==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 10-NOV-11 3ULI . COMPND 2 MOLECULE: CYCLIN-DEPENDENT KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.A.LARSEN,J.A.TUCKER,T.WANG . 285 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14464.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 176 61.8 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 . 40 14.0 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 . 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 . 17 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 26.7 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+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 2 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 . 0 1 1 0 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 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 42 0, 0.0 3,-0.2 0, 0.0 65,-0.0 0.000 360.0 360.0 360.0 4.0 -12.8 30.6 -2.8 2 2 A E + 0 0 137 1,-0.2 22,-0.0 3,-0.1 0, 0.0 0.697 360.0 57.5 -84.3 -25.0 -13.3 31.0 -6.6 3 3 A N S S+ 0 0 81 21,-0.1 21,-2.7 20,-0.1 22,-0.7 0.473 99.8 79.7 -80.6 -4.4 -10.6 33.7 -6.5 4 4 A F E -A 23 0A 18 19,-0.2 2,-0.5 -3,-0.2 19,-0.2 -0.765 59.5-155.8-119.3 155.8 -8.0 31.3 -5.0 5 5 A Q E -A 22 0A 83 17,-1.0 17,-1.5 -2,-0.3 2,-0.1 -0.910 24.5-133.3-132.7 97.1 -5.8 28.6 -6.2 6 6 A K E +A 21 0A 112 -2,-0.5 15,-0.3 15,-0.2 3,-0.1 -0.329 27.0 176.1 -59.5 122.2 -4.7 26.0 -3.6 7 7 A V E - 0 0 56 13,-3.3 2,-0.3 1,-0.4 14,-0.2 0.893 59.6 -29.6 -96.6 -56.4 -1.0 25.5 -3.8 8 8 A E E -A 20 0A 119 12,-1.3 12,-2.7 0, 0.0 2,-0.4 -0.968 62.2 -99.4-160.3 155.5 -0.2 23.1 -0.9 9 9 A K E +A 19 0A 121 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.676 38.8 170.8 -77.6 127.5 -1.6 22.3 2.5 10 10 A I E - 0 0 72 8,-2.5 2,-0.3 -2,-0.4 9,-0.2 0.370 57.1 -2.1-117.9 -1.1 0.6 24.1 5.1 11 11 A G E -A 18 0A 29 7,-1.2 7,-2.4 2,-0.0 2,-0.3 -0.988 49.0-155.5-179.2 167.6 -1.3 23.5 8.3 12 12 A E E +A 17 0A 118 -2,-0.3 5,-0.2 5,-0.3 2,-0.2 -0.986 13.2 165.6-156.9 149.1 -4.4 22.2 10.2 13 13 A G - 0 0 31 3,-2.6 3,-0.1 -2,-0.3 -2,-0.0 -0.747 54.7 -81.0-143.9-161.7 -6.3 22.8 13.5 14 14 A T S S+ 0 0 115 -2,-0.2 3,-0.1 1,-0.2 22,-0.0 0.873 125.9 46.6 -75.2 -36.3 -9.6 21.9 15.1 15 15 A Y S S- 0 0 47 1,-0.2 21,-3.3 129,-0.1 2,-0.3 0.479 124.1 -55.8 -87.9 -4.3 -11.5 24.6 13.2 16 16 A G E - B 0 35A 11 19,-0.3 -3,-2.6 -3,-0.1 2,-0.3 -0.956 56.0 -68.4 157.6-173.3 -10.1 23.9 9.7 17 17 A V E -AB 12 34A 28 17,-1.3 17,-3.2 -2,-0.3 2,-0.4 -0.737 33.6-140.1-112.8 154.8 -7.2 23.4 7.3 18 18 A V E -AB 11 33A 29 -7,-2.4 -8,-2.5 -2,-0.3 -7,-1.2 -0.981 16.4-169.2-122.8 129.3 -4.8 26.1 6.0 19 19 A Y E -AB 9 32A 45 13,-2.6 13,-3.2 -2,-0.4 2,-0.4 -0.939 28.0-126.2-117.9 137.5 -3.5 26.3 2.4 20 20 A K E +AB 8 31A 45 -12,-2.7 -13,-3.3 -2,-0.4 -12,-1.3 -0.681 50.5 174.6 -66.2 133.4 -0.8 28.2 0.7 21 21 A A E -AB 6 30A 0 9,-2.5 9,-3.0 -2,-0.4 2,-0.5 -0.967 32.0-133.1-149.1 153.9 -2.8 29.8 -2.1 22 22 A R E -AB 5 29A 99 -17,-1.5 -17,-1.0 -2,-0.3 2,-0.9 -0.966 26.1-122.9-116.9 126.3 -2.5 32.3 -5.0 23 23 A N E > -A 4 0A 20 5,-3.5 4,-2.2 -2,-0.5 -19,-0.2 -0.579 17.9-155.0 -68.6 103.0 -5.1 35.0 -5.5 24 24 A K T 4 S+ 0 0 132 -21,-2.7 -1,-0.2 -2,-0.9 -20,-0.1 0.818 92.8 46.8 -46.8 -40.0 -6.2 34.3 -9.2 25 25 A L T 4 S+ 0 0 71 -22,-0.7 -1,-0.2 1,-0.1 -21,-0.1 0.999 126.5 19.5 -62.8 -67.6 -7.2 37.9 -9.4 26 26 A T T 4 S- 0 0 88 -23,-0.1 2,-0.2 2,-0.1 -2,-0.2 0.173 89.8-119.4-104.2 9.8 -4.3 39.7 -7.9 27 27 A G < + 0 0 51 -4,-2.2 -3,-0.1 1,-0.2 -1,-0.1 0.119 63.5 147.9 73.4 -25.9 -1.1 37.5 -8.0 28 28 A E - 0 0 85 -2,-0.2 -5,-3.5 -5,-0.1 2,-0.4 -0.127 42.6-143.0 -42.7 127.1 -1.0 37.7 -4.2 29 29 A V E +B 22 0A 60 -7,-0.2 49,-0.6 -3,-0.1 2,-0.3 -0.847 34.3 163.0 -99.8 130.7 0.3 34.6 -2.3 30 30 A V E -BC 21 77A 0 -9,-3.0 -9,-2.5 -2,-0.4 2,-0.6 -0.881 44.9-110.6-144.1 166.3 -1.5 34.0 0.9 31 31 A A E -BC 20 76A 10 45,-3.0 45,-3.3 -2,-0.3 2,-0.6 -0.962 36.3-159.8-105.3 117.2 -2.3 31.5 3.7 32 32 A L E -BC 19 75A 3 -13,-3.2 -13,-2.6 -2,-0.6 2,-0.7 -0.897 4.4-156.2-106.6 113.1 -6.0 30.6 3.4 33 33 A K E -BC 18 74A 9 41,-3.6 41,-2.2 -2,-0.6 2,-0.9 -0.803 4.8-155.2 -88.3 115.2 -7.8 29.1 6.4 34 34 A K E -BC 17 73A 63 -17,-3.2 -17,-1.3 -2,-0.7 2,-0.4 -0.827 14.9-148.1 -89.8 102.5 -10.8 26.9 5.4 35 35 A I E -BC 16 72A 10 37,-1.9 2,-1.1 -2,-0.9 37,-0.6 -0.604 6.8-137.4 -74.3 123.3 -13.0 27.0 8.5 36 36 A R + 0 0 79 -21,-3.3 2,-0.2 -2,-0.4 -1,-0.1 -0.720 31.3 171.7 -87.7 97.4 -15.1 23.8 9.0 37 37 A L 0 0 45 -2,-1.1 35,-0.0 33,-0.1 -22,-0.0 -0.677 360.0 360.0 -97.2 159.6 -18.6 24.8 10.0 38 38 A D 0 0 140 -2,-0.2 -1,-0.0 0, 0.0 0, 0.0 -0.558 360.0 360.0-109.9 360.0 -21.5 22.2 10.2 39 ! 