==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-OCT-05 2BAJ . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.GERHARDT,R.A.PAUPTIT,J.READ,J.BREED,R.A.NORMAN,W.H.WARD . 337 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17351.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 207 61.4 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 . 41 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 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 . 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 . 23 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 27.3 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+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 1 0 0 0 1 0 1 1 0 1 1 0 1 0 0 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 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 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 -1 A H 0 0 141 0, 0.0 2,-0.3 0, 0.0 94,-0.1 0.000 360.0 360.0 360.0 140.8 1.0 -23.0 31.0 2 0 A H > - 0 0 61 92,-0.2 3,-1.4 1,-0.0 4,-0.2 -0.928 360.0-104.1-150.1 148.1 3.5 -22.8 28.1 3 1 A H G >> S+ 0 0 134 -2,-0.3 3,-2.4 1,-0.3 4,-0.7 0.852 114.7 61.4 -39.5 -52.3 5.7 -25.0 25.8 4 2 A S G 34 S+ 0 0 20 1,-0.3 3,-0.5 2,-0.2 5,-0.3 0.763 91.4 66.5 -59.7 -26.0 8.9 -24.2 27.7 5 3 A Q G <4 S+ 0 0 18 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.502 109.9 37.7 -75.4 -4.3 7.5 -25.7 30.9 6 4 A E T <4 S+ 0 0 143 -3,-2.4 -1,-0.2 -4,-0.2 -2,-0.2 0.386 102.9 82.3-111.9 -8.3 7.6 -29.1 29.1 7 5 A R S < S- 0 0 127 -4,-0.7 2,-1.8 -3,-0.5 3,-0.3 -0.868 75.3-141.6-109.4 102.4 10.9 -28.5 27.3 8 6 A P + 0 0 135 0, 0.0 -3,-0.1 0, 0.0 -4,-0.0 -0.412 59.4 127.5 -67.9 87.1 14.0 -29.2 29.4 9 7 A T + 0 0 24 -2,-1.8 13,-1.3 -5,-0.3 2,-0.3 0.509 33.0 110.1-120.0 -12.0 15.9 -26.2 28.0 10 8 A F E +A 21 0A 59 -3,-0.3 2,-0.3 11,-0.2 9,-0.0 -0.512 38.5 178.1 -85.8 127.4 17.0 -24.3 31.2 11 9 A Y E -A 20 0A 57 9,-2.3 9,-1.7 -2,-0.3 2,-0.4 -0.790 17.6-134.4-119.2 170.0 20.5 -24.1 32.3 12 10 A R E +A 19 0A 165 -2,-0.3 2,-0.3 7,-0.2 7,-0.2 -0.972 26.4 158.7-137.8 128.4 22.1 -22.4 35.2 13 11 A Q E -A 18 0A 57 5,-2.1 5,-2.2 -2,-0.4 2,-0.4 -0.968 37.2-117.7-139.3 153.2 25.1 -20.2 35.7 14 12 A E 0 0 156 -2,-0.3 -2,-0.0 3,-0.3 5,-0.0 -0.825 360.0 360.0 -96.0 138.7 26.1 -17.6 38.4 15 13 A L 0 0 69 -2,-0.4 -1,-0.1 13,-0.0 24,-0.0 -0.398 360.0 360.0-169.9 360.0 26.6 -14.1 37.1 16 ! 