==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 23-AUG-03 1UKI . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 8 ISOFORM 4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Y.-S.HEO,Y.K.KIM,B.-J.SUNG,H.S.LEE,J.I.LEE,C.I.SEO,S.- . 338 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16333.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 217 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 10.9 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 . 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 . 25 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 12.1 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 . 6 1.8 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 0 2 0 1 0 0 1 1 2 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 1 1 0 3 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 0 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 9 A N 0 0 148 0, 0.0 15,-1.3 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 -40.3 -21.3 44.2 39.3 2 10 A F E -A 15 0A 63 13,-0.2 2,-0.3 14,-0.1 13,-0.2 -0.597 360.0-152.2-107.8 172.0 -18.4 45.4 37.0 3 11 A Y E -A 14 0A 55 11,-3.0 11,-1.0 -2,-0.2 2,-0.5 -0.977 12.0-126.9-144.2 154.2 -16.3 48.6 37.3 4 12 A S E -A 13 0A 76 -2,-0.3 2,-0.5 9,-0.2 9,-0.2 -0.919 17.8-175.0-113.7 126.4 -14.5 50.7 34.7 5 13 A V E -A 12 0A 38 7,-2.5 7,-3.7 -2,-0.5 2,-0.8 -0.966 24.5-135.1-113.2 125.8 -10.8 51.7 34.9 6 14 A E E -A 11 0A 112 -2,-0.5 2,-0.6 5,-0.3 5,-0.3 -0.724 26.0-176.3 -82.8 111.4 -9.6 54.1 32.2 7 15 A I E > -A 10 0A 16 3,-2.1 3,-1.4 -2,-0.8 2,-0.1 -0.949 55.8 -50.0-111.8 119.5 -6.3 52.7 31.0 8 16 A G T 3 S- 0 0 64 -2,-0.6 -2,-0.0 1,-0.2 0, 0.0 -0.345 121.2 -16.9 60.5-127.3 -4.6 54.9 28.3 9 17 A D T 3 S+ 0 0 170 -2,-0.1 2,-0.3 2,-0.0 -1,-0.2 -0.063 128.9 61.7-100.9 31.4 -7.0 55.8 25.5 10 18 A S E < S-A 7 0A 28 -3,-1.4 -3,-2.1 -5,-0.0 2,-0.4 -0.957 78.5-121.8-157.3 135.9 -9.6 53.1 26.3 11 19 A T E -A 6 0A 68 -2,-0.3 2,-0.8 -5,-0.3 -5,-0.3 -0.648 20.7-150.2 -80.6 131.6 -11.8 52.3 29.2 12 20 A F E -A 5 0A 0 -7,-3.7 -7,-2.5 -2,-0.4 2,-1.2 -0.881 11.2-169.3-102.9 100.7 -11.3 48.8 30.7 13 21 A T E +A 4 0A 42 -2,-0.8 -9,-0.2 -9,-0.2 2,-0.1 -0.693 25.4 153.6 -97.9 89.8 -14.6 47.7 32.1 14 22 A V E -A 3 0A 0 -2,-1.2 -11,-3.0 -11,-1.0 2,-0.1 -0.456 49.8 -68.8-107.5 178.0 -13.8 44.6 34.1 15 23 A L E > -A 2 0A 28 -13,-0.2 3,-2.5 -2,-0.1 -13,-0.2 -0.426 42.1-122.1 -67.3 136.9 -15.1 42.6 37.0 16 24 A K T 3 S+ 0 0 109 -15,-1.3 22,-0.2 1,-0.3 -1,-0.1 0.762 107.3 79.3 -52.7 -23.4 -14.7 44.4 40.3 17 25 A R T 3 S+ 0 0 70 20,-0.1 21,-1.2 1,-0.1 22,-0.5 0.524 85.0 72.9 -64.3 -3.0 -12.7 41.3 41.4 18 26 A Y E < +B 37 0B 1 -3,-2.5 2,-0.2 19,-0.2 19,-0.2 -0.962 62.4 164.2-121.3 119.6 -9.8 42.8 39.4 19 27 A Q E +B 36 0B 92 17,-1.6 17,-0.7 -2,-0.5 3,-0.1 -0.572 50.1 40.4-119.8-179.0 -7.9 45.7 40.8 20 28 