==== 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 30-SEP-08 3EQG . COMPND 2 MOLECULE: DUAL SPECIFICITY MITOGEN-ACTIVATED PROTEIN KINASE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.O.FISCHMANN . 312 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15376.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 214 68.6 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 12.2 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 . 1 0.3 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 . 28 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 106 34.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 0 2 2 1 3 0 0 0 0 1 0 1 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 2 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 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 0 102 0, 0.0 136,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -0.9 11.4 65.1 12.7 2 40 A L + 0 0 52 138,-0.1 2,-0.2 2,-0.1 135,-0.0 0.175 360.0 127.3-100.9 17.0 11.8 64.8 16.5 3 41 A E - 0 0 159 1,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.467 54.5-133.5 -75.1 144.8 14.2 67.8 16.6 4 42 A L - 0 0 66 -2,-0.2 2,-0.1 1,-0.1 -2,-0.1 -0.677 12.0-134.4 -95.1 151.6 13.5 70.7 19.0 5 43 A D > - 0 0 78 -2,-0.3 4,-1.5 1,-0.0 5,-0.1 -0.203 38.4 -92.7 -86.2-173.2 13.7 74.3 17.9 6 44 A E H > S+ 0 0 174 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.872 125.1 53.0 -73.0 -38.6 15.6 76.8 20.1 7 45 A Q H > S+ 0 0 110 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.729 112.0 49.1 -69.1 -20.4 12.5 78.0 22.0 8 46 A Q H > S+ 0 0 33 2,-0.2 4,-2.1 3,-0.1 -1,-0.2 0.858 107.5 49.8 -86.4 -42.7 11.7 74.3 22.8 9 47 A R H X S+ 0 0 165 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.861 111.5 52.3 -63.8 -36.0 15.1 73.2 24.1 10 48 A K H X S+ 0 0 147 -4,-1.6 4,-2.7 2,-0.2 3,-0.2 0.930 108.5 48.1 -65.7 -47.0 15.1 76.2 26.4 11 49 A R H X S+ 0 0 39 -4,-1.1 4,-2.5 1,-0.2 -2,-0.2 0.903 112.1 51.8 -61.5 -36.0 11.7 75.4 27.8 12 50 A L H X S+ 0 0 29 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.804 110.4 46.7 -67.7 -33.8 13.0 71.8 28.3 13 51 A E H X S+ 0 0 92 -4,-1.7 4,-2.3 -3,-0.2 5,-0.2 0.909 111.0 53.6 -73.9 -45.2 16.2 73.0 30.2 14 52 A A H X S+ 0 0 53 -4,-2.7 4,-1.9 1,-0.2 5,-0.2 0.968 108.5 48.7 -51.7 -58.1 14.1 75.3 32.3 15 53 A F H X S+ 0 0 25 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.880 112.5 47.0 -48.7 -52.4 11.8 72.5 33.4 16 54 A L H X S+ 0 0 64 -4,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.856 109.2 54.0 -59.7 -41.9 14.6 70.1 34.3 17 55 A T H X S+ 0 0 72 -4,-2.3 4,-0.7 2,-0.2 -1,-0.2 0.826 110.8 46.5 -61.9 -35.7 16.4 72.8 36.2 18 56 A Q H >< S+ 0 0 100 -4,-1.9 3,-0.6 -5,-0.2 4,-0.3 0.886 114.3 48.9 -73.8 -39.9 13.2 73.4 38.3 19 57 A K H >< S+ 0 0 27 -4,-2.3 3,-2.0 -5,-0.2 -2,-0.2 0.856 97.6 68.5 -65.9 -39.1 12.8 69.7 38.7 20 58 A Q H 3< S+ 0 0 162 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.825 97.9 53.9 -49.5 -36.5 16.4 69.3 39.8 21 59 A K T << S+ 0 0 161 -4,-0.7 2,-0.7 -3,-0.6 -1,-0.3 0.592 84.3 98.0 -76.1 -16.0 15.5 71.2 43.0 22 60 A V < - 0 0 19 -3,-2.0 3,-0.1 -4,-0.3 -3,-0.0 -0.663 58.0-166.2 -82.4 114.1 12.6 68.9 44.0 23 61 A G - 0 0 61 -2,-0.7 2,-0.3 1,-0.3 -1,-0.1 0.489 53.0 -33.5 -70.0-138.6 13.8 66.4 46.5 24 62 A E S S- 0 0 153 1,-0.0 2,-0.4 69,-0.0 -1,-0.3 -0.618 70.7-121.1 -83.3 140.7 11.8 63.3 47.4 25 63 A L + 0 0 16 -2,-0.3 2,-0.3 -3,-0.1 69,-0.1 -0.751 34.8 179.2 -90.3 136.7 8.1 64.1 47.2 26 64 A K > - 0 0 113 -2,-0.4 3,-2.3 1,-0.1 4,-0.4 -0.992 39.0-113.8-135.0 147.1 6.0 63.5 50.4 27 65 A D G > S+ 0 0 44 -2,-0.3 3,-1.8 1,-0.3 -1,-0.1 0.845 112.3 56.1 -40.1 -53.5 2.3 64.0 51.3 28 66 A D G 3 S+ 0 0 134 1,-0.3 -1,-0.3 -3,-0.1 22,-0.1 0.592 92.7 67.1 -65.1 -12.2 2.9 66.8 53.7 29 67 A D G < S+ 0 0 25 -3,-2.3 21,-3.8 