==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 29-AUG-07 2R3G . COMPND 2 MOLECULE: CELL DIVISION PROTEIN KINASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.O.FISCHMANN,A.W.HRUZA,V.M.MADISON,J.S.DUCA . 287 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14166.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 63.8 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 . 39 13.6 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 . 18 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 26.5 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 2 2 0 1 1 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 . 1 1 1 0 2 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 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 59 0, 0.0 3,-2.7 0, 0.0 59,-0.0 0.000 360.0 360.0 360.0 -28.3 -13.0 30.6 -3.4 2 2 A E T 3 + 0 0 149 1,-0.3 3,-0.0 3,-0.0 22,-0.0 0.561 360.0 69.0 -60.0 -4.5 -13.0 30.7 -7.2 3 3 A N T 3 S+ 0 0 69 21,-0.1 21,-2.9 20,-0.1 22,-0.6 0.508 93.5 68.4 -91.1 -4.6 -10.6 33.6 -6.7 4 4 A F E < -A 23 0A 21 -3,-2.7 2,-0.5 19,-0.3 19,-0.2 -0.944 61.7-154.6-124.7 139.0 -7.8 31.3 -5.4 5 5 A Q E -A 22 0A 97 17,-3.1 17,-3.1 -2,-0.4 2,-0.3 -0.914 25.9-128.8-107.0 126.7 -5.6 28.6 -7.0 6 6 A K E +A 21 0A 99 -2,-0.5 15,-0.3 15,-0.2 3,-0.1 -0.550 26.5 178.1 -76.0 133.5 -4.3 26.0 -4.6 7 7 A V E - 0 0 62 13,-3.2 2,-0.3 1,-0.4 14,-0.2 0.805 61.8 -24.8-100.5 -47.4 -0.6 25.5 -4.8 8 8 A E E -A 20 0A 109 12,-1.4 12,-3.2 0, 0.0 2,-0.5 -0.979 61.5-101.0-165.1 154.3 0.1 23.0 -2.1 9 9 A K E -A 19 0A 123 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.693 27.4-171.8 -81.4 127.1 -1.3 21.6 1.1 10 10 A I E - 0 0 65 8,-2.6 2,-0.3 -2,-0.5 9,-0.2 0.861 53.8 -75.8 -85.9 -41.4 0.7 23.0 4.1 11 11 A G E -A 18 0A 26 7,-1.5 7,-2.8 5,-0.0 2,-0.6 -0.985 48.4 -66.2 167.3-175.8 -0.9 20.8 6.7 12 12 A E E -A 17 0A 83 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.924 48.6-165.9-105.8 116.9 -3.9 20.0 8.8 13 13 A G - 0 0 19 3,-2.4 136,-0.4 -2,-0.6 137,-0.3 -0.209 39.6 -86.4 -88.2-171.8 -4.6 22.7 11.4 14 14 A T S S+ 0 0 11 1,-0.2 135,-1.2 134,-0.2 136,-0.1 0.913 125.1 25.0 -62.0 -45.4 -6.8 22.5 14.4 15 15 A Y S S- 0 0 34 1,-0.2 2,-0.3 133,-0.2 -1,-0.2 0.590 129.8 -32.5-100.9 -13.4 -9.9 23.6 12.5 16 16 A G S S- 0 0 5 134,-0.0 -3,-2.4 -5,-0.0 -1,-0.2 -0.975 79.7 -51.1 173.9 177.1 -9.3 22.5 8.9 17 17 A V E -A 12 0A 13 17,-0.3 17,-2.6 -2,-0.3 2,-0.4 -0.356 45.0-145.1 -70.6 151.9 -6.7 22.0 6.2 18 18 A V E -AB 11 33A 12 -7,-2.8 -8,-2.6 15,-0.2 -7,-1.5 -0.983 18.6-172.8-120.4 131.9 -4.3 24.9 5.4 19 19 A Y E -AB 9 32A 52 13,-2.5 13,-3.1 -2,-0.4 2,-0.4 -0.957 28.1-127.2-125.1 147.7 -3.2 25.5 1.8 20 20 A K E +AB 8 31A 40 -12,-3.2 -13,-3.2 -2,-0.4 -12,-1.4 -0.758 46.9 175.0 -82.2 133.9 -0.7 27.7 0.2 21 21 A A E -AB 6 30A 0 9,-2.8 9,-2.7 -2,-0.4 2,-0.5 -0.955 30.7-132.9-143.8 160.3 -2.7 29.4 -2.6 22 22 A R E -AB 5 29A 90 -17,-3.1 -17,-3.1 -2,-0.3 2,-0.7 -0.967 25.5-122.8-117.7 129.0 -2.5 32.1 -5.2 23 23 A N E > -A 4 0A 24 5,-3.5 4,-2.0 -2,-0.5 -19,-0.3 -0.580 17.9-144.6 -67.3 110.9 -5.1 34.8 -5.7 24 24 A K T 4 S+ 0 0 126 -21,-2.9 -1,-0.2 -2,-0.7 -20,-0.2 0.697 95.6 41.7 -52.2 -15.8 -6.1 34.3 -9.3 25 25 A L T 4 S+ 0 0 136 -22,-0.6 -1,-0.1 3,-0.1 -21,-0.0 0.813 125.0 21.7 -93.8 -93.1 -6.4 38.1 -9.3 26 26 A T T 4 S- 0 0 104 1,-0.2 -2,-0.1 2,-0.0 3,-0.1 0.747 94.3-129.7 -47.9 -26.8 -3.6 40.0 -7.5 27 27 A G < + 0 0 35 -4,-2.0 -1,-0.2 1,-0.3 -3,-0.1 0.489 54.1 159.4 82.6 2.3 -1.4 36.9 -8.0 28 28 A E - 0 0 86 -5,-0.1 -5,-3.5 -6,-0.1 2,-0.5 -0.310 39.6-132.8 -58.2 138.0 -0.8 37.4 -4.2 29 29 A V E +B 22 0A 54 -7,-0.2 43,-0.6 -3,-0.1 2,-0.3 -0.846 39.2 160.6 -97.1 130.4 0.4 34.2 -2.5 30 30 A V E -BC 21 71A 0 -9,-2.7 -9,-2.8 -2,-0.5 2,-0.5 -0.848 43.1-107.8-140.7 173.8 -1.5 33.5 0.8 31 31 A A E -BC 20 70A 10 39,-2.6 39,-3.2 -2,-0.3 2,-0.5 -0.943 31.6-157.4-108.0 128.9 -2.3 30.8 3.3 32 32 A L E -BC 19 69A 9 -13,-3.1 -13,-2.5 -2,-0.5 2,-0.6 -0.951 2.7-161.7-111.8 120.0 -6.0 29.6 3.0 33 33 A K E -BC 18 68A 35 35,-3.1 35,-2.5 -2,-0.5 2,-0.8 -0.916 6.0-153.6-105.3 118.7 -7.5 28.0 6.1 34 34 A K E C 0 67A 40 -17,-2.6 -17,-0.3 -2,-0.6 33,-0.2 -0.810 360.0 360.0 -95.1 106.3 -10.6 25.9 5.5 35 35 A I 0 0 53 31,-3.0 -1,-0.2 -2,-0.8 32,-0.1 0.973 360.0 360.0 -76.2 360.0 -12.6 25.9 8.7 36 ! 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 37 47 A T > 0 0 143 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -41.3 -21.0 34.6 17.0 38 48 A A H > + 0 0 28 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.949 360.0 52.4 -64.2 -46.3 -18.0 33.1 15.3 39 49 A I H > S+ 0 0 63 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.899 111.5 46.2 -56.5 -43.4 -18.3 35.3 12.3 40 50 A R H > S+ 0 0 182 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.958 113.7 47.9 -65.5 -48.4 -18.4 38.5 14.4 41 51 A E H X S+ 0 0 26 -4,-2.3 4,-1.0 1,-0.2 -2,-0.2 0.913 115.4 44.6 -58.2 -47.9 -15.5 37.5 16.6 42 52 A I H >X S+ 0 0 0 -4,-2.9 3,-1.0 1,-0.2 4,-0.6 0.934 108.5 57.3 -63.3 -46.1 -13.3 36.5 13.5 43 53 A S H >< S+ 0 0 39 -4,-2.5 3,-1.4 -5,-0.3 4,-0.2 0.889 101.7 56.9 -54.6 -36.9 -14.3 39.6 11.7 44 54 A L H >< S+ 0 0 112 -4,-2.0 3,-1.7 1,-0.3 4,-0.4 0.833 94.6 67.1 -62.3 -33.9 -13.0 41.7 14.6 45 55 A L H X< S+ 0 0 12 -4,-1.0 3,-1.1 -3,-1.0 11,-0.3 0.735 81.5 77.8 -61.8 -20.0 -9.6 40.1 14.2 46 56 A K T << S+ 0 0 82 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.751 97.0 44.5 -62.2 -23.1 -9.2 41.8 10.8 47 57 A E T < S+ 0 0 171 -3,-1.7 2,-2.0 -4,-0.2 -1,-0.3 0.525 85.8 94.7 -97.7 -9.7 -8.3 45.1 12.6 48 58 A L < + 0 0 19 -3,-1.1 2,-0.4 -4,-0.4 8,-0.1 -0.544 61.0 164.4 -83.1 71.6 -6.0 43.5 15.1 49 59 A N + 0 0 72 -2,-2.0 5,-0.1 6,-0.1 6,-0.0 -0.801 8.4 146.0-101.1 137.0 -2.9 44.2 13.0 50 60 A H > - 0 0 43 3,-0.5 3,-2.2 -2,-0.4 54,-0.1 -0.971 55.3-110.4-162.6 149.3 0.7 44.2 14.2 51 61 A P T 3 S+ 0 0 88 0, 0.0 4,-0.1 0, 0.0 53,-0.1 0.753 118.3 49.1 -58.8 -24.4 4.1 43.2 12.6 52 62 A N T 3 S+ 0 0 9 80,-0.1 81,-2.8 48,-0.1 2,-0.4 0.194 97.4 80.0-102.0 17.7 4.3 40.1 14.8 53 63 A I B < S-e 133 0B 10 -3,-2.2 -3,-0.5 79,-0.3 81,-0.2 -0.991 89.8-113.9-125.4 121.1 0.8 38.9 14.2 54 64 A V - 0 0 9 79,-2.2 2,-0.2 -2,-0.4 82,-0.2 -0.352 44.4-110.7 -56.2 124.6 0.2 36.9 10.9 55 65 A K - 0 0 89 -4,-0.1 16,-2.5 1,-0.1 2,-0.9 -0.395 17.0-143.5 -67.9 130.8 -2.2 39.2 9.0 56 66 A L E -D 70 0A 12 -11,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.819 22.9-179.8 -90.7 102.2 -5.8 38.1 8.6 57 67 A L E - 0 0 32 12,-2.3 2,-0.3 -2,-0.9 13,-0.2 0.899 54.7 -18.2 -73.6 -46.1 -6.4 39.3 5.0 58 68 A D E -D 69 0A 91 11,-1.6 11,-2.9 2,-0.0 2,-0.4 -0.995 46.9-133.8-159.5 163.2 -10.0 38.2 4.6 59 69 A V E -D 68 0A 29 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.987 19.2-167.1-123.0 128.0 -12.8 36.1 5.7 60 70 A I E -D 67 0A 43 7,-2.8 7,-2.7 -2,-0.4 2,-0.5 -0.978 5.8-178.8-119.6 120.9 -14.9 34.2 3.1 61 71 A H E +D 66 0A 103 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.972 20.2 147.0-122.5 111.9 -18.2 32.6 4.2 62 72 A T E > +D 65 0A 58 3,-2.4 3,-2.0 -2,-0.5 -2,-0.1 -0.989 61.5 5.0-152.1 139.7 -20.0 30.7 1.5 63 73 A E T 3 S- 0 0 176 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.811 127.8 -64.5 58.6 28.1 -22.3 27.7 1.2 64 74 A N T 3 S+ 0 0 155 1,-0.3 2,-0.3 0, 0.0 -1,-0.3 0.750 113.2 121.3 65.1 25.8 -22.0 27.7 5.0 65 75 A K E < - D 0 62A 75 -3,-2.0 -3,-2.4 -30,-0.0 2,-0.5 -0.901 53.4-142.5-116.7 145.4 -18.3 27.0 4.7 66 76 A L E - D 0 61A 17 -2,-0.3 -31,-3.0 -5,-0.2 2,-0.4 -0.950 16.7-178.7-118.3 128.2 -15.6 