==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 18-DEC-08 3FLC . COMPND 2 MOLECULE: GLYCEROL KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS CASSELIFLAVUS; . AUTHOR P.BRIOZZO . 991 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36407.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 750 75.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 58 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 150 15.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 82 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 97 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 288 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 2.4 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 3 5 1 5 6 0 4 0 1 1 0 0 0 1 2 1 0 0 0 0 0 0 2 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 2 2 0 2 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 . 8 4 6 0 4 0 8 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 . 6 0 0 0 4 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 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 3 O E 0 0 169 0, 0.0 2,-1.0 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -49.5 52.3 44.8 30.3 2 4 O K + 0 0 81 1,-0.1 71,-0.1 71,-0.1 70,-0.1 -0.690 360.0 138.9-102.1 78.9 48.9 46.0 29.3 3 5 O N + 0 0 43 -2,-1.0 19,-0.5 69,-0.3 2,-0.3 0.170 52.5 62.8-108.9 19.0 48.1 48.5 32.1 4 6 O Y E -Ab 21 73A 47 68,-1.6 70,-3.7 17,-0.2 71,-0.7 -0.955 55.9-154.7-141.8 160.0 46.5 51.3 30.2 5 7 O V E -Ab 20 75A 0 15,-2.2 15,-3.0 -2,-0.3 2,-0.4 -0.982 15.0-148.3-131.4 140.6 43.4 52.1 28.1 6 8 O M E -Ab 19 76A 0 69,-2.2 71,-3.1 -2,-0.4 2,-0.4 -0.939 6.0-161.4-115.1 138.1 43.2 54.9 25.5 7 9 O A E -Ab 18 77A 1 11,-2.9 11,-2.6 -2,-0.4 2,-0.5 -0.959 2.9-158.9-116.6 133.8 40.1 56.8 24.6 8 10 O I E -Ab 17 78A 0 69,-3.0 71,-2.8 -2,-0.4 2,-0.7 -0.965 4.3-168.8-113.5 121.4 39.8 58.7 21.4 9 11 O D E -Ab 16 79A 15 7,-3.0 7,-1.7 -2,-0.5 2,-1.3 -0.892 2.2-167.2-114.1 98.4 37.2 61.5 21.4 10 12 O Q E -Ab 15 80A 0 69,-2.8 71,-2.5 -2,-0.7 5,-0.2 -0.721 22.5-174.1 -88.1 92.0 36.7 62.7 17.8 11 13 O G - 0 0 13 3,-1.8 70,-0.0 -2,-1.3 -2,-0.0 -0.172 38.8-105.8 -84.2 178.0 34.7 65.9 18.5 12 14 O T S S+ 0 0 9 1,-0.1 3,-0.1 68,-0.1 22,-0.1 0.841 119.1 23.2 -70.3 -34.1 33.0 68.4 16.3 13 15 O T S S+ 0 0 21 1,-0.3 21,-1.2 20,-0.1 2,-0.3 0.708 132.7 1.1-106.6 -28.4 35.7 71.0 16.9 14 16 O S E - C 0 33A 16 19,-0.2 -3,-1.8 -5,-0.1 2,-0.3 -0.969 62.0-121.9-154.9 166.8 38.8 69.0 17.9 15 17 O S E -AC 10 32A 0 17,-2.8 17,-2.6 -2,-0.3 2,-0.3 -0.877 26.5-171.1-113.1 148.4 40.1 65.5 18.4 16 18 O R E -AC 9 31A 67 -7,-1.7 -7,-3.0 -2,-0.3 2,-0.4 -0.987 11.9-164.6-140.2 147.6 41.5 64.3 21.7 17 19 O A E -AC 8 30A 0 13,-2.1 13,-1.5 -2,-0.3 2,-0.4 -0.999 13.6-177.3-132.1 129.3 43.3 61.1 22.8 18 20 O I E -AC 7 29A 7 -11,-2.6 -11,-2.9 -2,-0.4 2,-0.5 -0.990 15.8-149.2-131.5 138.6 43.6 60.3 26.5 19 21 O I E -AC 6 28A 0 9,-3.2 8,-3.1 -2,-0.4 9,-1.3 -0.926 17.6-170.2-108.5 127.2 45.4 57.4 28.3 20 22 O F E -AC 5 26A 11 -15,-3.0 -15,-2.2 -2,-0.5 6,-0.2 -0.875 11.7-139.8-116.0 150.4 43.9 56.2 31.6 21 23 O D E > -A 4 0A 29 4,-1.8 3,-2.3 -2,-0.3 -17,-0.2 -0.315 45.4 -80.4 -94.7-175.3 45.4 53.8 34.1 22 24 O R T 3 S+ 0 0 133 -19,-0.5 -18,-0.1 1,-0.3 -1,-0.0 0.682 131.2 56.2 -61.2 -19.1 43.5 51.1 36.0 23 25 O N T 3 S- 0 0 127 2,-0.1 -1,-0.3 439,-0.0 3,-0.1 0.264 119.9-110.0 -95.4 12.0 42.3 53.7 38.5 24 26 O G < + 0 0 10 -3,-2.3 2,-0.4 1,-0.2 -2,-0.2 0.768 68.4 152.7 66.9 24.9 40.8 55.6 35.7 25 27 O K - 0 0 138 1,-0.0 -4,-1.8 -4,-0.0 2,-0.5 -0.724 50.6-117.6 -91.9 136.7 43.5 58.3 36.2 26 28 O K E +C 20 0A 116 -2,-0.4 -6,-0.2 -6,-0.2 3,-0.1 -0.593 40.3 164.8 -72.4 118.8 44.5 60.5 33.2 27 29 O I E + 0 0 49 -8,-3.1 2,-0.3 -2,-0.5 -1,-0.2 0.625 64.5 9.0-109.0 -21.1 48.2 59.8 32.6 28 30 O G E +C 19 0A 0 -9,-1.3 -9,-3.2 39,-0.0 -1,-0.4 -0.980 62.2 165.8-160.5 146.4 48.5 61.3 29.1 29 31 O S E -C 18 0A 22 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.990 10.9-172.5-158.7 162.9 46.5 63.4 26.6 30 32 O S E -C 17 0A 31 -13,-1.5 -13,-2.1 -2,-0.3 2,-0.4 -0.962 7.7-161.5-158.7 142.8 46.6 65.5 23.5 31 33 O Q E -C 16 0A 97 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.2 -0.975 7.4-179.2-131.5 144.5 44.1 67.7 21.7 32 34 O K E -C 15 0A 105 -17,-2.6 -17,-2.8 -2,-0.4 26,-0.1 -0.946 16.8-143.9-149.1 122.1 44.1 68.9 18.1 33 35 O E E -C 14 0A 107 -2,-0.3 -19,-0.2 -19,-0.3 -20,-0.1 -0.399 18.0-160.7 -78.3 160.6 41.6 71.1 16.3 34 36 O F - 0 0 14 -21,-1.2 17,-0.1 -2,-0.1 16,-0.0 -0.962 32.9 -70.1-140.3 157.4 40.8 70.5 12.6 35 37 O P - 0 0 55 0, 0.0 2,-0.4 0, 0.0 12,-0.4 -0.136 38.4-155.0 -52.8 135.8 39.3 72.7 9.9 36 38 O Q - 0 0 37 10,-0.1 2,-0.5 2,-0.0 10,-0.2 -0.945 10.2-154.5-112.2 131.8 35.6 73.6 10.0 37 39 O Y B +F 45 0B 76 8,-2.4 8,-2.6 -2,-0.4 0, 0.0 -0.932 18.9 178.0-116.5 130.7 33.9 74.4 6.7 38 40 O F + 0 0 127 -2,-0.5 6,-0.1 6,-0.2 5,-0.1 -0.661 11.6 164.4-126.5 73.4 30.8 76.6 6.3 39 41 O P + 0 0 70 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.814 67.9 7.2 -60.8 -34.3 30.2 76.7 2.5 40 42 O K S > S- 0 0 128 3,-0.1 3,-2.9 0, 0.0 66,-0.1 -0.956 101.4 -61.9-146.3 164.2 26.6 78.1 2.8 41 43 O S T 3 S+ 0 0 54 -2,-0.3 3,-0.1 1,-0.3 307,-0.1 -0.227 125.0 2.0 -49.0 117.6 24.1 79.4 5.4 42 44 O G T 3 S+ 0 0 10 305,-0.3 63,-2.4 1,-0.3 2,-0.3 0.299 102.2 126.7 86.2 -10.9 23.5 76.6 7.8 43 45 O W < + 0 0 48 -3,-2.9 2,-0.4 61,-0.3 -1,-0.3 -0.638 32.8 178.9 -84.6 137.4 26.0 74.3 6.1 44 46 O V + 0 0 2 -2,-0.3 57,-1.8 57,-0.2 60,-0.4 -0.965 6.9 168.9-141.3 119.0 28.7 72.6 8.2 45 47 O E E -FG 37 100B 26 -8,-2.6 -8,-2.4 -2,-0.4 2,-0.3 -0.904 16.5-161.6-130.7 159.0 31.3 70.2 6.7 46 48 O H E - G 0 99B 0 53,-2.1 53,-2.6 -2,-0.3 2,-0.7 -0.919 28.2-118.2-132.1 158.0 34.5 68.5 7.7 47 49 O N > - 0 0 40 -12,-0.4 4,-2.1 -2,-0.3 3,-0.3 -0.905 21.7-150.8 -98.2 114.1 37.2 66.8 5.6 48 50 O A H > S+ 0 0 1 -2,-0.7 4,-2.2 49,-0.3 -1,-0.1 0.785 96.2 54.1 -57.2 -30.2 37.2 63.2 6.9 49 51 O N H > S+ 0 0 41 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.886 107.6 49.7 -71.7 -38.1 40.8 62.8 6.0 50 52 O E H > S+ 0 0 53 -3,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.871 109.7 51.9 -67.7 -34.9 41.7 65.9 8.1 51 53 O I H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.947 109.3 50.1 -64.3 -47.2 39.7 64.4 10.9 52 54 O W H X S+ 0 0 9 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.931 110.4 49.6 -56.8 -47.2 41.7 61.2 10.6 53 55 O N H X S+ 0 0 52 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.892 108.0 53.1 -61.3 -38.2 44.9 63.1 10.7 54 56 O S H X S+ 0 0 3 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.867 109.4 50.3 -64.7 -34.3 43.9 65.0 13.8 55 57 O V H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.926 110.4 47.9 -68.4 -45.1 43.1 61.6 15.4 56 58 O Q H X S+ 0 0 24 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.893 110.5 54.5 -62.0 -37.4 46.5 60.3 14.5 57 59 O S H X S+ 0 0 29 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.903 110.6 43.4 -63.2 -43.4 48.1 63.5 15.8 58 60 O V H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.829 110.7 55.4 -74.3 -29.9 46.5 63.2 19.2 59 61 O I H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.960 114.2 40.8 -64.3 -48.6 47.2 59.5 19.5 60 62 O A H X S+ 0 0 4 -4,-2.4 4,-3.3 1,-0.2 5,-0.2 0.932 113.7 54.3 -63.6 -45.7 50.9 60.3 18.9 61 63 O G H X S+ 0 0 19 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.902 107.3 49.7 -55.3 -44.9 50.8 63.3 21.1 62 64 O