==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 01-JUL-12 4FWQ . COMPND 2 MOLECULE: PROPIONATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR S.CHITTORI,H.S.SAVITHRI,M.R.N.MURTHY . 394 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17937.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 294 74.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 49 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 25 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 128 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.8 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 1 2 2 0 0 2 2 1 1 0 2 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 2 0 3 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 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 4 A F 0 0 110 0, 0.0 75,-0.0 0, 0.0 20,-0.0 0.000 360.0 360.0 360.0 79.5 -56.5 26.6 9.5 2 5 A P - 0 0 58 0, 0.0 19,-2.3 0, 0.0 20,-0.4 -0.155 360.0-155.9 -64.5 156.9 -54.7 24.7 6.6 3 6 A V E -Ab 20 77A 2 73,-2.7 75,-2.1 17,-0.2 76,-1.3 -0.898 10.6-132.5-131.5 161.4 -50.9 25.1 5.9 4 7 A V E -Ab 19 79A 0 15,-3.2 15,-2.5 -2,-0.3 2,-0.7 -0.957 12.2-148.4-114.7 132.1 -48.5 24.7 3.0 5 8 A L E -Ab 18 80A 6 74,-2.6 76,-2.8 -2,-0.4 2,-0.4 -0.899 14.9-163.3-100.1 112.5 -45.2 22.9 3.3 6 9 A V E -Ab 17 81A 6 11,-3.0 11,-2.1 -2,-0.7 2,-0.4 -0.824 6.2-168.3 -98.1 133.6 -42.6 24.4 0.9 7 10 A I E -Ab 16 82A 17 74,-3.0 76,-2.5 -2,-0.4 2,-0.6 -0.985 18.6-175.6-128.7 124.3 -39.5 22.3 0.2 8 11 A N E -A 15 0A 44 7,-3.7 7,-2.8 -2,-0.4 2,-1.2 -0.901 15.5-168.5-114.0 98.4 -36.3 23.3 -1.5 9 12 A C E -A 14 0A 2 -2,-0.6 5,-0.2 74,-0.5 113,-0.2 -0.691 13.5-179.2 -95.5 87.4 -34.3 20.0 -1.7 10 13 A G - 0 0 20 -2,-1.2 105,-0.0 3,-1.0 -2,-0.0 -0.110 42.3 -96.6 -79.5 179.3 -30.8 21.0 -2.8 11 14 A S S S+ 0 0 72 1,-0.2 -1,-0.1 3,-0.0 3,-0.1 0.773 121.7 18.5 -70.0 -29.2 -27.7 18.8 -3.4 12 15 A S S S+ 0 0 65 1,-0.1 23,-2.4 22,-0.1 22,-0.6 0.457 130.2 25.1-119.1 -8.1 -26.3 19.3 0.1 13 16 A S E - C 0 33A 17 20,-0.2 -3,-1.0 21,-0.2 2,-0.4 -0.912 59.8-131.0-149.0 171.0 -29.3 20.5 2.1 14 17 A I E -AC 9 32A 4 18,-0.5 18,-1.2 -2,-0.3 2,-0.5 -0.886 21.7-163.8-131.8 102.0 -33.1 20.6 2.4 15 18 A K E +AC 8 31A 116 -7,-2.8 -7,-3.7 -2,-0.4 2,-0.3 -0.740 17.2 178.5 -84.1 127.2 -34.6 24.1 3.0 16 19 A F E -AC 7 30A 6 14,-2.0 14,-1.9 -2,-0.5 2,-0.3 -0.933 13.9-178.4-130.6 156.1 -38.2 23.9 4.3 17 20 A S E -AC 6 29A 14 -11,-2.1 -11,-3.0 -2,-0.3 2,-0.5 -0.990 17.6-146.0-148.1 147.1 -40.9 26.4 5.3 18 21 A V E -AC 5 28A 1 10,-3.5 9,-3.4 -2,-0.3 10,-1.3 -0.968 22.6-174.0-116.7 116.4 -44.5 26.1 6.6 19 22 A L E -AC 4 26A 0 -15,-2.5 -15,-3.2 -2,-0.5 2,-0.2 -0.893 27.1-116.5-113.4 139.0 -46.8 28.9 5.5 20 23 A D E > -A 3 0A 22 5,-2.4 4,-2.2 -2,-0.4 -17,-0.2 -0.541 19.1-140.4 -70.9 133.4 -50.4 29.5 6.6 21 24 A V T 4 S+ 0 0 34 -19,-2.3 -1,-0.1 -2,-0.2 -18,-0.1 0.882 97.0 48.5 -62.4 -40.4 -52.8 29.2 3.7 22 25 A A T 4 S+ 0 0 88 -20,-0.4 -1,-0.2 1,-0.2 -19,-0.1 0.886 130.9 13.3 -70.8 -42.7 -55.0 32.2 4.8 23 26 A T T 4 S- 0 0 76 2,-0.1 -2,-0.2 0, 0.0 -1,-0.2 0.564 88.5-130.7-113.3 -15.1 -52.3 34.8 5.4 24 27 A C < + 0 0 11 -4,-2.2 2,-0.2 1,-0.2 -3,-0.1 0.653 54.6 151.0 64.9 19.7 -49.2 33.2 3.8 25 28 A D - 0 0 96 -5,-0.1 -5,-2.4 1,-0.1 2,-0.5 -0.514 53.1-109.3 -76.4 146.7 -47.2 34.0 6.9 26 29 