4 5 4 A F E < -A 24 0A 29 -3,-1.7 2,-0.6 19,-0.2 19,-0.2 -0.875 59.0-163.1-106.3 125.8 -13.1 12.9 -35.2 6 5 A Q E -A 23 0A 100 17,-2.8 17,-2.3 -2,-0.5 2,-0.1 -0.934 26.0-131.8 -99.2 118.1 -10.6 14.5 -37.5 7 6 A K E -A 22 0A 84 -2,-0.6 15,-0.3 15,-0.2 3,-0.1 -0.457 22.3-174.4 -71.0 141.6 -7.6 15.5 -35.4 8 7 A V E - 0 0 68 13,-3.3 2,-0.3 1,-0.4 14,-0.2 0.790 57.6 -43.0-103.3 -42.8 -6.3 19.0 -35.9 9 8 A E E -A 21 0A 121 12,-1.5 12,-2.9 0, 0.0 2,-0.6 -0.957 58.3 -83.6-178.8 164.0 -3.1 19.1 -33.8 10 9 A K E -A 20 0A 122 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.739 31.9-173.8 -84.4 122.2 -1.4 18.1 -30.5 11 10 A I E - 0 0 80 8,-2.1 2,-0.3 -2,-0.6 9,-0.2 0.884 46.7 -96.9 -81.7 -44.0 -2.2 20.7 -27.8 12 11 A G E -A 19 0A 24 7,-1.6 7,-3.3 0, 0.0 2,-0.4 -0.988 49.9 -45.2 160.2-156.0 0.1 19.3 -25.1 13 12 A E E -A 18 0A 153 -2,-0.3 5,-0.2 5,-0.2 4,-0.1 -0.908 42.0-150.8-109.2 141.3 -0.0 17.1 -22.0 14 13 A G - 0 0 21 3,-1.5 3,-0.2 -2,-0.4 5,-0.1 -0.057 52.4 -76.0 -83.2-164.0 -2.6 17.3 -19.2 15 14 A T S S+ 0 0 49 1,-0.3 2,-0.3 33,-0.0 33,-0.0 0.845 127.8 9.1 -62.5 -31.2 -1.9 16.3 -15.6 16 15 A Y S S+ 0 0 86 32,-0.1 -1,-0.3 33,-0.0 2,-0.1 -0.970 122.7 8.0-148.5 132.4 -2.2 12.8 -17.1 17 16 A G S S- 0 0 19 -2,-0.3 -3,-1.5 -3,-0.2 2,-0.4 -0.284 85.5 -66.2 91.8-178.7 -2.4 11.8 -20.7 18 17 A V E -AB 13 35A 20 17,-2.1 17,-3.2 -5,-0.2 2,-0.5 -0.905 39.5-142.7-118.8 140.2 -2.0 13.7 -24.0 19 18 A V E -AB 12 34A 26 -7,-3.3 -8,-2.1 -2,-0.4 -7,-1.6 -0.885 16.9-178.8-111.7 131.2 -4.3 16.4 -25.4 20 19 A Y E -AB 10 33A 42 13,-3.0 13,-3.1 -2,-0.5 2,-0.5 -0.913 25.9-130.7-119.8 149.0 -5.3 16.9 -29.0 21 20 A K E +AB 9 32A 58 -12,-2.9 -13,-3.3 -2,-0.3 -12,-1.5 -0.852 41.9 167.4 -89.1 134.8 -7.5 19.5 -30.7 22 21 A A E -AB 7 31A 0 9,-3.0 9,-2.7 -2,-0.5 2,-0.4 -0.902 29.5-129.8-144.7 171.0 -10.0 17.7 -33.0 23 22 A R E -AB 6 30A 97 -17,-2.3 -17,-2.8 -2,-0.3 2,-0.7 -0.990 18.1-129.1-130.5 129.8 -13.1 18.3 -35.0 24 23 A N E > -A 5 0A 6 5,-3.5 4,-2.3 -2,-0.4 -19,-0.2 -0.697 21.9-154.3 -72.3 116.4 -16.4 16.3 -35.1 25 24 A K T 4 S+ 0 0 64 -21,-3.3 -1,-0.2 -2,-0.7 -20,-0.1 0.710 87.3 43.2 -69.5 -22.6 -16.8 15.7 -38.8 26 25 A L T 4 S+ 0 0 6 -22,-0.4 -1,-0.2 3,-0.1 885,-0.1 0.867 127.2 25.0 -93.8 -40.7 -20.5 15.3 -38.7 27 26 A T T 4 S- 0 0 0 2,-0.1 877,-2.9 876,-0.1 880,-0.2 0.626 95.1-128.6 -98.2 -17.6 -21.6 18.1 -36.3 28 27 A G < + 0 0 2 -4,-2.3 -3,-0.1 1,-0.3 875,-0.1 0.282 54.0 153.2 85.1 -9.4 -18.6 20.4 -36.9 29 28 A E - 0 0 23 873,-0.4 -5,-3.5 -6,-0.1 2,-0.5 -0.268 40.3-138.6 -59.0 131.7 -18.0 20.7 -33.1 30 29 A V E +B 23 0A 54 -7,-0.2 53,-1.2 -3,-0.1 2,-0.3 -0.802 32.5 173.8 -91.3 131.8 -14.4 21.4 -32.2 31 30 A V E -BC 22 82A 0 -9,-2.7 -9,-3.0 -2,-0.5 2,-0.5 -0.853 33.4-122.1-133.1 166.0 -13.3 19.3 -29.2 32 31 A A E -BC 21 81A 12 49,-2.9 49,-3.4 -2,-0.3 2,-0.5 -0.964 25.7-153.6-108.5 132.4 -10.2 18.5 -27.1 33 32 A L E -BC 20 80A 0 -13,-3.1 -13,-3.0 -2,-0.5 2,-0.7 -0.918 4.0-161.2-107.3 124.6 -9.3 14.8 -26.9 34 33 A K E -BC 19 79A 8 45,-2.9 45,-2.6 -2,-0.5 2,-0.6 -0.921 13.0-157.0-104.6 110.2 -7.4 13.6 -23.9 35 34 A K E -BC 18 78A 21 -17,-3.2 -17,-2.1 -2,-0.7 2,-0.6 -0.783 10.9-175.0 -91.2 122.8 -5.8 10.2 -24.8 36 35 A I E - C 0 77A 2 41,-3.2 41,-2.2 -2,-0.6 2,-0.3 -0.962 18.2-142.9-116.5 112.6 -5.0 7.9 -21.9 37 36 A R E - C 0 76A 114 -2,-0.6 39,-0.2 39,-0.2 -20,-0.0 -0.559 19.3-178.3 -76.0 135.1 -3.1 4.8 -23.0 38 37 A L S > S+ 0 0 18 37,-2.5 3,-2.1 -2,-0.3 6,-0.2 0.558 71.2 82.8-104.4 -15.4 -4.0 1.6 -21.2 39 38 A D T 3 S+ 0 0 102 36,-1.0 -1,-0.1 1,-0.3 37,-0.1 0.744 89.2 55.1 -60.7 -24.3 -1.5 -0.5 -23.1 40 39 A T T 3 S+ 0 0 84 1,-0.1 2,-0.3 4,-0.0 -1,-0.3 0.056 92.2 109.6 -96.4 23.6 1.1 0.7 -20.6 41 40 A E < + 0 0 34 -3,-2.1 -1,-0.1 1,-0.2 4,-0.0 -0.911 24.1 155.3-145.5 115.8 -1.1 -0.5 -17.8 42 41 A T S S+ 0 0 87 -2,-0.3 -1,-0.2 3,-0.0 359,-0.1 -0.524 82.1 55.4 89.6 -53.2 -0.2 -2.9 -16.1 43 42 A E S S- 0 0 64 1,-0.4 2,-0.1 -5,-0.2 -2,-0.1 0.188 101.8-124.0-131.9 13.0 -2.4 -1.5 -13.3 44 43 A G S S- 0 0 8 -6,-0.2 -1,-0.4 2,-0.1 374,-0.1 -0.433 72.3 -0.1 76.9-152.5 -5.7 -1.2 -15.2 45 44 A V S S- 0 0 0 373,-0.2 -7,-0.1 -2,-0.1 5,-0.1 -0.570 88.0-111.7 -74.8 125.6 -7.5 