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 17 17 A I 0 0 72 0, 0.0 2,-0.4 0, 0.0 -3,-0.3 0.000 360.0 360.0 360.0 73.4 22.4 -16.9 39.5 18 18 A W E -A 13 0A 6 -5,-2.2 -5,-2.1 2,-0.0 2,-0.5 -0.711 360.0-171.6 -92.9 127.6 20.7 -17.0 36.0 19 19 A E E +A 12 0A 44 -2,-0.4 -7,-0.2 -7,-0.2 -9,-0.1 -0.976 27.5 154.3-113.5 113.0 18.5 -19.8 34.8 20 20 A V E -A 11 0A 1 -9,-1.7 -9,-2.3 -2,-0.5 -2,-0.0 -0.969 47.6 -88.0-138.6 152.3 17.8 -19.3 31.1 21 21 A P E > -A 10 0A 11 0, 0.0 3,-1.7 0, 0.0 -11,-0.2 -0.194 42.3-112.3 -57.8 154.2 16.9 -21.4 28.1 22 22 A E T 3 S+ 0 0 119 -13,-1.3 22,-0.1 1,-0.3 -12,-0.1 0.585 109.3 75.2 -70.0 -15.6 19.8 -22.8 26.1 23 23 A R T 3 S+ 0 0 53 1,-0.1 21,-3.2 20,-0.1 2,-0.7 0.758 86.2 73.9 -62.2 -26.7 19.1 -20.7 23.1 24 24 A Y E < +B 43 0B 1 -3,-1.7 19,-0.2 19,-0.2 2,-0.2 -0.838 68.7 160.5 -99.0 108.9 20.6 -17.8 25.1 25 25 A Q E +B 42 0B 74 17,-3.0 17,-2.5 -2,-0.7 -2,-0.0 -0.599 42.6 41.3-120.9 174.0 24.4 -18.2 25.3 26 26 A N E S- 0 0 108 15,-0.2 -1,-0.2 -2,-0.2 14,-0.1 0.832 70.3-166.0 53.9 41.5 27.5 -16.1 26.1 27 27 A L E + 0 0 18 -3,-0.2 14,-0.2 14,-0.1 -1,-0.1 -0.299 9.5 179.9 -60.4 140.4 25.9 -14.2 29.0 28 28 A S E -B 40 0B 59 12,-1.7 12,-2.3 -13,-0.0 -13,-0.0 -0.937 28.6-116.8-153.6 115.1 27.9 -11.1 29.9 29 29 A P E +B 39 0B 86 0, 0.0 10,-0.2 0, 0.0 3,-0.1 -0.258 35.7 165.0 -60.1 136.9 27.1 -8.7 32.7 30 30 A V E - 0 0 86 8,-2.5 2,-0.2 1,-0.4 9,-0.2 0.434 62.3 -12.0-126.4 -1.4 26.4 -5.1 31.6 31 31 A G E -B 38 0B 30 7,-0.9 7,-2.4 2,-0.0 -1,-0.4 -0.861 52.5-168.1 167.7 152.7 24.7 -3.5 34.7 32 32 A S E +B 37 0B 90 -2,-0.2 2,-0.3 5,-0.2 5,-0.2 -0.990 12.2 153.5-156.1 152.8 23.1 -4.1 38.0 33 33 A G - 0 0 35 3,-1.5 3,-0.4 -2,-0.3 130,-0.2 -0.891 60.0 -70.9-162.6-169.8 21.1 -2.4 40.7 34 34 A A S S+ 0 0 70 128,-0.5 129,-0.2 -2,-0.3 3,-0.1 0.747 127.4 46.4 -68.6 -22.8 18.6 -3.0 43.5 35 35 A Y S S- 0 0 30 127,-2.0 21,-1.9 1,-0.3 2,-0.3 0.485 122.2 -55.0-102.6 -9.9 15.8 -3.9 41.1 36 36 A G E - C 0 55B 1 -3,-0.4 -3,-1.5 126,-0.4 2,-0.3 -0.934 46.3 -93.8 159.3-174.8 17.6 -6.2 38.7 37 37 A S E -BC 32 54B 28 17,-2.5 17,-1.6 -2,-0.3 2,-0.4 -0.870 19.5-150.6-130.2 156.3 20.5 -7.2 36.4 38 38 A V E -BC 31 53B 10 -7,-2.4 -8,-2.5 -2,-0.3 -7,-0.9 -0.998 12.1-177.4-131.5 132.8 21.1 -7.1 32.7 39 39 A C E -BC 29 52B 1 13,-2.3 13,-2.7 -2,-0.4 2,-0.2 -0.952 22.0-134.3-117.1 145.7 23.3 -9.3 30.6 40 40 A A E +BC 28 51B 2 -12,-2.3 -12,-1.7 -2,-0.3 2,-0.3 -0.589 38.6 160.4 -77.9 162.8 24.1 -9.2 26.9 41 41 A A E - C 0 50B 0 9,-1.9 9,-2.6 -2,-0.2 2,-0.4 -0.943 38.6-107.5-171.5 169.3 24.0 -12.6 25.2 42 42 A F E -BC 25 49B 72 -17,-2.5 -17,-3.0 -2,-0.3 2,-0.7 -0.983 21.5-144.8-117.4 131.6 23.6 -14.3 21.9 43 43 A D E > -B 24 0B 2 5,-2.5 4,-2.2 -2,-0.4 5,-0.4 -0.848 7.1-165.7 -97.0 113.5 20.4 -16.1 20.9 44 44 A T T 4 S+ 0 0 81 -21,-3.2 -1,-0.1 -2,-0.7 -20,-0.1 0.746 85.5 59.6 -72.9 -25.2 21.3 -19.2 18.8 45 45 A K T 4 S+ 0 0 160 -22,-0.2 -1,-0.2 1,-0.1 -21,-0.0 0.973 120.7 24.2 -64.1 -56.5 17.6 -19.5 17.5 46 