A V E +C 19 0A 80 -7,-0.2 -7,-0.2 -2,-0.2 3,-0.1 -0.682 38.2 171.4 -78.1 124.8 -44.3 31.8 7.9 27 30 A L E + 0 0 96 -9,-3.4 2,-0.3 -2,-0.5 -8,-0.2 0.707 69.5 7.9-101.7 -31.8 -45.1 29.6 10.9 28 31 A M E +C 18 0A 3 -10,-1.3 -10,-3.5 2,-0.0 -1,-0.4 -0.990 63.6 172.5-150.8 145.6 -42.0 27.4 10.8 29 32 A A E +C 17 0A 28 -2,-0.3 16,-1.1 -12,-0.3 2,-0.3 -0.951 11.7 138.0-146.3 165.4 -38.8 27.2 8.8 30 33 A G E -CD 16 44A 14 -14,-1.9 -14,-2.0 14,-0.3 2,-0.3 -0.991 32.1-118.2 176.1-172.8 -35.6 25.2 8.9 31 34 A I E -CD 15 43A 45 12,-3.0 12,-3.1 -2,-0.3 2,-0.6 -0.989 4.6-151.9-155.4 138.5 -32.7 23.3 7.1 32 35 A A E -CD 14 42A 4 -18,-1.2 -18,-0.5 -2,-0.3 10,-0.2 -0.878 35.1-173.3-114.2 96.7 -31.3 19.8 7.1 33 36 A D E +CD 13 41A 58 8,-1.9 8,-1.6 -2,-0.6 -20,-0.2 -0.353 51.2 39.3 -96.0 166.3 -27.6 20.3 6.2 34 37 A G S > S- 0 0 16 -22,-0.6 3,-1.2 6,-0.2 21,-0.2 0.885 77.4-162.9 66.5 43.7 -24.7 18.0 5.3 35 38 A M T 3 + 0 0 17 -23,-2.4 -1,-0.2 1,-0.2 21,-0.1 -0.350 63.5 3.3 -69.6 130.7 -26.8 15.6 3.3 36 39 A N T 3 S+ 0 0 62 19,-1.7 -1,-0.2 1,-0.3 2,-0.2 0.296 105.7 106.7 82.0 -8.2 -25.5 12.1 2.5 37 40 A T S < S- 0 0 78 -3,-1.2 18,-0.4 2,-0.2 17,-0.4 -0.465 89.6 -99.6 -95.8 168.7 -22.3 12.6 4.5 38 41 A E S S+ 0 0 82 1,-0.2 16,-1.7 16,-0.2 2,-0.8 0.851 115.3 57.6 -56.7 -37.9 -21.6 11.0 7.9 39 42 A N E + E 0 53A 98 14,-0.2 2,-0.4 15,-0.1 -2,-0.2 -0.848 65.6 159.2-102.1 101.1 -22.6 14.2 9.6 40 43 A A E - E 0 52A 10 12,-1.3 12,-2.5 -2,-0.8 2,-0.4 -0.990 15.5-173.6-121.1 125.2 -26.2 15.3 8.7 41 44 A F E -DE 33 51A 89 -8,-1.6 -8,-1.9 -2,-0.4 2,-0.5 -0.955 18.8-143.2-127.9 138.2 -28.0 17.7 11.0 42 45 A L E -DE 32 50A 17 8,-0.6 8,-1.6 -2,-0.4 2,-0.4 -0.840 19.9-176.4 -96.1 128.8 -31.5 19.2 11.3 43 46 A S E -D 31 0A 23 -12,-3.1 -12,-3.0 -2,-0.5 2,-0.6 -0.994 11.0-154.6-126.7 132.8 -31.9 22.8 12.3 44 47 A I E > -D 30 0A 7 4,-0.4 3,-3.3 -2,-0.4 -14,-0.3 -0.933 63.8 -48.3-114.3 116.3 -35.2 24.5 12.9 45 48 A N T 3 S- 0 0 73 -16,-1.1 -15,-0.1 -2,-0.6 -1,-0.1 0.685 115.3 -46.9 30.4 43.8 -35.5 28.4 12.5 46 49 A G T 3 S+ 0 0 71 1,-0.2 -1,-0.3 2,-0.0 -16,-0.1 0.229 113.7 116.2 92.7 -13.4 -32.4 29.0 14.8 47 50 A D S < S- 0 0 94 -3,-3.3 -1,-0.2 1,-0.2 -2,-0.0 0.227 77.0 -28.4 -72.2-162.4 -33.4 26.6 17.5 48 51 A K - 0 0 84 1,-0.1 2,-1.0 -5,-0.1 -4,-0.4 -0.306 60.7-135.8 -59.0 122.0 -31.7 23.4 18.7 49 52 A P - 0 0 92 0, 0.0 -6,-0.2 0, 0.0 -1,-0.1 -0.716 24.5-164.4 -84.7 101.5 -29.7 21.7 15.9 50 53 A I E -E 42 0A 56 -8,-1.6 -8,-0.6 -2,-1.0 2,-0.3 -0.163 8.5-132.8 -74.2 173.7 -30.4 18.0 16.1 51 54 A N E -E 41 0A 94 -10,-0.3 2,-0.3 2,-0.0 -10,-0.2 -0.893 18.4-172.2-133.3 160.8 -28.3 15.3 14.4 52 55 A L E > -E 40 0A 29 -12,-2.5 -12,-1.3 -2,-0.3 3,-0.7 -0.891 27.8-125.1-154.9 120.8 -28.6 12.2 12.2 53 56 A A E 3 S-E 39 0A 76 -2,-0.3 -14,-0.2 1,-0.2 -15,-0.2 -0.555 83.1 -24.6 -76.2 115.8 -25.7 9.8 11.2 54 57 A H T 3 S+ 0 0 48 -16,-1.7 2,-0.4 -2,-0.5 -1,-0.2 0.923 88.3 178.7 51.7 58.7 -25.3 9.3 7.4 55 58 A S < - 0 0 25 -3,-0.7 -19,-1.7 -18,-0.4 -1,-0.2 -0.750 18.7-144.1-101.1 137.3 -28.9 10.2 6.6 56 59 A N > - 0 0 99 -2,-0.4 4,-2.0 -21,-0.1 3,-0.3 -0.318 37.3 -90.6 -87.5 175.4 -30.5 10.3 3.1 57 60 A Y H > S+ 0 0 49 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.785 122.2 55.2 -57.5 -33.5 -33.1 12.6 1.7 58 61 A E H > S+ 0 0 52 