==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-MAR-12 4AN2 . COMPND 2 MOLECULE: DUAL SPECIFICITY MITOGEN-ACTIVATED PROTEIN KINASE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.D.RICE,N.AAY,N.K.ANAND,C.M.BLAZEY,O.J.BOWLES,J.BUSSENIUS, . 282 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13959.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 14.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 18 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 32.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 0 2 0 0 3 1 3 0 0 0 0 0 1 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 0 0 1 2 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 58 A M 0 0 186 0, 0.0 4,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 153.5 -53.0 3.2 -7.0 2 59 A A - 0 0 110 1,-0.2 71,-0.0 2,-0.1 0, 0.0 0.852 360.0 -14.8 -43.7 -49.2 -53.1 6.7 -8.4 3 60 A L S S+ 0 0 39 70,-0.2 2,-3.9 1,-0.0 -1,-0.2 0.650 75.2 169.5-123.5 -42.4 -50.9 5.6 -11.5 4 61 A G + 0 0 56 1,-0.1 2,-1.1 2,-0.0 -2,-0.1 -0.219 63.4 73.4 63.4 -54.7 -49.4 2.2 -10.6 5 62 A E + 0 0 134 -2,-3.9 2,-0.6 -4,-0.2 -1,-0.1 -0.649 60.3 169.0 -99.4 75.1 -48.1 1.7 -14.1 6 63 A L + 0 0 30 -2,-1.1 2,-0.3 69,-0.1 69,-0.0 -0.809 9.6 158.3-100.7 125.6 -45.1 3.9 -14.8 7 64 A K > - 0 0 94 -2,-0.6 3,-1.4 1,-0.1 4,-0.4 -0.981 48.6-113.6-149.2 151.5 -43.1 3.2 -17.9 8 65 A D G > S+ 0 0 71 -2,-0.3 3,-1.1 1,-0.3 -1,-0.1 0.780 107.4 59.4 -56.8 -38.4 -40.7 4.9 -20.3 9 66 A D G 3 S+ 0 0 129 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.732 98.1 61.4 -67.8 -22.6 -42.9 5.1 -23.4 10 67 A D G < S+ 0 0 30 -3,-1.4 21,-1.9 20,-0.1 -1,-0.2 0.622 90.4 78.1 -81.5 -14.8 -45.6 7.1 -21.6 11 68 A F E < -A 30 0A 12 -3,-1.1 2,-0.3 -4,-0.4 19,-0.2 -0.566 61.0-162.5 -93.7 166.3 -43.4 10.1 -20.8 12 69 A E E -A 29 0A 100 17,-1.3 17,-2.8 -2,-0.2 -3,-0.0 -0.952 22.0-117.4-153.8 118.4 -42.6 12.7 -23.3 13 70 A K E +A 28 0A 133 -2,-0.3 15,-0.2 15,-0.2 3,-0.1 -0.299 29.9 171.8 -57.4 132.9 -39.7 15.2 -22.9 14 71 A I E - 0 0 85 13,-3.6 2,-0.2 1,-0.4 14,-0.2 0.594 69.9 -27.7-106.7 -25.9 -40.7 18.9 -22.9 15 72 A S E -A 27 0A 50 12,-1.3 12,-2.4 0, 0.0 -1,-0.4 -0.889 58.4-102.2-176.8 151.0 -37.2 20.2 -22.0 16 73 A E E -A 26 0A 139 -2,-0.2 10,-0.2 10,-0.2 3,-0.1 -0.636 27.1-169.6 -68.2 137.3 -33.8 19.3 -20.3 17 74 A L E - 0 0 66 8,-3.5 9,-0.2 1,-0.4 2,-0.2 0.467 50.3 -91.7-107.4 -9.2 -33.8 21.1 -16.9 18 75 A G E -A 25 0A 24 7,-0.8 7,-2.4 2,-0.0 -1,-0.4 -0.527 35.7 -78.8 124.2 175.7 -30.1 20.4 -16.3 19 76 A A E +A 24 0A 87 5,-0.2 5,-0.2 -2,-0.2 2,-0.1 -0.831 38.2 166.2-116.9 143.3 -27.5 18.0 -14.8 20 77 A G - 0 0 54 3,-2.4 2,-1.5 -2,-0.3 -1,-0.0 -0.301 56.2 -37.2-128.6-140.8 -26.3 17.5 -11.3 21 78 A N S S- 0 0 92 1,-0.2 147,-0.1 -2,-0.1 3,-0.1 -0.555 126.1 -23.2 -92.3 69.0 -24.3 15.1 -9.1 22 79 A G S S+ 0 0 21 -2,-1.5 21,-0.7 1,-0.3 2,-0.3 0.075 121.4 71.8 123.0 -19.6 -25.4 11.9 -10.7 23 80 A G E - B 0 42A 8 19,-0.2 -3,-2.4 17,-0.0 2,-0.4 -0.900 57.0-146.0-127.2 152.8 -28.8 12.6 -12.3 24 81 A V E -AB 19 41A 27 17,-3.7 17,-4.4 -2,-0.3 2,-0.4 -0.942 22.3-148.7-114.4 147.7 -30.2 14.5 -15.3 25 82 A V E -AB 18 40A 32 -7,-2.4 -8,-3.5 -2,-0.4 -7,-0.8 -0.933 13.9-176.3-121.2 130.5 -33.6 16.1 -14.9 26 83 A F E -AB 16 39A 22 13,-3.3 13,-2.5 -2,-0.4 2,-0.7 -0.923 29.1-128.0-124.6 149.2 -36.4 16.8 -17.5 27 84 A K E -AB 15 38A 59 -12,-2.4 -13,-3.6 -2,-0.4 -12,-1.3 -0.841 46.6-179.5 -80.5 119.5 -39.7 18.5 -17.6 28 85 A V E -AB 13 37A 0 9,-3.0 9,-1.9 -2,-0.7 2,-0.5 -0.793 31.5-130.6-120.6 163.8 -41.9 15.8 -19.1 29 86 A S E -AB 12 36A 32 -17,-2.8 -17,-1.3 -2,-0.3 2,-1.0 -0.951 16.4-146.7-103.7 131.4 -45.5 15.3 -20.1 30 87 A H E >>> -AB 11 35A 3 5,-2.6 4,-1.9 -2,-0.5 3,-1.2 -0.767 15.7-163.3 -96.1 94.9 -47.0 12.1 -18.8 31 88 A K G >45S+ 0 0 101 -21,-1.9 3,-0.5 -2,-1.0 -1,-0.2 0.821 77.7 52.5 -50.3 -56.4 -49.4 11.2 -21.7 32 89 A P G 345S+ 0 0 90 0, 0.0 -1,-0.3 0, 0.0 -21,-0.1 0.713 125.1 25.1 -60.6 -24.8 -51.8 8.7 -20.1 33 90 A S G <45S- 0 0 57 -3,-1.2 -2,-0.2 2,-0.1 3,-0.1 0.553 96.4-124.6-111.8 -7.6 -52.8 11.1 -17.2 34 91 A G T <<5 + 0 0 58 -4,-1.9 -3,-0.2 -3,-0.5 2,-0.1 0.449 59.0 151.2 76.0 -0.7 -52.1 14.6 -18.5 35 92 A L E < -B 30 0A 54 -5,-0.6 -5,-2.6 -6,-0.1 2,-0.4 -0.440 41.3-142.2 -65.7 131.9 -49.8 15.2 -15.5 36 93 A V E +B 29 0A 72 -7,-0.2 52,-0.6 -2,-0.1 2,-0.3 -0.859 34.8 166.2 -89.9 133.8 -46.8 17.6 -15.8 37 94 A M E -BC 28 87A 0 -9,-1.9 -9,-3.0 -2,-0.4 2,-0.4 -0.943 40.1-122.5-147.7 154.6 -43.8 16.3 -14.0 38 95 A A E -BC 27 86A 9 48,-2.9 48,-3.2 -2,-0.3 2,-0.4 -0.848 31.1-162.9 -93.8 143.1 -40.0 16.7 -13.4 39 96 A R E -BC 26 85A 16 -13,-2.5 -13,-3.3 -2,-0.4 2,-0.6 -0.980 6.2-160.6-135.8 122.4 -38.1 13.5 -14.0 40 97 A K E -BC 25 84A 29 44,-3.2 44,-2.7 -2,-0.4 2,-0.6 -0.903 5.4-157.9-106.5 123.7 -34.7 12.8 -12.8 41 98 A L E -BC 24 83A 17 -17,-4.4 -17,-3.7 -2,-0.6 2,-0.5 -0.940 6.4-170.4-102.4 123.6 -32.6 10.1 -14.5 42 99 A I E -BC 23 82A 2 40,-2.3 40,-2.5 -2,-0.6 2,-0.3 -0.971 10.2-152.4-111.0 109.0 -29.7 8.6 -12.5 43 100 A H E + C 0 81A 105 -21,-0.7 38,-0.2 -2,-0.5 2,-0.2 -0.611 28.0 165.0 -69.6 128.4 -27.3 6.2 -14.4 44 101 A L - 0 0 32 36,-0.7 -1,-0.1 -2,-0.3 2,-0.0 -0.374 37.6-126.4-121.4-147.1 -25.8 3.7 -12.0 45 102 A E + 0 0 181 -2,-0.2 2,-0.3 2,-0.1 -2,-0.0 -0.450 54.0 131.2-164.5 83.6 -23.8 0.4 -12.4 46 103 A I - 0 0 46 -2,-0.0 -2,-0.1 3,-0.0 5,-0.0 -0.996 58.7 -91.4-156.3 145.3 -25.5 -2.3 -10.3 47 104 A K > - 0 0 158 -2,-0.3 4,-2.4 1,-0.1 3,-0.4 -0.123 46.3-113.8 -43.5 133.0 -26.9 -5.8 -9.8 48 105 A P H > S+ 0 0 84 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.651 117.7 62.8 -49.7 -14.8 -30.7 -6.1 -10.5 49 106 A A H > S+ 0 0 68 2,-0.2 4,-2.3 3,-0.1 5,-0.1 0.972 107.3 38.1 -74.5 -55.3 -31.0 -6.8 -6.8 50 107 A I H > S+ 0 0 49 -3,-0.4 4,-2.2 2,-0.2 5,-0.3 0.959 114.8 55.7 -58.5 -53.7 -29.6 -3.4 -5.7 51 108 A R H X S+ 0 0 44 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.927 110.7 44.3 -46.0 -54.6 -31.5 -1.7 -8.6 52 109 A N H X S+ 0 0 99 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.842 109.5 55.1 -66.6 -35.3 -34.8 -3.1 -7.5 53 110 A Q H X S+ 0 0 64 -4,-2.3 4,-3.7 2,-0.2 3,-0.3 0.969 107.1 51.9 -50.1 -60.4 -34.2 -2.4 -3.7 54 111 A I H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.919 110.4 47.7 -39.2 -55.2 -33.6 1.2 -4.6 55 112 A I H < S+ 0 0 18 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.831 113.8 47.5 -62.8 -31.3 -36.9 1.3 -6.5 56 113 A R H >< S+ 0 0 161 -4,-1.7 3,-2.3 -3,-0.3 4,-0.5 0.968 111.7 50.0 -70.7 -55.2 -38.7 -0.4 -3.5 57 114 A E H >< S+ 0 0 44 -4,-3.7 3,-0.7 1,-0.3 -2,-0.2 0.770 104.9 58.8 -52.1 -33.0 -37.1 2.1 -1.0 58 115 A L G >< S+ 0 0 2 -4,-1.9 3,-1.3 -5,-0.3 -1,-0.3 0.520 84.5 79.9 -74.9 -6.3 -38.2 5.0 -3.1 59 116 A Q G X S+ 0 0 68 -3,-2.3 3,-2.9 1,-0.3 4,-0.3 0.833 74.6 76.7 -76.7 -26.0 -41.8 4.0 -2.9 60 117 A V G X S+ 0 0 59 -3,-0.7 3,-1.6 -4,-0.5 -1,-0.3 0.728 77.1 75.6 -55.3 -20.0 -41.9 5.6 0.6 61 118 A L G X S+ 0 0 17 -3,-1.3 3,-2.2 1,-0.3 11,-0.4 0.817 77.9 73.2 -64.4 -26.0 -42.0 8.9 -1.2 62 119 A H G < S+ 0 0 75 -3,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.784 95.8 53.4 -54.5 -23.5 -45.7 8.2 -2.0 63 120 A E G < S+ 0 0 128 -3,-1.6 2,-0.8 -4,-0.3 -1,-0.3 0.381 79.9 104.4 -96.6 2.9 -46.3 8.9 1.7 64 121 A C < + 0 0 12 -3,-2.2 2,-0.4 -4,-0.1 8,-0.4 -0.753 42.9 166.5 -81.9 115.0 -44.6 12.3 1.7 65 122 A N + 0 0 143 -2,-0.8 5,-0.1 6,-0.1 6,-0.1 -0.814 18.3 120.9-137.1 97.7 -47.5 14.8 1.8 66 123 A S > - 0 0 12 -2,-0.4 3,-0.7 3,-0.4 53,-0.0 -0.994 63.0-128.7-153.3 147.8 -46.5 18.3 2.7 67 124 A P T 3 S+ 0 0 81 0, 0.0 80,-0.2 0, 0.0 4,-0.1 0.717 113.9 52.1 -73.8 -13.5 -46.8 21.7 1.2 68 125 A Y T 3 S+ 0 0 73 50,-0.1 81,-3.2 80,-0.1 2,-0.5 0.428 99.3 72.8 -98.3 -0.8 -43.0 22.0 1.9 69 126 A I B < S-e 149 0B 3 -3,-0.7 -3,-0.4 79,-0.2 81,-0.2 -0.964 89.9-112.4-117.1 127.0 -41.9 18.8 0.2 70 127 A V - 0 0 10 79,-2.1 2,-0.2 -2,-0.5 -2,-0.1 -0.266 45.7-103.9 -52.3 138.1 -41.9 18.4 -3.5 71 128 A G - 0 0 20 -4,-0.1 16,-3.1 17,-0.1 2,-0.5 -0.540 27.2-137.2 -76.9 140.1 -44.6 15.9 -4.5 72 129 A F E +D 86 0A 21 -8,-0.4 14,-0.2 -11,-0.4 3,-0.1 -0.871 26.1 168.5 -94.1 125.7 -43.8 12.2 -5.5 73 130 A Y E - 0 0 73 12,-2.6 2,-0.2 -2,-0.5 -70,-0.2 0.785 61.1 -57.2-101.2 -33.5 -45.5 10.5 -8.5 74 131 A G E -D 85 0A 1 11,-1.3 11,-2.8 -71,-0.1 2,-0.3 -0.884 35.5-134.0 166.3 163.9 -43.4 7.3 -8.9 75 132 A A E +D 84 0A 8 -2,-0.2 2,-0.3 9,-0.2 9,-0.2 -0.994 27.6 160.8-136.5 140.1 -40.0 5.8 -9.5 76 133 A F E -D 83 0A 19 7,-1.1 7,-3.0 -2,-0.3 2,-0.4 -0.965 36.5-108.7-149.4 162.8 -39.1 2.9 -11.9 77 134 A Y E +D 82 0A 84 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.805 41.5 165.5 -91.9 135.3 -35.9 1.4 -13.6 78 135 A S E > -D 81 0A 20 3,-2.3 3,-1.2 -2,-0.4 -2,-0.0 -0.891 56.4 -15.9-159.6 134.6 -35.4 1.8 -17.4 79 136 A D T 3 S- 0 0 149 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.922 125.3 -53.6 47.8 49.6 -32.7 1.5 -20.1 80 137 A G T 3 S+ 0 0 34 1,-0.1 -36,-0.7 -37,-0.1 2,-0.4 0.732 122.7 101.8 59.2 26.9 -30.1 1.4 -17.4 81 138 A E E < -CD 43 78A 48 -3,-1.2 -3,-2.3 -38,-0.2 2,-0.3 -0.985 66.3-137.8-140.8 123.1 -31.3 4.7 -15.8 82 139 A I E -CD 42 77A 5 -40,-2.5 -40,-2.3 -2,-0.4 2,-0.5 -0.694 21.5-142.8 -82.9 142.7 -33.5 4.9 -12.7 83 140 A S E -CD 41 76A 3 -7,-3.0 -7,-1.1 -2,-0.3 2,-0.6 -0.893 14.7-168.8-111.4 122.1 -36.3 7.4 -12.9 84 141 A I E -CD 40 75A 21 -44,-2.7 -44,-3.2 -2,-0.5 2,-0.5 -0.980 14.0-160.2-110.2 121.7 -37.6 9.6 -10.1 85 142 A C E +CD 39 74A 0 -11,-2.8 -12,-2.6 -2,-0.6 -11,-1.3 -0.886 22.0 157.8-102.8 121.9 -40.8 11.3 -11.0 86 143 A M E -CD 38 72A 22 -48,-3.2 -48,-2.9 -2,-0.5 -14,-0.2 -0.858 47.9 -68.8-141.0 165.8 -41.8 14.4 -9.1 87 144 A E E -C 37 0A 33 -16,-3.1 2,-0.2 -2,-0.3 -50,-0.2 -0.414 53.4-127.1 -52.8 127.4 -43.9 17.6 -9.1 88 145 A H - 0 0 40 -52,-0.6 2,-0.5 -60,-0.1 -17,-0.1 -0.596 18.9-156.0 -73.6 143.6 -42.4 20.1 -11.6 89 146 A M > - 0 0 10 -2,-0.2 3,-1.8 1,-0.1 52,-0.2 -0.943 6.8-153.4-130.6 110.9 -41.6 23.5 -10.1 90 147 A D T 3 S+ 0 0 65 -2,-0.5 52,-0.2 1,-0.3 -1,-0.1 0.450 89.7 58.9 -71.3 -3.5 -41.6 26.3 -12.7 91 148 A G T 3 S- 0 0 5 50,-2.1 -1,-0.3 1,-0.3 51,-0.2 0.636 91.0-150.2 -86.0 -18.1 -39.1 28.5 -10.7 92 149 A G E < -F 141 0B 17 -3,-1.8 49,-2.8 49,-0.7 -1,-0.3 -0.577 44.4 -35.1 70.7-146.7 -36.3 26.0 -10.6 93 150 A S E >> -F 140 0B 5 47,-0.2 4,-2.6 -2,-0.2 3,-0.7 -0.662 51.6-108.3-112.8 164.5 -34.1 26.3 -7.5 94 151 A L H 3> S+ 0 0 1 45,-2.1 4,-3.5 42,-0.9 43,-0.2 0.820 120.3 61.4 -57.6 -33.5 -32.9 29.1 -5.3 95 152 A D H 3> S+ 0 0 33 41,-1.1 4,-1.9 44,-0.3 -1,-0.2 0.873 107.7 42.4 -62.1 -35.8 -29.4 28.4 -6.9 96 153 A Q H <> S+ 0 0 104 -3,-0.7 4,-2.1 40,-0.2 -2,-0.2 0.910 116.3 50.2 -73.1 -36.6 -30.9 29.2 -10.3 97 154 A V H X S+ 0 0 0 -4,-2.6 4,-3.8 2,-0.2 -2,-0.2 0.913 109.5 50.4 -62.0 -44.5 -32.7 32.1 -8.6 98 155 A L H X S+ 0 0 11 -4,-3.5 4,-3.2 2,-0.2 -1,-0.2 0.947 107.9 51.5 -60.6 -53.0 -29.5 33.3 -7.0 99 156 A K H < S+ 0 0 149 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.880 116.9 42.4 -47.7 -47.9 -27.6 33.2 -10.3 100 157 A K H < S+ 0 0 135 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.963 122.1 37.5 -60.4 -58.0 -30.4 35.3 -11.9 101 158 A A H < S- 0 0 32 -4,-3.8 2,-0.4 -5,-0.2 -2,-0.2 0.655 88.8-140.9 -75.8 -21.8 -30.8 37.7 -8.9 102 159 A G S < S+ 0 0 44 -4,-3.2 2,-0.3 -5,-0.2 -1,-0.1 -0.240 82.3 11.7 88.4 -44.6 -27.3 38.2 -7.7 103 160 A R S S- 0 0 170 -2,-0.4 97,-0.2 -6,-0.2 96,-0.1 -0.968 76.0-129.8-172.4 133.3 -28.3 38.2 -4.1 104 161 A I - 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0 0 49 -2,-0.3 4,-2.2 1,-0.1 3,-0.2 -0.320 53.0-108.8 -66.3 150.4 -8.3 24.9 -2.9 211 310 A I H > S+ 0 0 71 1,-0.2 4,-1.8 2,-0.2 -1,-0.1 0.911 115.0 44.7 -53.8 -53.1 -10.8 22.2 -2.0 212 311 A F H > S+ 0 0 162 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.902 111.9 54.4 -63.9 -30.8 -8.8 20.1 0.4 213 312 A E H > S+ 0 0 115 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.927 104.6 57.3 -62.3 -39.6 -7.6 23.3 2.1 214 313 A L H X S+ 0 0 15 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.890 101.8 54.3 -52.2 -47.3 -11.4 24.2 2.5 215 314 A L H X S+ 0 0 29 