2.2 -15.5 46 45 A P >> - 0 0 12 0, 0.0 4,-2.1 0, 0.0 3,-0.8 -0.278 14.9-127.3 -62.9 140.0 -5.5 4.8 -13.7 47 46 A S H 3> S+ 0 0 39 1,-0.3 4,-2.5 2,-0.2 5,-0.3 0.858 109.9 60.3 -53.6 -37.1 -7.1 6.2 -10.5 48 47 A T H 3> S+ 0 0 30 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.881 107.7 44.0 -59.8 -39.7 -6.6 9.7 -11.9 49 48 A A H <> S+ 0 0 1 -3,-0.8 4,-2.5 2,-0.2 5,-0.3 0.891 110.7 54.6 -70.7 -40.9 -8.7 8.9 -14.9 50 49 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.926 113.8 41.4 -59.0 -46.1 -11.4 7.1 -12.8 51 50 A R H X S+ 0 0 10 -4,-2.5 4,-2.8 2,-0.2 5,-0.4 0.922 112.8 53.2 -67.1 -45.9 -11.8 10.2 -10.6 52 51 A E H X S+ 0 0 4 -4,-2.0 4,-2.3 -5,-0.3 5,-0.2 0.935 115.9 39.3 -57.8 -46.6 -11.7 12.7 -13.4 53 52 A I H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.953 116.8 47.5 -70.5 -51.0 -14.4 11.0 -15.4 54 53 A S H X S+ 0 0 0 -4,-2.3 4,-0.6 -5,-0.3 -2,-0.2 0.932 119.4 40.4 -57.9 -43.1 -16.7 10.1 -12.5 55 54 A L H >X S+ 0 0 0 -4,-2.8 4,-0.9 -5,-0.2 3,-0.9 0.924 113.7 50.8 -74.4 -42.8 -16.5 13.6 -11.0 56 55 A L H 3< S+ 0 0 3 -4,-2.3 11,-0.3 -5,-0.4 3,-0.3 0.815 101.3 62.8 -67.1 -31.2 -16.7 15.6 -14.2 57 56 A K H 3< S+ 0 0 78 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.799 107.1 45.3 -62.0 -28.3 -19.8 13.7 -15.4 58 57 A E H << S+ 0 0 29 -3,-0.9 2,-1.2 -4,-0.6 -1,-0.2 0.721 98.3 79.7 -83.7 -23.9 -21.6 15.1 -12.3 59 58 A L < + 0 0 2 -4,-0.9 2,-0.8 -3,-0.3 8,-0.2 -0.642 50.2 164.4 -98.0 83.8 -20.4 18.6 -12.7 60 59 A N + 0 0 97 -2,-1.2 5,-0.1 -3,-0.1 6,-0.1 -0.861 22.4 133.4 -98.7 108.3 -22.4 20.5 -15.3 61 60 A H > - 0 0 37 -2,-0.8 3,-1.7 3,-0.4 54,-0.0 -0.984 63.6-118.3-153.0 144.3 -21.7 24.2 -14.9 62 61 A P T 3 S+ 0 0 86 0, 0.0 4,-0.1 0, 0.0 53,-0.1 0.692 114.9 49.2 -62.5 -18.9 -20.8 27.0 -17.4 63 62 A N T 3 S+ 0 0 7 80,-0.1 81,-2.5 2,-0.1 2,-0.4 0.069 98.2 75.6-110.5 23.4 -17.5 27.6 -15.6 64 63 A I B < S-e 144 0B 1 -3,-1.7 -3,-0.4 79,-0.3 81,-0.2 -0.998 94.1-107.8-127.4 126.3 -16.4 23.9 -15.5 65 64 A V - 0 0 3 79,-2.8 2,-0.5 -2,-0.4 -6,-0.1 -0.262 40.2-117.3 -56.2 137.5 -15.1 22.5 -18.8 66 65 A K - 0 0 