A N E - 0 0 116 15,-0.2 14,-0.2 -2,-0.2 -1,-0.1 0.725 69.4-174.8 49.8 27.9 -4.6 47.5 40.2 21 29 A L E + 0 0 23 -3,-0.2 14,-0.2 12,-0.1 -1,-0.2 -0.308 5.5 176.1 -54.7 130.7 -5.0 47.1 36.5 22 30 A K E -B 34 0B 121 12,-0.7 12,-2.4 -3,-0.1 2,-0.3 -0.982 29.9-116.6-142.0 127.7 -1.7 48.4 34.9 23 31 A P E +B 33 0B 65 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.480 49.8 143.4 -71.4 128.2 -0.9 48.3 31.1 24 32 A I + 0 0 99 8,-2.8 2,-1.0 -2,-0.3 9,-0.2 0.295 56.0 90.3-133.3 -16.1 2.1 46.2 30.0 25 33 A G + 0 0 15 7,-3.3 7,-0.4 1,-0.1 -1,-0.0 -0.754 33.7 151.9 -95.2 96.9 0.4 45.1 26.9 26 34 A S + 0 0 123 -2,-1.0 -1,-0.1 5,-0.2 5,-0.1 -0.049 37.8 128.3-109.1 25.7 1.2 47.5 24.1 27 35 A G - 0 0 51 3,-0.5 3,-0.4 1,-0.1 -2,-0.0 -0.371 66.7-122.8 -79.2 163.6 0.8 44.7 21.5 28 36 A A S S+ 0 0 105 1,-0.2 3,-0.1 -2,-0.1 -1,-0.1 0.809 105.2 64.4 -78.1 -33.3 -1.5 45.0 18.5 29 37 A Q S S- 0 0 47 1,-0.2 2,-0.3 20,-0.0 -1,-0.2 0.656 124.7 -47.6 -66.8 -11.5 -3.7 41.9 19.1 30 38 A G - 0 0 15 -3,-0.4 2,-0.5 19,-0.1 -3,-0.5 -0.901 60.0 -80.1 160.9 170.7 -4.9 43.8 22.2 31 39 A I E - C 0 48B 50 17,-1.3 17,-2.1 -2,-0.3 2,-0.5 -0.874 41.1-163.6 -99.1 127.8 -4.1 45.8 25.3 32 40 A V E - C 0 47B 32 -2,-0.5 -7,-3.3 -7,-0.4 -8,-2.8 -0.945 6.1-172.5-117.4 129.3 -3.0 43.7 28.3 33 41 A C E -BC 23 46B 0 13,-3.0 13,-1.2 -2,-0.5 2,-0.6 -0.641 25.8-121.0-111.0 173.1 -2.9 45.0 31.9 34 42 A A E +BC 22 45B 20 -12,-2.4 -12,-0.7 -2,-0.2 11,-0.2 -0.972 42.8 164.9-114.7 114.3 -1.7 43.6 35.1 35 43 A A E - 0 0 5 9,-1.0 9,-0.4 -2,-0.6 2,-0.3 -0.235 34.4-115.5-110.1-157.8 -4.5 43.3 37.6 36 44 A Y E -B 19 0B 87 -17,-0.7 -17,-1.6 7,-0.2 2,-1.3 -0.968 15.4-140.3-145.7 125.5 -5.0 41.5 40.9 37 45 A D E >> -B 18 0B 3 5,-3.1 4,-2.7 -2,-0.3 3,-1.5 -0.641 15.3-172.8 -95.4 84.8 -7.6 38.8 41.4 38 46 A A T 34 S+ 0 0 48 -2,-1.3 -1,-0.2 -21,-1.2 -20,-0.1 0.645 81.2 66.4 -45.3 -20.7 -8.9 39.6 44.8 39 47 A I T 34 S+ 0 0 106 -22,-0.5 -1,-0.3 1,-0.2 -21,-0.1 0.022 121.0 16.1 -96.5 29.4 -10.9 36.3 44.6 40 48 A L T <4 S- 0 0 89 -3,-1.5 -2,-0.2 2,-0.1 -1,-0.2 0.139 101.8-124.3-167.0 -21.2 -7.8 34.2 44.6 41 49 A E S < S+ 0 0 149 -4,-2.7 2,-0.3 1,-0.2 -3,-0.2 0.999 70.2 116.5 59.3 68.3 -5.4 36.8 45.9 42 50 A R S S- 0 0 96 -5,-0.4 -5,-3.1 0, 0.0 2,-0.4 -0.979 70.9 -94.2-163.3 153.5 -3.1 36.4 42.9 43 51 A N + 0 0 84 -2,-0.3 59,-1.0 -7,-0.2 2,-0.2 -0.582 45.7 172.9 -78.3 128.1 -1.7 38.3 39.9 44 52 A V E - D 0 101B 0 -2,-0.4 -9,-1.0 -9,-0.4 2,-0.4 -0.617 28.7-123.5-121.8 178.9 -3.5 37.8 36.7 45 53 A A E -CD 34 100B 8 55,-2.4 55,-1.7 -2,-0.2 2,-0.5 -0.972 19.3-163.0-134.5 116.1 -3.3 39.3 33.2 46 54 A I E -CD 33 99B 0 -13,-1.2 -13,-3.0 -2,-0.4 2,-0.5 -0.894 6.1-172.2-103.8 123.0 -6.4 40.9 31.6 47 55 A K E -CD 32 98B 15 51,-2.9 51,-2.6 -2,-0.5 2,-0.5 -0.970 8.3-153.9-119.0 122.8 -6.4 41.5 27.8 48 56 A K E -CD 31 97B 14 -17,-2.1 -17,-1.3 -2,-0.5 2,-0.7 -0.827 7.2-164.0-101.5 127.8 -9.2 43.4 26.1 49 57 A L E - D 0 96B 6 47,-3.3 47,-2.2 -2,-0.5 2,-0.6 -0.933 20.3-143.7-105.6 108.8 -10.2 43.0 22.5 50 58 A S E S- D 0 95B 76 -2,-0.7 45,-0.2 1,-0.3 47,-0.0 -0.673 76.5 -25.5 -77.0 120.6 -12.2 46.0 21.6 51 59 A R S S- 0 0 81 43,-1.3 -1,-0.3 -2,-0.6 44,-0.1 0.918 70.0-166.3 36.7 75.9 -15.0 44.9 19.3 52 60 A P S S+ 0 0 0 0, 0.0 2,-0.3 0, 0.0 3,-0.3 0.938 75.9 67.8 -55.0 -40.8 -13.1 41.8 18.0 53 61 A F + 0 0 5 5,-0.2 3,-0.1 1,-0.2 264,-0.0 -0.598 55.5 104.2 -80.6 139.4 -15.8 41.8 15.4 54 62 A Q S S+ 0 0 111 -2,-0.3 2,-0.2 1,-0.1 -1,-0.2 0.183 87.7 20.9 168.0 -5.3 -15.6 44.7 12.9 55 63 A N S > S- 0 0 60 -3,-0.3 4,-1.8 262,-0.1 5,-0.4 -0.788 84.6-104.2-179.2 135.5 -14.1 42.9 9.9 56 64 A Q H > S+ 0 0 104 -2,-0.2 4,-1.0 1,-0.2 5,-0.2 0.781 117.4 54.9 -33.8 -41.3 -13.9 39.3 8.7 57 65 A T H >> S+ 0 0 99 2,-0.2 4,-2.6 3,-0.1 3,-1.9 0.992 110.5 36.6 -60.0 -78.2 -10.2 39.4 9.8 58 66 A H H 3> S+ 0 0 69 1,-0.3 4,-3.4 2,-0.2 5,-0.3 0.880 113.3 57.1 -42.8 -53.8 -10.3 40.5 13.4 59 67 A A H 3X S+ 0 0 0 -4,-1.8 4,-1.7 1,-0.2 -1,-0.3 0.804 115.2 40.6 -50.8 -30.1 -13.4 38.5 14.2 60 68 A K H X S+ 0 0 38 -4,-1.7 4,-1.5 -5,-0.2 3,-0.6 0.942 113.8 50.3 -51.7 -59.3 -11.2 28.8 21.0 68 76 A L H >X S+ 0 0 27 -4,-2.7 4,-3.1 1,-0.2 3,-0.7 0.905 108.3 52.1 -46.5 -56.2 -7.5 27.9 21.4 69 77 A M H 3< S+ 0 0 11 -4,-2.8 11,-0.5 1,-0.2 -1,-0.2 0.812 106.7 55.5 -53.1 -36.8 -7.2 29.2 24.9 70 78 A K H << S+ 0 0 70 -4,-1.6 -1,-0.2 -3,-0.6 -2,-0.2 0.848 121.6 24.8 -67.9 -36.9 -10.3 27.2 26.0 71 79 A C H << S+ 0 0 35 -4,-1.5 2,-0.5 -3,-0.7 -2,-0.2 0.631 100.2 91.7-105.6 -17.2 -8.9 23.8 24.9 72 80 A V < + 0 0 10 -4,-3.1 8,-0.4 -5,-0.3 2,-0.3 -0.693 52.4 169.7 -81.8 127.2 -5.2 24.4 25.0 73 81 A N + 0 0 126 -2,-0.5 2,-0.3 6,-0.1 5,-0.1 -0.817 11.6 124.3-150.7 110.6 -3.7 23.4 28.3 74 82 A H > - 0 0 16 3,-0.4 3,-1.6 -2,-0.3 231,-0.1 -0.984 58.1-119.0-157.3 150.9 -0.1 22.9 29.5 75 83 A K T 3 S+ 0 0 116 -2,-0.3 4,-0.1 1,-0.3 55,-0.1 0.622 115.2 52.2 -68.0 -14.1 2.1 24.3 32.3 76 84 A N T 3 S+ 0 0 3 82,-0.1 83,-0.4 229,-0.1 2,-0.4 0.138 100.6 73.4-109.1 18.4 4.4 25.7 29.7 77 85 A I S < S- 0 0 6 -3,-1.6 -3,-0.4 81,-0.3 2,-0.3 -0.997 99.4 -92.4-133.7 136.4 1.7 27.6 27.8 78 86 A I - 0 0 8 81,-3.0 2,-0.2 -2,-0.4 -2,-0.1 -0.249 52.0-144.5 -47.8 104.1 -0.1 30.8 28.8 79 87 A G - 0 0 8 -2,-0.3 22,-1.9 -4,-0.1 2,-0.1 -0.528 7.3-117.4 -82.7 143.7 -3.1 29.3 30.6 80 88 A L E +E 100 0B 49 -11,-0.5 20,-0.3 -8,-0.4 -1,-0.1 -0.433 29.9 172.7 -76.4 147.2 -6.6 30.9 30.6 81 89 A L E - 0 0 61 18,-2.9 19,-0.3 1,-0.2 2,-0.2 0.626 65.1 -15.7-122.3 -34.8 -8.2 32.1 33.8 82 90 A N E -E 99 0B 31 17,-2.5 17,-4.2 249,-0.1 2,-0.4 -0.737 42.2-165.1 179.9 127.6 -11.3 33.8 32.6 83 91 A V E +E 98 0B 2 15,-0.3 2,-0.3 -2,-0.2 15,-0.2 -0.953 31.5 153.3-115.3 132.2 -13.0 35.2 29.5 84 92 A F E -E 97 0B 12 13,-2.1 13,-2.2 -2,-0.4 245,-0.1 -0.947 31.0-141.9-151.6 168.3 -16.0 37.5 30.1 85 93 A T - 0 0 15 -2,-0.3 11,-0.1 11,-0.2 8,-0.1 -0.997 9.8-151.2-138.9 138.9 -18.0 40.4 28.6 86 94 A P S S+ 0 0 26 0, 0.0 -1,-0.1 0, 0.0 -84,-0.1 0.801 72.6 101.6 -77.1 -29.4 -19.6 43.4 30.4 87 95 A Q - 0 0 30 8,-0.3 -2,-0.1 1,-0.1 6,-0.1 -0.335 67.7-147.6 -58.1 130.8 -22.3 43.6 27.6 88 96 A K S S+ 0 0 181 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.789 71.6 17.9 -73.9 -30.1 -25.5 42.0 28.8 89 97 A S S > S- 0 0 35 1,-0.1 4,-2.6 0, 0.0 -1,-0.1 -0.906 78.7-104.0-141.4 170.1 -26.7 40.7 25.5 90 98 A L T 4 S+ 0 0 37 -2,-0.3 -1,-0.1 2,-0.2 235,-0.1 0.809 118.3 63.9 -59.4 -29.3 -25.6 39.8 22.0 91 99 A E T 4 S+ 0 0 148 1,-0.2 -1,-0.2 3,-0.0 -4,-0.0 0.989 117.3 19.9 -57.1 -78.0 -27.3 43.0 21.1 92 100 A E T 4 S+ 0 0 104 2,-0.0 -1,-0.2 0, 0.0 -2,-0.2 0.642 96.4 128.4 -69.0 -14.5 -25.1 45.4 23.0 93 101 A F < + 0 0 0 -4,-2.6 3,-0.1 1,-0.1 232,-0.1 -0.171 17.5 129.0 -45.4 124.2 -22.4 42.8 23.0 94 102 A Q + 0 0 77 1,-0.3 -43,-1.3 231,-0.0 2,-0.3 0.299 48.5 64.2-168.2 21.6 -19.2 44.4 21.6 95 103 A D E -D 50 0B 13 -45,-0.2 2,-0.4 -44,-0.1 -8,-0.3 -0.937 52.1-162.2-156.6 129.0 -16.2 43.8 23.9 96 104 A V E -D 49 0B 0 -47,-2.2 -47,-3.3 -2,-0.3 2,-0.4 -0.940 3.6-169.1-119.9 136.9 -14.2 40.8 25.0 97 105 A Y E -DE 48 84B 2 -13,-2.2 -13,-2.1 -2,-0.4 2,-0.5 -0.975 3.3-163.1-125.1 130.8 -11.8 40.4 28.0 98 106 A I E -DE 47 83B 1 -51,-2.6 -51,-2.9 -2,-0.4 2,-0.4 -0.951 1.7-162.5-117.6 127.3 -9.5 37.5 28.7 99 107 A V E +DE 46 82B 0 -17,-4.2 -18,-2.9 -2,-0.5 -17,-2.5 -0.854 24.5 153.6-102.9 141.1 -7.9 36.8 32.0 100 108 A M E -DE 45 80B 18 -55,-1.7 -55,-2.4 -2,-0.4 -20,-0.2 -0.945 48.7 -58.9-158.8 165.3 -5.0 34.5 32.0 101 109 A E E -D 44 0B 43 -22,-1.9 2,-0.6 -2,-0.3 -57,-0.2 -0.107 46.1-128.5 -57.6 149.2 -1.9 34.0 34.2 102 110 A L - 0 0 32 -59,-1.0 2,-0.2 -24,-0.0 -59,-0.1 -0.874 21.7-165.2-104.2 117.6 0.6 36.7 34.8 103 111 A M - 0 0 21 -2,-0.6 49,-0.2 1,-0.1 3,-0.1 -0.630 26.4-121.1 -97.9 159.4 4.3 36.0 34.2 104 112 A D S S- 0 0 87 47,-0.9 2,-0.2 1,-0.2 48,-0.2 0.824 74.9 -42.0 -70.3 -35.5 7.2 38.1 35.4 105 113 A A E -F 151 0C 42 46,-1.8 46,-3.4 4,-0.0 -1,-0.2 -0.878 55.9 -96.6 173.1 156.2 8.8 38.9 32.0 106 114 A N E > -F 150 0C 44 44,-0.3 3,-0.5 -2,-0.2 4,-0.5 -0.005 45.7 -96.8 -75.2-173.6 9.9 37.5 28.6 107 115 A L T 3> S+ 0 0 3 39,-1.5 4,-1.8 42,-0.8 5,-0.3 0.531 88.9 111.4 -84.8 -5.3 13.3 36.3 27.7 108 116 A C T 34 S+ 0 0 62 38,-0.7 -1,-0.2 1,-0.2 4,-0.2 0.761 96.7 11.1 -38.1 -40.2 14.4 39.5 26.0 109 117 A Q T X> S+ 0 0 110 -3,-0.5 3,-2.5 2,-0.1 4,-1.0 0.817 112.5 71.9-108.4 -50.7 16.9 40.2 28.8 110 118 A V T 34 S+ 0 0 8 -4,-0.5 -2,-0.1 1,-0.3 -3,-0.1 0.795 96.2 62.6 -36.9 -34.0 17.4 37.1 30.9 111 119 A I T 3< S+ 0 0 1 -4,-1.8 -1,-0.3 1,-0.2 4,-0.2 0.890 97.8 53.3 -62.0 -42.5 19.2 35.8 