20,-0.1 2,-0.3 0.563 91.3 84.6 -84.9 -5.0 4.8 69.1 51.2 30 68 A F E < -A 49 0A 18 -3,-1.8 2,-0.4 -4,-0.4 19,-0.2 -0.759 54.0-172.6-102.8 146.1 1.6 69.5 49.3 31 69 A E E -A 48 0A 101 17,-1.6 17,-1.7 -2,-0.3 -3,-0.0 -0.977 30.2-119.2-138.1 117.9 -1.3 72.0 49.8 32 70 A K E +A 47 0A 135 -2,-0.4 15,-0.2 15,-0.2 3,-0.1 -0.140 32.4 172.7 -50.2 144.9 -4.5 71.7 47.8 33 71 A I E - 0 0 72 13,-2.0 2,-0.2 1,-0.6 14,-0.2 0.394 64.8 -29.6-130.6 -17.5 -5.1 74.9 45.7 34 72 A S E -A 46 0A 45 12,-1.1 12,-1.7 0, 0.0 -1,-0.6 -0.891 62.4 -98.6 170.2 161.7 -8.1 73.7 43.7 35 73 A E E -A 45 0A 101 -2,-0.2 10,-0.3 10,-0.2 3,-0.1 -0.909 27.2-174.6-104.7 125.3 -9.7 70.6 42.2 36 74 A L E - 0 0 65 8,-3.1 2,-0.3 -2,-0.5 9,-0.2 0.715 59.4 -48.5 -89.6 -27.7 -8.9 70.1 38.5 37 75 A G E -A 44 0A 29 7,-1.4 7,-2.2 2,-0.0 -1,-0.3 -0.943 43.8-118.9 170.2 169.7 -11.1 67.1 37.9 38 76 A A E -A 43 0A 84 -2,-0.3 2,-0.3 5,-0.2 5,-0.3 -0.914 22.9-169.6-128.2 156.7 -12.3 63.6 38.9 39 77 A G E > -A 42 0A 51 3,-3.3 2,-3.1 -2,-0.3 3,-0.8 -0.928 43.7 -89.9-141.5 165.3 -12.1 60.3 37.1 40 78 A N T 3 S+ 0 0 127 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 -0.339 127.0 21.2 -73.7 60.4 -13.5 56.8 37.4 41 79 A G T 3 S+ 0 0 15 -2,-3.1 2,-0.3 1,-0.3 -1,-0.2 0.201 127.8 2.6 163.8 -18.1 -10.4 55.8 39.5 42 80 A G E < -A 39 0A 17 -3,-0.8 -3,-3.3 19,-0.2 -1,-0.3 -0.990 56.1-115.7-172.8 178.0 -9.0 59.1 40.9 43 81 A V E -AB 38 60A 42 17,-2.0 17,-2.9 -2,-0.3 2,-0.4 -0.786 19.0-145.0-124.3 168.0 -9.0 62.8 41.4 44 82 A V E -AB 37 59A 37 -7,-2.2 -8,-3.1 -2,-0.3 -7,-1.4 -0.993 13.3-170.0-141.5 132.3 -6.6 65.6 40.3 45 83 A F E -AB 35 58A 27 13,-2.2 13,-3.1 -2,-0.4 2,-0.6 -0.895 28.1-131.0-124.4 152.0 -5.6 68.8 42.1 46 84 A K E +AB 34 57A 70 -12,-1.7 -13,-2.0 -2,-0.3 -12,-1.1 -0.878 51.1 171.0 -91.8 122.4 -3.7 72.0 41.3 47 85 A V E -AB 32 56A 4 9,-2.5 9,-2.1 -2,-0.6 2,-0.5 -0.845 36.2-127.4-134.8 168.0 -1.4 72.0 44.3 48 86 A S E -AB 31 55A 23 -17,-1.7 -17,-1.6 -2,-0.3 2,-0.9 -0.994 15.5-141.9-122.5 121.2 1.6 73.9 45.7 49 87 A H E >> -AB 30 54A 6 5,-3.7 4,-2.5 -2,-0.5 5,-0.9 -0.843 23.0-148.1 -83.1 106.1 4.6 71.8 46.7 50 88 A K T 45S+ 0 0 113 -21,-3.8 -1,-0.2 -2,-0.9 -20,-0.1 0.835 84.6 48.9 -46.6 -53.5 5.4 74.0 49.8 51 89 A P T 45S+ 0 0 90 0, 0.0 -1,-0.2 0, 0.0 -29,-0.0 0.976 123.4 29.5 -53.9 -65.2 9.3 73.7 49.9 52 90 A S T 45S- 0 0 50 2,-0.1 -2,-0.2 -23,-0.1 3,-0.1 0.719 99.1-131.2 -67.7 -27.6 10.0 74.4 46.2 53 91 A G T <5 + 0 0 50 -4,-2.5 2,-0.4 1,-0.3 -3,-0.2 0.655 54.4 155.2 78.5 16.8 7.0 76.6 45.8 54 92 A L E < -B 49 0A 19 -5,-0.9 -5,-3.7 -36,-0.1 2,-0.3 -0.636 40.9-139.8 -81.2 133.9 6.2 74.6 42.7 55 93 A V E +B 48 0A 63 -2,-0.4 52,-0.4 -7,-0.2 2,-0.3 -0.690 35.8 161.6 -83.5 140.8 2.6 74.4 41.4 56 94 A M E -B 47 0A 0 -9,-2.1 -9,-2.5 -2,-0.3 2,-0.5 -0.895 42.7-107.2-148.2 176.9 1.8 70.9 40.1 57 95 A A E -BC 46 105A 6 48,-2.0 48,-2.1 -2,-0.3 2,-0.7 -0.950 31.0-154.8-110.0 129.4 -1.1 68.6 39.3 58 96 A R E -BC 45 104A 17 -13,-3.1 -13,-2.2 -2,-0.5 2,-0.6 -0.931 4.9-164.2-110.5 112.9 -1.6 65.9 41.9 59 97 A K E -BC 44 103A 38 44,-3.0 44,-2.1 -2,-0.7 2,-0.6 -0.846 3.7-166.7 -94.3 124.6 -3.3 62.9 40.6 60 98 A L E -BC 43 102A 23 -17,-2.9 -17,-2.0 -2,-0.6 2,-1.2 -0.931 3.7-166.5-116.3 104.5 -4.5 60.7 43.4 61 99 A I E - C 0 101A 8 40,-2.6 2,-3.6 -2,-0.6 40,-1.6 -0.747 8.9-157.1 -90.4 88.8 -5.5 57.3 42.2 62 100 A H + 0 0 102 -2,-1.2 2,-0.4 38,-0.2 38,-0.1 -0.157 42.0 139.3 -66.8 55.3 -7.4 56.0 45.2 63 101 A L - 0 0 33 -2,-3.6 2,-0.5 38,-0.1 38,-0.2 -0.803 45.9-136.6 -97.6 138.8 -6.8 52.3 44.3 64 102 A E + 0 0 106 -2,-0.4 2,-0.3 36,-0.1 36,-0.1 -0.867 39.0 138.2-106.5 124.8 -6.0 49.9 47.1 65 103 A I - 0 0 30 -2,-0.5 5,-0.1 34,-0.0 34,-0.1 -0.964 56.7 -82.1-155.8 149.4 -3.3 47.3 46.9 66 104 A K >> - 0 0 127 -2,-0.3 4,-2.1 1,-0.1 3,-0.8 -0.132 