46 A T T 4 S- 0 0 45 2,-0.2 -2,-0.2 -23,-0.1 -1,-0.1 0.746 97.4-131.8 -82.2 -25.9 17.5 -16.0 15.9 47 47 A G < + 0 0 38 -4,-2.2 2,-0.2 1,-0.3 -3,-0.2 0.481 68.9 114.4 82.3 5.3 21.3 -15.6 15.3 48 48 A L - 0 0 92 -5,-0.4 -5,-2.5 1,-0.0 -1,-0.3 -0.642 69.3-107.6-109.1 164.0 21.1 -12.1 16.8 49 49 A R E +C 42 0B 118 -7,-0.2 59,-1.5 -2,-0.2 2,-0.3 -0.652 41.7 179.7 -91.0 149.3 22.6 -10.5 20.0 50 50 A V E -CD 41 107B 0 -9,-2.6 -9,-1.9 57,-0.3 2,-0.3 -0.905 26.6-127.0-143.7 162.7 20.3 -9.6 22.8 51 51 A A E -CD 40 106B 14 55,-2.3 55,-1.9 -2,-0.3 2,-0.4 -0.892 21.5-160.3-110.0 154.7 20.0 -8.2 26.3 52 52 A V E -CD 39 105B 2 -13,-2.7 -13,-2.3 -2,-0.3 2,-0.6 -0.989 3.3-158.3-139.0 127.2 18.3 -10.0 29.2 53 53 A K E -CD 38 104B 19 51,-2.1 51,-1.9 -2,-0.4 2,-0.7 -0.910 0.3-164.4-107.4 118.9 17.0 -8.5 32.5 54 54 A K E -CD 37 103B 34 -17,-1.6 -17,-2.5 -2,-0.6 49,-0.2 -0.938 22.6-137.4 -91.8 114.1 16.5 -10.7 35.5 55 55 A L E -C 36 0B 5 47,-1.9 2,-0.6 -2,-0.7 47,-0.3 -0.525 22.0-118.3 -61.7 141.4 14.3 -8.7 37.9 56 56 A S S S- 0 0 42 -21,-1.9 4,-0.2 1,-0.2 -1,-0.1 -0.773 79.7 -25.2 -95.3 117.3 15.6 -9.0 41.5 57 57 A R S > S- 0 0 160 -2,-0.6 3,-1.6 1,-0.1 4,-0.4 0.945 78.6-173.9 51.1 55.3 13.3 -10.6 44.0 58 58 A P T 3 S+ 0 0 0 0, 0.0 10,-0.3 0, 0.0 3,-0.1 0.684 74.1 33.4 -60.3 -24.9 10.3 -9.6 41.8 59 59 A F T 3 S+ 0 0 24 41,-0.4 -2,-0.1 1,-0.1 3,-0.1 -0.128 89.3 99.4-124.0 39.1 7.5 -10.8 44.2 60 60 A Q S < S+ 0 0 117 -3,-1.6 2,-0.3 -4,-0.2 -1,-0.1 0.799 90.4 15.9 -93.6 -37.2 9.1 -10.1 47.5 61 61 A S S > S- 0 0 39 -4,-0.4 4,-2.1 -3,-0.1 -1,-0.1 -0.852 78.7-112.8-126.6 168.1 7.5 -6.8 48.3 62 62 A I H > S+ 0 0 83 -2,-0.3 4,-2.6 2,-0.2 5,-0.4 0.873 117.4 57.5 -71.8 -34.5 4.4 -5.0 46.8 63 63 A I H > S+ 0 0 107 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.976 112.1 39.7 -55.3 -55.9 6.7 -2.4 45.4 64 64 A H H > S+ 0 0 32 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.896 115.8 53.4 -60.8 -40.4 8.7 -5.0 43.4 65 65 A A H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.906 113.8 38.3 -63.8 -48.3 5.6 -6.9 42.5 66 66 A K H X S+ 0 0 42 -4,-2.6 4,-2.9 1,-0.2 -1,-0.2 0.918 116.6 53.5 -70.5 -42.1 3.6 -4.1 41.0 67 67 A R H X S+ 0 0 45 -4,-2.3 4,-2.8 -5,-0.4 -2,-0.2 0.861 106.9 51.8 -59.2 -39.7 6.7 -2.7 39.4 68 68 A T H X S+ 0 0 3 -4,-2.4 4,-1.9 -10,-0.3 -1,-0.2 0.919 113.7 43.5 -63.0 -45.8 7.4 -6.1 37.8 69 69 A Y H X S+ 0 0 14 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.857 112.0 53.8 -67.9 -40.5 3.9 -6.2 36.4 70 70 A R H X S+ 0 0 86 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.964 110.6 46.1 -60.5 -54.3 4.0 -2.6 35.3 71 71 A E H X S+ 0 0 34 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.883 114.8 46.6 -58.3 -42.1 7.3 -3.1 33.3 72 72 A L H X S+ 0 0 1 -4,-1.9 4,-2.1 2,-0.2 5,-0.2 0.944 113.2 47.9 -70.4 -44.7 6.1 -6.2 31.6 73 73 A R H X S+ 0 0 39 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.935 113.4 50.4 -56.5 -45.3 2.7 -4.8 30.7 74 74 A L H X S+ 0 0 34 -4,-2.8 4,-1.5 1,-0.2 3,-0.3 0.930 112.9 43.6 -58.4 -46.8 4.6 -1.7 29.4 75 75 A L H < S+ 0 0 22 -4,-2.6 11,-1.1 1,-0.3 -1,-0.2 0.744 108.5 57.3 -77.2 -24.7 7.1 -3.6 27.2 76 76 A K H < S+ 0 0 37 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.797 110.8 45.4 -73.9 -30.3 4.5 -6.0 25.9 77 77 A H H < S+ 0 0 37 -4,-1.3 2,-0.9 -3,-0.3 232,-0.2 0.793 88.2 97.5 -79.1 -30.8 2.5 -2.9 24.6 78 78 A M < + 0 0 7 -4,-1.5 2,-0.5 -5,-0.1 8,-0.3 -0.458 38.9 158.9 -70.4 101.1 5.5 -1.1 23.0 79 79 A K + 0 0 156 -2,-0.9 2,-0.3 6,-0.1 5,-0.1 -0.796 31.1 113.1-121.9 86.2 5.6 -1.9 19.3 80 80 A H > - 0 0 12 -2,-0.5 3,-1.8 3,-0.5 48,-0.0 -0.971 68.4-126.4-157.4 140.0 7.6 0.9 17.8 81 81 A E T 3 S+ 0 0 109 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.819 111.0 47.1 -60.1 -31.6 11.0 1.1 16.0 82 82 A N T 3 S+ 0 0 5 74,-0.1 75,-2.1 45,-0.1 2,-0.3 0.134 105.8 70.6-100.5 19.7 12.3 3.9 18.4 83 83 A V B < S-f 157 0C 5 -3,-1.8 -3,-0.5 73,-0.3 75,-0.2 -0.997 93.9 -94.0-137.0 142.5 11.1 2.2 21.5 84 84 A I - 0 0 32 73,-2.3 2,-0.4 -2,-0.3 -6,-0.1 -0.202 44.5-162.0 -53.3 134.2 12.4 -0.9 23.3 85 85 A G - 0 0 19 -4,-0.1 2,-0.5 -6,-0.1 22,-0.5 -0.969 20.2-113.9-127.7 140.0 10.4 -4.0 22.3 86 86 A L + 0 0 15 -11,-1.1 20,-0.2 -2,-0.4 3,-0.1 -0.617 28.2 175.2 -73.8 119.4 10.1 -7.4 24.0 87 87 A L S S- 0 0 34 18,-3.0 2,-0.3 -2,-0.5 19,-0.2 0.660 73.2 -12.8 -83.1 -29.2 11.6 -10.2 22.0 88 88 A D E -E 105 0B 20 17,-1.6 17,-3.0 250,-0.1 2,-0.3 -0.990 50.3-161.7-167.3 156.2 10.9 -12.7 24.8 89 89 A V E +E 104 0B 7 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.961 28.5 165.3-144.3 140.2 9.9 -13.1 28.5 90 90 A F E -E 103 0B 11 13,-2.4 13,-1.3 -2,-0.3 244,-0.1 -0.992 23.9-162.8-156.3 159.5 10.5 -16.3 30.3 91 91 A T - 0 0 4 -2,-0.3 11,-0.1 2,-0.2 -71,-0.1 -0.986 27.0-134.8-144.2 145.2 10.7 -18.1 33.7 92 92 A P S S+ 0 0 25 0, 0.0 -82,-0.1 0, 0.0 7,-0.1 0.644 73.3 118.3 -68.5 -16.1 12.3 -21.4 34.8 93 93 A A - 0 0 3 8,-0.3 -2,-0.2 1,-0.1 3,-0.1 -0.284 50.3-165.8 -58.5 135.4 9.0 -22.0 36.7 94 94 A R S S+ 0 0 163 1,-0.2 2,-0.3 -93,-0.1 -92,-0.2 0.639 76.7 5.1 -95.6 -22.0 7.1 -25.0 35.6 95 95 A S S > S- 0 0 54 -94,-0.1 3,-1.9 1,-0.0 4,-0.4 -0.956 86.6 -90.9-150.8 170.2 4.0 -23.8 37.4 96 96 A L G > S+ 0 0 74 1,-0.3 3,-1.1 -2,-0.3 -3,-0.0 0.798 120.5 62.7 -48.4 -34.2 2.6 -20.8 39.4 97 97 A E G 3 S+ 0 0 180 1,-0.3 -1,-0.3 3,-0.0 -4,-0.0 0.698 109.5 39.5 -69.6 -23.8 3.9 -22.4 42.7 98 98 A E G < S+ 0 0 