27.8 112 120 A Q T <4 S+ 0 0 92 -3,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.981 98.3 79.2 -53.7 -60.1 21.9 38.4 28.0 113 121 A M S < S- 0 0 70 -4,-1.0 2,-0.7 1,-0.1 88,-0.1 0.246 96.1 -96.3 -40.3 168.3 22.7 37.5 31.6 114 122 A E + 0 0 136 87,-0.0 2,-0.4 146,-0.0 -1,-0.1 -0.865 46.0 174.7-103.9 114.3 24.8 34.5 32.5 115 123 A L - 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0 0 108 -54,-0.2 4,-1.5 -55,-0.2 5,-0.2 -0.007 45.2 -98.8 -52.0 167.0 11.9 29.9 -5.5 234 254 A P H > S+ 0 0 88 0, 0.0 4,-1.4 0, 0.0 3,-0.2 0.969 117.8 38.0 -60.5 -55.6 13.3 31.0 -8.9 235 255 A T H > S+ 0 0 100 1,-0.2 4,-1.7 2,-0.2 -3,-0.0 0.858 117.3 49.6 -65.0 -38.9 14.5 34.6 -8.0 236 256 A V H > S+ 0 0 31 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.774 105.5 57.8 -72.3 -27.2 15.8 33.7 -4.5 237 257 A R H X S+ 0 0 82 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.903 105.4 51.4 -68.2 -41.0 17.8 30.7 -5.9 238 258 A T H X S+ 0 0 71 -4,-1.4 4,-1.6 2,-0.2 5,-0.3 0.991 106.5 53.7 -54.5 -64.9 19.6 33.1 -8.2 239 259 A Y H >< S+ 0 0 65 -4,-1.7 3,-1.1 1,-0.3 4,-0.4 0.854 111.5 43.7 -35.1 -61.3 20.6 35.4 -5.4 240 260 A V H >< S+ 0 0 9 -4,-1.8 3,-2.2 1,-0.3 -1,-0.3 0.942 113.2 52.3 -53.5 -51.1 22.1 32.7 -3.3 241 261 A E H 3< S+ 0 0 102 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.653 104.9 57.4 -61.5 -17.7 23.9 31.3 -6.4 242 262 A N T << S+ 0 0 114 -4,-1.6 -1,-0.3 -3,-1.1 -2,-0.2 0.465 93.2 91.6 -92.9 -1.6 25.3 34.7 -7.1 243 263 A R S < S- 0 0 84 -3,-2.2 3,-0.1 -4,-0.4 -3,-0.0 -0.662 83.5 -95.2 -98.2 152.8 27.0 34.9 -3.7 244 264 A P - 0 0 78 0, 0.0 2,-0.9 0, 0.0 -1,-0.1 0.153 54.1 -78.5 -50.9 170.4 30.5 33.9 -2.7 245 265 A K + 0 0 196 1,-0.1 2,-0.7 2,-0.0 -26,-0.0 -0.677 50.2 178.8 -83.0 108.2 31.4 30.5 -1.2 246 266 A Y + 0 0 64 -2,-0.9 -23,-2.5 -3,-0.1 3,-0.1 -0.680 11.7 171.7-110.8 77.5 30.4 30.7 2.5 247 267 A A - 0 0 87 -2,-0.7 -1,-0.1 -25,-0.2 -28,-0.1 0.353 39.5-144.6 -68.1 11.6 31.1 27.3 4.0 248 268 A G - 0 0 20 -29,-0.3 2,-0.3 -30,-0.0 -27,-0.2 -0.275 21.5 -77.3 63.8-145.5 30.3 28.9 7.3 249 269 A Y - 0 0 127 -29,-0.9 2,-0.2 -28,-0.7 -3,-0.0 -0.886 43.9 -91.0-145.0 172.1 32.2 27.9 10.5 250 270 A S > - 0 0 43 -2,-0.3 4,-2.6 1,-0.1 3,-0.4 -0.515 32.8-115.8 -88.5 161.0 32.1 25.0 12.9 251 271 A F H > S+ 0 0 37 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.589 116.6 62.3 -70.5 -7.1 30.0 25.0 16.1 252 272 A E H 4 S+ 0 0 108 2,-0.2 -1,-0.2 1,-0.1 5,-0.2 0.875 112.9 31.8 -81.6 -42.8 33.2 24.9 18.0 253 273 A K H 4 S+ 0 0 158 -3,-0.4 -2,-0.2 3,-0.1 -1,-0.1 0.775 119.2 54.7 -84.5 -31.7 34.4 28.4 16.6 254 274 A L H < S+ 0 0 18 -4,-2.6 -3,-0.2 1,-0.3 -2,-0.2 0.970 124.0 24.3 -63.7 -57.3 30.8 29.7 16.4 255 275 A F S < S- 0 0 5 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.1 -0.764 91.1-160.2-112.7 80.1 30.1 29.0 20.0 256 276 A P > - 0 0 43 0, 0.0 