==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 24-APR-12 4ARK . COMPND 2 MOLECULE: DUAL SPECIFICITY MITOGEN-ACTIVATED PROTEIN KINASE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR I.V.HARTUNG,M.HITCHCOCK,F.PUEHLER,R.NEUHAUS,A.SCHOLZ,S.HAMME . 291 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14971.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 194 66.7 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 . 40 13.7 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 0.7 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 . 26 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 31.3 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+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 1 0 2 1 2 1 0 0 0 0 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 1 3 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 61 A M 0 0 162 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 162.5 40.0 19.6 59.8 2 62 A E - 0 0 163 1,-0.1 2,-0.4 69,-0.0 69,-0.1 -0.485 360.0-129.8 -76.7 140.6 36.3 19.6 58.6 3 63 A L - 0 0 25 -2,-0.2 2,-0.3 69,-0.1 69,-0.1 -0.769 28.7-177.1 -89.6 131.0 34.6 22.9 57.9 4 64 A K > - 0 0 110 -2,-0.4 3,-1.2 1,-0.1 4,-0.2 -0.946 34.3-113.5-129.2 148.8 31.1 23.2 59.6 5 65 A D G > S+ 0 0 68 -2,-0.3 3,-1.7 1,-0.2 -1,-0.1 0.899 110.2 47.5 -45.7 -57.0 28.5 26.1 59.4 6 66 A D G 3 S+ 0 0 114 1,-0.3 -1,-0.2 3,-0.0 0, 0.0 0.569 97.0 72.7 -75.9 -4.0 28.6 27.4 63.0 7 67 A D G < S+ 0 0 33 -3,-1.2 21,-2.0 21,-0.0 -1,-0.3 0.489 86.9 85.1 -80.3 -6.8 32.4 27.5 63.1 8 68 A F E < -A 27 0A 17 -3,-1.7 2,-0.4 -4,-0.2 19,-0.2 -0.647 58.4-162.2 -99.8 156.4 32.3 30.6 60.8 9 69 A E E -A 26 0A 108 17,-1.7 17,-3.0 -2,-0.2 2,-0.2 -0.992 22.4-123.6-139.8 127.8 32.0 34.3 61.5 10 70 A K E +A 25 0A 146 -2,-0.4 15,-0.2 15,-0.2 3,-0.1 -0.494 30.6 169.3 -74.9 133.1 31.0 36.9 58.9 11 71 A I E - 0 0 84 13,-3.0 2,-0.3 1,-0.4 14,-0.2 0.776 63.5 -33.6-104.9 -52.1 33.4 39.9 58.5 12 72 A S E -A 24 0A 55 12,-1.5 12,-3.1 0, 0.0 2,-0.5 -0.961 61.3 -94.3-160.8 169.5 32.0 41.6 55.3 13 73 A E E -A 23 0A 116 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.862 24.0-165.0 -97.5 125.2 30.3 40.9 52.0 14 74 A L E - 0 0 62 8,-2.5 2,-0.2 -2,-0.5 9,-0.2 0.601 56.2 -80.0 -86.3 -10.8 32.7 40.5 49.1 15 75 A G E -A 22 0A 29 7,-0.9 7,-2.6 2,-0.0 -1,-0.3 -0.763 40.2-108.5 138.4 178.0 30.0 40.9 46.4 16 76 A A E +A 21 0A 66 -2,-0.2 2,-0.2 5,-0.2 5,-0.2 -0.994 18.5 179.7-142.4 140.7 27.3 39.0 44.6 17 77 A G - 0 0 57 3,-2.0 2,-0.3 -2,-0.3 -2,-0.0 -0.503 56.1 -72.6-107.7-167.5 26.7 37.6 41.2 18 78 A N S S+ 0 0 122 -2,-0.2 2,-0.2 1,-0.2 144,-0.1 -0.741 120.3 22.7 -89.0 142.6 23.4 35.7 40.5 19 79 A G S S+ 0 0 50 -2,-0.3 21,-1.4 -3,-0.0 2,-0.3 -0.319 124.8 47.6 95.7 -47.5 23.1 32.2 42.0 