==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 20-MAR-09 3GP0 . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 11; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.FILIPPAKOPOULOS,A.BARR,O.FEDOROV,T.KEATES,M.SOUNDARARAJAN, . 333 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16504.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 213 64.0 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 . 38 11.4 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 0.6 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 . 20 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 98 29.4 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+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 1 1 2 0 0 0 0 1 0 1 0 2 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 . 0 1 1 2 2 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 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 M 0 0 84 0, 0.0 85,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 126.5 8.5 61.7 45.9 2 5 A R > - 0 0 83 83,-1.1 3,-1.1 1,-0.1 2,-0.1 -0.065 360.0 -92.9 -53.3 159.2 11.5 60.3 47.9 3 6 A A T 3 S+ 0 0 101 1,-0.2 -1,-0.1 84,-0.0 3,-0.1 -0.428 115.3 37.8 -64.1 152.9 13.3 62.0 50.7 4 7 A G T 3 S+ 0 0 51 1,-0.3 15,-2.3 -2,-0.1 2,-0.3 0.546 97.3 106.1 74.0 4.2 16.3 63.9 49.3 5 8 A F E < -A 18 0A 23 -3,-1.1 2,-0.3 13,-0.3 -1,-0.3 -0.829 51.8-161.1-106.7 155.6 14.3 65.0 46.2 6 9 A Y E -A 17 0A 49 11,-2.6 11,-2.2 -2,-0.3 2,-0.4 -0.938 10.4-133.4-133.8 158.8 12.9 68.4 45.5 7 10 A R E +A 16 0A 140 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.886 25.8 160.8-117.0 141.9 10.2 69.6 43.1 8 11 A Q E -A 15 0A 58 7,-2.4 7,-3.6 -2,-0.4 2,-0.5 -0.976 33.5-119.8-145.9 167.9 10.0 72.4 40.6 9 12 A E E -A 14 0A 128 -2,-0.3 2,-0.6 5,-0.2 5,-0.2 -0.926 20.4-171.4-111.2 126.6 7.9 73.4 37.6 10 13 A L S S- 0 0 24 3,-3.0 3,-0.1 -2,-0.5 15,-0.0 -0.894 75.4 -29.7-121.6 100.9 9.6 73.9 34.3 11 14 A N S S- 0 0 94 -2,-0.6 -1,-0.2 1,-0.2 3,-0.1 0.991 126.5 -43.4 47.9 73.3 7.2 75.3 31.6 12 15 A K S S+ 0 0 87 -3,-0.1 2,-0.4 1,-0.1 -1,-0.2 0.662 119.2 106.2 47.8 28.6 4.1 73.8 33.1 13 16 A T - 0 0 49 -3,-0.1 -3,-3.0 2,-0.0 2,-0.5 -1.000 67.7-129.5-128.5 134.9 5.7 70.4 33.7 14 17 A V E -A 9 0A 56 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.705 20.5-166.1 -85.6 127.7 6.6 69.1 37.2 15 18 A W E -A 8 0A 4 -7,-3.6 -7,-2.4 -2,-0.5 2,-0.5 -0.955 5.4-171.4-111.6 132.7 10.2 67.8 37.7 16 19 A E E +A 7 0A 35 -2,-0.4 -9,-0.2 -9,-0.2 -14,-0.1 -0.983 22.9 159.5-122.2 112.9 11.1 65.8 40.9 17 20 A V E -A 6 0A 0 -11,-2.2 -11,-2.6 -2,-0.5 -2,-0.0 -0.931 41.5 -93.3-135.7 158.6 14.8 65.3 41.2 18 21 A P E > -A 5 0A 5 0, 0.0 3,-2.0 0, 0.0 -13,-0.3 -0.312 40.7-109.1 -69.9 157.9 17.5 64.4 43.8 19 22 A Q T 3 S+ 0 0 106 -15,-2.3 18,-0.1 1,-0.3 -14,-0.1 0.774 112.5 73.3 -55.3 -32.5 19.4 67.2 45.5 20 23 A R T 3 S+ 0 0 59 -16,-0.2 17,-3.6 16,-0.1 2,-0.6 0.764 86.2 73.1 -56.7 -26.2 22.6 66.2 43.6 21 24 A L E < +B 36 0B 0 -3,-2.0 2,-0.3 15,-0.2 15,-0.2 -0.827 68.6 171.2 -93.5 118.8 21.0 67.8 40.5 22 25 A Q E +B 35 0B 83 13,-2.8 13,-2.8 -2,-0.6 -2,-0.0 -0.855 46.5 25.7-126.3 160.3 21.0 71.6 40.6 23 26 A G E - 0 0 56 -2,-0.3 -1,-0.2 11,-0.2 10,-0.1 0.844 69.0-163.2 61.7 42.3 20.2 74.5 38.3 24 27 A L E + 0 0 15 -3,-0.2 10,-0.2 10,-0.1 -1,-0.2 -0.321 12.6 176.3 -59.3 134.5 17.8 72.7 35.9 25 28 A R E -B 33 0B 176 8,-1.9 8,-3.0 -15,-0.0 -15,-0.0 -0.967 33.5-113.6-143.7 118.0 17.4 74.7 32.7 26 29 A P E +B 32 0B 71 0, 0.0 6,-0.3 0, 0.0 -15,-0.0 -0.279 36.6 167.8 -51.4 131.5 15.3 73.5 29.7 27 30 A V 0 0 88 4,-3.1 5,-0.1 0, 0.0 17,-0.0 0.914 360.0 360.0 -76.5 -50.6 17.5 72.8 26.6 28 31 A G 0 0 57 3,-0.6 4,-0.1 -3,-0.0 0, 0.0 0.287 360.0 360.0-160.9 360.0 15.0 71.6 25.7 29 ! 