79 -4,-0.1 16,-2.2 -6,-0.1 2,-0.7 -0.662 12.0-144.6 -87.1 124.6 -17.7 20.0 -20.1 67 66 A L E -D 81 0A 20 -2,-0.5 14,-0.2 -11,-0.3 3,-0.1 -0.788 20.8-177.9 -78.7 116.2 -16.8 16.3 -20.5 68 67 A L E - 0 0 50 12,-3.0 2,-0.3 -2,-0.7 13,-0.2 0.831 54.6 -22.5 -88.0 -36.6 -18.8 15.4 -23.6 69 68 A D E -D 80 0A 87 11,-1.3 11,-2.8 2,-0.0 2,-0.4 -0.982 47.0-132.8-166.7 162.4 -18.0 11.7 -24.0 70 69 A V E -D 79 0A 34 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.976 23.7-165.5-130.8 120.8 -15.7 8.9 -23.1 71 70 A I E -D 78 0A 16 7,-3.1 7,-3.0 -2,-0.4 2,-0.7 -0.909 8.6-155.6-112.9 126.2 -14.6 6.5 -25.8 72 71 A H E -D 77 0A 63 -2,-0.5 5,-0.2 5,-0.2 2,-0.2 -0.873 17.0-178.7 -99.2 109.0 -12.9 3.2 -25.3 73 72 A T E > -D 76 0A 27 3,-1.9 3,-0.6 -2,-0.7 5,-0.0 -0.463 52.4 -72.6 -92.5 172.4 -10.8 2.1 -28.2 74 73 A E T 3 S- 0 0 130 1,-0.3 -2,-0.0 -2,-0.2 -1,-0.0 0.830 124.9 -6.3 -29.6 -67.3 -8.9 -1.2 -28.4 75 74 A N T 3 S+ 0 0 76 2,-0.0 -37,-2.5 -37,-0.0 -36,-1.0 0.145 123.1 82.8-121.6 18.5 -6.2 -0.2 -25.9 76 75 A K E < -CD 37 73A 69 -3,-0.6 -3,-1.9 -39,-0.2 2,-0.5 -0.892 56.2-151.3-129.0 152.8 -7.1 3.5 -25.4 77 76 A L E -CD 36 72A 1 -41,-2.2 -41,-3.2 -2,-0.3 2,-0.5 -0.995 17.9-165.9-119.0 124.3 -9.4 5.7 -23.4 78 77 A Y E -CD 35 71A 10 -7,-3.0 -7,-3.1 -2,-0.5 2,-0.6 -0.955 7.0-159.3-114.2 118.5 -10.3 9.0 -25.0 79 78 A L E -CD 34 70A 0 -45,-2.6 -45,-2.9 -2,-0.5 2,-0.6 -0.855 12.8-151.4 -91.0 124.7 -12.0 11.7 -23.0 80 79 A V E -CD 33 69A 3 -11,-2.8 -12,-3.0 -2,-0.6 -11,-1.3 -0.880 20.0-179.9-101.1 116.9 -13.8 14.1 -25.3 81 80 A F E -CD 32 67A 15 -49,-3.4 -49,-2.9 -2,-0.6 -14,-0.2 -0.836 36.7 -98.0-114.2 150.9 -14.0 17.7 -23.9 82 81 A E E -C 31 0A 41 -16,-2.2 2,-0.4 -2,-0.3 -51,-0.2 -0.402 51.5-113.1 -56.2 142.4 -15.5 20.9 -25.2 83 82 A F - 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0 0 17 -4,-2.6 -235,-0.1 -5,-0.3 -42,-0.0 -0.529 58.2-146.9 -86.4 147.6 -7.8 5.4 -1.1 396 270 B I S S+ 0 0 44 1,-0.3 -1,-0.1 -2,-0.2 -236,-0.0 0.909 105.0 22.9 -66.9 -43.2 -4.6 7.4 -0.9 397 271 B Y S S- 0 0 175 -3,-0.0 -1,-0.3 3,-0.0 -5,-0.1 -0.768 