20 80 A G E - B 0 39A 6 -2,-0.2 -3,-2.0 19,-0.2 2,-0.4 -0.950 54.5-161.2-133.0 146.7 25.7 33.1 44.7 21 81 A V E -AB 16 38A 48 17,-1.4 17,-2.7 -2,-0.3 2,-0.5 -0.928 20.1-149.8-110.0 149.3 26.9 35.6 47.3 22 82 A V E -AB 15 37A 34 -7,-2.6 -8,-2.5 -2,-0.4 -7,-0.9 -0.976 11.8-168.0-126.2 127.2 30.4 35.6 48.7 23 83 A F E -AB 13 36A 30 13,-2.7 13,-3.1 -2,-0.5 2,-0.6 -0.787 25.3-124.8-109.9 153.6 31.4 36.7 52.1 24 84 A K E +AB 12 35A 60 -12,-3.1 -13,-3.0 -2,-0.3 -12,-1.5 -0.893 47.4 177.4 -92.2 121.0 34.7 37.4 53.9 25 85 A V E -AB 10 34A 3 9,-3.5 9,-3.0 -2,-0.6 2,-0.5 -0.872 33.6-130.0-132.2 155.4 34.7 35.2 56.9 26 86 A S E -AB 9 33A 23 -17,-3.0 -17,-1.7 -2,-0.3 2,-1.1 -0.940 16.7-143.8-101.8 126.0 36.8 34.1 59.9 27 87 A H E >> -A 8 0A 5 5,-3.0 4,-2.7 -2,-0.5 3,-1.0 -0.801 20.4-154.6 -82.1 99.2 37.1 30.4 60.5 28 88 A K T 34 S+ 0 0 115 -21,-2.0 -1,-0.2 -2,-1.1 -20,-0.1 0.779 83.4 51.8 -52.0 -39.1 37.0 30.6 64.2 29 89 A P T 34 S+ 0 0 67 0, 0.0 -1,-0.2 0, 0.0 -21,-0.1 0.809 122.9 28.4 -73.9 -27.7 38.9 27.4 65.1 30 90 A S T <4 S- 0 0 62 -3,-1.0 -2,-0.2 2,-0.2 3,-0.1 0.674 95.5-131.7 -98.9 -22.0 41.9 28.2 62.8 31 91 A G < + 0 0 50 -4,-2.7 -3,-0.1 1,-0.3 2,-0.0 0.208 57.7 146.1 82.1 -12.5 41.8 32.0 62.9 32 92 A L - 0 0 74 -5,-0.3 -5,-3.0 -6,-0.1 2,-0.6 -0.310 47.7-136.6 -60.0 132.4 42.1 31.9 59.1 33 93 A V E +B 26 0A 60 -7,-0.2 52,-0.6 -3,-0.1 2,-0.3 -0.795 36.9 168.9 -81.0 124.0 40.3 34.6 57.1 34 94 A M E -BC 25 84A 2 -9,-3.0 -9,-3.5 -2,-0.6 2,-0.5 -0.844 37.1-113.7-131.3 175.0 38.6 33.0 54.1 35 95 A A E -BC 24 83A 8 48,-2.5 48,-3.1 -2,-0.3 2,-0.6 -0.944 27.9-158.9-107.9 125.9 36.1 33.7 51.4 36 96 A R E -BC 23 82A 28 -13,-3.1 -13,-2.7 -2,-0.5 2,-0.4 -0.923 1.7-161.6-112.8 115.1 32.8 31.8 51.6 37 97 A K E -BC 22 81A 34 44,-3.0 44,-2.4 -2,-0.6 2,-0.5 -0.814 9.0-161.2 -92.1 132.5 30.7 31.4 48.4 38 98 A L E -BC 21 80A 18 -17,-2.7 -17,-1.4 -2,-0.4 2,-0.6 -0.970 5.1-166.2-119.0 124.8 27.1 30.4 49.1 39 99 A I E -BC 20 79A 4 40,-2.4 40,-1.8 -2,-0.5 2,-0.9 -0.923 14.2-144.6-114.8 114.3 24.9 28.9 46.4 40 100 A H E + C 0 78A 108 -21,-1.4 2,-0.5 -2,-0.6 38,-0.2 -0.641 30.3 169.4 -77.5 107.8 21.2 28.8 47.1 41 101 A L - 0 0 16 36,-1.8 2,-1.7 -2,-0.9 118,-0.1 -0.950 31.1-153.0-127.3 114.6 20.0 25.5 45.5 42 102 A E + 0 0 185 -2,-0.5 2,-0.3 36,-0.0 36,-0.1 -0.617 50.6 138.1 -82.2 83.3 16.6 24.1 46.0 43 103 A I - 0 0 45 -2,-1.7 -2,-0.1 34,-0.1 5,-0.1 -0.989 57.4 -93.4-139.9 141.8 17.6 20.4 45.3 44 104 A K > - 0 0 162 -2,-0.3 4,-1.2 1,-0.1 -1,-0.1 0.065 38.1-116.4 -43.7 153.9 17.1 16.9 46.7 45 105 A P H > S+ 0 0 73 0, 0.0 4,-0.8 0, 0.0 5,-0.1 0.784 106.8 62.2 -73.5 -29.3 19.6 15.5 49.3 46 106 A A H >> S+ 0 0 75 1,-0.2 4,-1.0 2,-0.2 3,-0.8 0.960 109.8 39.2 -57.9 -55.0 20.9 12.6 47.2 47 107 A I H 3> S+ 0 0 42 