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.911 112.3 39.6 -69.0 -45.4 -36.0 10.3 2.7 59 62 A D H > S+ 0 0 45 -3,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.784 113.3 55.8 -76.8 -29.5 -35.1 10.1 6.4 60 63 A A H X S+ 0 0 7 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.875 108.9 46.5 -68.8 -40.2 -34.1 13.7 6.6 61 64 A L H X S+ 0 0 20 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.756 110.5 55.1 -70.5 -26.6 -37.6 14.8 5.4 62 65 A K H X S+ 0 0 22 -4,-0.9 4,-1.8 2,-0.2 -2,-0.2 0.829 104.2 53.3 -72.7 -35.4 -39.0 12.3 7.9 63 66 A A H X S+ 0 0 33 -4,-1.7 4,-1.2 2,-0.2 -2,-0.2 0.905 110.5 46.7 -63.2 -43.9 -37.1 14.0 10.7 64 67 A I H X S+ 0 0 7 -4,-1.7 4,-1.0 1,-0.2 -2,-0.2 0.882 110.8 53.4 -62.0 -40.7 -38.7 17.3 9.6 65 68 A A H X S+ 0 0 14 -4,-1.7 4,-1.3 1,-0.2 -2,-0.2 0.808 102.6 57.4 -65.8 -33.2 -42.0 15.5 9.4 66 69 A F H X S+ 0 0 146 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.853 104.9 51.8 -63.1 -37.0 -41.6 14.3 13.0 67 70 A E H X S+ 0 0 66 -4,-1.2 4,-1.1 2,-0.2 -1,-0.2 0.749 105.1 55.1 -73.1 -25.9 -41.2 17.9 14.1 68 71 A L H <>S+ 0 0 1 -4,-1.0 5,-3.4 2,-0.2 6,-1.3 0.806 107.9 50.3 -73.0 -32.0 -44.5 18.8 12.3 69 72 A E H ><5S+ 0 0 104 -4,-1.3 3,-1.5 3,-0.2 -2,-0.2 0.898 106.7 55.2 -66.5 -43.8 -46.1 16.0 14.4 70 73 A K H 3<5S+ 0 0 73 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.814 112.6 40.8 -61.2 -35.1 -44.7 17.5 17.6 71 74 A R T 3<5S- 0 0 120 -4,-1.1 -1,-0.3 -5,-0.1 -2,-0.2 0.160 114.7-114.8-102.1 16.7 -46.2 20.9 17.0 72 75 A D T < 5S+ 0 0 129 -3,-1.5 -3,-0.2 1,-0.1 -2,-0.1 0.832 82.6 120.2 53.1 41.8 -49.5 19.4 15.7 73 76 A L >>< + 0 0 33 -5,-3.4 3,-0.9 -6,-0.1 4,-0.7 0.581 47.7 81.7-106.7 -15.5 -49.0 20.7 12.2 74 77 A T G >4 S+ 0 0 31 -6,-1.3 3,-1.0 1,-0.3 -5,-0.1 0.904 91.8 50.4 -56.8 -46.7 -49.0 17.4 10.3 75 78 A D G 34 S+ 0 0 144 1,-0.2 -1,-0.3 -7,-0.2 -2,-0.1 0.654 109.5 53.8 -67.7 -16.2 -52.8 17.2 10.2 76 79 A S G <4 S+ 0 0 34 -3,-0.9 -73,-2.7 -74,-0.1 2,-1.0 0.543 74.3 112.7 -98.4 -10.4 -53.0 20.7 8.9 77 80 A V E << +b 3 0A 11 -3,-1.0 -73,-0.2 -4,-0.7 3,-0.1 -0.526 31.7 162.4 -66.8 99.5 -50.7 20.3 5.9 78 81 A A E + 0 0 48 -75,-2.1 56,-0.7 -2,-1.0 2,-0.3 0.721 62.4 22.3 -90.8 -26.5 -53.1 20.7 3.0 79 82 A L E -bf 4 134A 14 -76,-1.3 -74,-2.6 54,-0.1 2,-0.4 -0.991 60.2-152.9-144.6 146.4 -50.6 21.3 0.2 80 83 A I E -bf 5 135A 0 54,-2.0 56,-3.1 -2,-0.3 2,-0.5 -0.991 11.3-158.3-123.6 128.9 -46.9 20.7 -0.5 81 84 A G E -bf 6 136A 0 -76,-2.8 -74,-3.0 -2,-0.4 2,-0.5 -0.904 4.4-162.1-107.7 130.2 -44.7 22.9 -2.8 82 85 A H E -bf 7 137A 2 54,-2.8 56,-3.3 -2,-0.5 2,-0.6 -0.939 12.2-142.6-112.2 128.4 -41.5 21.7 -4.4 83 86 A R E - f 0 138A 41 -76,-2.5 -74,-0.5 -2,-0.5 2,-0.4 -0.801 20.3-167.8 -83.8 121.9 -38.9 23.9 -5.8 84 87 A I E - f 0 139A 0 54,-3.3 56,-2.4 -2,-0.6 57,-0.3 -0.950 14.0-152.8-112.3 133.0 -37.5 22.4 -9.0 85 88 A A S S+ 0 0 12 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.914 78.2 27.7 -71.1 -45.5 -34.3 23.8 -10.5 86 89 A H + 0 0 0 26,-0.1 -1,-0.2 54,-0.1 22,-0.1 -0.974 46.8 167.7-130.0 125.2 -34.8 22.9 -14.2 87 90 A G >> - 0 0 0 -2,-0.4 4,-1.7 1,-0.3 3,-0.7 0.226 32.8-154.0-114.9 11.8 -38.0 22.4 -16.1 88 91 A G T 34 - 0 0 0 1,-0.2 -1,-0.3 20,-0.2 17,-0.0 -0.158 56.6 -46.2 51.4-139.5 -36.6 22.3 -19.6 89 92 A E T 34 S+ 0 0 83 1,-0.1 -1,-0.2 3,-0.0 