29.3 6.2 67 77 A Y E -CD 34 60A 28 -7,-2.7 -7,-2.8 -2,-0.5 2,-0.5 -0.977 11.1-157.3-122.9 133.9 -12.2 30.2 4.8 68 78 A L E -CD 33 59A 0 -35,-2.5 -35,-3.1 -2,-0.4 2,-0.6 -0.946 8.6-151.6-111.2 129.2 -9.7 32.4 6.4 69 79 A V E -CD 32 58A 4 -11,-2.9 -12,-2.3 -2,-0.5 -11,-1.6 -0.911 22.4-178.5-104.5 119.8 -7.1 34.1 4.1 70 80 A F E -CD 31 56A 13 -39,-3.2 -39,-2.6 -2,-0.6 -14,-0.2 -0.845 36.1 -93.8-116.8 159.2 -3.8 34.8 5.8 71 81 A E E -C 30 0A 47 -16,-2.5 2,-0.4 -2,-0.3 -41,-0.2 -0.324 51.2-122.2 -56.9 141.8 -0.5 36.4 5.0 72 82 A F - 0 0 37 -43,-0.6 2,-0.3 -42,-0.1 -1,-0.1 -0.806 30.1-179.5 -98.9 134.2 1.9 33.6 3.9 73 83 A L - 0 0 13 -2,-0.4 53,-0.1 53,-0.1 3,-0.0 -0.948 27.8-129.2-125.7 151.5 5.2 32.8 5.7 74 84 A H S S+ 0 0 102 -2,-0.3 2,-0.3 51,-0.3 52,-0.1 0.592 77.1 16.9 -80.1 -17.3 7.5 30.0 4.6 75 85 A Q E -F 125 0B 38 50,-1.1 50,-2.9 213,-0.1 2,-0.2 -0.997 61.2-133.8-154.4 156.1 8.3 28.1 7.7 76 86 A D E > -F 124 0B 21 -2,-0.3 4,-2.1 48,-0.3 48,-0.2 -0.617 30.5-113.0-106.4 163.8 7.1 27.4 11.2 77 87 A L H > S+ 0 0 0 46,-2.6 4,-2.7 43,-1.2 44,-0.2 0.806 113.6 59.6 -67.8 -30.2 9.1 27.3 14.4 78 88 A K H > S+ 0 0 81 42,-0.7 4,-2.5 45,-0.3 5,-0.2 0.964 110.4 42.6 -61.5 -49.9 8.5 23.6 14.9 79 89 A K H > S+ 0 0 105 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.919 114.2 51.4 -62.9 -39.7 10.1 22.9 11.6 80 90 A F H X S+ 0 0 11 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.903 111.2 47.9 -64.3 -40.7 12.9 25.4 12.3 81 91 A M H < S+ 0 0 22 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.920 111.4 49.3 -66.7 -43.0 13.6 23.8 15.6 82 92 A D H >< S+ 0 0 100 -4,-2.5 3,-1.3 1,-0.2 4,-0.3 0.923 112.9 48.7 -60.3 -43.3 13.7 20.3 14.2 83 93 A A H 3< S+ 0 0 80 -4,-2.6 3,-0.3 1,-0.3 -1,-0.2 0.777 112.6 47.5 -67.8 -26.6 16.0 21.5 11.5 84 94 A S T 3X S+ 0 0 18 -4,-1.5 4,-3.2 -5,-0.2 3,-0.3 0.222 80.1 110.7 -96.8 10.3 18.3 23.2 14.1 85 95 A A T <4 + 0 0 48 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.1 0.896 69.4 56.6 -52.8 -49.0 18.4 20.2 16.4 86 96 A L T 4 S+ 0 0 164 -3,-0.3 -1,-0.2 -4,-0.3 -2,-0.1 0.884 129.6 10.2 -52.8 -45.9 22.0 19.2 15.8 87 97 A T T 4 S- 0 0 113 -3,-0.3 -1,-0.2 1,-0.1 -2,-0.2 0.539 102.7-126.5-114.2 -11.1 23.4 22.6 16.9 88 98 A G < - 0 0 10 -4,-3.2 -3,-0.1 -7,-0.2 99,-0.1 0.191 37.4 -65.8 78.4 157.5 20.5 24.4 18.4 89 99 A I - 0 0 14 97,-0.6 5,-0.1 1,-0.1 100,-0.0 -0.641 64.2-104.6 -77.8 128.4 19.1 27.9 17.6 90 100 A P >> - 0 0 82 0, 0.0 4,-2.3 0, 0.0 3,-1.0 -0.290 26.4-118.8 -56.9 141.0 21.8 30.5 