==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SYNTHETASE 30-JAN-03 1OBC . COMPND 2 MOLECULE: LEUCYL-TRNA SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR S.CUSACK,A.YAREMCHUK,M.TUKALO . 812 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35686.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 543 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 102 12.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 47 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 87 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 251 30.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.7 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 6 1 2 3 1 1 2 1 1 0 2 2 1 0 1 1 0 1 1 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 4 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 . 4 5 5 3 0 2 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 6 3 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 1 A M 0 0 127 0, 0.0 694,-0.1 0, 0.0 690,-0.0 0.000 360.0 360.0 360.0 131.6 62.7 21.3 92.3 2 2 A E - 0 0 96 1,-0.1 2,-0.2 692,-0.1 692,-0.1 -0.193 360.0-135.6 -65.3 161.5 62.1 24.7 90.7 3 3 A K - 0 0 170 1,-0.1 -1,-0.1 691,-0.0 684,-0.1 -0.707 33.7 -66.9-118.1 168.9 58.5 25.8 89.9 4 4 A Y - 0 0 12 -2,-0.2 -1,-0.1 683,-0.1 683,-0.1 -0.295 48.3-176.6 -55.6 128.6 56.6 27.4 87.0 5 5 A N > - 0 0 92 1,-0.1 4,-0.5 -3,-0.0 3,-0.3 -0.882 13.5-174.9-135.3 102.9 57.8 31.0 86.4 6 6 A P H > + 0 0 2 0, 0.0 4,-1.6 0, 0.0 649,-0.2 0.709 60.6 93.6 -69.0 -21.0 56.0 33.0 83.7 7 7 A H H 4 S+ 0 0 110 1,-0.2 4,-0.5 2,-0.2 646,-0.0 0.838 95.8 13.7 -44.2 -62.6 58.3 36.0 83.9 8 8 A A H > S+ 0 0 78 -3,-0.3 4,-1.7 1,-0.1 3,-0.3 0.901 118.4 64.8 -88.3 -37.8 61.0 35.7 81.3 9 9 A I H X S+ 0 0 20 -4,-0.5 4,-2.3 1,-0.2 5,-0.2 0.808 95.3 57.4 -53.8 -37.7 59.7 32.9 79.2 10 10 A E H X S+ 0 0 9 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.934 107.3 45.3 -65.5 -45.3 56.6 34.7 77.9 11 11 A A H > S+ 0 0 61 -4,-0.5 4,-2.0 -3,-0.3 -1,-0.2 0.890 111.7 56.7 -62.9 -37.1 58.5 37.6 76.3 12 12 A K H X S+ 0 0 97 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.960 111.7 38.6 -58.2 -55.0 60.9 35.1 74.8 13 13 A W H X S+ 0 0 21 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.829 110.2 60.7 -68.7 -31.8 58.3 33.1 73.0 14 14 A Q H X S+ 0 0 10 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.933 109.3 42.5 -61.1 -44.2 56.3 36.2 72.0 15 15 A R H X S+ 0 0 150 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.915 112.9 54.4 -68.0 -41.3 59.3 37.5 70.0 16 16 A F H X S+ 0 0 39 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.927 108.5 47.1 -56.4 -51.6 60.0 34.0 68.6 17 17 A W H X>S+ 0 0 2 -4,-2.8 5,-1.1 1,-0.2 4,-1.0 0.905 113.8 48.7 -60.7 -41.6 56.5 33.6 67.2 18 18 A E H ><5S+ 0 0 78 -4,-1.7 3,-0.8 -5,-0.2 -2,-0.2 0.956 111.7 47.3 -64.2 -50.0 56.6 37.0 65.7 19 19 A E H 3<5S+ 0 0 146 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.839 112.3 50.9 -58.8 -37.8 60.0 36.7 64.0 20 20 A K H 3<5S- 0 0 115 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.704 98.6-143.6 -73.8 -21.2 59.0 33.3 62.6 21 21 A G T X<5 + 0 0 29 -4,-1.0 3,-2.1 -3,-0.8 -3,-0.2 0.811 39.5 159.5 61.7 32.4 55.8 34.7 61.2 22 22 A F T 3 -D 645 0C 17 -2,-0.3 4,-2.1 598,-0.2 3,-0.5 -0.658 46.8 -78.2-124.4-176.9 41.2 45.4 79.7 48 50 A M H > S+ 0 0 0 596,-1.9 4,-1.2 1,-0.2 5,-0.1 0.687 124.7 65.2 -61.0 -17.2 40.4 41.7 80.3 49 51 A G H >> S+ 0 0 17 2,-0.2 4,-1.3 1,-0.2 3,-0.7 0.967 106.6 40.4 -68.2 -51.2 37.0 42.2 78.7 50 52 A H H 3> S+ 0 0 60 -3,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.906 113.5 57.1 -60.3 -40.9 38.5 43.0 75.3 51 53 A L H 3X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.3 0.731 97.2 60.1 -66.1 -22.6 41.0 40.3 75.9 52 54 A K H S+ 0 0 30 -4,-3.1 5,-1.9 1,-0.2 4,-0.4 0.876 112.5 52.2 -62.5 -37.7 43.4 25.9 63.1 65 67 A R H ><5S+ 0 0 59 -4,-2.2 3,-1.2 -5,-0.2 -1,-0.2 0.900 107.9 51.6 -65.6 -39.5 47.0 26.8 62.2 66 68 A M H 3<5S+ 0 0 4 -4,-2.5 736,-0.8 1,-0.3 -1,-0.2 0.828 103.4 59.2 -65.3 -32.3 48.3 23.6 64.0 67 69 A Q T 3<5S- 0 0 60 -4,-1.6 -1,-0.3 734,-0.2 -2,-0.2 0.607 123.8-104.2 -72.5 -11.5 45.8 21.5 61.9 68 70 A G T < 5S+ 0 0 54 -3,-1.2 -3,-0.2 -4,-0.4 -2,-0.1 0.434 72.2 141.9 104.3 -0.7 47.5 22.8 58.7 69 71 A Y < - 0 0 75 -5,-1.9 2,-0.7 1,-0.1 -1,-0.3 -0.373 60.3-112.5 -72.5 153.6 44.9 25.3 57.5 70 72 A E E -a 32 0A 39 -39,-2.7 -37,-2.5 -2,-0.1 2,-0.5 -0.797 45.9-154.1 -83.2 118.3 45.9 28.6 55.9 71 73 A V E -a 33 0A 2 -2,-0.7 2,-0.6 -47,-0.2 -37,-0.2 -0.858 23.4-167.2-110.7 132.5 44.8 31.0 58.6 72 74 A L E +a 34 0A 0 -39,-2.5 -37,-2.1 -2,-0.5 -48,-0.1 -0.957 20.5 160.1-112.0 112.2 43.8 34.6 58.3 73 75 A H + 0 0 0 -2,-0.6 45,-1.4 -50,-0.4 2,-0.2 -0.826 19.2 176.2-135.2 89.4 43.7 36.2 61.8 74 76 A P - 0 0 0 0, 0.0 -37,-0.5 0, 0.0 2,-0.3 -0.590 19.2-161.1-101.1 162.5 43.9 40.0 61.4 75 77 A M + 0 0 1 43,-0.3 48,-0.5 -2,-0.2 2,-0.3 -0.970 20.3 152.6-136.3 148.7 43.7 43.0 63.8 76 78 A G - 0 0 0 -2,-0.3 2,-0.5 46,-0.2 48,-0.2 -0.910 39.0 -91.7-160.0-174.2 43.1 46.7 62.9 77 79 A W B -e 124 0D 0 46,-2.7 2,-2.2 -2,-0.3 48,-1.9 -0.950 6.5-155.3-126.4 122.2 41.7 49.9 64.3 78 80 A D + 0 0 0 -38,-2.3 6,-0.2 -2,-0.5 46,-0.1 -0.588 43.3 154.2 -84.7 72.8 38.2 51.3 64.1 79 81 A A + 0 0 0 -2,-2.2 2,-0.2 -38,-0.2 -1,-0.2 0.370 34.0 80.5 -91.7 1.0 39.7 54.7 64.5 80 82 A F S S+ 0 0 0 418,-0.1 4,-0.4 -3,-0.1 349,-0.2 -0.622 75.3 19.0-105.0 166.8 37.3 57.1 62.8 81 83 A G S > S- 0 0 6 347,-1.6 4,-2.1 -2,-0.2 5,-0.2 -0.239 105.1 -20.7 83.3-166.4 34.0 58.6 64.1 82 84 A L H > S+ 0 0 4 1,-0.2 4,-3.2 2,-0.2 5,-0.4 0.846 122.3 56.2 -51.3 -53.3 32.4 59.1 67.4 83 85 A P H > S+ 0 0 1 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.952 115.6 36.4 -49.4 -58.8 34.2 56.6 69.7 84 86 A A H > S+ 0 0 0 -4,-0.4 4,-2.3 -6,-0.2 -2,-0.2 0.925 122.2 44.3 -61.7 -48.4 37.7 57.9 69.0 85 87 A E H X S+ 0 0 0 -4,-2.1 4,-2.7 343,-0.2 5,-0.2 0.905 111.3 51.3 -67.4 -43.7 36.8 61.6 68.7 86 88 A N H X S+ 0 0 31 -4,-3.2 4,-1.4 -5,-0.2 -1,-0.2 0.916 113.7 45.9 -59.5 -43.9 34.5 61.8 71.8 87 89 A A H X S+ 0 0 11 -4,-1.7 4,-1.0 -5,-0.4 3,-0.3 0.933 113.6 48.0 -64.4 -47.8 37.2 60.2 74.0 88 90 A A H ><>S+ 0 0 0 -4,-2.3 5,-2.9 1,-0.2 3,-0.6 0.902 113.2 48.7 -60.6 -41.3 39.9 62.4 72.6 89 91 A L H ><5S+ 0 0 36 -4,-2.7 3,-1.3 1,-0.2 -1,-0.2 0.744 99.4 65.3 -72.5 -23.8 37.8 65.5 73.1 90 92 A K H 3<5S+ 0 0 143 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.825 110.5 38.9 -67.0 -28.8 36.9 64.6 76.7 91 93 A F T <<5S- 0 0 102 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.063 116.2-113.2-106.9 22.5 40.5 65.0 77.5 92 94 A G T < 5S+ 0 0 52 -3,-1.3 2,-0.3 1,-0.2 -3,-0.2 0.753 71.8 139.3 52.7 28.4 41.1 68.1 75.3 93 95 A V < - 0 0 47 -5,-2.9 -1,-0.2 -6,-0.2 -2,-0.1 -0.770 61.6-102.6-105.4 148.8 43.4 66.1 73.1 94 96 A H > - 0 0 17 -2,-0.3 4,-2.5 1,-0.1 3,-0.4 -0.467 30.8-127.0 -66.5 134.6 43.6 66.1 69.3 95 97 A P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.823 106.4 51.7 -51.9 -38.9 41.8 63.0 67.8 96 98 A K H > S+ 0 0 99 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.892 112.5 44.3 -69.1 -39.6 44.8 62.0 65.7 97 99 A D H > S+ 0 0 108 -3,-0.4 4,-1.7 2,-0.2 5,-0.2 0.928 115.8 48.3 -68.7 -45.3 47.3 62.1 68.6 98 100 A W H X S+ 0 0 38 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.929 110.6 50.8 -59.4 -49.7 44.9 60.3 70.9 99 101 A T H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.943 111.9 44.9 -56.3 -54.0 44.1 57.6 68.4 100 102 A Y H X S+ 0 0 88 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.804 111.6 52.4 -64.6 -30.1 47.7 56.7 67.6 101 103 A A H X S+ 0 0 43 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.914 112.1 46.9 -71.0 -40.4 48.7 56.7 71.3 102 104 A N H X S+ 0 0 9 -4,-2.3 4,-2.6 -60,-0.2 -2,-0.2 0.864 109.6 53.5 -66.8 -37.8 45.8 54.3 72.0 103 105 A I H X S+ 0 0 7 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.926 107.5 51.6 -63.0 -42.9 46.8 52.1 69.1 104 106 A R H X S+ 0 0 208 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.932 112.9 44.8 -58.5 -47.5 50.3 51.9 70.4 105 107 A Q H X S+ 0 0 78 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.881 111.6 52.4 -65.4 -39.7 49.0 50.8 73.9 106 108 A A H X S+ 0 0 7 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.915 106.1 53.7 -63.6 -44.8 46.5 48.3 72.4 107 109 A K H X S+ 0 0 73 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.892 109.8 48.4 -56.6 -42.3 49.2 46.6 70.3 108 110 A E H X S+ 0 0 119 -4,-1.5 4,-3.0 2,-0.2 -1,-0.2 0.921 108.8 52.7 -65.5 -44.1 51.3 46.1 73.5 109 111 A S H X S+ 0 0 16 -4,-2.2 4,-0.6 1,-0.2 -2,-0.2 0.889 113.5 44.3 -57.8 -41.9 48.3 44.7 75.4 110 112 A L H ><>S+ 0 0 1 -4,-2.3 5,-1.8 2,-0.2 3,-0.8 0.917 114.1 48.8 -69.8 -45.0 47.7 42.2 72.7 111 113 A R H ><5S+ 0 0 86 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.913 107.4 55.6 -62.1 -41.7 51.3 41.3 72.3 112 114 A L H 3<5S+ 0 0 42 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.683 103.2 56.3 -65.5 -19.0 51.8 40.8 76.0 113 115 A M T <<5S- 0 0 0 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.412 117.4-110.4 -93.1 1.4 48.9 38.3 76.1 114 116 A G T < 5 + 0 0 0 -3,-1.7 2,-0.4 1,-0.3 -3,-0.2 0.665 64.9 153.6 79.9 15.9 50.6 36.1 