==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-FEB-13 3ZLX . COMPND 2 MOLECULE: DUAL SPECIFICITY MITOGEN-ACTIVATED PROTEIN KINASE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.AMANING,M.LOWINSKY,F.VALLEE,V.STEIER,C.MARCIREAU,A.UGOLINI . 309 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15275.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 204 66.0 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 . 39 12.6 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 . 16 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 111 35.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 1 1 0 3 1 1 2 0 0 0 1 1 0 0 0 0 0 1 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 0 1 0 0 2 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 . 0 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 39 A E 0 0 90 0, 0.0 139,-0.1 0, 0.0 136,-0.0 0.000 360.0 360.0 360.0 -26.4 -23.8 43.3 -24.3 2 40 A L + 0 0 48 138,-0.1 135,-0.0 2,-0.1 139,-0.0 0.366 360.0 120.2 -94.9 2.3 -24.2 44.1 -20.5 3 41 A E - 0 0 156 1,-0.1 2,-0.4 0, 0.0 0, 0.0 -0.213 56.2-132.0 -65.2 154.8 -28.0 45.0 -20.6 4 42 A L - 0 0 66 4,-0.0 -1,-0.1 2,-0.0 -2,-0.1 -0.922 5.3-132.1-116.6 144.4 -30.5 42.9 -18.5 5 43 A D > - 0 0 85 -2,-0.4 4,-2.0 1,-0.1 5,-0.2 -0.171 40.0 -94.5 -76.2 176.9 -33.8 41.3 -19.4 6 44 A E H > S+ 0 0 165 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.955 124.4 49.4 -58.1 -53.2 -36.9 41.7 -17.1 7 45 A Q H > S+ 0 0 111 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.819 111.2 49.8 -54.5 -41.9 -36.3 38.5 -15.1 8 46 A Q H > S+ 0 0 29 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.943 111.4 46.8 -67.1 -49.2 -32.6 39.4 -14.4 9 47 A R H X S+ 0 0 182 -4,-2.0 4,-2.9 1,-0.2 -2,-0.2 0.915 113.4 50.2 -57.4 -46.3 -33.4 42.9 -13.2 10 48 A K H X S+ 0 0 141 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.846 112.4 45.9 -59.4 -44.6 -36.2 41.6 -10.9 11 49 A R H X S+ 0 0 57 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.892 113.8 49.5 -67.5 -42.1 -33.9 38.8 -9.4 12 50 A L H X S+ 0 0 37 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.922 113.3 46.1 -61.8 -44.1 -31.1 41.4 -8.9 13 51 A E H X S+ 0 0 125 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.903 111.0 52.9 -66.2 -41.1 -33.7 43.8 -7.2 14 52 A A H X S+ 0 0 53 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.860 108.4 51.4 -63.9 -35.1 -35.0 40.9 -5.0 15 53 A F H X S+ 0 0 24 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.939 111.2 45.8 -65.3 -52.7 -31.5 40.1 -3.9 16 54 A L H X S+ 0 0 48 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.841 110.6 53.6 -60.3 -36.2 -30.7 43.7 -2.8 17 55 A T H X S+ 0 0 70 -4,-2.0 4,-0.5 2,-0.2 -1,-0.2 0.894 112.6 44.1 -65.5 -42.6 -34.1 44.1 -1.0 18 56 A Q H >< S+ 0 0 94 -4,-1.7 3,-0.9 1,-0.2 -2,-0.2 0.905 113.7 52.4 -66.4 -43.6 -33.3 40.9 