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 30 37 A S 0 0 69 0, 0.0 17,-1.9 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 54.5 11.6 67.6 28.0 31 38 A V E - C 0 46B 20 15,-0.2 -4,-3.1 13,-0.0 -3,-0.6 -0.983 360.0-175.5-120.6 133.8 15.4 67.8 28.3 32 39 A C E -BC 26 45B 2 13,-2.7 13,-3.2 -2,-0.4 2,-0.2 -0.956 22.8-130.2-121.9 150.1 17.2 70.1 30.7 33 40 A S E +BC 25 44B 22 -8,-3.0 -8,-1.9 -2,-0.3 2,-0.3 -0.624 39.9 161.2 -83.0 156.0 20.8 71.0 31.4 34 41 A A E - C 0 43B 7 9,-2.0 9,-2.6 -2,-0.2 2,-0.5 -0.971 42.3-107.5-163.9 168.1 21.9 70.7 35.0 35 42 A Y E -BC 22 42B 111 -13,-2.8 -13,-2.8 -2,-0.3 2,-0.7 -0.958 26.5-153.0-107.2 126.9 24.9 70.4 37.3 36 43 A D E >> -BC 21 41B 0 5,-2.7 5,-1.5 -2,-0.5 4,-1.3 -0.898 4.7-165.5-100.9 112.7 25.2 66.9 38.9 37 44 A A T 45S+ 0 0 59 -17,-3.6 -1,-0.1 -2,-0.7 -16,-0.1 0.649 85.7 55.1 -76.5 -15.7 27.1 67.4 42.2 38 45 A R T 45S+ 0 0 142 -18,-0.2 -1,-0.2 1,-0.1 -17,-0.1 0.918 116.7 34.4 -79.5 -44.8 27.8 63.7 42.6 39 46 A L T 45S- 0 0 65 2,-0.2 -2,-0.2 -19,-0.1 -1,-0.1 0.629 103.3-134.2 -83.1 -13.9 29.5 63.4 39.2 40 47 A R T <5 + 0 0 203 -4,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.926 69.4 89.9 60.8 47.4 31.0 66.9 39.5 41 48 A Q E S- 0 0 64 -2,-0.9 3,-1.9 1,-0.1 4,-0.3 0.925 71.8-167.2 44.0 62.8 4.3 59.2 30.2 51 58 A P T 3 S+ 0 0 1 0, 0.0 10,-0.3 0, 0.0 3,-0.2 0.741 79.6 34.6 -56.5 -31.1 6.5 56.1 30.2 52 59 A F T 3 S+ 0 0 21 41,-0.4 -2,-0.1 1,-0.1 274,-0.1 0.014 78.6 115.1-115.6 28.2 3.7 53.6 31.1 53 60 A Q S < S- 0 0 135 -3,-1.9 2,-0.3 -4,-0.2 -1,-0.1 0.818 90.2 -6.1 -59.8 -36.7 0.8 55.2 29.3 54 61 A S S > S- 0 0 39 -4,-0.3 4,-2.4 -3,-0.2 5,-0.2 -0.942 79.8 -93.9-152.6 169.3 0.5 52.2 26.9 55 62 A L H > S+ 0 0 97 -2,-0.3 4,-2.8 1,-0.2 5,-0.1 0.875 123.1 50.9 -57.2 -45.5 2.3 49.0 26.0 56 63 A I H > S+ 0 0 80 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.893 110.6 48.6 -64.2 -41.5 4.3 50.7 23.2 57 64 A H H > S+ 0 0 63 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.916 112.9 48.6 -60.4 -44.3 5.5 53.5 25.5 58 65 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.927 111.9 49.0 -63.4 -42.9 6.5 51.0 28.2 59 66 A R H X S+ 0 0 83 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.928 114.3 45.4 -62.0 -41.6 8.4 48.9 25.6 60 67 A R H X S+ 0 0 163 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.810 110.3 54.4 -71.7 -32.6 10.2 52.1 24.3 61 68 A T H X S+ 0 0 9 -4,-2.4 4,-2.1 -10,-0.3 -1,-0.2 0.941 112.1 43.5 -61.0 -53.0 10.9 53.3 27.8 62 69 A Y H X S+ 0 0 9 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.946 114.5 50.9 -58.0 -47.9 12.6 50.0 28.6 63 70 A R H X S+ 0 0 48 -4,-2.6 4,-3.0 -5,-0.2 5,-0.3 0.897 108.6 50.1 -60.2 -44.6 14.4 49.9 25.3 64 71 A E H X S+ 0 0 56 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.951 115.0 44.2 -61.9 -45.6 15.8 53.5 25.6 65 72 A L H X S+ 0 0 1 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.933 118.3 43.4 -59.2 -48.8 17.1 52.7 29.1 66 73 A R H X S+ 0 0 81 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.858 113.8 50.7 -69.1 -38.7 18.5 49.2 28.0 67 74 A L H X S+ 0 0 26 -4,-3.0 4,-2.3 -5,-0.2 -1,-0.2 0.879 111.8 46.1 -67.9 -43.1 20.0 50.5 24.8 68 75 A L H < S+ 0 0 23 -4,-2.1 11,-0.6 -5,-0.3 -2,-0.2 0.848 110.9 53.3 -68.4 -38.0 21.8 53.4 26.5 69 76 A K H < S+ 0 0 63 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.920 114.7 45.1 -51.4 -47.2 23.1 51.0 29.2 70 77 A H H < S+ 0 0 39 -4,-2.0 2,-0.8 -5,-0.1 -2,-0.2 0.850 97.8 75.0 -68.0 -45.9 24.4 48.9 26.4 71 78 A L < + 0 0 12 -4,-2.3 2,-0.5 -5,-0.1 8,-0.4 -0.651 51.9 167.2 -84.0 109.4 26.0 51.5 24.1 72 79 A K + 0 0 153 -2,-0.8 2,-0.3 6,-0.1 6,-0.1 -0.909 22.9 129.4-124.8 106.1 29.3 52.7 25.5 73 80 A H > - 0 0 13 -2,-0.5 3,-1.8 3,-0.4 57,-0.0 -0.984 63.1-121.4-159.1 141.0 31.3 54.6 23.0 74 81 A E T 3 S+ 0 0 98 -2,-0.3 4,-0.1 1,-0.3 56,-0.1 0.721 113.1 47.2 -58.1 -27.0 33.0 58.0 22.8 75 82 A N T 3 S+ 0 0 5 83,-0.1 84,-2.3 2,-0.1 2,-0.4 0.095 101.1 74.3-105.1 22.3 30.8 59.1 19.9 76 83 A V B < S-f 159 0C 6 -3,-1.8 -3,-0.4 82,-0.3 84,-0.2 -0.996 98.3 -92.2-131.6 140.4 27.4 58.1 21.3 77 84 A I - 0 0 19 82,-3.4 2,-0.5 -2,-0.4 -4,-0.1 -0.223 47.4-132.2 -53.3 135.7 25.6 59.9 24.1 78 85 A G - 0 0 16 -4,-0.1 22,-1.3 -6,-0.1 2,-0.4 -0.842 4.4-132.9-101.6 122.6 26.7 58.3 27.4 79 86 A L E +E 99 0B 21 -11,-0.6 20,-0.2 -2,-0.5 3,-0.1 -0.621 31.0 168.9 -67.9 123.5 24.1 57.2 30.1 80 87 A L E - 0 0 51 18,-3.3 2,-0.3 -2,-0.4 19,-0.2 0.659 59.7 -4.0-109.6 -28.5 25.4 58.5 33.4 81 88 A D E -E 98 0B 10 17,-1.6 17,-3.1 