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.894 112.6 41.9 -63.8 -38.8 -12.1 21.0 4.4 216 315 A D H X S+ 0 0 106 -4,-1.6 4,-3.3 2,-0.2 5,-0.4 0.952 111.8 56.0 -70.3 -42.0 -9.4 21.7 7.0 217 316 A Y H X S+ 0 0 63 -4,-3.1 4,-4.0 1,-0.2 -2,-0.2 0.923 108.0 49.6 -50.5 -44.3 -10.4 25.3 7.1 218 317 A I H < S+ 0 0 1 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.880 115.1 40.3 -67.3 -40.4 -14.0 24.3 7.9 219 318 A V H < S+ 0 0 29 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.891 128.1 34.1 -72.3 -37.6 -13.1 21.9 10.7 220 319 A N H < S+ 0 0 102 -4,-3.3 -2,-0.2 -5,-0.2 -3,-0.2 0.809 108.4 61.9 -91.3 -34.4 -10.4 24.3 12.1 221 320 A E S < S- 0 0 91 -4,-4.0 0, 0.0 -5,-0.4 0, 0.0 -0.384 90.4 -85.0 -97.7 172.6 -11.6 27.8 11.5 222 321 A P - 0 0 82 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.375 50.6 -95.9 -71.4 155.5 -14.7 29.7 12.8 223 322 A P - 0 0 36 0, 0.0 20,-0.0 0, 0.0 21,-0.0 -0.201 47.7 -91.2 -64.9 159.1 -18.1 29.5 11.1 224 323 A P - 0 0 13 0, 0.0 2,-0.3 0, 0.0 19,-0.1 -0.240 40.3-161.5 -69.3 165.1 -19.2 32.1 8.6 225 324 A K - 0 0 151 -20,-0.2 11,-0.1 -28,-0.0 3,-0.0 -0.929 23.8-101.5-144.3 153.8 -21.2 35.2 9.7 226 325 A L - 0 0 8 -2,-0.3 2,-0.3 10,-0.2 -29,-0.0 -0.492 50.2 -90.2 -74.8 152.4 -23.4 37.7 7.9 227 326 A P > - 0 0 61 0, 0.0 4,-0.8 0, 0.0 3,-0.3 -0.568 47.0-135.6 -61.7 127.2 -22.0 41.2 7.0 228 327 A S T 4 S+ 0 0 93 -2,-0.3 -2,-0.0 1,-0.2 5,-0.0 0.092 87.9 46.5 -86.4 26.0 -23.1 42.9 10.3 229 328 A A T 4 S+ 0 0 95 -2,-0.1 -1,-0.2 3,-0.0 4,-0.1 0.644 106.7 48.2-126.2 -34.2 -24.4 46.1 8.9 230 329 A V T 4 S+ 0 0 110 -3,-0.3 2,-0.4 2,-0.1 -2,-0.1 0.616 104.7 63.5 -87.4 -10.8 -26.6 45.4 6.0 231 330 A F S < S- 0 0 29 -4,-0.8 -5,-0.0 1,-0.1 -31,-0.0 -0.906 90.0-102.2-120.0 143.3 -28.7 42.6 7.6 232 331 A S > - 0 0 34 -2,-0.4 4,-2.1 1,-0.1 5,-0.1 -0.058 29.2-119.9 -54.9 158.9 -31.0 42.8 10.6 233 332 A L H > S+ 0 0 130 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.749 112.7 60.4 -79.3 -23.8 -29.6 41.5 13.9 234 333 A E H > S+ 0 0 77 2,-0.2 4,-3.1 3,-0.2 27,-0.3 0.950 108.0 43.2 -60.5 -53.4 -32.5 38.9 14.0 235 334 A F H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.938 115.2 48.8 -57.9 -54.9 -31.3 37.4 10.8 236 335 A Q H X S+ 0 0 23 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.876 113.9 46.6 -52.5 -42.9 -27.6 37.5 11.8 237 336 A D H X S+ 0 0 59 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.947 