76,-0.0 0.468 129.0 76.5 -98.3 -7.4 -39.0 23.4 -22.4 90 93 A L T <4 S+ 0 0 73 -3,-0.7 2,-0.6 14,-0.1 -2,-0.2 0.800 85.4 62.9 -76.2 -31.6 -41.8 21.2 -21.0 91 94 A F < + 0 0 8 -4,-1.7 -4,-0.1 1,-0.1 -1,-0.1 -0.869 41.3 156.1-109.9 117.3 -42.8 23.4 -18.1 92 95 A T S S+ 0 0 89 -2,-0.6 2,-0.3 1,-0.1 -1,-0.1 0.459 74.0 12.4-110.3 -9.2 -44.2 26.8 -18.6 93 96 A Q S S- 0 0 133 44,-0.0 2,-0.2 52,-0.0 -1,-0.1 -0.922 94.9 -67.9-155.4 175.4 -46.1 27.1 -15.3 94 97 A S - 0 0 13 -2,-0.3 2,-0.3 44,-0.1 44,-0.2 -0.535 53.1-162.9 -76.2 141.3 -46.5 25.4 -11.9 95 98 A V E -G 137 0A 29 42,-1.8 42,-2.9 -2,-0.2 2,-0.4 -0.873 26.4-109.3-127.9 154.4 -48.1 21.9 -12.0 96 99 A I E -G 136 0A 33 -2,-0.3 2,-0.4 40,-0.2 40,-0.3 -0.721 50.2-111.9 -76.6 127.8 -49.8 19.4 -9.7 97 100 A I + 0 0 7 38,-3.4 38,-0.3 -2,-0.4 2,-0.2 -0.506 53.3 150.3 -72.3 121.5 -47.4 16.5 -9.3 98 101 A T > - 0 0 55 -2,-0.4 4,-2.1 1,-0.0 5,-0.1 -0.728 64.2 -84.5-131.4-176.6 -48.5 13.3 -11.0 99 102 A D H > S+ 0 0 114 -2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.844 129.3 54.2 -60.4 -35.1 -46.7 10.3 -12.6 100 103 A E H > S+ 0 0 126 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.916 107.3 49.0 -63.4 -46.2 -46.5 12.3 -15.8 101 104 A I H > S+ 0 0 13 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.893 109.3 52.3 -63.4 -42.3 -44.8 15.2 -14.1 102 105 A I H X S+ 0 0 26 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.943 110.8 47.5 -58.6 -49.7 -42.2 13.0 -12.4 103 106 A D H X S+ 0 0 96 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.892 111.7 51.3 -56.1 -43.8 -41.3 11.4 -15.8 104 107 A N H X S+ 0 0 23 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.836 108.8 49.5 -67.3 -35.5 -41.1 14.8 -17.4 105 108 A I H X S+ 0 0 0 -4,-2.2 4,-0.9 2,-0.2 -1,-0.2 0.906 111.4 50.4 -67.0 -42.5 -38.7 16.1 -14.6 106 109 A R H < S+ 0 0 141 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.847 106.9 56.0 -60.7 -36.1 -36.6 13.0 -15.2 107 110 A R H < S+ 0 0 168 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.892 115.1 36.1 -63.0 -42.7 -36.6 13.7 -18.9 108 111 A V H >< S+ 0 0 13 -4,-1.5 3,-1.8 1,-0.2 4,-0.4 0.473 91.8 97.5 -90.7 -3.9 -35.2 17.2 -18.4 109 112 A S G >< + 0 0 0 -4,-0.9 3,-1.6 1,-0.3 7,-0.3 0.792 68.9 67.8 -58.2 -35.0 -32.9 16.2 -15.5 110 113 A P G 3 S+ 0 0 86 0, 0.0 -1,-0.3 0, 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119.4 -14.6 34.4 -23.0 239 242 A F H > S+ 0 0 165 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.818 97.4 60.7 -66.1 -32.1 -14.5 30.7 -24.1 240 243 A G H > S+ 0 0 44 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.865 106.4 46.8 -59.2 -38.4 -11.3 31.5 -26.1 241 244 A A H > S+ 0 0 37 -3,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.884 110.8 51.9 -68.1 -41.6 -9.8 32.5 -22.7 242 245 A M H X S+ 0 0 29 -4,-1.8 4,-1.3 1,-0.2 -2,-0.2 0.844 111.9 46.1 -64.3 -36.3 -11.1 29.3 -21.1 243 246 A A H X S+ 0 0 28 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.817 110.9 53.4 -73.5 -33.9 -9.5 27.2 -23.9 244 247 A W H X S+ 0 0 156 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.896 108.3 48.9 -67.4 -43.4 -6.3 29.2 -23.6 245 248 A I H X S+ 0 0 56 -4,-2.4 4,-2.7 1,-0.2 5,-0.5 0.866 106.0 59.4 -61.8 -38.8 -6.1 28.5 -19.8 246 249 A A H X>S+ 0 0 31 -4,-1.3 5,-0.9 1,-0.2 4,-0.7 0.873 112.1 37.7 -59.2 -42.0 -6.8 24.8 -20.6 247 250 A K H <5S+ 0 0 166 -4,-1.4 -1,-0.2 3,-0.2 -2,-0.2 0.870 119.4 47.4 -76.1 -39.9 -3.7 24.5 -22.8 248 251 A E H <5S+ 0 0 132 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.2 0.889 123.0 29.3 -75.1 -42.6 -1.4 26.7 -20.7 249 252 A T H <5S- 0 0 82 -4,-2.7 -1,-0.2 -5,-0.2 -3,-0.2 0.627 104.2-121.4 -92.1 -17.5 -2.1 25.3 -17.2 250 253 A G T <5 + 0 0 65 -4,-0.7 2,-0.3 -5,-0.5 -3,-0.2 0.920 58.4 151.1 73.5 47.1 -2.9 21.7 -18.3 251 254 A Q < - 0 0 57 -5,-0.9 -1,-0.2 -6,-0.4 -2,-0.1 -0.864 39.4-130.4-112.8 145.6 -6.4 21.6 -16.9 252 255 A T > - 0 0 79 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.335 30.9-104.0 -83.6 170.2 -9.4 19.7 -18.0 253 256 A L H > S+ 0 0 74 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.855 123.2 52.3 -61.7 -37.2 -12.9 21.0 -18.6 254 257 A S H > S+ 0 0 86 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.788 108.2 51.1 -71.6 -30.4 -14.1 19.5 -15.3 255 258 A D H > S+ 0 0 61 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.934 113.4 44.4 -66.0 -48.8 -11.2 21.1 -13.5 256 259 A L H X S+ 0 0 16 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.805 107.2 59.8 -67.3 -31.6 -12.2 24.5 -15.0 257 260 A E H X S+ 0 0 122 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.884 106.8 47.2 -62.2 -41.0 -15.9 23.8 -14.3 258 261 A R H X>S+ 0 0 109 -4,-1.3 4,-2.8 2,-0.2 5,-0.6 0.918 113.9 47.7 -62.5 -46.8 -15.0 23.6 -10.6 259 262 A V H X5S+ 0 0 35 -4,-1.9 4,-1.4 1,-0.2 5,-0.5 0.916 113.9 46.1 -61.6 -46.8 -12.9 26.8 -10.8 260 263 A V H <5S+ 0 0 20 -4,-3.0 -26,-1.9 1,-0.2 -25,-0.3 0.736 121.5 38.1 -70.1 -25.1 -15.6 28.7 -12.6 261 264 A N H <5S+ 0 0 55 -4,-1.3 -2,-0.2 -28,-0.2 -29,-0.2 0.801 133.5 12.9 -96.4 -33.8 -18.4 27.5 -10.2 262 265 A K H <5S+ 0 0 122 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.1 0.561 128.0 40.6-127.1 -13.7 -16.7 27.5 -6.8 263 266 A E S <> + 0 0 20 -32,-1.9 4,-1.6 -5,-0.5 3,-0.8 0.007 67.9 51.2-105.3-154.9 -14.2 32.4 -9.0 265 268 A G H 3> S- 0 0 5 2,-0.2 4,-2.2 1,-0.2 5,-0.2 -0.265 119.5 -11.7 66.4-141.0 -16.4 35.5 -8.8 266 269 A L H 3> S+ 0 0 0 -36,-2.3 4,-1.7 -35,-0.3 7,-0.3 0.848 143.3 50.3 -61.5 -37.1 -16.1 37.8 -5.8 267 270 A L H <> S+ 0 0 54 -36,-2.1 4,-2.5 -3,-0.8 5,-0.3 0.926 109.4 51.9 -64.1 -47.6 -14.1 35.1 -4.1 268 271 A G H < S+ 0 0 36 -4,-1.6 -2,-0.2 -37,-0.3 -1,-0.2 0.900 115.4 37.1 -58.2 -50.1 -11.8 34.8 -7.1 269 272 A I H < S+ 0 0 56 -4,-2.2 -1,-0.2 1,-0.1 -2,-0.2 0.960 123.8 39.2 -71.0 -52.6 -10.9 38.4 -7.6 270 273 A S H < S- 0 0 3 -4,-1.7 -2,-0.2 -5,-0.2 -3,-0.2 0.867 86.8-149.1 -66.1 -38.8 -10.7 39.5 -3.9 271 274 A G S < S+ 0 0 51 -4,-2.5 -3,-0.1 -5,-0.3 -4,-0.1 0.746 80.8 74.9 70.6 27.3 -9.0 36.3 -2.7 272 275 A L S S- 0 0 90 -5,-0.3 2,-0.3 -6,-0.3 -5,-0.1 0.639 97.3 -16.3-133.9 -59.5 -10.8 36.8 0.6 273 276 A S - 0 0 23 -7,-0.3 -1,-0.3 -6,-0.1 -3,-0.2 -0.995 28.2-143.9-157.7 155.6 -14.6 36.1 0.6 274 277 A S S S+ 0 0 39 -2,-0.3 2,-0.4 -8,-0.1 -8,-0.1 0.497 82.2 97.1 -92.0 -11.4 -17.7 35.5 -1.5 275 278 A D > - 0 0 39 1,-0.1 4,-1.6 -9,-0.1 3,-0.1 -0.685 66.5-151.9 -83.7 127.5 -19.7 37.4 1.1 276 279 A L H > S+ 0 0 12 -2,-0.4 4,-3.5 2,-0.2 5,-0.3 0.853 92.7 61.6 -65.7 -38.9 -20.3 41.1 0.4 277 280 A R H > S+ 0 0 180 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.893 108.3 44.2 -55.7 -43.1 -20.5 42.1 4.1 278 281 A V H > S+ 0 0 67 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.908 116.8 46.7 -65.4 -43.7 -16.8 41.0 4.5 279 282 A L H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.830 108.5 54.2 -70.9 -36.0 -15.8 42.6 1.2 280 283 A E H X S+ 0 0 59 -4,-3.5 4,-1.8 2,-0.2 -1,-0.2 0.885 112.4 44.4 -64.2 -41.4 -17.6 45.9 2.0 281 284 A K H X S+ 0 0 69 -4,-1.5 4,-1.6 -5,-0.3 -2,-0.2 0.870 110.6 56.0 -68.4 -38.5 -15.7 46.2 5.3 282 285 A A H <>S+ 0 0 5 -4,-2.0 5,-2.9 2,-0.2 -2,-0.2 0.898 108.2 46.4 -60.6 -43.9 -12.5 45.2 3.5 283 286 A W H ><5S+ 0 0 69 -4,-2.2 3,-2.0 3,-0.2 -1,-0.2 0.914 110.3 52.9 -65.1 -44.0 -12.8 48.0 1.0 284 287 A H H 3<5S+ 0 0 170 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.806 107.8 53.5 -57.5 -32.3 -13.6 50.5 3.9 285 288 A E T 3<5S- 0 0 156 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.215 128.8-100.2 -89.6 11.9 -10.4 49.1 5.5 286 289 A G T < 5 + 0 0 64 -3,-2.0 2,-0.4 1,-0.3 -3,-0.2 0.599 64.9 158.7 83.6 13.8 -8.4 49.9 2.3 287 290 A H >< - 0 0 68 -5,-2.9 4,-1.1 1,-0.2 -1,-0.3 -0.594 25.1-161.9 -71.1 121.4 -8.3 46.5 0.7 288 291 A E H > S+ 0 0 58 -2,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.915 84.4 49.9 -75.0 -46.1 -7.6 47.0 -3.0 289 292 A R H > S+ 0 0 130 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.719 109.2 53.7 -68.7 -23.4 -8.7 43.6 -4.4 290 293 A A H > S+ 0 0 0 2,-0.2 4,-1.8 -20,-0.2 -1,-0.2 0.832 107.8 50.6 -76.0 -36.1 -12.0 43.8 -2.5 291 294 A R H X S+ 0 0 92 -4,-1.1 4,-2.3 2,-0.2 -2,-0.2 0.900 112.2 47.6 -63.4 -43.1 -12.6 47.2 -4.1 292 295 A L H X S+ 0 0 76 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.892 109.3 52.4 -66.5 -42.9 -11.9 45.7 -7.5 293 296 A A H X S+ 0 0 0 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.898 114.3 42.9 -59.2 -43.6 -14.1 42.7 -6.9 294 297 A I H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.864 114.1 50.6 -72.0 -38.8 -17.1 44.9 -5.9 295 298 A K H X S+ 0 0 96 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.875 112.8 45.9 -66.6 -40.1 -16.4 47.4 -8.8 296 299 A T H X S+ 0 0 46 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.882 112.7 51.9 -67.5 -41.4 -16.3 44.6 -11.3 297 300 A F H X S+ 0 0 1 -4,-1.9 4,-1.5 -5,-0.2 -2,-0.2 0.945 113.3 44.1 -56.3 -52.1 -19.4 43.1 -9.7 298 301 A V H X S+ 0 0 3 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.883 112.3 52.4 -61.6 -43.6 -21.2 46.5 -10.0 299 302 A H H X S+ 0 0 82 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.870 109.5 48.1 -63.6 -40.1 -19.9 47.1 -13.6 300 303 A R H X S+ 0 0 77 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.790 111.5 50.6 -74.4 -28.6 -21.2 43.7 -14.9 301 304 A I H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.920 111.1 47.9 -70.4 -47.2 -24.6 44.3 -13.2 302 305 A A H X S+ 0 0 1 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.887 111.4 52.1 -59.4 -40.3 -25.0 47.8 -14.8 303 306 A R H X S+ 0 0 175 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.904 113.5 42.3 -64.6 -44.6 -24.0 46.3 -18.2 304 307 A H H X S+ 0 0 35 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.843 112.6 53.0 -74.0 -35.2 -26.6 43.5 -18.0 305 308 A I H X S+ 0 0 0 -4,-2.7 4,-1.3 2,-0.2 -2,-0.2 0.984 114.5 41.9 -59.1 -56.9 -29.4 45.8 -16.7 306 309 A A H X S+ 0 0 39 -4,-2.4 4,-0.5 1,-0.2 -2,-0.2 0.827 