==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-JUL-03 1PXJ . COMPND 2 MOLECULE: CELL DIVISION PROTEIN KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.Y.WU,I.MCNAE,G.KONTOPIDIS,S.J.MCCLUE,C.MCINNES, . 294 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14539.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 185 62.9 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 . 41 13.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 19 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 26.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 1 0 1 0 0 2 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 . 1 1 1 0 1 2 0 1 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 52 0, 0.0 3,-3.1 0, 0.0 66,-0.0 0.000 360.0 360.0 360.0 143.4 26.4 57.1 23.3 2 2 A E T 3 + 0 0 146 1,-0.3 22,-0.1 3,-0.0 0, 0.0 0.773 360.0 54.5 -34.9 -49.2 26.5 60.7 22.0 3 3 A N T 3 S+ 0 0 66 20,-0.1 21,-2.7 1,-0.1 2,-0.4 0.403 103.4 69.2 -74.0 3.9 24.0 60.1 19.2 4 4 A F E < -A 23 0A 15 -3,-3.1 2,-0.7 19,-0.2 19,-0.2 -0.976 59.2-162.7-132.2 128.5 21.4 58.7 21.6 5 5 A Q E -A 22 0A 87 17,-2.0 17,-1.4 -2,-0.4 2,-0.1 -0.901 25.6-134.5-106.5 108.6 19.3 60.3 24.4 6 6 A K E -A 21 0A 74 -2,-0.7 15,-0.3 15,-0.2 3,-0.1 -0.383 20.3-174.4 -61.3 133.2 17.9 57.7 26.8 7 7 A V E - 0 0 66 13,-2.7 2,-0.3 1,-0.4 14,-0.2 0.780 63.0 -30.6 -97.9 -35.5 14.2 58.4 27.5 8 8 A E E -A 20 0A 113 12,-1.4 12,-2.7 0, 0.0 2,-0.4 -0.979 64.2 -89.0-172.7 165.9 13.8 55.7 30.1 9 9 A K E -A 19 0A 109 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.745 27.3-170.9 -87.4 129.6 14.9 52.3 31.4 10 10 A I E - 0 0 81 8,-3.1 2,-0.3 -2,-0.4 9,-0.2 0.579 57.0 -73.0 -95.8 -12.7 12.8 49.5 29.8 11 11 A G E -A 18 0A 26 7,-1.1 7,-2.7 2,-0.0 2,-0.6 -0.853 50.8 -65.0 146.9 177.6 14.3 46.8 32.1 12 12 A E E -A 17 0A 66 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.904 50.6-162.2-104.6 115.6 17.2 44.6 33.1 13 13 A G E > -A 16 0A 18 3,-2.5 3,-1.3 -2,-0.6 143,-0.3 -0.415 34.6-102.7 -93.5 172.1 18.1 42.1 30.4 14 14 A T T 3 S+ 0 0 17 1,-0.3 142,-0.3 -2,-0.1 3,-0.1 0.823 124.3 35.2 -60.4 -31.7 20.1 38.9 30.5 15 15 A Y T 3 S- 0 0 20 1,-0.3 21,-0.6 140,-0.1 -1,-0.3 0.160 130.0 -59.9-110.9 18.4 23.0 40.8 28.9 16 16 A G E < S-A 13 0A 7 -3,-1.3 -3,-2.5 19,-0.2 -1,-0.3 -0.756 77.9 -29.3 134.3 178.8 22.6 44.2 30.4 17 17 A V E -A 12 0A 24 -2,-0.2 17,-1.8 -5,-0.2 2,-0.5 -0.445 50.6-146.6 -72.3 141.8 20.3 47.2 30.9 18 18 A V E -AB 11 33A 17 -7,-2.7 -8,-3.1 15,-0.2 -7,-1.1 -0.950 