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.787 107.3 64.1 -67.7 -30.4 22.4 14.9 44.5 48 108 A R H 3X S+ 0 0 57 -4,-1.2 4,-1.5 1,-0.2 -1,-0.2 0.705 102.0 50.3 -74.0 -16.2 23.6 17.5 47.0 49 109 A N H < S+ 0 0 160 -4,-3.0 3,-0.8 1,-0.2 4,-0.2 0.880 111.3 48.3 -62.1 -42.9 31.6 14.8 46.8 54 114 A E H >< S+ 0 0 54 -4,-3.1 3,-0.7 1,-0.2 -1,-0.2 0.741 106.5 58.4 -72.1 -22.5 32.4 16.2 43.4 55 115 A L H >< S+ 0 0 2 -4,-2.0 3,-1.1 1,-0.2 -1,-0.2 0.588 86.4 80.1 -78.7 -12.3 33.8 19.4 45.0 56 116 A Q G X< S+ 0 0 68 -3,-0.8 3,-1.9 -4,-0.5 4,-0.3 0.691 74.2 72.4 -70.6 -19.8 36.3 17.4 47.0 57 117 A V G X S+ 0 0 63 -3,-0.7 3,-2.3 1,-0.3 -1,-0.2 0.781 79.9 77.1 -66.2 -21.5 38.7 17.1 44.1 58 118 A L G X S+ 0 0 18 -3,-1.1 3,-1.1 1,-0.3 11,-0.3 0.698 79.7 70.6 -57.3 -20.3 39.4 20.8 44.7 59 119 A H G < S+ 0 0 84 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.738 101.1 45.0 -66.2 -25.8 41.5 19.5 47.6 60 120 A E G < S+ 0 0 128 -3,-2.3 2,-1.2 -4,-0.3 -1,-0.2 0.233 85.1 103.5-100.1 10.7 43.9 18.3 45.0 61 121 A C < + 0 0 5 -3,-1.1 2,-0.8 -4,-0.1 -1,-0.1 -0.507 44.9 155.8 -91.7 67.9 43.8 21.5 42.9 62 122 A N + 0 0 119 -2,-1.2 5,-0.1 6,-0.1 6,-0.1 -0.836 11.3 126.6-102.1 105.4 47.1 23.0 44.0 63 123 A S > - 0 0 17 -2,-0.8 3,-1.5 3,-0.4 53,-0.0 -0.975 63.6-123.1-148.8 147.4 48.7 25.4 41.6 64 124 A P T 3 S+ 0 0 80 0, 0.0 80,-0.3 0, 0.0 52,-0.1 0.529 115.0 53.6 -68.8 -1.2 50.0 29.0 42.1 65 125 A Y T 3 S+ 0 0 66 50,-0.1 81,-2.7 80,-0.1 2,-0.4 0.284 98.4 72.6-114.0 7.6 47.5 30.0 39.4 66 126 A I B < S-e 146 0B 2 -3,-1.5 -3,-0.4 79,-0.3 81,-0.2 -0.981 89.2-108.6-124.5 132.8 44.4 28.5 40.9 67 127 A V - 0 0 9 79,-2.8 -2,-0.1 -2,-0.4 2,-0.1 -0.293 43.6-104.9 -55.2 141.4 42.6 29.8 44.0 68 128 A G - 0 0 23 -4,-0.1 16,-1.7 -6,-0.1 2,-0.4 -0.376 28.5-142.3 -70.2 150.8 43.1 27.7 47.1 69 129 A F E +D 83 0A 26 -11,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.951 22.2 173.9-115.8 133.7 40.3 25.4 48.4 70 130 A Y E - 0 0 83 12,-3.1 2,-0.3 -2,-0.4 13,-0.2 0.775 58.5 -55.5-103.2 -41.0 39.6 24.9 52.0 71 131 A G E -D 82 0A 6 11,-1.2 11,-2.7 -69,-0.1 2,-0.4 -0.952 37.4-128.6 171.0 168.8 36.4 22.8 52.0 72 132 A A E +D 81 0A 13 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -1.000 28.8 153.3-144.8 138.8 32.8 22.4 51.0 73 133 A F E -D 80 0A 23 7,-1.5 7,-2.7 -2,-0.4 2,-0.5 -0.945 36.0-111.8-156.4 168.9 29.6 21.6 52.9 74 134 A Y E +D 79 0A 71 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.959 36.8 157.6-116.4 130.7 25.8 22.0 52.9 75 135 A S E > -D 78 0A 27 3,-2.4 3,-1.0 -2,-0.5 -2,-0.1 -0.902 60.9 -12.9-154.8 121.2 23.9 24.1 55.3 76 136 A D T 3 S- 0 0 149 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.893 126.7 -42.4 67.1 47.0 20.4 25.8 55.3 77 137 A G T 3 S+ 0 0 18 1,-0.1 -36,-1.8 -34,-0.1 