115.3 52.2 -59.1 -35.7 -28.8 48.3 -19.5 307 310 A G H >< S+ 0 0 39 -4,-1.7 3,-1.0 -5,-0.2 4,-0.3 0.907 108.2 48.6 -67.2 -44.7 -28.5 45.4 -22.0 308 311 A H H >< S+ 0 0 6 -4,-2.6 3,-0.8 1,-0.2 -1,-0.2 0.685 97.8 71.5 -69.8 -20.1 -31.8 43.7 -20.9 309 312 A A H >< S+ 0 0 16 -4,-1.3 3,-2.0 1,-0.2 -1,-0.2 0.806 84.6 69.2 -63.6 -30.3 -33.5 47.1 -21.3 310 313 A A T << S+ 0 0 88 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.2 0.815 90.6 60.5 -57.1 -33.8 -33.1 46.7 -25.0 311 314 A S T < S+ 0 0 35 -3,-0.8 2,-0.3 -4,-0.3 -1,-0.3 0.461 95.9 80.8 -75.1 -2.1 -35.7 43.9 -24.9 312 315 A L < - 0 0 17 -3,-2.0 3,-0.2 1,-0.1 -117,-0.1 -0.792 69.8-148.2-103.6 150.6 -38.2 46.4 -23.5 313 316 A H S S+ 0 0 98 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.751 91.4 7.5 -80.8 -28.8 -40.2 48.9 -25.5 314 317 A R S S- 0 0 92 -120,-0.1 2,-0.8 -3,-0.0 -1,-0.3 -0.958 72.3-132.7-156.3 134.1 -40.2 51.4 -22.6 315 318 A L + 0 0 33 -2,-0.3 -119,-0.2 1,-0.2 3,-0.1 -0.807 35.0 157.1 -97.1 105.0 -38.3 51.2 -19.3 316 319 A D + 0 0 29 -121,-2.3 54,-1.7 -2,-0.8 2,-0.3 0.817 61.8 15.0 -92.4 -38.2 -40.6 52.0 -16.3 317 320 A G E -ik 196 370B 0 -122,-1.7 -120,-1.9 52,-0.2 2,-0.4 -0.991 43.8-159.1-146.3 148.0 -38.8 50.4 -13.4 318 321 A I E -ik 197 371B 0 52,-2.3 54,-2.2 -2,-0.3 2,-0.5 -0.997 26.1-165.5-120.1 122.9 -35.6 48.9 -12.1 319 322 A I E -ik 198 372B 0 -122,-3.2 -120,-3.4 -2,-0.4 2,-0.4 -0.940 8.1-154.3-119.3 127.2 -36.1 46.6 -9.1 320 323 A F E +ik 199 373B 0 52,-2.9 54,-2.2 -2,-0.5 2,-0.3 -0.788 26.5 154.5 -98.4 140.0 -33.5 45.3 -6.7 321 324 A T E > +i 200 0B 0 -122,-2.0 -120,-3.4 -2,-0.4 4,-0.8 -0.952 22.5 61.6-157.0 170.6 -34.0 42.0 -4.8 322 325 A G H > S- 0 0 3 -2,-0.3 4,-2.6 52,-0.3 5,-0.4 -0.139 97.5 -54.4 90.0 168.4 -32.3 39.1 -3.1 323 326 A G H > S+ 0 0 46 1,-0.2 4,-0.9 2,-0.2 -121,-0.2 0.846 142.2 33.7 -46.6 -44.2 -29.9 39.1 -0.1 324 327 A I H > S+ 0 0 22 -123,-2.1 4,-2.2 -3,-0.2 -1,-0.2 0.911 117.6 52.2 -80.1 -46.8 -27.6 41.7 -1.8 325 328 A G H < S+ 0 0 0 -124,-1.7 -3,-0.2 -4,-0.8 -2,-0.2 0.736 116.0 41.9 -62.7 -24.9 -30.3 43.7 -3.7 326 329 A E H < S+ 0 0 23 -4,-2.6 -1,-0.2 -125,-0.3 -2,-0.2 0.773 125.8 29.4 -90.0 -30.2 -32.3 44.1 -0.5 327 330 A N H < S+ 0 0 101 -4,-0.9 2,-1.0 -5,-0.4 -2,-0.2 0.501 91.8 93.3-115.6 -8.5 -29.5 44.9 2.0 328 331 A S X + 0 0 5 -4,-2.2 4,-1.8 1,-0.2 5,-0.2 -0.757 36.3 173.6-100.7 95.8 -26.7 46.6 0.1 329 332 A V H > S+ 0 0 52 -2,-1.0 4,-1.9 2,-0.2 -1,-0.2 0.904 84.5 48.8 -57.6 -43.4 -26.9 50.4 0.3 330 333 A L H > S+ 0 0 54 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.948 109.4 47.5 -65.3 -55.2 -23.5 50.6 -1.4 331 334 A I H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.904 113.4 48.6 -57.4 -45.4 -24.1 48.2 -4.4 332 335 A R H X S+ 0 0 1 -4,-1.8 4,-2.5 -8,-0.2 5,-0.2 0.923 113.2 48.6 -59.8 -45.4 -27.4 49.7 -5.2 333 336 A Q H X S+ 0 0 35 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.940 113.6 45.9 -56.3 -51.4 -25.9 53.2 -5.1 334 337 A L H X S+ 0 0 28 -4,-3.0 4,-1.2 2,-0.2 -2,-0.2 0.834 114.2 48.0 -65.3 -36.0 -22.9 52.2 -7.3 335 338 A V H < S+ 0 0 0 -4,-2.5 4,-0.3 -5,-0.2 -1,-0.2 0.933 112.8 46.7 -70.3 -47.8 -25.1 50.4 -9.9 336 339 A I H >< S+ 0 0 3 -4,-2.5 3,-1.0 1,-0.2 -2,-0.2 0.866 112.4 50.5 -63.7 -38.0 -27.6 53.2 -10.2 337 340 A E H >< S+ 0 0 121 -4,-2.2 3,-1.0 