77 -3,-1.9 2,-0.9 3,-0.0 -1,-0.3 0.288 85.6 121.8-100.3 -0.6 7.5 -22.2 41.4 99 99 A F < + 0 0 0 -3,-1.1 3,-0.1 -4,-0.4 231,-0.1 -0.609 23.0 124.0 -77.5 103.7 7.0 -18.8 39.8 100 100 A N + 0 0 90 -2,-0.9 -41,-0.4 1,-0.2 2,-0.4 0.393 58.2 54.7-136.6 -11.6 9.6 -16.6 41.6 101 101 A D - 0 0 37 -3,-0.2 2,-0.4 -44,-0.1 -8,-0.3 -0.997 54.2-162.1-140.1 141.7 11.7 -15.0 38.8 102 102 A V - 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0 0 32 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.0 -0.336 29.1-147.8 -62.8 131.8 26.8 18.5 29.5 210 222 A L S S+ 0 0 30 -11,-0.4 -1,-0.1 1,-0.2 -31,-0.1 0.939 89.9 18.1 -67.2 -48.9 24.4 21.5 29.1 211 223 A F + 0 0 4 -33,-0.3 2,-1.4 -12,-0.1 -1,-0.2 -0.698 67.8 172.3-129.9 75.4 23.6 21.9 32.9 212 224 A P + 0 0 63 0, 0.0 -34,-0.1 0, 0.0 7,-0.0 -0.373 18.1 179.6 -81.2 58.1 26.2 20.1 35.1 213 225 A G - 0 0 1 -2,-1.4 3,-0.1 1,-0.1 -36,-0.1 -0.258 31.4-148.2 -61.1 140.7 24.9 21.4 38.5 214 226 A T S S- 0 0 89 1,-0.2 2,-0.2 2,-0.0 -1,-0.1 0.816 82.9 -15.0 -65.8 -33.8 26.7 20.4 41.7 215 227 A D S >> S- 0 0 78 -38,-0.0 4,-2.7 -47,-0.0 3,-0.6 -0.924 89.4 -70.8-167.5 174.3 23.3 20.6 43.4 216 228 A H H 3> S+ 0 0 99 1,-0.3 4,-1.8 -2,-0.2 5,-0.1 0.761 125.5 43.8 -60.6 -35.9 19.8 22.0 43.1 217 229 A I H 3> S+ 0 0 88 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.809 115.3 49.8 -75.6 -35.1 20.5 25.8 43.5 218 230 A D H <> S+ 0 0 37 -3,-0.6 4,-2.0 2,-0.2 -2,-0.2 0.889 109.2 53.8 -67.5 -41.7 23.5 25.5 41.2 219 231 A Q H X S+ 0 0 0 -4,-2.7 4,-2.2 2,-0.2 -2,-0.2 0.942 110.4 44.1 -61.8 -49.9 21.4 23.7 38.6 220 232 A L H X S+ 0 0 6 -4,-1.8 4,-3.5 1,-0.2 5,-0.3 0.941 110.9 53.6 -62.1 -48.6 18.7 26.4 38.5 221 233 A K H X S+ 0 0 125 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.872 111.4 48.1 -51.9 -38.9 21.3 29.2 38.3 222 234 A L H X S+ 0 0 24 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.861 113.1 47.3 -70.7 -38.6 22.9 27.4 35.4 223 235 A I H >X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 3,-0.6 0.963 115.4 44.1 -63.8 -53.4 19.4 26.9 33.7 224 236 A L H 3X S+ 0 0 2 -4,-3.5 4,-2.1 1,-0.3 -2,-0.2 0.812 104.7 63.8 -63.2 -32.7 18.5 30.6 34.3 225 237 A R H 3< S+ 0 0 135 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.909 113.5 36.1 -56.4 -39.9 21.9 31.7 33.1 226 238 A L H << S+ 0 0 9 -4,-1.2 30,-2.2 -3,-0.6 -2,-0.2 0.903 131.6 22.6 -78.0 -46.7 20.9 30.2 29.7 227 239 A V H < S- 0 0 19 -4,-2.2 28,-0.5 28,-0.2 -3,-0.2 0.544 104.5-117.8-110.9 -10.2 17.2 30.9 29.3 228 240 A G < - 0 0 3 -4,-2.1 -1,-0.2 26,-0.3 -2,-0.1 -0.074 40.0 -55.6 94.6 163.5 16.7 33.8 31.6 229 241 A T S S- 0 0 27 24,-1.5 26,-0.1 1,-0.1 19,-0.1 -0.330 70.9 -83.1 -67.7 154.1 14.5 34.3 34.6 230 242 A P - 