==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 19-MAY-11 3S4A . COMPND 2 MOLECULE: CELLOBIOSE PHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CELLULOMONAS UDA; . AUTHOR A.VAN HOOREBEKE,J.STOUT,W.SOETAERT,J.VAN BEEUMEN,T.DESMET,S. . 1644 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48783.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1214 73.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 374 22.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 22 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 5 0.3 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 . 152 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 180 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 373 22.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 34 2.1 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 6 4 2 0 4 2 2 6 6 1 2 0 1 0 2 2 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 0 0 0 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 PARALLEL BRIDGES PER LADDER . 21 22 11 8 7 6 2 6 2 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 7 3 3 3 0 0 0 2 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 0 136 0, 0.0 700,-0.9 0, 0.0 699,-0.9 0.000 360.0 360.0 360.0 173.3 -24.0 1.6 -47.4 2 2 A R - 0 0 131 698,-0.2 696,-0.1 697,-0.1 3,-0.1 -0.752 360.0-158.2-126.9 165.7 -25.7 2.4 -44.0 3 3 A Y S S- 0 0 39 -2,-0.2 13,-2.1 694,-0.2 14,-0.7 0.094 79.8 -20.3-130.6 17.1 -25.1 1.9 -40.3 4 4 A G E -A 15 0A 6 11,-0.3 2,-0.3 12,-0.2 11,-0.2 -0.957 66.0-111.8 170.0-157.6 -28.7 2.2 -39.2 5 5 A H E -A 14 0A 69 9,-1.8 9,-3.2 -2,-0.3 2,-0.2 -0.984 28.6 -94.4-165.5 156.2 -32.1 3.6 -40.1 6 6 A F E -A 13 0A 16 -2,-0.3 2,-0.6 7,-0.2 7,-0.2 -0.555 23.1-158.9 -75.0 143.0 -34.6 6.3 -39.2 7 7 A D E >> +A 12 0A 40 5,-3.2 5,-2.3 -2,-0.2 4,-0.8 -0.917 13.4 179.2-118.9 94.9 -37.4 5.3 -36.9 8 8 A D T 45S+ 0 0 74 -2,-0.6 3,-0.2 3,-0.2 -1,-0.1 0.837 75.9 58.4 -68.4 -35.6 -40.0 7.9 -37.7 9 9 A E T 45S+ 0 0 100 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.901 117.6 34.0 -60.6 -40.4 -42.7 6.7 -35.2 10 10 A A T 45S- 0 0 36 2,-0.1 -1,-0.2 90,-0.0 -2,-0.2 0.536 106.4-126.4 -88.4 -9.6 -40.1 7.1 -32.3 11 11 A R T <5 + 0 0 83 -4,-0.8 90,-0.4 1,-0.2 2,-0.3 0.976 68.2 125.7 57.7 55.5 -38.5 10.2 -33.9 12 12 A E E < -A 7 0A 20 -5,-2.3 -5,-3.2 88,-0.2 