==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-MAY-08 3DA6 . COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 10; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.J.CEE,A.C.CHENG,K.ROMERO,S.BELLON,C.MOHR,D.A.WHITTINGTON, . 328 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16737.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 200 61.0 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 . 41 12.5 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 . 1 0.3 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 . 14 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 31.1 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 3 1 1 0 1 0 0 0 1 1 0 1 1 1 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 2 0 1 1 2 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 46 A N 0 0 140 0, 0.0 16,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 146.1 -22.2 12.1 -58.9 2 47 A Q + 0 0 143 84,-0.1 15,-1.9 14,-0.1 2,-0.2 0.511 360.0 49.0 -67.1 -10.3 -19.6 11.0 -56.3 3 48 A F E -A 16 0A 23 13,-0.2 2,-0.3 14,-0.1 13,-0.2 -0.721 67.8-155.6-129.7 169.5 -22.4 11.5 -53.7 4 49 A Y E -A 15 0A 65 11,-1.3 11,-1.9 -2,-0.2 2,-0.4 -0.987 16.6-126.6-147.3 153.5 -26.0 10.4 -53.3 5 50 A S E +A 14 0A 71 -2,-0.3 2,-0.3 9,-0.2 9,-0.3 -0.819 24.4 176.3-106.8 146.1 -28.9 11.8 -51.3 6 51 A V E -A 13 0A 54 7,-3.5 7,-3.4 -2,-0.4 2,-0.3 -0.991 29.2-122.9-145.1 132.2 -31.1 10.1 -48.8 7 52 A E E +A 12 0A 118 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.599 28.0 174.2 -69.2 133.4 -33.9 11.2 -46.5 8 53 A V E > -A 11 0A 13 3,-1.9 3,-0.6 -2,-0.3 2,-0.2 -0.895 67.9 -54.3-139.4 108.3 -33.2 10.5 -42.8 9 54 A G T 3 S- 0 0 62 -2,-0.3 -1,-0.0 1,-0.2 0, 0.0 -0.373 114.8 -25.3 50.3-119.0 -36.1 12.2 -40.9 10 55 A D T 3 S+ 0 0 162 -2,-0.2 -1,-0.2 -3,-0.1 2,-0.1 0.813 125.2 72.8 -92.3 -37.9 -36.4 15.8 -41.9 11 56 A S E < S-A 8 0A 39 -3,-0.6 -3,-1.9 -4,-0.1 2,-0.4 -0.415 78.2-128.6 -72.8 152.4 -32.8 16.5 -43.0 12 57 A T E -A 7 0A 55 -5,-0.2 2,-0.5 -2,-0.1 -5,-0.2 -0.874 14.3-149.3 -96.5 133.5 -31.3 15.1 -46.2 13 58 A F E -A 6 0A 1 -7,-3.4 -7,-3.5 -2,-0.4 2,-0.4 -0.936 15.5-179.3 -97.6 130.7 -28.0 13.2 -46.0 14 59 A T E +A 5 0A 28 -2,-0.5 -9,-0.2 -9,-0.3 2,-0.2 -0.977 23.6 154.3-133.3 108.6 -26.0 13.6 -49.2 15 60 A V E -A 4 0A 1 -11,-1.9 -11,-1.3 -2,-0.4 -2,-0.0 -0.826 50.0 -65.9-136.2 166.1 -22.7 11.5 -48.8 16 61 A L E > -A 3 0A 30 -2,-0.2 3,-2.1 -13,-0.2 -13,-0.2 -0.317 48.3-122.8 -51.2 136.6 -20.0 9.6 -50.5 17 62 A K T 3 S+ 0 0 120 -15,-1.9 -1,-0.1 1,-0.3 -14,-0.1 0.699 