2,-0.4 0.378 120.7 96.4 83.1 -5.2 19.5 25.5 51.6 78 138 A E E < -CD 40 75A 47 -3,-1.0 -3,-2.4 -38,-0.2 2,-0.3 -0.968 64.9-137.9-131.0 137.2 23.0 26.5 50.5 79 139 A I E -CD 39 74A 0 -40,-1.8 -40,-2.4 -2,-0.4 2,-0.5 -0.607 26.3-151.3 -74.1 139.4 26.3 24.9 49.3 80 140 A S E -CD 38 73A 0 -7,-2.7 -7,-1.5 -2,-0.3 2,-0.5 -0.981 13.5-173.1-118.3 124.9 29.3 26.5 50.8 81 141 A I E -CD 37 72A 21 -44,-2.4 -44,-3.0 -2,-0.5 2,-0.6 -0.991 12.9-156.1-112.3 125.9 32.6 26.6 49.1 82 142 A C E +CD 36 71A 0 -11,-2.7 -12,-3.1 -2,-0.5 -11,-1.2 -0.907 20.4 174.1-105.2 121.0 35.3 28.0 51.2 83 143 A M E -CD 35 69A 21 -48,-3.1 -48,-2.5 -2,-0.6 -14,-0.2 -0.732 41.1 -78.4-119.4 166.1 38.3 29.5 49.4 84 144 A E E -C 34 0A 25 -16,-1.7 2,-0.5 -2,-0.2 -50,-0.1 -0.442 54.1-119.1 -52.7 128.1 41.6 31.4 49.9 85 145 A H - 0 0 44 -52,-0.6 2,-0.8 -2,-0.2 -1,-0.1 -0.693 21.0-152.4 -79.9 121.6 40.6 35.1 50.3 86 146 A M > - 0 0 13 -2,-0.5 3,-1.3 1,-0.1 52,-0.2 -0.882 3.7-162.3 -97.2 110.4 42.2 37.1 47.5 87 147 A D T 3 S+ 0 0 55 -2,-0.8 52,-0.2 1,-0.3 -1,-0.1 0.535 84.3 60.8 -76.3 -5.9 42.6 40.6 49.0 88 148 A G T 3 S- 0 0 6 50,-1.8 -1,-0.3 1,-0.3 51,-0.2 0.516 96.7-146.4 -93.4 -9.0 43.0 42.3 45.6 89 149 A G < - 0 0 16 -3,-1.3 49,-2.6 49,-0.5 -1,-0.3 -0.269 37.0 -36.2 74.0-163.7 39.6 41.2 44.4 90 150 A S B >> -F 137 0B 13 47,-0.2 4,-2.0 1,-0.1 3,-1.0 -0.577 52.3-113.1 -96.1 158.8 38.7 40.4 40.8 91 151 A L H 3> S+ 0 0 1 45,-2.5 4,-2.1 42,-1.3 43,-0.2 0.719 115.4 63.4 -66.3 -21.0 40.1 41.9 37.7 92 152 A D H 3> S+ 0 0 53 41,-0.8 4,-1.2 44,-0.3 -1,-0.3 0.874 107.7 43.9 -66.8 -33.6 36.7 43.4 36.9 93 153 A Q H <> S+ 0 0 68 -3,-1.0 4,-1.6 40,-0.2 -2,-0.2 0.902 113.6 48.1 -75.5 -44.6 37.0 45.4 40.1 94 154 A V H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.855 108.8 56.5 -67.3 -32.0 40.6 46.4 39.5 95 155 A L H X S+ 0 0 11 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.904 102.6 55.9 -58.5 -42.7 39.6 47.4 35.9 96 156 A K H < S+ 0 0 160 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.924 116.9 33.4 -60.3 -47.6 36.9 49.8 37.3 97 157 A K H < S+ 0 0 126 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.799 119.6 51.6 -80.8 -27.2 39.4 51.7 39.4 98 158 A A H < S- 0 0 29 -4,-2.6 2,-1.3 -5,-0.2 -2,-0.2 0.829 87.6-153.9 -71.7 -31.9 42.3 51.4 37.0 99 159 A G S < S+ 0 0 42 -4,-2.6 2,-0.3 -5,-0.2 -1,-0.2 -0.382 77.2 12.5 84.3 -53.0 40.2 52.6 34.1 100 160 A R S S- 0 0 87 -2,-1.3 97,-0.2 -6,-0.1 96,-0.1 -0.984 77.1-129.7-151.5 145.8 42.5 50.6 31.8 101 161 A I - 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0 0 38 -4,-0.8 -1,-0.1 -3,-0.5 0, 0.0 -0.990 66.1 -61.2 171.1-158.1 25.0 24.7 20.4 178 238 A T S S+ 0 0 122 -2,-0.3 2,-2.6 1,-0.1 -1,-0.1 0.550 91.2 103.4 -96.0 -13.2 26.6 21.8 22.3 179 239 A H + 0 0 176 -6,-0.2 2,-0.3 -3,-0.1 -1,-0.1 -0.383 62.3 98.3 -72.4 68.8 29.5 21.4 19.8 180 240 A Y + 0 0 66 -2,-2.6 2,-0.2 -6,-0.1 0, 0.0 -0.955 35.6 153.7-147.2 167.4 32.1 23.1 22.0 181 241 A S > - 0 0 65 -2,-0.3 3,-1.5 75,-0.0 4,-0.4 -0.662 64.6 -23.2-163.9-141.7 34.9 22.3 24.4 182 242 A V T >> S+ 0 0 36 1,-0.3 3,-1.6 -2,-0.2 4,-0.7 0.750 119.4 68.8 -64.4 -28.6 38.3 23.7 25.8 183 243 A Q H >> S+ 0 0 36 1,-0.3 4,-1.2 2,-0.2 3,-0.8 0.825 88.9 68.9 -57.9 -30.6 39.0 25.9 22.8 184 244 A S H <> S+ 0 0 2 -3,-1.5 4,-1.9 1,-0.2 -1,-0.3 0.805 89.8 60.1 -57.8 -33.3 36.0 27.9 24.0 185 245 A D H <> S+ 0 0 7 -3,-1.6 4,-2.4 -4,-0.4 -1,-0.2 0.860 99.7 57.4 -64.1 -34.0 38.0 29.1 27.0 186 246 A I H X S+ 0 0 8 -4,-1.9 4,-2.9 2,-0.2 3,-0.5 0.967 113.3 43.2 -64.9 -52.4 38.2 44.4 27.5 196 256 A M H 3< S+ 0 0 0 -4,-2.7 -95,-2.3 1,-0.3 -2,-0.2 0.821 114.3 51.9 -65.3 -33.1 40.8 45.0 30.1 197 257 A A H 3< S+ 0 0 0 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.770 118.8 36.2 -69.3 -29.0 43.2 46.5 27.6 198 258 A V H << S- 0 0 20 -4,-1.2 -2,-0.2 -3,-0.5 -3,-0.2 0.722 101.9-122.5-105.1 -26.7 40.5 48.9 26.3 199 259 A G S < S+ 0 0 34 -4,-2.9 2,-0.3 -5,-0.2 -3,-0.1 0.189 83.3 61.1 103.6 -17.0 38.5 49.9 29.4 200 260 A R S S- 0 0 68 -5,-0.4 -2,-0.2 -6,-0.3 -1,-0.2 -0.977 98.8 -84.0-140.1 154.0 35.1 48.8 28.2 201 261 A Y - 0 0 16 -2,-0.3 -9,-0.1 1,-0.1 2,-0.0 -0.406 50.8-131.0 -53.1 127.9 33.4 45.6 27.1 202 262 A P + 0 0 4 0, 0.0 32,-0.2 0, 0.0 -1,-0.1 0.109 60.0 121.3 -87.8 23.1 34.5 45.5 23.5 203 263 A I S S+ 0 0 9 1,-0.2 15,-0.1 2,-0.1 -2,-0.1 -0.988 73.7 28.5-133.9 126.9 31.2 44.9 21.6 204 264 A P S S- 0 0 52 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.583 109.1-119.8 -69.2 155.4 30.1 46.8 19.5 205 265 A P - 0 0 49 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.279 38.4 -80.8 -68.4 155.0 33.7 47.8 18.8 206 266 A P - 0 0 40 0, 0.0 2,-0.1 0, 0.0 5,-0.1 -0.373 46.7-132.2 -56.8 118.3 34.7 51.5 19.3 207 267 A D >> - 0 0 89 -2,-0.2 3,-3.1 -3,-0.1 4,-0.9 -0.417 37.0 -89.9 -69.3 152.1 33.6 53.6 16.3 208 268 A A T 34 S+ 0 0 82 1,-0.3 4,-0.3 2,-0.2 3,-0.3 0.686 127.1 48.5 -36.1 -40.8 36.2 55.9 14.8 209 269 A K T 34 S+ 0 0 165 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.715 106.1 57.5 -74.1 -24.4 35.2 58.9 17.1 210 270 A E T <4 S+ 0 0 86 -3,-3.1 -1,-0.2 1,-0.2 3,-0.2 0.688 98.6 57.1 -86.0 -21.1 35.2 56.8 20.3 211 271 A L S < S+ 0 0 89 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.569 89.6 78.6 -84.4 -10.9 38.8 55.6 20.1 212 272 A E S S+ 0 0 153 -4,-0.3 2,-1.9 -3,-0.2 -1,-0.2 0.927 77.1 74.8 -55.4 -50.9 39.8 59.3 20.0 213 273 A L + 0 0 150 -4,-0.5 2,-0.2 -3,-0.2 -1,-0.2 -0.493 65.8 118.5 -69.6 81.6 39.3 59.5 23.8 214 274 A M 0 0 56 -2,-1.9 -1,-0.1 0, 0.0 -3,-0.0 -0.722 360.0 360.0-150.6 96.4 42.5 57.6 24.8 215 275 A F 0 0 253 -2,-0.2 -2,-0.1 0, 0.0 -3,-0.0 -0.801 360.0 360.0-102.7 360.0 45.2 59.5 26.9 216 ! 