2,-0.0 -1,-0.4 -0.983 49.2-161.6-162.3 158.7 22.5 58.0 35.7 82 89 A V E +E 97 0B 7 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.974 23.2 162.7-145.3 135.6 18.8 56.9 35.9 83 90 A F E -E 96 0B 5 13,-2.1 13,-2.6 -2,-0.3 251,-0.1 -0.965 23.7-155.0-148.7 166.3 16.4 57.7 38.7 84 91 A T - 0 0 1 -2,-0.3 11,-0.1 11,-0.2 -82,-0.1 -0.993 21.9-140.2-139.4 144.4 12.8 57.8 39.7 85 92 A P + 0 0 5 0, 0.0 -83,-1.1 0, 0.0 -80,-0.1 0.541 69.7 121.3 -75.5 -2.6 11.0 59.9 42.4 86 93 A A - 0 0 2 8,-0.3 -2,-0.2 -85,-0.2 6,-0.1 -0.332 52.4-160.8 -66.0 139.0 9.0 56.7 43.1 87 94 A T S S- 0 0 101 1,-0.2 2,-0.3 -85,-0.1 -1,-0.1 0.681 75.5 -8.0 -89.2 -26.5 9.2 55.3 46.6 88 95 A S S > S- 0 0 41 1,-0.0 3,-1.0 0, 0.0 -1,-0.2 -0.951 82.6 -85.5-155.3 177.2 7.9 51.8 45.5 89 96 A I G > S+ 0 0 48 -2,-0.3 3,-1.3 1,-0.2 241,-0.0 0.813 117.8 67.2 -56.2 -32.9 6.5 50.0 42.5 90 97 A E G 3 S+ 0 0 164 1,-0.3 -1,-0.2 3,-0.0 -4,-0.0 0.840 112.6 31.0 -63.0 -32.2 2.9 51.2 43.4 91 98 A D G < S+ 0 0 67 -3,-1.0 2,-0.7 3,-0.0 -1,-0.3 0.168 85.0 129.3-111.2 22.7 3.8 54.8 42.7 92 99 A F < + 0 0 0 -3,-1.3 3,-0.1 1,-0.2 238,-0.1 -0.669 21.4 126.1 -77.9 109.6 6.3 54.1 39.9 93 100 A S + 0 0 62 -2,-0.7 -41,-0.4 1,-0.2 2,-0.3 0.433 54.2 60.5-141.5 -13.3 5.1 56.4 37.1 94 101 A E - 0 0 49 -3,-0.2 2,-0.4 -44,-0.1 -8,-0.3 -0.943 52.8-168.1-128.6 144.3 8.1 58.6 36.0 95 102 A V - 0 0 0 -2,-0.3 -47,-2.8 -47,-0.3 2,-0.4 -0.998 4.8-166.8-132.7 127.3 11.6 57.8 34.6 96 103 A Y E -DE 47 83B 1 -13,-2.6 -13,-2.1 -2,-0.4 2,-0.4 -0.962 3.7-160.1-118.7 135.1 14.5 60.3 34.3 97 104 A L E -DE 46 82B 3 -51,-2.5 -51,-2.9 -2,-0.4 2,-0.5 -0.904 2.9-157.8-113.1 141.3 17.7 59.6 32.3 98 105 A V E +DE 45 81B 0 -17,-3.1 -18,-3.3 -2,-0.4 -17,-1.6 -0.971 21.1 163.3-120.5 130.0 20.9 61.5 32.8 99 106 A T E -DE 44 79B 22 -55,-2.7 -55,-2.5 -2,-0.5 -20,-0.2 -0.818 44.2 -66.0-134.3 172.7 23.6 61.8 30.1 100 107 A T E -D 43 0B 22 -22,-1.3 2,-0.5 -2,-0.3 -57,-0.2 -0.285 45.7-141.4 -45.5 143.6 26.7 63.7 29.0 101 108 A L - 0 0 43 -59,-0.6 2,-0.2 -58,-0.1 -59,-0.1 -0.981 16.7-163.2-112.0 126.9 25.9 67.3 28.1 102 109 A M - 0 0 23 -2,-0.5 50,-0.2 56,-0.1 3,-0.1 -0.492 31.6-104.7 -98.4 173.8 27.9 68.7 25.1 103 110 A G S S- 0 0 64 -2,-0.2 2,-0.3 1,-0.1 49,-0.2 0.864 84.3 -34.0 -64.7 -37.0 28.3 72.4 24.2 104 111 A A E -G 151 0C 28 47,-2.0 47,-3.1 3,-0.0 2,-0.2 -0.927 62.4 -93.3-167.5 177.3 25.8 72.6 21.2 105 112 A D E > -G 150 0C 50 45,-0.3 4,-1.7 -2,-0.3 3,-0.5 -0.690 43.6 -98.7-108.3 170.6 24.3 70.7 18.3 106 113 A L H > S+ 0 0 1 43,-1.7 4,-2.2 40,-1.2 5,-0.2 0.716 119.8 60.1 -58.9 -26.9 25.4 70.7 14.6 107 114 A N H > S+ 0 0 39 39,-0.5 4,-2.6 42,-0.2 -1,-0.2 0.934 104.3 50.1 -64.1 -45.7 22.7 73.3 13.6 108 115 A N H > S+ 0 0 84 -3,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.909 110.1 51.0 -54.1 -48.3 24.3 75.8 16.0 109 116 A I H X S+ 0 0 14 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.957 113.0 43.7 -55.4 -55.8 27.7 75.0 14.5 110 117 A V H < S+ 0 0 24 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.884 113.2 51.8 -59.7 -43.0 26.5 75.6 10.9 111 118 A K H < S+ 0 0 87 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.893 117.9 37.0 -61.1 -42.0 24.5 78.7 11.7 112 119 A C H < S+ 0 0 91 -4,-2.2 2,-0.3 -5,-0.2 -2,-0.2 0.763 121.1 31.7 -84.7 -28.5 27.5 80.4 13.5 113 120 A Q < - 0 0 91 -4,-2.2 2,-0.7 -5,-0.2 -1,-0.1 -0.955 62.1-131.4-135.0 147.9 30.5 79.3 11.3 114 121 A A - 0 0 103 -2,-0.3 2,-0.2 -3,-0.0 91,-0.1 -0.907 48.8-129.5 -89.5 112.7 31.6 78.3 7.8 115 122 A L - 0 0 24 -2,-0.7 -5,-0.0 89,-0.4 92,-0.0 -0.434 10.2-124.3 -73.4 130.8 33.4 75.1 8.7 116 123 A S > - 0 0 49 -2,-0.2 4,-2.4 1,-0.1 3,-0.2 -0.298 27.4-112.4 -61.8 155.3 37.0 74.4 7.5 117 124 A D H > S+ 0 0 41 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.884 119.1 56.7 -57.9 -36.9 37.5 71.2 5.5 118 125 A E H > S+ 0 0 112 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.878 106.7 47.8 -65.4 -39.2 39.6 69.9 8.4 119 126 A H H > S+ 0 0 79 -3,-0.2 4,-2.6 2,-0.2 5,-0.2 0.913 110.0 51.9 -68.2 -40.8 36.7 70.4 10.8 120 127 A V H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.4 0.933 109.1 51.8 -57.4 -46.3 34.3 68.7 8.4 121 128 A Q H X S+ 0 0 22 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.963 112.4 44.8 -50.9 -51.1 36.7 65.7 8.2 122 129 A F H X S+ 0 0 48 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.889 114.8 47.9 -67.5 -38.1 36.9 65.4 12.0 123 130 A L H X S+ 0 0 2 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.964 115.9 42.0 -70.0 -47.6 33.1 65.8 12.5 124 131 A V H X S+ 0 0 1 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.881 110.6 58.9 -69.9 -32.3 32.0 63.3 9.9 125 132 A Y H X S+ 0 0 13 -4,-2.4 4,-2.2 -5,-0.4 -1,-0.2 0.952 109.8 42.3 -57.8 -50.8 34.8 60.9 11.0 126 133 A Q H X S+ 0 0 10 -4,-2.0 4,-2.8 2,-0.2 5,-0.3 0.854 111.0 55.4 -64.0 -39.9 33.4 60.8 14.5 127 134 A L H X S+ 0 0 1 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.956 112.7 43.3 -58.2 -46.0 29.8 60.5 13.2 128 135 A L H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 -2,-0.2 0.834 111.7 53.8 -68.5 -35.2 30.8 57.5 11.2 129 136 A R H X S+ 0 0 16 -4,-2.2 4,-1.6 -5,-0.2 -1,-0.2 0.934 112.1 43.8 -67.8 -44.9 32.9 56.0 14.0 130 137 A G H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.936 114.1 52.1 -63.8 -41.7 29.9 56.2 16.4 131 138 A L H X S+ 0 0 0 -4,-2.5 4,-3.3 -5,-0.3 5,-0.3 0.914 103.8 56.3 -62.4 -40.8 27.7 54.8 13.6 132 139 A K H X S+ 0 0 34 -4,-3.0 4,-2.2 2,-0.2 176,-0.3 0.924 111.1 45.8 -50.7 -44.5 30.0 51.8 13.0 133 140 A Y H X S+ 0 0 20 -4,-1.6 4,-1.4 2,-0.2 175,-0.4 0.958 112.4 48.6 -68.2 -52.0 29.6 51.0 16.7 134 141 A I H ><>S+ 0 0 7 -4,-2.7 5,-1.7 1,-0.2 3,-0.7 0.943 114.1 46.7 -52.4 -50.4 25.8 51.4 16.6 135 142 A H H ><5S+ 0 0 14 -4,-3.3 3,-1.8 1,-0.3 -1,-0.2 0.863 105.1 59.0 -63.3 -36.0 25.4 49.3 13.5 136 143 A S H 3<5S+ 0 0 27 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.792 100.3 58.6 -63.6 -27.1 27.7 46.5 14.8 137 144 A A T <<5S- 0 0 2 -4,-1.4 174,-3.1 -3,-0.7 -1,-0.3 0.583 121.0-111.6 -73.3 -9.6 25.2 46.3 17.7 138 145 A G T < 5S+ 0 0 58 -3,-1.8 2,-0.4 -4,-0.3 -3,-0.2 0.697 75.8 135.8 84.1 22.4 22.5 45.5 15.1 139 146 A I < - 0 0 13 -5,-1.7 2,-0.5 51,-0.0 -1,-0.3 -0.829 44.7-154.4-104.4 139.2 20.8 48.8 15.8 140 147 A I - 0 0 38 -2,-0.4 50,-0.1 1,-0.2 51,-0.0 -0.960 2.9-158.4-105.9 130.1 19.5 51.3 13.2 141 148 A H - 0 0 15 -2,-0.5 -1,-0.2 49,-0.2 49,-0.0 0.979 16.2-178.1 -67.8 -57.3 19.4 54.9 14.3 142 149 A R + 0 0 90 48,-0.1 -1,-0.1 1,-0.1 36,-0.1 0.208 66.0 60.5 78.1 -7.9 16.8 55.9 11.7 143 150 A D + 0 0 21 5,-0.1 2,-0.3 34,-0.1 20,-0.1 -0.091 60.9 155.6-138.8 41.9 16.7 59.7 12.6 144 151 A L + 0 0 1 32,-0.1 17,-0.1 17,-0.1 5,-0.1 -0.561 20.0 133.6 -69.7 128.2 20.2 61.1 12.0 145 152 A K S > S- 0 0 21 -2,-0.3 3,-2.4 54,-0.0 -39,-0.1 -0.931 70.4 -86.4-167.3 162.5 20.0 64.8 11.4 146 153 A P G > S+ 0 0 2 0, 0.0 -40,-1.2 0, 0.0 3,-1.1 0.746 122.9 57.5 -55.2 -30.2 21.9 67.8 12.8 147 154 A S G 3 S+ 0 0 22 1,-0.2 -3,-0.1 -41,-0.2 14,-0.0 0.563 102.9 56.3 -77.3 -6.8 19.7 68.3 15.9 148 155 A N G < S+ 0 0 0 -3,-2.4 12,-2.7 13,-0.1 2,-0.4 0.075 94.9 77.9-106.7 18.7 20.6 64.7 17.0 149 156 A V E < - H 0 159C 0 -3,-1.1 -43,-1.7 10,-0.2 2,-0.4 -0.984 65.5-162.7-132.1 119.8 24.3 65.3 16.9 150 157 A A E -GH 105 158C 13 8,-2.7 8,-2.7 -2,-0.4 2,-0.3 -0.859 9.6-175.4-111.4 140.2 25.9 67.2 19.8 151 158 A V E -GH 104 157C 1 -47,-3.1 -47,-2.0 -2,-0.4 6,-0.2 -0.971 16.4-138.6-137.8 144.9 29.3 68.8 19.7 152 159 A N > - 0 0 44 4,-2.2 3,-2.8 -2,-0.3 -50,-0.1 -0.552 42.3 -94.6 -92.3 168.0 31.7 70.6 22.0 153 160 A E T 3 S+ 0 0 113 1,-0.3 -1,-0.0 -2,-0.2 -51,-0.0 0.738 127.6 56.1 -53.5 -24.2 33.9 73.7 21.2 154 161 A D T 3 S- 0 0 92 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.259 121.0-108.9 -94.0 10.2 36.7 71.3 20.3 155 162 A C < + 0 0 13 -3,-2.8 2,-0.2 1,-0.3 -2,-0.1 0.530 64.7 153.4 77.1 7.5 34.5 69.5 17.8 156 163 A E - 0 0 101 -30,-0.0 -4,-2.2 1,-0.0 2,-0.4 -0.534 30.3-155.6 -65.9 140.5 34.2 66.3 19.8 157 164 A L E - H 0 151C 2 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.923 21.4-173.3-130.8 139.2 30.9 64.8 18.7 158 165 A R E - H 0 150C 60 -8,-2.7 -8,-2.7 -2,-0.4 2,-0.3 -0.999 21.5-132.4-133.9 137.4 28.3 62.4 20.1 159 166 A I E +fH 76 149C 2 -84,-2.3 -82,-3.4 -2,-0.4 2,-0.2 -0.622 34.4 164.8 -78.4 136.0 25.2 60.8 18.4 160 167 A L - 0 0 33 -12,-2.7 2,-0.3 -2,-0.3 -12,-0.0 -0.811 31.0-135.3-137.4-178.2 21.9 61.0 20.3 161 168 A D - 0 0 70 -2,-0.2 -13,-0.1 1,-0.1 -17,-0.1 -0.843 11.1-174.4-147.8 107.6 18.2 60.6 19.6 162 169 A F 0 0 80 -2,-0.3 -1,-0.1 1,-0.0 -14,-0.0 0.654 360.0 360.0 -69.2 -20.4 15.8 63.1 20.9 163 170 A G 0 0 92 -20,-0.1 -2,-0.0 -15,-0.0 -1,-0.0 0.774 360.0 360.0 90.8 360.0 12.8 61.1 19.6 164 ! 