2,-0.5 -0.973 63.5-132.1-140.0 152.7 -35.1 8.5 -33.5 13 13 A Y E -AB 6 99A 0 86,-2.0 86,-2.3 -2,-0.3 2,-0.7 -0.962 29.3-146.6-103.0 124.6 -32.1 7.6 -35.7 14 14 A V E -AB 5 98A 0 -9,-3.2 -9,-1.8 -2,-0.5 2,-0.6 -0.845 8.9-162.8-100.1 112.5 -31.3 4.0 -34.9 15 15 A I E -AB 4 97A 0 82,-4.0 82,-2.8 -2,-0.7 -11,-0.3 -0.833 5.9-174.5 -96.2 119.5 -27.5 3.2 -35.1 16 16 A T + 0 0 64 -13,-2.1 79,-0.3 -2,-0.6 -12,-0.2 0.376 61.2 42.9-103.9 4.2 -27.2 -0.6 -35.4 17 17 A T - 0 0 34 -14,-0.7 3,-0.1 80,-0.1 80,-0.1 -0.992 65.0-138.1-142.5 149.7 -23.5 -1.0 -35.2 18 18 A P S S+ 0 0 12 0, 0.0 2,-1.7 0, 0.0 -1,-0.1 0.720 91.2 83.6 -67.8 -23.1 -20.6 0.4 -33.1 19 19 A H + 0 0 78 4,-0.0 -3,-0.1 2,-0.0 1024,-0.0 -0.487 57.9 154.3 -95.1 68.2 -18.6 0.6 -36.3 20 20 A T - 0 0 4 -2,-1.7 685,-0.1 -3,-0.1 681,-0.0 -0.477 58.0-110.1 -83.6 162.6 -19.7 3.9 -37.9 21 21 A P S S- 0 0 27 0, 0.0 684,-0.1 0, 0.0 -1,-0.1 0.807 101.5 -1.5 -58.9 -29.0 -17.4 5.9 -40.3 22 22 A Y S S- 0 0 26 682,-0.3 2,-0.0 683,-0.1 682,-0.0 -0.970 96.8 -75.5-157.6 155.1 -17.1 8.5 -37.5 23 23 A P - 0 0 16 0, 0.0 2,-0.6 0, 0.0 683,-0.2 -0.351 49.0-149.6 -56.6 130.4 -18.5 9.1 -33.9 24 24 A W - 0 0 0 681,-0.1 15,-1.2 -2,-0.0 2,-0.2 -0.938 18.8-162.3-112.9 123.4 -22.1 10.2 -34.4 25 25 A I E -J 38 0B 0 -2,-0.6 2,-0.3 13,-0.2 13,-0.2 -0.589 18.9-163.4-114.4 167.2 -23.5 12.5 -31.7 26 26 A N E -J 37 0B 0 11,-1.9 11,-2.2 -2,-0.2 2,-0.5 -0.877 23.7-122.8-135.0 161.4 -26.6 13.9 -30.2 27 27 A Y E -J 36 0B 7 -2,-0.3 75,-0.4 9,-0.2 2,-0.4 -0.951 20.2-163.6-111.1 127.0 -27.2 17.0 -27.9 28 28 A L E +J 35 0B 0 7,-2.2 7,-2.1 -2,-0.5 75,-0.1 -0.872 51.5 55.0-100.7 146.9 -28.9 16.5 -24.5 29 29 A G - 0 0 11 73,-0.4 5,-0.1 -2,-0.4 94,-0.1 0.287 44.3-160.2 107.7 130.4 -30.3 19.6 -22.7 30 30 A S S S+ 0 0 7 92,-0.1 4,-0.1 91,-0.1 -1,-0.1 0.410 80.7 29.0-120.0 1.1 -32.8 22.3 -23.6 31 31 A E S S- 0 0 75 2,-0.5 17,-0.1 94,-0.2 95,-0.1 0.168 122.5 -34.1-126.2-118.8 -31.9 25.0 -21.1 32 32 A Q S S+ 0 0 85 93,-0.1 16,-3.3 15,-0.1 2,-0.5 0.629 115.9 70.3 -88.9 -15.0 -28.6 25.9 -19.3 33 33 A F E + K 0 47B 0 92,-0.3 -2,-0.5 14,-0.2 2,-0.3 -0.913 62.4 173.3-113.9 126.8 -27.2 22.4 -19.0 34 34 A F E - K 0 46B 11 12,-2.3 12,-2.0 -2,-0.5 2,-0.3 -0.939 14.9-164.7-135.1 155.3 -26.0 20.5 -22.1 35 35 A S E -JK 28 45B 0 -7,-2.1 -7,-2.2 -2,-0.3 2,-0.5 -0.984 16.5-143.4-134.9 