==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER KINASE/INHIBITOR 16-SEP-04 1W83 . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.TICKLE,H.JHOTI,A.CLEASBY,L.DEVINE . 351 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17739.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 62.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 12.0 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 1 0.3 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 . 27 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 99 28.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 5 0 0 2 0 0 1 0 1 1 0 1 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 0 2 0 1 1 1 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 . 1 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 4 A E 0 0 246 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -53.6 27.2 0.0 23.5 2 5 A R - 0 0 83 1,-0.1 3,-0.1 89,-0.0 89,-0.0 -0.680 360.0-114.3 -80.5 136.7 24.5 2.6 22.6 3 6 A P - 0 0 62 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.342 36.0 -98.7 -69.2 157.4 21.1 0.9 21.6 4 7 A T - 0 0 85 1,-0.0 15,-1.9 -2,-0.0 2,-0.3 -0.591 37.8-149.6 -79.2 140.2 20.0 1.4 18.1 5 8 A F E -A 18 0A 23 -2,-0.3 2,-0.3 13,-0.3 11,-0.1 -0.778 7.8-160.5-108.8 151.5 17.4 4.1 17.4 6 9 A Y E -A 17 0A 56 11,-2.2 11,-1.6 -2,-0.3 2,-0.2 -0.970 14.7-122.0-135.2 152.2 14.6 4.2 14.7 7 10 A R E +A 16 0A 153 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.642 28.6 163.9-102.5 150.4 12.5 7.1 13.2 8 11 A Q E -A 15 0A 56 7,-1.1 7,-3.0 -2,-0.2 2,-0.6 -0.888 27.7-140.8-165.0 121.4 8.8 7.7 13.1 9 12 A E E +A 14 0A 125 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.835 24.9 175.3 -88.0 118.9 6.8 10.8 12.3 10 13 A L E > S-A 13 0A 26 3,-2.6 3,-1.4 -2,-0.6 -2,-0.1 -0.997 73.3 -16.3-124.4 122.2 3.7 11.0 14.5 11 14 A N T 3 S- 0 0 131 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.869 126.4 -57.0 51.3 49.5 1.5 14.2 14.2 12 15 A K T 3 S+ 0 0 180 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.774 116.1 110.4 39.0 40.5 4.4 16.0 12.5 13 16 A T E < -A 10 0A 46 -3,-1.4 -3,-2.6 -5,-0.0 2,-0.4 -0.988 67.8-128.8-123.6 137.5 6.8 15.5 15.3 14 17 A I E -A 9 0A 53 -2,-0.4 2,-0.5 -5,-0.2 -5,-0.2 -0.694 18.0-157.3 -82.2 132.8 9.7 13.1 14.7 15 18 A W E -A 8 0A 4 -7,-3.0 -7,-1.1 -2,-0.4 2,-0.5 -0.973 10.2-176.5-113.5 121.8 10.3 10.4 17.2 16 19 A E E +A 7 0A 54 -2,-0.5 -9,-0.2 -9,-0.2 -11,-0.0 -0.979 23.1 155.0-113.2 113.0 13.7 8.8 17.5 17 20 A V E -A 6 0A 1 -11,-1.6 -11,-2.2 -2,-0.5 -2,-0.0 -0.950 48.3 -90.7-138.5 151.0 13.6 