3,-0.8 0, 0.0 4,-0.3 -0.128 30.2-112.9 -57.8 157.2 33.5 29.0 21.7 257 277 A D G > S+ 0 0 104 1,-0.2 3,-1.7 -5,-0.2 -4,-0.1 0.756 111.6 75.7 -63.4 -24.6 33.9 27.2 25.0 258 278 A V G 3 S+ 0 0 132 1,-0.3 -1,-0.2 3,-0.0 -3,-0.0 0.916 86.6 58.7 -53.4 -47.1 34.6 30.7 26.5 259 279 A L G < S+ 0 0 47 -3,-0.8 -1,-0.3 2,-0.0 -2,-0.2 0.678 104.2 68.5 -57.7 -18.3 30.8 31.5 26.3 260 280 A F < 0 0 21 -3,-1.7 -144,-0.1 -4,-0.3 -146,-0.0 -0.386 360.0 360.0 -99.5 175.1 30.2 28.5 28.6 261 281 A P 0 0 89 0, 0.0 6,-0.2 0, 0.0 -1,-0.1 -0.687 360.0 360.0 -98.6 360.0 30.9 27.7 32.3 262 ! 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 0.0 263 287 A N 0 0 101 0, 0.0 4,-0.1 0, 0.0 -146,-0.1 0.000 360.0 360.0 360.0 -1.2 29.9 19.8 34.0 264 288 A K + 0 0 156 2,-0.1 4,-0.2 3,-0.0 3,-0.1 0.716 360.0 39.9-108.9 -35.1 32.7 20.1 31.4 265 289 A L S >> S+ 0 0 96 1,-0.2 3,-2.5 2,-0.2 4,-2.4 0.782 97.4 80.1 -83.9 -32.4 31.2 18.1 28.6 266 290 A K H 3> S+ 0 0 60 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.868 88.9 55.7 -41.5 -46.9 27.8 19.6 29.2 267 291 A A H 34 S+ 0 0 8 1,-0.3 -1,-0.3 2,-0.2 -2,-0.2 0.730 114.8 37.2 -62.9 -23.8 28.8 22.7 27.3 268 292 A S H <> S+ 0 0 57 -3,-2.5 4,-2.3 2,-0.2 -1,-0.3 0.620 111.3 60.7 -98.5 -18.6 29.8 20.7 24.2 269 293 A Q H X S+ 0 0 31 -4,-2.4 4,-0.9 1,-0.2 27,-0.2 0.840 106.1 48.5 -70.6 -36.6 26.8 18.4 24.8 270 294 A A H X S+ 0 0 0 -4,-2.3 4,-1.3 -5,-0.3 -1,-0.2 0.653 107.6 55.4 -76.5 -20.6 24.8 21.6 24.4 271 295 A R H > S+ 0 0 14 -5,-0.2 4,-2.9 2,-0.2 3,-0.2 0.929 99.3 59.1 -78.0 -47.0 26.7 22.4 21.3 272 296 A D H < S+ 0 0 63 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.839 106.0 51.0 -48.9 -36.1 25.8 19.0 19.7 273 297 A L H >X S+ 0 0 1 -4,-0.9 3,-1.7 1,-0.2 4,-0.8 0.923 108.6 48.8 -68.8 -46.2 22.2 20.1 20.1 274 298 A L H >X S+ 0 0 0 -4,-1.3 4,-2.8 1,-0.3 3,-1.5 0.926 103.2 62.2 -57.9 -45.1 22.7 23.4 18.4 275 299 A S H 3< S+ 0 0 41 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.402 112.8 38.3 -62.4 4.6 24.5 21.6 15.6 276 300 A K H <4 S+ 0 0 84 -3,-1.7 10,-3.8 -5,-0.2 -1,-0.3 0.418 116.4 48.5-131.4 -8.2 21.2 19.9 15.0 277 301 A M H << S+ 0 0 1 -3,-1.5 2,-1.0 -4,-0.8 -85,-0.2 0.675 103.0 61.9-104.8 -27.5 18.8 22.7 15.7 278 302 A L < + 0 0 6 -4,-2.8 2,-0.5 -5,-0.2 -1,-0.2 -0.650 68.9 134.6-103.2 73.5 20.5 25.3 13.5 279 303 A V - 0 0 30 -2,-1.0 5,-0.2 -3,-0.2 6,-0.1 -0.969 42.1-159.5-125.9 110.1 20.1 23.5 10.2 280 304 A I S S+ 0 0 10 -2,-0.5 2,-1.4 -58,-0.2 -105,-0.2 0.890 80.7 78.1 -56.7 -45.2 19.0 25.7 7.3 281 305 A D S > S- 0 0 16 1,-0.2 3,-3.0 3,-0.1 4,-0.4 -0.551 79.1-152.8 -68.5 98.4 17.8 22.8 5.2 282 306 A A G > S+ 0 0 15 -2,-1.4 3,-1.4 1,-0.3 -1,-0.2 0.778 87.8 67.4 -42.8 -34.4 14.6 22.3 7.2 283 307 A S G 3 S+ 0 0 69 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.507 104.0 41.3 -70.1 -6.1 14.7 18.6 6.2 284 308 A K G < S+ 0 0 