A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 6,-0.4 0.898 114.9 44.5 -62.7 -40.9 49.4 61.3 24.0 63 65 O F H X S+ 0 0 17 -4,-1.8 4,-2.1 -5,-0.2 5,-0.3 0.919 114.9 47.9 -69.5 -43.8 52.1 58.7 23.6 64 66 O I H < S+ 0 0 26 -4,-3.3 -2,-0.2 2,-0.2 -3,-0.2 0.929 115.4 44.5 -62.7 -46.8 54.9 61.2 23.2 65 67 O E H < S+ 0 0 122 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.902 121.2 37.9 -65.8 -42.8 53.8 63.3 26.2 66 68 O S H < S- 0 0 32 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.685 94.0-136.6 -84.2 -19.8 53.2 60.3 28.5 67 69 O G < + 0 0 64 -4,-2.1 2,-0.2 1,-0.3 -3,-0.1 0.486 59.5 138.3 75.8 -1.1 56.1 58.2 27.4 68 70 O I - 0 0 27 -6,-0.4 -1,-0.3 -5,-0.3 -2,-0.1 -0.510 48.2-133.3 -74.5 145.8 53.7 55.3 27.5 69 71 O R > - 0 0 90 -2,-0.2 3,-2.4 -3,-0.1 4,-0.2 -0.762 15.9-114.2-106.3 153.5 54.1 53.0 24.5 70 72 O P G > S+ 0 0 16 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 0.835 112.0 63.7 -46.2 -43.1 51.3 51.5 22.2 71 73 O E G 3 S+ 0 0 82 1,-0.3 162,-0.0 165,-0.1 164,-0.0 0.667 94.2 62.6 -61.0 -16.5 52.0 47.9 23.4 72 74 O A G < S+ 0 0 11 -3,-2.4 -68,-1.6 -70,-0.1 2,-0.6 0.474 78.8 103.6 -88.4 -1.2 50.9 48.9 26.9 73 75 O I E < -b 4 0A 0 -3,-2.2 -68,-0.2 -4,-0.2 3,-0.1 -0.734 49.9-170.7 -87.0 117.8 47.4 49.7 25.8 74 76 O A E S- 0 0 15 -70,-3.7 2,-0.3 -2,-0.6 -69,-0.2 0.769 70.5 -12.0 -75.4 -28.8 44.9 47.0 26.8 75 77 O G E -b 5 0A 0 -71,-0.7 -69,-2.2 161,-0.1 2,-0.4 -0.972 58.8-127.4-170.0 156.1 42.2 48.5 24.7 76 78 O I E -bd 6 238A 0 161,-2.2 163,-2.0 -2,-0.3 164,-1.4 -0.930 16.2-156.3-113.2 133.1 41.0 51.5 22.7 77 79 O G E -bd 7 240A 0 -71,-3.1 -69,-3.0 -2,-0.4 2,-0.5 -0.928 10.0-156.4-108.7 131.2 37.7 53.3 23.3 78 80 O I E +bd 8 241A 0 162,-3.6 164,-1.8 -2,-0.5 2,-0.3 -0.924 18.3 166.0-111.1 126.8 36.3 55.3 20.4 79 81 O T E +bd 9 242A 0 -71,-2.8 -69,-2.8 -2,-0.5 2,-0.3 -0.975 10.9 170.6-136.8 154.2 33.8 58.1 20.8 80 82 O N E -bd 10 243A 0 162,-0.9 164,-3.2 -2,-0.3 165,-0.3 -0.988 44.2 -77.5-160.0 164.6 32.7 60.8 18.4 81 83 O Q - 0 0 0 -71,-2.5 83,-0.5 -2,-0.3 84,-0.2 -0.489 64.2-129.5 -62.7 130.0 30.6 63.6 17.2 82 84 O R S S+ 0 0 3 -2,-0.2 2,-3.0 1,-0.2 20,-0.4 -0.243 74.3 20.1 -83.9 175.1 27.4 61.7 16.2 83 85 O E S S+ 0 0 3 101,-0.3 -1,-0.2 1,-0.2 17,-0.1 -0.073 79.4 135.5 61.9 -40.2 25.4 61.8 13.0 84 86 O T - 0 0 0 -2,-3.0 80,-0.6 1,-0.1 2,-0.5 -0.112 49.1-140.7 -40.8 129.0 28.3 63.3 11.0 85 87 O T E +HI 100 163B 0 15,-2.6 15,-2.1 78,-0.2 2,-0.4 -0.873 25.2 179.7-112.8 127.9 28.3 61.4 7.8 86 88 O V E - I 0 162B 0 76,-2.3 76,-2.1 -2,-0.5 2,-0.4 -0.946 4.8-171.2-119.5 138.7 31.2 60.1 5.7 87 89 O V E + I 0 161B 1 -2,-0.4 9,-2.9 10,-0.3 10,-0.5 -0.996 18.7 170.7-129.6 125.5 30.8 58.1 2.5 88 90 O W E -JI 95 160B 0 72,-2.3 72,-3.1 -2,-0.4 2,-0.4 -0.920 40.3 -99.2-137.3 161.8 34.0 56.6 1.0 89 91 O D E > - I 0 159B 30 5,-2.3 4,-2.3 -2,-0.3 70,-0.2 -0.665 28.9-144.7 -78.3 126.2 35.2 54.2 -1.7 90 92 O K T 4 S+ 0 0 108 68,-2.8 -1,-0.1 -2,-0.4 69,-0.1 0.695 95.8 44.7 -68.4 -17.9 35.8 50.8 -0.1 91 93 O T T 4 S+ 0 0 120 67,-0.4 -1,-0.2 3,-0.1 68,-0.1 0.906 125.1 27.9 -90.1 -50.4 38.8 50.1 -2.4 92 94 O T T 4 S- 0 0 99 2,-0.1 -2,-0.2 1,-0.0 -1,-0.1 0.741 92.6-139.9 -82.3 -24.7 40.6 53.5 -2.3 93 95 O G < + 0 0 11 -4,-2.3 -3,-0.1 1,-0.3 82,-0.1 0.559 55.6 139.5 74.9 7.8 39.4 54.3 1.2 94 96 O Q - 0 0 102 -5,-0.2 -5,-2.3 1,-0.1 -1,-0.3 -0.717 57.6-117.5 -90.4 130.0 38.9 57.9 -0.1 95 97 O P B -J 88 0B 9 0, 0.0 -7,-0.3 0, 0.0 3,-0.1 -0.303 14.6-135.2 -60.6 147.8 35.8 59.9 0.9 96 98 O I S S- 0 0 41 -9,-2.9 2,-0.3 1,-0.2 -8,-0.1 0.623 80.9 -24.1 -80.9 -12.1 33.7 60.9 -2.0 97 99 O A S S- 0 0 33 -10,-0.5 -10,-0.3 50,-0.1 -49,-0.3 -0.957 96.5 -44.3-176.7 179.5 33.4 64.3 -0.6 98 100 O N - 0 0 46 -2,-0.3 -51,-0.2 -51,-0.1 2,-0.2 -0.260 66.0-103.8 -58.7 150.5 33.6 66.3 2.7 99 101 O A E -G 46 0B 0 -53,-2.6 -53,-2.1 -13,-0.1 2,-0.7 -0.498 31.5-125.0 -74.4 146.9 31.8 64.7 5.6 100 102 O I E -GH 45 85B 0 -15,-2.1 -15,-2.6 -55,-0.2 -55,-0.2 -0.872 26.6-135.6 -99.1 116.1 28.5 66.3 6.4 101 103 O V > - 0 0 0 -57,-1.8 3,-0.9 -2,-0.7 -57,-0.2 -0.281 19.8-111.6 -69.4 153.2 28.5 67.4 10.1 102 104 O W T 3 S+ 0 0 4 -20,-0.4 -1,-0.1 1,-0.2 -19,-0.1 0.859 116.3 56.2 -52.0 -39.7 25.5 66.8 12.3 103 105 O Q T 3 S+ 0 0 10 203,-0.1 -1,-0.2 2,-0.0 31,-0.1 0.817 81.6 116.2 -63.1 -33.5 24.8 70.6 12.5 104 106 O S < - 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0 0 33 -3,-1.7 2,-0.2 4,-0.1 -4,-0.0 -0.472 48.4-160.7 -64.0 125.2 25.0 97.6 24.6 371 373 O T > - 0 0 57 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.535 34.4-104.4-105.3 171.4 28.6 96.7 25.0 372 374 O K H > S+ 0 0 99 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.927 124.9 54.8 -56.8 -44.1 30.9 93.9 23.9 373 375 O E H > S+ 0 0 50 1,-0.2 4,-2.5 2,-0.2 -38,-0.3 0.908 108.4 47.0 -55.3 -47.0 30.6 92.6 27.4 374 376 O D H > S+ 0 0 7 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.901 112.0 50.9 -62.6 -42.4 26.8 92.6 27.2 375 377 O F H X S+ 0 0 27 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.927 111.9 46.3 -62.4 -46.3 26.9 90.9 23.8 376 378 O V H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.912 111.0 52.4 -62.8 -44.2 29.2 88.2 25.1 377 379 O R H X S+ 0 0 39 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.922 109.7 48.9 -57.8 -46.4 27.1 87.6 28.2 378 380 O A H X S+ 0 0 4 -4,-2.3 4,-1.2 1,-0.2 -35,-0.5 0.891 110.4 51.3 -61.4 -40.2 24.0 87.2 26.1 379 381 O T H < S+ 0 0 4 -4,-2.0 4,-0.5 1,-0.2 3,-0.2 0.914 112.3 45.9 -64.1 -42.9 25.8 84.7 23.9 380 382 O L H >X S+ 0 0 18 -4,-2.4 3,-0.9 1,-0.2 4,-0.6 0.877 108.8 54.9 -66.7 -40.9 27.0 82.6 26.8 381 383 O Q H 3X S+ 0 0 14 -4,-2.4 4,-2.4 1,-0.2 3,-0.4 0.760 90.0 77.9 -65.6 -26.2 23.6 82.6 28.6 382 384 O A H 3X S+ 0 0 1 -4,-1.2 4,-2.7 1,-0.3 -1,-0.2 0.842 90.7 52.6 -54.2 -38.1 21.9 81.2 25.5 383 385 O V H <> S+ 0 0 8 -3,-0.9 4,-2.0 -4,-0.5 -1,-0.3 0.901 109.5 49.4 -67.7 -36.5 23.1 77.7 26.2 384 386 O A H X S+ 0 0 0 -4,-0.6 4,-1.3 -3,-0.4 -2,-0.2 0.911 113.3 46.9 -66.4 -42.2 21.7 77.9 29.7 385 387 O Y H X S+ 0 0 2 -4,-2.4 4,-1.9 2,-0.2 3,-0.3 0.927 112.0 48.7 -65.0 -46.6 18.4 79.1 28.4 386 388 O Q H X S+ 0 0 13 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.865 107.7 56.4 -62.6 -35.7 18.2 76.5 25.7 387 389 O S H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.857 106.4 50.5 -64.7 -33.6 19.1 73.8 28.3 388 390 O K H X S+ 0 0 23 -4,-1.3 4,-2.8 -3,-0.3 5,-0.3 0.876 104.0 57.6 -71.4 -37.3 16.0 75.0 30.3 389 391 O D H X S+ 0 0 10 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.942 113.1 42.1 -55.0 -45.4 13.8 74.7 27.2 390 392 O V H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.906 113.5 49.0 -68.4 -46.1 14.9 71.0 27.0 391 393 O I H X S+ 0 0 2 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.927 112.2 49.7 -61.9 -44.5 14.7 70.3 30.8 392 394 O D H X S+ 0 0 47 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.912 111.4 49.1 -59.7 -43.9 11.2 71.8 30.9 393 395 O T H X S+ 0 0 51 -4,-1.8 4,-2.4 -5,-0.3 5,-0.2 0.891 110.3 51.6 -63.6 -39.7 10.1 69.7 27.9 394 396 O M H X>S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 5,-0.5 0.916 110.3 47.9 -64.0 -44.0 11.6 66.6 29.5 395 397 O K H X5S+ 0 0 76 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.934 116.3 43.3 -62.0 -46.2 9.7 67.1 32.7 396 398 O K H <5S+ 0 0 191 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.830 120.7 41.0 -69.4 -33.8 6.4 67.8 30.9 397 399 O D H <5S+ 0 0 55 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.832 127.5 29.2 -84.9 -34.8 