==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 18-FEB-05 1YWR . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR A.GOLEBIOWSKI,J.A.TOWNES,M.J.LAUFERSWEILER,T.A.BRUGEL, . 338 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16691.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 211 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 . 44 13.0 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 . 3 0.9 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 . 22 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 27.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 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 4 0 0 0 0 1 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 1 2 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 . 1 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 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 5 A R 0 0 144 0, 0.0 89,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 147.7 24.2 2.8 8.1 2 6 A P - 0 0 69 0, 0.0 2,-0.5 0, 0.0 0, 0.0 -0.085 360.0 -96.0 -70.3 179.7 24.1 4.1 11.7 3 7 A T - 0 0 89 2,-0.0 15,-3.6 0, 0.0 16,-0.2 -0.900 41.5-159.7 -98.2 124.9 26.1 3.0 14.7 4 8 A F E -A 17 0A 28 -2,-0.5 2,-0.3 13,-0.3 11,-0.1 -0.458 6.4-156.3 -95.9 173.1 24.3 0.5 16.9 5 9 A Y E -A 16 0A 51 11,-1.9 11,-1.3 -2,-0.2 2,-0.2 -0.980 14.9-133.5-145.0 144.7 24.9 -0.4 20.5 6 10 A R E +A 15 0A 168 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.581 30.0 159.2 -97.7 163.9 23.9 -3.6 22.2 7 11 A Q E -A 14 0A 60 7,-1.0 7,-3.4 -2,-0.2 2,-0.5 -0.908 34.7-121.4-174.1 149.7 22.2 -4.1 25.5 8 12 A E E -A 13 0A 123 5,-0.3 2,-0.5 -2,-0.3 5,-0.3 -0.922 26.5-174.9-109.9 129.0 20.1 -6.6 27.4 9 13 A L E > S-A 12 0A 23 3,-4.2 3,-2.0 -2,-0.5 15,-0.1 -0.976 70.5 -19.4-124.2 113.8 16.6 -5.7 28.6 10 14 A N T 3 S- 0 0 130 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.873 130.4 -50.8 59.1 33.7 14.4 -7.9 30.7 11 15 A K T 3 S+ 0 0 174 1,-0.2 2,-0.6 -3,-0.0 -1,-0.3 0.590 123.5 117.1 73.3 11.9 16.7 -10.8 29.5 12 16 A T E < -A 9 0A 36 -3,-2.0 -3,-4.2 2,-0.0 -1,-0.2 -0.921 59.4-144.0-113.3 112.1 16.0 -9.4 26.0 13 17 A I E -A 8 0A 65 -2,-0.6 2,-0.4 -5,-0.3 -5,-0.3 -0.461 14.9-165.3 -73.9 149.7 19.0 -8.2 24.1 14 18 A W E -A 7 0A 3 -7,-3.4 -7,-1.0 -2,-0.1 2,-0.5 -0.996 13.6-171.2-135.5 125.1 18.6 -5.2 21.9 15 19 A E E +A 6 0A 46 -2,-0.4 -9,-0.2 -9,-0.2 -11,-0.1 -0.835 29.4 154.4-121.3 96.1 21.0 -3.9 19.1 16 20 A V E -A 5 0A 1 -11,-1.3 -11,-1.9 -2,-0.5 -2,-0.1 -0.697 45.9 -88.3-118.0 161.3 19.7 -0.5 17.9 17 21 A P E > -A 4 0A 3 0, 0.0 3,-2.0 0, 0.0 -13,-0.3 -0.372 40.7-108.3 -72.4 156.7 21.2 2.5 16.3 18 22 A E T 3 S+ 0 0 100 -15,-3.6 22,-0.2 1,-0.3 -14,-0.1 0.774 108.8 76.9 -49.6 -39.6 22.7 5.3 18.5 19 23 A R T 3 S+ 0 0 68 -16,-0.2 21,-2.6 20,-0.1 2,-0.6 0.736 84.8 74.0 -51.4 -25.2 19.9 7.7 17.7 20 24 A Y E < +B 39 0B 1 -3,-2.0 2,-0.2 19,-0.2 19,-0.2 -0.848 68.0 178.7-103.4 120.7 17.6 5.8 20.1 21 25 A Q E +B 38 0B 71 17,-2.9 17,-3.1 -2,-0.6 -2,-0.0 -0.723 48.4 23.6-118.4 157.8 18.3 6.4 23.8 22 26 A N E - 0 0 124 -2,-0.2 -1,-0.2 15,-0.2 14,-0.1 0.873 69.4-160.9 54.9 44.4 17.1 5.4 27.2 23 27 A L E + 0 0 13 -3,-0.2 14,-0.2 14,-0.1 -1,-0.1 -0.293 13.4 179.4 -51.2 137.1 15.4 2.1 26.1 24 28 A S E -B 36 0B 55 12,-1.2 12,-2.6 -15,-0.1 -15,-0.0 -0.869 30.9-113.4-153.0 110.0 12.9 1.1 28.8 25 29 A P E +B 35 0B 59 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.081 37.9 166.7 -51.8 138.4 10.7 -2.0 28.6 26 30 A V E - 0 0 93 8,-2.8 2,-0.3 1,-0.4 9,-0.2 0.598 59.5 -12.2-125.5 -34.1 7.0 -1.2 28.2 27 31 A G E +B 34 0B 30 7,-1.6 7,-2.3 2,-0.0 -1,-0.4 -0.997 58.3 160.1-167.3 162.9 5.5 -4.5 27.2 28 32 A S E +B 33 0B 80 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.997 11.5 131.7-175.1 175.0 6.0 -8.0 26.0 29 33 A G S S- 0 0 48 3,-1.6 3,-0.1 -2,-0.3 -2,-0.0 -0.887 77.8 -22.0 169.1-133.9 4.9 -11.6 25.4 30 34 A A S S+ 0 0 92 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 0.941 126.2 58.2 -66.8 -55.4 4.9 -14.0 22.5 31 35 A Y S S- 0 0 96 1,-0.1 21,-3.0 21,-0.1 2,-0.3 0.736 117.7 -97.1 -47.5 -36.4 5.1 -11.4 19.7 32 36 A G E - C 0 51B 3 19,-0.3 -3,-1.6 20,-0.2 2,-0.3 -0.993 50.7 -63.1 143.0-146.9 8.3 -9.9 21.0 33 37 A S E -BC 28 50B 18 17,-1.6 17,-2.8 -2,-0.3 2,-0.4 -0.987 28.7-145.7-144.9 153.4 8.9 -6.9 23.1 34 38 A V E -BC 27 49B 25 -7,-2.3 -8,-2.8 -2,-0.3 -7,-1.6 -0.965 11.3-169.3-120.8 133.9 8.5 -3.1 23.1 35 39 A C E -BC 25 48B 1 13,-2.3 13,-2.9 -2,-0.4 2,-0.4 -0.971 22.9-129.6-116.4 134.6 10.7 -0.4 24.6 36 40 A A E +BC 24 47B 4 -12,-2.6 -12,-1.2 -2,-0.4 2,-0.3 -0.662 40.8 177.9 -69.7 134.7 9.9 3.3 25.1 37 41 A A E - C 0 46B 0 9,-3.2 9,-3.1 -2,-0.4 2,-0.5 -0.952 31.9-123.8-138.8 161.8 12.9 5.2 23.7 38 42 A F E -BC 21 45B 73 -17,-3.1 -17,-2.9 -2,-0.3 2,-0.9 -0.912 21.1-146.4-106.0 128.9 14.0 8.8 23.1 39 43 A D E >>> -BC 20 44B 4 5,-2.3 4,-1.5 -2,-0.5 3,-1.4 -0.814 10.3-169.4-100.0 102.5 14.9 9.6 19.5 40 44 A T T 345S+ 0 0 73 -21,-2.6 -1,-0.2 -2,-0.9 -20,-0.1 0.718 79.9 64.8 -63.0 -26.9 17.8 12.1 19.6 41 45 A K T 345S+ 0 0 140 -22,-0.4 -1,-0.3 1,-0.2 -21,-0.1 0.740 121.5 16.3 -76.8 -16.2 17.6 12.9 15.9 42 46 A T T <45S- 0 0 56 -3,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.437 95.3-121.6-133.1 4.5 14.1 14.4 16.1 43 47 A G T <5S+ 0 0 42 -4,-1.5 2,-0.2 1,-0.2 -3,-0.2 0.423 72.0 127.0 70.9 -1.4 