==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-JAN-10 3LIJ . COMPND 2 MOLECULE: CALCIUM/CALMODULIN DEPENDENT PROTEIN KINASE WITH . SOURCE 2 ORGANISM_SCIENTIFIC: CRYPTOSPORIDIUM PARVUM; . AUTHOR W.QIU,A.HUTCHINSON,A.WERNIMONT,J.R.WALKER,H.SULLIVAN,Y.- . 465 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23192.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 301 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 27 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 162 34.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 4 1 2 1 3 0 3 3 0 2 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 . 3 3 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 3 0 1 0 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 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 38 A Y 0 0 130 0, 0.0 2,-0.3 0, 0.0 437,-0.1 0.000 360.0 360.0 360.0 149.5 16.7 0.9 -11.5 2 39 A F > - 0 0 158 1,-0.0 3,-1.1 436,-0.0 4,-0.4 -0.764 360.0-107.8-112.8 172.1 13.8 2.2 -13.5 3 40 A Q G > S+ 0 0 52 -2,-0.3 3,-1.2 1,-0.2 -1,-0.0 0.844 117.1 65.5 -65.6 -32.0 11.0 4.5 -12.3 4 41 A G G 3 S+ 0 0 57 1,-0.2 -1,-0.2 3,-0.0 297,-0.0 0.465 95.9 58.9 -67.4 -5.8 8.6 1.5 -12.4 5 42 A D G < S+ 0 0 79 -3,-1.1 -1,-0.2 2,-0.0 -2,-0.2 0.662 84.7 98.4 -94.4 -25.3 10.6 -0.2 -9.6 6 43 A L < - 0 0 6 -3,-1.2 2,-0.4 -4,-0.4 -3,-0.0 -0.357 58.3-154.4 -69.2 146.3 10.1 2.6 -7.0 7 44 A Q - 0 0 94 372,-0.1 2,-0.6 -2,-0.1 372,-0.2 -0.982 7.9-148.5-126.5 121.6 7.5 2.3 -4.3 8 45 A A + 0 0 0 370,-0.7 421,-0.1 -2,-0.4 370,-0.0 -0.800 32.2 164.7 -87.6 117.6 5.8 5.2 -2.5 9 46 A T > - 0 0 41 -2,-0.6 3,-1.1 369,-0.1 4,-0.3 -0.977 46.9-125.0-130.9 148.4 5.0 4.0 1.1 10 47 A P G > S+ 0 0 25 0, 0.0 3,-1.0 0, 0.0 62,-0.1 0.823 109.9 61.6 -63.2 -27.6 4.0 6.1 4.3 11 48 A G G > S+ 0 0 10 1,-0.2 3,-1.6 2,-0.2 61,-0.1 0.702 86.1 72.2 -69.0 -24.3 6.9 4.4 6.1 12 49 A M G < S+ 0 0 19 -3,-1.1 -1,-0.2 1,-0.3 60,-0.0 0.701 87.2 65.9 -66.7 -18.5 9.6 5.8 3.8 13 50 A F G < S+ 0 0 6 -3,-1.0 2,-0.5 -4,-0.3 -1,-0.3 0.472 91.7 73.8 -81.6 -2.4 9.0 9.3 5.4 14 51 A I < + 0 0 1 -3,-1.6 2,-0.3 69,-0.1 -1,-0.1 -0.962 58.3 146.4-120.4 118.8 10.4 8.0 8.6 15 52 A T - 0 0 74 -2,-0.5 2,-0.5 69,-0.4 69,-0.3 -0.975 57.4 -91.5-146.1 148.7 14.1 7.4 8.9 16 53 A S + 0 0 76 -2,-0.3 2,-0.3 69,-0.1 69,-0.1 -0.537 60.3 167.4 -67.9 111.7 16.7 7.8 11.8 17 54 A K - 0 0 58 -2,-0.5 69,-2.2 67,-0.4 2,-0.4 -0.921 39.0-109.3-129.2 156.1 17.9 11.4 11.5 18 55 A K B +a 86 0A 197 -2,-0.3 2,-0.3 67,-0.2 69,-0.2 -0.707 53.5 143.7 -85.9 132.9 19.9 13.8 13.6 19 56 A G - 0 0 4 67,-2.1 2,-0.4 -2,-0.4 66,-0.1 -0.986 42.7-126.8-166.1 160.3 17.9 16.7 15.0 20 57 A H > - 0 0 91 -2,-0.3 4,-0.8 1,-0.1 5,-0.2 -0.909 17.9-138.0-114.3 140.9 17.3 19.1 17.9 21 58 A L H >> S+ 0 0 35 -2,-0.4 4,-3.2 1,-0.2 3,-0.9 0.942 106.0 47.7 -60.0 -52.6 13.9 19.7 19.6 22 59 A S H 34 S+ 0 0 85 1,-0.2 -1,-0.2 2,-0.2 21,-0.0 0.684 102.3 66.1 -62.9 -25.0 14.2 23.5 19.8 23 60 A E H 34 S+ 0 0 132 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.2 0.831 124.5 8.7 -66.7 -36.3 15.4 23.7 16.1 24 61 A M H << S+ 0 0 48 -3,-0.9 19,-2.4 -4,-0.8 20,-0.3 0.641 125.0 48.1-121.3 -22.2 11.9 22.5 14.8 25 62 A Y E < -B 42 0A 4 -4,-3.2 2,-0.4 17,-0.2 17,-0.2 -0.929 58.9-143.6-128.9 151.7 9.4 22.5 17.8 26 63 A Q E -B 41 0A 93 15,-2.4 15,-2.8 -2,-0.3 2,-0.2 -0.947 29.5-119.3-112.0 128.4 8.4 24.8 20.6 27 64 A R E +B 40 0A 146 -2,-0.4 13,-0.2 13,-0.2 3,-0.1 -0.493 36.6 167.9 -68.0 128.9 7.5 23.2 24.0 28 65 A V E - 0 0 73 11,-2.6 2,-0.3 1,-0.3 12,-0.2 0.809 58.2 -30.4-105.1 -63.1 3.9 23.9 25.1 29 66 A K E -B 39 0A 115 10,-1.1 10,-2.9 0, 0.0 2,-0.4 -0.984 59.5 -96.2-158.7 157.5 3.1 21.6 28.1 30 67 A K E +B 38 0A 115 -2,-0.3 8,-0.2 8,-0.2 3,-0.1 -0.649 33.4 176.0 -78.8 126.5 4.0 18.2 29.7 31 68 A L E + 0 0 90 6,-2.8 2,-0.3 -2,-0.4 7,-0.2 0.696 63.1 11.3-102.5 -30.1 1.4 15.6 28.8 32 69 A G E B 37 0A 21 5,-2.2 5,-1.6 1,-0.1 -1,-0.3 -0.995 360.0 360.0-154.4 152.9 3.0 12.5 30.4 33 70 A S 0 0 127 -2,-0.3 -1,-0.1 3,-0.2 5,-0.0 0.510 360.0 360.0-114.3 360.0 5.7 11.3 32.8 34 ! 