111.9 51.5 -67.5 -47.8 -28.5 35.9 15.2 238 337 A F H >X S+ 0 0 0 -4,-3.1 4,-1.5 2,-0.2 3,-0.7 0.954 112.3 45.5 -45.3 -64.8 -30.6 33.2 13.5 239 338 A V H >X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.3 3,-1.0 0.908 110.5 52.7 -46.9 -56.2 -27.9 32.3 11.1 240 339 A N H 3< S+ 0 0 47 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.832 106.3 55.4 -56.0 -31.0 -25.2 32.3 13.9 241 340 A K H << S+ 0 0 83 -4,-2.0 10,-2.7 -3,-0.7 3,-0.4 0.787 108.6 47.1 -72.9 -30.1 -27.5 29.9 15.9 242 341 A C H << S+ 0 0 0 -4,-1.5 -1,-0.2 -3,-1.0 -2,-0.2 0.738 111.2 55.4 -72.9 -28.4 -27.6 27.5 12.9 243 342 A L < + 0 0 1 -4,-1.5 2,-0.3 -5,-0.2 -2,-0.2 0.224 64.1 131.3-103.3 15.8 -23.9 27.7 12.5 244 343 A I - 0 0 61 -3,-0.4 6,-0.2 1,-0.2 -54,-0.1 -0.568 52.2-144.2 -60.1 124.8 -22.4 26.8 15.9 245 344 A K S S+ 0 0 52 -2,-0.3 -69,-0.3 4,-0.1 -1,-0.2 0.812 83.9 79.2 -56.5 -37.1 -19.7 24.2 15.1 246 345 A N S >> S- 0 0 75 1,-0.2 4,-1.6 -71,-0.1 3,-1.4 -0.708 74.1-154.6 -81.6 117.0 -20.4 22.1 18.2 247 346 A P T 34 S+ 0 0 39 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.744 91.2 60.4 -69.5 -22.8 -23.5 20.1 17.2 248 347 A A T 34 S+ 0 0 92 1,-0.2 -2,-0.1 -3,-0.1 -3,-0.0 0.764 112.9 38.1 -68.8 -23.5 -24.6 19.8 20.9 249 348 A E T <4 S+ 0 0 142 -3,-1.4 -1,-0.2 2,-0.1 -5,-0.1 0.725 91.9 106.2-104.1 -19.0 -24.8 23.5 21.1 250 349 A R S < S- 0 0 9 -4,-1.6 -8,-0.2 -6,-0.2 -9,-0.1 -0.185 79.5-102.0 -54.6 147.7 -26.2 24.3 17.6 251 350 A A - 0 0 5 -10,-2.7 2,-0.2 -13,-0.2 -1,-0.1 -0.384 35.6-144.0 -66.7 153.1 -29.9 25.3 17.6 252 351 A D > - 0 0 52 -2,-0.1 4,-2.1 -63,-0.1 5,-0.2 -0.624 29.9 -93.7-111.8 177.6 -32.5 22.7 16.6 253 352 A L H > S+ 0 0 16 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.769 120.5 55.4 -65.1 -31.3 -35.7 23.0 14.6 254 353 A K H > S+ 0 0 181 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.975 113.9 42.7 -65.8 -46.9 -38.0 23.4 17.7 255 354 A Q H 4 S+ 0 0 114 1,-0.2 3,-0.3 2,-0.2 -2,-0.2 0.796 114.5 49.2 -69.8 -30.9 -35.9 26.4 18.8 256 355 A L H >< S+ 0 0 0 -4,-2.1 3,-1.5 1,-0.2 6,-0.3 0.828 98.8 66.5 -77.9 -34.3 -35.5 27.9 15.4 257 356 A M H 3< S+ 0 0 58 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.771 107.3 42.6 -55.8 -24.4 -39.3 27.8 14.6 258 357 A V T 3< S+ 0 0 95 -4,-0.7 -1,-0.2 -3,-0.3 -2,-0.2 0.303 86.8 130.7-105.7 9.6 -39.8 30.4 17.5 259 358 A H X> - 0 0 18 -3,-1.5 4,-3.1 1,-0.1 3,-0.5 -0.245 69.9-117.2 -66.9 146.2 -36.9 