16.7-170.8-113.6 122.6 17.8 48.0 28.1 19 19 A Y E -AB 9 32A 44 13,-3.1 13,-3.3 -2,-0.5 2,-0.5 -0.868 24.5-133.1-115.0 145.3 16.9 51.6 27.4 20 20 A K E +AB 8 31A 44 -12,-2.7 -13,-2.7 -2,-0.3 -12,-1.4 -0.815 46.2 170.6 -87.8 134.2 14.3 53.2 25.2 21 21 A A E -AB 6 30A 0 9,-2.6 9,-3.1 -2,-0.5 2,-0.5 -0.939 34.1-127.1-145.2 167.5 16.2 55.9 23.4 22 22 A R E -AB 5 29A 95 -17,-1.4 -17,-2.0 -2,-0.3 2,-0.5 -0.977 21.1-131.7-123.4 125.0 16.0 58.4 20.6 23 23 A N E >> -A 4 0A 15 5,-2.8 4,-2.8 -2,-0.5 3,-0.8 -0.617 15.3-152.6 -72.0 120.0 18.5 58.6 17.8 24 24 A K T 34 S+ 0 0 135 -21,-2.7 -1,-0.2 -2,-0.5 -20,-0.1 0.746 91.3 47.6 -68.4 -25.4 19.4 62.3 17.5 25 25 A L T 34 S+ 0 0 117 -22,-0.4 -1,-0.2 1,-0.1 -21,-0.1 0.487 127.7 23.1 -95.9 -3.2 20.3 62.1 13.8 26 26 A T T <4 S- 0 0 92 -3,-0.8 -2,-0.2 2,-0.2 3,-0.1 0.519 89.9-132.8-131.5 -22.3 17.2 60.2 12.7 27 27 A G < + 0 0 39 -4,-2.8 2,-0.2 1,-0.3 -3,-0.1 0.449 57.7 140.9 79.5 -1.1 14.6 60.9 15.3 28 28 A E - 0 0 111 -5,-0.1 -5,-2.8 -6,-0.1 2,-0.4 -0.520 49.9-132.9 -77.3 141.1 13.8 57.2 15.5 29 29 A V E +B 22 0A 30 -7,-0.2 50,-0.6 -2,-0.2 -7,-0.3 -0.766 36.5 170.5 -92.5 140.8 13.1 55.7 18.9 30 30 A V E -BC 21 78A 3 -9,-3.1 -9,-2.6 -2,-0.4 2,-0.6 -0.825 39.8-103.7-141.3 178.0 14.9 52.5 19.6 31 31 A A E -BC 20 77A 8 46,-2.8 46,-3.3 -2,-0.2 2,-0.4 -0.955 36.9-162.8-111.1 113.1 15.8 49.9 22.2 32 32 A L E -BC 19 76A 2 -13,-3.3 -13,-3.1 -2,-0.6 2,-0.4 -0.840 4.5-168.4-101.1 131.6 19.4 50.3 23.2 33 33 A K E -BC 18 75A 25 42,-2.8 42,-2.8 -2,-0.4 2,-0.5 -0.977 9.5-152.0-124.1 130.5 21.2 47.4 25.0 34 34 A K E - C 0 74A 63 -17,-1.8 2,-0.5 -2,-0.4 40,-0.2 -0.850 11.8-153.1 -99.3 132.8 24.5 47.7 26.8 35 35 A I E C 0 73A 3 38,-2.9 38,-0.9 -2,-0.5 -19,-0.2 -0.938 360.0 360.0-112.1 123.3 26.6 44.5 27.0 36 36 A R 0 0 143 -21,-0.6 -1,-0.1 -2,-0.5 -20,-0.1 0.541 360.0 360.0 49.4 360.0 29.1 44.0 29.8 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 41 A T 0 0 162 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 91.2 35.7 42.7 30.9 39 42 A E - 0 0 181 32,-0.0 32,-0.0 3,-0.0 0, 0.0 0.667 360.0 -85.7-116.3 -37.9 38.4 42.1 28.3 40 43 A G S S- 0 0 17 2,-0.0 32,-0.1 31,-0.0 31,-0.1 0.412 74.3 -72.4 135.8 15.9 37.3 44.4 25.4 41 44 A V - 0 0 37 30,-0.1 31,-0.0 -5,-0.0 2,-0.0 0.842 56.9-106.9 68.4 110.9 34.9 42.2 23.6 42 45 A P >> - 0 0 76 0, 0.0 4,-1.5 0, 0.0 3,-0.5 -0.324 20.7-119.6 -67.5 146.4 36.4 39.2 21.6 43 46 A S H 3> S+ 0 0 69 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.881 112.0 