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 35 74 A G 0 0 68 0, 0.0 2,-0.3 0, 0.0 19,-0.2 0.000 360.0 360.0 360.0 111.4 10.1 8.5 29.2 36 75 A E E - C 0 53A 61 17,-0.8 17,-3.3 2,-0.0 2,-0.5 -0.889 360.0-149.1-161.6 126.0 8.2 11.8 28.8 37 76 A V E -BC 32 52A 34 -5,-1.6 -6,-2.8 -2,-0.3 -5,-2.2 -0.894 24.5-174.8-101.1 122.7 5.2 12.9 26.6 38 77 A L E -BC 30 51A 2 13,-2.7 13,-3.1 -2,-0.5 2,-0.5 -0.979 25.4-135.0-126.2 131.7 5.4 16.5 25.6 39 78 A L E +BC 29 50A 9 -10,-2.9 -11,-2.6 -2,-0.4 -10,-1.1 -0.739 37.5 179.5 -82.5 119.7 2.9 18.7 23.7 40 79 A C E -BC 27 49A 0 9,-2.8 9,-2.9 -2,-0.5 2,-0.5 -0.923 25.0-135.9-126.6 153.9 4.9 20.7 21.1 41 80 A R E -BC 26 48A 71 -15,-2.8 -15,-2.4 -2,-0.3 7,-0.2 -0.945 25.7-120.0-113.6 124.8 4.2 23.3 18.4 42 81 A D E > -B 25 0A 18 5,-2.8 4,-1.9 -2,-0.5 -17,-0.2 -0.460 19.4-142.8 -61.5 121.5 5.8 23.1 14.9 43 82 A K T 4 S+ 0 0 93 -19,-2.4 -1,-0.1 -2,-0.2 -18,-0.1 0.636 95.0 35.5 -64.6 -16.4 7.8 26.3 14.4 44 83 A V T 4 S+ 0 0 91 -20,-0.3 -1,-0.1 3,-0.1 -19,-0.1 0.872 131.3 23.6-100.9 -56.6 6.9 26.6 10.7 45 84 A T T 4 S- 0 0 42 2,-0.1 -2,-0.2 362,-0.0 3,-0.1 0.552 90.3-134.2 -88.4 -15.6 3.3 25.2 10.3 46 85 A H < + 0 0 115 -4,-1.9 2,-0.2 1,-0.3 -3,-0.1 0.473 52.8 149.9 69.0 8.4 2.1 25.9 13.9 47 86 A V - 0 0 69 -6,-0.1 -5,-2.8 1,-0.1 2,-0.4 -0.508 44.6-131.0 -70.2 130.4 0.6 22.3 14.0 48 87 A E E -C 41 0A 101 -7,-0.2 49,-0.5 -2,-0.2 2,-0.3 -0.739 30.3-179.8 -90.2 132.8 0.7 20.9 17.5 49 88 A R E -CD 40 96A 14 -9,-2.9 -9,-2.8 -2,-0.4 2,-0.6 -0.927 31.0-116.0-131.1 155.7 2.1 17.3 17.9 50 89 A A E -CD 39 95A 9 45,-2.1 45,-3.2 -2,-0.3 2,-0.6 -0.840 31.2-163.0 -93.9 118.5 2.7 14.8 20.8 51 90 A I E -CD 38 94A 0 -13,-3.1 -13,-2.7 -2,-0.6 2,-0.7 -0.935 7.9-155.7-109.8 118.4 6.4 14.1 21.2 52 91 A K E -CD 37 93A 42 41,-2.4 41,-2.3 -2,-0.6 2,-0.7 -0.852 11.6-158.4 -93.7 110.9 7.5 11.0 23.2 53 92 A I E -CD 36 92A 14 -17,-3.3 -17,-0.8 -2,-0.7 2,-0.5 -0.861 11.7-177.2 -94.8 110.5 11.0 11.7 24.5 54 93 A I E - D 0 91A 44 37,-2.3 37,-2.8 -2,-0.7 -2,-0.0 -0.961 20.8-132.1-115.5 116.9 12.9 8.4 25.3 55 94 A R E D 0 90A 178 -2,-0.5 35,-0.3 35,-0.2 34,-0.0 -0.298 360.0 360.0 -66.2 146.5 16.4 8.7 26.8 56 95 A K 0 0 85 33,-3.1 -1,-0.1 -2,-0.0 4,-0.0 -0.559 360.0 360.0 -77.7 360.0 19.3 6.6 25.5 57 ! 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 58 101 A S > 0 0 136 0, 0.0 3,-0.7 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 133.0 22.5 -2.6 21.9 59 102 A S T > + 0 0 108 1,-0.2 3,-0.5 2,-0.1 4,-0.2 0.653 360.0 60.7 -78.7 -19.2 20.1 -1.7 24.7 60 103 A N T 3> S+ 0 0 44 1,-0.2 4,-1.4 2,-0.1 3,-0.4 0.315 76.8 95.0 -89.9 5.1 18.4 0.9 22.4 61 104 A S H <> S+ 0 0 44 -3,-0.7 4,-2.0 1,-0.2 -1,-0.2 0.771 75.1 62.4 -66.0 -31.7 17.4 -1.9 19.9 62 105 A K H <> S+ 0 0 152 -3,-0.5 4,-1.4 2,-0.2 -1,-0.2 0.859 105.2 45.9 -63.2 -39.6 13.9 -2.3 21.5 63 106 A L H > S+ 0 0 15 -3,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.896 110.6 52.1 -69.8 -45.7 13.0 1.3 20.5 64 107 A L H X S+ 0 0 70 -4,-1.4 4,-2.4 2,-0.2 -2,-0.2 0.877 109.9 49.5 -59.9 -39.2 14.3 1.0 16.9 65 108 A E H X S+ 0 0 128 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.865 111.4 50.0 -66.6 -37.1 12.2 -2.2 16.5 66 109 A E H X S+ 0 0 29 -4,-1.4 4,-3.1 2,-0.2 3,-0.2 0.905 110.9 48.1 -67.0 -43.3 9.2 -0.2 17.9 67 110 A V H X S+ 0 0 6 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.899 107.7 56.4 -63.0 -40.5 9.9 2.7 15.4 68 111 A A H < S+ 0 0 51 -4,-2.4 4,-0.4 1,-0.2 -1,-0.2 0.815 113.8 40.3 -59.8 -32.8 10.1 0.0 12.6 69 112 A V H >X S+ 0 0 14 -4,-1.2 3,-1.0 -3,-0.2 4,-0.9 0.928 113.3 53.9 -78.4 -51.7 6.6 -1.1 13.6 70 113 A L H 3< S+ 0 0 4 -4,-3.1 11,-0.4 1,-0.2 3,-0.4 0.795 102.8 56.3 -53.2 -39.6 5.2 2.5 14.1 71 114 A K T 3< S+ 0 0 59 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.1 0.786 105.6 52.1 -66.6 -29.0 6.2 3.7 10.7 72 115 A L T <4 S+ 0 0 98 -3,-1.0 2,-0.3 -4,-0.4 -1,-0.2 0.737 81.3 112.9 -75.3 -30.2 4.2 0.9 9.0 73 116 A L < + 0 0 7 -4,-0.9 8,-0.3 -3,-0.4 2,-0.2 -0.314 31.8 155.5 -54.9 109.1 1.0 1.8 10.9 74 117 A D + 0 0 15 -2,-0.3 312,-0.5 6,-0.1 313,-0.1 -0.701 23.2 114.9-143.2 81.9 -1.6 3.1 8.4 75 118 A H > - 0 0 6 3,-0.4 3,-2.0 -2,-0.2 53,-0.0 -0.989 68.5-120.2-151.8 140.1 -5.2 2.6 9.6 76 119 A P T 3 S+ 0 0 1 0, 0.0 -1,-0.1 0, 0.0 81,-0.1 0.749 115.8 45.4 -53.1 -25.5 -8.0 5.0 10.6 77 120 A N T 3 S+ 0 0 2 82,-0.1 83,-2.5 47,-0.1 2,-0.4 0.223 102.0 77.6-104.8 13.3 -8.1 3.4 14.1 78 121 A I B < S-f 160 0B 4 -3,-2.0 -3,-0.4 81,-0.3 83,-0.2 -0.968 86.5 -96.7-126.6 144.1 -4.3 3.3 14.8 79 122 A M - 0 0 7 81,-2.5 2,-0.4 -2,-0.4 -4,-0.2 -0.015 34.9-134.3 -52.1 152.1 -1.9 6.1 15.9 80 123 A K - 0 0 40 16,-0.2 16,-2.3 -6,-0.1 2,-0.6 -0.937 3.1-144.8-117.0 134.8 0.1 7.9 13.3 81 124 A L E - E 0 95A 2 -2,-0.4 14,-0.3 -11,-0.4 3,-0.1 -0.913 14.2-175.8 -99.4 117.4 3.9 8.7 13.6 82 125 A Y E - 0 0 18 12,-2.2 2,-0.3 -2,-0.6 13,-0.2 0.899 63.0 -15.0 -77.9 -48.2 4.6 12.1 11.9 83 126 A D E - E 0 94A 7 11,-1.7 11,-2.4 -69,-0.1 2,-0.3 -0.963 50.7-148.3-153.6 165.7 8.4 12.1 12.3 84 127 A F E + E 0 93A 4 -69,-0.3 -69,-0.4 -2,-0.3 -67,-0.4 -0.978 26.2 153.5-144.1 126.5 11.4 10.5 14.1 85 128 A F E - E 0 92A 0 7,-1.7 7,-3.0 -2,-0.3 2,-0.3 -0.946 21.9-145.2-147.3 163.6 14.7 12.1 15.1 86 129 A E E -aE 18 91A 39 -69,-2.2 -67,-2.1 -2,-0.3 5,-0.2 -0.970 5.2-162.6-139.5 154.1 17.5 11.7 17.7 87 130 A D - 0 0 34 3,-2.9 -67,-0.1 -2,-0.3 5,-0.0 -0.522 48.6 -88.0-115.3-175.6 20.0 13.7 19.8 88 131 A K S S+ 0 0 173 -2,-0.2 3,-0.1 1,-0.1 -70,-0.0 0.619 127.1 19.6 -71.1 -14.8 23.2 12.7 21.7 89 132 A R S S+ 0 0 190 1,-0.2 -33,-3.1 -34,-0.0 2,-0.3 0.632 121.6 42.5-126.2 -32.1 21.0 11.8 24.8 90 133 A N E -D 55 0A 43 -35,-0.3 -3,-2.9 2,-0.0 2,-0.4 -0.877 58.6-135.5-128.0 160.5 17.3 11.2 23.6 91 134 A Y E -DE 54 86A 16 -37,-2.8 -37,-2.3 -2,-0.3 2,-0.6 -0.884 24.2-147.7-105.7 137.4 15.1 9.6 20.9 92 135 A Y E -DE 53 85A 12 -7,-3.0 -7,-1.7 -2,-0.4 2,-0.8 -0.919 11.8-171.2-119.5 109.7 12.2 11.8 19.6 93 136 A L E -DE 52 84A 1 -41,-2.3 -41,-2.4 -2,-0.6 2,-0.8 -0.860 11.7-158.6 -99.0 101.1 8.9 10.1 18.5 94 137 A V E -DE 51 83A 0 -11,-2.4 -12,-2.2 -2,-0.8 -11,-1.7 -0.777 19.3-176.6 -87.1 109.3 6.8 12.8 16.8 95 138 A M E -DE 50 81A 17 -45,-3.2 -45,-2.1 -2,-0.8 -14,-0.2 -0.811 34.2-100.3-111.2 150.6 3.2 11.6 16.9 96 139 A E E -D 49 0A 48 -16,-2.3 2,-0.4 -2,-0.3 -16,-0.2 -0.468 48.6-118.4 -64.4 130.4 -0.1 12.9 15.6 97 140 A C - 0 0 36 -49,-0.5 2,-0.5 -2,-0.1 -1,-0.1 -0.667 24.5-162.7 -82.4 129.5 -1.9 14.6 18.5 98 141 A Y - 0 0 28 -2,-0.4 3,-0.3 1,-0.1 53,-0.2 -0.969 6.4-176.0-114.4 118.1 -5.3 13.2 19.7 99 142 A K + 0 0 130 51,-1.5 52,-0.2 -2,-0.5 51,-0.2 0.302 60.4 87.6-100.4 8.5 -7.3 15.6 21.9 100 143 A G S S- 0 0 6 49,-2.3 50,-0.2 1,-0.3 -1,-0.2 0.398 89.6-124.2 -87.1 1.8 -10.4 13.5 22.9 101 144 A G - 0 0 21 48,-0.4 48,-3.2 -3,-0.3 -1,-0.3 -0.143 40.4 -50.1 80.6-179.6 -8.8 11.9 25.9 102 145 A E B > -G 148 0B 65 46,-0.2 4,-1.2 1,-0.1 3,-0.5 -0.524 43.9-119.7 -83.4 160.2 -8.4 8.2 26.7 103 146 A L H > S+ 0 0 0 44,-2.9 4,-2.3 41,-1.2 42,-0.2 0.844 116.3 66.4 -66.2 -28.5 -11.4 5.7 26.6 104 147 A F H > S+ 0 0 76 40,-1.4 4,-2.1 43,-0.3 -1,-0.2 0.872 97.5 51.7 -55.2 -44.9 -10.6 5.2 30.3 105 148 A D H > S+ 0 0 59 -3,-0.5 4,-2.2 39,-0.2 -1,-0.2 0.898 109.2 49.5 -60.2 -45.9 -11.6 8.9 31.0 106 149 A E H X S+ 0 0 49 -4,-1.2 4,-3.3 2,-0.2 5,-0.4 0.874 109.1 52.7 -62.9 -38.5 -15.0 8.3 29.2 107 150 A I H X S+ 0 0 16 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.912 110.5 47.5 -63.5 -42.5 -15.5 5.1 31.2 108 151 A I H < S+ 0 0 101 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.904 119.7 39.2 -64.8 -41.1 -14.9 7.1 34.5 109 152 A H H < S+ 0 0 151 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.891 127.2 32.0 -75.7 -45.6 -17.3 9.9 33.4 110 153 A R H < S- 0 0 107 -4,-3.3 2,-0.9 -5,-0.1 -3,-0.2 0.747 84.2-159.6 -81.5 -32.9 -20.1 7.8 31.7 111 154 A M S < S+ 0 0 137 -4,-2.2 2,-0.3 -5,-0.4 -4,-0.1 -0.102 70.0 18.7 73.1 -28.0 -19.7 4.8 34.1 112 155 A K S S- 0 0 107 -2,-0.9 2,-0.3 101,-0.0 99,-0.2 -0.959 72.5-135.6-164.8 150.0 -21.4 2.4 31.5 113 156 A F - 0 0 9 97,-3.2 100,-0.0 -2,-0.3 -6,-0.0 -0.875 21.1-118.7-112.2 145.8 -22.2 2.4 27.8 114 157 A N > - 0 0 88 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.250 40.0 -99.8 -72.1 168.2 -25.4 1.4 26.0 115 158 A E H > S+ 0 0 39 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.868 121.7 48.5 -59.8 -40.0 -25.1 -1.6 23.6 116 159 A V H > S+ 0 