142.2 -24.2 17.3 -23.0 36 36 A L E -J 27 0B 0 8,-3.0 2,-0.4 -2,-0.3 8,-0.4 -0.948 30.3-178.5 -95.5 126.8 -22.5 16.1 -26.1 37 37 A L E -J 26 0B 0 -11,-2.2 -11,-1.9 -2,-0.5 6,-0.2 -0.949 10.1-161.6-134.0 115.9 -23.2 12.3 -26.4 38 38 A S E > -J 25 0B 0 4,-2.1 3,-2.0 -2,-0.4 -13,-0.2 -0.387 40.6 -99.7 -87.5 177.1 -22.0 9.9 -29.1 39 39 A H T 3 S+ 0 0 4 -15,-1.2 -14,-0.1 1,-0.3 -1,-0.1 0.448 127.7 52.7 -77.3 -1.2 -23.3 6.6 -30.0 40 40 A Q T 3 S- 0 0 3 -16,-0.1 -1,-0.3 2,-0.1 44,-0.1 -0.012 124.0-104.4-116.2 24.0 -20.5 5.2 -27.9 41 41 A A S < S+ 0 0 1 -3,-2.0 29,-2.2 1,-0.2 -2,-0.1 0.643 75.8 144.1 65.9 16.8 -21.4 7.3 -24.9 42 42 A G B +N 69 0C 0 27,-0.3 -4,-2.1 42,-0.1 2,-0.3 -0.361 25.8 60.0 -78.6 163.8 -18.5 9.6 -25.6 43 43 A G - 0 0 2 25,-1.4 2,-0.3 -6,-0.2 -6,-0.2 -0.813 67.1-102.4 122.7-159.2 -18.4 13.3 -25.0 44 44 A Y - 0 0 0 -8,-0.4 -8,-3.0 -2,-0.3 2,-0.3 -0.909 15.4-121.8-159.4 178.7 -18.9 15.6 -22.1 45 45 A S E +K 35 0B 0 -2,-0.3 10,-1.5 -10,-0.2 11,-1.3 -0.966 21.4 175.6-135.2 149.5 -21.3 18.0 -20.2 46 46 A F E -KL 34 54B 4 -12,-2.0 -12,-2.3 -2,-0.3 2,-0.7 -0.980 30.9-120.1-148.2 155.1 -21.2 21.7 -19.1 47 47 A Y E S-K 33 0B 35 6,-2.1 2,-3.0 2,-0.3 -14,-0.2 -0.893 79.3 -50.5 -99.7 109.6 -23.4 24.3 -17.4 48 48 A R S S+ 0 0 92 -16,-3.3 2,-0.6 -2,-0.7 -15,-0.1 -0.148 131.2 60.6 70.0 -48.9 -24.1 27.3 -19.7 49 49 A D > - 0 0 17 -2,-3.0 4,-2.5 4,-0.1 -2,-0.3 -0.932 58.1-172.5-123.2 103.1 -20.4 27.9 -20.5 50 50 A A T 4 S+ 0 0 5 -2,-0.6 107,-0.2 1,-0.2 4,-0.2 0.710 87.4 51.9 -70.3 -18.8 -18.5 25.0 -22.3 51 51 A K T 4 S+ 0 0 41 309,-0.1 106,-3.2 2,-0.1 107,-0.6 0.897 128.4 13.3 -81.3 -45.9 -15.1 26.9 -21.9 52 52 A M T 4 S+ 0 0 17 104,-0.3 -2,-0.2 1,-0.2 -1,-0.1 0.668 125.4 50.9-117.0 -6.3 -15.3 27.6 -18.1 53 53 A R < + 0 0 52 -4,-2.5 -6,-2.1 103,-0.1 2,-0.6 -0.115 69.4 147.4-121.7 37.4 -18.1 25.5 -16.6 54 54 A R E -LM 46 155B 3 101,-2.7 101,-1.2 -3,-0.3 -8,-0.3 -0.658 27.4-170.7 -82.2 119.0 -17.2 22.1 -18.0 55 55 A L E + 0 0 0 -10,-1.5 98,-2.4 -2,-0.6 2,-0.3 0.894 68.7 32.2 -68.8 -43.5 -18.1 19.2 -15.6 56 56 A T E S- M 0 152B 5 -11,-1.3 2,-0.3 96,-0.3 96,-0.3 -0.861 79.2-115.5-131.0 153.6 -16.3 16.4 -17.5 57 57 A R - 0 0 15 94,-2.1 2,-0.3 -2,-0.3 94,-0.2 -0.625 26.9-179.7 -95.2 141.4 -13.2 16.0 -19.6 58 58 A Y - 0 0 18 -2,-0.3 2,-0.7 -16,-0.1 10,-0.1 -0.999 19.0-139.7-140.4 