108.6 76.1 -51.0 -24.5 -21.4 6.5 -52.2 18 63 A R T 3 S+ 0 0 58 19,-0.1 20,-3.1 1,-0.1 2,-0.6 0.707 82.0 81.8 -59.0 -21.2 -19.0 4.4 -50.2 19 64 A Y E < +B 37 0B 0 -3,-2.1 2,-0.3 18,-0.2 3,-0.2 -0.791 67.2 174.9 -93.1 111.7 -21.4 5.1 -47.3 20 65 A Q E +B 36 0B 80 16,-2.0 16,-2.8 -2,-0.6 -2,-0.0 -0.772 46.5 19.1-120.2 154.3 -24.4 2.7 -47.4 21 66 A N E S- 0 0 113 -2,-0.3 2,-0.4 14,-0.2 -1,-0.2 0.951 72.9-157.3 59.3 54.0 -27.5 1.8 -45.3 22 67 A L E - 0 0 23 -3,-0.2 13,-0.2 13,-0.2 -1,-0.2 -0.598 12.3-174.6 -61.9 127.6 -27.6 5.0 -43.3 23 68 A K E -B 34 0B 128 11,-2.6 11,-2.8 -2,-0.4 2,-0.1 -0.988 28.6-116.6-125.7 127.0 -29.5 4.6 -40.0 24 69 A P E +B 33 0B 92 0, 0.0 2,-0.3 0, 0.0 9,-0.3 -0.424 44.8 179.3 -66.3 136.5 -30.2 7.6 -37.7 25 70 A I E +B 32 0B 59 7,-2.5 7,-0.6 -2,-0.1 3,-0.1 -0.861 26.3 3.5-134.4 166.8 -28.4 7.2 -34.3 26 71 A G S S- 0 0 77 -2,-0.3 2,-0.9 1,-0.1 6,-0.1 0.058 98.4 -35.3 64.8-168.5 -27.8 8.8 -30.8 27 72 A S 0 0 135 1,-0.2 -1,-0.1 120,-0.1 -2,-0.0 -0.803 360.0 360.0 -94.2 95.0 -29.2 12.0 -29.4 28 73 A G 0 0 81 -2,-0.9 -1,-0.2 4,-0.1 3,-0.1 0.153 360.0 360.0-160.9 360.0 -29.6 14.7 -32.2 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 76 A G 0 0 61 0, 0.0 2,-0.4 0, 0.0 19,-0.1 0.000 360.0 360.0 360.0 159.8 -26.3 17.4 -35.3 31 77 A I E - C 0 48B 40 17,-0.7 17,-2.1 -3,-0.1 2,-0.4 -0.723 360.0-168.5 -89.1 135.2 -27.8 14.4 -37.0 32 78 A V E -BC 25 47B 33 -7,-0.6 -7,-2.5 -2,-0.4 2,-0.4 -0.971 1.8-167.9-125.8 138.4 -25.6 11.5 -36.9 33 79 A C E -BC 24 46B 0 13,-2.1 13,-2.9 -2,-0.4 2,-0.3 -0.979 18.7-133.8-124.7 138.5 -26.1 8.3 -38.9 34 80 A A E +BC 23 45B 15 -11,-2.8 -11,-2.6 -2,-0.4 2,-0.3 -0.706 38.4 170.2 -75.2 146.5 -24.5 4.9 -38.6 35 81 A A E - C 0 44B 5 9,-2.4 9,-2.8 -2,-0.3 2,-0.5 -0.981 38.0-108.6-152.3 160.8 -23.5 3.6 -42.0 36 82 A Y E -BC 20 43B 73 -16,-2.8 -16,-2.0 -2,-0.3 2,-1.0 -0.789 25.9-144.5 -87.7 121.4 -21.5 0.9 -43.6 37 83 A D E >> -BC 19 42B 0 5,-3.5 4,-1.9 -2,-0.5 5,-1.1 -0.769 12.1-169.6 -90.2 104.5 -18.2 2.0 -45.2 38 84 A A T 45S+ 0 0 39 -20,-3.1 -1,-0.2 -2,-1.0 -19,-0.1 0.721 85.5 49.8 -56.6 -30.4 -17.8 -0.1 -48.4 39 85 A V T 45S+ 0 0 101 -21,-0.4 -1,-0.2 1,-0.1 -2,-0.1 0.875 121.5 28.7 -83.1 -42.1 -14.4 1.1 -48.9 40 86 A L T 45S- 0 0 75 2,-0.2 -2,-0.2 -22,-0.1 -1,-0.1 0.505 101.5-132.7 -90.1 -9.9 -13.0 0.5 -45.4 41 87 A D T <5 + 0 0 116 -4,-1.9 2,-0.3 1,-0.2 -3,-0.2 0.930 69.4 97.5 51.0 50.0 -15.5 -2.5 -44.9 42 88 A R E S- 0 0 94 43,-1.6 3,-2.4 -2,-0.7 -1,-0.2 0.931 72.1-176.2 44.1 58.3 -24.2 25.6 -42.4 52 98 A P G > S+ 0 0 7 0, 