40.9-110.3 -54.8 149.6 -0.7 46.1 49.4 67 105 A P H 3> S+ 0 0 64 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.846 123.5 63.3 -49.9 -30.7 2.5 48.0 49.7 68 106 A A H 34 S+ 0 0 77 2,-0.2 3,-0.3 1,-0.1 4,-0.1 0.961 110.6 35.1 -58.2 -51.3 3.9 44.9 48.1 69 107 A I H X> S+ 0 0 49 -3,-0.8 3,-2.6 1,-0.2 4,-0.7 0.968 113.3 53.9 -65.7 -61.6 1.8 45.6 44.9 70 108 A R H 3X S+ 0 0 54 -4,-2.1 4,-1.6 1,-0.3 -1,-0.2 0.575 95.7 71.2 -53.7 -14.8 1.8 49.4 44.7 71 109 A N H 3< S+ 0 0 82 -4,-1.0 4,-0.3 -3,-0.3 -1,-0.3 0.582 93.7 54.7 -82.9 -7.9 5.6 49.4 44.8 72 110 A Q H <> S+ 0 0 56 -3,-2.6 4,-2.0 2,-0.2 5,-0.2 0.789 105.7 50.7 -91.3 -30.7 5.8 48.0 41.3 73 111 A I H X S+ 0 0 0 -4,-0.7 4,-2.3 1,-0.2 3,-0.4 0.987 110.0 50.0 -64.4 -55.2 3.7 50.7 39.8 74 112 A I H < S+ 0 0 24 -4,-1.6 4,-0.5 1,-0.2 -1,-0.2 0.768 109.7 55.8 -53.0 -27.3 5.9 53.3 41.5 75 113 A R H >4 S+ 0 0 158 -4,-0.3 3,-0.6 2,-0.2 -1,-0.2 0.919 110.7 38.6 -73.5 -50.6 8.8 51.5 40.0 76 114 A E H >< S+ 0 0 40 -4,-2.0 3,-1.2 -3,-0.4 -2,-0.2 0.750 108.6 65.1 -73.7 -23.3 7.8 51.5 36.3 77 115 A L G >< S+ 0 0 3 -4,-2.3 3,-2.4 1,-0.3 -1,-0.2 0.697 84.1 74.6 -67.8 -24.3 6.5 55.1 36.8 78 116 A Q G X S+ 0 0 72 -3,-0.6 3,-1.5 -4,-0.5 -1,-0.3 0.660 78.5 76.2 -64.1 -15.9 10.1 56.2 37.5 79 117 A V G X S+ 0 0 42 -3,-1.2 3,-1.7 1,-0.3 -1,-0.3 0.719 77.7 74.1 -65.2 -22.4 10.4 55.7 33.7 80 118 A L G X S+ 0 0 21 -3,-2.4 3,-0.9 1,-0.3 11,-0.3 0.715 81.3 67.6 -67.9 -16.5 8.6 59.1 33.5 81 119 A H G < S+ 0 0 71 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.672 100.8 52.0 -74.7 -13.0 11.8 60.8 34.6 82 120 A E G < S+ 0 0 111 -3,-1.7 2,-1.3 -4,-0.2 -1,-0.2 0.511 85.1 92.8 -96.0 -10.3 13.0 59.7 31.2 83 121 A C < + 0 0 8 -3,-0.9 2,-0.7 -4,-0.3 8,-0.2 -0.643 48.5 161.1 -91.3 82.2 10.1 61.1 29.1 84 122 A N + 0 0 63 -2,-1.3 5,-0.1 6,-0.1 -72,-0.0 -0.872 16.4 123.9-110.5 105.1 11.4 64.5 28.0 85 123 A S > - 0 0 11 -2,-0.7 3,-1.1 3,-0.4 53,-0.0 -0.974 65.9-119.3-152.0 155.5 9.6 66.1 25.1 86 124 A P T 3 S+ 0 0 11 0, 0.0 80,-0.3 0, 0.0 52,-0.1 0.499 115.6 53.8 -73.3 -7.1 7.6 69.3 24.3 87 125 A Y T 3 S+ 0 0 27 50,-0.1 81,-2.4 80,-0.1 2,-0.4 0.154 96.4 76.2-115.0 12.5 4.6 67.1 23.6 88 126 A I B < S-e 168 0B 4 -3,-1.1 -3,-0.4 79,-0.3 81,-0.2 -0.994 87.0-111.9-131.6 128.9 4.6 65.1 26.8 89 127 A V - 0 0 10 79,-2.4 -6,-0.1 -2,-0.4 -2,-0.1 -0.320 43.5-107.9 -57.5 127.5 3.3 66.5 30.1 90 128 A G - 0 0 9 15,-0.1 16,-3.6 -4,-0.1 2,-0.4 -0.293 30.5-143.2 -63.0 144.3 6.3 66.9 32.5 91 129 A F E +D 105 0A 9 -11,-0.3 14,-0.2 14,-0.3 3,-0.1 -0.871 22.7 177.5-114.3 137.7 6.6 64.5 35.5 92 130 A Y E - 0 0 16 12,-2.7 2,-0.3 1,-0.4 13,-0.2 0.762 58.4 -75.0-107.4 -37.1 7.8 65.3 39.0 93 131 A G E -D 104 0A 6 11,-1.4 11,-3.1 -69,-0.1 -1,-0.4 -0.904 33.0-114.8 158.0 173.4 7.4 61.9 40.7 94 132 A A E +D 103 0A 13 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.998 29.0 166.5-140.6 138.6 5.1 59.3 42.2 95 133 A F E -D 102 0A 24 7,-1.4 7,-2.9 -2,-0.3 2,-0.3 -0.953 29.5-118.7-146.0 164.1 4.7 58.0 45.8 96 134 A Y E +D 101 0A 38 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.799 41.4 141.6-107.3 149.7 2.2 56.0 47.9 97 135 A S + 0 0 25 3,-1.1 3,-0.3 -2,-0.3 -2,-0.1 -0.599 61.6 15.4 172.8 123.1 0.4 57.3 51.0 98 136 A D S S- 0 0 110 1,-0.2 3,-0.1 -2,-0.2 -2,-0.0 0.742 126.0 -62.8 77.9 25.3 -3.0 57.0 52.5 99 137 A G S S+ 0 0 10 1,-0.2 2,-0.4 -34,-0.1 -1,-0.2 0.705 117.8 99.5 73.6 21.3 -3.9 53.9 50.4 100 138 A E S S- 0 0 25 -3,-0.3 -3,-1.1 -38,-0.1 2,-0.3 -0.997 70.3-126.8-143.4 137.5 -3.6 56.0 47.2 101 139 A I E -CD 61 96A 6 -40,-1.6 -40,-2.6 -2,-0.4 2,-0.4 -0.615 22.4-152.6 -83.1 138.1 -0.9 56.5 44.6 102 140 A S E -CD 60 95A 1 -7,-2.9 -7,-1.4 -2,-0.3 2,-0.5 -0.938 11.2-173.7-113.2 131.8 0.1 60.1 43.9 103 141 A I E -CD 59 94A 19 -44,-2.1 -44,-3.0 -2,-0.4 2,-0.5 -0.999 11.6-163.9-123.3 