61.8 -50.7 -44.6 36.5 39.3 17.8 44 47 A T H 3> S+ 0 0 80 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.907 102.5 49.2 -50.1 -49.8 34.3 36.2 17.7 45 48 A A H <> S+ 0 0 2 -3,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.893 109.6 54.1 -58.8 -39.9 31.4 37.9 19.5 46 49 A I H X S+ 0 0 36 -4,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.893 110.3 44.2 -62.2 -43.6 31.8 40.8 17.0 47 50 A R H X S+ 0 0 130 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.877 111.5 53.0 -71.3 -37.6 31.5 38.6 13.9 48 51 A E H X S+ 0 0 56 -4,-2.3 4,-1.3 -5,-0.2 3,-0.3 0.962 112.7 45.1 -60.8 -50.8 28.6 36.6 15.3 49 52 A I H X S+ 0 0 1 -4,-2.3 4,-0.9 1,-0.2 3,-0.3 0.884 108.5 56.4 -59.8 -41.6 26.6 39.8 16.0 50 53 A S H >< S+ 0 0 41 -4,-2.0 3,-0.7 1,-0.3 4,-0.4 0.873 103.3 55.4 -60.1 -35.8 27.5 41.2 12.6 51 54 A L H >X S+ 0 0 105 -4,-1.8 3,-1.6 -3,-0.3 4,-0.9 0.878 101.5 58.6 -63.7 -35.5 26.0 38.2 11.0 52 55 A L H 3< S+ 0 0 8 -4,-1.3 11,-0.3 -3,-0.3 -1,-0.2 0.760 89.9 71.0 -65.9 -23.5 22.8 38.9 13.0 53 56 A K T << S+ 0 0 75 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.721 102.0 47.2 -65.7 -18.3 22.6 42.3 11.3 54 57 A E T <4 S+ 0 0 138 -3,-1.6 2,-2.0 -4,-0.4 -1,-0.2 0.781 85.0 85.9 -95.8 -32.0 21.7 40.4 8.1 55 58 A L < + 0 0 19 -4,-0.9 2,-0.4 -3,-0.0 8,-0.1 -0.509 61.7 170.1 -76.9 89.2 19.0 38.0 9.2 56 59 A N + 0 0 69 -2,-2.0 5,-0.1 6,-0.1 -3,-0.0 -0.781 5.6 155.4-101.5 141.7 16.0 40.2 8.8 57 60 A H > - 0 0 46 3,-0.5 3,-1.9 -2,-0.4 5,-0.0 -0.965 51.4-112.9-161.0 149.3 12.4 39.1 9.0 58 61 A P T 3 S+ 0 0 93 0, 0.0 4,-0.1 0, 0.0 53,-0.0 0.750 118.5 45.7 -58.4 -25.5 9.0 40.7 9.8 59 62 A N T 3 S+ 0 0 11 80,-0.1 81,-2.8 48,-0.1 2,-0.5 0.220 98.6 80.9-105.5 15.6 8.8 38.5 12.9 60 63 A I B < S-e 140 0B 8 -3,-1.9 -3,-0.5 79,-0.3 2,-0.2 -0.988 90.0-113.2-121.3 124.8 12.3 39.1 14.2 61 64 A V - 0 0 8 79,-2.9 82,-0.2 -2,-0.5 81,-0.1 -0.418 42.9-115.1 -58.5 119.9 13.1 42.3 16.0 62 65 A K - 0 0 95 -2,-0.2 16,-2.7 -4,-0.1 2,-0.9 -0.357 13.8-138.5 -65.9 131.0 15.4 44.2 13.7 63 66 A L E -D 77 0A 10 -11,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.816 23.5-176.4 -89.0 105.4 19.0 44.8 14.8 64 67 A L E - 0 0 43 12,-1.7 2,-0.3 -2,-0.9 13,-0.2 0.932 56.6 -8.6 -71.6 -51.1 19.5 48.4 13.7 65 68 A D E -D 76 0A 81 11,-1.4 11,-2.8 2,-0.0 2,-0.5 -0.994 47.7-144.4-151.8 156.2 23.1 49.0 14.6 66 69 A V E -D 75 0A 32 -2,-0.3 2,-0.7 9,-0.2 9,-0.2 -0.967 21.0-167.0-123.4 110.2 26.1 47.5 16.4 67 70 A I E -D 74 0A 27 7,-2.5 7,-1.9 -2,-0.5 