0 0 18 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.242 39.8-132.6 -63.3 147.6 10.8 33.7 34.4 231 243 A G > - 0 0 49 -3,-0.1 4,-1.5 1,-0.0 -3,-0.0 -0.317 37.3 -84.0 -86.9-179.4 8.2 36.2 33.1 232 244 A A H > S+ 0 0 75 1,-0.2 4,-1.4 2,-0.2 -1,-0.0 0.834 121.0 52.4 -53.7 -48.8 4.9 37.3 34.7 233 245 A E H >> S+ 0 0 118 1,-0.2 4,-1.5 2,-0.2 3,-0.5 0.933 108.9 47.5 -62.4 -53.9 2.7 34.5 33.4 234 246 A L H 3> S+ 0 0 29 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.854 108.4 56.8 -54.6 -39.4 4.9 31.5 34.5 235 247 A L H >< S+ 0 0 22 -4,-1.5 3,-0.6 1,-0.2 -1,-0.2 0.864 104.9 51.2 -64.6 -35.0 5.2 33.0 38.0 236 248 A K H << S+ 0 0 159 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.872 106.6 54.7 -67.8 -39.0 1.4 33.2 38.5 237 249 A K H 3< S+ 0 0 82 -4,-1.5 2,-0.8 2,-0.0 -1,-0.2 0.567 81.0 99.9 -74.0 -13.3 1.0 29.5 37.5 238 250 A I << - 0 0 17 -4,-0.7 -55,-0.0 -3,-0.6 -4,-0.0 -0.698 58.0-166.8 -78.9 110.3 3.6 28.3 40.2 239 251 A S + 0 0 122 -2,-0.8 2,-0.9 1,-0.1 -1,-0.2 0.767 61.5 83.3 -78.5 -29.1 1.2 27.1 43.0 240 252 A S S S- 0 0 58 1,-0.1 5,-0.2 2,-0.1 -1,-0.1 -0.683 71.3-146.9 -80.8 107.5 3.7 26.8 45.9 241 253 A E 0 0 144 -2,-0.9 4,-2.4 1,-0.3 -1,-0.1 0.767 360.0 360.0 -39.3 -44.0 4.2 30.2 47.5 242 254 A S 0 0 94 2,-0.2 4,-1.8 3,-0.2 -1,-0.3 0.817 360.0 360.0 -78.1 360.0 7.9 29.5 48.3 243 ! 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 0.0 244 256 A R > 0 0 84 0, 0.0 4,-2.0 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 -56.9 7.5 31.4 43.6 245 257 A N H > + 0 0 95 -4,-2.4 4,-1.5 -5,-0.2 -3,-0.2 0.906 360.0 49.7 -52.9 -47.0 8.9 33.7 46.2 246 258 A Y H > S+ 0 0 83 -4,-1.8 4,-0.5 2,-0.2 -1,-0.2 0.922 114.7 38.4 -70.1 -51.2 12.4 32.2 45.7 247 259 A I H 4 S+ 0 0 20 -5,-0.2 3,-0.4 1,-0.2 -1,-0.2 0.797 114.7 56.1 -70.9 -27.1 12.6 32.4 41.8 248 260 A Q H < S+ 0 0 125 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.840 103.5 55.2 -69.1 -31.6 10.9 35.8 41.9 249 261 A S H < S+ 0 0 92 -4,-1.5 2,-0.3 -5,-0.2 -1,-0.2 0.637 86.2 105.2 -78.2 -14.4 13.5 37.2 44.3 250 262 A L S < S- 0 0 44 -4,-0.5 3,-0.1 -3,-0.4 -21,-0.0 -0.501 85.3-104.3 -71.0 128.9 16.3 36.2 41.8 251 263 A T - 0 0 112 -2,-0.3 2,-0.1 1,-0.1 -1,-0.1 -0.248 44.8-103.0 -47.2 130.3 17.9 39.0 40.0 252 264 A Q - 0 0 171 -4,-0.1 -1,-0.1 -24,-0.1 -4,-0.0 -0.410 41.3-170.4 -63.7 126.9 16.6 39.0 36.4 253 265 A M - 0 0 63 -2,-0.1 -24,-1.5 -3,-0.1 2,-0.3 -0.913 21.0-118.8-113.3 150.6 19.1 37.6 33.9 254 266 A P - 0 0 107 0, 0.0 -26,-0.3 0, 0.0 0, 0.0 -0.705 28.5-106.9 -88.8 138.0 18.7 37.8 30.1 255 267 A K - 0 0 87 -28,-0.5 -28,-0.2 -2,-0.3 -29,-0.1 -0.281 40.7-117.9 -47.1 141.6 18.5 34.7 27.9 256 268 A M - 0 0 73 -30,-2.2 2,-0.9 -31,-0.1 -1,-0.1 -0.411 27.4 -97.8 -78.3 159.3 21.6 34.1 25.9 257 269 A N >> - 0 0 94 1,-0.2 3,-0.9 -2,-0.1 4,-0.5 -0.791 35.5-155.0 -67.6 108.6 21.9 34.1 22.2 258 270 A F H >> S+ 0 0 0 -2,-0.9 4,-2.7 1,-0.2 3,-1.0 0.811 88.0 71.6 -59.4 -30.3 21.7 30.3 21.8 259 271 A A H 34 S+ 0 0 40 1,-0.3 5,-0.4 2,-0.2 6,-0.3 0.855 100.2 44.0 -54.6 -37.6 23.5 30.7 18.5 260 272 A N H <4 S+ 0 0 112 -3,-0.9 3,-0.3 1,-0.2 -1,-0.3 0.508 112.0 52.0 -90.4 -7.8 26.7 31.6 20.3 261 273 A V H << S+ 0 0 46 -3,-1.0 2,-1.0 -4,-0.5 -2,-0.2 0.828 116.8 40.6 -80.9 -41.9 26.3 28.8 22.9 262 274 A F S >< S- 0 0 4 -4,-2.7 3,-2.0 3,-0.1 -1,-0.2 -0.575 95.2-159.7-106.1 68.6 25.9 26.3 20.1 263 275 A I T 3 + 0 0 147 -2,-1.0 -3,-0.1 -3,-0.3 -4,-0.1 -0.257 69.0 0.8 -63.6 125.9 28.6 27.8 17.9 264 276 A G T 3 S+ 0 0 82 -5,-0.4 -1,-0.3 1,-0.2 -4,-0.1 0.291 93.4 144.3 87.2 -8.1 28.2 26.9 14.2 265 277 A A < - 0 0 25 -3,-2.0 -1,-0.2 -6,-0.3 5,-0.1 -0.224 65.1 -81.2 -66.6 151.9 25.0 24.8 14.6 266 278 A N > - 0 0 62 1,-0.1 4,-1.9 2,-0.1 3,-0.3 -0.257 38.5-131.5 -40.0 122.4 22.2 24.6 12.1 267 279 A P H > S+ 0 0 105 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.911 109.6 55.6 -49.9 -46.6 20.1 27.7 12.7 268 280 A L H > S+ 0 0 74 2,-0.2 4,-2.1 1,-0.2 27,-0.2 0.863 105.3 51.8 -50.1 -42.6 17.0 25.4 12.7 269 281 A A H > S+ 0 0 1 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.934 109.6 48.4 -62.3 -45.1 18.6 23.2 15.5 270 282 A V H X S+ 0 0 11 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.889 111.1 51.2 -64.3 -39.9 19.2 26.3 17.7 271 283 A D H X S+ 0 0 57 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.878 109.8 49.6 -64.3 -40.3 15.6 27.4 17.1 272 284 A L H X S+ 0 0 0 -4,-2.1 4,-0.9 2,-0.2 -2,-0.2 0.866 108.0 53.9 -66.3 -35.4 14.3 24.0 18.1 273 285 A L H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 3,-0.3 0.890 105.8 53.1 -66.8 -40.6 16.4 24.0 21.3 274 286 A E H < S+ 0 0 51 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.896 108.8 49.4 -59.1 -44.5 14.9 27.3 22.3 275 287 A K H < S+ 0 0 92 -4,-1.5 10,-2.3 1,-0.2 3,-0.3 0.680 114.6 46.9 -70.4 -18.4 11.4 25.9 21.9 276 288 A M H < S+ 0 0 0 -4,-0.9 2,-1.2 -3,-0.3 -2,-0.2 0.861 106.5 54.1 -86.1 -41.4 12.5 22.9 24.0 277 289 A L S < S+ 0 0 1 -4,-2.7 2,-0.4 -5,-0.1 -1,-0.2 -0.413 71.9 136.8 -98.1 57.9 14.2 24.6 26.9 278 290 A V - 0 0 35 -2,-1.2 6,-0.1 -3,-0.3 5,-0.1 -0.889 51.9-140.6-100.7 136.4 11.4 26.9 28.0 279 291 A L S S+ 0 0 28 -2,-0.4 2,-0.6 -52,-0.1 -96,-0.2 0.935 85.8 74.5 -60.2 -46.7 10.8 27.1 31.7 280 292 A D S >> S- 0 0 15 1,-0.1 3,-1.5 -3,-0.1 4,-0.6 -0.573 70.2-157.5 -76.9 113.6 7.0 27.3 31.5 281 293 A S T 34 S+ 0 0 20 -2,-0.6 -90,-0.2 1,-0.3 -1,-0.1 0.591 86.0 67.6 -72.6 -14.5 5.8 