13.5 15.1 19.9 44 48 A H E < -C 39 0B 122 -5,-0.6 -5,-2.3 -6,-0.1 2,-0.3 -0.610 61.3-122.5 -94.9 150.2 10.5 12.8 19.8 45 49 A R E -C 38 0B 121 -2,-0.2 59,-2.1 -7,-0.2 2,-0.3 -0.683 37.7-176.0 -86.9 134.9 9.7 9.9 22.1 46 50 A V E -CD 37 103B 0 -9,-3.1 -9,-3.2 -2,-0.3 2,-0.5 -0.815 28.7-124.0-132.3 171.9 9.1 6.6 20.3 47 51 A A E -CD 36 102B 14 55,-3.0 55,-2.0 -2,-0.3 2,-0.5 -0.975 23.2-160.6-114.8 130.1 8.2 3.0 20.8 48 52 A V E -CD 35 101B 1 -13,-2.9 -13,-2.3 -2,-0.5 2,-0.6 -0.959 4.4-165.4-114.2 118.8 10.6 0.4 19.5 49 53 A K E -CD 34 100B 34 51,-3.4 51,-2.8 -2,-0.5 2,-0.7 -0.915 5.3-160.8-110.2 122.3 9.3 -3.1 18.9 50 54 A K E -CD 33 99B 27 -17,-2.8 -17,-1.6 -2,-0.6 49,-0.2 -0.860 25.7-126.1 -97.0 119.1 11.7 -6.0 18.4 51 55 A L E -C 32 0B 10 47,-3.0 -19,-0.3 -2,-0.7 47,-0.2 -0.299 19.2-129.4 -67.5 149.7 10.0 -8.8 16.7 52 56 A S S S- 0 0 49 -21,-3.0 -20,-0.2 1,-0.2 3,-0.1 0.969 82.2 -15.7 -66.1 -81.4 10.3 -12.1 18.6 53 57 A R S > S- 0 0 148 1,-0.2 3,-2.2 -22,-0.2 4,-0.3 -0.536 74.0-178.5-124.3 72.3 11.5 -14.8 16.3 54 58 A P T 3 S+ 0 0 3 0, 0.0 10,-0.4 0, 0.0 3,-0.2 0.677 76.7 23.7 -52.6 -32.4 10.8 -13.2 13.0 55 59 A F T 3 S+ 0 0 16 41,-0.3 271,-0.1 1,-0.1 42,-0.0 -0.047 78.9 119.3-127.2 35.1 11.9 -16.0 10.8 56 60 A Q S < S- 0 0 104 -3,-2.2 2,-0.3 2,-0.0 -1,-0.1 0.747 86.8 -1.7 -71.9 -20.3 11.6 -19.2 12.9 57 61 A S S > S- 0 0 33 -4,-0.3 4,-2.5 -3,-0.2 5,-0.2 -0.894 80.7 -93.0-154.7 177.5 9.1 -20.7 10.5 58 62 A I H > S+ 0 0 68 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.932 125.8 48.8 -68.6 -42.9 7.1 -20.0 7.3 59 63 A I H > S+ 0 0 111 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.914 113.8 45.8 -64.8 -41.3 4.2 -18.7 9.3 60 64 A H H > S+ 0 0 60 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.964 114.0 48.6 -59.3 -53.3 6.5 -16.5 11.4 61 65 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.901 113.2 47.3 -60.5 -37.0 8.3 -15.2 8.4 62 66 A K H X S+ 0 0 27 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.920 112.3 49.2 -71.1 -40.0 5.0 -14.5 6.5 63 67 A R H X S+ 0 0 86 -4,-2.3 4,-3.5 -5,-0.2 5,-0.2 0.905 109.3 53.1 -67.0 -39.3 3.5 -12.7 9.5 64 68 A T H X S+ 0 0 9 -4,-3.1 4,-2.8 -10,-0.4 5,-0.2 0.975 112.4 43.8 -56.6 -53.0 6.7 -10.6 9.9 65 69 A Y H X S+ 0 0 16 -4,-2.1 4,-2.8 -5,-0.2 5,-0.2 0.925 113.7 52.8 -56.5 -45.6 6.5 -9.6 6.2 66 70 A R H X S+ 0 0 25 -4,-2.9 4,-2.6 2,-0.2 5,-0.3 0.953 110.5 46.2 -56.1 -54.8 2.7 -9.0 6.7 67 71 A E H X S+ 0 0 12 -4,-3.5 4,-2.8 1,-0.2 5,-0.3 0.964 113.6 48.1 -57.7 -51.0 3.2 -6.7 9.7 68 72 A L H X S+ 0 0 1 -4,-2.8 4,-2.5 -5,-0.2 -1,-0.2 0.927 113.5 47.4 -55.8 -45.2 6.0 -4.7 8.0 69 73 A R H X S+ 0 0 34 -4,-2.8 4,-0.9 -5,-0.2 -1,-0.2 0.927 112.9 49.1 -62.8 -43.2 3.9 -4.3 4.8 70 74 A L H >X S+ 0 0 7 -4,-2.6 4,-1.7 -5,-0.2 3,-0.8 0.957 114.4 45.4 -57.5 -52.4 0.8 -3.2 6.8 71 75 A L H 3< S+ 0 0 17 -4,-2.8 11,-0.8 -5,-0.3 -2,-0.2 0.882 109.1 53.4 -65.8 -38.5 2.8 -0.7 8.8 72 76 A K H 3< S+ 0 0 34 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.2 0.792 111.8 50.2 -67.2 -17.6 4.7 0.8 5.9 73 77 A H H << S+ 0 0 36 -4,-0.9 2,-0.6 -3,-0.8 236,-0.2 0.843 86.0 88.7 -88.8 -39.4 1.3 1.4 4.2 74 78 A M < + 0 0 3 -4,-1.7 2,-0.4 6,-0.2 8,-0.4 -0.568 41.8 168.6 -71.8 113.0 -0.8 3.1 6.9 75 79 A K + 0 0 144 -2,-0.6 2,-0.3 6,-0.1 5,-0.1 -0.792 34.1 112.6-122.2 87.1 -0.5 6.9 6.8 76 80 A H B > -F 79 0C 16 3,-0.5 3,-1.3 -2,-0.4 57,-0.0 -0.997 69.3-120.6-156.7 148.0 -3.2 8.3 9.1 77 81 A E T 3 S+ 0 0 99 -2,-0.3 -1,-0.1 1,-0.3 4,-0.1 0.776 112.9 43.4 -63.6 -31.8 -3.6 10.1 12.4 78 82 A N T 3 S+ 0 0 3 83,-0.1 84,-2.6 51,-0.1 2,-0.4 0.096 105.3 72.4-104.0 19.3 -5.7 7.3 14.0 79 83 A V B < S-Fg 76 162C 2 -3,-1.3 -3,-0.5 82,-0.3 84,-0.1 -0.991 86.5-113.9-137.5 126.2 -3.6 4.4 12.8 80 84 A I + 0 0 19 82,-2.1 2,-0.2 -2,-0.4 -6,-0.2 -0.381 44.9 177.5 -58.9 136.2 -0.2 3.4 14.0 81 85 A G - 0 0 10 -4,-0.1 2,-0.6 -8,-0.1 22,-0.2 -0.682 30.4 -80.1-133.9-174.2 2.3 3.8 11.3 82 86 A L + 0 0 14 -11,-0.8 20,-0.2 -8,-0.4 3,-0.1 -0.807 32.7 167.2-104.0 118.0 6.1 3.5 10.7 83 87 A L S S- 0 0 40 18,-2.9 2,-0.3 -2,-0.6 19,-0.2 0.881 78.4 -13.0 -82.2 -43.1 8.6 6.1 11.7 84 88 A D E -E 101 0B 28 17,-1.2 17,-2.5 254,-0.1 -1,-0.4 -0.985 51.8-162.2-155.6 150.7 11.6 3.8 11.1 85 89 A V E +E 100 0B 7 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.974 25.5 166.0-138.8 132.4 12.4 0.1 10.5 86 90 A F E -E 99 0B 14 13,-2.0 13,-2.3 -2,-0.4 3,-0.1 -0.937 22.4-161.5-143.4 162.3 15.9 -1.3 11.1 87 91 A T - 0 0 14 -2,-0.3 11,-0.1 11,-0.2 8,-0.1 -0.998 25.5-137.5-139.9 142.6 18.1 -4.4 11.4 88 92 A P S S+ 0 0 24 0, 0.0 -1,-0.1 0, 0.0 -84,-0.1 0.881 75.5 113.5 -59.6 -35.5 21.6 -4.9 12.8 89 93 A A - 0 0 17 8,-0.3 -2,-0.2 1,-0.2 3,-0.1 -0.004 52.5-165.4 -40.8 123.6 22.1 -7.2 9.8 90 94 A R S S+ 0 0 186 1,-0.1 2,-0.3 -89,-0.0 -1,-0.2 0.687 73.3 18.7 -90.3 -12.7 24.6 -5.8 7.4 91 95 A S S >> S- 0 0 31 1,-0.1 4,-1.9 0, 0.0 3,-0.6 -0.946 82.7-102.8-144.5 166.4 23.5 -8.2 4.6 92 96 A L T 34 S+ 0 0 59 -2,-0.3 -1,-0.1 1,-0.2 -3,-0.1 0.906 120.1 58.7 -49.2 -44.9 20.7 -10.5 3.5 93 97 A E T 34 S+ 0 0 149 1,-0.2 -1,-0.2 -3,-0.1 -4,-0.0 0.804 110.9 38.5 -62.0 -34.4 22.8 -13.4 4.8 94 98 A E T <4 S+ 0 0 144 -3,-0.6 -1,-0.2 -6,-0.0 -2,-0.2 0.782 85.5 123.5 -87.3 -29.3 23.0 -12.1 8.4 95 99 A F < + 0 0 0 -4,-1.9 3,-0.1 1,-0.2 235,-0.1 -0.047 16.7 127.7 -38.8 116.7 19.5 -10.8 