119.3 1.5 61.1 40.4 104 142 A C E +CD 58 93A 0 -11,-3.1 -12,-2.7 -2,-0.5 -11,-1.4 -0.921 18.2 161.4-112.8 131.9 2.6 64.7 40.4 105 143 A M E -CD 57 91A 24 -48,-2.1 -48,-2.0 -2,-0.5 -14,-0.3 -0.858 44.4 -60.9-140.2 177.0 3.2 66.4 37.2 106 144 A E - 0 0 20 -16,-3.6 2,-0.5 -2,-0.3 -50,-0.2 -0.319 55.7-121.3 -57.3 140.4 3.6 69.7 35.3 107 145 A H - 0 0 47 -52,-0.4 2,-0.7 -60,-0.1 -1,-0.1 -0.781 18.0-152.4 -91.0 126.5 0.4 71.8 35.7 108 146 A M > - 0 0 9 -2,-0.5 3,-1.2 1,-0.1 52,-0.1 -0.896 3.8-162.7-100.5 113.1 -1.1 72.7 32.4 109 147 A D T 3 S+ 0 0 84 -2,-0.7 52,-0.2 1,-0.2 -1,-0.1 0.614 85.0 58.3 -72.2 -13.9 -3.0 76.1 32.8 110 148 A G T 3 S- 0 0 10 50,-2.0 -1,-0.2 1,-0.3 51,-0.2 0.480 99.8-144.5 -91.0 -5.0 -5.2 75.8 29.7 111 149 A G < - 0 0 19 -3,-1.2 49,-2.8 49,-0.5 -1,-0.3 -0.362 38.8 -34.2 76.1-156.4 -6.7 72.5 31.0 112 150 A S B >> -F 159 0B 12 47,-0.2 4,-2.3 -3,-0.1 3,-1.0 -0.660 51.2-115.4-102.3 153.7 -7.7 69.6 28.7 113 151 A L H 3> S+ 0 0 1 45,-2.6 4,-3.2 42,-1.1 43,-0.2 0.846 115.4 72.2 -60.8 -25.1 -9.1 69.8 25.2 114 152 A D H 3> S+ 0 0 55 41,-1.2 4,-1.6 44,-0.3 -1,-0.3 0.938 106.9 32.0 -43.7 -58.4 -12.1 68.2 26.8 115 153 A Q H <> S+ 0 0 76 -3,-1.0 4,-2.4 2,-0.2 -2,-0.2 0.821 112.3 61.2 -79.7 -33.6 -12.8 71.6 28.5 116 154 A V H X S+ 0 0 2 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.928 107.2 49.1 -58.5 -39.6 -11.5 73.7 25.8 117 155 A L H X S+ 0 0 15 -4,-3.2 4,-2.6 2,-0.2 -2,-0.2 0.926 108.2 50.5 -65.5 -50.3 -14.2 72.2 23.6 118 156 A K H < S+ 0 0 170 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.936 115.7 44.8 -53.0 -48.7 -17.0 72.7 26.1 119 157 A K H < S+ 0 0 135 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.926 120.7 38.3 -60.4 -49.2 -16.0 76.3 26.4 120 158 A A H < S- 0 0 29 -4,-3.0 2,-1.6 -5,-0.2 -2,-0.2 0.655 87.6-141.1 -84.6 -15.4 -15.5 76.9 22.6 121 159 A G S < S+ 0 0 48 -4,-2.6 2,-0.3 -5,-0.2 -1,-0.1 -0.382 82.8 6.0 85.1 -53.2 -18.4 74.9 21.1 122 160 A R S S- 0 0 111 -2,-1.6 97,-0.2 -6,-0.1 96,-0.1 -0.982 75.3-122.3-158.9 149.7 -16.1 73.8 18.3 123 161 A I - 0 0 4 95,-2.9 2,-0.1 -2,-0.3 98,-0.0 -0.762 32.7-114.6 -98.3 131.5 -12.4 74.1 17.5 124 162 A P >> - 0 0 54 0, 0.0 4,-2.3 0, 0.0 3,-1.0 -0.409 24.9-118.2 -65.9 145.3 -11.3 75.7 14.2 125 163 A E H 3> S+ 0 0 30 1,-0.3 4,-1.1 2,-0.2 94,-0.0 0.833 112.1 56.6 -52.3 -39.9 -9.6 73.4 11.7 126 164 A Q H 3> S+ 0 0 103 2,-0.2 4,-0.9 1,-0.2 -1,-0.3 0.799 108.6 48.6 -64.7 -31.9 -6.3 75.4 11.7 127 165 A I H X> S+ 0 0 8 -3,-1.0 4,-2.0 2,-0.2 3,-0.8 0.931 108.7 51.4 -71.3 -49.4 -6.1 75.0 15.5 128 166 A L H 3X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.3 -2,-0.2 0.719 100.1 68.1 -60.9 -19.2 -6.8 71.2 15.2 129 167 A G H 3X S+ 0 0 0 -4,-1.1 4,-1.9 -5,-0.2 -1,-0.3 0.923 105.0 39.4 -61.9 -50.0 -3.9 71.4 12.7 130 168 A K H S- 0 0 33 -2,-0.3 3,-2.1 59,-0.0 4,-0.2 -0.901 72.5 -87.9-175.1 162.4 -9.0 61.2 23.9 155 193 A P G > S+ 0 0 2 0, 0.0 3,-1.2 0, 0.0 -41,-1.2 0.798 122.6 58.1 -56.0 -33.2 -9.8 64.9 24.4 156 194 A S G 3 S+ 0 0 34 1,-0.2 -3,-0.1 -43,-0.2 -41,-0.0 0.588 103.3 55.0 -73.6 -7.8 -9.3 64.7 28.2 157 195 A N G < S+ 0 0 3 -3,-2.1 12,-1.8 -45,-0.1 2,-0.5 0.308 89.9 80.6-108.7 7.3 -5.8 63.5 27.7 158 196 A I E < - G 0 168B 3 -3,-1.2 -45,-2.6 10,-0.2 -44,-0.3 -0.985 66.3-169.2-115.1 119.8 -4.5 66.3 25.5 159 197 A L E -FG 112 167B 23 8,-2.7 8,-2.5 -2,-0.5 2,-0.3 -0.878 5.0-166.2-116.4 145.2 -3.6 69.3 27.7 160 198 A V E - G 0 166B 0 -49,-2.8 -50,-2.0 -2,-0.3 -49,-0.5 -0.818 2.0-155.6-128.9 165.6 -2.8 72.8 26.6 161 199 A N > - 0 0 7 4,-1.1 3,-2.9 -2,-0.3 4,-0.5 -0.966 36.9-102.1-146.4 156.1 -1.2 75.9 28.2 162 200 A S T 3 S+ 0 0 56 -2,-0.3 147,-0.1 1,-0.3 146,-0.0 0.613 116.7 68.0 -53.3 -11.9 -1.1 79.7 28.0 163 201 A R T 3 S- 0 0 116 2,-0.1 -1,-0.3 141,-0.0 142,-0.2 0.353 120.6-107.4 -87.8 9.9 2.3 79.3 26.3 