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 0.0 165 177 A E 0 0 111 0, 0.0 5,-0.1 0, 0.0 7,-0.0 0.000 360.0 360.0 360.0 -29.8 6.9 71.9 14.1 166 178 A E 0 0 111 3,-0.0 4,-0.0 0, 0.0 0, 0.0 0.570 360.0 360.0 -96.1 -11.5 6.5 75.8 13.8 167 179 A M 0 0 97 2,-0.1 3,-1.6 0, 0.0 0, 0.0 -0.427 360.0 360.0 -80.2 360.0 9.0 76.7 16.6 168 ! 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 0.0 169 181 A G 0 0 103 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 35.8 15.0 75.8 15.6 170 182 A Y - 0 0 136 -3,-1.6 2,-0.5 -5,-0.1 0, 0.0 -0.464 360.0-161.4 -71.6 133.8 12.9 72.9 14.2 171 183 A V - 0 0 11 -2,-0.2 2,-0.4 -26,-0.0 -1,-0.0 -0.980 16.9-132.7-119.5 115.8 14.9 70.4 12.0 172 184 A A > - 0 0 6 -2,-0.5 3,-0.9 1,-0.2 4,-0.3 -0.546 5.8-151.6 -73.9 124.1 12.7 68.2 9.7 173 185 A T G >> S+ 0 0 27 -2,-0.4 3,-2.2 1,-0.2 4,-0.9 0.862 94.8 73.6 -49.1 -38.8 13.5 64.5 9.6 174 186 A R G >4 S+ 0 0 81 1,-0.3 3,-0.7 2,-0.2 -1,-0.2 0.842 88.8 57.3 -51.1 -38.4 12.1 64.7 6.1 175 187 A W G <4 S+ 0 0 71 -3,-0.9 36,-0.3 1,-0.2 -1,-0.3 0.704 116.3 33.2 -70.8 -18.3 15.2 66.5 4.9 176 188 A Y G <4 S+ 0 0 5 -3,-2.2 2,-0.3 -4,-0.3 -1,-0.2 0.370 88.2 118.4-114.8 1.4 17.6 63.6 6.0 177 189 A R << - 0 0 71 -4,-0.9 5,-0.1 -3,-0.7 16,-0.1 -0.547 69.9-110.1 -85.5 129.8 15.4 60.5 5.5 178 190 A A >> - 0 0 0 -2,-0.3 4,-1.9 14,-0.2 3,-1.1 -0.254 26.1-122.5 -52.0 139.8 16.6 57.8 3.1 179 191 A P H 3> S+ 0 0 0 0, 0.0 4,-2.8 0, 0.0 6,-0.1 0.825 110.6 60.8 -58.5 -33.7 14.3 57.6 -0.0 180 192 A E H 34>S+ 0 0 3 2,-0.2 5,-2.7 1,-0.2 8,-0.1 0.789 105.8 47.1 -64.9 -28.0 13.5 53.9 0.6 181 193 A I H X45S+ 0 0 23 -3,-1.1 3,-1.5 3,-0.2 -1,-0.2 0.926 112.8 48.8 -73.1 -44.0 12.0 54.9 4.0 182 194 A M H 3<5S+ 0 0 19 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.1 0.891 110.7 51.7 -60.5 -38.8 10.0 57.7 2.3 183 195 A L T 3<5S- 0 0 0 -4,-2.8 57,-2.7 55,-0.3 60,-0.3 0.246 116.6-113.9 -88.3 14.4 8.8 55.3 -0.4 184 196 A N T < 5 + 0 0 103 -3,-1.5 2,-0.5 1,-0.2 -3,-0.2 0.816 46.5 176.4 63.3 34.3 7.6 52.8 2.2 185 197 A W > < - 0 0 75 -5,-2.7 3,-0.8 53,-0.4 -1,-0.2 -0.641 21.4-150.8 -65.8 120.6 10.1 50.0 1.4 186 198 A M T 3 S+ 0 0 160 -2,-0.5 -1,-0.1 1,-0.2 -5,-0.0 0.592 85.1 50.3 -74.5 -11.5 9.2 47.5 4.1 187 199 A H T 3 S+ 0 0 141 -7,-0.1 -1,-0.2 2,-0.0 -2,-0.0 -0.074 70.7 149.4-124.3 34.1 12.7 45.9 4.3 188 200 A Y < - 0 0 77 -3,-0.8 2,-0.2 -8,-0.1 50,-0.0 -0.235 24.3-169.0 -63.5 156.6 15.0 48.9 4.7 189 201 A N > - 0 0 76 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.619 43.7 -57.8-135.9-165.1 18.2 48.2 6.8 190 202 A Q T >> S+ 0 0 78 1,-0.3 3,-2.0 -2,-0.2 4,-0.6 0.674 114.0 80.1 -60.5 -19.7 21.1 50.1 8.4 191 203 A T H >> S+ 0 0 22 1,-0.3 4,-1.6 2,-0.2 3,-0.7 0.744 75.1 77.6 -59.2 -22.3 22.2 51.8 5.1 192 204 A V H <> S+ 0 0 2 -3,-2.1 4,-1.6 1,-0.2 -1,-0.3 0.865 90.7 55.3 -50.6 -35.7 19.3 54.3 5.7 193 205 A D H <> S+ 0 0 0 -3,-2.0 4,-2.4 -4,-0.2 -1,-0.2 0.833 100.6 57.6 -70.6 -30.8 21.7 55.9 8.2 194 206 A I H S- 0 0 80 1,-0.1 4,-2.4 -41,-0.0 5,-0.2 -0.932 90.3 -75.1-170.0-178.5 6.7 68.5 1.7 216 228 A Y H > S+ 0 0 70 -2,-0.3 4,-2.1 2,-0.2 5,-0.1 0.932 126.4 42.0 -60.3 -54.3 6.8 64.8 0.6 217 229 A I H > S+ 0 0 69 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.927 115.2 50.6 -61.0 -45.1 6.6 65.3 -3.2 218 230 A D H > S+ 0 0 36 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.880 108.2 54.6 -60.1 -37.7 9.0 68.3 -3.1 219 231 A Q H X S+ 0 0 1 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.950 110.6 44.7 -58.0 -50.3 11.4 66.2 -1.1 220 232 A L H X S+ 0 0 2 -4,-2.1 4,-2.7 1,-0.2 5,-0.3 0.909 111.3 52.9 -63.8 -44.3 11.4 63.5 -3.7 221 233 A K H X S+ 0 0 85 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.900 