73.5 115 117 A I < - 0 0 6 -5,-1.8 2,-0.5 1,-0.0 -1,-0.3 -0.650 28.6-155.8 -81.8 132.4 48.0 36.9 70.8 116 118 A L + 0 0 7 -2,-0.4 2,-0.2 2,-0.0 -55,-0.0 -0.941 18.0 167.0-116.2 125.8 49.3 36.6 67.3 117 119 A Y - 0 0 4 -2,-0.5 2,-1.3 -45,-0.0 -94,-0.2 -0.739 48.6-103.3-123.0 171.7 47.9 38.4 64.2 118 120 A D > - 0 0 5 -45,-1.4 3,-2.2 -2,-0.2 -43,-0.3 -0.785 40.4-174.3 -95.1 86.1 49.2 38.9 60.7 119 121 A W G > S+ 0 0 53 -2,-1.3 3,-1.1 1,-0.3 -1,-0.2 0.571 72.2 76.9 -62.5 -8.0 50.2 42.5 61.4 120 122 A D G 3 S+ 0 0 92 1,-0.2 -1,-0.3 -3,-0.1 -96,-0.0 0.664 94.2 51.9 -75.3 -13.2 51.1 43.0 57.7 121 123 A R G < S+ 0 0 11 -3,-2.2 -1,-0.2 2,-0.1 -2,-0.2 0.238 80.0 141.3-105.5 12.7 47.3 43.3 57.1 122 124 A E < - 0 0 54 -3,-1.1 2,-0.4 -46,-0.1 -46,-0.2 -0.244 32.2-163.6 -56.7 136.7 46.8 45.9 59.7 123 125 A V - 0 0 9 -48,-0.5 -46,-2.7 7,-0.0 2,-0.4 -0.952 14.7-165.7-125.3 147.5 44.3 48.6 58.8 124 126 A T B > -e 77 0D 10 -2,-0.4 3,-2.1 -48,-0.2 6,-0.3 -0.916 10.0-158.0-132.5 101.9 43.7 52.0 60.3 125 127 A T T 3 S+ 0 0 0 -48,-1.9 6,-0.3 -2,-0.4 -47,-0.1 0.694 86.4 65.3 -56.3 -24.5 40.4 53.5 59.1 126 128 A C T 3 S+ 0 0 10 -49,-0.2 -1,-0.3 4,-0.1 303,-0.1 0.490 85.5 95.4 -80.3 0.1 41.3 57.1 59.9 127 129 A E S X> S- 0 0 57 -3,-2.1 4,-2.5 1,-0.1 3,-1.9 -0.669 80.8-127.9 -92.9 146.3 44.0 57.0 57.3 128 130 A P H 3> S+ 0 0 43 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.848 108.6 67.6 -57.0 -37.3 43.5 58.2 53.7 129 131 A E H 34 S+ 0 0 119 1,-0.2 -4,-0.1 2,-0.2 -3,-0.0 0.731 114.6 29.8 -57.2 -21.5 44.9 54.9 52.4 130 132 A Y H X> S+ 0 0 5 -3,-1.9 3,-2.0 -6,-0.3 4,-0.6 0.845 117.6 49.1-103.8 -55.6 41.7 53.4 53.9 131 133 A Y H 3X S+ 0 0 10 -4,-2.5 4,-2.0 -6,-0.3 3,-0.3 0.665 94.8 73.8 -65.4 -13.2 38.9 56.0 53.8 132 134 A R H 3X S+ 0 0 64 -4,-1.9 4,-1.5 -5,-0.3 -1,-0.3 0.818 99.6 49.3 -66.2 -25.8 39.6 56.8 50.1 133 135 A W H <> S+ 0 0 7 -3,-2.0 4,-2.1 -5,-0.2 -1,-0.3 0.693 102.3 59.1 -84.5 -19.5 37.9 53.4 49.6 134 136 A N H X S+ 0 0 0 -4,-0.6 4,-2.3 -3,-0.3 -2,-0.2 0.903 109.9 45.4 -69.0 -41.7 35.0 54.4 51.8 135 137 A Q H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.883 109.2 54.4 -68.1 -38.8 34.5 57.3 49.3 136 138 A W H X S+ 0 0 12 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.940 111.4 45.1 -59.5 -48.5 34.9 54.9 46.4 137 139 A I H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.897 109.9 55.4 -63.4 -40.5 32.1 52.7 47.8 138 140 A F H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.916 106.7 51.2 -58.8 -43.5 30.0 55.8 48.5 139 141 A L H X S+ 0 0 5 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.891 108.1 51.7 -61.1 -41.3 30.3 56.8 44.9 140 142 A K H X S+ 0 0 45 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.864 109.5 49.8 -64.5 -36.5 29.2 53.4 43.6 141 143 A M H <>S+ 0 0 0 -4,-2.0 5,-3.8 2,-0.2 6,-1.0 0.864 110.1 51.5 -69.5 -36.1 26.1 53.5 45.9 142 144 A W H ><5S+ 0 0 78 -4,-2.0 3,-1.8 4,-0.3 -2,-0.2 0.967 111.0 46.9 -62.4 -52.5 25.3 56.9 44.5 143 145 A E H 3<5S+ 0 0 109 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.773 112.7 51.0 -60.8 -28.2 25.5 55.7 41.0 144 146 A K T 3<5S- 0 0 134 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.247 119.0-107.1 -95.9 13.3 23.4 52.7 41.8 145 147 A G T < 5S+ 0 0 36 -3,-1.8 -3,-0.2 2,-0.2 -2,-0.1 0.793 91.9 109.3 69.3 29.7 20.6 54.7 43.5 146 148 A L < + 0 0 12 -5,-3.8 47,-3.3 1,-0.2 2,-0.5 0.468 65.4 60.8-113.2 -6.5 21.5 53.7 47.0 147 149 A A E +F 192 0E 6 -6,-1.0 2,-0.3 45,-0.2 45,-0.2 -0.982 66.3 153.9-124.9 121.6 22.9 57.0 48.4 148 150 A Y E -F 191 0E 56 43,-2.1 43,-2.8 -2,-0.5 2,-0.4 -0.952 39.0-121.8-145.5 163.7 20.7 60.0 48.5 149 151 A R E +F 190 0E 61 -2,-0.3 2,-0.3 41,-0.2 41,-0.2 -0.891 36.5 164.7-106.3 135.9 20.1 63.4 50.2 150 152 A A E -F 189 0E 32 39,-2.4 39,-2.8 -2,-0.4 2,-0.4 -0.995 31.7-130.7-151.2 151.0 16.7 64.1 51.8 151 153 A K E +F 188 0E 142 -2,-0.3 2,-0.3 37,-0.3 37,-0.2 -0.834 52.6 106.3-101.9 139.5 15.2 66.5 54.3 152 154 A G E S-F 187 0E 20 35,-1.6 35,-1.9 -2,-0.4 2,-0.2 -0.971 70.0 -44.5 172.2 179.6 13.2 65.1 57.2 153 155 A L E +F 186 0E 44 -2,-0.3 2,-0.3 33,-0.2 33,-0.2 -0.515 58.1 178.0 -72.8 134.2 13.1 64.4 60.9 154 156 A V E -F 185 0E 6 31,-2.9 31,-1.9 -2,-0.2 2,-0.3 -0.914 32.4-101.5-134.6 159.9 16.2 62.9 62.3 155 157 A N E -FG 184 164E 36 9,-0.7 9,-2.0 -2,-0.3 2,-0.4 -0.602 38.7-168.9 -81.7 143.7 17.6 61.8 65.7 156 158 A W E -FG 183 163E 11 27,-2.8 27,-3.6 7,-0.3 7,-0.2 -0.996 17.6-150.6-139.6 130.9 20.0 64.2 67.4 157 159 A C E >> - G 0 162E 0 5,-2.2 4,-2.0 -2,-0.4 5,-1.1 -0.902 6.5-157.6-101.4 117.5 22.3 63.8 70.4 158 160 A P T 45S+ 0 0 40 0, 