6.9 64.9 28.5 398 400 O S H <5S- 0 0 46 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.714 87.0-141.7 -97.7 -25.6 8.2 62.3 30.8 399 401 O G << + 0 0 60 -4,-2.1 2,-0.2 -5,-0.5 -4,-0.1 0.495 57.3 135.3 76.0 0.0 6.6 63.4 34.1 400 402 O I - 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0 0 13 -3,-1.1 4,-2.4 1,-0.2 3,-0.5 -0.614 59.5-166.5 -76.7 100.5 33.0 78.3 33.5 415 417 O D H > S+ 0 0 75 -2,-1.1 4,-2.4 1,-0.2 5,-0.2 0.842 85.7 53.7 -55.8 -39.3 31.7 78.6 37.1 416 418 O L H > S+ 0 0 94 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.855 110.0 47.8 -66.8 -34.4 29.6 81.6 36.4 417 419 O L H > S+ 0 0 9 -3,-0.5 4,-2.6 2,-0.2 -2,-0.2 0.925 112.5 47.7 -71.7 -44.8 27.8 79.9 33.5 418 420 O M H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.891 112.2 50.2 -63.4 -38.5 27.2 76.7 35.6 419 421 O Q H X S+ 0 0 33 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.915 111.1 48.7 -64.8 -42.3 25.8 78.9 38.4 420 422 O F H X S+ 0 0 26 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.893 109.4 53.9 -62.6 -40.5 23.6 80.7 36.0 421 423 O Q H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 5,-0.3 0.934 111.0 44.3 -59.1 -48.3 22.4 77.3 34.6 422 424 O A H X>S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 5,-1.1 0.888 114.1 51.9 -63.9 -39.6 21.5 76.2 38.1 423 425 O D H <5S+ 0 0 19 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.947 112.2 43.1 -62.8 -51.1 19.8 79.5 38.8 424 426 O I H <5S+ 0 0 0 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.878 121.5 40.1 -64.6 -39.4 17.7 79.5 35.7 425 427 O L H <5S- 0 0 10 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.791 98.1-142.3 -77.7 -29.6 16.7 75.9 36.1 426 428 O D T <5 + 0 0 81 -4,-2.3 2,-0.3 1,-0.3 -3,-0.2 0.878 65.3 102.6 66.1 39.7 16.4 76.3 39.8 427 429 O I S + 0 0 28 1,-0.2 4,-1.6 -28,-0.1 -1,-0.3 -0.330 55.6 139.9 -80.8 58.9 36.3 65.0 29.7 437 439 O T H > + 0 0 3 -2,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.731 62.7 67.2 -72.6 -22.8 33.7 62.5 30.9 438 440 O T H > S+ 0 0 8 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.956 103.9 41.4 -61.9 -51.7 33.1 61.6 27.3 439 441 O A H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.889 112.3 55.9 -63.6 -39.9 36.5 60.1 26.9 440 442 O L H X S+ 0 0 15 -4,-1.6 4,-2.6 1,-0.2 -1,-0.2 0.916 106.6 50.8 -58.5 -43.7 36.3 58.5 30.3 441 443 O G H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.913 110.6 47.7 -60.7 -44.0 33.0 56.8 29.2 442 444 O A H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.911 112.0 50.7 -63.4 -41.8 34.7 55.5 26.1 443 445 O A H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.892 108.9 51.6 -62.7 -41.2 37.6 54.2 28.1 444 446 O Y H X S+ 0 0 5 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.915 109.2 49.6 -62.7 -44.3 35.3 52.4 30.5 445 447 O L H X S+ 0 0 1 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.917 114.6 44.7 -60.9 -43.7 33.4 50.7 27.7 446 448 O A H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 6,-0.3 0.911 113.3 51.0 -66.9 -42.9 36.7 49.5 26.2 447 449 O G H X>S+ 0 0 0 -4,-2.9 5,-1.8 1,-0.2 6,-1.1 0.910 110.2 48.6 -61.7 -44.3 38.1 48.5 29.6 448 450 O L H <5S+ 0 0 27 -4,-2.8 3,-0.3 1,-0.2 -1,-0.2 0.899 107.7 57.2 -62.5 -40.1 35.0 46.5 30.4 449 451 O A H <5S+ 0 0 31 -4,-1.9 -227,-0.2 1,-0.2 -2,-0.2 0.903 114.5 34.6 -58.4 -46.0 35.2 44.8 27.0 450 452 O V H <5S- 0 0 52 -4,-1.8 -1,-0.2 -229,-0.1 -2,-0.2 0.523 116.2-106.5 -89.4 -6.9 38.7 43.4 27.5 451 453 O G T <5S+ 0 0 36 -4,-1.1 -3,-0.2 -3,-0.3 -4,-0.1 0.551 79.6 132.6 93.5 8.0 38.5 42.8 31.2 452 454 O F S > S- 0 0 88 1,-0.1 3,-0.9 -4,-0.0 4,-0.9 -0.984 70.9 -86.2-167.7 170.8 32.2 44.7 35.7 456 458 O L H >> S+ 0 0 36 -2,-0.3 4,-1.1 1,-0.2 3,-1.0 0.884 119.3 58.8 -55.4 -43.3 