23.8 30.6 282 294 A D T 34 S+ 0 0 101 1,-0.2 -1,-0.3 -93,-0.1 -2,-0.1 0.561 110.9 37.0 -78.1 -9.2 2.5 24.9 29.1 283 295 A K T <4 S+ 0 0 116 -3,-1.5 -2,-0.2 2,-0.1 -1,-0.2 0.403 86.9 114.2-121.3 -10.3 4.5 26.5 26.3 284 296 A R S < S- 0 0 7 -4,-0.6 -8,-0.2 -6,-0.1 2,-0.1 -0.360 78.4-101.3 -58.2 144.8 7.3 24.0 25.8 285 297 A I - 0 0 18 -10,-2.3 2,-0.1 -13,-0.2 -1,-0.1 -0.484 38.3-134.2 -72.3 141.8 7.1 22.3 22.4 286 298 A T > - 0 0 55 -2,-0.1 4,-2.8 1,-0.1 5,-0.2 -0.479 24.2-102.8 -91.3 168.6 5.6 18.7 22.4 287 299 A A H > S+ 0 0 3 1,-0.2 4,-1.6 2,-0.2 -157,-0.2 0.925 121.7 47.5 -57.2 -45.1 6.9 15.6 20.7 288 300 A A H 4 S+ 0 0 54 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.875 114.7 45.3 -67.9 -41.1 4.3 15.9 17.9 289 301 A Q H >4 S+ 0 0 111 1,-0.2 3,-1.1 2,-0.2 4,-0.5 0.907 110.6 54.4 -61.2 -45.8 4.9 19.6 17.3 290 302 A A H >< S+ 0 0 0 -4,-2.8 3,-0.7 1,-0.3 6,-0.2 0.804 100.6 58.7 -66.9 -29.9 8.7 19.2 17.4 291 303 A L T 3< S+ 0 0 1 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.687 104.3 53.3 -66.5 -22.4 8.6 16.4 14.7 292 304 A A T < S+ 0 0 62 -3,-1.1 -1,-0.2 -4,-0.5 -2,-0.2 0.496 82.6 115.2 -93.2 -6.3 7.0 18.9 12.3 293 305 A H S X S- 0 0 30 -3,-0.7 3,-1.9 -4,-0.5 7,-0.1 -0.403 79.2-118.3 -60.7 144.0 9.7 21.5 12.9 294 306 A A G > S+ 0 0 60 1,-0.3 3,-2.0 2,-0.2 4,-0.2 0.635 104.4 79.6 -68.8 -18.5 11.6 22.2 9.8 295 307 A Y G 3 S+ 0 0 7 1,-0.3 -1,-0.3 -27,-0.2 3,-0.3 0.817 100.4 41.9 -52.6 -36.4 14.9 21.0 11.2 296 308 A F G X> S+ 0 0 0 -3,-1.9 4,-2.7 -6,-0.2 3,-2.7 0.139 75.4 125.3 -96.6 19.0 13.6 17.5 10.5 297 309 A A T <4 S+ 0 0 74 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.828 73.0 55.0 -54.5 -29.0 12.2 18.2 7.0 298 310 A Q T 34 S+ 0 0 143 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.621 120.6 29.2 -79.7 -11.8 14.3 15.4 5.5 299 311 A Y T <4 S+ 0 0 71 -3,-2.7 -2,-0.2 -8,-0.1 -1,-0.2 0.718 91.4 111.4-113.0 -29.8 12.9 12.8 7.9 300 312 A H < + 0 0 64 -4,-2.7 -8,-0.1 -7,-0.1 3,-0.1 -0.168 22.8 152.4 -56.4 129.0 9.4 14.0 8.8 301 313 A D > - 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0 0 25 -3,-0.7 -247,-0.1 -4,-0.3 -3,-0.0 -0.425 41.3-166.4 -64.1 130.1 3.5 -13.7 25.6 337 349 A V - 0 0 105 -2,-0.1 -2,-0.1 -249,-0.1 -249,-0.0 -0.988 22.6-117.6-117.6 129.7 4.0 -14.3 21.8 338 350 A P - 0 0 71 0, 0.0 3,-0.1 0, 0.0 -251,-0.1 -0.306 38.7 -96.6 -67.1 146.6 7.2 -13.2 20.1 339 351 A P - 0 0 58 0, 0.0 2,-0.1 0, 0.0 -254,-0.0 -0.283 56.8 -74.7 -61.5 145.1 7.0 -10.6 17.4 340 352 A P 0 0 135 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 -0.234 360.0 360.0 -41.2 105.4 6.8 -11.8 13.7 341 353 A L 0 0 183 -3,-0.1 -295,-0.0 -2,-0.1 0, 0.0 -0.533 360.0 360.0 -88.2 360.0 10.3 -12.9 12.6