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42.9 43.3 557 559 A L T 3<5S- 0 0 49 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.681 119.3-116.3 -75.0 -16.7 28.7 44.9 42.0 558 560 A G T < 5S+ 0 0 59 -3,-1.6 -3,-0.2 -4,-0.5 -2,-0.1 0.662 87.8 109.1 90.3 19.3 30.3 41.6 41.2 559 561 A M S -C 590 0O 161 3,-2.4 3,-2.0 -2,-0.4 2,-0.1 -0.915 67.3 -48.0-141.5 107.8 17.7 46.4 109.4 588 590 A G T 3 S- 0 0 61 -2,-0.4 -1,-0.0 1,-0.3 0, 0.0 -0.444 121.0 -22.7 65.5-132.9 16.1 43.0 109.6 589 591 A S T 3 S+ 0 0 77 -2,-0.1 21,-1.8 -3,-0.1 2,-0.5 0.414 121.1 93.8 -91.1 2.5 15.6 41.6 106.1 590 592 A V E < -CD 587 609O 69 -3,-2.0 -3,-2.4 19,-0.2 2,-0.6 -0.849 57.3-159.9-106.3 127.6 15.6 45.1 104.6 591 593 A V E -CD 586 608O 0 17,-4.3 17,-2.6 -2,-0.5 2,-0.4 -0.891 12.3-149.2-103.0 121.4 18.6 46.8 103.1 592 594 A R E -CD 585 607O 118 -7,-3.3 -7,-1.8 -2,-0.6 15,-0.2 -0.766 7.2-152.8 -91.8 133.7 18.3 50.6 102.8 593 595 A L - 0 0 2 13,-3.1 -9,-0.1 -2,-0.4 -2,-0.0 -0.911 9.5-139.2-110.5 114.5 20.1 52.3 99.9 594 596 A P > - 0 0 25 0, 0.0 4,-2.6 0, 0.0 3,-0.4 -0.324 34.5-100.4 -65.8 156.2 21.3 55.9 100.3 595 597 A E H > S+ 0 0 92 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.846 120.6 51.3 -45.3 -48.1 20.8 58.0 97.2 596 598 A P H > S+ 0 0 70 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.944 114.0 44.5 -58.7 -45.9 24.4 57.9 96.0 597 599 A T H > S+ 0 0 0 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.916 114.3 48.5 -63.6 -45.6 24.5 54.1 96.3 598 600 A R H X>S+ 0 0 54 -4,-2.6 5,-1.3 1,-0.2 4,-1.0 0.920 111.2 51.1 -61.4 -44.7 21.1 53.7 94.6 599 601 A I H <5S+ 0 0 100 -4,-2.8 3,-0.4 -5,-0.3 -1,-0.2 0.891 108.9 49.6 -62.0 -40.9 22.1 56.0 91.8 600 602 A R H <5S+ 0 0 120 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.888 111.1 50.2 -65.9 -36.5 25.4 54.1 91.1 601 603 A L H <5S- 0 0 15 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.661 103.4-139.9 -73.4 -16.9 23.4 50.8 91.0 602 604 A E T <5 + 0 0 154 -4,-1.0 -3,-0.2 -3,-0.4 -2,-0.1 0.908 55.9 127.1 57.1 47.5 21.0 52.5 88.6 603 605 A I < - 0 0 34 -5,-1.3 -1,-0.2 2,-0.2 -2,-0.1 -0.938 63.7-131.6-129.7 153.8 17.9 50.9 90.1 604 606 A P S S+ 0 0 104 0, 0.0 2,-0.2 0, 0.0 -5,-0.1 0.672 75.1 104.2 -79.3 -15.6 14.6 52.6 91.3 605 607 A E - 0 0 86 1,-0.2 -2,-0.2 -7,-0.1 3,-0.1 -0.459 42.6-178.1 -72.7 133.3 14.6 50.7 94.7 606 608 A S S S+ 0 0 61 -2,-0.2 -13,-3.1 1,-0.2 2,-0.4 0.454 80.5 43.0-101.2 -7.2 15.6 52.6 97.8 607 609 A A E -D 592 0O 53 -15,-0.2 2,-0.3 -9,-0.0 -15,-0.2 -1.000 65.3-179.9-141.6 136.7 15.1 49.4 99.7 608 610 A L E -D 591 0O 6 -17,-2.6 -17,-4.3 -2,-0.4 2,-0.1 -0.985 25.3-126.3-135.0 144.4 16.0 45.8 98.9 609 611 A S E > -D 590 0O 32 -2,-0.3 4,-2.0 -19,-0.2 -19,-0.2 -0.489 33.0-110.3 -82.7 163.2 15.4 42.6 100.9 610 612 A L H > S+ 0 0 80 -21,-1.8 4,-2.4 1,-0.2 5,-0.1 0.852 123.0 56.7 -61.2 -31.3 18.5 40.4 101.6 611 613 A E H > S+ 0 0 82 -22,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.880 103.6 51.7 -67.3 -38.0 16.9 38.0 99.1 612 614 A D H > S+ 0 0 66 -3,-0.2 4,-2.0 2,-0.2 6,-0.2 0.904 109.4 50.5 -63.7 -42.1 16.9 40.7 96.4 613 615 A V H <>S+ 0 0 6 -4,-2.0 5,-2.4 2,-0.2 -2,-0.2 0.940 112.8 46.0 -61.3 -47.0 20.6 41.4 97.0 614 616 A R H ><5S+ 0 0 156 -4,-2.4 3,-1.9 1,-0.2 -2,-0.2 0.947 111.4 52.7 -60.2 -49.3 21.4 37.7 96.8 615 617 A K H 3<5S+ 0 0 140 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.817 105.3 52.5 -58.4 -36.3 19.3 37.3 93.6 616 618 A M T 3<5S- 0 0 67 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.398 120.7-108.3 -82.5 5.9 20.9 40.1 91.7 617 619 A G T < 5S+ 0 0 35 -3,-1.9 -3,-0.2 1,-0.2 2,-0.2 0.672 76.7 130.6 79.3 18.4 24.3 38.5 92.5 618 620 A A < - 0 0 11 -5,-2.4 2,-0.3 -6,-0.2 -1,-0.2 -0.511 35.7-167.2-100.9 169.5 25.4 41.1 95.0 619 621 A E E -B 631 0N 82 12,-2.3 12,-3.0 -2,-0.2 2,-0.5 -0.975 22.6-118.5-150.7 158.6 26.8 40.8 98.5 620 622 A L E -B 630 0N 45 -2,-0.3 10,-0.2 10,-0.2 8,-0.0 -0.894 29.4-169.5-104.8 127.3 27.4 43.1 101.5 621 623 A R E -B 629 0N 71 8,-2.6 8,-2.3 -2,-0.5 6,-0.1 -0.962 26.9-113.9-121.2 132.6 31.0 43.5 102.6 622 624 A P E -B 628 0N 118 0, 0.0 2,-0.3 0, 0.0 6,-0.2 -0.346 36.9-154.7 -59.7 138.1 32.2 45.2 105.8 623 625 A H > - 0 0 68 4,-2.5 3,-1.6 1,-0.1 4,-0.1 -0.852 25.5-119.1-117.5 154.2 34.2 48.3 105.0 624 626 A E T 3 S+ 0 0 192 -2,-0.3 -1,-0.1 1,-0.3 4,-0.1 0.740 108.4 74.1 -62.8 -21.3 37.0 50.1 106.9 625 627 A D T 3 S- 0 0 84 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.369 119.9-106.3 -74.0 8.8 34.8 53.2 107.0 626 628 A G S < S+ 0 0 71 -3,-1.6 2,-0.2 1,-0.3 -2,-0.2 0.456 88.2 96.3 82.4 1.5 32.7 