6.0 20.1 18 21 A P E > -A 5 0A 2 0, 0.0 3,-1.8 0, 0.0 -13,-0.3 -0.308 44.1-110.3 -59.1 153.7 15.6 2.8 20.9 19 22 A E T 3 S+ 0 0 112 -15,-1.9 22,-0.1 1,-0.3 -14,-0.1 0.746 111.2 76.1 -63.6 -26.4 14.1 -0.4 19.1 20 23 A R T 3 S+ 0 0 56 -16,-0.2 21,-2.7 20,-0.1 2,-0.7 0.701 81.9 78.4 -55.9 -23.7 12.9 -1.8 22.5 21 24 A Y E < +B 40 0B 2 -3,-1.8 2,-0.2 19,-0.2 19,-0.2 -0.843 68.8 169.0 -92.2 115.3 10.1 0.7 22.4 22 25 A Q E +B 39 0B 66 17,-2.0 17,-2.4 -2,-0.7 -2,-0.0 -0.729 44.6 30.0-121.8 166.8 7.4 -0.6 20.0 23 26 A N E S- 0 0 126 -2,-0.2 2,-0.3 15,-0.2 -1,-0.2 0.846 72.0-162.5 51.6 48.5 3.8 0.2 19.0 24 27 A L E + 0 0 15 -3,-0.2 14,-0.2 14,-0.1 -1,-0.2 -0.454 12.4 178.6 -66.4 123.1 4.1 3.9 19.7 25 28 A S E -B 37 0B 63 12,-2.4 12,-2.8 -2,-0.3 -15,-0.0 -0.986 29.7-116.9-134.6 118.8 0.6 5.5 20.0 26 29 A P E +B 36 0B 59 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.266 33.1 170.4 -61.8 141.4 0.1 9.2 20.7 27 30 A V E - 0 0 98 8,-2.8 2,-0.3 1,-0.4 9,-0.2 0.563 61.1 -26.9-123.7 -31.2 -1.8 10.0 24.0 28 31 A G E -B 35 0B 31 7,-1.3 7,-4.0 2,-0.0 -1,-0.4 -0.895 46.1-156.3 178.8 149.4 -1.4 13.8 24.3 29 32 A S E +B 34 0B 92 5,-0.3 2,-0.3 -2,-0.3 5,-0.2 -0.814 15.1 166.2-125.4 177.5 0.6 16.8 23.4 30 33 A G E > -B 33 0B 26 3,-0.6 3,-2.3 -2,-0.3 139,-0.2 -0.917 56.9 -76.3-176.4 166.9 1.0 20.3 25.0 31 34 A A T 3 S+ 0 0 63 1,-0.3 138,-0.2 -2,-0.3 3,-0.1 0.795 129.7 45.2 -48.9 -35.0 3.4 23.3 24.7 32 35 A Y T 3 S- 0 0 30 136,-2.7 21,-0.6 1,-0.2 -1,-0.3 0.293 124.7 -42.0 -95.3 5.9 6.0 21.5 26.8 33 36 A G E < -BC 30 52B 0 -3,-2.3 -3,-0.6 135,-0.4 2,-0.3 -0.737 47.8-101.2 151.7 162.5 5.9 18.1 25.1 34 37 A S E -BC 29 51B 14 17,-1.9 17,-2.9 -5,-0.2 2,-0.4 -0.910 27.4-147.3-115.8 145.3 4.1 15.1 23.5 35 38 A V E -BC 28 50B 25 -7,-4.0 -8,-2.8 -2,-0.3 -7,-1.3 -0.888 10.4-171.4-114.2 138.1 3.3 11.6 25.0 36 39 A C E -BC 26 49B 1 13,-2.1 13,-2.9 -2,-0.4 2,-0.3 -0.990 21.8-132.9-121.6 139.9 3.1 8.1 23.5 37 40 A A E +BC 25 48B 20 -12,-2.8 -12,-2.4 -2,-0.4 2,-0.3 -0.646 40.5 170.3 -67.9 141.1 1.9 4.9 24.9 38 41 A A E - C 0 47B 6 9,-2.4 9,-3.7 -2,-0.3 2,-0.6 -0.978 36.1-119.7-150.0 165.8 4.5 2.2 24.0 39 42 A F E -BC 22 46B 83 -17,-2.4 -17,-2.0 -2,-0.3 2,-1.1 -0.945 20.4-146.7-109.3 117.3 5.4 -1.4 24.8 40 43 A D E >>> -BC 21 45B 3 5,-2.8 4,-2.5 -2,-0.6 3,-1.1 -0.759 10.0-168.9 -81.9 103.5 8.9 -2.0 26.3 41 44 A T T 345S+ 0 0 79 -21,-2.7 -1,-0.2 -2,-1.1 -20,-0.1 0.620 82.5 63.0 -67.1 -14.6 9.9 -5.3 24.8 42 45 A K T 345S+ 0 0 136 -22,-0.3 -1,-0.2 1,-0.1 -21,-0.1 0.685 121.9 15.8 -83.8 -20.6 12.9 -5.4 27.2 43 46 A T T <45S- 0 