164 202 A G S < S+ 0 0 23 -3,-2.9 2,-0.3 1,-0.2 -2,-0.2 0.681 71.0 150.0 73.7 20.3 0.5 77.7 23.3 165 203 A E - 0 0 20 -4,-0.5 -4,-1.1 139,-0.1 2,-0.5 -0.648 33.6-161.1 -90.6 142.3 1.8 74.2 24.2 166 204 A I E + G 0 160B 16 -2,-0.3 2,-0.3 -80,-0.3 -6,-0.2 -0.980 20.6 167.3-125.2 116.7 0.0 70.9 23.5 167 205 A K E - G 0 159B 11 -8,-2.5 -8,-2.7 -2,-0.5 2,-0.3 -0.933 28.0-127.7-129.7 154.6 1.1 67.8 25.5 168 206 A L E +eG 88 158B 2 -81,-2.4 -79,-2.4 -2,-0.3 2,-0.3 -0.724 26.7 173.9-101.4 146.5 -0.1 64.2 26.1 169 207 A C + 0 0 10 -12,-1.8 -79,-0.0 -2,-0.3 -12,-0.0 -0.797 52.3 49.3-138.2 179.2 -0.6 62.7 29.5 170 208 A D + 0 0 67 -2,-0.3 2,-0.1 1,-0.2 -1,-0.1 0.679 68.5 157.7 59.3 28.5 -2.1 59.4 30.9 171 209 A F - 0 0 20 -3,-0.1 2,-2.4 1,-0.1 3,-0.3 -0.446 55.7 -96.7 -81.5 153.6 -0.1 57.1 28.5 172 210 A G + 0 0 12 -22,-3.5 -23,-0.2 -23,-0.4 3,-0.1 -0.316 67.2 140.7 -71.7 64.1 0.5 53.4 29.4 173 211 A V + 0 0 29 -2,-2.4 2,-0.7 1,-0.2 -1,-0.2 0.874 67.8 47.9 -73.2 -37.4 4.0 53.6 30.9 174 212 A S > - 0 0 3 -3,-0.3 4,-2.1 1,-0.2 3,-0.3 -0.904 62.1-169.6-111.0 108.9 3.3 51.1 33.7 175 213 A G H > S+ 0 0 39 -2,-0.7 4,-2.6 1,-0.2 5,-0.2 0.844 91.7 56.6 -62.5 -33.2 1.6 47.9 32.6 176 214 A Q H > S+ 0 0 54 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.836 105.3 48.4 -68.6 -35.0 1.1 47.1 36.3 177 215 A L H > S+ 0 0 20 -3,-0.3 4,-0.7 2,-0.2 5,-0.5 0.905 109.8 57.3 -70.5 -35.3 -0.8 50.3 36.9 178 216 A I H >X S+ 0 0 56 -4,-2.1 4,-3.5 3,-0.2 3,-0.7 0.971 117.5 29.6 -53.8 -61.7 -2.7 49.3 33.7 179 217 A D H 3< S+ 0 0 76 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.899 115.8 57.9 -68.3 -45.5 -3.8 45.9 35.2 180 218 A S H 3< S+ 0 0 21 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.616 126.8 22.8 -60.5 -10.1 -3.9 47.0 38.8 181 219 A M H << S+ 0 0 52 -3,-0.7 2,-4.8 -4,-0.7 -2,-0.2 0.701 109.3 67.3-117.5 -66.0 -6.4 49.6 37.6 182 220 A A S < S+ 0 0 62 -4,-3.5 -1,-0.1 -5,-0.5 4,-0.1 -0.274 100.4 63.4 -60.4 61.6 -8.0 48.5 34.4 183 221 A N S S+ 0 0 127 -2,-4.8 2,-1.4 2,-0.3 -1,-0.2 0.032 112.6 17.8-145.3 -90.5 -9.6 45.8 36.5 184 222 A S S S+ 0 0 108 -4,-0.2 2,-0.2 1,-0.1 -2,-0.1 -0.361 127.0 59.9 -89.0 54.0 -11.9 47.1 39.2 185 223 A F - 0 0 64 -2,-1.4 2,-0.3 -122,-0.0 -2,-0.3 -0.611 65.8-160.7 178.9 114.6 -12.1 50.4 37.3 186 224 A V - 0 0 93 -2,-0.2 2,-0.4 -4,-0.1 -146,-0.1 -0.769 0.6-164.3-104.4 152.4 -13.2 51.3 33.8 187 225 A G - 0 0 44 -2,-0.3 -2,-0.0 -148,-0.1 -148,-0.0 -0.967 51.0 -74.4-137.5 114.1 -12.3 54.4 31.9 188 226 A T - 0 0 61 -2,-0.4 3,-0.3 1,-0.2 -1,-0.0 0.424 35.9-166.5 -13.2 123.2 -14.4 55.1 28.8 189 227 A R > + 0 0 93 1,-0.2 3,-1.7 2,-0.1 -1,-0.2 0.114 59.4 111.6-101.0 15.4 -13.8 52.9 25.8 190 228 A S T 3 S+ 0 0 14 1,-0.3 -1,-0.2 60,-0.0 -2,-0.1 0.573 79.7 44.3 -71.2 -7.7 -15.8 55.3 23.6 191 229 A Y T 3 S+ 0 0 30 -3,-0.3 -1,-0.3 2,-0.1 2,-0.3 0.107 88.4 120.9-118.1 16.3 -12.6 56.4 21.7 192 230 A M < - 0 0 15 -3,-1.7 15,-0.1 1,-0.1 -3,-0.1 -0.581 67.9-109.6 -83.4 143.7 -11.2 52.8 21.4 193 231 A S >> - 0 0 0 -2,-0.3 4,-1.9 13,-0.1 3,-0.5 -0.279 26.4-109.7 -69.1 158.3 -10.6 51.5 17.9 194 232 A P H 3> S+ 0 0 6 0, 0.0 4,-0.9 0, 0.0 6,-0.2 0.864 117.5 54.4 -55.7 -39.0 -12.8 48.8 16.4 195 233 A E H 34 S+ 0 0 4 82,-0.3 5,-0.4 1,-0.2 4,-0.1 0.839 107.7 47.3 -68.5 -33.4 -9.9 46.3 16.7 196 234 A R H <4 S+ 0 0 47 -3,-0.5 3,-0.5 1,-0.2 -1,-0.2 0.806 112.3 49.8 -78.1 -29.1 -9.3 46.8 20.4 197 235 A L H < S+ 0 0 32 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.658 109.2 52.6 -78.9 -18.2 -13.0 46.6 21.2 198 236 A Q S < S- 0 0 125 -4,-0.9 -1,-0.2 -5,-0.2 -2,-0.2 0.438 113.9-122.7 -91.9 -4.1 -13.1 43.3 19.1 199 237 A G + 0 0 65 -3,-0.5 -3,-0.2 1,-0.2 -4,-0.1 0.108 69.8 130.1 85.4 -22.7 -10.2 42.1 21.3 200 238 A T - 0 0 59 -5,-0.4 -1,-0.2 -6,-0.2 -2,-0.0 0.311 66.1 -42.3 -54.0-174.9 -8.1 