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 0.0 217 307 A P 0 0 175 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-146.8 23.2 50.0 25.5 218 308 A M - 0 0 45 -52,-0.2 2,-0.1 -15,-0.1 -15,-0.0 -0.871 360.0-122.0-110.0 139.5 22.7 46.9 23.3 219 309 A A > - 0 0 59 -2,-0.4 4,-3.0 1,-0.1 5,-0.2 -0.345 29.6-105.4 -79.5 161.3 19.8 44.4 23.3 220 310 A I H > S+ 0 0 103 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.904 117.7 36.8 -54.2 -57.9 20.2 40.7 24.0 221 311 A F H > S+ 0 0 158 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.931 115.0 56.6 -63.7 -46.6 19.7 39.3 20.5 222 312 A E H > S+ 0 0 104 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.929 111.0 44.2 -44.2 -53.7 21.6 42.3 18.9 223 313 A L H X S+ 0 0 6 -4,-3.0 4,-2.2 2,-0.2 -1,-0.2 0.912 115.7 45.9 -64.0 -43.1 24.6 41.5 21.1 224 314 A L H X S+ 0 0 59 -4,-2.2 4,-2.3 -5,-0.2 5,-0.3 0.961 109.9 53.2 -69.7 -47.2 24.6 37.8 20.5 225 315 A D H X S+ 0 0 58 -4,-3.4 4,-3.0 1,-0.2 5,-0.5 0.874 108.0 53.8 -52.2 -40.2 24.0 38.1 16.7 226 316 A Y H X S+ 0 0 52 -4,-1.9 4,-2.7 -5,-0.3 -1,-0.2 0.982 107.7 48.8 -56.2 -58.3 27.1 40.4 16.8 227 317 A I H < S+ 0 0 3 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.891 121.7 33.6 -49.1 -50.1 29.3 37.8 18.5 228 318 A V H < S+ 0 0 27 -4,-2.3 -1,-0.2 1,-0.1 -2,-0.2 0.817 130.2 27.9 -81.8 -30.8 28.3 35.0 16.1 229 319 A N H < S+ 0 0 104 -4,-3.0 -3,-0.2 -5,-0.3 -2,-0.2 0.643 104.8 69.9-111.6 -15.8 27.8 36.8 12.8 230 320 A E S < S- 0 0 94 -4,-2.7 0, 0.0 -5,-0.5 0, 0.0 -0.700 93.8 -83.9-106.5 156.6 30.0 39.8 12.8 231 321 A P - 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.318 59.2 -99.2 -62.2 143.1 33.8 40.0 12.5 232 322 A P - 0 0 52 0, 0.0 21,-0.0 0, 0.0 20,-0.0 0.056 40.1 -89.5 -59.1 162.3 35.5 39.6 16.0 233 323 A P - 0 0 5 0, 0.0 2,-0.3 0, 0.0 19,-0.1 -0.316 45.8-173.3 -70.1 159.3 36.8 42.4 18.2 234 324 A K - 0 0 150 -32,-0.2 11,-0.1 -40,-0.1 3,-0.1 -0.985 29.6 -95.3-150.4 153.6 40.4 43.5 17.8 235 325 A L - 0 0 4 -2,-0.3 2,-0.1 10,-0.2 -41,-0.0 -0.412 46.4-108.0 -63.5 142.3 42.9 45.8 19.5 236 326 A P - 0 0 30 0, 0.0 4,-0.4 0, 0.0 2,-0.1 -0.476 40.7-110.4 -63.2 150.2 43.2 49.3 18.1 237 327 A S S S+ 0 0 101 1,-0.2 2,-0.9 -2,-0.1 4,-0.1 -0.412 88.6 28.1 -82.0 160.1 46.4 49.8 16.2 238 328 A G S S+ 0 0 73 2,-0.4 -1,-0.2 1,-0.1 4,-0.1 -0.350 109.0 61.4 96.2 -53.3 49.2 52.1 17.4 239 329 A V S S+ 0 0 90 -2,-0.9 2,-0.3 -3,-0.1 -1,-0.1 0.521 101.2 53.3 -94.7 -5.7 48.8 52.1 21.2 240 330 A F S S- 0 0 16 -4,-0.4 -2,-0.4 -137,-0.0 5,-0.0 -0.961 95.1 -97.5-125.2 148.1 49.4 48.3 21.7 241 331 A S > - 0 0 29 -2,-0.3 4,-2.3 1,-0.1 3,-0.1 -0.216 27.0-119.5 -64.4 