1.0 19 57 A K H >X S+ 0 0 25 -4,-2.5 3,-2.2 1,-0.2 4,-0.7 0.879 99.9 60.9 -60.0 -44.3 -29.7 42.1 1.6 20 58 A Q H 3< S+ 0 0 161 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.704 100.3 56.9 -59.5 -21.1 -30.8 45.5 3.0 21 59 A K T << S+ 0 0 166 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.492 92.5 74.0 -86.2 -8.9 -32.7 43.8 5.8 22 60 A V T <4 + 0 0 20 -3,-2.2 -2,-0.2 -4,-0.2 -1,-0.1 0.953 69.9 177.4 -74.8 -51.1 -29.5 42.0 7.0 23 61 A G < + 0 0 58 -4,-0.7 2,-0.2 2,-0.1 -1,-0.1 -0.429 50.2 4.7 80.4-159.3 -27.6 44.7 8.7 24 62 A E S S- 0 0 151 -2,-0.1 2,-0.4 1,-0.1 69,-0.1 -0.441 73.4-132.7 -68.9 126.4 -24.2 44.2 10.5 25 63 A L + 0 0 16 -2,-0.2 2,-0.3 69,-0.1 -1,-0.1 -0.681 29.7 178.0 -83.0 127.5 -22.9 40.6 10.2 26 64 A K > - 0 0 108 -2,-0.4 3,-1.5 1,-0.1 4,-0.2 -0.970 37.4-118.9-135.5 148.8 -21.6 39.0 13.4 27 65 A D G > S+ 0 0 50 -2,-0.3 3,-1.7 1,-0.3 -1,-0.1 0.879 110.3 52.4 -48.6 -56.2 -20.2 35.6 14.3 28 66 A D G 3 S+ 0 0 131 1,-0.3 -1,-0.3 -3,-0.1 22,-0.1 0.575 94.7 72.5 -63.7 -10.3 -22.9 34.6 16.8 29 67 A D G < S+ 0 0 46 -3,-1.5 21,-2.8 21,-0.1 2,-0.5 0.530 85.3 88.4 -83.2 -0.9 -25.7 35.3 14.2 30 68 A F E < -A 49 0A 16 -3,-1.7 2,-0.5 19,-0.2 19,-0.2 -0.859 54.3-167.5-110.3 131.0 -24.7 32.2 12.2 31 69 A E E -A 48 0A 111 17,-2.7 17,-2.7 -2,-0.5 2,-0.2 -0.938 25.9-128.2-111.3 122.9 -25.9 28.6 12.5 32 70 A K E +A 47 0A 145 -2,-0.5 15,-0.2 15,-0.2 3,-0.1 -0.527 30.3 171.4 -69.9 128.6 -23.8 26.0 10.5 33 71 A I E - 0 0 85 13,-2.5 2,-0.3 1,-0.4 14,-0.2 0.775 60.9 -39.8-101.1 -53.3 -26.1 23.8 8.3 34 72 A S E -A 46 0A 49 12,-1.4 12,-2.9 0, 0.0 -1,-0.4 -0.958 58.9 -87.9-165.2 173.2 -23.4 21.8 6.3 35 73 A E E -A 45 0A 118 -2,-0.3 10,-0.3 10,-0.3 3,-0.1 -0.812 31.4-176.4 -94.0 130.8 -20.1 22.0 4.5 36 74 A L E - 0 0 55 8,-2.9 2,-0.3 1,-0.5 9,-0.2 0.808 60.0 -39.4 -96.8 -38.2 -20.4 23.0 0.8 37 75 A G E -A 44 0A 21 7,-1.5 7,-3.0 74,-0.1 -1,-0.5 -0.945 45.0-134.3-178.8 165.4 -16.8 22.8 -0.3 38 76 A A E +A 43 0A 71 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.977 43.4 121.0-135.8 139.8 -13.2 23.4 0.7 39 77 A G + 0 0 61 3,-2.2 2,-0.9 -2,-0.3 4,-0.0 -0.449 54.6 14.0-160.5-125.0 -10.6 25.1 -1.6 40 78 A N S S- 0 0 52 1,-0.2 144,-0.1 -2,-0.1 3,-0.0 -0.694 125.6 -7.8 -88.7 109.7 -8.2 28.0 -1.8 41 79 A G S S- 0 0 29 -2,-0.9 21,-0.5 142,-0.1 2,-0.2 -0.343 125.2 -34.3 110.0 -44.7 -7.8 29.8 1.5 42 80 A G E S- B 0 61A 18 19,-0.2 -3,-2.2 2,-0.0 2,-0.3 -0.895 75.2 -47.1-174.7-158.8 -10.4 27.9 3.5 43 81 A V E -AB 38 60A 43 17,-1.0 17,-2.6 -2,-0.2 2,-0.5 -0.758 33.4-144.1-105.5 147.3 -13.8 26.2 3.8 44 82 A V E -AB 37 59A 33 -7,-3.0 -8,-2.9 -2,-0.3 -7,-1.5 -0.953 19.4-169.2-112.0 127.2 -17.2 27.2 2.6 45 83 A F E -AB 35 58A 35 13,-2.7 13,-3.2 -2,-0.5 2,-0.4 -0.874 26.3-125.9-115.9 146.3 -20.2 26.4 4.8 46 84 A K E +AB 34 57A 61 -12,-2.9 -13,-2.5 -2,-0.3 -12,-1.4 -0.785 