8.6 96 100 A N + 0 0 86 1,-0.3 2,-0.4 -42,-0.0 -41,-0.3 0.249 55.9 64.1-154.1 1.8 17.6 -12.3 11.5 97 101 A D - 0 0 46 -43,-0.1 2,-0.4 -44,-0.1 -8,-0.3 -0.998 52.6-167.8-141.3 139.1 16.2 -9.4 13.5 98 102 A V - 0 0 0 -2,-0.4 -47,-3.0 -47,-0.2 2,-0.4 -0.988 1.4-170.5-126.1 128.9 13.6 -6.8 12.8 99 103 A Y E -DE 50 86B 1 -13,-2.3 -13,-2.0 -2,-0.4 2,-0.4 -0.982 6.8-160.4-120.1 133.1 12.9 -3.7 14.8 100 104 A L E -DE 49 85B 7 -51,-2.8 -51,-3.4 -2,-0.4 2,-0.4 -0.901 5.2-159.9-113.0 140.7 9.8 -1.4 14.2 101 105 A V E +DE 48 84B 1 -17,-2.5 -18,-2.9 -2,-0.4 -17,-1.2 -0.980 19.4 153.1-128.0 134.5 9.6 2.2 15.4 102 106 A T E -D 47 0B 23 -55,-2.0 -55,-3.0 -2,-0.4 -20,-0.1 -0.888 53.3 -68.9-146.9 172.7 6.5 4.4 15.8 103 107 A H E -D 46 0B 90 -2,-0.3 -57,-0.3 -57,-0.2 2,-0.2 -0.382 58.5-106.9 -70.4 142.8 5.5 7.4 18.0 104 108 A L - 0 0 47 -59,-2.1 2,-0.3 -67,-0.1 -59,-0.1 -0.511 33.7-159.2 -72.4 135.9 5.1 6.5 21.6 105 109 A M - 0 0 28 -2,-0.2 50,-0.2 1,-0.1 3,-0.1 -0.838 17.2-128.5-110.4 155.0 1.6 6.3 22.9 106 110 A G - 0 0 59 48,-0.5 2,-0.3 -2,-0.3 49,-0.2 0.918 68.0 -38.6 -70.8 -56.3 0.6 6.6 26.6 107 111 A A E -H 154 0C 31 47,-2.3 47,-2.9 5,-0.1 2,-0.2 -0.862 60.2 -94.5-155.0-169.8 -1.6 3.7 27.4 108 112 A D E -H 153 0C 41 45,-0.3 3,-0.4 -2,-0.3 45,-0.2 -0.584 44.2 -94.4-113.6-179.8 -4.4 1.5 25.9 109 113 A L S > S+ 0 0 10 40,-2.0 3,-0.7 43,-1.3 41,-0.2 0.687 116.1 69.5 -75.1 -17.0 -8.1 1.8 26.3 110 114 A N T 3 S+ 0 0 79 39,-0.4 -1,-0.2 1,-0.2 2,-0.2 0.983 114.9 24.9 -55.1 -54.5 -8.2 -0.7 29.1 111 115 A N T 3 0 0 103 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 -0.329 360.0 360.0-114.3 49.8 -6.5 1.8 31.4 112 116 A I < 0 0 44 -3,-0.7 -1,-0.2 -2,-0.2 -5,-0.1 -0.398 360.0 360.0 164.7 360.0 -7.2 5.3 30.1 113 ! 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 0.0 114 118 A K 0 0 161 0, 0.0 4,-0.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-114.1 -9.7 9.8 32.6 115 119 A C - 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0 0 35 -2,-0.4 -9,-0.1 1,-0.2 -10,-0.0 -0.407 31.0-142.1 -66.8 132.3 -18.2 -5.3 29.5 210 222 A L S S+ 0 0 34 -11,-0.5 -1,-0.2 1,-0.3 -34,-0.1 0.970 90.7 15.1 -61.0 -54.0 -21.3 -5.6 27.3 211 223 A F S S+ 0 0 7 -36,-0.3 -1,-0.3 1,-0.1 12,-0.1 -0.680 70.4 172.5-124.2 83.4 -21.0 -9.4 26.7 212 224 A P + 0 0 55 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.883 19.2 169.1 -56.9-100.9 -18.5 -11.0 29.1 213 225 A G - 0 0 11 1,-0.1 -38,-0.1 5,-0.1 3,-0.1 0.401 40.4-135.7 99.4 121.7 -19.0 -14.7 28.4 214 226 A T S S- 0 0 110 1,-0.1 2,-0.3 -40,-0.1 -1,-0.1 0.499 83.3 -9.6 -95.1 -6.5 -16.9 -17.6 29.5 215 227 A D S > S- 0 0 73 -41,-0.0 4,-2.4 1,-0.0 5,-0.2 -0.970 87.6 -74.9-172.0-177.1 -16.8 -19.3 26.1 216 228 A H H > S+ 0 0 80 -2,-0.3 4,-1.5 1,-0.2 5,-0.1 0.781 127.0 47.6 -67.2 -23.8 -18.2 -19.2 22.6 217 229 A I H > S+ 0 0 69 2,-0.2 4,-1.5 3,-0.1 -1,-0.2 0.912 114.5 43.1 -81.3 -45.0 -21.6 -20.7 23.7 218 230 A D H > S+ 0 0 51 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.849 113.7 55.7 -64.9 -36.3 -22.1 -18.4 26.7 219 231 A Q H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.916 107.7 45.4 -61.7 -52.0 -20.9 -15.5 24.6 220 232 A L H X S+ 0 0 17 -4,-1.5 4,-2.1 -5,-0.2 -1,-0.2 0.823 112.4 53.2 -63.0 -31.3 -23.5 -16.1 21.9 221 233 A K H X S+ 0 0 97 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.922 107.7 50.3 -69.0 -47.2 -26.2 -16.5 24.5 222 234 A L H X S+ 0 0 38 -4,-2.6 4,-0.8 1,-0.2 -2,-0.2 0.916 112.5 48.5 -56.6 -42.9 -25.3 -13.2 26.1 223 235 A I H >X S+ 0 0 1 -4,-2.2 4,-2.5 1,-0.2 3,-0.7 0.907 108.1 51.3 -67.9 -41.2 -25.5 -11.6 22.7 224 236 A L H 3X S+ 0 0 5 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.840 100.4 65.9 -66.9 -28.0 -28.9 -13.0 21.7 225 237 A R H 3< S+ 0 0 129 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.887 112.5 31.9 -59.4 -36.1 -30.3 -11.8 25.0 226 238 A L H << S+ 0 0 3 -4,-0.8 30,-2.3 -3,-0.7 -2,-0.2 0.882 131.5 30.5 -88.8 -44.9 -29.8 -8.2 23.9 227 239 A V H < S- 0 0 17 -4,-2.5 28,-0.2 28,-0.2 -3,-0.2 0.678 107.5-125.1 -92.8 -12.0 -30.3 -8.4 20.1 228 240 A G < - 0 0 4 -4,-2.6 -3,-0.1 26,-0.4 27,-0.1 0.227 38.7 -54.5 84.6 154.3 -32.8 -11.3 20.1 229 241 A T S S- 0 0 14 24,-1.8 2,-0.1 1,-0.1 26,-0.1 -0.257 71.1 -88.2 -59.2 152.7 -32.7 -14.6 18.3 230 242 A P - 0 0 10 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.379 43.9-135.7 -58.7 132.5 -32.2 -14.4 14.5 231 243 A G > - 0 0 37 -3,-0.1 4,-2.4 -2,-0.1 3,-0.3 -0.256 34.4 -90.7 -79.1-179.3 -35.5 -14.1 12.7 232 244 A A H > S+ 0 0 73 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.798 124.1 65.9 -63.7 -23.0 -36.2 -16.1 9.6 233 245 A E H 4 S+ 0 0 122 1,-0.2 3,-0.3 2,-0.2 -1,-0.2 0.973 112.4 30.1 -64.6 -47.3 -34.8 -13.3 7.5 234 246 A L H >4 S+ 0 0 25 -3,-0.3 3,-2.0 1,-0.2 4,-0.2 0.817 111.3 66.8 -78.6 -29.4 -31.3 -13.7 8.8 235 247 A L H >< S+ 0 0 23 -4,-2.4 3,-1.2 1,-0.3 -1,-0.2 0.780 89.3 68.2 -65.0 -24.6 -31.7 -17.4 9.4 236 248 A K T 3< S+ 0 0 173 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.653 97.4 53.4 -57.2 -26.6 -31.9 -17.7 5.6 237 249 A K T < S+ 0 0 71 -3,-2.0 2,-0.7 -4,-0.2 -1,-0.2 0.353 82.7 98.1 -99.3 6.2 -28.2 -16.7 5.4 238 250 A I < - 0 0 18 -3,-1.2 6,-0.0 -4,-0.2 -3,-0.0 -0.851 51.2-172.4 -98.6 116.0 -26.8 -19.3 7.8 239 251 A S + 0 0 96 -2,-0.7 2,-0.5 4,-0.0 -1,-0.2 0.912 57.4 82.5 -71.3 -49.6 -25.4 -22.2 