0 31 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.935 114.0 46.0 -65.3 -48.4 -24.9 0.6 20.4 117 160 A D H > S+ 0 0 47 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.894 113.9 48.7 -61.6 -43.3 -22.2 2.9 21.9 118 161 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.871 112.2 49.1 -63.6 -42.1 -20.2 -0.1 23.2 119 162 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.887 108.8 52.3 -65.6 -42.1 -20.4 -1.9 19.7 120 163 A V H X S+ 0 0 27 -4,-2.2 4,-1.0 2,-0.2 -2,-0.2 0.901 115.5 41.7 -61.3 -43.6 -19.3 1.3 17.8 121 164 A I H >X S+ 0 0 13 -4,-1.9 4,-1.7 2,-0.2 3,-0.5 0.951 115.9 48.0 -68.2 -54.1 -16.2 1.6 20.1 122 165 A I H 3X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.826 105.7 57.5 -60.6 -34.8 -15.4 -2.1 20.1 123 166 A K H 3X S+ 0 0 67 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.872 108.1 49.3 -62.3 -36.7 -15.7 -2.5 16.3 124 167 A Q H <>S+ 0 0 0 -4,-2.2 5,-3.0 1,-0.2 3,-0.7 0.920 112.4 46.7 -57.6 -50.4 -2.2 -5.4 13.3 133 176 A H H ><5S+ 0 0 26 -4,-2.7 3,-1.6 1,-0.2 -1,-0.2 0.859 108.7 54.6 -61.7 -38.4 -2.6 -9.2 13.4 134 177 A K H 3<5S+ 0 0 97 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.721 109.7 48.8 -66.1 -24.5 -2.7 -9.4 9.5 135 178 A H T <<5S- 0 0 63 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.081 124.2-107.9-101.5 19.7 0.7 -7.5 9.5 136 179 A N T < 5S+ 0 0 49 -3,-1.6 33,-2.5 1,-0.2 2,-0.4 0.720 76.2 135.8 57.1 32.6 2.1 -9.9 12.2 137 180 A I E < -I 168 0C 10 -5,-3.0 2,-0.4 31,-0.2 31,-0.2 -0.910 37.0-166.1-111.5 132.0 1.9 -7.3 15.0 138 181 A V E -I 167 0C 0 29,-2.6 29,-2.0 -2,-0.4 59,-0.1 -0.961 8.3-158.8-114.1 131.1 0.6 -8.1 18.5 139 182 A H - 0 0 0 -2,-0.4 26,-0.2 27,-0.2 -1,-0.1 0.929 11.4-172.0 -74.6 -49.8 -0.2 -5.1 20.8 140 183 A R S S+ 0 0 26 56,-0.1 41,-0.1 1,-0.1 -1,-0.1 0.278 71.0 63.4 71.3 -4.4 -0.0 -7.0 24.2 141 184 A D + 0 0 18 21,-0.1 2,-0.4 39,-0.1 5,-0.1 -0.177 60.9 155.9-139.9 44.9 -1.3 -3.9 26.2 142 185 A L + 0 0 1 42,-0.1 39,-0.2 3,-0.1 64,-0.1 -0.631 20.7 128.4 -77.0 126.3 -4.9 -3.2 25.0 143 186 A K S > S- 0 0 32 -2,-0.4 3,-1.5 62,-0.0 -40,-0.2 -0.923 73.3 -90.8-167.7 160.2 -6.8 -1.4 27.7 144 187 A P G > S+ 0 0 1 0, 0.0 -40,-1.4 0, 0.0 -41,-1.2 0.754 122.2 61.2 -56.4 -27.2 -9.0 1.8 27.8 145 188 A E G 3 S+ 0 0 51 1,-0.2 -3,-0.1 -42,-0.2 -40,-0.1 0.786 104.6 50.1 -67.0 -30.0 -5.9 4.0 28.8 146 189 A N G < S+ 0 0 12 -3,-1.5 15,-2.3 -5,-0.1 2,-0.5 0.071 95.5 81.9 -97.7 19.8 -4.2 2.9 25.5 147 190 A L E < - H 0 160B 0 -3,-1.1 -44,-2.9 13,-0.2 -43,-0.3 -0.969 65.2-168.3-126.6 109.8 -7.3 3.9 23.4 148 191 A L E -GH 102 159B 34 11,-2.9 11,-2.8 -2,-0.5 2,-0.4 -0.731 20.5-124.5 -99.6 150.6 -7.5 7.6 22.6 149 192 A L E - H 0 158B 13 -48,-3.2 -49,-2.3 -2,-0.3 -48,-0.4 -0.808 15.8-137.9 -94.9 135.3 -10.3 9.6 21.1 150 193 A E S S- 0 0 29 7,-2.4 -51,-1.5 -2,-0.4 2,-0.2 0.890 78.9 -12.3 -50.2 -54.5 -9.4 11.6 17.9 151 194 A S - 0 0 7 2,-0.2 -51,-0.1 -52,-0.2 5,-0.1 -0.758 68.9-103.0-141.0 179.0 -11.4 14.7 19.0 152 195 A K S S+ 0 0 159 -2,-0.2 -2,-0.0 -53,-0.1 -52,-0.0 0.427 85.3 116.9 -89.4 -2.1 -14.0 15.9 21.6 153 196 A E S > S- 0 0 86 1,-0.1 3,-1.4 2,-0.1 -2,-0.2 -0.262 80.2-106.3 -67.4 152.9 -16.6 15.6 18.7 154 197 A K T 3 S+ 0 0 208 1,-0.3 -1,-0.1 -2,-0.0 -3,-0.0 0.844 115.5 32.0 -47.0 -56.3 -19.6 13.2 18.9 155 198 A D T 3 S+ 0 0 102 2,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.170 83.9 156.7 -95.4 18.8 -18.4 10.5 16.3 156 199 A A < - 0 0 11 -3,-1.4 2,-0.1 1,-0.1 0, 0.0 -0.128 44.3-112.4 -49.1 130.5 -14.6 11.0 17.0 157 200 A L - 0 0 10 -8,-0.1 -7,-2.4 1,-0.1 2,-0.3 -0.346 22.3-115.4 -70.0 147.9 -12.6 7.9 16.0 158 201 A I E - H 0 149B 2 -9,-0.2 2,-0.5 -37,-0.1 -9,-0.2 -0.645 28.4-158.3 -80.6 138.2 -10.8 5.6 18.4 159 202 A K E - H 0 148B 10 -11,-2.8 -11,-2.9 -2,-0.3 2,-0.5 -0.982 11.6-138.6-124.7 121.8 -7.0 5.5 18.1 160 203 A I E +fH 78 147B 0 -83,-2.5 -81,-2.5 -2,-0.5 -13,-0.2 -0.693 35.6 173.2 -77.3 127.7 -4.9 2.6 19.4 161 204 A V + 0 0 22 -15,-2.3 -15,-0.1 -2,-0.5 -16,-0.0 -0.661 34.8 57.7-127.5 177.5 -1.8 4.0 21.0 162 205 A D + 0 0 54 -2,-0.2 3,-0.4 1,-0.1 -1,-0.1 0.994 39.5 176.8 59.1 85.5 1.3 2.8 23.1 163 206 A F > + 0 0 1 1,-0.2 3,-1.1 2,-0.1 -1,-0.1 0.150 46.6 115.1-100.3 19.9 3.2 0.2 21.1 164 207 A G T 3 S+ 0 0 41 1,-0.3 -1,-0.2 -23,-0.1 -98,-0.1 0.757 84.1 35.6 -59.4 -32.9 5.9 -0.0 23.8 165 208 A L T 3 S+ 0 0 53 -3,-0.4 -1,-0.3 -26,-0.2 -2,-0.1 0.330 95.0 122.6-104.2 5.2 5.0 -3.6 24.6 166 209 A S < - 0 0 18 -3,-1.1 2,-0.3 -25,-0.1 -27,-0.2 -0.051 39.7-169.3 -63.9 164.8 4.2 -4.6 21.0 167 210 A A E -I 138 0C 21 -29,-2.0 -29,-2.6 -101,-0.0 2,-0.6 -0.988 29.2-120.1-154.5 154.2 5.9 -7.4 19.1 168 211 A V E -I 137 0C 98 -2,-0.3 2,-0.2 -31,-0.2 -31,-0.2 -0.888 42.0-157.4 -92.9 118.6 6.3 -8.9 15.7 169 212 A F - 0 0 10 -33,-2.5 2,-0.4 -2,-0.6 5,-0.1 -0.682 8.2-137.7 -99.6 161.1 5.0 -12.5 16.0 170 213 A E B > -J 173 0D 98 3,-0.5 3,-0.9 -2,-0.2 5,-0.0 -0.927 14.0-133.9-117.4 138.9 5.7 -15.6 13.9 171 214 A N T 3 S+ 0 0 142 -2,-0.4 -1,-0.1 1,-0.2 3,-0.0 0.704 106.5 45.5 -62.5 -23.9 3.0 -18.1 12.8 172 215 A Q T 3 S+ 0 0 143 1,-0.1 2,-0.4 2,-0.0 -1,-0.2 0.512 107.7 61.6 -98.6 -8.7 5.3 -21.1 13.8 173 216 A K B < S-J 170 0D 125 -3,-0.9 -3,-0.5 21,-0.0 2,-0.2 -0.972 70.2-136.9-127.6 137.8 6.5 -19.9 17.3 174 217 A K - 0 0 102 -2,-0.4 21,-0.2 -5,-0.1 2,-0.2 -0.614 26.6-118.2 -87.2 148.0 4.7 -19.0 20.5 175 218 A M B -K 194 0E 24 19,-3.2 19,-1.9 -2,-0.2 -1,-0.1 -0.561 23.6-172.7 -84.8 151.9 5.6 -15.9 22.5 176 219 A K + 0 0 160 -2,-0.2 2,-0.3 17,-0.2 -1,-0.1 0.628 44.1 110.6-119.7 -22.2 7.0 -16.2 26.1 177 220 A E - 0 0 98 1,-0.1 2,-1.2 17,-0.1 16,-0.1 -0.461 62.4-137.2 -66.8 118.9 7.3 -12.7 27.6 178 221 A R + 0 0 142 -2,-0.3 2,-0.3 12,-0.1 -1,-0.1 -0.674 47.0 149.8 -78.8 94.7 4.7 -12.1 30.5 179 222 A L + 0 0 39 -2,-1.2 2,-0.3 -14,-0.1 10,-0.0 -0.962 16.5 59.2-132.5 149.7 3.6 -8.6 29.6 180 223 A G S S- 0 0 32 -2,-0.3 2,-0.4 5,-0.1 -39,-0.1 -0.979 76.8 -47.2 141.6-153.7 0.4 -6.5 30.0 181 224 A T >> - 0 0 33 -2,-0.3 4,-2.2 -39,-0.2 3,-1.1 -0.990 44.7-119.4-128.1 132.6 -2.1 -5.2 32.6 182 225 A A T 34 S+ 0 0 17 -2,-0.4 -1,-0.1 1,-0.3 47,-0.1 0.754 110.5 42.3 -34.5 -55.8 -3.7 -7.2 35.5 183 226 A Y T 34 S+ 0 0 87 1,-0.2 -1,-0.3 -3,-0.0 34,-0.2 0.824 124.3 36.3 -65.6 -35.5 -7.4 -6.8 34.5 184 227 A Y T <4 S+ 0 0 13 -3,-1.1 -2,-0.2 2,-0.1 21,-0.2 0.604 84.3 116.8 -97.3 -19.4 -6.7 -7.3 30.7 185 228 A I < - 0 0 12 -4,-2.2 -5,-0.1 1,-0.1 14,-0.1 -0.248 63.9-122.5 -59.5 134.7 -4.0 -10.0 30.5 186 229 A A >> - 0 0 1 1,-0.1 4,-1.3 12,-0.1 3,-1.1 -0.536 19.0-123.4 -75.4 143.8 -4.8 -13.4 28.9 187 230 A P H 3> S+ 0 0 0 0, 0.0 4,-1.2 0, 0.0 5,-0.1 0.854 112.3 58.1 -59.3 -32.3 -4.3 -16.5 31.1 188 231 A E H 34>S+ 0 0 2 2,-0.2 5,-2.1 1,-0.2 4,-0.0 0.763 100.9 56.2 -69.6 -22.0 -1.9 -18.0 28.5 189 232 A V H X45S+ 0 0 5 -3,-1.1 3,-1.4 1,-0.2 -1,-0.2 0.897 106.1 51.1 -70.3 -40.8 0.3 -14.8 28.8 190 233 A L H 3<5S+ 0 0 22 -4,-1.3 -2,-0.2 1,-0.3 -1,-0.2 0.781 108.0 52.6 -63.4 -29.5 0.5 -15.6 32.6 191 234 A R T 3<5S- 0 0 137 -4,-1.2 -1,-0.3 2,-0.1 -2,-0.2 0.386 113.0-123.7 -87.4 0.5 1.5 -19.3 31.5 192 235 A K T < 5S+ 0 0 125 -3,-1.4 -3,-0.2 -5,-0.1 2,-0.2 0.812 84.1 94.4 60.1 38.9 4.4 -17.8 29.3 193 236 A K < + 0 0 143 -5,-2.1 2,-0.3 -16,-0.1 -17,-0.2 -0.694 52.8 124.5-159.7 95.1 3.1 -19.5 26.1 194 237 A Y B -K 175 0E 2 -19,-1.9 -19,-3.2 -2,-0.2 2,-0.2 -0.930 37.6-150.1-150.2 171.5 0.8 -17.5 23.8 195 238 A D > - 0 0 34 -2,-0.3 3,-1.5 -21,-0.2 4,-0.1 -0.517 58.2 -63.9-128.2-163.7 -0.0 -16.1 20.3 196 239 A E T >> S+ 0 0 49 1,-0.3 3,-1.6 -2,-0.2 4,-0.5 0.610 115.1 83.5 -67.1 -11.7 -1.9 -13.0 19.0 197 240 A K H >> S+ 0 0 29 1,-0.3 4,-1.7 2,-0.2 3,-0.5 0.716 72.5 78.5 -63.9 -18.9 -5.2 -14.3 20.5 198 241 A C H <> S+ 0 0 4 -3,-1.5 4,-1.5 1,-0.2 -1,-0.3 0.797 89.9 54.5 -56.8 -32.7 -4.0 -12.7 23.8 199 242 A D H <> S+ 0 0 0 -3,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.830 102.7 55.3 -70.9 -36.6 -5.2 -9.3 22.3 200 243 A V H S- 0 0 63 -3,-0.1 4,-1.9 1,-0.1 3,-0.3 -0.856 83.8-114.2-127.6 161.2 -4.6 -6.4 44.8 222 265 A D H > S+ 0 0 106 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.854 118.2 60.2 -60.3 -35.6 -2.8 -7.6 41.6 223 266 A Q H > S+ 0 0 146 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.886 106.6 45.5 -57.1 -46.6 -2.3 -11.0 43.3 224 267 A E H > S+ 0 0 80 -3,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.904 114.6 47.2 -64.5 -48.2 -6.2 -11.3 43.7 225 268 A I H X S+ 0 0 8 -4,-1.9 4,-2.2 1,-0.2 3,-0.4 0.941 112.4 49.0 -60.1 -52.2 -6.9 -10.2 40.0 226 269 A L H X S+ 0 0 36 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.814 108.0 53.5 -60.5 -35.7 -4.2 -12.6 38.5 227 270 A R H X S+ 0 0 175 -4,-1.6 4,-1.2 2,-0.2 -1,-0.2 0.855 111.2 47.0 -69.7 -30.8 -5.4 -15.6 40.5 228 271 A K H X>S+ 0 0 89 -4,-1.4 4,-1.5 -3,-0.4 5,-0.6 0.884 112.3 50.2 -73.3 -39.4 -8.9 -15.0 39.1 229 272 A V H <5S+ 0 0 0 -4,-2.2 3,-0.3 2,-0.2 -2,-0.2 0.934 106.0 55.8 -62.9 -48.0 -7.4 -14.5 35.5 230 273 A E H <5S+ 0 0 88 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.846 110.5 45.2 -51.0 -43.6 -5.5 -17.9 35.9 231 274 A K H <5S- 0 0 146 -4,-1.2 -1,-0.2 -5,-0.1 -2,-0.2 0.795 96.2-148.0 -72.3 -32.3 -8.8 -19.8 36.6 232 275 A G T <5 + 0 0 11 -4,-1.5 2,-0.4 -3,-0.3 -3,-0.1 0.536 46.3 141.9 73.6 11.2 -10.5 -17.9 33.7 233 276 A K < + 0 0 165 -5,-0.6 2,-0.3 25,-0.0 -1,-0.2 -0.725 15.0 149.1 -90.8 129.4 -13.9 -18.0 35.6 234 277 A Y - 0 0 57 -2,-0.4 2,-0.3 -3,-0.1 -17,-0.1 -0.888 25.9-142.2-146.7 171.2 -16.2 -15.0 35.3 235 278 A T - 0 0 82 -2,-0.3 -2,-0.0 -19,-0.2 0, 0.0 -0.994 26.2-157.4-146.5 152.5 -20.0 -14.4 35.4 236 279 A F + 0 0 28 -2,-0.3 2,-1.9 1,-0.1 5,-0.2 0.170 68.1 115.0-101.2 8.2 -22.9 -12.3 33.9 237 280 A D + 0 0 145 3,-0.1 -1,-0.1 4,-0.0 -2,-0.0 -0.511 49.3 98.1 -84.6 71.6 -24.8 -13.1 37.1 238 281 A S S > S- 0 0 38 -2,-1.9 3,-1.9 1,-0.0 4,-0.3 -0.960 85.4-111.0-150.3 148.3 -25.0 -9.5 38.4 239 282 A P G > S+ 0 0 115 0, 0.0 3,-1.1 0, 0.0 4,-0.3 0.758 112.5 70.0 -59.9 -23.4 -27.9 -6.9 38.1 240 283 A E G 3 S+ 0 0 75 1,-0.2 3,-0.2 2,-0.1 -3,-0.1 0.705 101.5 48.1 -62.2 -20.9 -25.8 -4.8 35.7 241 284 A W G X S+ 0 0 1 -3,-1.9 3,-1.2 -5,-0.2 -1,-0.2 0.480 80.2 99.8 -98.7 -9.1 -26.3 -7.7 33.1 242 285 A K T < S+ 0 0 171 -3,-1.1 -1,-0.1 -4,-0.3 -2,-0.1 0.812 93.9 31.1 -47.0 -46.6 -30.2 -8.2 33.5 243 286 A N T 3 S+ 0 0 136 -4,-0.3 2,-0.3 -3,-0.2 -1,-0.3 0.358 90.9 116.7 -99.3 1.4 -31.1 -6.1 30.3 244 287 A V S < S- 0 0 19 -3,-1.2 -3,-0.0 1,-0.1 -130,-0.0 -0.565 70.4-111.8 -74.6 132.1 -28.0 -6.9 28.2 245 288 A S > - 0 0 40 -2,-0.3 4,-1.6 1,-0.1 3,-0.3 -0.166 14.8-118.1 -64.2 157.1 -28.8 -8.9 25.1 246 289 A E H > S+ 0 0 145 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.854 113.7 59.8 -61.8 -34.5 -27.8 -12.5 24.4 247 290 A G H > S+ 0 0 26 2,-0.2 4,-1.8 1,-0.2 27,-0.3 0.826 103.7 47.8 -63.5 -39.4 -25.8 -11.3 21.4 248 291 A A H > S+ 0 0 0 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.906 114.3 46.8 -69.4 -42.2 -23.5 -9.1 23.5 249 292 A K H X S+ 0 0 34 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.843 109.2 55.9 -66.8 -36.7 -22.9 -11.9 26.1 250 293 A D H X S+ 0 0 73 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.925 108.3 47.0 -62.9 -45.0 -22.2 -14.3 23.2 251 294 A L H X S+ 0 0 0 -4,-1.8 4,-1.7 2,-0.2 5,-0.2 0.949 112.2 49.4 -62.7 -48.4 -19.5 -12.1 21.8 252 295 A I H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 3,-0.3 0.905 109.3 53.0 -54.9 -46.3 -17.9 -11.6 25.3 253 296 A K H < S+ 0 0 113 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.875 109.7 48.3 -57.5 -42.0 -17.9 -15.4 25.9 254 297 A Q H >< S+ 0 0 69 -4,-1.8 10,-1.8 -3,-0.2 3,-0.5 0.801 114.6 44.7 -69.5 -33.0 -16.1 -16.0 22.5 255 298 A M H 3< S+ 0 0 0 -4,-1.7 -51,-0.2 -3,-0.3 -2,-0.2 0.758 115.9 47.1 -80.6 -31.3 -13.4 -13.4 23.3 256 299 A L T 3< S+ 0 0 5 -4,-2.4 2,-0.4 -5,-0.2 -1,-0.2 0.040 79.5 140.2 -98.4 24.5 -13.0 -14.6 26.9 257 300 A Q < - 0 0 73 -3,-0.5 6,-0.2 1,-0.2 -3,-0.1 -0.575 50.7-144.3 -68.7 118.1 -12.8 -18.3 25.7 258 301 A F S S+ 0 0 82 -2,-0.4 2,-0.9 -26,-0.1 -1,-0.2 0.842 84.7 76.1 -56.6 -37.7 -10.1 -19.9 27.9 259 302 A D S >> S- 0 0 79 1,-0.2 4,-1.4 2,-0.0 3,-1.2 -0.713 72.4-156.0 -84.1 106.4 -8.9 -22.0 25.0 260 303 A S T 34 S+ 0 0 14 -2,-0.9 -1,-0.2 1,-0.3 -3,-0.1 0.749 92.4 55.9 -48.5 -37.0 -6.8 -19.7 22.6 261 304 A Q T 34 S+ 0 0 170 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.0 0.807 113.6 39.1 -69.0 -34.2 -7.5 -22.0 19.6 262 305 A R T <4 S+ 0 0 190 -3,-1.2 -2,-0.2 2,-0.1 -1,-0.2 0.577 93.3 110.6 -92.2 -13.7 -11.3 -21.9 20.1 263 306 A R S < S- 0 0 2 -4,-1.4 -8,-0.2 -6,-0.2 -9,-0.1 -0.386 80.1-102.8 -64.0 136.4 -11.2 -18.1 21.0 264 307 A I - 0 0 11 -10,-1.8 2,-0.2 -13,-0.2 -1,-0.1 -0.213 35.1-122.9 -59.2 143.8 -12.7 -15.8 18.3 265 308 A S > - 0 0 33 1,-0.1 4,-2.7 -3,-0.1 5,-0.2 -0.529 21.9-112.1 -84.5 163.3 -10.2 -13.9 16.1 266 309 A A H > S+ 0 0 3 1,-0.2 4,-1.7 2,-0.2 -136,-0.2 0.908 120.7 51.1 -60.1 -38.4 -10.3 -10.1 16.0 267 310 A Q H > S+ 0 0 39 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.895 112.4 44.0 -64.4 -46.1 -11.4 -10.5 12.3 268 311 A Q H >4 S+ 0 0 116 1,-0.2 3,-0.5 2,-0.2 4,-0.4 0.856 110.6 55.2 -68.6 -37.9 -14.2 -12.9 13.1 269 312 A A H >< S+ 0 0 0 -4,-2.7 3,-0.9 1,-0.2 6,-0.3 0.851 102.1 57.2 -63.9 -34.0 -15.3 -10.7 16.1 270 313 A L H 3< S+ 0 0 6 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.798 109.5 46.5 -64.2 -29.3 -15.7 -7.7 13.8 271 314 A E T << S+ 0 0 68 -4,-0.7 -1,-0.2 -3,-0.5 -2,-0.2 0.474 83.5 131.0 -90.6 -7.5 -18.2 -9.8 11.7 272 315 A H <> - 0 0 12 -3,-0.9 4,-2.1 -4,-0.4 3,-0.5 -0.161 68.3-119.6 -50.5 137.6 -20.2 -11.1 14.8 273 316 A P H > S+ 0 0 95 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.774 112.9 54.3 -52.6 -32.6 -24.0 -10.7 14.4 274 317 A W H > S+ 0 0 2 -27,-0.3 4,-2.5 2,-0.2 5,-0.2 0.908 108.1 48.8 -68.1 -43.7 -24.2 -8.3 17.5 275 318 A I H > S+ 0 0 2 -3,-0.5 4,-2.6 -6,-0.3 5,-0.3 0.953 114.1 47.4 -57.2 -51.1 -21.6 -6.0 16.0 276 319 A K H X S+ 0 0 113 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.890 113.9 46.1 -58.8 -45.7 -23.5 -6.0 12.7 277 320 A E H X S+ 0 0 111 -4,-2.4 4,-1.1 2,-0.2 -1,-0.2 0.917 116.6 43.3 -64.0 -49.6 -26.9 -5.3 14.3 278 321 A M H X S+ 0 0 8 -4,-2.5 4,-1.4 1,-0.2 3,-0.2 0.891 114.9 47.6 -67.6 -42.8 -25.7 -2.5 16.6 279 322 A C H X S+ 0 0 11 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.775 108.6 56.1 -71.8 -23.6 -23.6 -0.7 14.1 280 323 A S H X S+ 0 0 75 -4,-1.4 4,-1.2 -5,-0.3 -1,-0.2 0.796 105.3 53.3 -72.7 -32.4 -26.5 -0.9 11.5 281 324 A K H < S+ 0 0 120 -4,-1.1 -2,-0.2 -3,-0.2 -1,-0.2 0.868 109.9 47.3 -68.5 -39.2 -28.7 0.9 14.2 282 325 A K H < S+ 0 0 84 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.911 113.2 47.6 -67.7 -44.5 -26.0 3.7 14.4 283 326 A E H < 0 0 123 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.691 360.0 360.0 -69.8 -25.4 -25.7 4.1 10.6 284 327 A S < 0 0 131 -4,-1.2 -1,-0.2 -5,-0.1 -2,-0.2 0.765 360.0 360.0 -74.2 360.0 -29.5 4.2 10.0 285 ! 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 0.0 286 331 A L 0 0 177 0, 0.0 2,-0.2 0, 0.0 39,-0.0 0.000 360.0 360.0 360.0 68.4 -23.8 8.5 4.2 287 332 A P - 0 0 57 0, 0.0 2,-0.3 0, 0.0 65,-0.0 -0.572 360.0-141.7 -95.2 155.7 -22.1 10.5 1.3 288 333 A S - 0 0 51 -2,-0.2 2,-0.2 67,-0.0 65,-0.2 -0.769 23.1-109.3-108.8 153.0 -20.7 9.5 -2.1 289 334 A L - 0 0 16 63,-2.2 2,-0.4 -2,-0.3 3,-0.2 -0.568 25.0-138.8 -83.4 143.1 -17.6 10.7 -4.0 290 335 A A S S- 0 0 89 -2,-0.2 65,-0.1 1,-0.2 64,-0.1 -0.915 78.2 -11.4-109.2 128.4 -17.8 12.9 -7.1 291 336 A N S > S+ 0 0 113 63,-0.4 4,-1.4 -2,-0.4 -1,-0.2 0.750 86.2 142.4 54.9 33.3 -15.5 12.3 -10.2 292 337 A A H > + 0 0 4 61,-0.7 4,-2.1 -3,-0.2 62,-0.1 0.865 64.5 53.4 -68.3 -40.5 -13.3 10.0 -8.0 293 338 A I H > S+ 0 0 22 2,-0.2 4,-2.0 60,-0.2 -1,-0.2 0.875 109.3 48.0 -64.5 -40.3 -12.6 7.5 -10.9 294 339 A E H > S+ 0 0 72 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.855 113.3 48.9 -66.6 -38.0 -11.3 10.2 -13.3 295 340 A N H < S+ 0 0 27 -4,-1.4 3,-0.5 2,-0.2 4,-0.4 0.854 111.2 49.4 -69.1 -39.8 -9.1 11.6 -10.4 296 341 A M H >< S+ 0 0 2 -4,-2.1 3,-1.4 1,-0.2 -2,-0.2 0.867 103.9 59.6 -67.7 -39.1 -7.7 8.1 -9.6 297 342 A R H >< S+ 0 0 98 -4,-2.0 3,-1.4 1,-0.3 -1,-0.2 0.694 90.5 71.3 -62.0 -24.0 -6.9 7.5 -13.3 298 343 A K T 3< S+ 0 0 47 -4,-0.6 -1,-0.3 -3,-0.5 -2,-0.2 0.795 89.7 62.4 -64.0 -27.3 -4.5 10.5 -13.2 299 344 A F T X S+ 0 0 1 -3,-1.4 3,-1.5 -4,-0.4 2,-0.4 0.529 75.3 113.5 -76.4 -6.3 -2.1 8.4 -11.1 300 345 A Q T < S- 0 0 89 -3,-1.4 75,-0.1 1,-0.3 72,-0.0 -0.482 95.9 -6.8 -71.0 120.5 -1.6 5.9 -13.8 301 346 A N T 3 S+ 0 0 149 -2,-0.4 -1,-0.3 73,-0.2 2,-0.1 0.823 98.5 160.8 69.3 27.2 1.9 6.1 -15.0 302 347 A S < - 0 