48.1 179.3 -84.3 128.0 -23.9 26.5 4.1 47 85 A V E -AB 32 56A 3 9,-3.2 9,-2.5 -2,-0.4 2,-0.5 -0.939 32.3-129.1-135.1 161.9 -25.2 28.7 7.0 48 86 A S E -AB 31 55A 32 -17,-2.7 -17,-2.7 -2,-0.3 2,-1.1 -0.955 14.6-143.9-111.7 124.9 -28.3 30.2 8.4 49 87 A H E > -A 30 0A 2 5,-3.0 4,-2.4 -2,-0.5 5,-0.5 -0.834 22.4-154.7 -84.7 98.9 -28.2 33.9 9.3 50 88 A K T 4 S+ 0 0 100 -21,-2.8 -1,-0.2 -2,-1.1 -20,-0.1 0.890 82.4 47.7 -48.3 -52.4 -30.5 33.4 12.4 51 89 A P T 4 S+ 0 0 90 0, 0.0 -1,-0.2 0, 0.0 -21,-0.0 0.934 123.8 30.0 -58.1 -52.9 -32.0 37.0 12.6 52 90 A S T 4 S- 0 0 45 2,-0.1 -2,-0.2 -30,-0.1 3,-0.1 0.657 97.4-132.9 -80.3 -19.3 -32.9 37.4 9.0 53 91 A G < + 0 0 50 -4,-2.4 2,-0.2 1,-0.3 -3,-0.2 0.453 54.9 148.7 77.8 2.5 -33.6 33.7 8.4 54 92 A L - 0 0 21 -5,-0.5 -5,-3.0 -36,-0.1 2,-0.4 -0.521 46.4-135.0 -74.5 133.4 -31.5 33.9 5.1 55 93 A V E +B 48 0A 64 -2,-0.2 52,-0.4 -7,-0.2 2,-0.3 -0.718 37.0 170.7 -85.5 132.3 -29.5 30.9 4.0 56 94 A M E -B 47 0A 0 -9,-2.5 -9,-3.2 -2,-0.4 2,-0.5 -0.892 37.7-115.8-136.3 169.1 -26.0 32.0 2.9 57 95 A A E -BC 46 105A 8 48,-2.5 48,-2.9 -2,-0.3 2,-0.6 -0.951 31.5-161.8-108.6 123.3 -22.6 30.5 2.0 58 96 A R E -BC 45 104A 21 -13,-3.2 -13,-2.7 -2,-0.5 2,-0.6 -0.945 4.4-160.8-114.6 116.7 -20.0 31.4 4.5 59 97 A K E -BC 44 103A 14 44,-3.1 44,-2.3 -2,-0.6 2,-0.4 -0.865 8.2-159.2 -99.3 125.1 -16.3 31.2 3.6 60 98 A L E -BC 43 102A 22 -17,-2.6 -17,-1.0 -2,-0.6 2,-0.5 -0.888 5.9-168.9-106.1 126.7 -13.9 31.0 6.5 61 99 A I E -BC 42 101A 2 40,-2.3 40,-2.5 -2,-0.4 2,-0.6 -0.972 19.1-138.6-118.0 109.1 -10.2 31.9 6.0 62 100 A H E + C 0 100A 116 -2,-0.5 2,-0.3 -21,-0.5 38,-0.3 -0.612 37.4 160.7 -72.7 112.6 -8.0 31.1 9.0 63 101 A L - 0 0 16 36,-2.8 2,-0.9 -2,-0.6 36,-0.1 -0.943 32.7-157.0-141.6 115.3 -5.6 34.1 9.4 64 102 A E + 0 0 141 -2,-0.3 2,-0.3 116,-0.1 -2,-0.0 -0.854 44.5 139.7 -92.6 100.5 -3.6 35.0 12.5 65 103 A I - 0 0 31 -2,-0.9 34,-0.1 3,-0.0 -2,-0.1 -0.991 54.2 -93.9-148.9 148.3 -3.0 38.8 11.9 66 104 A K > - 0 0 135 -2,-0.3 4,-1.7 1,-0.1 3,-0.4 -0.070 42.2-106.3 -55.2 155.1 -3.0 42.1 13.8 67 105 A P H > S+ 0 0 75 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.736 117.9 65.2 -58.3 -21.1 -6.2 44.4 14.0 68 106 A A H > S+ 0 0 66 2,-0.2 4,-1.0 1,-0.1 -2,-0.0 0.957 106.1 37.5 -61.2 -59.8 -4.3 46.7 11.5 69 107 A I H >> S+ 0 0 34 -3,-0.4 4,-2.3 1,-0.2 3,-0.5 0.920 116.0 52.6 -63.5 -50.4 -4.3 44.2 8.6 70 108 A R H 3X S+ 0 0 66 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.842 107.1 51.6 -59.3 -36.4 -7.7 42.7 9.2 71 109 A N H 3X S+ 0 0 89 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.2 0.804 111.1 49.4 -69.4 -30.2 -9.5 46.1 9.3 72 110 A Q H < S+ 0 0 53 -4,-2.5 3,-1.0 1,-0.2 -1,-0.2 0.814 106.5 54.7 -66.8 -35.5 -11.1 46.4 0.8 77 115 A L H >< S+ 0 0 5 -4,-2.2 3,-2.0 1,-0.2 -1,-0.2 0.724 86.6 81.2 -72.5 -20.1 -13.8 43.7 0.5 78 116 A Q G >< S+ 0 