140.2 -13.2 15.0 -23.3 59 59 A R > - 0 0 31 -2,-0.3 3,-0.5 8,-0.1 7,-0.4 -0.895 11.4-154.6-106.0 112.6 -10.2 14.5 -25.6 60 60 A Y T 3 S+ 0 0 33 -2,-0.7 296,-0.1 1,-0.2 295,-0.0 -0.492 82.6 21.3 -70.6 152.5 -10.4 15.8 -29.2 61 61 A N T 3 S+ 0 0 17 1,-0.2 -1,-0.2 -2,-0.1 2,-0.2 0.908 89.4 167.0 53.6 47.8 -8.2 14.0 -31.7 62 62 A N < - 0 0 14 -3,-0.5 -1,-0.2 6,-0.0 6,-0.0 -0.586 41.6-101.2 -87.5 156.4 -7.9 10.9 -29.4 63 63 A I S S+ 0 0 22 1,-0.3 984,-0.4 -2,-0.2 2,-0.1 -0.935 119.3 22.0-115.9 107.5 -6.4 7.6 -30.6 64 64 A P S > S- 0 0 18 0, 0.0 3,-0.8 0, 0.0 -1,-0.3 0.613 114.2-111.5 -76.6 167.3 -8.8 6.0 -31.1 65 65 A A T 3 S+ 0 0 42 1,-0.2 3,-0.1 -2,-0.1 -2,-0.1 -0.224 94.1 14.8 -57.3 140.8 -11.4 8.8 -31.5 66 66 A D T 3 S+ 0 0 3 -7,-0.4 2,-1.1 1,-0.2 -1,-0.2 0.820 74.9 151.5 68.3 32.3 -14.1 9.2 -28.8 67 67 A A < + 0 0 18 -3,-0.8 -1,-0.2 -8,-0.2 2,-0.2 -0.771 52.5 59.6 -95.5 87.7 -12.4 7.1 -26.2 68 68 A G + 0 0 2 -2,-1.1 -25,-1.4 -3,-0.1 2,-0.3 -0.404 62.1 96.5 154.2 126.1 -13.8 8.8 -23.1 69 69 A G B S-N 42 0C 10 -27,-0.3 2,-0.8 -2,-0.2 82,-0.3 -0.931 78.0 -24.4 169.8-150.7 -17.3 9.3 -21.9 70 70 A R - 0 0 8 -29,-2.2 2,-0.3 -2,-0.3 80,-0.2 -0.825 68.8-177.9-100.3 107.5 -19.8 7.8 -19.5 71 71 A Y E -O 149 0D 3 78,-2.1 78,-1.2 -2,-0.8 2,-0.4 -0.777 26.8-161.4-112.8 152.6 -18.9 4.2 -19.1 72 72 A L E -O 148 0D 6 -2,-0.3 2,-0.6 76,-0.2 76,-0.2 -0.879 16.6-153.2-130.8 96.2 -20.4 1.2 -17.2 73 73 A Y E -O 147 0D 1 74,-2.8 74,-2.9 -2,-0.4 2,-0.7 -0.615 8.6-156.4 -73.4 116.4 -17.8 -1.6 -16.8 74 74 A V E -OP 146 81D 0 7,-3.2 7,-2.1 -2,-0.6 2,-0.7 -0.834 6.7-168.3 -92.3 119.1 -19.6 -4.9 -16.5 75 75 A N E +OP 145 80D 12 70,-2.2 70,-1.7 -2,-0.7 2,-0.6 -0.941 8.1 178.9-106.7 111.5 -17.6 -7.5 -14.7 76 76 A D E > S-OP 144 79D 26 3,-2.8 3,-1.7 -2,-0.7 68,-0.1 -0.905 75.4 -32.0-115.8 96.5 -19.3 -10.9 -15.2 77 77 A G T 3 S- 0 0 78 66,-0.7 -1,-0.1 -2,-0.6 3,-0.1 0.800 126.0 -47.0 66.0 26.8 -17.3 -13.6 -13.5 78 78 A G T 3 S+ 0 0 42 1,-0.3 2,-0.4 152,-0.1 -1,-0.3 0.177 112.7 117.6 99.9 -19.6 -14.1 -11.8 -14.2 79 79 A D E < -P 76 0D 54 -3,-1.7 -3,-2.8 2,-0.0 2,-0.4 -0.736 52.3-154.9 -80.5 129.0 -14.9 -11.0 -17.9 80 80 A V E +P 75 0D 16 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.889 24.3 149.9-113.0 132.4 -15.0 -7.2 -18.3 81 81 A W E -P 74 0D 0 -7,-2.1 -7,-3.2 -2,-0.4 5,-0.1 -0.978 33.9-133.4-151.8 166.2 -16.9 -5.3 -21.0 82 82 A T > - 0 0 1 3,-0.3 3,-1.7 -2,-0.3 8,-0.2 -0.994 13.1-141.8-129.2 133.9 -18.8 -2.1 -21.7 83 83 A P T 3 S+ 0 0 6 0, 0.0 26,-0.1 0, 0.0 3,-0.1 0.675 105.4 63.1 -67.7 -19.3 -22.3 -1.9 -23.4 84 84 A S T 3 S- 0 0 5 2,-0.2 2,-2.2 1,-0.2 -42,-0.1 0.376 103.6-138.8 -80.8 6.5 -21.0 1.3 -25.2 85 85 A W <> + 0 0 24 -3,-1.7 4,-3.3 6,-0.0 5,-0.5 -0.479 65.4 100.0 66.4 -74.8 -18.5 -1.1 -26.8 86 86 A L T 4 + 0 0 7 -2,-2.2 -2,-0.2 1,-0.3 -19,-0.0 -0.499 69.7 31.9 -63.5 150.6 -15.6 1.4 -26.5 87 87 A P T 4 S+ 0 0 11 0, 0.0 -1,-0.3 0, 0.0 138,-0.2 -0.977 131.7 30.3 -91.3 -14.1 -13.5 1.6 -24.6 88 88 A V T 4 S- 0 0 34 -3,-0.3 -2,-0.2 136,-0.1 137,-0.1 0.842 80.3-155.3 -70.3 -36.7 -13.1 -2.1 -23.9 89 89 A K < + 0 0 37 -4,-3.3 2,-0.2 1,-0.2 -3,-0.1 0.843 28.0 165.3 58.0 39.6 -14.1 -3.3 -27.4 90 90 A A - 0 0 16 -5,-0.5 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0 0 3,-3.0 2,-1.3 -2,-0.6 -88,-0.2 -0.474 49.3 -60.6-115.3-161.6 -33.8 11.0 -30.1 101 101 A L S S- 0 0 9 -90,-0.4 214,-0.2 1,-0.2 3,-0.1 -0.646 119.6 -17.7 -87.1 94.6 -34.8 14.6 -29.4 102 102 A G S S+ 0 0 1 -2,-1.3 19,-0.8 -75,-0.4 -73,-0.4 0.551 131.6 57.3 91.5 0.5 -32.9 15.4 -26.2 103 103 A Y E - D 0 120A 6 17,-0.2 -3,-3.0 -3,-0.1 2,-0.3 -0.971 58.0-163.6-151.3 162.7 -32.1 11.9 -25.1 104 104 A S E -CD 99 119A 0 15,-2.1 15,-2.8 -2,-0.3 2,-0.4 -0.957 8.5-148.7-140.5 158.6 -30.4 8.8 -26.4 105 105 A T E -CD 98 118A 19 -7,-2.5 -7,-3.0 -2,-0.3 2,-0.4 -0.996 9.6-170.0-126.0 139.2 -30.4 5.1 -25.5 106 106 A I E -CD 97 117A 4 11,-2.3 11,-2.8 -2,-0.4 2,-0.4 -1.000 7.1-173.2-125.6 130.7 -27.4 2.8 -25.9 107 107 A T E +CD 96 116A 11 -11,-2.6 -11,-2.0 -2,-0.4 2,-0.4 -0.976 6.5 175.4-128.2 134.4 -27.8 -1.0 -25.4 108 108 A G E -CD 95 115A 0 7,-2.2 7,-2.7 -2,-0.4 2,-0.4 -0.998 6.5-169.1-136.1 141.2 -25.1 -3.7 -25.4 109 109 A E E +CD 94 114A 25 -15,-2.4 -16,-2.3 -2,-0.4 -15,-1.4 -0.995 11.5 163.2-133.7 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92.1 68.5 -66.8 -33.4 -27.4 44.3 -43.0 426 426 A W H 3X S+ 0 0 0 -4,-1.0 4,-2.2 -3,-0.5 -1,-0.3 0.727 88.4 66.7 -57.8 -21.8 -28.1 40.9 -41.5 427 427 A L H <> S+ 0 0 0 -3,-1.5 4,-2.3 -4,-0.4 -1,-0.2 0.872 102.2 47.6 -65.3 -35.6 -29.8 42.8 -38.5 428 428 A I H + 0 0 37 -6,-0.4 3,-1.5 1,-0.2 4,-0.2 -0.441 12.1 160.6 -81.7 76.3 -45.1 42.1 -33.7 441 441 A F G > + 0 0 69 -2,-2.2 3,-1.6 1,-0.3 4,-0.3 0.725 61.8 83.6 -66.0 -16.8 -44.2 45.5 -35.3 442 442 A S G > S+ 0 0 56 1,-0.3 3,-1.2 -3,-0.2 4,-0.3 0.680 71.8 74.1 -60.8 -21.9 -43.8 46.7 -31.6 443 443 A I G X S+ 0 0 0 -3,-1.5 3,-1.5 1,-0.2 17,-0.4 0.846 85.9 64.1 -59.0 -32.6 -40.3 45.4 -31.6 444 444 A L G < S+ 0 0 3 -3,-1.6 17,-2.7 1,-0.3 18,-0.3 0.679 99.2 54.0 -67.3 -17.7 -39.2 48.3 -33.8 445 445 A D G < S+ 0 0 99 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.504 80.3 121.4 -93.6 -7.6 -40.1 50.7 -31.0 446 446 A E S < S- 0 0 66 -3,-1.5 14,-1.6 -4,-0.3 2,-0.4 -0.294 71.4-113.7 -60.6 139.7 -38.0 49.0 -28.4 447 447 A P E +E 459 0L 85 0, 0.0 -1,-0.1 0, 0.0 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1219 396 B F > - 0 0 49 4,-2.5 3,-2.0 54,-0.2 -1,-0.1 -0.420 22.7-114.9 -75.4 155.1 10.9 50.8 -18.8 1220 397 B A T 3 S+ 0 0 53 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.749 114.9 60.1 -68.0 -20.3 12.5 54.2 -18.5 1221 398 B D T 3 S- 0 0 99 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.461 122.5-104.1 -86.2 4.0 11.1 54.5 -15.0 1222 399 B G S < S+ 0 0 0 -3,-2.0 -2,-0.1 1,-0.3 71,-0.1 0.153 81.4 127.9 97.8 -20.6 13.1 51.5 -13.9 1223 400 B S - 0 0 12 -5,-0.1 -4,-2.5 1,-0.1 -1,-0.3 -0.179 47.6-138.4 -65.4 162.6 10.1 49.1 -13.9 1224 401 B A - 0 0 2 -6,-0.2 19,-0.4 19,-0.2 2,-0.3 -0.884 18.2-106.1-125.1 148.8 10.3 45.8 -15.8 1225 402 B Y - 0 0 13 -2,-0.3 16,-0.2 1,-0.2 -36,-0.2 -0.642 32.3-140.5 -62.8 133.0 8.0 43.6 -18.0 1226 403 B H S S+ 0 0 11 14,-2.4 -37,-2.7 -2,-0.3 -36,-0.5 0.830 86.4 43.8 -66.0 -32.6 7.2 40.7 -15.7 1227 404 B Q E S-U 1188 0d 42 13,-0.5 9,-2.7 9,-0.3 2,-0.4 -0.956 71.6-157.0-123.7 131.4 7.5 38.3 -18.6 1228 405 B Y E -UV11871235d 2 -41,-3.2 -41,-2.6 -2,-0.4 7,-0.2 -0.851 9.2-147.7-104.3 140.0 10.2 38.2 -21.2 1229 406 B Q E >>> - V 01234d 26 5,-2.9 4,-1.7 -2,-0.4 5,-1.3 -0.877 11.2-170.0-108.9 96.1 9.7 36.6 -24.6 1230 407 B P T 345S+ 0 0 18 0, 0.0 -1,-0.1 0, 0.0 -44,-0.1 0.611 80.8 60.7 -64.8 -16.6 13.2 35.2 -25.6 1231 408 B L T 345S+ 0 0 49 -46,-0.3 -45,-0.1 1,-0.1 -359,-0.0 0.794 121.4 22.3 -82.5 -30.7 12.2 34.4 -29.1 1232 409 B T T <45S- 0 0 83 -3,-1.0 -1,-0.1 2,-0.2 3,-0.1 0.406 99.5-129.0-110.0 -3.4 11.3 38.0 -30.0 1233 410 B K T <5 + 0 0 78 -4,-1.7 2,-0.3 1,-0.2 -5,-0.0 0.902 69.5 119.4 56.7 41.7 13.5 