41.6 18.1 201 239 A H - 0 0 132 -3,-0.1 2,-0.3 1,-0.0 -3,-0.1 -0.086 60.2-169.1 -49.8 147.4 -4.6 42.8 17.4 202 240 A Y + 0 0 82 -3,-0.1 2,-0.1 -6,-0.1 -1,-0.0 -0.866 17.5 150.9-155.4 121.9 -3.5 46.3 18.4 203 241 A S S >> S- 0 0 55 -2,-0.3 3,-2.0 -54,-0.0 4,-0.5 -0.330 70.8 -59.5-119.7-156.8 -0.6 48.7 17.8 204 242 A V H 3> S+ 0 0 13 1,-0.3 4,-1.4 2,-0.2 5,-0.1 0.476 123.1 79.6 -70.0 -0.5 -0.2 52.5 17.7 205 243 A Q H 3> S+ 0 0 20 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.732 86.9 57.6 -75.7 -24.8 -2.7 52.3 14.9 206 244 A S H <> S+ 0 0 1 -3,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.887 104.8 49.4 -69.9 -38.7 -5.2 52.1 17.7 207 245 A D H X S+ 0 0 0 -4,-0.5 4,-2.2 2,-0.2 -2,-0.2 0.835 107.9 54.5 -67.9 -35.0 -3.9 55.4 19.0 208 246 A I H X S+ 0 0 0 -4,-1.4 4,-2.6 1,-0.2 5,-0.2 0.902 106.3 52.5 -66.7 -39.3 -4.3 56.9 15.5 209 247 A W H X S+ 0 0 2 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.898 110.6 46.9 -60.0 -47.1 -7.9 55.8 15.4 210 248 A S H X S+ 0 0 4 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.887 111.2 51.1 -66.5 -40.4 -8.6 57.6 18.8 211 249 A M H X S+ 0 0 3 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.940 112.3 46.6 -60.6 -47.9 -6.8 60.7 17.6 212 250 A G H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 5,-0.2 0.917 112.9 49.9 -60.5 -44.6 -8.9 60.8 14.4 213 251 A L H X S+ 0 0 0 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.917 111.6 48.6 -59.4 -44.4 -12.1 60.2 16.4 214 252 A S H X S+ 0 0 2 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.845 107.5 55.0 -63.6 -41.5 -11.2 63.0 18.9 215 253 A L H X S+ 0 0 3 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.870 106.9 49.9 -63.4 -41.2 -10.5 65.4 16.1 216 254 A V H X S+ 0 0 1 -4,-2.0 4,-2.1 2,-0.2 5,-0.3 0.931 111.9 50.0 -63.8 -41.6 -13.9 64.9 14.5 217 255 A E H X>S+ 0 0 20 -4,-1.8 4,-2.2 1,-0.2 5,-1.4 0.918 113.0 44.0 -60.0 -46.4 -15.4 65.5 17.8 218 256 A M H <5S+ 0 0 1 -4,-2.4 -95,-2.9 1,-0.2 -1,-0.2 0.801 113.9 52.3 -68.9 -34.3 -13.5 68.7 18.5 219 257 A A H <5S+ 0 0 0 -4,-2.1 -1,-0.2 -97,-0.2 -2,-0.2 0.807 119.5 32.4 -69.3 -39.2 -14.2 69.9 14.9 220 258 A V H <5S- 0 0 10 -4,-2.1 -2,-0.2 2,-0.2 -3,-0.2 0.717 104.5-119.3 -95.5 -22.1 -18.0 69.4 15.1 221 259 A G T <5S+ 0 0 30 -4,-2.2 2,-0.3 -5,-0.3 -3,-0.2 0.742 81.8 75.3 89.0 28.6 -18.6 70.1 18.8 222 260 A R S - 0 0 129 -2,-0.6 3,-3.9 1,-0.1 2,-1.3 -0.417 35.0-101.1 -62.6 106.1 -28.7 63.1 11.1 230 268 A A T 3> S+ 0 0 82 -2,-0.6 4,-1.0 1,-0.3 3,-0.3 0.290 123.8 53.8 9.2 -46.3 -28.5 65.8 8.3 231 269 A K H 3> S+ 0 0 148 -2,-1.3 4,-1.0 1,-0.2 -1,-0.3 0.696 99.8 62.9 -77.8 -19.4 -30.9 68.2 10.0 232 270 A E H <> S+ 0 0 79 -3,-3.9 4,-0.7 1,-0.2 -1,-0.2 0.732 103.6 52.6 -71.5 -23.1 -28.7 67.9 13.1 233 271 A L H >>S+ 0 0 45 -4,-0.3 4,-2.0 -3,-0.3 5,-0.7 0.815 97.1 59.4 -84.1 -36.0 -26.1 69.5 10.9 234 272 A E H X5S+ 0 0 112 -4,-1.0 4,-1.1 1,-0.2 -2,-0.2 0.899 108.5 47.9 -61.6 -36.4 -28.0 72.6 9.6 235 273 A L H <5S+ 0 0 143 -4,-1.0 -1,-0.2 2,-0.1 -2,-0.2 0.868 113.7 53.0 -68.5 -33.5 -28.3 73.7 13.2 236 274 A M H <5S- 0 0 42 -4,-0.7 -2,-0.2 1,-0.1 -3,-0.1 0.992 131.2 -0.1 -66.0 -71.0 -24.6 73.0 13.6 237 275 A F H <5 0 0 44 -4,-2.0 -3,-0.2 0, 0.0 -2,-0.1 0.401 360.0 360.0-105.7 -0.1 -22.7 74.9 10.8 238 276 A G << 0 0 83 -4,-1.1 -4,-0.2 -5,-0.7 -3,-0.1 0.460 360.0 360.0 102.4 360.0 -25.7 76.5 9.0 239 ! 