0 75 -4,-1.0 3,-1.6 -3,-0.4 4,-0.2 0.663 74.5 76.6 -58.9 -19.2 -16.5 46.4 0.8 79 117 A V G X S+ 0 0 52 -3,-1.0 3,-2.4 1,-0.3 4,-0.5 0.872 81.7 68.1 -56.7 -39.0 -15.9 46.9 -2.9 80 118 A L G < S+ 0 0 23 -3,-2.0 -1,-0.3 1,-0.3 11,-0.2 0.613 83.7 70.3 -57.7 -18.2 -18.0 43.7 -3.4 81 119 A H G < S+ 0 0 62 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.690 99.9 49.7 -71.7 -19.1 -21.1 45.6 -2.2 82 120 A E S < S+ 0 0 119 -3,-2.4 2,-1.6 -4,-0.2 -1,-0.2 0.632 86.1 93.9 -89.8 -23.5 -20.8 47.5 -5.6 83 121 A C + 0 0 7 -4,-0.5 2,-0.7 -3,-0.2 8,-0.2 -0.580 50.3 161.8 -79.1 84.6 -20.5 44.3 -7.8 84 122 A N + 0 0 47 -2,-1.6 5,-0.1 6,-0.1 6,-0.0 -0.886 15.1 127.9-111.1 101.3 -24.2 43.8 -8.8 85 123 A S > - 0 0 6 -2,-0.7 3,-1.7 3,-0.4 53,-0.0 -0.993 64.1-123.8-151.4 147.0 -24.6 41.5 -11.8 86 124 A P T 3 S+ 0 0 12 0, 0.0 80,-0.2 0, 0.0 52,-0.1 0.642 115.0 54.3 -61.9 -17.5 -26.6 38.3 -12.7 87 125 A Y T 3 S+ 0 0 32 50,-0.1 81,-2.4 80,-0.1 2,-0.4 0.252 98.8 71.0-103.4 10.2 -23.2 36.8 -13.6 88 126 A I B < S-e 168 0B 4 -3,-1.7 -3,-0.4 79,-0.3 81,-0.2 -0.997 89.4-107.9-132.2 129.0 -21.5 37.4 -10.2 89 127 A V - 0 0 11 79,-2.2 81,-0.1 -2,-0.4 -2,-0.1 -0.275 44.3-107.2 -53.5 129.8 -22.3 35.7 -6.9 90 128 A G - 0 0 7 -4,-0.1 16,-2.4 15,-0.1 2,-0.4 -0.214 30.6-143.5 -58.9 144.2 -24.1 38.0 -4.5 91 129 A F E +D 105 0A 10 14,-0.3 14,-0.3 -11,-0.2 3,-0.1 -0.978 21.6 178.8-116.5 128.7 -22.1 39.3 -1.6 92 130 A Y E - 0 0 19 12,-2.9 2,-0.3 -2,-0.4 13,-0.2 0.792 57.4 -77.7 -95.3 -35.3 -23.7 39.9 1.9 93 131 A G E -D 104 0A 5 11,-1.5 11,-3.0 -69,-0.1 -1,-0.3 -0.901 32.9-109.6 157.8 177.1 -20.6 41.1 3.7 94 132 A A E +D 103 0A 10 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.993 30.5 161.7-140.3 144.6 -17.3 40.3 5.4 95 133 A F E -D 102 0A 19 7,-1.5 7,-3.3 -2,-0.3 2,-0.4 -0.948 30.2-122.2-153.5 167.9 -16.1 40.4 9.0 96 134 A Y E +D 101 0A 51 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.955 29.1 168.0-118.0 141.0 -13.3 39.0 11.3 97 135 A S E > -D 100 0A 21 3,-2.3 3,-1.3 -2,-0.4 -2,-0.1 -0.900 61.5 -26.7-158.2 123.3 -13.9 36.9 14.4 98 136 A D T 3 S- 0 0 149 -2,-0.3 3,-0.1 1,-0.3 -34,-0.1 0.836 127.2 -31.3 37.6 67.5 -11.4 34.9 16.5 99 137 A G T 3 S+ 0 0 2 -34,-0.1 -36,-2.8 -36,-0.1 2,-0.4 0.369 121.1 90.4 84.3 -3.7 -8.7 34.0 14.0 100 138 A E E < -CD 62 97A 64 -3,-1.3 -3,-2.3 -38,-0.3 2,-0.4 -0.984 61.2-144.0-135.6 138.5 -10.9 33.9 10.9 101 139 A I E -CD 61 96A 0 -40,-2.5 -40,-2.3 -2,-0.4 2,-0.4 -0.758 23.2-152.8 -88.9 135.7 -12.2 36.1 8.1 102 140 A S E -CD 60 95A 0 -7,-3.3 -7,-1.5 -2,-0.4 2,-0.5 -0.944 11.1-169.0-113.4 135.0 -15.7 35.4 7.0 103 141 A I E -CD 59 94A 16 -44,-2.3 -44,-3.1 -2,-0.4 2,-0.5 -0.992 12.1-157.3-120.7 119.6 -17.1 36.2 3.6 104 142 A C E +CD 58 93A 0 -11,-3.0 -12,-2.9 -2,-0.5 -11,-1.5 -0.863 21.9 166.1-104.7 124.7 -20.8 35.8 3.3 105 143 A M E -CD 57 91A 29 -48,-2.9 -48,-2.5 -2,-0.5 -14,-0.3 -0.859 42.9 -73.1-131.4 170.1 -22.3 35.2 -0.1 106 144 A E - 0 0 24 -16,-2.4 2,-0.5 -2,-0.3 -50,-0.1 -0.326 52.9-118.6 -60.2 139.3 -25.3 34.1 -2.0 107 145 A H - 0 0 42 -52,-0.4 2,-0.7 -60,-0.1 -1,-0.1 -0.771 22.2-159.5 -88.6 125.8 -25.9 30.3 -1.7 108 146 A M > - 0 0 9 -2,-0.5 3,-2.0 1,-0.1 52,-0.2 -0.930 3.3-158.8-109.4 103.4 -25.7 28.5 -5.1 109 147 A D T 3 S+ 0 0 63 -2,-0.7 52,-0.2 1,-0.3 -1,-0.1 0.660 88.1 58.5 -61.9 -15.8 -27.5 25.2 -4.6 110 148 A G T 3 S- 0 0 6 50,-1.6 -1,-0.3 1,-0.3 51,-0.2 0.478 98.2-149.2 -88.3 -6.5 -25.8 23.5 -7.6 111 149 A G < - 0 0 16 -3,-2.0 49,-2.5 49,-0.4 -1,-0.3 -0.251 39.0 -31.6 68.6-153.9 -22.4 24.2 -6.0 112 150 A S B > -F 159 0B 12 47,-0.2 4,-2.1 -3,-0.1 3,-0.4 -0.543 53.2-113.9 -98.2 163.1 -19.3 24.7 -8.2 113 151 A L H > S+ 0 0 2 45,-2.5 4,-2.4 42,-1.3 43,-0.3 0.714 113.7 62.2 -71.2 -18.9 -18.4 23.3 -11.7 114 152 A D H > S+ 0 0 71 41,-0.6 4,-1.7 44,-0.2 -1,-0.2 0.921 111.5 41.4 -68.3 -36.5 -15.5 21.3 -10.4 115 153 A Q H > S+ 0 0 70 -3,-0.4 4,-1.9 2,-0.2 -2,-0.2 0.884 114.3 49.8 -74.5 -40.6 -18.1 19.4 -8.3 116 154 A V H X S+ 0 0 1 -4,-2.1 4,-3.3 1,-0.2 5,-0.2 0.931 110.7 51.3 -64.4 -42.4 -20.7 19.2 -11.1 117 155 A L H X S+ 0 0 13 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.901 106.7 53.4 -57.9 -45.4 -18.0 17.9 -13.4 118 156 A K H < S+ 0 0 194 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.905 115.9 40.7 -57.2 -43.0 -17.0 15.2 -10.9 119 157 A K H < S+ 0 0 143 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.918 119.6 43.0 -70.8 -49.7 -20.7 14.1 -10.8 120 158 A A H < S- 0 0 32 -4,-3.3 2,-1.2 1,-0.2 -2,-0.2 0.735 89.5-144.0 -69.8 -31.8 -21.4 14.4 -14.6 121 159 A G S < S+ 0 0 43 -4,-2.7 2,-0.3 -5,-0.2 -1,-0.2 -0.527 81.0 7.1 93.1 -62.6 -18.2 12.8 -15.8 122 160 A R S S- 0 0 106 -2,-1.2 94,-0.2 -6,-0.1 93,-0.1 -0.982 78.1-124.2-145.9 152.2 -18.2 15.3 -18.7 123 161 A I - 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0 0 85 -2,-0.1 4,-1.7 1,-0.1 5,-0.1 -0.230 34.9 -92.5 -85.2 178.5 -3.3 9.5 -26.2 227 268 A A H > S+ 0 0 71 1,-0.2 4,-0.7 2,-0.2 -1,-0.1 0.785 128.0 52.3 -63.0 -28.4 -5.3 7.6 -28.9 228 269 A K H > S+ 0 0 153 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.856 106.6 49.1 -77.1 -41.2 -6.1 5.0 -26.2 229 270 A E H > S+ 0 0 71 1,-0.2 4,-1.4 2,-0.2 3,-0.4 0.862 107.8 55.4 -67.8 -36.9 -7.5 7.5 -23.6 230 271 A L H X S+ 0 0 56 -4,-1.7 4,-2.0 1,-0.2 5,-0.4 0.793 104.8 54.3 -65.1 -30.3 -9.7 9.2 -26.2 231 272 A E H X S+ 0 0 121 -4,-0.7 4,-0.8 3,-0.2 -1,-0.2 0.762 103.7 56.4 -72.7 -29.8 -11.3 5.7 -27.0 232 273 A L H < S+ 0 0 153 -4,-0.8 -2,-0.2 -3,-0.4 -1,-0.2 0.921 116.4 32.9 -68.0 -47.4 -12.2 5.2 -23.3 233 274 A M H < S+ 0 0 43 -4,-1.4 -2,-0.2 1,-0.1 -3,-0.1 0.924 136.2 18.9 -76.0 -51.7 -14.2 8.5 -23.0 234 275 A F H < 0 0 47 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.1 0.634 360.0 360.0-101.1 -17.9 -15.8 8.8 -26.5 235 276 A G < 0 0 94 -4,-0.8 -4,-0.2 -5,-0.4 -3,-0.1 0.779 360.0 360.0 65.9 360.0 -15.6 5.3 -28.0 236 ! 