83.0-166.1-126.1 84.7 -2.6 4.2 -1.5 398 272 B P - 0 0 47 0, 0.0 3,-0.1 0, 0.0 -10,-0.1 -0.402 33.0-101.9 -68.7 148.8 -4.8 1.6 -3.2 399 273 B P - 0 0 13 0, 0.0 -4,-0.1 0, 0.0 5,-0.0 -0.374 45.5-100.9 -63.0 151.5 -3.4 -1.9 -3.1 400 274 B E >> - 0 0 109 1,-0.1 4,-1.3 -3,-0.1 3,-1.1 -0.329 29.6-108.7 -72.7 159.6 -1.7 -3.0 -6.4 401 275 B V H 3> S+ 0 0 0 1,-0.3 4,-2.4 2,-0.2 3,-0.3 0.872 118.4 61.4 -55.7 -39.6 -3.6 -5.2 -8.8 402 276 B A H 3> S+ 0 0 50 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.852 100.7 55.1 -57.8 -33.5 -1.3 -8.1 -8.1 403 277 B E H <> S+ 0 0 66 -3,-1.1 4,-1.6 2,-0.2 -1,-0.2 0.903 107.3 48.3 -67.7 -39.7 -2.5 -7.9 -4.5 404 278 B F H X S+ 0 0 3 -4,-1.3 4,-0.6 -3,-0.3 -2,-0.2 0.865 112.3 49.5 -67.6 -36.3 -6.2 -8.2 -5.6 405 279 B V H ><>S+ 0 0 18 -4,-2.4 3,-1.1 1,-0.2 5,-1.1 0.949 109.8 52.5 -62.2 -48.1 -5.2 -11.2 -7.8 406 280 B Y H ><5S+ 0 0 166 -4,-2.7 3,-1.1 1,-0.3 -2,-0.2 0.795 102.7 57.3 -59.8 -33.9 -3.4 -12.7 -4.8 407 281 B I H 3<5S+ 0 0 28 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.662 92.7 67.1 -78.2 -15.9 -6.4 -12.5 -2.4 408 282 B T T X<5S- 0 0 2 -3,-1.1 3,-2.1 -4,-0.6 -1,-0.3 0.207 114.4-118.9 -81.6 16.6 -8.6 -14.5 -4.8 409 283 B D T < 5 - 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0 0 75 -3,-0.9 -3,-0.2 -4,-0.3 -4,-0.1 0.859 62.5 -66.4 42.6 43.7 -21.0 4.2 -16.9 430 304 B F T 3 - 0 0 5 1,-0.1 4,-1.8 -2,-0.1 5,-0.2 -0.815 34.5-113.4-123.5 162.5 -22.8 5.6 1.2 437 311 B V H > S+ 0 0 8 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.912 120.8 56.7 -54.4 -41.0 -24.2 4.8 4.6 438 312 B N H > S+ 0 0 21 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.918 102.4 52.5 -59.5 -45.7 -20.8 5.9 5.8 439 313 B Q H > S+ 0 0 20 1,-0.2 4,-1.1 2,-0.2 -284,-0.3 0.891 112.3 44.5 -61.4 -40.9 -21.0 9.3 4.2 440 314 B F H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.883 110.4 56.2 -69.8 -37.4 -24.4 10.1 5.9 441 315 B L H X S+ 0 0 2 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.943 103.7 52.1 -57.9 -48.6 -23.2 8.7 9.2 442 316 B T H X S+ 0 0 29 -4,-2.3 4,-0.5 1,-0.2 -1,-0.2 0.837 