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 0.0 240 307 A P 0 0 182 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-162.0 -30.2 58.1 23.5 241 308 A M - 0 0 67 -15,-0.0 2,-0.1 4,-0.0 5,-0.0 -0.886 360.0-139.9-106.6 120.5 -27.5 55.4 23.1 242 309 A A >> - 0 0 36 -2,-0.6 4,-2.1 1,-0.1 3,-1.1 -0.371 34.0-101.5 -70.0 152.2 -26.3 53.4 26.0 243 310 A I H 3> S+ 0 0 81 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.847 122.3 46.5 -38.5 -56.2 -22.5 52.6 26.2 244 311 A F H 3> S+ 0 0 137 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.792 109.4 54.1 -63.0 -31.1 -22.9 49.1 24.9 245 312 A E H <> S+ 0 0 96 -3,-1.1 4,-1.5 2,-0.2 -1,-0.2 0.898 112.9 46.8 -69.7 -34.9 -25.2 50.1 22.1 246 313 A L H X S+ 0 0 18 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.966 107.1 50.9 -71.5 -56.3 -22.5 52.6 21.1 247 314 A L H X S+ 0 0 30 -4,-2.7 4,-1.8 1,-0.3 -1,-0.2 0.837 110.6 53.0 -55.5 -31.0 -19.4 50.4 21.2 248 315 A D H X S+ 0 0 92 -4,-1.3 4,-3.0 -5,-0.2 5,-0.3 0.924 105.5 54.6 -67.6 -43.4 -21.3 47.9 19.1 249 316 A Y H X S+ 0 0 60 -4,-1.5 4,-3.6 1,-0.2 -2,-0.2 0.949 106.6 51.2 -51.7 -55.1 -22.0 50.8 16.6 250 317 A I H < S+ 0 0 8 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.896 114.6 42.3 -50.3 -48.8 -18.3 51.5 16.4 251 318 A V H < S+ 0 0 27 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.853 126.3 31.9 -71.1 -35.3 -17.5 47.9 15.6 252 319 A N H < S+ 0 0 96 -4,-3.0 -2,-0.2 -5,-0.1 -3,-0.2 0.678 108.0 64.5 -99.2 -21.9 -20.4 47.3 13.2 253 320 A E S < S- 0 0 86 -4,-3.6 0, 0.0 -5,-0.3 0, 0.0 -0.581 91.2 -86.2-101.4 168.4 -21.1 50.6 11.4 254 321 A P - 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.410 57.6 -91.5 -71.2 146.5 -18.9 52.7 9.1 255 322 A P - 0 0 47 0, 0.0 2,-0.1 0, 0.0 21,-0.1 -0.026 48.0 -91.1 -57.6 160.3 -16.5 55.1 10.7 256 323 A P - 0 0 15 0, 0.0 2,-0.3 0, 0.0 19,-0.1 -0.392 42.8-163.0 -68.6 154.2 -17.5 58.8 11.4 257 324 A K - 0 0 157 -33,-0.2 3,-0.1 -2,-0.1 11,-0.1 -0.962 23.7-104.8-133.7 159.1 -16.8 61.5 8.9 258 325 A L - 0 0 6 -2,-0.3 5,-0.0 10,-0.1 -42,-0.0 -0.602 46.7-101.5 -76.8 142.9 -16.6 65.2 8.9 259 326 A P > - 0 0 21 0, 0.0 4,-0.7 0, 0.0 3,-0.2 -0.320 47.0-120.9 -57.2 138.9 -19.6 66.9 7.3 260 327 A S T 4 S+ 0 0 94 1,-0.2 2,-0.8 2,-0.1 4,-0.1 -0.338 87.3 32.9 -85.5 167.8 -18.5 68.0 3.8 261 328 A G T 4 S+ 0 0 77 2,-0.3 -1,-0.2 1,-0.1 4,-0.1 -0.091 109.3 71.3 79.6 -37.2 -18.4 71.5 2.3 262 329 A V T 4 S+ 0 0 67 -2,-0.8 2,-0.2 -3,-0.2 -2,-0.1 0.845 97.0 41.9 -75.4 -44.0 -17.6 72.9 5.8 263 330 A F S < S- 0 0 24 -4,-0.7 -2,-0.3 1,-0.1 -44,-0.0 -0.693 93.7 -92.2-106.7 161.0 -13.9 71.7 6.2 264 331 A S > - 0 0 35 -2,-0.2 4,-2.1 1,-0.1 5,-0.1 -0.251 31.6-119.9 -69.7 160.0 -11.0 71.6 3.7 265 332 A L H > S+ 0 0 136 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.886 113.2 56.6 -74.3 -33.4 -10.5 68.4 1.6 266 333 A E H > S+ 0 0 81 1,-0.2 4,-2.5 2,-0.2 27,-0.3 0.931 109.2 46.7 -61.6 -43.5 -7.0 67.9 3.1 267 334 A F H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 5,-0.3 0.914 112.4 49.6 -67.5 -40.4 -8.5 67.9 6.6 268 335 A Q H X S+ 0 0 28 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.937 112.3 47.8 -62.5 -43.8 -11.3 65.5 5.6 269 336 A D H X S+ 0 0 63 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.947 109.3 55.3 -63.1 -44.4 -8.8 63.1 3.9 270 337 A F H X S+ 0 0 0 -4,-2.5 4,-0.5 -5,-0.2 -2,-0.2 0.912 112.6 39.9 -51.6 -51.4 -6.6 63.3 7.1 271 338 A V H >X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 3,-0.9 0.878 111.1 58.4 -70.5 -35.6 -9.3 62.2 9.5 272 339 A N H 3< S+ 0 0 72 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.839 105.8 50.9 -58.9 -35.8 -10.6 59.6 7.0 273 340 A K H 3< S+ 0 0 81 -4,-1.8 10,-2.5 1,-0.2 -1,-0.2 0.606 112.7 44.9 -78.0 -17.9 -7.1 58.0 7.0 274 341 A C H << S+ 0 0 0 -3,-0.9 -2,-0.2 -4,-0.5 -1,-0.2 0.697 111.1 54.5 -90.7 -34.1 -7.1 57.8 10.8 275 342 A L S < S+ 0 0 1 -4,-2.2 2,-0.5 -63,-0.1 -2,-0.2 0.304 72.9 129.5 -90.7 9.8 -10.6 56.5 10.9 276 343 A I - 0 0 53 1,-0.1 6,-0.3 -4,-0.1 -67,-0.1 -0.559 53.4-145.9 -67.6 115.7 -10.0 53.5 8.6 277 344 A K S S+ 0 0 58 -2,-0.5 -82,-0.3 4,-0.1 -1,-0.1 0.784 81.8 72.7 -53.3 -41.3 -11.4 50.5 10.5 278 345 A N S >> S- 0 0 65 1,-0.2 4,-2.0 -84,-0.1 3,-1.6 -0.744 74.9-151.3 -84.1 112.1 -8.9 48.0 9.2 279 346 A P T 34 S+ 0 0 21 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.753 92.7 62.1 -50.9 -35.6 -5.7 48.8 11.1 280 347 A A T 34 S+ 0 0 88 1,-0.2 -3,-0.0 -3,-0.1 -2,-0.0 0.850 112.6 36.0 -61.9 -34.7 -3.6 47.5 8.2 281 348 A E T <4 S+ 0 0 127 -3,-1.6 -1,-0.2 2,-0.1 3,-0.1 0.789 95.3 96.7 -89.6 -31.3 -5.0 50.1 5.8 282 349 A R S < S- 0 0 4 -4,-2.0 -8,-0.2 -6,-0.3 -9,-0.1 -0.286 87.0 -98.8 -60.2 141.0 -5.3 53.0 8.3 283 350 A A - 0 0 3 -10,-2.5 2,-0.2 1,-0.1 -1,-0.1 -0.025 35.1-141.5 -55.0 169.3 -2.4 55.4 8.1 284 351 A D > - 0 0 53 -3,-0.1 4,-2.4 -76,-0.1 5,-0.2 -0.691 32.7 -87.6-126.4 179.2 0.5 55.2 10.5 285 352 A L H > S+ 0 0 12 -2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.847 122.5 50.7 -55.3 -47.7 2.7 57.9 12.1 286 353 A K H 4 S+ 0 0 162 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.869 114.0 45.9 -62.8 -36.9 5.3 58.3 9.3 287 354 A Q H >4 S+ 0 0 106 -3,-0.2 3,-1.0 2,-0.2 -2,-0.2 0.907 112.4 49.6 -71.9 -46.0 2.6 58.7 6.7 288 355 A L H >< S+ 0 0 1 -4,-2.4 3,-1.3 1,-0.2 6,-0.3 0.847 100.8 65.0 -63.2 -32.7 0.5 61.2 8.8 289 356 A M T 3< S+ 0 0 17 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.764 111.5 35.6 -63.5 -22.6 3.7 63.2 9.4 290 357 A V T < S+ 0 0 84 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.251 85.8 130.5-115.0 11.6 3.8 64.0 5.7 291 358 A H S X> S- 0 0 20 -3,-1.3 4,-2.7 -4,-0.2 3,-0.5 -0.324 71.2-115.5 -63.0 145.1 0.1 64.2 5.0 292 359 A A H 3> S+ 0 0 47 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.852 117.1 54.7 -48.1 -43.5 -0.9 67.3 3.1 293 360 A F H 3> S+ 0 0 0 -27,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.874 110.6 45.2 -62.4 -38.3 -2.9 68.5 6.1 294 361 A I H <> S+ 0 0 0 -3,-0.5 4,-2.2 -6,-0.3 -2,-0.2 0.935 114.1 47.9 -72.4 -41.8 0.2 68.2 8.4 295 362 A K H X S+ 0 0 130 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.845 115.7 44.9 -65.7 -37.8 2.6 69.9 5.9 296 363 A R H X S+ 0 0 63 -4,-2.2 4,-1.0 -5,-0.3 -1,-0.2 0.902 112.9 51.5 -72.3 -41.2 0.1 72.7 5.4 297 364 A S H < S+ 0 0 0 -4,-2.0 5,-0.2 -5,-0.2 -2,-0.2 0.840 108.6 50.7 -64.5 -37.1 -0.5 73.0 9.1 298 365 A D H < S+ 0 0 84 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.931 109.5 48.5 -63.8 -52.2 3.2 73.2 9.9 299 366 A A H < S+ 0 0 79 -4,-1.5 2,-0.3 -5,-0.2 -1,-0.2 0.685 96.8 90.3 -64.6 -19.7 4.0 76.0 7.4 300 367 A E S < S- 0 0 37 -4,-1.0 2,-0.8 -5,-0.1 -3,-0.0 -0.573 74.0-146.3 -74.5 140.4 1.0 77.8 8.8 301 368 A E + 0 0 194 -2,-0.3 2,-0.4 2,-0.0 -3,-0.1 -0.857 26.4 179.4-113.0 88.2 1.9 80.1 11.8 302 369 A V - 0 0 28 -2,-0.8 2,-1.3 -5,-0.2 3,-0.2 -0.764 30.6-131.5 -90.6 140.8 -1.2 79.8 13.9 303 370 A D > + 0 0 111 -2,-0.4 4,-2.1 1,-0.2 5,-0.2 -0.711 33.6 170.8 -92.8 83.7 -1.3 81.7 17.1 304 371 A F H > S+ 0 0 12 -2,-1.3 4,-2.7 1,-0.2 -1,-0.2 0.952 75.4 51.5 -61.3 -43.5 -2.5 78.9 19.3 305 372 A A H > S+ 0 0 23 2,-0.2 4,-2.8 -3,-0.2 5,-0.3 0.918 110.0 48.3 -58.7 -47.8 -1.9 80.9 22.5 306 373 A G H > S+ 0 0 24 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.985 113.6 46.2 -55.7 -59.8 -3.8 83.9 21.3 307 374 A W H X S+ 0 0 54 -4,-2.1 4,-1.3 1,-0.2 -2,-0.2 0.878 113.8 51.9 -49.6 -45.9 -6.8 81.8 20.2 308 375 A L H X S+ 0 0 2 -4,-2.7 4,-2.0 -5,-0.2 3,-0.4 0.936 109.8 44.0 -60.0 -54.3 -6.7 79.9 23.5 309 376 A C H X S+ 0 0 59 -4,-2.8 4,-1.4 1,-0.2 3,-0.3 0.974 113.3 53.3 -60.1 -43.9 -6.7 82.8 25.9 310 377 A S H < S+ 0 0 108 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.764 113.1 44.4 -55.9 -31.4 -9.4 84.5 23.9 311 378 A T H < S+ 0 0 46 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.779 122.3 30.8 -88.8 -32.0 -11.6 81.4 24.1 312 379 A I H < 0 0 42 -4,-2.0 -2,-0.2 -3,-0.3 -3,-0.1 0.319 360.0 360.0-109.6 5.5 -11.4 80.3 27.7 313 380 A G < 0 0 99 -4,-1.4 -3,-0.2 -5,-0.3 -4,-0.1 0.484 360.0 360.0 77.4 360.0 -10.9 83.8 29.1