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 40 44 A V 0 0 77 0, 0.0 5,-0.1 0, 0.0 31,-0.1 0.000 360.0 360.0 360.0 -57.8 -22.6 30.1 10.2 41 45 A P > - 0 0 58 0, 0.0 4,-1.2 0, 0.0 3,-0.3 -0.192 360.0-148.4 -50.4 122.7 -22.9 31.4 13.8 42 46 A S H > S+ 0 0 70 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.832 95.5 57.4 -63.4 -40.4 -23.4 35.2 13.8 43 47 A T H > S+ 0 0 87 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.856 104.9 53.1 -55.8 -40.1 -21.6 35.7 17.2 44 48 A A H > S+ 0 0 2 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.854 106.0 54.4 -64.2 -36.7 -18.5 34.0 15.7 45 49 A I H X S+ 0 0 41 -4,-1.2 4,-2.0 2,-0.2 -2,-0.2 0.902 107.6 47.4 -64.0 -45.0 -18.6 36.4 12.7 46 50 A R H X S+ 0 0 168 -4,-1.7 4,-0.8 1,-0.2 -1,-0.2 0.784 111.4 53.6 -70.4 -28.4 -18.5 39.6 14.9 47 51 A E H X S+ 0 0 43 -4,-1.3 4,-0.8 2,-0.2 3,-0.3 0.896 108.8 46.6 -70.0 -46.2 -15.7 38.0 16.9 48 52 A I H >X S+ 0 0 1 -4,-1.9 3,-0.9 1,-0.2 4,-0.8 0.887 106.4 59.1 -64.3 -38.7 -13.5 37.4 13.8 49 53 A S H 3< S+ 0 0 56 -4,-2.0 3,-0.4 1,-0.3 4,-0.2 0.790 98.7 59.7 -63.4 -28.6 -14.2 40.8 12.5 50 54 A L H >X S+ 0 0 104 -4,-0.8 3,-1.2 -3,-0.3 4,-0.6 0.826 98.5 59.2 -60.5 -34.4 -12.6 42.1 15.7 51 55 A L H << S+ 0 0 18 -3,-0.9 3,-0.4 -4,-0.8 11,-0.3 0.728 91.1 67.5 -73.0 -21.2 -9.4 40.3 14.7 52 56 A K T 3< S+ 0 0 68 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.645 103.1 47.6 -66.2 -17.2 -9.2 42.4 11.5 53 57 A E T <4 S+ 0 0 147 -3,-1.2 2,-1.9 -4,-0.2 -1,-0.2 0.626 87.5 89.3 -95.2 -20.3 -8.5 45.4 13.7 54 58 A L < + 0 0 15 -4,-0.6 2,-0.5 -3,-0.4 8,-0.2 -0.582 62.4 165.9 -85.6 78.4 -5.9 43.7 15.9 55 59 A N + 0 0 71 -2,-1.9 5,-0.1 6,-0.1 6,-0.1 -0.879 4.3 147.2-109.4 129.3 -3.0 44.6 13.7 56 60 A H > - 0 0 49 -2,-0.5 3,-1.9 3,-0.4 54,-0.0 -0.987 55.8-116.8-158.1 146.5 0.6 44.4 14.7 57 61 A P T 3 S+ 0 0 91 0, 0.0 4,-0.1 0, 0.0 -1,-0.0 0.762 118.7 48.1 -58.9 -21.1 4.0 43.7 13.0 58 62 A N T 3 S+ 0 0 11 48,-0.1 81,-2.9 80,-0.1 2,-0.4 0.166 98.2 79.3-106.9 14.6 4.2 40.5 15.3 59 63 A I B < S-e 139 0B 7 -3,-1.9 -3,-0.4 79,-0.3 81,-0.2 -0.995 93.0-109.4-118.5 128.0 0.7 39.2 14.6 60 64 A V - 0 0 10 79,-3.1 2,-0.3 -2,-0.4 82,-0.1 -0.354 45.4-113.1 -56.3 127.1 0.1 37.3 11.3 61 65 A K - 0 0 93 -4,-0.1 16,-2.6 1,-0.1 2,-0.8 -0.498 16.5-142.2 -77.2 124.0 -2.0 39.8 9.3 62 66 A L E -D 76 0A 9 -2,-0.3 14,-0.3 -11,-0.3 3,-0.1 -0.762 20.1-175.3 -77.7 110.2 -5.6 38.8 8.6 63 67 A L E - 0 0 38 12,-3.4 2,-0.3 -2,-0.8 13,-0.2 0.970 59.1 -15.1 -75.2 -52.2 -6.1 40.2 5.0 64 68 A D E -D 75 0A 83 11,-1.3 11,-2.5 2,-0.0 2,-0.5 -0.957 49.8-136.0-150.5 160.1 -9.8 39.4 4.5 65 69 A V E -D 74 0A 30 -2,-0.3 2,-0.8 9,-0.2 9,-0.2 -0.996 21.3-161.7-120.2 119.7 -12.7 37.4 5.9 66 70 A I E +D 73 0A 42 7,-2.6 7,-1.5 -2,-0.5 2,-0.7 -0.868 11.8 177.2-112.1 99.9 -14.7 35.6 3.2 67 71 A H E +D 72 0A 83 -2,-0.8 2,-0.3 5,-0.2 5,-0.2 -0.906 27.9 