111.9 48.2 -63.8 -30.3 -20.2 11.1 9.4 443 317 B Q H >< S+ 0 0 2 -4,-1.1 3,-1.4 -5,-0.2 -1,-0.2 0.942 110.5 49.6 -67.9 -49.5 -22.6 13.9 8.8 444 318 B Y H >< S+ 0 0 0 -4,-2.7 3,-2.6 1,-0.3 -2,-0.2 0.873 99.9 67.2 -58.0 -37.4 -25.0 12.8 11.4 445 319 B F H >< S+ 0 0 16 -4,-2.8 3,-1.9 1,-0.3 -1,-0.3 0.795 85.6 70.3 -54.5 -29.9 -22.2 12.4 13.9 446 320 B L T << S+ 0 0 80 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.633 90.3 64.0 -64.8 -10.2 -21.8 16.2 13.9 447 321 B H T < S+ 0 0 49 -3,-2.6 -1,-0.3 -4,-0.2 -2,-0.2 0.263 76.4 112.3-100.1 8.8 -25.1 16.4 15.7 448 322 B Q < - 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0 0 74 -3,-1.2 -3,-0.2 1,-0.3 -4,-0.1 0.867 63.5 -65.9 43.3 43.7 -29.9 5.6 -27.8 959 304 D F T 3 - 0 0 5 -2,-0.2 4,-1.5 1,-0.1 5,-0.2 -0.777 35.2-109.9-123.2 166.3 -46.3 13.4 -30.9 966 311 D V H > S+ 0 0 7 -2,-0.3 4,-2.5 1,-0.2 3,-0.1 0.895 121.3 56.3 -55.6 -40.1 -48.8 16.2 -31.1 967 312 D N H > S+ 0 0 23 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.883 101.4 54.5 -62.0 -40.4 -50.3 14.2 -33.9 968 313 D Q H > S+ 0 0 23 1,-0.2 4,-0.9 2,-0.2 -254,-0.3 0.855 112.5 43.0 -65.8 -36.5 -50.8 11.1 -31.8 969 314 D F H X S+ 0 0 0 -4,-1.5 4,-2.8 2,-0.2 3,-0.2 0.889 110.6 56.3 -74.0 -40.9 -52.8 13.0 -29.3 970 315 D L H X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.921 104.1 52.6 -55.3 -47.2 -54.8 14.9 -31.9 971 316 D T H X S+ 0 0 31 -4,-2.4 4,-0.5 1,-0.2 -1,-0.2 0.833 111.3 48.1 -62.9 -31.8 -55.9 11.6 -33.5 972 317 D Q H >< S+ 0 0 3 -4,-0.9 3,-1.5 -3,-0.2 4,-0.3 0.956 111.0 48.6 -68.8 -52.0 -57.2 10.4 -30.1 973 318 D Y H >< S+ 0 0 0 -4,-2.8 3,-2.4 1,-0.3 -2,-0.2 0.854 100.2 68.4 -55.9 -36.4 -59.0 13.7 -29.4 974 319 D F H >< S+ 0 0 16 -4,-2.5 3,-1.4 1,-0.3 -1,-0.3 0.786 86.5 67.5 -55.3 -30.7 -60.6 13.6 -32.8 975 320 D L T << S+ 0 0 101 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 0.681 88.1 69.4 -64.0 -17.0 -62.6 10.5 -31.7 976 321 D H T < S+ 0 0 51 -3,-2.4 -1,-0.3 -4,-0.3 2,-0.2 0.128 76.7 112.1 -92.0 21.2 -64.4 12.9 -29.3 977 322 D Q < - 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