30.1 47.9 35.8 457 459 O D H 3> S+ 0 0 103 1,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.811 97.4 60.7 -59.9 -29.9 30.1 48.1 39.6 458 460 O E H X4 S+ 0 0 72 -3,-0.9 3,-0.5 1,-0.2 4,-0.3 0.853 98.7 59.0 -65.5 -31.7 33.9 48.3 39.6 459 461 O L H X< S+ 0 0 0 -3,-1.0 3,-2.1 -4,-0.9 4,-0.3 0.898 97.0 60.1 -61.9 -41.0 33.6 51.5 37.6 460 462 O K H >< S+ 0 0 82 -4,-1.1 3,-1.6 1,-0.3 -1,-0.2 0.810 92.9 65.8 -57.7 -31.5 31.5 53.1 40.3 461 463 O S T << S+ 0 0 96 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.639 101.0 50.9 -66.9 -13.5 34.4 52.7 42.7 462 464 O M T < S+ 0 0 33 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.2 0.432 81.7 129.6-101.3 -3.2 36.3 55.2 40.6 463 465 O A < + 0 0 58 -3,-1.6 2,-0.4 -4,-0.3 -211,-0.1 -0.266 31.4 177.4 -56.8 133.8 33.5 57.8 40.6 464 466 O E - 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0 0 34 -3,-1.7 2,-0.2 4,-0.1 -4,-0.0 -0.473 49.6-157.8 -66.5 125.8 63.3 107.1 9.4 869 373 X T > - 0 0 56 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.565 32.4-106.8-103.1 167.9 60.2 104.8 9.6 870 374 X K H > S+ 0 0 88 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.890 124.1 55.1 -56.2 -40.1 59.5 101.4 11.1 871 375 X E H > S+ 0 0 46 1,-0.2 4,-2.4 2,-0.2 -38,-0.3 0.908 107.5 48.0 -60.9 -44.1 59.6 100.2 7.6 872 376 X D H > S+ 0 0 9 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.915 112.1 50.0 -62.3 -44.1 63.0 101.6 7.0 873 377 X F H X S+ 0 0 28 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.928 111.8 46.9 -60.9 -48.6 64.3 100.1 10.2 874 378 X V H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.905 111.6 51.7 -61.1 -43.2 63.0 96.7 9.4 875 379 X R H X S+ 0 0 37 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.925 109.8 49.0 -60.1 -45.4 64.4 96.8 5.9 876 380 X A H X S+ 0 0 3 -4,-2.5 4,-1.1 1,-0.2 -35,-0.5 0.910 109.7 52.1 -61.0 -43.3 67.8 97.8 7.2 877 381 X T H >< S+ 0 0 3 -4,-2.3 3,-0.5 1,-0.2 4,-0.5 0.919 111.7 46.5 -59.7 -44.4 67.7 94.9 9.7 878 382 X L H >< S+ 0 0 23 -4,-2.3 3,-0.7 1,-0.2 4,-0.5 0.868 108.8 55.4 -66.3 -37.5 66.9 92.4 7.0 879 383 X Q H 3X S+ 0 0 15 -4,-2.2 4,-2.1 1,-0.2 3,-0.3 0.666 84.9 82.9 -72.1 -17.9 69.6 93.7 4.6 880 384 X A H S+ 0 0 10 -3,-0.7 4,-1.9 -4,-0.5 -1,-0.2 0.886 107.2 52.4 -61.4 -37.9 72.7 89.6 6.2 882 386 X A H > S+ 0 0 0 -4,-0.5 4,-1.2 -3,-0.3 -1,-0.2 0.900 111.5 46.4 -64.4 -42.0 73.0 90.5 2.5 883 387 X Y H >X S+ 0 0 3 -4,-2.1 4,-1.9 2,-0.2 3,-0.5 0.957 114.3 44.8 -66.3 -52.1 75.9 93.0 3.2 884 388 X Q H 3X S+ 0 0 15 -4,-2.6 4,-2.6 1,-0.3 -1,-0.2 0.824 106.8 61.1 -64.2 -28.6 77.9 90.7 5.5 885 389 X S H 3X S+ 0 0 0 -4,-1.9 4,-2.9 -5,-0.3 -1,-0.3 0.894 105.1 48.9 -63.8 -35.0 77.3 87.9 3.0 886 390 X K H S- 0 0 8 26,-2.2 3,-1.8 -146,-0.3 4,-0.2 -0.037 80.0 -76.2 103.6 151.0 66.8 78.6 3.8 908 412 X G G > S+ 0 0 50 1,-0.3 3,-1.6 2,-0.2 -145,-0.2 0.845 127.7 54.3 -49.7 -44.2 63.5 80.1 5.0 909 413 X A G > S+ 0 0 39 -147,-1.7 3,-1.5 1,-0.3 -1,-0.3 0.662 90.2 76.7 -68.2 -15.4 64.6 83.7 4.8 910 414 X A G < S+ 0 0 0 -3,-1.8 -1,-0.3 -148,-0.5 -2,-0.2 0.569 74.6 81.4 -71.1 -7.1 65.5 83.2 1.1 911 415 X K G < + 0 0 145 -3,-1.6 2,-0.9 -4,-0.2 -1,-0.3 0.753 67.1 98.0 -67.8 -24.8 61.8 83.3 0.4 912 416 X N <> - 0 0 12 -3,-1.5 4,-2.5 1,-0.2 5,-0.2 -0.548 55.8-170.6 -71.5 103.8 62.1 87.1 0.5 913 417 X D H > S+ 0 0 78 -2,-0.9 4,-2.5 1,-0.2 5,-0.2 0.868 86.5 54.1 -62.3 -38.8 62.3 88.2 -3.2 914 418 X L H > S+ 0 0 80 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.911 111.2 45.5 -62.0 -43.1 63.2 91.7 -2.2 915 419 X L H > S+ 0 0 8 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.900 113.6 47.9 -68.2 -43.3 66.0 90.5 -0.0 916 420 X M H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.877 111.2 50.8 -67.2 -36.8 67.4 