134.5-104.7 108.8 -18.1 34.6 4.5 68 72 A T E > +D 71 0A 37 3,-2.3 3,-2.4 -2,-0.7 -2,-0.1 -0.990 57.3 17.0-161.4 146.5 -19.9 33.1 1.5 69 73 A E T 3 S- 0 0 135 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.785 128.3 -67.7 51.4 31.4 -22.1 30.1 0.5 70 74 A N T 3 S+ 0 0 119 1,-0.3 2,-0.3 -30,-0.1 -1,-0.3 0.740 114.8 115.8 54.7 29.2 -22.5 29.8 4.4 71 75 A K E < - D 0 68A 119 -3,-2.4 -3,-2.3 -31,-0.1 2,-0.4 -0.867 57.9-139.6-115.8 154.7 -18.7 28.9 4.6 72 76 A L E -CD 35 67A 5 -37,-0.6 -37,-1.9 -2,-0.3 2,-0.4 -0.964 18.5-179.3-118.6 132.4 -16.0 31.0 6.3 73 77 A Y E -CD 34 66A 36 -7,-1.5 -7,-2.6 -2,-0.4 2,-0.5 -0.973 13.7-152.8-126.0 144.1 -12.5 31.5 5.0 74 78 A L E -CD 33 65A 0 -41,-2.2 -41,-3.6 -2,-0.4 2,-0.7 -0.986 6.2-156.9-119.7 121.4 -9.7 33.5 6.6 75 79 A V E +CD 32 64A 2 -11,-2.5 -12,-3.4 -2,-0.5 -11,-1.3 -0.866 22.2 176.2-102.0 108.0 -7.1 35.0 4.3 76 80 A F E -CD 31 62A 27 -45,-3.3 -45,-3.0 -2,-0.7 -14,-0.2 -0.720 39.1 -88.5-106.6 155.7 -3.8 35.7 6.1 77 81 A E E -C 30 0A 50 -16,-2.6 2,-0.4 -2,-0.3 -47,-0.2 -0.363 48.3-126.4 -40.6 130.3 -0.3 36.9 5.3 78 82 A F - 0 0 35 -49,-0.6 2,-0.3 -57,-0.1 -49,-0.1 -0.821 23.8-169.2 -91.9 134.7 1.8 33.9 4.2 79 83 A L - 0 0 12 -2,-0.4 53,-0.1 53,-0.1 52,-0.0 -0.936 22.8-132.1-119.1 148.7 5.2 33.3 6.0 80 84 A H S S+ 0 0 132 -2,-0.3 2,-0.3 51,-0.3 52,-0.1 0.623 78.4 20.4 -85.2 -12.8 7.7 30.8 4.6 81 85 A Q E -F 131 0B 15 50,-1.1 50,-2.3 205,-0.0 2,-0.2 -0.989 60.8-136.6-150.4 159.1 8.5 28.9 7.8 82 86 A D E > -F 130 0B 40 -2,-0.3 4,-1.7 48,-0.2 48,-0.2 -0.676 32.3-113.3-110.0 167.3 7.4 28.0 11.4 83 87 A L H > S+ 0 0 0 46,-2.2 4,-3.1 43,-1.2 5,-0.2 0.793 112.8 60.5 -74.2 -27.5 9.5 27.9 14.5 84 88 A K H > S+ 0 0 85 42,-0.7 4,-3.0 45,-0.3 5,-0.2 0.965 108.6 41.6 -61.7 -52.3 9.1 24.2 14.9 85 89 A K H > S+ 0 0 119 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.892 116.6 50.1 -62.2 -38.6 10.8 23.5 11.6 86 90 A F H X S+ 0 0 11 -4,-1.7 4,-0.8 2,-0.2 -2,-0.2 0.924 111.6 47.5 -67.3 -42.8 13.4 26.1 12.3 87 91 A M H >< S+ 0 0 21 -4,-3.1 3,-0.7 2,-0.2 4,-0.3 0.909 112.8 49.3 -63.9 -43.6 14.1 24.6 15.7 88 92 A D H >< S+ 0 0 92 -4,-3.0 3,-1.2 1,-0.2 -2,-0.2 0.929 111.2 49.9 -59.4 -45.7 14.3 21.2 14.2 89 93 A A H 3< S+ 0 0 41 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.624 115.3 44.3 -66.6 -14.1 16.7 22.6 11.5 90 94 A S T > - 0 0 78 0, 0.0 4,-2.0 0, 0.0 3,-1.1 -0.325 26.4-122.9 -60.0 140.9 22.0 31.4 18.6 97 101 A L H 3> S+ 0 0 59 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.824 