51.3 109.6 627 629 A T S S- 0 0 55 -4,-0.1 -4,-2.5 -6,-0.1 2,-0.4 -0.690 76.6-104.5-119.4 172.4 29.8 50.6 107.3 628 630 A L E -AB 584 622N 58 -44,-0.7 -44,-2.3 -2,-0.2 2,-0.3 -0.816 34.0-157.1 -95.6 134.6 28.6 47.8 105.0 629 631 A H E -AB 583 621N 13 -8,-2.3 -8,-2.6 -2,-0.4 2,-0.6 -0.855 14.8-126.1-112.3 149.7 29.0 48.3 101.3 630 632 A L E -AB 582 620N 0 -48,-2.8 -49,-2.9 -2,-0.3 -48,-0.5 -0.845 29.0-173.5 -96.5 121.4 27.1 46.6 98.5 631 633 A W E +AB 580 619N 58 -12,-3.0 -12,-2.3 -2,-0.6 -51,-0.2 -0.886 8.8 165.9-112.8 146.8 29.3 44.9 95.9 632 634 A K E -A 579 0N 48 -53,-2.1 -53,-1.7 -2,-0.4 -14,-0.2 -0.974 42.7 -99.1-159.2 142.7 28.1 43.3 92.7 633 635 A P E -A 578 0N 20 0, 0.0 2,-0.3 0, 0.0 -55,-0.2 -0.462 47.1-179.2 -64.4 134.7 29.7 42.0 89.5 634 636 A A E -A 577 0N 5 -57,-2.2 -57,-2.3 -2,-0.1 3,-0.1 -0.971 39.8 -78.2-135.4 149.9 29.4 44.7 86.8 635 637 A V E -A 576 0N 60 -2,-0.3 2,-0.4 -59,-0.2 -59,-0.3 -0.194 54.0-111.7 -49.0 126.9 30.5 44.8 83.2 636 638 A M + 0 0 6 -61,-2.8 2,-0.3 5,-0.1 -61,-0.2 -0.492 63.9 130.2 -66.2 119.1 34.2 45.5 83.0 637 639 A S >> - 0 0 28 -2,-0.4 5,-1.2 1,-0.1 4,-0.9 -0.985 67.3-107.2-164.5 163.7 34.7 48.9 81.5 638 640 A K T >45S+ 0 0 113 -2,-0.3 3,-1.4 1,-0.2 5,-0.1 0.944 115.1 57.3 -61.0 -52.3 36.4 52.3 81.9 639 641 A S T 345S+ 0 0 112 1,-0.3 -1,-0.2 2,-0.1 -3,-0.1 0.798 109.9 47.2 -51.0 -31.4 33.2 54.2 82.9 640 642 A K T 345S- 0 0 74 -3,-0.3 -1,-0.3 -5,-0.1 -2,-0.2 0.673 99.9-138.1 -85.4 -19.7 32.9 51.7 85.8 641 643 A G T <<5S+ 0 0 69 -3,-1.4 -3,-0.2 -4,-0.9 -2,-0.1 0.722 75.1 109.6 68.1 21.0 36.5 52.0 86.9 642 644 A N < + 0 0 20 -5,-1.2 2,-0.1 -7,-0.2 -4,-0.1 0.092 41.4 136.8-112.8 20.0 36.6 48.2 87.4 643 645 A G - 0 0 21 -6,-0.4 2,-0.7 -5,-0.1 -597,-0.0 -0.422 46.6-147.9 -73.2 140.8 38.9 47.4 84.5 644 646 A V - 0 0 33 -2,-0.1 -596,-1.9 4,-0.0 2,-0.2 -0.936 24.1-147.0-106.5 107.3 41.7 44.9 84.9 645 647 A M B > -D 47 0C 69 -2,-0.7 4,-1.6 -598,-0.2 -598,-0.2 -0.520 9.1-134.1 -79.3 143.9 44.4 46.2 82.5 646 648 A V H > S+ 0 0 0 -600,-0.9 4,-3.0 -2,-0.2 5,-0.4 0.940 97.0 57.0 -60.4 -55.7 46.7 43.8 80.7 647 649 A G H > S+ 0 0 29 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.915 113.0 38.1 -43.7 -61.4 50.1 45.5 81.3 648 650 A P H > S+ 0 0 89 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.869 118.2 49.3 -61.6 -40.6 49.9 45.5 85.2 649 651 A F H X S+ 0 0 27 -4,-1.6 4,-3.0 1,-0.2 5,-0.3 0.940 112.6 45.8 -66.2 -47.1 48.3 42.1 85.4 650 652 A V H < S+ 0 0 17 -4,-3.0 -1,-0.2 3,-0.2 5,-0.2 0.810 111.3 53.9 -65.1 -32.5 50.8 40.4 83.1 651 653 A K H < S+ 0 0 170 -4,-1.8 -1,-0.2 -5,-0.4 -2,-0.2 0.925 119.0 33.0 -68.4 -45.0 53.7 42.0 84.9 652 654 A E H < S+ 0 0 146 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.779 142.6 5.4 -82.9 -28.3 52.6 40.8 88.3 653 655 A Q S < S- 0 0 33 -4,-3.0 2,-0.3 -5,-0.2 -3,-0.2 0.518 97.3-104.1-117.7 -93.8 51.1 37.5 87.2 654 656 A G > - 0 0 0 -5,-0.3 4,-1.6 1,-0.1 -3,-0.1 -0.919 17.3 -99.5 169.6 165.5 51.4 36.4 83.5 655 657 A A H > S+ 0 0 0 -2,-0.3 4,-3.0 2,-0.2 5,-0.2 0.933 117.3 48.2 -71.4 -48.8 49.7 35.9 80.2 656 658 A D H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.877 110.6 54.1 -61.2 -34.9 49.0 32.2 80.4 657 659 A I H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.944 112.0 43.8 -62.2 -46.5 47.5 32.8 83.9 658 660 A A H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.908 113.5 51.1 -64.9 -43.3 45.2 35.5 82.4 659 661 A R H X S+ 0 0 0 -4,-3.0 4,-2.9 2,-0.2 -2,-0.2 0.913 113.2 44.2 -61.5 -45.6 44.3 33.3 79.4 660 662 A I H X S+ 0 0 2 -4,-2.7 4,-2.4 2,-0.2 5,-0.3 0.905 110.5 55.7 -67.1 -40.6 43.4 30.3 81.5 661 663 A T H X S+ 0 0 7 -4,-2.4 4,-0.9 -5,-0.3 -2,-0.2 0.950 115.1 39.5 -55.7 -48.6 41.5 32.5 84.0 662 664 A I H >< S+ 0 0 5 -4,-2.4 3,-0.6 1,-0.2 4,-0.5 0.965 118.2 45.6 -65.2 -54.5 39.4 33.8 81.1 663 665 A L H 3< S+ 0 0 7 -4,-2.9 80,-0.2 1,-0.2 -1,-0.2 0.720 116.6 42.6 -65.7 -25.8 38.9 30.6 79.2 664 666 A F H 3< S+ 0 0 88 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.593 90.4 88.2 -97.2 -11.3 38.1 28.3 82.1 665 667 A A S << S- 0 0 47 -4,-0.9 -2,-0.1 -3,-0.6 -1,-0.1 0.857 104.7 -44.1 -56.2 -42.5 35.7 30.7 83.9 666 668 A A S S- 0 0 25 -4,-0.5 74,-0.2 -3,-0.1 -1,-0.1 -0.965 83.5 -48.4-174.9 175.0 32.5 29.6 82.1 667 669 A P > - 0 0 37 0, 0.0 3,-1.7 0, 0.0 -94,-0.2 -0.392 58.2-122.7 -58.4 139.4 31.2 28.8 78.7 668 670 A P T 3 S+ 0 0 6 0, 0.0 -95,-2.9 0, 0.0 70,-0.1 0.785 109.1 60.8 -57.5 -27.5 32.3 31.7 76.4 669 671 A E T 3 S+ 0 0 96 -97,-0.3 2,-0.1 2,-0.1 -95,-0.1 0.711 99.6 72.1 -72.4 -18.7 28.8 32.6 75.4 670 672 A N S < S- 0 0 83 -3,-1.7 -97,-0.5 -97,-0.2 2,-0.1 -0.482 93.0-101.4 -92.9 166.3 28.0 33.3 79.0 671 673 A E - 0 0 116 -2,-0.1 2,-0.3 -98,-0.1 -96,-0.2 -0.398 38.8-163.1 -77.7 162.9 29.1 36.2 81.2 672 674 A M E -z 575 0N 9 -98,-1.9 -96,-3.8 -2,-0.1 2,-0.5 -0.982 15.9-129.7-146.2 154.8 31.9 35.5 83.6 673 675 A V E -z 576 0N 46 -2,-0.3 2,-0.5 -98,-0.2 -96,-0.2 -0.936 20.6-132.1-110.6 125.5 33.3 37.3 86.6 674 676 A W E +z 577 0N 26 -98,-3.3 -96,-0.6 -2,-0.5 2,-0.3 -0.656 43.0 172.1 -72.7 122.1 37.0 38.0 86.8 675 677 A T > - 0 0 43 -2,-0.5 4,-2.2 -98,-0.1 5,-0.1 -0.949 50.5-122.5-137.4 159.9 38.0 36.8 90.3 676 678 A E H > S+ 0 0 120 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.871 115.6 57.1 -63.4 -37.7 41.0 36.2 92.5 677 679 A E H > S+ 0 0 127 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.874 106.1 50.4 -62.1 -36.7 39.8 32.6 92.9 678 680 A G H > S+ 0 0 27 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.944 110.5 48.1 -65.6 -47.9 39.9 32.2 89.1 679 681 A V H X S+ 0 0 4 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.918 112.2 49.2 -58.3 -46.0 43.5 33.6 88.9 680 682 A Q H X S+ 0 0 82 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.870 108.8 54.0 -62.1 -36.9 44.6 31.3 91.7 681 683 A G H X S+ 0 0 17 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.863 107.4 49.8 -65.7 -36.3 43.0 28.4 89.9 682 684 A A H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.915 111.1 50.1 -68.1 -42.2 44.9 29.2 86.7 683 685 A W H X S+ 0 0 58 -4,-2.2 4,-2.7 1,-0.2 5,-0.3 0.946 109.8 50.3 -59.1 -49.8 48.1 29.3 88.8 684 686 A R H X S+ 0 0 146 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.888 112.8 47.0 -57.5 -41.3 47.4 26.0 90.4 685 687 A F H X S+ 0 0 11 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.942 114.2 44.5 -68.1 -48.7 46.7 24.4 87.0 686 688 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.876 113.3 51.7 -64.9 -37.2 49.9 25.7 85.3 687 689 A N H X S+ 0 0 56 -4,-2.7 4,-2.7 -5,-0.2 -1,-0.2 0.893 108.8 52.0 -63.7 -40.3 52.0 24.9 88.3 688 690 A R H X S+ 0 0 84 -4,-1.7 4,-1.4 -5,-0.3 -1,-0.2 0.828 109.7 48.5 -66.5 -33.9 50.7 21.3 88.2 689 691 A I H X S+ 0 0 2 -4,-1.6 4,-1.9 2,-0.2 3,-0.2 0.962 113.6 46.6 -69.4 -52.7 51.5 20.9 84.5 690 692 A Y H X S+ 0 0 26 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.902 111.0 52.1 -55.2 -46.9 55.1 22.3 85.0 691 693 A R H X S+ 0 0 125 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.852 106.8 53.1 -60.4 -38.5 55.7 20.1 88.1 692 694 A R H X S+ 0 0 21 -4,-1.4 4,-1.3 -3,-0.2 -1,-0.2 0.930 114.7 40.3 -63.9 -46.8 54.6 16.9 86.2 693 695 A V H X S+ 0 0 5 -4,-1.9 4,-0.9 2,-0.2 -2,-0.2 0.894 115.2 50.6 -70.8 -41.2 57.0 17.5 83.4 694 696 A A H < S+ 0 0 13 -4,-2.7 3,-0.5 1,-0.2 4,-0.4 0.891 107.2 54.9 -64.2 -40.3 59.9 18.7 85.5 695 697 A E H < S+ 0 0 105 -4,-2.2 4,-0.2 -5,-0.2 -1,-0.2 0.882 120.4 31.7 -60.7 -37.1 59.6 15.7 87.8 696 698 A D H X S+ 0 0 2 -4,-1.3 4,-3.3 -5,-0.2 5,-0.3 0.404 87.5 107.2-102.5 3.0 59.9 13.4 84.8 697 699 A R H X S+ 0 0 87 -4,-0.9 4,-2.0 -3,-0.5 -1,-0.1 0.872 81.1 46.5 -47.3 -51.3 62.2 15.6 82.6 698 700 A E H > S+ 0 0 159 -4,-0.4 4,-1.0 2,-0.2 -1,-0.2 0.943 116.6 42.8 -60.8 -50.9 65.3 13.4 83.1 699 701 A A H >4 S+ 0 0 30 -4,-0.2 3,-0.7 1,-0.2 -2,-0.2 0.908 112.1 55.2 -63.5 -41.6 63.6 10.1 82.5 700 702 A L H >< S+ 0 0 2 -4,-3.3 3,-1.5 1,-0.2 -1,-0.2 0.877 102.3 57.1 -58.4 -40.1 61.7 11.6 79.5 701 703 A L H 3< S+ 0 0 100 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.803 109.3 45.1 -62.5 -30.6 65.0 12.7 77.9 702 704 A E T << S+ 0 0 154 -4,-1.0 2,-0.4 -3,-0.7 -1,-0.3 0.236 101.2 90.7 -97.8 14.2 66.3 9.1 77.9 703 705 A T < - 0 0 24 -3,-1.5 2,-0.2 -4,-0.1 60,-0.1 -0.890 67.5-137.7-115.1 140.5 63.0 7.6 76.7 704 706 A S - 0 0 71 -2,-0.4 63,-0.2 2,-0.1 64,-0.2 -0.607 7.6-144.6 -88.5 154.5 61.9 6.9 73.1 705 707 A G + 0 0 24 -2,-0.2 2,-0.4 62,-0.1 -1,-0.1 0.398 65.6 109.5 -99.3 3.3 58.3 7.8 72.1 706 708 A V + 0 0 121 2,-0.0 2,-0.3 61,-0.0 -2,-0.1 -0.640 38.7 138.6 -84.6 132.6 58.0 4.8 69.7 707 709 A F - 0 0 61 -2,-0.4 2,-0.7 57,-0.1 3,-0.1 -0.974 52.6-108.1-163.6 166.3 55.7 1.9 70.7 708 710 A Q >> - 0 0 130 -2,-0.3 3,-1.6 1,-0.2 4,-0.5 -0.913 22.3-156.8-107.9 103.9 53.1 -0.5 69.4 709 711 A A G >4 S+ 0 0 30 -2,-0.7 3,-2.1 1,-0.3 -1,-0.2 0.888 93.0 55.5 -45.5 -53.2 49.6 0.4 70.7 710 712 A E G 34 S+ 0 0 185 1,-0.3 -1,-0.3 -3,-0.1 7,-0.0 0.765 104.3 55.6 -55.7 -27.1 48.3 -3.1 70.2 711 713 A A G <4 S+ 0 0 60 -3,-1.6 -1,-0.3 2,-0.0 -2,-0.2 0.546 85.0 106.5 -85.1 -7.5 51.1 -4.5 72.4 712 714 A L << + 0 0 24 -3,-2.1 2,-0.3 -4,-0.5 -5,-0.0 -0.382 46.3 177.9 -72.4 151.5 50.3 -2.2 75.4 713 715 A