39.6 -27.3 1234 411 B R E < -V 1229 0d 118 -5,-1.3 -5,-2.9 -17,-0.0 -1,-0.2 -0.908 67.7-107.1-132.5 158.0 10.5 41.7 -26.2 1235 412 B G E -V 1228 0d 4 -2,-0.3 2,-0.7 -7,-0.2 -7,-0.2 -0.553 42.7-100.4 -79.8 152.1 8.5 42.1 -23.0 1236 413 B N > - 0 0 27 -9,-2.7 4,-2.3 -2,-0.2 -9,-0.3 -0.659 32.1-165.8 -76.2 114.9 5.0 40.6 -22.8 1237 414 B N T 4 S+ 0 0 119 -2,-0.7 -1,-0.2 2,-0.2 4,-0.1 0.801 83.0 57.4 -73.4 -31.3 2.6 43.5 -23.4 1238 415 B D T 4 S+ 0 0 154 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.950 114.4 37.1 -66.8 -46.9 -0.6 41.7 -22.2 1239 416 B I T 4 S+ 0 0 42 1,-0.2 -2,-0.2 -12,-0.1 -1,-0.2 0.921 93.5 174.9 -72.1 -43.9 0.9 40.9 -18.8 1240 417 B G < - 0 0 16 -4,-2.3 -14,-2.4 -13,-0.1 -13,-0.5 -0.450 30.6 -61.0 74.3-148.8 2.7 44.2 -18.4 1241 418 B S S S+ 0 0 29 -16,-0.2 -16,-0.1 -15,-0.1 3,-0.1 -0.078 71.5 107.5-121.4-156.6 4.6 45.3 -15.4 1242 419 B G + 0 0 26 -18,-0.3 66,-2.9 1,-0.2 2,-0.9 0.559 42.8 124.2 91.8 8.3 4.0 46.1 -11.6 1243 420 B F B > -W 1307 0e 4 -19,-0.4 3,-1.6 65,-0.2 -1,-0.2 -0.878 52.2-154.1 -97.1 105.5 5.7 43.2 -9.9 1244 421 B N T 3 S+ 0 0 16 62,-1.6 4,-0.3 -2,-0.9 66,-0.2 0.557 82.6 58.1 -75.0 -5.0 8.0 45.2 -7.7 1245 422 B D T >> S+ 0 0 0 64,-0.6 4,-0.9 61,-0.2 3,-0.7 0.719 86.4 84.0 -84.5 -21.1 10.8 42.6 -7.2 1246 423 B D H X> S+ 0 0 0 -3,-1.6 3,-1.1 1,-0.2 4,-0.5 0.887 82.5 54.1 -50.6 -48.6 11.5 42.3 -10.9 1247 424 B P H >> S+ 0 0 2 0, 0.0 3,-1.1 0, 0.0 4,-0.5 0.828 102.0 58.2 -61.2 -34.0 13.8 45.4 -11.4 1248 425 B L H X> S+ 0 0 0 -3,-0.7 4,-1.5 -4,-0.3 3,-0.8 0.781 92.6 68.3 -65.8 -26.2 16.3 44.4 -8.7 1249 426 B W H + 0 0 37 -6,-0.4 3,-1.7 1,-0.2 4,-0.2 -0.393 11.9 160.4 -79.0 72.8 34.0 42.2 -18.0 1264 441 B F G > + 0 0 64 -2,-2.2 3,-1.6 1,-0.3 4,-0.3 0.682 62.0 81.9 -63.4 -15.5 33.1 45.6 -16.5 1265 442 B S G > S+ 0 0 58 1,-0.3 3,-1.5 2,-0.2 4,-0.5 0.728 72.3 74.5 -67.2 -19.5 32.7 46.9 -20.1 1266 443 B I G X S+ 0 0 0 -3,-1.7 3,-1.2 1,-0.3 17,-0.4 0.849 86.3 65.9 -59.9 -28.2 29.2 45.5 -20.3 1267 444 B L G < S+ 0 0 4 -3,-1.6 17,-2.4 1,-0.3 18,-0.3 0.715 99.4 51.0 -67.3 -21.4 28.2 48.4 -18.0 1268 445 B D G < S+ 0 0 94 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.507 80.6 121.6 -92.6 -7.2 29.1 50.8 -20.9 1269 446 B E S < S- 0 0 66 -3,-1.2 14,-1.5 -4,-0.5 2,-0.3 -0.358 71.9-113.2 -58.6 136.8 26.9 49.0 -23.5 1270 447 B P E +X 