0 18 -3,-1.5 -1,-0.2 73,-0.1 -3,-0.1 -0.440 48.3 -85.8 -86.5 158.2 2.6 9.1 -12.9 303 348 A Q > - 0 0 78 159,-0.2 4,-1.9 1,-0.1 3,-0.2 -0.361 31.4-135.2 -63.3 135.5 6.0 10.4 -11.7 304 349 A K H > S+ 0 0 19 1,-0.2 4,-2.5 2,-0.2 -1,-0.1 0.796 105.3 54.0 -64.7 -32.1 7.3 8.8 -8.5 305 350 A L H > S+ 0 0 8 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.873 110.1 48.8 -69.0 -34.9 8.4 12.1 -7.0 306 351 A A H > S+ 0 0 1 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.851 111.8 48.5 -70.9 -37.1 4.9 13.4 -7.6 307 352 A Q H X S+ 0 0 10 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.944 112.7 48.4 -65.9 -47.9 3.4 10.2 -6.0 308 353 A A H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.856 112.9 48.6 -58.9 -42.3 5.7 10.5 -3.0 309 354 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.956 114.8 42.7 -63.2 -55.1 4.8 14.2 -2.5 310 355 A L H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.852 112.8 53.7 -63.2 -37.1 1.0 13.7 -2.7 311 356 A L H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.896 111.8 45.6 -63.9 -40.0 1.3 10.6 -0.5 312 357 A Y H X>S+ 0 0 5 -4,-1.8 4,-2.2 2,-0.2 5,-0.8 0.896 114.0 49.0 -68.4 -42.4 3.2 12.7 2.2 313 358 A M H X5S+ 0 0 0 -4,-2.5 4,-0.8 3,-0.2 5,-0.3 0.910 118.8 38.6 -63.5 -44.4 0.7 15.6 1.8 314 359 A A H <5S+ 0 0 2 -4,-2.8 4,-0.2 3,-0.2 -2,-0.2 0.861 124.1 37.2 -75.6 -40.5 -2.4 13.3 2.2 315 360 A S H <5S+ 0 0 5 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.737 134.2 16.1 -85.1 -29.9 -1.0 11.0 4.9 316 361 A K H <5S+ 0 0 18 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.1 0.571 125.6 46.3-119.7 -18.4 1.0 13.3 7.1 317 362 A L S < - 0 0 46 -2,-0.3 4,-1.3 1,-0.1 3,-0.3 -0.358 25.3-109.9 -82.5 166.5 -6.2 17.6 9.1 320 365 A Q H > S+ 0 0 36 1,-0.2 4,-1.4 2,-0.2 3,-0.2 0.877 119.4 57.0 -62.7 -39.6 -9.0 15.4 10.6 321 366 A E H 4 S+ 0 0 116 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.811 107.2 48.1 -60.8 -36.1 -11.6 17.9 9.1 322 367 A E H 4 S+ 0 0 63 -3,-0.3 4,-0.2 1,-0.2 -1,-0.2 0.778 119.5 36.4 -76.0 -33.2 -10.2 17.5 5.6 323 368 A T H X S+ 0 0 14 -4,-1.3 4,-3.0 -3,-0.2 5,-0.3 0.486 87.3 100.3-100.5 -5.5 -10.1 13.6 5.7 324 369 A K H X S+ 0 0 88 -4,-1.4 4,-1.9 1,-0.2 5,-0.1 0.889 88.3 40.1 -46.6 -57.8 -13.3 13.0 7.7 325 370 A E H > S+ 0 0 89 -4,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.876 116.5 51.2 -62.6 -40.8 -15.6 12.2 4.7 326 371 A L H > S+ 0 0 10 -4,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.907 109.8 49.1 -63.3 -44.7 -12.8 10.1 3.0 327 372 A T H X S+ 0 0 6 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.868 111.0 50.6 -62.1 -39.6 -12.2 8.0 6.1 328 373 A D H X S+ 0 0 64 -4,-1.9 4,-1.7 -5,-0.3 -2,-0.2 0.893 112.9 45.6 -67.7 -38.5 -15.9 7.4 6.5 329 374 A I H X S+ 0 0 5 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.941 113.4 50.1 -68.4 -45.5 -16.1 6.2 2.8 330 375 A F H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.924 110.3 49.7 -54.6 -51.5 -12.9 4.1 3.2 331 376 A R H < S+ 0 0 88 -4,-2.6 6,-0.2 1,-0.2 -1,-0.2 0.865 111.0 51.2 -57.2 -38.7 -14.4 2.4 6.4 332 377 A H H < S+ 0 0 94 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.919 113.5 41.8 -64.1 -51.6 -17.6 1.7 4.5 333 378 A I H < S+ 0 0 3 -4,-2.3 2,-2.6 1,-0.2 -2,-0.2 0.858 99.0 78.5 -64.7 -39.1 -15.9 0.0 1.4 334 379 A D >< + 0 0 7 -4,-2.7 3,-2.1 -5,-0.2 -1,-0.2 -0.418 63.5 173.3 -72.2 68.1 -13.5 -1.8 3.8 335 380 A K T 3 S+ 0 0 119 -2,-2.6 -1,-0.2 1,-0.3 -2,-0.1 0.831 76.8 42.5 -48.1 -44.5 -16.2 -4.5 4.7 336 381 A N T 3 S- 0 0 32 -3,-0.2 -1,-0.3 4,-0.2 -66,-0.1 0.402 104.3-132.2 -86.7 2.1 -13.8 -6.7 6.8 337 382 A G < + 0 0 7 -3,-2.1 -206,-0.3 -6,-0.2 -207,-0.2 0.668 63.0 135.1 55.4 26.9 -12.3 -3.6 8.4 338 383 A D S S- 0 0 6 2,-0.3 -1,-0.1 -208,-0.1 3,-0.1 0.425 74.9-112.5 -83.1 2.3 -8.7 -4.7 7.8 339 384 A G S S+ 0 0 0 1,-0.2 47,-0.9 -5,-0.1 2,-0.3 0.545 88.3 93.7 78.6 10.3 -7.5 -1.3 6.6 340 385 A Q E -L 385 0F 10 45,-0.2 2,-0.7 46,-0.1 -2,-0.3 -0.994 67.7-138.7-133.0 139.9 -7.0 -2.4 3.0 341 386 A L E -L 384 0F 0 43,-2.6 43,-2.2 -2,-0.3 2,-0.1 -0.890 25.7-164.9-100.8 110.8 -9.3 -2.3 -0.0 342 387 A D > - 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