152.9 52.4 46.3 20.5 242 332 A L H > S+ 0 0 132 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.797 114.1 55.0 -60.7 -30.2 52.1 44.2 17.2 243 333 A E H > S+ 0 0 86 2,-0.2 4,-2.0 1,-0.2 27,-0.4 0.882 108.0 46.6 -74.9 -40.9 52.8 41.1 19.3 244 334 A F H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.909 110.3 55.2 -61.9 -44.0 49.9 41.7 21.7 245 335 A Q H X S+ 0 0 31 -4,-2.3 4,-2.5 1,-0.2 -10,-0.2 0.935 111.0 42.8 -58.0 -49.1 47.7 42.4 18.7 246 336 A D H X S+ 0 0 65 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.884 110.6 58.1 -61.8 -41.6 48.4 39.1 17.0 247 337 A F H X S+ 0 0 0 -4,-2.0 4,-1.3 2,-0.2 3,-0.3 0.968 111.9 38.4 -56.3 -56.8 48.1 37.3 20.3 248 338 A V H >X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 3,-0.6 0.915 112.9 59.7 -63.1 -36.6 44.6 38.5 20.9 249 339 A N H 3< S+ 0 0 70 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.873 104.7 48.8 -56.7 -38.3 43.9 38.0 17.2 250 340 A K H 3< S+ 0 0 80 -4,-2.5 10,-2.3 -3,-0.3 3,-0.5 0.749 111.4 50.7 -73.8 -25.0 44.8 34.3 17.5 251 341 A C H << S+ 0 0 0 -4,-1.3 -2,-0.2 -3,-0.6 -1,-0.2 0.814 108.2 51.6 -75.6 -36.3 42.5 34.0 20.5 252 342 A L S < S+ 0 0 3 -4,-2.0 2,-0.4 -5,-0.1 -1,-0.2 -0.056 71.6 132.1-101.2 31.5 39.5 35.6 18.9 253 343 A I - 0 0 37 -3,-0.5 6,-0.2 1,-0.1 5,-0.0 -0.701 55.1-137.6 -78.2 134.4 39.3 33.5 15.7 254 344 A K S S+ 0 0 59 -2,-0.4 -81,-0.3 4,-0.1 -1,-0.1 0.896 84.4 74.5 -62.5 -45.6 35.7 32.4 15.2 255 345 A N S >> S- 0 0 81 1,-0.2 4,-2.7 -83,-0.1 3,-1.4 -0.595 74.2-149.1 -76.5 115.5 36.3 28.8 14.1 256 346 A P T 34 S+ 0 0 44 0, 0.0 -1,-0.2 0, 0.0 -70,-0.1 0.709 95.0 52.2 -65.6 -19.7 37.4 26.9 17.2 257 347 A A T 34 S+ 0 0 93 1,-0.1 4,-0.1 4,-0.0 -2,-0.1 0.697 112.9 44.9 -83.5 -23.0 39.7 24.5 15.3 258 348 A E T <4 S+ 0 0 138 -3,-1.4 -1,-0.1 2,-0.1 3,-0.1 0.853 94.1 98.3 -86.9 -40.4 41.5 27.4 13.7 259 349 A R S < S- 0 0 4 -4,-2.7 -8,-0.2 -6,-0.2 -9,-0.1 -0.013 87.8 -98.4 -38.8 143.8 41.8 29.3 17.0 260 350 A A - 0 0 3 -10,-2.3 2,-0.2 -13,-0.1 -1,-0.1 -0.354 39.6-145.6 -65.7 151.6 45.1 29.0 18.8 261 351 A D >> - 0 0 53 -3,-0.1 4,-2.2 -4,-0.1 3,-1.1 -0.701 31.4 -92.0-113.0 173.3 45.2 26.5 21.6 262 352 A L H 3> S+ 0 0 22 1,-0.3 4,-2.4 -2,-0.2 5,-0.2 0.880 123.2 59.3 -49.9 -45.3 47.0 26.6 25.0 263 353 A K H 3> S+ 0 0 172 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.844 112.8 39.2 -49.8 -40.1 50.0 24.7 23.5 264 354 A Q H <4 S+ 0 0 109 -3,-1.1 -1,-0.2 2,-0.2 -2,-0.2 0.838 113.1 51.3 -85.6 -39.2 50.5 27.5 20.9 265 355 A L H >< S+ 0 0 1 -4,-2.2 3,-2.0 1,-0.2 6,-0.3 0.873 102.0 63.9 -66.7 -37.4 49.8 30.6 23.1 266 356 A M H 3< S+ 0 0 60 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.891 110.5 37.3 -49.5 -45.3 52.3 29.3 25.6 267 357 A V T 3< S+ 0 0 103 -4,-0.7 -1,-0.3 -3,-0.2 2,-0.2 