110.0 57.7 -58.5 -37.5 21.0 33.2 21.9 98 102 A P H 3> S+ 0 0 68 0, 0.0 4,-1.8 0, 0.0 182,-0.4 0.879 111.2 44.8 -60.6 -33.1 20.9 36.7 20.3 99 103 A L H <> S+ 0 0 7 -3,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.864 111.5 52.0 -74.5 -39.2 18.3 35.2 17.9 100 104 A I H X S+ 0 0 4 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.906 112.0 47.7 -54.0 -48.1 16.4 33.5 20.7 101 105 A K H X S+ 0 0 12 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.879 110.0 50.8 -67.5 -40.4 16.3 36.8 22.5 102 106 A S H X S+ 0 0 5 -4,-1.8 4,-2.5 -5,-0.2 5,-0.2 0.936 112.5 47.3 -61.1 -46.0 15.1 38.8 19.5 103 107 A Y H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.898 112.5 48.9 -65.1 -41.3 12.3 36.3 18.9 104 108 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.927 112.9 47.8 -62.7 -45.4 11.3 36.4 22.6 105 109 A F H X S+ 0 0 48 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.926 112.8 48.5 -60.8 -45.5 11.3 40.2 22.7 106 110 A Q H X S+ 0 0 10 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.905 113.1 46.6 -65.2 -43.0 9.2 40.4 19.4 107 111 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.909 110.5 53.2 -65.6 -41.4 6.7 37.9 20.7 108 112 A L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.810 109.0 50.7 -58.1 -32.4 6.5 39.7 24.0 109 113 A Q H X S+ 0 0 73 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.942 109.8 49.5 -71.3 -45.8 5.8 42.9 22.0 110 114 A G H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.869 115.0 44.5 -55.6 -41.9 3.0 41.1 20.1 111 115 A L H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.907 106.7 56.9 -76.3 -42.4 1.5 39.9 23.4 112 116 A A H X S+ 0 0 18 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.941 111.7 47.4 -52.9 -43.5 1.8 43.3 25.2 113 117 A F H X S+ 0 0 50 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.966 115.0 41.5 -60.6 -60.7 -0.3 44.6 22.3 114 118 A C H ><>S+ 0 0 0 -4,-2.2 5,-2.7 1,-0.2 3,-0.6 0.912 116.7 50.3 -48.3 -51.5 -3.0 41.9 22.3 115 119 A H H ><5S+ 0 0 28 -4,-3.0 3,-1.5 1,-0.3 -1,-0.2 0.805 102.6 58.4 -66.0 -33.4 -3.1 41.8 26.0 116 120 A S H 3<5S+ 0 0 85 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.820 108.9 48.2 -63.7 -29.6 -3.5 45.6 26.2 117 121 A H T <<5S- 0 0 108 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.228 120.8-113.0 -91.7 13.8 -6.7 45.0 24.1 118 122 A R T < 5S+ 0 0 215 -3,-1.5 2,-0.5 1,-0.2 -3,-0.2 0.653 73.5 137.5 64.6 19.4 -7.8 42.3 26.4 119 123 A V < - 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