0 49 -3,-1.1 -2,-0.2 2,-0.2 -1,-0.1 0.538 97.0-120.8-125.6 -15.7 10.8 -5.5 30.4 44 47 A G T <5 + 0 0 46 -4,-2.5 2,-0.2 1,-0.3 -3,-0.2 0.672 68.3 137.5 74.2 18.2 7.4 -6.4 29.1 45 48 A L E < -C 40 0B 55 -5,-0.7 -5,-2.8 59,-0.0 2,-0.5 -0.612 57.4-129.5 -89.9 152.2 6.0 -3.2 30.5 46 49 A R E -C 39 0B 188 -7,-0.2 59,-2.0 -2,-0.2 2,-0.3 -0.889 42.0-171.0 -92.8 134.7 3.5 -0.8 28.8 47 50 A V E -CD 38 104B 0 -9,-3.7 -9,-2.4 -2,-0.5 2,-0.4 -0.796 29.0-131.4-128.2 160.3 5.1 2.6 29.1 48 51 A A E -CD 37 103B 14 55,-2.6 55,-2.1 -2,-0.3 2,-0.5 -0.957 23.1-159.5-107.5 140.9 4.4 6.3 28.5 49 52 A V E -CD 36 102B 1 -13,-2.9 -13,-2.1 -2,-0.4 2,-0.6 -0.959 2.4-162.7-124.6 113.3 7.1 8.1 26.6 50 53 A K E -CD 35 101B 29 51,-3.5 51,-3.3 -2,-0.5 2,-0.6 -0.859 0.9-163.3 -99.5 122.7 7.3 11.8 26.9 51 54 A K E -CD 34 100B 21 -17,-2.9 -17,-1.9 -2,-0.6 2,-0.4 -0.923 24.0-126.1-103.0 121.7 9.3 13.8 24.3 52 55 A L E -C 33 0B 9 47,-3.2 2,-0.5 -2,-0.6 47,-0.4 -0.505 15.7-128.4 -78.4 124.5 10.1 17.3 25.4 53 56 A S S S- 0 0 35 -21,-0.6 4,-0.2 -2,-0.4 -1,-0.1 -0.613 82.7 -26.9 -70.4 115.0 9.1 20.1 23.1 54 57 A R S > S- 0 0 176 -2,-0.5 3,-1.4 1,-0.1 4,-0.3 0.887 76.2-169.3 42.7 65.3 12.1 22.4 22.4 55 58 A P T 3 S+ 0 0 5 0, 0.0 10,-0.4 0, 0.0 3,-0.2 0.769 79.2 33.1 -59.5 -32.6 13.9 21.5 25.8 56 59 A F T 3 S+ 0 0 21 41,-0.3 -2,-0.1 1,-0.1 279,-0.1 -0.263 77.8 121.8-121.0 46.6 16.5 24.2 25.6 57 60 A Q S < S+ 0 0 99 -3,-1.4 2,-0.2 -4,-0.2 -1,-0.1 0.945 83.6 7.4 -71.8 -51.9 14.7 27.0 23.8 58 61 A S S > S- 0 0 30 -4,-0.3 4,-2.0 -3,-0.2 5,-0.1 -0.567 81.8-104.0-115.5-176.1 15.2 29.6 26.6 59 62 A I H > S+ 0 0 78 2,-0.2 4,-2.1 -2,-0.2 5,-0.2 0.914 126.0 48.9 -69.5 -46.8 17.2 29.6 29.9 60 63 A I H > S+ 0 0 123 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.783 112.1 49.5 -68.2 -31.3 13.9 29.1 31.8 61 64 A H H > S+ 0 0 3 2,-0.2 4,-2.0 1,-0.1 -1,-0.2 0.945 111.0 48.1 -64.6 -55.4 13.1 26.2 29.4 62 65 A A H X S+ 0 0 0 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.791 112.8 49.3 -58.2 -33.7 16.5 24.5 29.8 63 66 A K H X S+ 0 0 34 -4,-2.1 4,-3.0 2,-0.2 -1,-0.2 0.892 108.3 53.1 -69.2 -46.4 16.2 24.9 33.6 64 67 A R H X S+ 0 0 88 -4,-1.5 4,-2.9 2,-0.2 -2,-0.2 0.857 110.0 48.0 -56.0 -42.5 12.7 23.3 33.6 65 68 A T H X S+ 0 0 7 -4,-2.0 4,-2.3 -10,-0.4 -1,-0.2 0.905 113.0 47.9 -65.3 -45.6 14.0 20.3 31.7 66 69 A Y H X S+ 0 0 13 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.889 111.9 51.6 -62.2 -42.1 16.9 20.0 34.1 67 70 A R H X S+ 0 0 46 -4,-3.0 4,-2.1 2,-0.2 -2,-0.2 0.941 110.1 46.9 -61.7 -50.6 14.3 20.3 37.0 68 71 A E H X S+ 0 