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 0.0 237 307 A P 0 0 185 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 125.9 2.0 11.4 -13.4 238 308 A M - 0 0 82 1,-0.1 2,-0.1 2,-0.0 0, 0.0 -0.526 360.0-136.0 -72.5 125.9 3.2 15.0 -13.9 239 309 A A >> - 0 0 35 -2,-0.3 4,-1.8 1,-0.1 3,-1.0 -0.482 32.5-102.7 -76.3 149.6 4.2 17.1 -10.9 240 310 A I H 3> S+ 0 0 87 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.820 122.0 52.6 -43.8 -41.3 2.9 20.8 -10.8 241 311 A F H 3> S+ 0 0 147 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.881 108.5 49.6 -66.5 -37.7 6.3 22.2 -11.9 242 312 A E H <> S+ 0 0 89 -3,-1.0 4,-2.2 2,-0.2 -1,-0.2 0.860 111.3 50.9 -66.5 -36.9 6.4 19.9 -15.0 243 313 A L H X S+ 0 0 20 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.910 109.4 48.5 -64.5 -50.0 2.9 21.0 -15.9 244 314 A L H X S+ 0 0 34 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.904 113.1 48.7 -63.6 -35.5 3.7 24.7 -15.6 245 315 A D H X S+ 0 0 98 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.923 109.9 52.3 -68.0 -39.2 6.7 24.1 -17.8 246 316 A Y H X S+ 0 0 57 -4,-2.2 4,-3.0 1,-0.2 -2,-0.2 0.918 108.0 51.5 -60.6 -47.4 4.5 22.1 -20.3 247 317 A I H < S+ 0 0 5 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.905 115.6 41.1 -55.6 -48.7 2.0 25.1 -20.5 248 318 A V H < S+ 0 0 29 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.888 125.8 33.9 -69.0 -39.9 4.8 27.6 -21.3 249 319 A N H < S+ 0 0 93 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.720 106.5 61.9 -94.0 -24.8 6.7 25.3 -23.7 250 320 A E S < S- 0 0 89 -4,-3.0 0, 0.0 -5,-0.2 0, 0.0 -0.604 90.8 -83.0-105.5 162.7 4.2 23.1 -25.6 251 321 A P - 0 0 96 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.198 60.9 -95.6 -57.7 150.6 1.3 23.8 -28.1 252 322 A P - 0 0 46 0, 0.0 20,-0.1 0, 0.0 21,-0.0 -0.337 44.7 -95.8 -68.2 156.5 -1.9 24.6 -26.2 253 323 A P - 0 0 15 0, 0.0 2,-0.3 0, 0.0 -31,-0.1 -0.189 43.3-168.0 -65.2 164.4 -4.5 21.9 -25.6 254 324 A K - 0 0 146 -33,-0.2 3,-0.1 -41,-0.0 11,-0.1 -0.980 26.4 -95.2-148.6 160.9 -7.4 21.3 -27.9 255 325 A L - 0 0 4 -2,-0.3 2,-0.1 10,-0.2 -42,-0.0 -0.486 48.7-102.5 -71.6 146.5 -10.7 19.5 -28.1 256 326 A P >> - 0 0 20 0, 0.0 4,-0.6 0, 0.0 3,-0.6 -0.396 42.2-116.1 -65.1 147.3 -10.6 16.1 -29.8 257 327 A S T 34 S+ 0 0 91 1,-0.2 4,-0.1 2,-0.1 5,-0.0 -0.404 90.5 30.8 -83.7 161.2 -12.1 16.3 -33.4 258 328 A G T 34 S+ 0 0 81 2,-0.4 -1,-0.2 1,-0.1 3,-0.1 0.693 110.8 67.3 65.0 24.9 -15.2 14.5 -34.6 259 329 A V T <4 S+ 0 0 66 -3,-0.6 2,-0.3 1,-0.4 -2,-0.1 0.412 99.0 45.1-134.9 -36.4 -16.9 14.7 -31.1 260 330 A F S < S- 0 0 23 -4,-0.6 -1,-0.4 1,-0.1 -2,-0.4 -0.809 92.3 -98.0-114.9 156.0 -17.4 18.5 -30.8 261 331 A S > - 