0.037 91.4 130.7-100.6 24.4 55.1 29.6 23.1 268 358 A H <> - 0 0 22 -3,-2.0 4,-2.6 1,-0.1 3,-0.3 -0.565 69.4-118.2 -81.1 144.2 53.8 32.9 21.5 269 359 A A H > S+ 0 0 41 1,-0.2 4,-2.6 -2,-0.2 5,-0.2 0.828 114.9 54.2 -45.6 -41.2 56.0 35.9 21.0 270 360 A F H > S+ 0 0 0 -27,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.948 111.1 43.9 -62.2 -50.3 53.9 38.0 23.4 271 361 A I H > S+ 0 0 9 -6,-0.3 4,-2.5 -3,-0.3 -2,-0.2 0.879 114.0 50.5 -61.1 -40.3 54.2 35.4 26.2 272 362 A K H X S+ 0 0 133 -4,-2.6 4,-1.0 1,-0.2 -2,-0.2 0.909 113.9 45.3 -67.6 -39.8 57.9 35.0 25.6 273 363 A R H X S+ 0 0 71 -4,-2.6 4,-0.9 -5,-0.3 -2,-0.2 0.828 115.6 47.1 -68.8 -35.1 58.3 38.8 25.7 274 364 A S H < S+ 0 0 0 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.859 105.6 58.1 -75.2 -36.6 56.1 39.1 28.8 275 365 A D H < S+ 0 0 97 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.812 108.1 46.5 -63.5 -34.8 57.8 36.3 30.7 276 366 A A H < S+ 0 0 84 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.808 91.2 107.1 -74.7 -34.3 61.2 38.0 30.5 277 367 A E < - 0 0 39 -4,-0.9 2,-1.0 1,-0.1 -3,-0.0 -0.118 69.9-131.3 -58.6 142.7 59.9 41.4 31.5 278 368 A E + 0 0 191 2,-0.1 2,-0.5 0, 0.0 -1,-0.1 -0.790 41.2 164.4 -98.3 91.1 60.6 42.9 35.0 279 369 A V - 0 0 33 -2,-1.0 2,-1.4 -5,-0.1 3,-0.2 -0.950 35.8-148.8-119.7 123.4 57.2 44.0 36.2 280 370 A D > + 0 0 115 -2,-0.5 4,-2.0 1,-0.2 5,-0.1 -0.679 28.5 165.8 -86.9 83.4 56.3 44.8 39.8 281 371 A F H > S+ 0 0 11 -2,-1.4 4,-3.3 2,-0.2 5,-0.2 0.955 74.0 55.3 -64.7 -51.6 52.6 43.7 39.7 282 372 A A H > S+ 0 0 27 1,-0.2 4,-1.6 -3,-0.2 5,-0.2 0.914 110.9 46.2 -42.4 -54.9 52.3 43.8 43.5 283 373 A G H > S+ 0 0 32 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.860 114.2 46.9 -58.8 -42.2 53.4 47.4 43.4 284 374 A W H X S+ 0 0 48 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.889 106.4 58.9 -68.6 -41.1 51.2 48.4 40.6 285 375 A L H X S+ 0 0 0 -4,-3.3 4,-1.8 2,-0.2 -2,-0.2 0.888 113.3 37.0 -57.9 -42.2 48.1 46.7 42.1 286 376 A C H X S+ 0 0 22 -4,-1.6 4,-3.2 -5,-0.2 -1,-0.2 0.926 107.7 62.9 -79.3 -45.1 48.3 48.8 45.2 287 377 A S H < S+ 0 0 111 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.782 116.0 35.9 -44.4 -30.2 49.3 52.0 43.5 288 378 A T H < S+ 0 0 47 -4,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.803 129.3 27.4 -98.4 -34.3 45.9 51.7 41.7 289 379 A I H < S- 0 0 37 -4,-1.8 -3,-0.2 -5,-0.2 -2,-0.2 0.510 97.3-126.6-109.0 -7.5 43.5 50.2 44.4 290 380 A G < + 0 0 61 -4,-3.2 -3,-0.1 -5,-0.2 -4,-0.1 0.987 47.9 155.5 61.4 72.1 45.1 51.5 47.6 291 381 A L 0 0 67 -5,-0.0 -5,-0.1 -151,-0.0 -4,-0.1 0.665 360.0 360.0 -97.4 -21.2 45.6 48.4 49.8 292 382 A N 0 0 168 -6,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.699 360.0 360.0-108.9 360.0 48.5 49.8 51.9