88.1 -2.6 917 421 X Q H X S+ 0 0 32 -4,-2.5 4,-2.6 2,-0.2 53,-0.2 0.932 111.4 48.6 -64.8 -43.3 67.3 90.8 -5.3 918 422 X F H X S+ 0 0 13 -4,-2.0 4,-2.6 -5,-0.2 5,-0.3 0.888 109.6 53.5 -61.9 -39.2 69.1 93.1 -3.0 919 423 X Q H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 5,-0.2 0.931 111.6 43.9 -61.5 -46.6 71.6 90.3 -2.4 920 424 X A H X>S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 5,-1.0 0.873 113.2 53.9 -65.7 -38.1 72.2 89.9 -6.1 921 425 X D H <5S+ 0 0 15 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.931 111.8 40.5 -63.3 -50.5 72.4 93.6 -6.6 922 426 X I H <5S+ 0 0 2 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.836 121.2 43.3 -70.5 -32.6 75.1 94.4 -4.0 923 427 X L H <5S- 0 0 13 -4,-1.7 -2,-0.2 -5,-0.3 -1,-0.2 0.814 95.5-145.0 -79.0 -31.6 77.1 91.3 -4.9 924 428 X D T <5 + 0 0 69 -4,-2.2 2,-0.3 1,-0.3 -3,-0.2 0.924 64.1 102.7 63.4 45.8 76.7 91.9 -8.6 925 429 X I S + 0 0 19 1,-0.2 4,-1.6 -28,-0.1 -1,-0.2 -0.382 56.4 143.0 -84.4 60.4 64.5 73.4 2.9 935 439 X T H > + 0 0 3 -2,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.721 61.7 66.8 -72.6 -21.5 67.6 72.2 1.0 936 440 X T H > S+ 0 0 6 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.962 104.3 43.1 -63.1 -49.8 69.2 71.3 4.3 937 441 X A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.908 111.9 54.7 -62.6 -41.2 66.7 68.6 4.8 938 442 X L H X S+ 0 0 18 -4,-1.6 4,-2.8 1,-0.2 -1,-0.2 0.917 106.8 51.1 -58.4 -44.7 67.0 67.5 1.1 939 443 X G H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.900 109.8 48.8 -60.3 -42.1 70.7 67.1 1.5 940 444 X A H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.900 111.7 50.6 -64.8 -38.8 70.3 64.9 4.5 941 445 X A H X S+ 0 0 0 -4,-2.4 4,-3.3 2,-0.2 -2,-0.2 0.911 109.8 49.8 -63.9 -43.4 67.7 62.9 2.6 942 446 X Y H X S+ 0 0 7 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.920 109.5 52.1 -60.4 -45.7 70.1 62.5 -0.3 943 447 X L H X S+ 0 0 1 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.942 114.8 41.2 -55.9 -51.5 72.9 61.4 2.0 944 448 X A H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 6,-0.2 0.933 114.0 52.5 -64.0 -47.1 70.7 58.7 3.6 945 449 X G H <>S+ 0 0 0 -4,-3.3 5,-2.8 1,-0.2 6,-0.9 0.892 107.5 52.4 -56.7 -42.1 69.2 57.7 0.3 946 450 X L H ><5S+ 0 0 29 -4,-2.8 3,-0.9 1,-0.2 -1,-0.2 0.912 108.0 52.2 -60.2 -43.1 72.6 57.2 -1.2 947 451 X A H 3<5S+ 0 0 32 -4,-1.7 -227,-0.2 1,-0.2 -1,-0.2 0.820 114.8 39.9 -65.1 -33.7 73.7 55.0 1.7 948 452 X V T 3<5S- 0 0 47 -4,-1.7 -1,-0.2 -3,-0.1 -2,-0.2 0.310 116.0-107.9 -99.7 8.8 70.7 52.6 1.4 949 453 X G T < 5S+ 0 0 56 -3,-0.9 -3,-0.2 -4,-0.5 -4,-0.1 0.718 79.7 131.9 74.5 20.5 70.6 52.5 -2.4 950 454 X F S > - 0 0 69 1,-0.1 4,-1.4 -4,-0.0 3,-0.7 -0.970 69.6 -72.9-169.7 178.8 74.9 58.1 -7.1 954 458 X L H 3> S+ 0 0 35 -2,-0.3 4,-2.2 1,-0.2 3,-0.2 0.876 122.8 60.9 -53.9 -42.1 75.5 61.9 -7.3 955 459 X D H 3> S+ 0 0 107 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.883 102.3 51.0 -55.2 -40.8 74.7 62.0 -11.0 956 460 X E H <> S+ 0 0 54 -3,-0.7 4,-0.9 1,-0.2 -1,-0.3 0.882 108.0 53.3 -65.3 -35.5 71.2 60.7 -10.2 957 461 X L H >< S+ 0 0 0 -4,-1.4 3,-0.7 1,-0.2 4,-0.5 0.898 106.5 53.0 -65.0 -39.1 70.8 63.5 -7.6 958 462 X K H >< S+ 0 0 84 -4,-2.2 3,-2.0 1,-0.2 -1,-0.2 0.914 101.8 58.2 -61.8 -43.2 71.8 66.1 -10.2 959 463 X S H 3< S+ 0 0 97 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.759 104.5 53.0 -59.1 -24.1 69.1 64.8 -12.6 960 464 X M T << S+ 0 0 34 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.580 80.6 131.6 -86.1 -11.0 66.6 65.6 -9.8 961 465 X A < - 0 0 56 -3,-2.0 2,-0.5 -4,-0.5 -3,-0.1 -0.154 34.3-175.3 -47.1 125.6 67.9 69.1 -9.5 962 466 X E - 0 0 110 -30,-0.1 -31,-1.7 0, 0.0 -30,-0.4 -0.935 8.9-156.6-130.5 106.4 65.1 71.6 -9.6 963 467 X E E -L 930 0L 80 -2,-0.5 -33,-0.2 -33,-0.2 3,-0.1 -0.552 3.0-156.4 -86.6 147.6 66.0 75.3 -9.5 964 468 X G E - 0 0 26 -35,-2.6 -33,-0.2 1,-0.2 -34,-0.1 -0.045 52.7 -23.5 -99.0-154.1 63.9 78.1 -8.3 965 469 X Q E - 0 0 95 -35,-0.2 -36,-2.3 -37,-0.1 2,-0.5 -0.303 57.5-143.4 -62.4 133.0 64.0 81.8 -9.2 966 470 X M E -L 928 0L 71 -38,-0.2 2,-0.6 -3,-0.1 -38,-0.2 -0.844 10.0-153.6 -96.9 127.9 67.2 83.2 -10.5 967 471 X F E -L 927 0L 4 -40,-3.1 -40,-2.7 -2,-0.5 -42,-0.1 -0.921 12.1-166.9-107.0 118.2 68.0 86.7 -9.3 968 472 X T - 0 0 68 -2,-0.6 -42,-0.1 -42,-0.2 -47,-0.1 -0.794 34.0 -87.7-105.2 147.4 70.3 88.7 -11.7 969 473 X P + 0 0 40 0, 0.0 -48,-0.1 0, 0.0 -1,-0.1 -0.194 47.9 162.3 -51.7 136.0 72.1 92.0 -10.8 970 474 X E + 0 0 131 -53,-0.2 -49,-0.1 2,-0.1 -52,-0.1 0.417 44.4 96.4-132.2 -13.0 69.9 95.1 -11.6 971 475 X M S S- 0 0 22 1,-0.1 2,-0.0 -53,-0.1 0, 0.0 -0.668 73.8-116.9 -90.7 136.6 71.7 97.7 -9.6 972 476 X P > - 0 0 66 0, 0.0 4,-2.9 0, 0.0 5,-0.3 -0.309 24.3-115.4 -67.6 151.1 74.3 100.2 -11.1 973 477 X A H > S+ 0 0 27 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.910 115.3 53.4 -52.4 -49.2 77.9 100.1 -9.9 974 478 X E H > S+ 0 0 143 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.926 114.3 42.1 -53.3 -48.9 77.7 103.6 -8.5 975 479 X E H > S+ 0 0 103 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.956 117.1 43.8 -66.1 -53.9 74.6 102.7 -6.4 976 480 X R H X S+ 0 0 49 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.888 115.6 50.0 -61.8 -37.5 75.7 99.3 -5.2 977 481 X D H X S+ 0 0 89 -4,-3.1 4,-2.4 -5,-0.3 -1,-0.2 0.911 110.7 48.7 -67.1 -42.1 79.2 100.6 -4.4 978 482 X N H X S+ 0 0 114 -4,-2.1 4,-1.6 -5,-0.3 -2,-0.2 0.905 112.1 50.3 -63.7 -40.6 77.8 103.6 -2.4 979 483 X L H X S+ 0 0 12 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.940 112.5 45.3 -62.7 -47.1 75.5 101.2 -0.6 980 484 X Y H X S+ 0 0 32 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.864 107.4 59.1 -66.0 -35.1 78.3 98.8 0.4 981 485 X E H X S+ 0 0 81 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.882 105.0 50.0 -60.3 -39.1 80.5 101.8 1.4 982 486 X G H X S+ 0 0 12 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.893 109.2 51.8 -66.7 -39.4 78.0 102.8 3.9 983 487 X W H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 5,-0.2 0.939 108.5 50.1 -61.6 -48.1 77.9 99.2 5.2 984 488 X K H X S+ 0 0 95 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.898 111.2 49.8 -57.2 -40.8 81.7 99.2 5.6 985 489 X Q H X S+ 0 0 132 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.908 110.7 49.9 -64.1 -41.9 81.4 102.5 7.5 986 490 X A H X S+ 0 0 3 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.913 112.8 45.5 -63.8 -44.4 78.7 101.1 9.8 987 491 X V H X S+ 0 0 2 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.927 112.3 51.0 -66.0 -44.1 80.7 97.9 10.6 988 492 X A H X S+ 0 0 53 -4,-2.6 4,-1.1 -5,-0.2 -2,-0.2 0.908 112.5 47.0 -59.1 -41.7 83.9 99.9 11.2 989 493 X A H X S+ 0 0 38 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.876 109.2 54.6 -67.5 -37.5 82.0 102.2 13.5 990 494 X T H < S+ 0 0 3 -4,-2.2 3,-0.4 1,-0.2 -132,-0.3 0.931 108.8 47.5 -61.2 -45.6 80.4 99.2 15.3 991 495 X Q H < S+ 0 0 58 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.747 104.6 63.2 -68.2 -21.4 83.9 97.8 15.9 992 496 X T H < S+ 0 0 115 -4,-1.1 2,-0.9 -5,-0.2 -1,-0.2 0.874 86.2 79.3 -69.7 -38.1 85.0 101.2 17.2 993 497 X F < + 0 0 137 -4,-1.4 -135,-0.3 -3,-0.4 -1,-0.1 -0.618 49.7 150.4 -75.6 107.3 82.5 101.1 20.1 994 498 X K 0 0 93 -2,-0.9 -1,-0.1 -137,-0.1 -137,-0.1 -0.115 360.0 360.0-131.7 37.3 84.1 98.8 22.7 995 499 X F 0 0 229 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.283 360.0 360.0 -70.1 360.0 82.7 100.2 25.9