138 -3,-3.0 2,-0.3 -5,-0.2 -1,-0.3 0.253 88.0 116.4-122.2 8.8 17.8 17.9 8.3 285 309 A R S < S- 0 0 8 -3,-1.4 -8,-0.2 -4,-0.4 -100,-0.1 -0.597 72.2-103.4 -82.7 138.8 16.8 20.0 11.3 286 310 A I - 0 0 18 -10,-3.8 2,-0.3 -2,-0.3 -98,-0.1 -0.040 35.1-123.7 -55.9 162.5 16.2 18.1 14.6 287 311 A S > - 0 0 44 1,-0.1 4,-3.2 -99,-0.1 5,-0.2 -0.770 18.4-112.7-112.6 156.5 12.7 17.5 15.9 288 312 A V H > S+ 0 0 11 -2,-0.3 4,-2.7 2,-0.2 5,-0.3 0.926 119.7 49.2 -50.0 -51.3 11.0 18.4 19.2 289 313 A D H > S+ 0 0 76 1,-0.2 4,-1.4 2,-0.2 3,-0.4 0.977 113.6 44.8 -51.5 -62.6 10.8 14.7 20.1 290 314 A E H > S+ 0 0 104 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.827 112.2 54.2 -51.5 -36.5 14.5 14.2 19.3 291 315 A A H >< S+ 0 0 0 -4,-3.2 3,-0.5 1,-0.2 6,-0.3 0.921 105.4 50.3 -66.7 -44.4 15.3 17.4 21.2 292 316 A L H 3< S+ 0 0 2 -4,-2.7 -1,-0.2 -3,-0.4 9,-0.2 0.762 114.0 48.4 -63.9 -23.8 13.6 16.3 24.4 293 317 A Q H 3< S+ 0 0 94 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.660 83.9 116.5 -89.9 -19.2 15.6 13.1 24.1 294 318 A H S XX S- 0 0 10 -4,-1.1 4,-3.7 -3,-0.5 3,-1.1 -0.160 78.8-119.5 -49.3 143.5 18.8 14.9 23.5 295 319 A P T 34 S+ 0 0 65 0, 0.0 4,-0.3 0, 0.0 -1,-0.2 0.625 113.3 57.1 -63.0 -12.8 21.3 14.2 26.3 296 320 A Y T 34 S+ 0 0 2 -27,-0.2 -171,-0.1 -5,-0.2 4,-0.1 0.721 122.0 22.5 -90.3 -22.9 21.4 17.9 27.1 297 321 A I T X4 S+ 0 0 0 -3,-1.1 3,-1.4 -6,-0.3 4,-0.4 0.682 104.4 79.4-111.8 -32.7 17.6 18.2 27.6 298 322 A N G >< S+ 0 0 55 -4,-3.7 3,-2.1 1,-0.3 -2,-0.1 0.806 76.9 78.2 -46.9 -38.3 16.6 14.6 28.5 299 323 A V G 3 S+ 0 0 66 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.857 101.8 36.8 -36.8 -53.2 17.9 15.2 32.0 300 324 A W G < S+ 0 0 12 -3,-1.4 -1,-0.3 -4,-0.1 -2,-0.2 0.442 88.6 138.1 -83.9 -6.9 14.7 17.1 32.9 301 325 A Y < + 0 0 81 -3,-2.1 -3,-0.0 -4,-0.4 -8,-0.0 0.096 23.0 172.1 -39.5 153.5 12.4 14.9 30.8 302 326 A D >> - 0 0 46 1,-0.0 4,-2.6 0, 0.0 3,-1.5 -0.634 29.6-146.3-172.6 109.2 9.0 13.9 32.3 303 327 A P T 34 S+ 0 0 73 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 0.756 99.5 61.0 -48.2 -35.6 6.2 12.1 30.4 304 328 A S T 34 S+ 0 0 83 2,-0.1 0, 0.0 1,-0.1 0, 0.0 0.865 121.7 24.8 -62.2 -36.3 3.4 13.9 32.3 305 329 A E T <4 S+ 0 0 8 -3,-1.5 3,-0.4 3,-0.1 -229,-0.1 0.914 128.7 39.0 -91.9 -67.7 4.8 17.2 30.9 306 330 A A S < S+ 0 0 0 -4,-2.6 2,-1.9 1,-0.3 -2,-0.1 0.968 121.5 41.1 -48.2 -75.3 6.6 16.4 27.7 307 331 A E S S+ 0 0 89 -5,-0.1 -1,-0.3 -175,-0.0 -178,-0.0 -0.541 85.1 166.6 -78.3 79.8 4.2 13.8 26.3 308 332 A A - 0 0 16 -2,-1.9 -3,-0.1 -3,-0.4 -4,-0.1 -0.564 42.8 -94.5 -93.9 160.6 0.9 15.5 27.3 309 333 A P - 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -173,-0.0 -0.583 49.5 -98.3 -77.0 130.0 -2.5 14.5 26.0 310 334 A P - 0 0 89 0, 0.0 -173,-0.1 0, 0.0 -176,-0.1 -0.132 32.7-132.3 -47.7 137.6 -3.7 16.4 22.9 311 335 A P - 0 0 23 0, 0.0 2,-0.3 0, 0.0 -239,-0.1 0.985 46.4 -78.7 -56.0 -80.7 -6.1 19.4 23.7 312 336 A K 0 0 145 -175,-0.0 -241,-0.1 -244,-0.0 -240,-0.0 -0.986 360.0 360.0-179.4 173.4 -9.2 19.4 21.4 313 337 A I 0 0 186 -2,-0.3 -176,-0.0 -242,-0.0 0, 0.0 -0.726 360.0 360.0 -83.4 360.0 -10.9 20.1 18.1 314 ! 