5.8 240 252 A S > - 0 0 42 1,-0.2 4,-3.4 4,-0.0 5,-0.2 -0.479 60.0-156.4 -72.9 117.9 -24.6 -24.7 8.5 241 253 A E H > S+ 0 0 127 -2,-0.5 4,-3.9 2,-0.2 5,-0.3 0.896 99.0 67.6 -43.8 -45.7 -27.4 -26.8 9.9 242 254 A S H > S+ 0 0 96 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.944 109.2 29.8 -39.4 -72.7 -25.0 -26.8 12.8 243 255 A A H > S+ 0 0 21 1,-0.2 4,-2.1 2,-0.2 3,-0.3 0.971 121.5 53.0 -55.1 -56.0 -25.4 -23.2 13.6 244 256 A R H X S+ 0 0 63 -4,-3.4 4,-1.9 1,-0.2 -2,-0.2 0.810 108.8 50.2 -55.8 -32.6 -29.0 -23.1 12.3 245 257 A N H X S+ 0 0 86 -4,-3.9 4,-1.1 -5,-0.2 -1,-0.2 0.884 110.4 48.0 -75.3 -39.5 -30.0 -26.0 14.5 246 258 A Y H X S+ 0 0 75 -4,-1.8 4,-1.2 -3,-0.3 3,-0.4 0.984 115.8 43.2 -63.2 -56.3 -28.6 -24.6 17.7 247 259 A I H >< S+ 0 0 14 -4,-2.1 3,-0.8 1,-0.3 -2,-0.2 0.914 117.1 46.0 -53.3 -50.1 -30.2 -21.2 17.3 248 260 A Q H 3< S+ 0 0 121 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.733 107.2 63.5 -66.9 -20.0 -33.5 -22.6 16.2 249 261 A S H 3< S+ 0 0 91 -4,-1.1 2,-0.3 -3,-0.4 -1,-0.2 0.784 92.0 70.5 -72.9 -32.7 -33.1 -25.0 19.2 250 262 A L S << S- 0 0 39 -4,-1.2 3,-0.1 -3,-0.8 -21,-0.0 -0.691 97.2-105.2 -88.4 141.8 -33.2 -22.1 21.7 251 263 A T - 0 0 123 -2,-0.3 -2,-0.1 1,-0.1 -1,-0.1 -0.368 52.1 -81.1 -64.4 152.0 -36.6 -20.5 22.2 252 264 A Q - 0 0 127 -4,-0.1 -1,-0.1 -24,-0.1 -4,-0.0 -0.173 40.5-155.4 -48.5 135.3 -36.9 -17.1 20.6 253 265 A M - 0 0 79 -3,-0.1 -24,-1.8 -29,-0.1 -1,-0.1 -0.979 21.5-125.9-106.2 128.0 -35.4 -14.3 22.7 254 266 A P - 0 0 108 0, 0.0 2,-0.4 0, 0.0 -26,-0.4 -0.379 26.6-103.6 -71.1 159.3 -37.0 -10.9 21.9 255 267 A K - 0 0 113 -28,-0.2 -28,-0.2 -27,-0.1 -29,-0.1 -0.694 43.8-125.3 -78.0 129.9 -34.8 -8.0 20.9 256 268 A M - 0 0 73 -30,-2.3 2,-0.9 -2,-0.4 3,-0.1 -0.344 16.2-104.5 -80.6 160.3 -34.4 -5.6 23.8 257 269 A N >> - 0 0 107 1,-0.2 3,-2.5 -2,-0.1 4,-1.0 -0.726 28.0-160.5 -73.0 98.3 -35.1 -1.8 24.0 258 270 A F H >> S+ 0 0 1 -2,-0.9 4,-3.2 1,-0.3 3,-0.7 0.840 88.7 68.2 -57.6 -34.5 -31.5 -0.5 24.0 259 271 A A H 34 S+ 0 0 45 1,-0.3 -1,-0.3 2,-0.2 6,-0.2 0.724 105.1 42.5 -50.6 -31.3 -33.0 2.7 25.5 260 272 A N H <4 S+ 0 0 120 -3,-2.5 -1,-0.3 2,-0.1 -2,-0.2 0.613 113.1 51.2 -94.0 -18.7 -33.6 0.6 28.6 261 273 A V H << S+ 0 0 48 -4,-1.0 -2,-0.2 -3,-0.7 -3,-0.1 0.919 124.3 27.2 -83.8 -43.4 -30.3 -1.2 28.6 262 274 A F S >< S+ 0 0 7 -4,-3.2 3,-1.4 1,-0.2 -1,-0.2 0.121 96.2 178.3 -99.2 18.6 -28.1 1.8 28.3 263 275 A I T 3 + 0 0 126 1,-0.3 2,-0.4 -5,-0.2 -1,-0.2 0.235 63.1 19.6 16.0 -97.1 -30.9 3.7 30.0 264 276 A G T 3 S+ 0 0 72 -3,-0.1 -1,-0.3 -4,-0.1 2,-0.2 -0.199 90.8 124.2 -92.6 38.4 -29.8 7.3 30.5 265 277 A A S < S- 0 0 21 -3,-1.4 -3,-0.0 -2,-0.4 5,-0.0 -0.546 83.3 -69.4 -83.9 164.3 -27.1 7.5 28.0 266 278 A N > - 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0 0 43 -2,-1.2 6,-0.1 -3,-0.3 5,-0.0 -0.891 53.0-144.8-102.5 132.6 -27.0 -5.8 14.5 279 291 A L S S+ 0 0 29 -2,-0.4 2,-1.0 -52,-0.1 -99,-0.2 0.928 83.0 81.4 -61.2 -47.7 -26.6 -9.6 13.9 280 292 A D >> - 0 0 11 1,-0.2 3,-2.0 2,-0.1 4,-0.9 -0.487 67.6-160.4 -68.4 106.9 -27.1 -9.4 10.2 281 293 A S T 34 S+ 0 0 13 -2,-1.0 -1,-0.2 1,-0.3 -90,-0.2 0.613 90.4 62.2 -61.7 -13.8 -23.7 -8.2 9.0 282 294 A D T 34 S+ 0 0 94 1,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.763 108.6 40.7 -78.4 -21.1 -25.4 -7.1 5.8 283 295 A K T <4 S+ 0 0 128 -3,-2.0 -2,-0.2 2,-0.1 -1,-0.1 0.550 89.2 112.8-103.6 -8.1 -27.5 -4.6 7.7 284 296 A R S < S- 0 0 7 -4,-0.9 -8,-0.2 -6,-0.1 -93,-0.1 -0.347 74.8-107.2 -65.0 135.4 -24.7 -3.4 10.1 285 297 A I - 0 0 21 -10,-1.8 2,-0.2 -13,-0.1 -1,-0.1 -0.361 33.0-131.3 -65.0 148.6 -23.6 0.3 9.6 286 298 A T > - 0 0 40 1,-0.1 4,-3.0 -92,-0.0 5,-0.2 -0.537 23.5-104.6 -92.2 166.9 -20.2 0.8 8.1 287 299 A A H > S+ 0 0 2 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.937 120.3 50.5 -57.3 -49.4 -17.5 3.1 9.4 288 300 A A H 4 S+ 0 0 51 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.898 114.8 45.0 -60.1 -34.0 -18.0 5.8 6.7 289 301 A Q H >4 S+ 0 0 115 2,-0.2 3,-1.5 1,-0.2 4,-0.4 0.907 109.8 53.6 -73.3 -43.6 -21.8 5.8 7.6 290 302 A A H >< S+ 0 0 0 -4,-3.0 3,-2.1 1,-0.3 6,-0.2 0.915 101.0 61.4 -58.9 -36.8 -21.3 5.8 11.3 291 303 A L T 3< S+ 0 0 0 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.745 104.3 50.6 -63.8 -17.3 -19.0 8.9 10.9 292 304 A A T < S+ 0 0 63 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.407 82.8 114.5-100.9 0.1 -22.1 10.7 9.5 293 305 A H S X S- 0 0 24 -3,-2.1 3,-1.7 -4,-0.4 7,-0.1 -0.416 80.0-113.7 -68.8 152.3 -24.4 9.8 12.3 294 306 A A G > S+ 0 0 55 1,-0.3 3,-2.3 2,-0.2 4,-0.2 0.746 105.9 79.3 -60.7 -24.9 -25.6 12.8 14.4 295 307 A Y G 3 S+ 0 0 0 1,-0.3 -1,-0.3 -27,-0.2 3,-0.2 0.752 99.2 43.8 -58.7 -20.7 -23.8 11.6 17.6 296 308 A F G X> S+ 0 0 0 -3,-1.7 4,-3.8 -6,-0.2 3,-1.8 0.074 71.7 122.4-111.6 21.8 -20.5 13.0 16.0 297 309 A A T <4 S+ 0 0 75 -3,-2.3 -1,-0.1 1,-0.3 -2,-0.1 0.750 75.8 55.6 -50.9 -28.7 -21.9 16.3 14.7 298 310 A Q T 34 S+ 0 0 109 -4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.671 122.8 23.1 -81.2 -21.9 -19.3 18.1 16.8 299 311 A Y T <4 S+ 0 0 64 -3,-1.8 -2,-0.2 -8,-0.1 -1,-0.1 0.617 91.3 114.1-116.8 -23.0 -16.4 16.2 15.3 300 312 A H < + 0 0 62 -4,-3.8 3,-0.1 -7,-0.1 -8,-0.1 -0.231 30.7 166.3 -63.3 132.0 -17.6 15.0 11.9 301 313 A D > - 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