109.7 49.2 -55.9 -43.6 11.7 65.9 -6.6 222 234 A R H X S+ 0 0 93 -4,-2.2 4,-0.6 -5,-0.2 -1,-0.2 0.889 112.7 47.1 -65.0 -40.2 14.8 67.5 -5.0 223 235 A I H >X S+ 0 0 0 -4,-1.9 4,-2.8 1,-0.2 3,-1.4 0.958 112.3 47.9 -67.7 -50.0 16.5 64.1 -4.4 224 236 A M H 3X S+ 0 0 1 -4,-2.7 4,-1.9 1,-0.3 -1,-0.2 0.826 103.8 63.4 -60.2 -34.9 15.8 62.8 -7.9 225 237 A E H 3< S+ 0 0 85 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.769 115.6 30.2 -61.4 -24.9 17.1 66.1 -9.4 226 238 A V H << S+ 0 0 16 -3,-1.4 30,-2.6 -4,-0.6 -2,-0.2 0.867 128.7 34.6-100.2 -50.4 20.5 65.4 -7.9 227 239 A V H < S- 0 0 22 -4,-2.8 28,-0.2 28,-0.2 -3,-0.2 0.704 109.2-119.2 -83.7 -17.3 20.9 61.5 -7.8 228 240 A G < - 0 0 5 -4,-1.9 -3,-0.1 -5,-0.4 51,-0.1 0.238 36.3 -64.0 90.8 145.4 18.9 61.0 -11.0 229 241 A T - 0 0 46 24,-2.4 26,-0.1 -5,-0.1 2,-0.0 -0.361 60.9-118.4 -59.0 133.9 15.6 59.0 -11.6 230 242 A P - 0 0 21 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.312 25.5-102.4 -73.4 159.1 16.2 55.3 -10.8 231 243 A S > - 0 0 59 1,-0.1 4,-3.1 -2,-0.0 5,-0.2 -0.347 37.7-106.6 -66.5 163.0 15.7 52.5 -13.4 232 244 A P H > S+ 0 0 113 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.907 122.8 55.5 -56.9 -37.3 12.4 50.5 -13.0 233 245 A E H > S+ 0 0 165 1,-0.2 4,-0.6 2,-0.2 0, 0.0 0.910 112.2 39.9 -62.3 -45.6 14.5 47.7 -11.6 234 246 A V H >> S+ 0 0 27 2,-0.2 3,-0.9 1,-0.2 4,-0.5 0.874 111.4 57.4 -70.4 -38.9 16.0 49.8 -8.9 235 247 A L H >< S+ 0 0 9 -4,-3.1 3,-1.3 1,-0.2 4,-0.4 0.912 100.9 60.4 -57.2 -39.7 12.7 51.6 -8.2 236 248 A A H 3< S+ 0 0 37 -4,-2.3 3,-0.3 1,-0.2 -1,-0.2 0.768 106.2 45.1 -57.6 -30.6 11.2 48.1 -7.6 237 249 A K H << S+ 0 0 76 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.397 113.0 48.3 -99.5 3.2 13.6 47.5 -4.6 238 250 A I S << S+ 0 0 3 -3,-1.3 -53,-0.4 -4,-0.5 2,-0.3 0.302 109.1 44.1-119.1 11.3 13.3 50.9 -2.9 239 251 A S S S- 0 0 1 -4,-0.4 -55,-0.2 -3,-0.3 -53,-0.1 -0.988 73.1-108.5-154.9 154.8 9.5 51.4 -2.8 240 252 A S > - 0 0 35 -57,-2.7 4,-1.6 -2,-0.3 -55,-0.1 -0.338 46.1-102.0 -75.2 170.1 6.1 49.9 -2.1 241 253 A E T 4 S+ 0 0 83 1,-0.2 4,-0.5 2,-0.2 -1,-0.1 0.882 122.9 44.5 -60.6 -41.9 3.7 49.2 -5.0 242 254 A H T >4 S+ 0 0 71 1,-0.2 3,-0.7 2,-0.2 4,-0.3 0.863 109.4 53.8 -74.9 -35.6 1.7 52.3 -4.2 243 255 A A T >> S+ 0 0 1 -60,-0.3 3,-1.3 1,-0.2 4,-0.9 0.778 90.1 79.1 -75.6 -26.3 4.7 54.7 -3.7 244 256 A R H >X S+ 0 0 76 -4,-1.6 4,-2.5 1,-0.2 3,-0.8 0.872 84.8 60.3 -39.6 -50.3 6.1 53.7 -7.1 245 257 A T H <> S+ 0 0 69 -3,-0.7 4,-1.9 -4,-0.5 -1,-0.2 0.778 94.8 62.6 -57.9 -30.6 3.6 56.1 -8.9 246 258 A Y H <4 S+ 0 0 107 -3,-1.3 4,-0.5 -4,-0.3 -1,-0.3 0.923 112.7 36.8 -61.8 -40.8 5.0 59.1 -7.1 247 259 A I H X< S+ 0 0 3 -4,-0.9 3,-1.2 -3,-0.8 -2,-0.2 0.924 114.3 54.4 -75.5 -47.7 8.4 58.5 -8.8 248 260 A Q H 3< S+ 0 0 124 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.785 103.8 57.4 -58.9 -28.8 7.0 57.3 -12.1 249 261 A S T 3< S+ 0 0 100 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.728 88.1 90.7 -79.6 -19.7 4.9 60.5 -12.5 250 262 A L S < S- 0 0 25 -3,-1.2 3,-0.1 -4,-0.5 -3,-0.0 -0.432 91.8-104.3 -67.8 145.7 8.0 62.8 -12.2 251 263 A P - 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.491 50.5 -91.5 -64.8 147.2 9.7 63.7 -15.5 252 264 A P - 0 0 119 0, 0.0 -4,-0.0 0, 0.0 -27,-0.0 -0.331 46.0-163.7 -59.5 137.5 12.9 61.6 -15.9 253 265 A M - 0 0 30 -3,-0.1 -24,-2.4 -29,-0.1 2,-0.1 -0.990 13.4-129.4-124.7 134.5 16.0 63.4 -14.5 254 266 A P - 0 0 110 0, 0.0 -26,-0.3 0, 0.0 2,-0.2 -0.450 36.1 -94.6 -75.5 156.4 19.7 62.6 -15.2 255 267 A Q - 0 0 151 -28,-0.2 2,-0.2 -26,-0.1 -28,-0.2 -0.523 43.6-134.2 -64.4 136.0 22.1 62.1 -12.4 256 268 A K - 0 0 97 -30,-2.6 2,-0.5 -2,-0.2 -1,-0.0 -0.654 20.9-104.8 -90.7 152.1 24.1 65.4 -11.8 257 269 A D >> - 0 0 105 -2,-0.2 3,-1.6 1,-0.2 4,-0.6 -0.651 23.2-150.0 -74.3 121.2 27.8 65.6 -11.3 258 270 A L H 3> S+ 0 0 22 -2,-0.5 4,-2.6 1,-0.3 3,-0.4 0.745 94.8 67.8 -66.8 -21.4 28.4 66.1 -7.6 259 271 A S H 34 S+ 0 0 57 1,-0.2 -1,-0.3 2,-0.2 5,-0.2 0.745 100.3 48.9 -63.6 -25.1 31.5 68.0 -8.5 260 272 A S H <4 S+ 0 0 44 -3,-1.6 3,-0.3 1,-0.1 -1,-0.2 0.615 