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 0.0 315 347 A H 0 0 130 0, 0.0 5,-0.1 0, 0.0 -259,-0.0 0.000 360.0 360.0 360.0 134.3 -19.2 33.8 7.8 316 348 A T > - 0 0 67 1,-0.1 4,-1.5 3,-0.0 3,-0.2 -0.193 360.0-103.3 -69.0 162.3 -20.9 37.2 7.9 317 349 A I H >> S+ 0 0 79 1,-0.2 4,-1.9 2,-0.2 3,-0.8 0.925 124.1 49.8 -48.4 -51.9 -19.9 39.9 10.5 318 350 A E H 3> S+ 0 0 77 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.862 104.1 58.8 -57.2 -40.3 -23.1 39.2 12.4 319 351 A E H 3> S+ 0 0 89 -3,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.835 107.6 48.1 -60.1 -33.1 -22.4 35.4 12.4 320 352 A W H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 3,-0.6 0.927 116.4 48.5 -43.0 -57.7 -17.6 35.0 19.7 325 357 A Y H 3X S+ 0 0 30 -4,-2.3 4,-2.2 -5,-0.4 -1,-0.2 0.926 107.3 53.9 -51.1 -51.8 -20.3 35.9 22.1 326 358 A K H 3X S+ 0 0 111 -4,-3.3 4,-1.0 1,-0.2 -1,-0.3 0.879 112.4 48.5 -50.6 -36.0 -21.5 32.3 22.3 327 359 A E H << S+ 0 0 19 -4,-2.2 3,-0.3 -3,-0.6 4,-0.3 0.887 109.1 47.0 -73.1 -44.2 -17.8 31.6 23.2 328 360 A V H < S+ 0 0 1 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.713 113.7 54.9 -71.3 -17.2 -17.4 34.2 25.9 329 361 A M H < S+ 0 0 86 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.705 89.0 67.0 -88.1 -24.7 -20.7 32.9 27.2 330 362 A D < 0 0 89 -4,-1.0 -1,-0.2 -3,-0.3 -2,-0.1 0.641 360.0 360.0 -67.3 -10.0 -19.7 29.2 27.5 331 363 A L 0 0 126 -4,-0.3 -2,-0.1 -3,-0.1 -1,-0.1 0.127 360.0 360.0 67.9 360.0 -17.5 30.9 30.2 332 !* 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 0.0 333 154 B P 0 0 131 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 94.8 18.9 16.5 39.6 334 155 B K - 0 0 163 1,-0.1 3,-0.1 3,-0.0 0, 0.0 -0.425 360.0-119.2 -64.3 116.0 16.8 19.1 41.5 335 156 B R - 0 0 61 -2,-0.4 -1,-0.1 1,-0.1 -216,-0.1 -0.322 35.6 -97.4 -59.3 128.2 15.2 21.5 39.0 336 157 B P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.221 35.2-173.9 -51.6 117.6 16.2 25.2 39.5 337 158 B T + 0 0 92 -3,-0.1 2,-0.3 -2,-0.1 -182,-0.2 0.117 63.9 69.1-100.8 19.5 13.6 27.1 41.6 338 159 B T + 0 0 74 -184,-0.2 2,-0.3 -183,-0.1 -184,-0.2 -0.990 51.1 176.2-140.1 141.5 15.3 30.4 41.1 339 160 B L - 0 0 9 -186,-1.2 2,-1.1 -2,-0.3 -184,-0.2 -0.922 22.9-140.8-149.2 123.8 15.8 32.8 38.2 340 161 B N + 0 0 115 -2,-0.3 -227,-0.1 1,-0.2 -187,-0.1 -0.667 29.4 162.7 -92.2 90.3 17.4 36.2 38.3 341 162 B L 0 0 39 -2,-1.1 -1,-0.2 -228,-0.0 -228,-0.1 0.871 360.0 360.0 -71.2 -38.7 15.6 38.6 36.0 342 163 B F 0 0 237 -233,-0.0 -2,-0.0 -232,-0.0 0, 0.0 0.084 360.0 360.0 -51.1 360.0 17.0 41.8 37.6