18.5 91 101 A L H 3> S+ 0 0 67 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.868 112.3 56.6 -49.6 -44.1 20.9 32.4 21.8 92 102 A P H 3> S+ 0 0 67 0, 0.0 4,-2.0 0, 0.0 188,-0.4 0.853 110.4 45.4 -59.8 -33.9 20.8 35.8 20.0 93 103 A L H <> S+ 0 0 7 -3,-1.0 4,-3.0 2,-0.2 5,-0.2 0.906 112.1 50.8 -74.0 -42.1 18.1 34.4 17.6 94 104 A I H X S+ 0 0 5 -4,-2.3 4,-2.9 1,-0.2 5,-0.2 0.930 112.5 48.1 -56.6 -46.4 16.2 32.8 20.4 95 105 A K H X S+ 0 0 11 -4,-3.0 4,-2.5 -5,-0.2 -1,-0.2 0.918 111.3 49.0 -62.0 -46.1 16.3 36.2 22.3 96 106 A S H X S+ 0 0 3 -4,-2.0 4,-2.5 -5,-0.2 5,-0.2 0.941 113.0 48.1 -59.6 -45.3 15.2 38.1 19.1 97 107 A Y H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.936 112.3 48.1 -61.8 -48.4 12.3 35.6 18.6 98 108 A L H X S+ 0 0 0 -4,-2.9 4,-2.4 -5,-0.2 -1,-0.2 0.925 111.7 50.6 -58.6 -41.9 11.2 35.8 22.2 99 109 A F H X S+ 0 0 55 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.944 112.5 45.7 -62.9 -43.8 11.3 39.6 22.2 100 110 A Q H X S+ 0 0 10 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.893 111.8 51.4 -66.6 -41.9 9.2 39.9 19.0 101 111 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.895 108.2 52.5 -64.8 -38.8 6.7 37.3 20.3 102 112 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 -5,-0.2 -1,-0.2 0.883 107.5 52.7 -63.0 -35.6 6.3 39.3 23.5 103 113 A Q H X S+ 0 0 61 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.916 109.4 48.8 -64.2 -43.1 5.7 42.4 21.4 104 114 A G H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 5,-0.2 0.933 114.1 45.9 -59.4 -48.7 2.9 40.6 19.5 105 115 A L H X S+ 0 0 0 -4,-2.8 4,-3.3 1,-0.2 5,-0.3 0.915 109.3 54.1 -61.1 -45.5 1.4 39.4 22.8 106 116 A A H X S+ 0 0 23 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.919 110.9 48.1 -56.9 -41.0 1.7 42.9 24.4 107 117 A F H X S+ 0 0 47 -4,-2.1 4,-0.7 2,-0.2 3,-0.3 0.968 115.6 40.9 -62.8 -54.6 -0.2 44.3 21.4 108 118 A C H ><>S+ 0 0 0 -4,-2.4 5,-2.6 1,-0.2 3,-1.0 0.883 114.4 53.1 -62.3 -41.0 -3.0 41.7 21.4 109 119 A H H ><5S+ 0 0 26 -4,-3.3 3,-1.7 1,-0.3 -1,-0.2 0.825 100.3 61.2 -64.9 -32.0 -3.3 41.7 25.2 110 120 A S H 3<5S+ 0 0 70 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.728 107.2 46.5 -67.6 -20.0 -3.7 45.5 25.2 111 121 A H T <<5S- 0 0 82 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.223 120.3-113.0-102.7 9.1 -6.8 44.9 23.2 112 122 A R T < 5S+ 0 0 183 -3,-1.7 2,-0.5 1,-0.2 -3,-0.2 0.782 72.5 137.3 63.9 32.4 -7.9 42.2 25.5 113 123 A V < - 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