0.0 3,-0.5 0, 0.0 10,-0.2 0.734 75.9 63.2 -61.5 -17.7 -21.8 25.6 -39.5 53 99 A F G 3 S+ 0 0 0 41,-0.3 268,-0.2 1,-0.2 267,-0.2 0.371 72.5 106.7 -87.0 7.8 -20.7 29.1 -40.3 54 100 A Q G < S+ 0 0 92 -3,-2.4 2,-0.3 -4,-0.2 -1,-0.2 0.607 87.0 10.1 -69.6 -26.4 -24.2 30.5 -39.7 55 101 A N S <> S- 0 0 60 -3,-0.5 4,-2.0 262,-0.1 3,-0.2 -0.954 81.1-107.2-145.1 155.9 -23.4 32.2 -36.3 56 102 A Q H > S+ 0 0 51 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.783 116.7 54.5 -51.5 -33.6 -20.1 33.0 -34.4 57 103 A T H > S+ 0 0 115 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.930 111.9 37.3 -66.6 -54.4 -21.0 30.3 -31.9 58 104 A H H > S+ 0 0 109 -3,-0.2 4,-1.8 2,-0.1 -2,-0.2 0.833 121.9 51.2 -64.0 -28.1 -21.5 27.3 -34.1 59 105 A A H X S+ 0 0 0 -4,-2.0 4,-3.1 2,-0.2 5,-0.3 0.923 105.7 48.7 -81.6 -47.8 -18.6 28.7 -36.3 60 106 A K H X S+ 0 0 60 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.877 115.9 46.8 -53.3 -44.2 -15.8 29.2 -33.7 61 107 A R H X S+ 0 0 97 -4,-1.1 4,-2.7 -5,-0.2 -2,-0.2 0.889 113.6 45.2 -74.3 -43.9 -16.5 25.7 -32.3 62 108 A A H X S+ 0 0 14 -4,-1.8 4,-3.0 -10,-0.2 5,-0.3 0.954 117.0 45.3 -61.5 -50.2 -16.6 23.9 -35.6 63 109 A Y H X S+ 0 0 67 -4,-3.1 4,-2.2 1,-0.2 5,-0.2 0.975 116.3 47.1 -53.8 -57.9 -13.5 25.7 -36.9 64 110 A R H X S+ 0 0 58 -4,-2.8 4,-2.5 -5,-0.3 -1,-0.2 0.896 113.1 47.2 -50.7 -46.1 -11.8 25.1 -33.6 65 111 A E H X S+ 0 0 21 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.885 110.8 51.3 -73.0 -33.8 -12.7 21.4 -33.4 66 112 A L H X S+ 0 0 18 -4,-3.0 4,-1.5 2,-0.2 -1,-0.2 0.880 112.8 46.4 -66.4 -37.8 -11.7 20.7 -37.0 67 113 A V H X S+ 0 0 38 -4,-2.2 4,-1.3 -5,-0.3 -2,-0.2 0.877 114.7 48.0 -69.2 -39.7 -8.3 22.3 -36.4 68 114 A L H X S+ 0 0 25 -4,-2.5 4,-1.0 -5,-0.2 -2,-0.2 0.809 106.4 55.2 -72.6 -28.8 -7.8 20.5 -33.1 69 115 A M H < S+ 0 0 24 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.962 102.2 57.8 -69.0 -43.6 -8.8 17.1 -34.5 70 116 A K H < S+ 0 0 119 -4,-1.5 -2,-0.2 -5,-0.1 -1,-0.2 0.876 112.4 41.8 -45.7 -58.2 -6.1 17.4 -37.1 71 117 A C H < S+ 0 0 80 -4,-1.3 -2,-0.2 66,-0.0 -1,-0.1 0.935 100.2 69.9 -44.3 -94.3 -3.4 17.9 -34.3 72 118 A V < + 0 0 16 -4,-1.0 2,-0.2 65,-0.1 62,-0.0 0.294 50.8 179.6 -17.6 147.2 -4.2 15.3 -31.5 73 119 A N + 0 0 143 6,-0.1 2,-0.3 60,-0.0 6,-0.1 -0.616 24.0 125.1-173.8 100.1 -3.8 11.5 -31.8 74 120 A H > - 0 0 53 3,-0.4 3,-1.9 -2,-0.2 56,-0.0 -0.939 60.8-118.2-163.3 145.6 -4.5 9.1 -29.0 75 121 A K T 3 S+ 0 0 146 -2,-0.3 4,-0.1 1,-0.3 55,-0.1 0.667 112.6 55.3 -69.6 -18.1 -6.8 6.1 -28.8 76 122 A N T 3 