0 0 34 -2,-0.3 4,-2.5 1,-0.1 5,-0.1 -0.324 30.7-120.2 -69.9 159.2 -18.8 21.0 -33.3 262 332 A L H > S+ 0 0 136 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.846 115.0 58.9 -69.0 -28.7 -16.2 23.0 -35.2 263 333 A E H > S+ 0 0 82 2,-0.2 4,-2.1 1,-0.2 27,-0.3 0.903 108.6 43.9 -64.8 -42.4 -17.7 26.2 -33.7 264 334 A F H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.952 114.9 49.2 -68.1 -45.1 -16.9 24.9 -30.2 265 335 A Q H X S+ 0 0 28 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.927 113.5 46.1 -58.4 -44.2 -13.5 23.7 -31.3 266 336 A D H X S+ 0 0 62 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.889 109.9 55.1 -67.8 -38.3 -12.7 27.1 -32.9 267 337 A F H X S+ 0 0 0 -4,-2.1 4,-1.0 -5,-0.2 -1,-0.2 0.944 112.2 41.3 -58.6 -53.7 -14.1 29.0 -29.9 268 338 A V H >X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 3,-0.6 0.898 112.4 56.2 -63.7 -39.7 -11.7 27.2 -27.4 269 339 A N H 3X S+ 0 0 70 -4,-2.5 4,-0.5 1,-0.3 -1,-0.2 0.856 106.3 50.9 -58.8 -39.4 -8.8 27.5 -29.9 270 340 A K H 3< S+ 0 0 83 -4,-2.2 10,-2.3 1,-0.2 -1,-0.3 0.742 111.9 46.9 -71.0 -24.9 -9.2 31.3 -30.0 271 341 A C H << S+ 0 0 0 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.732 113.2 51.0 -80.2 -31.8 -9.2 31.4 -26.2 272 342 A L H < + 0 0 1 -4,-1.7 -2,-0.2 -5,-0.1 -1,-0.1 0.392 69.6 130.1 -94.8 7.8 -6.1 29.1 -26.1 273 343 A I < - 0 0 56 -4,-0.5 6,-0.2 -3,-0.2 -67,-0.0 -0.423 57.0-139.2 -58.9 122.3 -3.7 31.0 -28.5 274 344 A K S S+ 0 0 55 -2,-0.1 -82,-0.3 4,-0.1 -1,-0.1 0.872 86.4 75.9 -55.2 -41.8 -0.4 31.2 -26.5 275 345 A N S > S- 0 0 68 1,-0.1 4,-2.0 -84,-0.1 3,-0.5 -0.630 74.2-152.3 -74.7 114.2 0.3 34.8 -27.7 276 346 A P T 4 S+ 0 0 13 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.726 94.2 57.6 -60.5 -25.7 -2.1 37.1 -25.7 277 347 A A T 4 S+ 0 0 85 1,-0.2 4,-0.1 4,-0.0 -2,-0.0 0.903 112.5 39.4 -70.4 -41.2 -2.1 39.7 -28.6 278 348 A E T 4 S+ 0 0 136 -3,-0.5 -1,-0.2 2,-0.1 3,-0.1 0.785 97.2 101.4 -79.1 -24.5 -3.4 37.0 -31.1 279 349 A R S < S- 0 0 2 -4,-2.0 -8,-0.2 -6,-0.2 -9,-0.1 -0.276 86.5 -97.8 -59.3 141.1 -5.8 35.5 -28.4 280 350 A A - 0 0 6 -10,-2.3 2,-0.2 -13,-0.1 -1,-0.1 -0.220 36.1-138.6 -62.1 149.2 -9.4 36.6 -28.8 281 351 A D > - 0 0 54 -3,-0.1 4,-2.7 -4,-0.1 3,-0.4 -0.569 28.9 -98.3-103.0 169.7 -10.7 39.4 -26.6 282 352 A L H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.865 122.5 53.6 -56.3 -42.7 -14.0 39.6 -24.8 283 353 A K H > S+ 0 0 142 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.838 112.5 43.8 -60.9 -40.7 -15.6 41.8 -27.5 284 354 A Q H >4 S+ 0 0 111 -3,-0.4 3,-1.0 2,-0.2 4,-0.4 0.920 112.5 52.4 -74.9 -41.8 -14.7 39.2 -30.2 285 355 A L H >< S+ 0 0 0 -4,-2.7 3,-1.7 1,-0.2 6,-0.3 0.910 101.3 61.4 -60.0 -40.5 -15.8 36.2 -28.0 286 356 A M H 3< S+ 0 0 23 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.736 113.3 36.3 -58.1 -27.0 -19.2 37.9 -27.5 