1282 0f 84 0, 0.0 10,-0.1 0, 0.0 -1,-0.1 -0.556 43.1 179.3 -68.6 123.0 24.2 51.3 -25.1 1271 448 B V E -X 1281 0f 0 10,-2.4 10,-2.3 -2,-0.3 -58,-0.0 -0.982 16.3-144.1-139.0 123.0 20.8 49.9 -24.0 1272 449 B P - 0 0 16 0, 0.0 2,-0.4 0, 0.0 -54,-0.2 -0.123 19.3-115.4 -78.4 172.2 17.4 51.3 -24.9 1273 450 B F S > S- 0 0 12 3,-0.4 3,-2.1 1,-0.2 -54,-0.2 -0.953 94.1 -7.5-109.0 133.4 14.3 51.4 -22.7 1274 451 B D T 3 S- 0 0 62 -56,-2.5 -57,-0.2 -2,-0.4 -1,-0.2 0.860 122.0 -72.2 49.2 39.5 11.3 49.4 -23.8 1275 452 B N T 3 S+ 0 0 38 -59,-3.0 -1,-0.3 -57,-0.2 -58,-0.1 0.756 87.2 158.5 50.8 33.0 13.2 48.7 -27.0 1276 453 B E X - 0 0 121 -3,-2.1 3,-1.9 -60,-0.2 -3,-0.4 -0.780 43.6-122.7 -92.9 117.1 12.6 52.3 -28.2 1277 454 B P T 3 S+ 0 0 105 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 -0.300 96.9 23.9 -57.4 135.0 15.2 53.4 -30.9 1278 455 B G T 3 S+ 0 0 71 1,-0.0 -2,-0.0 3,-0.0 0, 0.0 0.350 96.2 95.6 93.9 -8.3 17.1 56.5 -29.7 1279 456 B S < + 0 0 31 -3,-1.9 -8,-0.1 -6,-0.1 -5,-0.0 0.425 52.2 142.7 -94.2 0.8 16.5 55.9 -25.9 1280 457 B E + 0 0 89 -4,-0.2 3,-0.0 -8,-0.1 -64,-0.0 -0.097 17.7 163.8 -51.3 129.1 19.9 54.1 -25.4 1281 458 B V E -X 1271 0f 30 -10,-2.3 -10,-2.4 -12,-0.1 5,-0.1 -0.941 48.9 -73.7-131.5 164.7 21.7 54.8 -22.2 1282 459 B P E >> -X 1270 0f 55 0, 0.0 4,-1.2 0, 0.0 3,-0.6 -0.164 40.8-119.0 -53.1 144.9 24.6 52.8 -20.6 1283 460 B L H >> S+ 0 0 0 -14,-1.5 4,-1.6 -17,-0.4 3,-0.6 0.900 116.3 63.1 -49.5 -40.3 23.6 49.5 -19.1 1284 461 B F H 3> S+ 0 0 9 -17,-2.4 4,-2.1 1,-0.2 3,-0.3 0.912 96.0 57.6 -53.2 -40.6 24.9 51.0 -15.8 1285 462 B E H <> S+ 0 0 64 -3,-0.6 4,-2.1 -18,-0.3 -1,-0.2 0.863 102.1 55.6 -61.8 -35.4 22.1 53.6 -16.0 1286 463 B H H < S+ 0 0 2 -4,-1.2 3,-0.9 -3,-0.4 11,-0.2 0.900 111.0 55.5 -65.8 -43.2 12.7 50.6 -5.0 1295 472 B V H 3< S+ 0 0 13 -4,-1.8 3,-0.4 1,-0.2 -1,-0.2 0.884 112.8 42.0 -54.6 -40.5 13.8 53.8 -3.3 1296 473 B T H 3< S+ 0 0 98 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.457 111.0 59.8 -88.6 -3.5 10.9 55.7 -4.7 1297 474 B H S << S+ 0 0 64 -3,-0.9 8,-2.7 -4,-0.5 2,-0.3 -0.338 72.5 127.5-122.9 55.4 8.4 52.9 -4.1 1298 475 B R B -Y 1304 0g 86 -3,-0.4 42,-0.0 6,-0.3 5,-0.0 -0.747 45.2-136.2-109.4 156.1 8.4 52.2 -0.3 1299 476 B G > - 0 0 16 4,-2.9 3,-2.7 -2,-0.3 -1,-0.1 -0.224 46.0 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