E >> + 0 0 150 -2,-0.1 3,-1.3 4,-0.0 4,-0.6 -0.945 40.8 1.9-147.2 166.6 48.7 -3.7 78.5 714 716 A G H 3> S- 0 0 58 -2,-0.3 4,-1.9 1,-0.3 3,-0.4 -0.209 127.5 -7.3 56.4-140.2 47.5 -2.7 81.9 715 717 A K H 3> S+ 0 0 50 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.800 133.8 61.5 -58.7 -30.0 47.9 0.9 82.9 716 718 A D H <> S+ 0 0 18 -3,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.936 107.4 42.8 -63.1 -45.5 49.8 1.6 79.7 717 719 A R H X S+ 0 0 162 -4,-0.6 4,-1.7 -3,-0.4 -2,-0.2 0.878 113.2 53.2 -66.9 -38.7 46.8 0.6 77.5 718 720 A E H X S+ 0 0 95 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.885 108.4 49.9 -63.3 -40.3 44.4 2.5 79.8 719 721 A L H X S+ 0 0 5 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.897 106.8 54.9 -66.5 -40.3 46.5 5.7 79.4 720 722 A Y H X S+ 0 0 33 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.893 109.9 47.1 -59.9 -41.3 46.6 5.4 75.6 721 723 A G H X S+ 0 0 11 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.923 112.3 48.3 -67.0 -44.7 42.8 5.2 75.6 722 724 A K H X S+ 0 0 77 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.872 108.8 56.5 -62.7 -37.6 42.4 8.2 77.9 723 725 A L H X S+ 0 0 1 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.959 111.7 40.0 -59.7 -52.9 44.8 10.1 75.8 724 726 A H H X S+ 0 0 4 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.833 112.7 55.1 -69.9 -27.9 42.8 9.6 72.6 725 727 A E H X S+ 0 0 105 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.911 110.9 47.2 -66.8 -39.9 39.5 10.2 74.4 726 728 A T H X S+ 0 0 15 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.903 109.7 52.4 -66.4 -42.3 41.0 13.5 75.6 727 729 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.903 110.5 48.2 -61.0 -42.7 42.2 14.4 72.1 728 730 A K H X S+ 0 0 83 -4,-2.1 4,-2.4 2,-0.2 5,-0.3 0.942 113.8 46.5 -63.2 -47.5 38.7 13.8 70.7 729 731 A K H X S+ 0 0 81 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.922 115.2 45.6 -61.2 -46.5 37.0 15.9 73.4 730 732 A V H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -1,-0.2 0.897 113.2 49.4 -65.3 -42.8 39.5 18.8 73.1 731 733 A T H X S+ 0 0 22 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.934 114.8 43.5 -63.4 -48.0 39.4 18.9 69.3 732 734 A E H X S+ 0 0 89 -4,-2.4 4,-1.5 -5,-0.2 -2,-0.2 0.891 113.6 51.6 -66.7 -38.5 35.6 18.9 69.1 733 735 A D H <>S+ 0 0 0 -4,-2.3 5,-3.4 -5,-0.3 4,-0.3 0.908 109.3 50.5 -64.7 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-44.5 49.0 11.4 84.2 754 756 A Y H X S+ 0 0 22 -4,-1.9 4,-0.6 2,-0.2 -2,-0.2 0.936 115.1 48.1 -62.8 -46.4 49.7 11.8 87.9 755 757 A E H >X S+ 0 0 99 -4,-2.6 3,-1.1 1,-0.2 4,-0.6 0.916 109.9 53.4 -59.9 -43.6 47.6 8.7 88.7 756 758 A Y H >X S+ 0 0 2 -4,-2.6 4,-3.0 1,-0.3 3,-1.5 0.920 104.8 54.0 -56.5 -47.4 49.5 6.8 86.0 757 759 A R H 3< S+ 0 0 60 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.597 93.6 70.5 -68.4 -10.3 52.9 7.7 87.4 758 760 A K H << S+ 0 0 152 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.805 118.7 19.3 -74.0 -26.6 51.9 6.3 90.8 759 761 A D H << S+ 0 0 113 -3,-1.5 -2,-0.2 -4,-0.6 -3,-0.1 0.735 124.4 49.7-109.7 -34.8 52.0 2.8 89.2 760 762 A R < - 0 0 88 -4,-3.0 -1,-0.1 -5,-0.2 3,-0.1 -0.811 69.5-131.1-114.9 151.8 54.1 3.2 86.1 761 763 A P - 0 0 68 0, 0.0 2,-0.5 0, 0.0 5,-0.1 -0.164 56.1 -62.7 -83.5-175.4 57.5 4.7 85.3 762 764 A V S S+ 0 0 20 4,-0.1 3,-0.0 -5,-0.1 -5,-0.0 -0.616 71.3 175.7 -72.0 119.9 58.2 7.1 82.4 763 765 A T > - 0 0 12 -2,-0.5 4,-3.0 -3,-0.1 5,-0.2 -0.726 46.5-100.4-122.6 171.7 57.4 5.0 79.3 764 766 A P H > S+ 0 0 45 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.914 125.5 48.1 -59.0 -41.8 57.2 5.5 75.5 765 767 A V H > S+ 0 0 2 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.889 112.0 50.3 -66.4 -35.8 53.5 5.8 75.7 766 768 A Y H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.918 108.7 51.6 -67.2 -42.2 53.8 8.2 78.6 767 769 A R H X S+ 0 0 40 -4,-3.0 4,-2.2 -63,-0.2 -2,-0.2 0.922 110.9 48.2 -60.0 -43.4 56.3 10.3 76.6 768 770 A T H X S+ 0 0 18 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.850 108.5 54.6 -65.7 -33.2 53.9 10.4 73.7 769 771 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.911 108.8 48.2 -66.0 -40.3 51.1 11.4 76.1 770 772 A I H X S+ 0 0 5 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.907 110.7 51.7 -65.4 -41.2 53.3 14.3 77.3 771 773 A R H X S+ 0 0 68 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.944 112.9 43.6 -60.4 -50.3 53.9 15.3 73.7 772 774 A Y H X S+ 0 0 47 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.852 110.4 57.8 -63.7 -35.3 50.2 15.3 72.8 773 