S+ 0 0 5 82,-0.1 83,-2.6 2,-0.1 2,-0.4 0.372 102.2 68.7 -91.0 5.4 -9.0 7.7 -26.1 77 123 A I B < S-f 159 0C 2 -3,-1.9 -3,-0.4 81,-0.3 83,-0.2 -0.937 93.8 -93.9-127.6 141.4 -9.7 10.8 -28.2 78 124 A I - 0 0 14 81,-2.0 2,-0.4 -2,-0.4 -4,-0.1 -0.166 34.2-169.5 -61.4 143.9 -11.7 11.0 -31.4 79 125 A S - 0 0 70 -4,-0.1 22,-0.5 -6,-0.1 2,-0.3 -0.995 19.5-130.0-126.6 138.3 -10.2 10.8 -34.8 80 126 A L - 0 0 40 -2,-0.4 20,-0.3 1,-0.2 3,-0.1 -0.608 10.4-164.6 -83.4 139.1 -12.0 11.5 -38.0 81 127 A L S S- 0 0 63 18,-3.8 2,-0.3 1,-0.4 19,-0.2 0.653 77.4 -2.6 -87.6 -22.4 -11.8 9.0 -40.7 82 128 A N E -E 99 0B 39 17,-1.4 17,-2.5 -3,-0.1 -1,-0.4 -0.994 52.6-164.0-165.1 149.4 -13.1 11.5 -43.2 83 129 A V E +E 98 0B 42 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.949 31.2 151.4-137.1 129.3 -14.3 15.0 -43.6 84 130 A F E -E 97 0B 14 13,-2.0 13,-2.8 -2,-0.3 245,-0.1 -0.978 32.2-152.6-150.4 164.2 -16.1 16.0 -46.7 85 131 A T - 0 0 7 -2,-0.3 11,-0.1 11,-0.2 -70,-0.1 -0.992 15.9-145.9-131.5 142.5 -18.7 18.3 -48.3 86 132 A P S S+ 0 0 16 0, 0.0 2,-0.2 0, 0.0 -84,-0.1 0.532 73.5 98.6 -80.2 -6.4 -20.8 17.5 -51.3 87 133 A Q - 0 0 38 8,-0.4 -2,-0.1 1,-0.1 6,-0.1 -0.618 63.3-151.5 -86.1 149.8 -20.7 21.2 -52.5 88 134 A K + 0 0 164 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.660 67.8 34.6-102.6 -18.3 -18.2 22.0 -55.1 89 135 A T S > S- 0 0 54 1,-0.1 4,-1.3 0, 0.0 3,-0.2 -0.937 76.8-115.0-134.5 161.3 -17.4 25.6 -54.6 90 136 A L T 4 S+ 0 0 33 -2,-0.3 3,-0.2 2,-0.2 -1,-0.1 0.840 117.5 54.2 -53.9 -38.7 -17.1 28.0 -51.7 91 137 A E T 4 S+ 0 0 151 1,-0.3 -1,-0.2 -3,-0.0 -4,-0.0 0.834 114.1 42.4 -76.8 -30.7 -20.1 30.0 -53.0 92 138 A E T 4 S+ 0 0 102 -3,-0.2 -1,-0.3 2,-0.0 -2,-0.2 0.699 87.3 128.8 -81.1 -21.3 -22.1 26.8 -53.0 93 139 A F < + 0 0 0 -4,-1.3 3,-0.1 -3,-0.2 -3,-0.1 -0.090 12.9 137.4 -53.0 119.6 -20.8 25.6 -49.6 94 140 A Q + 0 0 80 1,-0.3 -43,-1.6 -45,-0.0 2,-0.3 0.639 55.4 37.2-112.3 -51.7 -23.5 24.6 -47.1 95 141 A D E -D 50 0B 19 -45,-0.2 2,-0.4 -44,-0.2 -8,-0.4 -0.873 47.3-160.1-123.5 144.0 -22.6 21.4 -45.2 96 142 A V E -D 49 0B 0 -47,-1.5 -47,-3.7 -2,-0.3 2,-0.5 -0.948 14.1-156.4-115.0 135.2 -19.6 19.5 -43.6 97 143 A Y E -DE 48 84B 2 -13,-2.8 -13,-2.0 -2,-0.4 2,-0.4 -0.985 5.1-159.3-112.7 132.9 -19.9 15.7 -42.9 98 144 A L E -DE 47 83B 32 -51,-2.8 -51,-3.3 -2,-0.5 2,-0.5 -0.917 7.4-161.2-113.7 129.2 -17.6 14.2 -40.2 99 145 A V E +DE 46 82B 0 -17,-2.5 -18,-3.8 -2,-0.4 -17,-1.4 -0.965 18.0 157.7-114.2 130.2 -17.0 10.5 -40.3 100 146 A M E -D 45 0B 24 -55,-2.7 -55,-3.2 -2,-0.5 -20,-0.1 -0.910 49.7 -71.2-137.0 173.6 -15.7 8.4 -37.4 101 147 A E E -D 44 0B 42 -22,-0.5 2,-0.3 -2,-0.3 -57,-0.3 -0.360 54.4-112.4 -62.3 143.1 -15.7 4.7 -36.3 102 148 A L - 0 0 45 -59,-1.6 2,-0.2 -67,-0.1 -59,-0.1 -0.575 38.1-162.8 -80.5 127.3 -19.1 3.6 -35.2 103 149 A M - 0 0 18 -2,-0.3 49,-0.2 49,-0.1 3,-0.1 -0.541 22.1-117.0-101.8-176.9 -19.0 2.9 -31.5 104 150 A D S S- 0 0 90 47,-1.9 2,-0.3 1,-0.3 48,-0.2 0.812 76.1 -20.0 -90.7 -32.6 -21.4 0.9 -29.5 105 151 A A E -G 151 0C 21 46,-1.2 46,-3.4 4,-0.0 -1,-0.3 -0.972 58.7-111.9-165.9 157.6 -23.0 3.3 -26.9 106 152 A N E > -G 150 0C 28 -2,-0.3 4,-1.4 44,-0.3 3,-0.4 -0.467 39.0-104.8 -96.9 178.4 -22.5 6.6 -25.2 107 153 A L H > S+ 0 0 0 42,-1.9 4,-2.4 39,-1.4 40,-0.2 0.747 113.4 71.0 -83.9 -18.2 -21.7 6.9 -21.5 108 154 A C H > S+ 0 0 52 38,-0.4 4,-0.8 41,-0.2 -1,-0.2 0.882 105.9 42.6 -55.7 -39.1 -25.3 8.2 -20.6 109 155 A Q H > S+ 0 0 93 -3,-0.4 4,-0.8 2,-0.2 3,-0.4 0.874 110.4 53.6 -76.6 -43.1 -26.4 4.6 -21.4 110 156 A V H >< S+ 0 0 8 -4,-1.4 3,-0.6 1,-0.2 -2,-0.2 0.881 104.2 60.2 -57.5 -37.2 -23.4 2.9 -19.6 111 157 A I H 3< S+ 0 0 4 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.786 97.7 56.5 -54.1 -42.1 -24.4 5.0 -16.5 112 158 A Q H 3< S+ 0 0 151 -4,-0.8 -1,-0.2 -3,-0.4 -2,-0.2 0.749 100.0 78.8 -67.1 -24.0 -27.8 3.4 -16.3 113 159 A M S << S- 0 0 97 -4,-0.8 2,-0.5 -3,-0.6 91,-0.1 -0.391 86.3-112.0 -83.1 157.1 -26.2 -0.0 -16.1 114 160 A E - 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0 0 80 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.545 59.0-112.2 -61.1 120.6 -27.4 29.7 3.0 248 303 A K - 0 0 137 -2,-0.3 2,-0.3 -23,-0.0 3,-0.1 -0.147 31.4-169.3 -83.9 150.1 -25.0 27.3 4.7 249 304 A Y - 0 0 114 1,-0.1 -23,-2.0 -28,-0.1 -26,-0.1 -0.981 22.5-160.3-131.0 140.3 -24.2 23.5 4.7 250 305 A A - 0 0 108 -2,-0.3 -1,-0.1 -25,-0.2 -27,-0.1 0.829 50.2-152.0 -74.0 -38.7 -22.0 21.4 6.8 251 306 A G - 0 0 23 -29,-0.2 -27,-0.2 -26,-0.1 2,-0.2 0.434 13.3 -74.0 73.5 152.2 -22.2 18.9 4.0 252 307 A L - 0 0 82 -29,-1.8 2,-0.0 -30,-0.1 -29,-0.0 -0.498 35.4-121.2 -84.3 138.8 -22.0 15.1 4.0 253 308 A T >> - 0 0 84 -2,-0.2 4,-2.7 1,-0.1 3,-0.5 -0.267 39.2-103.2 -56.8 159.4 -19.0 12.8 4.4 254 309 A F H 3> S+ 0 0 32 1,-0.2 4,-2.2 2,-0.2 -1,-0.1 0.778 119.0 60.4 -71.8 -32.8 -18.4 10.5 1.5 255 310 A P H 34 S+ 0 0 74 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 0.880 112.2 40.4 -52.5 -41.4 -19.7 7.4 3.3 256 311 A K H <4 S+ 0 0 149 -3,-0.5 -2,-0.2 1,-0.2 -4,-0.0 0.906 117.3 49.3 -73.2 -50.9 -23.1 9.2 3.6 257 312 A L H < S+ 0 0 10 -4,-2.7 -1,-0.2 1,-0.2 -3,-0.2 0.816 128.9 21.4 -48.4 -40.0 -22.8 10.6 0.1 258 313 A F S < S- 0 0 1 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.1 -0.642 85.5-165.4-137.5 69.4 -21.9 7.2 -1.5 259 314 A P > - 0 0 46 0, 0.0 3,-1.6 0, 0.0 4,-0.2 -0.139 32.7-108.0 -61.6 161.7 -23.2 4.4 0.9 260 315 A D G > S+ 0 0 101 1,-0.3 3,-3.5 2,-0.2 14,-0.0 0.830 109.3 75.9 -62.3 -35.3 -22.0 0.8 0.5 261 316 A S G 3 S+ 0 0 109 1,-0.3 -1,-0.3 4,-0.0 4,-0.1 0.699 90.3 59.9 -47.6 -26.6 -25.3 -0.5 -0.9 262 317 A L G < S+ 0 0 64 -3,-1.6 -1,-0.3 2,-0.1 -2,-0.2 0.646 99.7 74.6 -74.1 -15.7 -24.3 1.2 -4.2 263 318 A F S < S- 0 0 20 -3,-3.5 2,-0.4 -4,-0.2 -147,-0.1 -0.648 89.8-106.7-106.1 151.6 -21.2 -1.0 -4.5 264 319 A P + 0 0 43 0, 0.0 10,-0.3 0, 0.0 -2,-0.1 -0.660 53.1 155.9 -56.5 127.6 -20.3 -4.5 -5.3 265 320 A A + 0 0 45 -2,-0.4 6,-0.1 -4,-0.1 -2,-0.0 0.060 29.9 105.7-151.2 24.7 -19.4 -5.6 -1.9 266 321 A D S S+ 0 0 132 4,-0.0 2,-0.2 5,-0.0 3,-0.0 0.807 79.3 40.5 -85.3 -34.9 -19.8 -9.5 -1.8 267 322 A S S > S- 0 0 45 1,-0.1 4,-1.9 0, 0.0 5,-0.1 -0.603 88.0-110.4-107.2 166.8 -16.2 -10.5 -1.8 268 323 A E H > S+ 0 0 145 -2,-0.2 4,-2.1 2,-0.2 5,-0.2 0.876 120.9 54.6 -64.4 -43.4 -13.1 -9.2 -0.0 269 324 A H H > S+ 0 0 116 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.914 111.0 46.2 -49.7 -47.2 -11.8 -7.9 -3.5 270 325 A N H > S+ 0 0 27 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.889 109.9 52.6 -71.7 -35.1 -15.1 -6.0 -4.0 271 326 A K H X S+ 0 0 104 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.887 113.4 44.1 -63.5 -44.9 -15.1 -4.6 -0.4 272 327 A L H >X S+ 0 0 97 -4,-2.1 4,-2.4 2,-0.2 3,-0.6 0.952 110.8 53.0 -63.5 -56.0 -11.7 -3.2 -0.9 273 328 A K H 3X S+ 0 0 27 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.896 107.6 54.2 -46.4 -42.3 -12.4 -1.9 -4.4 274 329 A A H 3X S+ 0 0 7 -4,-2.5 4,-1.8 -10,-0.3 -1,-0.2 0.853 108.0 47.4 -67.9 -30.1 -15.4 -0.1 -3.0 275 330 A S H X S+ 0 0 1 -4,-1.9 4,-1.5 1,-0.2 3,-1.3 0.934 111.3 50.5 -63.0 -50.1 -11.0 8.6 -5.3 281 336 A L H >X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.3 3,-0.6 0.916 107.1 55.5 -51.5 -44.2 -14.4 10.1 -5.4 282 337 A S H 3< S+ 0 0 36 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.718 112.6 42.5 -63.7 -20.5 -13.6 12.0 -2.2 283 338 A K H << S+ 0 0 88 -3,-1.3 10,-2.0 -4,-0.8 -1,-0.2 0.609 116.1 46.4-102.4 -16.4 -10.5 13.5 -3.9 284 339 A M H << S+ 0 0 0 -4,-1.5 2,-1.5 -3,-0.6 -89,-0.2 0.848 104.3 60.5 -97.1 -40.1 -12.1 14.3 -7.2 285 340 A L S < S+ 0 0 5 -4,-2.6 2,-0.5 -5,-0.2 -1,-0.2 -0.469 74.0 132.3 -91.9 70.1 -15.2 15.9 -5.9 286 341 A V - 0 0 32 -2,-1.5 6,-0.1 -3,-0.2 -91,-0.1 -0.975 50.0-148.0-128.2 124.6 -13.5 18.7 -4.0 287 342 A I S S+ 0 0 12 -2,-0.5 -109,-0.2 -63,-0.2 -1,-0.2 0.954 83.0 65.9 -65.3 -48.5 -14.7 22.3 -4.4 288 343 A D S > S- 0 0 11 1,-0.2 3,-1.5 3,-0.1 4,-0.4 -0.613 72.7-151.9 -83.2 122.6 -11.4 24.1 -4.0 289 344 A P T 3 S+ 0 0 13 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 0.682 92.0 69.6 -71.3 -14.9 -9.2 23.2 -7.0 290 345 A A T 3 S+ 0 0 60 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.0 0.767 108.7 33.4 -63.5 -36.7 -6.2 23.8 -4.7 291 346 A K S < S+ 0 0 124 -3,-1.5 2,-0.3 2,-0.1 -1,-0.2 0.355 97.5 106.9-103.4 7.5 -7.0 20.8 -2.7 292 347 A R S S- 0 0 11 -4,-0.4 -8,-0.2 -3,-0.3 -104,-0.1 -0.653 78.8-103.8 -87.5 140.1 -8.5 18.7 -5.7 293 348 A I - 0 0 25 -10,-2.0 -102,-0.1 -2,-0.3 2,-0.1 -0.170 34.6-127.0 -64.8 152.5 -6.3 15.8 -7.0 294 349 A S > - 0 0 40 1,-0.1 4,-1.8 -103,-0.1 5,-0.1 -0.388 24.7-103.7 -93.1 175.1 -4.5 16.3 -10.3 295 350 A V H > S+ 0 0 8 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.953 119.4 51.0 -63.3 -54.2 -4.7 14.1 -13.4 296 351 A D H > S+ 0 0 86 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.938 112.7 44.7 -49.4 -53.3 -1.2 12.5 -12.7 297 352 A D H >4 S+ 0 0 99 1,-0.2 3,-0.6 2,-0.2 4,-0.4 0.867 110.6 54.2 -66.3 -30.8 -2.0 11.7 -9.1 298 353 A A H >< S+ 0 0 0 -4,-1.8 3,-1.1 1,-0.2 6,-0.3 0.896 104.8 55.2 -63.4 -41.3 -5.5 10.3 -10.1 299 354 A L H 3< S+ 0 0 7 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.688 109.3 49.0 -60.9 -16.2 -3.7 8.0 -12.6 300 355 A Q T << S+ 0 0 99 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.391 82.7 118.9-104.6 -6.0 -1.6 6.7 -9.6 301 356 A H S X> S- 0 0 8 -3,-1.1 4,-3.6 -4,-0.4 3,-0.7 -0.386 75.1-122.6 -64.3 140.4 -4.5 6.2 -7.4 302 357 A P T 34 S+ 0 0 60 0, 0.0 4,-0.5 0, 0.0 -1,-0.1 0.871 111.6 55.9 -60.1 -33.4 -4.8 2.5 -6.5 303 358 A Y T 34 S+ 0 0 0 -27,-0.3 3,-0.1 1,-0.2 -178,-0.1 0.852 122.0 28.7 -56.5 -38.8 -8.4 2.2 -8.0 304 359 A I T X4 S+ 0 0 0 -3,-0.7 3,-1.6 -6,-0.3 4,-0.3 0.802 103.6 72.6 -92.7 -38.4 -7.0 3.4 -11.3 305 360 A N G >< S+ 0 0 59 -4,-3.6 3,-0.8 1,-0.3 -1,-0.1 0.526 73.5 83.5 -73.6 -3.1 -3.4 2.4 -11.5 306 361 A V G 3 S+ 0 0 86 -4,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.856 99.8 42.5 -64.7 -25.5 -4.0 -1.4 -12.1 307 362 A W G < S+ 0 0 80 -3,-1.6 -1,-0.2 -186,-0.1 -2,-0.2 0.578 87.3 141.8 -87.3 -12.9 -4.5 -0.4 -15.7 308 363 A Y < + 0 0 107 -3,-0.8 3,-0.1 -4,-0.3 -3,-0.0 0.077 20.5 169.4 -45.7 138.6 -1.5 1.9 -15.7 309 364 A D - 0 0 95 1,-0.1 -1,-0.1 0, 0.0 -2,-0.0 -0.819 37.4-151.4-158.5 110.9 0.5 1.8 -18.8 310 365 A P 0 0 121 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.902 360.0 360.0 -53.6 -43.0 3.3 4.2 -19.8 311 366 A A 0 0 116 -3,-0.1 -3,-0.0 0, 0.0 0, 0.0 -0.850 360.0 360.0 117.4 360.0 2.0 3.2 -23.2 312 ! 