32.7 16.6 260 359 A A H 3> S+ 0 0 43 1,-0.3 4,-2.5 2,-0.2 5,-0.3 0.913 116.9 54.8 -51.4 -41.5 -37.4 36.4 16.4 261 360 A F H 3> S+ 0 0 0 -27,-0.3 4,-2.4 1,-0.2 -1,-0.3 0.901 112.1 43.2 -57.0 -40.6 -36.4 36.2 12.7 262 361 A I H <> S+ 0 0 0 -3,-0.5 4,-2.7 -6,-0.3 -2,-0.2 0.920 112.9 50.2 -74.8 -43.6 -39.1 33.6 12.0 263 362 A K H X S+ 0 0 139 -4,-3.1 4,-1.5 2,-0.2 -2,-0.2 0.962 115.8 44.1 -54.9 -54.0 -41.8 35.3 14.0 264 363 A R H X S+ 0 0 75 -4,-2.5 4,-1.0 -5,-0.3 3,-0.2 0.900 114.0 49.0 -58.3 -47.1 -41.1 38.6 12.2 265 364 A S H < S+ 0 0 0 -4,-2.4 3,-0.5 -5,-0.3 -1,-0.2 0.862 105.1 59.8 -62.1 -37.5 -40.8 36.9 8.8 266 365 A D H < S+ 0 0 86 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.896 105.8 47.2 -60.2 -41.1 -44.1 35.1 9.4 267 366 A A H < S+ 0 0 92 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.708 91.1 99.1 -77.5 -18.4 -46.0 38.4 9.8 268 367 A E S < S- 0 0 55 -4,-1.0 2,-0.9 -3,-0.5 -3,-0.0 -0.378 71.8-132.3 -73.5 149.7 -44.6 40.2 6.7 269 368 A E + 0 0 197 2,-0.1 2,-0.6 -2,-0.0 -1,-0.1 -0.855 34.2 175.6 -94.9 98.4 -46.6 40.3 3.4 270 369 A V - 0 0 39 -2,-0.9 2,-1.9 -5,-0.1 3,-0.2 -0.936 26.2-150.3-112.6 116.3 -43.9 39.2 0.9 271 370 A D > + 0 0 113 -2,-0.6 4,-1.5 1,-0.2 5,-0.1 -0.591 31.2 162.9 -77.8 79.3 -45.2 38.8 -2.6 272 371 A F H > + 0 0 10 -2,-1.9 4,-3.2 2,-0.2 -1,-0.2 0.930 69.5 55.4 -70.6 -45.5 -42.6 36.2 -3.5 273 372 A A H > S+ 0 0 26 1,-0.2 4,-1.1 -3,-0.2 -1,-0.2 0.951 111.5 46.3 -45.3 -53.0 -44.5 34.9 -6.6 274 373 A G H > S+ 0 0 26 2,-0.2 4,-2.8 1,-0.2 3,-0.3 0.846 111.1 51.4 -59.6 -35.9 -44.4 38.5 -8.0 275 374 A W H X S+ 0 0 52 -4,-1.5 4,-3.7 1,-0.2 5,-0.3 0.962 103.5 58.0 -71.8 -48.0 -40.8 38.9 -7.1 276 375 A L H X S+ 0 0 0 -4,-3.2 4,-2.7 2,-0.2 5,-0.3 0.736 111.1 44.0 -44.3 -33.9 -40.0 35.7 -8.9 277 376 A C H X S+ 0 0 45 -4,-1.1 4,-2.1 -3,-0.3 -2,-0.2 0.934 111.3 50.4 -80.6 -55.8 -41.5 37.3 -12.0 278 377 A S H < S+ 0 0 105 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.958 125.9 31.4 -30.8 -65.0 -39.8 40.7 -11.6 279 378 A T H < S+ 0 0 35 -4,-3.7 -2,-0.2 1,-0.2 -3,-0.2 0.802 134.2 22.8 -77.7 -41.1 -36.6 38.6 -11.2 280 379 A I H < S- 0 0 40 -4,-2.7 -3,-0.2 -5,-0.3 -1,-0.2 0.530 96.2-129.7-108.8 -5.7 -36.9 35.4 -13.4 281 380 A G < 0 0 62 -4,-2.1 -4,-0.2 -5,-0.3 -3,-0.1 0.978 360.0 360.0 58.5 78.4 -39.5 36.7 -15.9 282 381 A L 0 0 113 -139,-0.0 -1,-0.2 0, 0.0 -5,-0.1 -0.847 360.0 360.0-105.4 360.0 -42.4 34.1 -16.2