775 A Y H X S+ 0 0 6 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.940 106.2 47.2 -61.6 -47.6 49.4 17.1 76.0 774 776 A L H X S+ 0 0 1 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.877 112.4 51.0 -63.0 -36.7 51.7 20.0 75.1 775 777 A Q H < S+ 0 0 5 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.930 112.3 45.1 -65.8 -44.6 50.2 20.2 71.6 776 778 A M H < S+ 0 0 0 -4,-2.6 4,-0.3 1,-0.2 -1,-0.2 0.767 113.0 52.7 -69.2 -26.5 46.7 20.3 73.0 777 779 A L H >X S+ 0 0 1 -4,-1.9 4,-2.5 -5,-0.2 3,-1.0 0.769 88.2 84.2 -79.1 -27.3 47.7 22.9 75.6 778 780 A F T 3< S+ 0 0 0 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.837 85.7 51.3 -46.4 -49.4 49.3 25.2 73.0 779 781 A P T 34 S+ 0 0 0 0, 0.0 -1,-0.3 0, 0.0 -717,-0.1 0.872 120.6 35.9 -60.0 -33.1 46.1 27.1 71.9 780 782 A F T <4 S+ 0 0 0 -3,-1.0 -2,-0.2 -4,-0.3 -117,-0.1 0.939 136.6 12.6 -85.6 -55.3 45.3 27.8 75.6 781 783 A A S X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.1 -1,-0.2 -0.677 72.4 167.4-125.7 73.7 48.6 28.4 77.4 782 784 A P H > + 0 0 0 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.818 69.7 56.3 -58.3 -37.6 51.1 28.8 74.4 783 785 A H H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.957 112.5 39.1 -64.4 -51.5 54.0 30.2 76.4 784 786 A L H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.907 116.5 52.1 -64.9 -41.4 54.3 27.3 78.9 785 787 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.925 112.3 45.1 -60.8 -45.4 53.5 24.7 76.2 786 788 A E H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.892 112.7 52.9 -65.9 -39.4 56.3 26.1 74.0 787 789 A E H < S+ 0 0 33 -4,-2.3 4,-0.3 -5,-0.2 -2,-0.2 0.953 114.3 39.3 -60.6 -52.8 58.7 26.3 76.9 788 790 A L H >< S+ 0 0 0 -4,-2.7 3,-1.6 1,-0.2 4,-0.5 0.863 109.8 62.0 -66.7 -37.0 58.2 22.7 78.0 789 791 A W H >X S+ 0 0 0 -4,-2.3 4,-2.7 -5,-0.3 3,-1.4 0.893 99.4 55.6 -56.3 -41.4 58.1 21.5 74.4 790 792 A H T 3< S+ 0 0 59 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.540 90.3 73.1 -72.5 -6.3 61.7 22.8 73.9 791 793 A W T <4 S+ 0 0 31 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.732 119.7 13.7 -75.9 -20.8 63.0 20.7 76.8 792 794 A F T <4 S+ 0 0 25 -3,-1.4 -2,-0.2 -4,-0.5 -3,-0.1 0.669 122.1 51.2-125.3 -30.0 62.6 17.7 74.6 793 795 A W < - 0 0 31 -4,-2.7 -1,-0.2 2,-0.1 0, 0.0 -0.865 59.7-141.1-121.1 153.3 62.0 18.6 71.0 794 796 A P S S+ 0 0 119 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.869 77.1 63.1 -75.0 -43.3 63.8 20.9 68.4 795 797 A D S S- 0 0 47 1,-0.1 2,-0.2 -6,-0.1 -2,-0.1 -0.065 85.8 -95.4 -80.8-178.9 60.9 22.5 66.5 796 798 A S >> - 0 0 0 1,-0.1 3,-1.3 -6,-0.0 4,-1.0 -0.600 30.8-114.4 -93.6 158.0 58.0 24.9 67.5 797 799 A L H 3> S+ 0 0 0 1,-0.3 4,-0.6 2,-0.2 3,-0.2 0.780 117.4 63.8 -62.9 -24.5 54.5 23.7 68.5 798 800 A F H 34 S+ 0 0 17 1,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.787 106.6 44.3 -67.9 -25.3 53.3 25.5 65.3 799 801 A E H <4 S+ 0 0 104 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.629 100.6 65.6 -94.6 -15.7 55.4 23.1 63.3 800 802 A A H < S- 0 0 25 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.612 92.5-150.8 -82.3 -12.1 54.5 19.8 65.0 801 803 A G < - 0 0 20 -4,-0.6 -734,-0.2 -3,-0.1 -1,-0.2 -0.211 32.2 -44.8 75.9-167.8 50.9 20.1 63.9 802 804 A W - 0 0 36 -736,-0.8 -30,-0.1 -737,-0.1 -26,-0.0 -0.871 67.0 -99.0-105.4 134.4 47.8 18.7 65.6 803 805 A P - 0 0 11 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.145 36.0-119.7 -51.3 140.0 47.8 15.2 67.1 804 806 A E - 0 0 165 1,-0.0 2,-0.2 -3,-0.0 -77,-0.1 -0.718 26.8-125.5 -87.5 129.2 46.2 12.5 65.0 805 807 A L - 0 0 51 -2,-0.4 2,-0.8 -78,-0.1 -81,-0.0 -0.504 8.9-143.6 -77.0 139.6 43.3 10.7 66.6 806 808 A D > - 0 0 46 -2,-0.2 3,-0.7 1,-0.2 4,-0.4 -0.862 12.4-169.8-105.2 97.9 43.2 6.9 66.9 807 809 A E G >> S+ 0 0 122 -2,-0.8 3,-2.1 1,-0.2 4,-0.6 0.888 84.0 56.2 -52.5 -47.8 39.6 5.9 66.4 808 810 A K G >4 S+ 0 0 148 1,-0.3 3,-0.9 2,-0.2 -1,-0.2 0.819 96.4 64.9 -58.0 -32.8 40.2 2.3 67.5 809 811 A A G <4 S+ 0 0 21 -3,-0.7 -1,-0.3 1,-0.2 -2,-0.2 0.682 97.1 59.0 -64.9 -15.6 41.6 3.5 70.8 810 812 A L G <4 0 0 47 -3,-2.1 -1,-0.2 -4,-0.4 -2,-0.2 0.751 360.0 360.0 -85.5 -25.5 38.1 4.8 71.5 811 813 A E << 0 0 179 -3,-0.9 -90,-0.0 -4,-0.6 -3,-0.0 -0.359 360.0 360.0 -60.5 360.0 36.3 1.5 71.2 812 ! 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 0.0 813 1814 A L 0 0 22 0, 0.0 -277,-0.1 0, 0.0 -775,-0.1 0.000 360.0 360.0 360.0 360.0 33.7 48.1 67.3 814 ! 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 0.0 815 1815 A X 0 0 28 0, 0.0 -479,-0.4 0, 0.0 -568,-0.3 0.000 360.0 360.0 360.0 360.0 -5.2 53.0 61.1