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 0.0 313 383 A R 0 0 232 0, 0.0 2,-0.5 0, 0.0 -253,-0.0 0.000 360.0 360.0 360.0 172.4 -10.9 36.2 -33.1 314 384 A E - 0 0 167 -254,-0.0 2,-0.3 0, 0.0 -258,-0.0 -0.817 360.0-179.0 -88.5 127.7 -14.3 37.6 -34.1 315 385 A H - 0 0 34 -2,-0.5 2,-0.1 -259,-0.0 -259,-0.1 -0.897 26.7-116.3-123.2 156.4 -15.3 36.9 -37.7 316 386 A T > - 0 0 75 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.460 37.8-106.0 -71.7 162.8 -18.2 37.6 -40.0 317 387 A I H > S+ 0 0 92 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.959 124.4 52.1 -50.9 -60.0 -20.3 34.7 -41.4 318 388 A E H > S+ 0 0 168 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.845 111.5 47.7 -41.4 -46.8 -18.7 35.2 -44.8 319 389 A E H > S+ 0 0 95 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.912 111.2 50.4 -67.2 -38.2 -15.2 34.9 -43.1 320 390 A W H X S+ 0 0 7 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.900 106.5 55.1 -65.7 -42.0 -16.2 31.8 -41.0 321 391 A K H X S+ 0 0 40 -4,-2.5 4,-3.2 -268,-0.2 -1,-0.2 0.904 108.4 46.9 -58.8 -48.0 -17.4 30.0 -44.1 322 392 A E H X S+ 0 0 91 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.880 114.1 49.3 -62.9 -38.8 -14.1 30.4 -46.0 323 393 A L H X S+ 0 0 44 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.919 116.4 40.5 -66.6 -43.4 -12.1 29.3 -43.0 324 394 A I H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.962 113.9 53.5 -73.9 -48.9 -14.3 26.3 -42.4 325 395 A Y H X S+ 0 0 34 -4,-3.2 4,-2.6 -5,-0.3 -1,-0.2 0.876 109.9 49.0 -48.3 -44.0 -14.4 25.6 -46.1 326 396 A K H X S+ 0 0 80 -4,-2.3 4,-2.5 2,-0.2 5,-0.4 0.899 109.0 50.4 -67.7 -47.6 -10.6 25.6 -46.3 327 397 A E H < S+ 0 0 32 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.929 112.9 49.2 -50.0 -50.5 -10.1 23.3 -43.3 328 398 A V H < S+ 0 0 7 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.954 119.1 35.6 -50.6 -59.2 -12.6 20.9 -45.0 329 399 A M H < S- 0 0 74 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.703 104.9-132.7 -76.1 -20.2 -10.8 21.1 -48.4 330 400 A N < 0 0 131 -4,-2.5 -3,-0.2 -5,-0.2 -4,-0.1 0.262 360.0 360.0 90.3 -7.6 -7.4 21.3 -46.6 331 401 A S 0 0 103 -5,-0.4 -4,-0.2 -6,-0.2 -5,-0.1 0.246 360.0 360.0 -73.3 360.0 -6.3 24.2 -48.8