0 44 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.920 111.9 51.5 -60.4 -42.9 12.0 17.6 35.7 69 72 A L H X S+ 0 0 1 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.919 111.2 46.3 -56.2 -47.2 15.0 15.2 35.1 70 73 A R H X S+ 0 0 39 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.904 113.9 48.5 -64.5 -47.6 16.4 15.6 38.6 71 74 A L H X S+ 0 0 32 -4,-2.1 4,-1.9 2,-0.2 3,-0.5 0.963 113.6 45.7 -50.4 -60.1 13.0 15.1 40.2 72 75 A L H < S+ 0 0 28 -4,-2.7 11,-0.7 1,-0.3 -2,-0.2 0.778 111.4 52.2 -66.9 -32.3 12.2 12.1 38.2 73 76 A K H < S+ 0 0 39 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.840 113.4 46.9 -64.4 -35.9 15.6 10.5 38.8 74 77 A H H < S+ 0 0 35 -4,-2.0 2,-0.6 -3,-0.5 244,-0.3 0.826 88.3 93.5 -74.0 -34.9 15.1 11.1 42.6 75 78 A M < + 0 0 9 -4,-1.9 8,-0.4 -5,-0.1 2,-0.2 -0.521 37.7 154.2 -76.8 111.7 11.6 9.7 43.1 76 79 A K + 0 0 157 -2,-0.6 2,-0.3 6,-0.1 6,-0.1 -0.718 28.5 120.1-133.9 78.5 11.7 6.1 44.1 77 80 A H > - 0 0 16 3,-0.4 3,-1.3 -2,-0.2 57,-0.1 -0.990 67.3-121.2-142.7 148.1 8.4 5.4 46.0 78 81 A E T 3 S+ 0 0 132 -2,-0.3 -1,-0.1 1,-0.2 4,-0.1 0.875 115.6 38.1 -52.6 -41.1 5.4 3.0 45.7 79 82 A N T 3 S+ 0 0 8 83,-0.1 84,-2.7 51,-0.1 2,-0.3 0.188 108.7 72.4-101.7 14.1 3.0 6.0 45.5 80 83 A V B < S-f 163 0C 5 -3,-1.3 -3,-0.4 82,-0.3 84,-0.2 -0.948 91.9 -99.1-127.6 145.0 5.1 8.4 43.5 81 84 A I - 0 0 22 82,-2.3 2,-0.3 -2,-0.3 -6,-0.1 -0.457 39.1-156.1 -61.5 130.7 5.9 8.1 39.8 82 85 A G - 0 0 16 -2,-0.2 2,-0.6 -6,-0.1 22,-0.4 -0.762 18.9-113.3-103.7 159.0 9.4 6.6 39.1 83 86 A L - 0 0 10 -11,-0.7 20,-0.2 -8,-0.4 3,-0.1 -0.843 26.7-178.8 -89.8 117.9 11.6 7.0 35.9 84 87 A L - 0 0 28 18,-2.5 2,-0.3 -2,-0.6 19,-0.2 0.860 69.4 -12.9 -79.2 -36.4 11.9 3.8 34.0 85 88 A D E -E 102 0B 24 17,-1.6 17,-3.5 262,-0.1 2,-0.3 -0.975 50.4-164.9-161.2 145.7 14.2 5.3 31.3 86 89 A V E +E 101 0B 6 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.976 25.8 169.3-129.3 140.7 15.5 8.6 30.0 87 90 A F E -E 100 0B 13 13,-1.9 13,-1.5 -2,-0.3 256,-0.1 -0.999 25.8-161.2-149.0 156.9 17.3 8.8 26.6 88 91 A T - 0 0 15 -2,-0.3 11,-0.1 2,-0.2 8,-0.1 -0.975 20.1-144.4-125.4 144.5 18.6 11.0 23.8 89 92 A P S S+ 0 0 20 0, 0.0 2,-0.1 0, 0.0 -84,-0.1 0.441 71.5 112.2 -76.5 -2.0 19.4 10.0 20.2 90 93 A A - 0 0 11 8,-0.3 -2,-0.2 1,-0.1 3,-0.1 -0.453 56.0-159.6 -71.3 144.5 22.4 12.4 20.4 91 94 A R S S+ 0 0 171 -2,-0.1 2,-0.2 -89,-0.0 -1,-0.1 0.588 73.2 16.0-102.1 -11.7 25.7 10.7 20.3 92 95 A S S > S- 0 0 28 1,-0.0 4,-0.6 0, 0.0 -2,-0.0 -0.812 86.4 -96.7-144.0-180.0 27.7 13.6 21.9 93 96 A L T 4 S+ 0 0 65 -2,-0.2 3,-0.3 1,-0.2 246,-0.1 0.815 119.1 58.6 -73.7 -30.2 27.0 16.8 23.8 94 97 A E T 4 S+ 0 0 167 1,-0.2 -1,-0.2 3,-0.0 -4,-0.0 0.805 107.1 46.9 -70.1 -30.0 27.2 19.0 20.6 95 98 A E T 4 S+ 0 0 104 2,-0.0 2,-0.3 3,-0.0 -1,-0.2 0.686 83.1 122.1 -82.6 -20.2 24.3 17.0 19.0 96 99 A F < + 0 0 0 -4,-0.6 3,-0.1 -3,-0.3 243,-0.1 -0.259 16.4 123.3 -60.2 107.4 22.1 17.2 22.2 97 100 A N + 0 0 94 -2,-0.3 2,-0.4 1,-0.2 -41,-0.3 0.387 58.5 69.6-134.7 -11.5 18.8 18.8 21.4 98 101 A D - 0 0 53 -44,-0.1 2,-0.4 -43,-0.1 -8,-0.3 -0.947 49.4-172.9-134.6 137.4 16.2 16.2 22.5 99 102 A V - 0 0 1 -47,-0.4 -47,-3.2 -2,-0.4 2,-0.4 -0.991 3.0-173.8-135.9 131.6 15.0 14.6 25.7 100 103 A Y E -DE 51 87B 1 -13,-1.5 -13,-1.9 -2,-0.4 2,-0.4 -0.984 7.1-159.5-128.0 128.9 12.7 11.7 26.2 101 104 A L E -DE 50 86B 9 -51,-3.3 -51,-3.5 -2,-0.4 2,-0.5 -0.937 4.4-158.2-115.5 137.2 11.3 10.4 29.5 102 105 A V E +DE 49 85B 0 -17,-3.5 -18,-2.5 -2,-0.4 -17,-1.6 -0.960 20.1 156.7-116.9 123.8 9.9 6.9 30.1 103 106 A T E -D 48 0B 21 -55,-2.1 -55,-2.6 -2,-0.5 2,-0.2 -0.802 51.6 -73.9-127.1 174.3 7.5 5.9 32.9 104 107 A H E -D 47 0B 67 -22,-0.4 2,-0.4 -2,-0.2 -57,-0.3 -0.514 60.3-105.6 -63.8 137.1 4.9 3.2 33.6 105 108 A L - 0 0 59 -59,-2.0 2,-0.3 -2,-0.2 -59,-0.1 -0.569 36.2-157.1 -68.5 122.7 1.8 3.8 31.5 106 109 A M + 0 0 37 -2,-0.4 2,-0.2 50,-0.0 3,-0.1 -0.661 14.7 176.1 -93.0 160.4 -1.0 5.2 33.6 107 110 A G + 0 0 64 1,-0.5 -2,-0.0 -2,-0.3 47,-0.0 -0.665 55.4 27.7-175.5 107.5 -4.6 4.8 32.5 108 111 A A - 0 0 40 -2,-0.2 47,-2.1 43,-0.1 -1,-0.5 0.525 66.3-155.2 93.8 116.5 -7.5 5.9 34.7 109 112 A D B > -G 154 0C 32 45,-0.2 4,-1.2 -3,-0.1 3,-0.4 -0.352 37.3 -93.8-100.2-174.0 -7.1 8.7 37.2 110 113 A L H > S+ 0 0 0 40,-1.7 4,-2.4 43,-1.4 41,-0.2 0.591 127.3 61.0 -76.8 -14.3 -9.0 9.5 40.4 111 114 A N H 4 S+ 0 0 47 39,-0.6 4,-0.5 42,-0.3 -1,-0.2 0.659 105.2 46.9 -84.8 -19.5 -11.1 11.8 38.3 112 115 A N H > S+ 0 0 85 -3,-0.4 4,-1.2 38,-0.2 -2,-0.2 0.776 115.5 47.1 -81.1 -35.1 -12.1 8.7 36.3 113 116 A I H X S+ 0 0 29 -4,-1.2 4,-0.8 2,-0.2 -2,-0.2 0.897 111.5 46.4 -78.7 -42.8 -12.7 6.9 39.6 114 117 A V H < S+ 0 0 17 -4,-2.4 -1,-0.2 1,-0.2 -3,-0.2 0.792 117.1 46.7 -70.1 -26.5 -14.8 9.5 41.4 115 118 A K H 4 S+ 0 0 133 -4,-0.5 -1,-0.2 -5,-0.1 -2,-0.2 0.802 125.6 26.2 -82.5 -29.6 -16.9 10.1 38.3 116 119 A C H < S+ 0 0 118 -4,-1.2 2,-0.3 1,-0.1 -2,-0.2 0.114 111.2 62.3-127.5 18.0 -17.5 6.4 37.4 117 120 A Q S < S- 0 0 98 -4,-0.8 2,-0.5 -3,-0.1 -1,-0.1 -0.983 71.1-125.3-150.8 133.3 -17.3 4.3 40.7 118 121 A K - 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