112.1 47.4 -92.3 -15.9 29.3 70.7 -10.0 261 273 A I H < S+ 0 0 38 -4,-0.6 2,-0.5 -3,-0.4 -2,-0.2 0.854 118.6 39.7 -86.2 -38.5 27.1 70.9 -6.9 262 274 A F S >< S+ 0 0 1 -4,-2.6 3,-2.2 3,-0.1 -1,-0.2 -0.412 82.2 177.1-111.5 56.0 30.0 71.1 -4.4 263 275 A R T 3 S+ 0 0 187 -2,-0.5 -3,-0.1 -3,-0.3 3,-0.1 -0.337 70.8 18.7 -61.6 127.0 32.3 73.4 -6.4 264 276 A G T 3 S+ 0 0 90 1,-0.3 -1,-0.3 -5,-0.2 2,-0.2 0.424 94.2 127.6 89.4 -6.4 35.3 74.1 -4.4 265 277 A A S < S- 0 0 22 -3,-2.2 -1,-0.3 -6,-0.2 -3,-0.1 -0.505 77.0 -83.3 -79.1 155.6 35.0 71.2 -2.0 266 278 A N >> - 0 0 45 1,-0.2 4,-1.7 -2,-0.2 3,-1.0 -0.352 38.9-130.9 -51.4 125.8 37.9 68.8 -1.4 267 279 A P H 3> S+ 0 0 100 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.846 108.8 59.2 -56.9 -28.8 37.6 66.2 -4.3 268 280 A L H 3> S+ 0 0 65 2,-0.2 4,-2.2 1,-0.2 27,-0.2 0.867 102.6 51.8 -63.6 -36.8 37.8 63.5 -1.6 269 281 A A H <> S+ 0 0 0 -3,-1.0 4,-2.4 2,-0.2 -1,-0.2 0.920 110.8 48.1 -62.8 -43.8 34.7 64.9 0.1 270 282 A I H X S+ 0 0 22 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.886 110.0 52.5 -63.0 -44.9 32.9 64.8 -3.2 271 283 A D H < S+ 0 0 80 -4,-2.4 4,-0.4 1,-0.2 -2,-0.2 0.929 111.9 44.7 -56.8 -51.3 34.1 61.2 -3.9 272 284 A L H >< S+ 0 0 0 -4,-2.2 3,-1.5 1,-0.2 4,-0.5 0.894 109.1 56.5 -61.3 -42.5 32.8 59.9 -0.5 273 285 A L H >X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.3 3,-1.5 0.890 102.1 57.4 -56.7 -39.6 29.5 61.8 -0.9 274 286 A G T 3< S+ 0 0 31 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.622 104.0 52.7 -67.9 -16.7 28.9 59.9 -4.2 275 287 A R T <4 S+ 0 0 72 -3,-1.5 10,-2.3 -4,-0.4 -1,-0.3 0.447 116.7 38.3 -94.5 0.0 29.2 56.6 -2.3 276 288 A M T <4 S+ 0 0 0 -3,-1.5 2,-1.7 -4,-0.5 -2,-0.2 0.773 104.3 63.3-111.8 -43.8 26.5 57.7 0.3 277 289 A L S < S+ 0 0 6 -4,-2.8 2,-0.3 -5,-0.2 -1,-0.1 -0.508 76.4 117.8 -89.6 67.2 23.9 59.6 -1.7 278 290 A V - 0 0 36 -2,-1.7 6,-0.1 -3,-0.2 -83,-0.0 -0.970 61.3-138.9-131.0 147.7 22.7 56.7 -4.0 279 291 A L S S+ 0 0 12 -2,-0.3 2,-0.7 -52,-0.1 -99,-0.1 0.830 85.6 77.7 -74.0 -37.8 19.3 55.2 -4.2 280 292 A D > - 0 0 28 1,-0.2 3,-1.7 3,-0.1 4,-0.2 -0.690 69.2-155.2 -77.5 111.8 20.5 51.5 -4.5 281 293 A S G > S+ 0 0 28 -2,-0.7 3,-2.6 1,-0.3 -1,-0.2 0.868 89.1 67.5 -57.1 -37.6 21.5 50.3 -1.0 282 294 A D G 3 S+ 0 0 121 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.787 103.1 49.3 -49.3 -29.8 23.9 47.7 -2.4 283 295 A Q G < S+ 0 0 131 -3,-1.7 2,-0.4 2,-0.1 -1,-0.3 0.371 85.8 103.4 -99.8 2.5 26.0 50.6 -3.6 284 296 A R S < S- 0 0 15 -3,-2.6 -8,-0.2 -4,-0.2 -9,-0.1 -0.755 76.1-116.0 -84.0 135.6 26.1 52.6 -0.4 285 297 A V - 0 0 26 -10,-2.3 2,-0.1 -2,-0.4 -2,-0.1 -0.329 29.1-120.4 -61.6 142.3 29.4 52.5 1.5 286 298 A S > - 0 0 49 1,-0.1 4,-2.5 -92,-0.0 5,-0.1 -0.443 22.9-113.1 -75.7 164.6 29.1 50.9 5.1 287 299 A A H > S+ 0 0 3 2,-0.2 4,-1.7 1,-0.2 -155,-0.2 0.923 119.4 53.3 -61.6 -43.7 30.1 53.1 8.1 288 300 A A H 4 S+ 0 0 47 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.896 113.0 41.7 -58.8 -44.5 33.1 50.7 8.6 289 301 A E H >4 S+ 0 0 74 1,-0.2 3,-1.3 2,-0.2 4,-0.3 0.896 108.4 60.1 -71.3 -40.4 34.3 51.1 5.0 290 302 A A H >< S+ 0 0 0 -4,-2.5 3,-1.7 1,-0.3 6,-0.2 0.829 96.0 62.0 -58.4 -33.7 33.7 54.8 5.0 291 303 A L T 3< S+ 0 0 0 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.800 99.3 57.0 -63.0 -26.8 36.2 55.3 7.9 292 304 A A T < S+ 0 0 63 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.531 81.8 117.6 -80.2 -6.8 38.9 53.8 5.6 293 305 A H S X S- 0 0 29 -3,-1.7 3,-2.5 -4,-0.3 7,-0.2 -0.327 76.4-120.1 -64.8 142.9 38.3 56.5 2.9 294 306 A A G > S+ 0 0 52 1,-0.3 3,-2.0 2,-0.2 4,-0.2 0.744 108.7 74.9 -57.0 -24.6 41.2 58.9 2.2 295 307 A Y G 3 S+ 0 0 2 1,-0.3 3,-0.3 -27,-0.2 -1,-0.3 0.839 103.0 41.7 -56.0 -27.4 39.0 61.9 3.2 296 308 A F G X> S+ 0 0 0 -3,-2.5 4,-2.9 -6,-0.2 3,-1.5 0.132 76.0 117.7-103.6 20.6 39.7 60.6 6.8 297 309 A S T <4 S+ 0 0 94 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.730 71.8 60.2 -68.8 -16.1 43.3 59.8 6.5 298 310 A Q T 34 S+ 0 0 143 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.863 122.2 21.4 -71.5 -28.7 44.2 62.4 9.1 299 311 A Y T <4 S+ 0 0 70 -3,-1.5 -2,-0.2 -8,-0.1 -1,-0.1 0.635 87.5 121.0-116.5 -27.1 42.0 60.6 11.7 300 312 A H < + 0 0 64 -4,-2.9 -8,-0.1 -7,-0.2 5,-0.0 -0.203 24.7 163.7 -56.7 132.7 41.6 56.9 10.6 301 313 A D > - 0 0 62 1,-0.1 3,-2.0 3,-0.0 -1,-0.0 -0.760 23.4-161.6-151.5 97.2 42.9 54.4 13.1 302 314 A P G > S+ 0 0 91 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.713 92.4 54.4 -53.3 -27.3 41.7 50.8 12.6 303 315 A E G 3 S+ 0 0 187 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.602 109.2 48.3 -83.8 -11.1 42.7 49.8 16.2 304 316 A D G < S+ 0 0 77 -3,-2.0 -1,-0.2 1,-0.1 -3,-0.0 -0.128 87.4 85.3-122.3 37.1 40.6 52.6 17.7 305 317 A E S < S- 0 0 9 -3,-0.6 -1,-0.1 -5,-0.0 -14,-0.0 -0.676 72.3-164.6-131.8 73.1 37.3 52.2 15.8 306 318 A P - 0 0 53 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.167 14.3-133.7 -75.2 157.8 35.6 49.5 18.0 307 319 A E - 0 0 121 -171,-0.1 2,-0.3 -172,-0.1 -174,-0.2 -0.619 21.4-127.7 -90.6 162.9 32.6 47.2 17.4 308 320 A A - 0 0 9 -175,-0.4 -237,-0.1 -176,-0.3 3,-0.1 -0.722 24.7-101.6 -99.9 158.6 29.8 46.7 19.9 309 321 A E - 0 0 152 -2,-0.3 -1,-0.0 -239,-0.2 3,-0.0 -0.582 57.2 -89.6 -64.6 140.5 28.4 43.5 21.3 310 322 A P - 0 0 92 0, 0.0 2,-0.6 0, 0.0 -172,-0.2 -0.302 39.6-120.0 -50.7 132.6 25.1 42.6 19.5 311 323 A Y - 0 0 21 -174,-3.1 2,-0.7 -3,-0.1 -244,-0.0 -0.731 26.6-138.2 -76.5 121.7 22.1 44.2 21.2 312 324 A D - 0 0 116 -2,-0.6 3,-0.3 1,-0.1 4,-0.3 -0.745 20.1-174.7 -88.0 115.7 19.9 41.2 22.2 313 325 A E > + 0 0 80 -2,-0.7 4,-2.0 1,-0.2 5,-0.2 0.525 55.0 104.2 -86.5 -3.7 16.2 42.1 21.6 314 326 A S H > S+ 0 0 78 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.841 80.8 42.9 -50.2 -48.7 14.8 38.8 23.2 315 327 A V H >4 S+ 0 0 66 -3,-0.3 3,-1.1 1,-0.2 -1,-0.2 0.965 116.8 43.9 -65.4 -54.5 13.6 40.3 26.5 316 328 A E H 34 S+ 0 0 3 -4,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.773 110.7 56.9 -66.7 -21.3 11.9 43.4 25.2 317 329 A A H 3< S+ 0 0 51 -4,-2.0 -1,-0.2 2,-0.1 -2,-0.2 0.680 82.9 101.8 -82.1 -17.5 10.3 41.6 22.3 318 330 A K S << S- 0 0 144 -3,-1.1 2,-0.1 -4,-0.8 -3,-0.0 -0.453 83.3-106.8 -72.4 136.0 8.4 39.0 24.5 319 331 A E + 0 0 191 -2,-0.1 2,-0.3 0, 0.0 -1,-0.1 -0.413 54.1 155.0 -60.3 130.9 4.7 39.7 25.0 320 332 A R - 0 0 44 -2,-0.1 2,-0.1 -4,-0.1 -4,-0.0 -0.973 41.2 -99.3-152.2 163.0 3.9 41.0 28.5 321 333 A T > - 0 0 73 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.305 37.6-106.9 -77.3 163.0 1.3 43.1 30.3 322 334 A L H > S+ 0 0 61 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.897 122.6 54.9 -54.1 -42.8 1.7 46.8 31.2 323 335 A E H > S+ 0 0 142 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.906 107.2 49.0 -59.4 -44.7 2.2 45.7 34.9 324 336 A E H > S+ 0 0 93 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.899 108.6 54.1 -58.9 -43.3 5.0 43.3 33.9 325 337 A W H X S+ 0 0 8 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.919 107.7 50.3 -56.9 -46.1 6.7 46.1 31.9 326 338 A K H X S+ 0 0 56 -4,-2.2 4,-3.0 2,-0.2 -1,-0.2 0.930 111.7 47.7 -58.4 -48.1 6.6 48.4 35.0 327 339 A E H X S+ 0 0 111 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.921 114.3 46.1 -61.6 -44.3 8.2 45.7 37.2 328 340 A L H X S+ 0 0 43 -4,-2.9 4,-1.9 2,-0.2 -2,-0.2 0.943 116.3 44.3 -61.1 -47.8 10.9 44.9 34.6 329 341 A T H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.896 109.6 56.8 -66.7 -41.9 11.7 48.6 34.0 330 342 A Y H X S+ 0 0 35 -4,-3.0 4,-2.7 -5,-0.2 -1,-0.2 0.920 107.9 48.1 -55.0 -46.8 11.6 49.4 37.8 331 343 A Q H X S+ 0 0 127 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.905 110.9 51.1 -60.6 -41.8 14.3 46.7 38.4 332 344 A E H X S+ 0 0 27 -4,-1.9 4,-0.6 2,-0.2 -2,-0.2 0.893 111.4 48.0 -61.8 -42.5 16.4 48.3 35.5 333 345 A V H >< S+ 0 0 6 -4,-2.7 3,-1.1 1,-0.2 -2,-0.2 0.948 113.5 46.1 -61.6 -51.2 16.1 51.7 37.1 334 346 A L H 3< S+ 0 0 84 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.768 106.9 59.7 -64.5 -26.0 17.0 50.5 40.6 335 347 A S H 3< 0 0 56 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.674 360.0 360.0 -79.5 -16.3 19.9 48.5 39.2 336 348 A F << 0 0 95 -3,-1.1 -1,-0.2 -4,-0.6 -2,-0.2 0.993 360.0 360.0 -69.6 360.0 21.7 51.5 37.7