287 357 A V T << S+ 0 0 88 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.290 86.9 128.3-108.6 5.9 -19.8 37.7 -31.3 288 358 A H S X> S- 0 0 19 -3,-1.7 4,-2.2 -4,-0.4 3,-0.9 -0.350 72.5-114.4 -63.2 141.9 -18.0 34.3 -32.0 289 359 A A H 3> S+ 0 0 42 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.800 116.9 56.6 -44.6 -39.0 -20.2 31.8 -33.9 290 360 A F H 3> S+ 0 0 0 -27,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.885 109.1 44.9 -65.1 -38.8 -20.3 29.5 -30.9 291 361 A I H <> S+ 0 0 2 -3,-0.9 4,-3.1 -6,-0.3 -2,-0.2 0.941 113.5 48.6 -71.6 -44.2 -21.7 32.3 -28.6 292 362 A K H X S+ 0 0 127 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.915 115.9 44.9 -63.2 -43.7 -24.3 33.4 -31.2 293 363 A R H X S+ 0 0 60 -4,-2.5 4,-0.9 -5,-0.2 -2,-0.2 0.955 115.8 46.0 -63.8 -50.9 -25.4 29.7 -31.7 294 364 A S H >< S+ 0 0 0 -4,-2.8 3,-0.5 1,-0.2 -2,-0.2 0.878 111.0 54.0 -59.2 -39.9 -25.4 29.0 -27.9 295 365 A D H 3< S+ 0 0 89 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.913 110.5 45.4 -62.4 -42.4 -27.3 32.3 -27.2 296 366 A A H 3< S+ 0 0 72 -4,-1.9 -1,-0.2 -5,-0.2 2,-0.2 0.588 94.6 100.0 -75.8 -15.2 -30.1 31.3 -29.7 297 367 A E S << S- 0 0 31 -4,-0.9 2,-1.0 -3,-0.5 -3,-0.0 -0.529 70.8-139.8 -75.3 140.3 -30.3 27.7 -28.3 298 368 A E + 0 0 186 -2,-0.2 2,-0.5 2,-0.1 -2,-0.1 -0.901 35.2 175.5-100.6 99.9 -33.1 27.0 -25.8 299 369 A V - 0 0 30 -2,-1.0 2,-1.8 -5,-0.1 3,-0.2 -0.969 33.5-139.9-115.0 124.1 -31.2 24.9 -23.4 300 370 A D > + 0 0 119 -2,-0.5 4,-2.6 1,-0.2 5,-0.2 -0.590 34.8 163.2 -83.4 83.0 -32.7 23.6 -20.2 301 371 A F H > S+ 0 0 9 -2,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.914 75.2 48.8 -65.6 -46.5 -29.6 24.1 -18.0 302 372 A A H > S+ 0 0 21 -3,-0.2 4,-2.9 2,-0.2 5,-0.2 0.932 113.3 48.6 -60.3 -43.3 -31.6 23.9 -14.7 303 373 A G H > S+ 0 0 28 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.933 114.0 44.8 -59.2 -52.1 -33.2 20.6 -16.0 304 374 A W H X S+ 0 0 52 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.893 116.1 49.2 -59.7 -43.0 -29.8 19.1 -17.1 305 375 A L H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 5,-0.2 0.927 109.8 46.4 -65.8 -51.1 -28.3 20.2 -13.8 306 376 A C H X>S+ 0 0 31 -4,-2.9 5,-2.1 1,-0.2 4,-1.1 0.890 115.5 48.0 -62.2 -37.6 -30.9 18.9 -11.3 307 377 A S H <5S+ 0 0 104 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.880 114.4 47.3 -65.5 -43.9 -31.0 15.5 -13.2 308 378 A T H <5S+ 0 0 38 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.838 121.7 31.7 -69.0 -43.6 -27.1 15.3 -13.2 309 379 A I H <5S- 0 0 33 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.486 108.5-116.3 -98.3 -1.3 -26.4 16.2 -9.6 310 380 A G T <5 0 0 67 -4,-1.1 -3,-0.2 -5,-0.2 -4,-0.1 0.896 360.0 360.0 68.7 45.3 -29.6 14.6 -8.2 311 381 A L < 0 0 94 -5,-2.1 -1,-0.2 -6,-0.2 -2,-0.1 -0.789 360.0 360.0 -91.2 360.0 -31.0 17.9 -6.9