2,-0.8 -0.878 10.0-179.7-106.4 110.7 28.2 50.2 18.1 68 71 A H E +D 73 0A 84 -2,-0.7 2,-0.3 5,-0.2 5,-0.2 -0.869 25.2 151.1-108.2 95.7 31.6 49.1 19.4 69 72 A T E > +D 72 0A 53 3,-1.3 3,-1.0 -2,-0.8 -2,-0.1 -0.965 60.1 3.0-130.1 146.7 33.1 52.2 21.0 70 73 A E T 3 S- 0 0 155 -2,-0.3 -1,-0.2 1,-0.3 3,-0.1 0.870 129.0 -61.3 48.4 41.4 35.6 52.7 23.8 71 74 A N T 3 S+ 0 0 113 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.901 113.1 120.6 52.2 45.5 35.9 48.9 24.0 72 75 A K E < - D 0 69A 58 -3,-1.0 -3,-1.3 -32,-0.1 2,-0.5 -0.978 57.3-134.6-136.7 147.7 32.2 48.7 24.9 73 76 A L E +CD 35 68A 1 -38,-0.9 -38,-2.9 -2,-0.3 2,-0.4 -0.921 23.5 173.3-112.2 124.4 29.4 46.9 23.1 74 77 A Y E -CD 34 67A 47 -7,-1.9 -7,-2.5 -2,-0.5 2,-0.5 -0.994 13.5-159.1-127.8 129.2 26.0 48.5 22.5 75 78 A L E -CD 33 66A 2 -42,-2.8 -42,-2.8 -2,-0.4 2,-0.6 -0.929 4.5-155.5-111.4 132.3 23.2 47.0 20.4 76 79 A V E -CD 32 65A 2 -11,-2.8 -12,-1.7 -2,-0.5 -11,-1.4 -0.932 18.3-176.8-109.4 121.2 20.5 49.1 18.9 77 80 A F E -CD 31 63A 9 -46,-3.3 -46,-2.8 -2,-0.6 -14,-0.2 -0.804 36.0 -93.2-117.7 157.7 17.2 47.4 18.2 78 81 A E E -C 30 0A 50 -16,-2.7 2,-0.4 -2,-0.3 -48,-0.2 -0.378 51.7-121.2 -59.5 143.7 13.9 48.3 16.6 79 82 A F - 0 0 35 -50,-0.6 2,-0.4 -58,-0.1 -50,-0.1 -0.802 29.0-175.3-100.1 133.5 11.6 49.3 19.5 80 83 A L - 0 0 15 -2,-0.4 53,-0.1 53,-0.1 52,-0.0 -0.967 26.9-130.2-123.3 141.9 8.2 47.6 20.3 81 84 A H S S+ 0 0 92 -2,-0.4 2,-0.3 51,-0.1 52,-0.1 0.595 78.2 15.1 -70.9 -12.5 5.8 48.9 22.9 82 85 A Q E -F 132 0B 22 50,-1.0 50,-2.9 213,-0.1 2,-0.2 -0.998 58.7-134.6-161.2 155.4 5.2 45.7 24.9 83 86 A D E > -F 131 0B 26 -2,-0.3 4,-2.0 48,-0.3 48,-0.2 -0.703 34.8-111.0-106.7 163.6 6.2 42.1 25.6 84 87 A L H > S+ 0 0 0 46,-2.4 4,-2.5 43,-1.0 44,-0.2 0.741 112.4 64.8 -63.9 -26.1 4.0 39.1 25.8 85 88 A K H > S+ 0 0 71 42,-0.8 4,-2.6 45,-0.2 -1,-0.2 0.980 108.1 36.8 -61.8 -58.1 4.6 38.8 29.6 86 89 A K H > S+ 0 0 98 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.907 116.1 55.4 -61.1 -42.9 2.9 42.1 30.4 87 90 A F H X S+ 0 0 8 -4,-2.0 4,-0.6 2,-0.2 -1,-0.2 0.909 109.4 46.9 -57.9 -42.4 0.3 41.5 27.8 88 91 A M H >< S+ 0 0 19 -4,-2.5 3,-1.8 2,-0.2 4,-0.2 0.959 110.6 50.6 -64.5 -50.6 -0.5 38.2 29.4 89 92 A D H >< S+ 0 0 91 -4,-2.6 3,-1.0 1,-0.3 -1,-0.2 0.878 111.0 51.3 -53.8 -37.6 -0.7 39.6 32.9 90 93 A A H 3< S+ 0 0 81 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.621 112.3 45.9 -75.7 -13.0 -3.0 42.3 31.5 91 94 A S T > - 0 0 78 0, 0.0 4,-2.2 0, 0.0 3,-1.2 -0.302 25.5-121.3 -57.1 135.2 -8.5 35.1 22.8 98 101 A L H 3> S+ 0 0 68 1,-0.3 4,-3.2 2,-0.2 5,-0.3 0.838 111.2 58.3 -45.2 -45.5 -7.7 31.9 21.0 99 102 A P H 3> S+ 0 0 69 0, 0.0 4,-1.8 0, 0.0 188,-0.4 0.888 110.8 43.6 -55.5 -38.4 -7.7 33.5 17.5 100 103 A L H <> S+ 0 0 8 -3,-1.2 4,-2.8 2,-0.2 -2,-0.2 0.876 111.3 54.0 -74.8 -35.8 -5.0 35.9 18.8 101 104 A I H X S+ 0 0 6 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.940 110.6 46.8 -61.3 -45.3 -3.1 33.0 20.4 102 105 A K H X S+ 0 0 11 -4,-3.2 4,-2.7 2,-0.2 -1,-0.2 0.881 111.2 51.8 -64.1 -39.9 -3.1 31.2 17.1 103 106 A S H X S+ 0 0 3 -4,-1.8 4,-2.2 -5,-0.3 -2,-0.2 0.948 112.1 45.7 -62.6 -49.1 -2.0 34.3 15.2 104 107 A Y H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.931 114.4 46.9 -60.9 -47.8 0.9 34.9 17.6 105 108 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.931 111.5 53.3 -60.2 -43.8 2.0 31.2 17.6 106 109 A F H X S+ 0 0 56 -4,-2.7 4,-1.1 -5,-0.2 -1,-0.2 0.877 112.1 43.4 -58.6 -41.7 1.8 31.2 13.8 107 110 A Q H X S+ 0 0 8 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.894 110.9 54.5 -73.0 -40.1 4.0 34.3 13.4 108 111 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.936 107.2 51.1 -58.8 -45.5 6.5 33.1 16.0 109 112 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.830 107.8 53.6 -61.2 -32.4 6.9 29.8 14.1 110 113 A Q H X S+ 0 0 64 -4,-1.1 4,-1.9 2,-0.2 -1,-0.2 0.943 109.9 46.6 -67.5 -46.2 7.5 31.8 10.9 111 114 A G H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.909 114.7 47.9 -60.8 -41.6 10.3 33.8 12.6 112 115 A L H X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 5,-0.3 0.915 107.8 54.2 -66.0 -43.6 11.7 30.5 13.9 113 116 A A H X S+ 0 0 15 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.868 110.4 48.7 -59.3 -35.9 11.5 28.8 10.5 114 117 A F H X S+ 0 0 47 -4,-1.9 4,-0.6 2,-0.2 -2,-0.2 0.953 115.2 40.8 -68.6 -52.9 13.5 31.7 9.0 115 118 A C H ><>S+ 0 0 0 -4,-2.2 5,-2.6 1,-0.2 3,-1.3 0.929 115.5 51.5 -62.3 -46.6 16.3 31.8 11.6 116 119 A H H ><5S+ 0 0 26 -4,-3.1 3,-1.9 1,-0.3 -1,-0.2 0.855 102.6 59.3 -59.8 -36.5 16.5 28.0 11.8 117 120 A S H 3<5S+ 0 0 73 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.730 108.1 47.4 -66.0 -18.7 16.8 27.8 8.0 118 121 A H T <<5S- 0 0 86 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.266 121.0-111.9-101.6 8.2 19.9 29.9 8.4 119 122 A R T < 5S+ 0 0 196 -3,-1.9 2,-0.5 1,-0.2 -3,-0.2 0.703 75.8 132.3 70.3 21.2 21.2 27.7 11.3 120 123 A V < - 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