1,-0.2 -1,-0.2 0.810 106.1 56.7 -67.7 -30.7 -24.8 55.8 -10.5 338 341 A H T 3< S+ 0 0 88 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.522 105.5 53.9 -74.7 -7.6 -23.3 53.5 -13.2 339 342 A L T X > + 0 0 4 -3,-1.0 3,-1.5 -4,-0.3 5,-0.9 -0.028 64.0 122.7-119.8 29.3 -26.6 53.8 -15.1 340 343 A G G X 5 + 0 0 44 -3,-1.0 3,-1.9 1,-0.3 -1,-0.1 0.757 64.3 73.5 -59.6 -26.7 -26.9 57.6 -15.3 341 344 A V G 3 5S+ 0 0 135 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.800 92.2 54.9 -57.0 -31.5 -27.1 57.3 -19.1 342 345 A L G < 5S- 0 0 55 -3,-1.5 -1,-0.3 2,-0.0 -2,-0.2 0.455 124.1-105.0 -83.3 -1.9 -30.7 56.0 -18.6 343 346 A G T < 5 + 0 0 26 -3,-1.9 25,-2.6 1,-0.2 26,-0.4 0.718 61.7 165.1 85.9 24.6 -31.6 59.1 -16.7 344 347 A L < - 0 0 16 -5,-0.9 2,-0.4 23,-0.2 -1,-0.2 -0.532 17.9-171.1 -77.3 136.8 -31.6 57.5 -13.2 345 348 A T - 0 0 60 24,-0.4 19,-2.0 -2,-0.2 2,-0.3 -0.992 12.0-148.6-127.4 123.4 -31.6 59.7 -10.1 346 349 A L B -M 363 0C 26 -2,-0.4 2,-0.7 17,-0.3 17,-0.3 -0.699 8.4-144.2 -94.0 139.9 -31.2 58.1 -6.7 347 350 A D > - 0 0 59 15,-2.9 4,-1.9 -2,-0.3 5,-0.1 -0.920 15.3-165.9 -98.1 110.5 -32.6 59.3 -3.4 348 351 A V H > S+ 0 0 70 -2,-0.7 4,-1.6 2,-0.2 -1,-0.1 0.826 84.2 54.2 -73.8 -34.6 -29.9 58.4 -0.9 349 352 A E H > S+ 0 0 136 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.893 114.0 43.8 -62.9 -39.4 -32.0 58.9 2.3 350 353 A M H 4 S+ 0 0 76 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.799 113.9 50.4 -73.1 -32.1 -34.5 56.4 0.8 351 354 A N H < S+ 0 0 0 -4,-1.9 -2,-0.2 11,-0.3 -1,-0.2 0.705 103.0 61.8 -76.8 -21.9 -31.6 54.1 -0.3 352 355 A K H < S+ 0 0 57 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.814 79.1 106.4 -71.0 -32.1 -30.1 54.3 3.2 353 356 A Q S < S- 0 0 54 -4,-0.8 7,-0.1 -3,-0.1 -3,-0.0 -0.223 72.6-123.4 -54.3 130.6 -33.2 52.7 4.8 354 357 A P > - 0 0 73 0, 0.0 3,-2.0 0, 0.0 -27,-0.1 -0.173 32.5 -91.8 -70.1 170.6 -32.6 49.0 5.8 355 358 A N G > S+ 0 0 37 1,-0.3 3,-2.7 2,-0.2 -28,-0.1 0.647 114.0 82.9 -62.7 -18.1 -34.7 46.1 4.6 356 359 A S G 3 S+ 0 0 107 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.706 81.8 66.5 -57.3 -16.5 -37.1 46.4 7.5 357 360 A H G < S- 0 0 103 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.436 90.9-169.0 -87.3 -1.4 -38.7 49.1 5.4 358 361 A G < + 0 0 21 -3,-2.7 2,-0.6 -4,-0.1 -1,-0.2 -0.117 55.4 24.4 56.1-136.1 -39.7 46.4 3.0 359 362 A E S S+ 0 0 61 15,-0.1 2,-0.3 -3,-0.1 15,-0.2 -0.510 84.8 159.7 -68.8 109.6 -41.1 47.3 -0.4 360 363 A R E -L 373 0B 12 13,-2.2 13,-3.2 -2,-0.6 2,-0.4 -0.990 43.0-129.2-141.5 140.0 -39.7 50.8 -1.0 361 364 A I E -L 372 0B 61 -2,-0.3 11,-0.3 11,-0.3 -42,-0.0 -0.759 20.9-177.9 -85.3 132.5 -39.0 53.2 -3.8 362 365 A I + 0 0 0 9,-2.4 -15,-2.9 -2,-0.4 -11,-0.3 0.374 49.3 95.1-114.3 1.7 -35.4 54.5 -3.7 363 366 A S B S-M 346 0C 17 8,-1.3 -17,-0.3 -17,-0.3 2,-0.1 -0.670 70.3-119.3 -97.9 151.2 -35.4 56.9 -6.7 364 367 A A > - 0 0 22 -19,-2.0 3,-1.0 -2,-0.3 -19,-0.2 -0.321 30.0-104.3 -80.1 167.0 -36.0 60.7 -6.6 365 368 A N T 3 S+ 0 0 168 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.0 0.878 115.0 56.4 -61.4 -44.7 -38.8 62.5 -8.5 366 369 A P T 3 S+ 0 0 110 0, 0.0 -1,-0.2 0, 0.0 2,-0.0 0.568 83.1 117.6 -68.8 -5.4 -36.8 64.0 -11.4 367 370 A S < - 0 0 19 -3,-1.0 -23,-0.2 -22,-0.2 3,-0.1 -0.330 62.9-145.0 -63.1 139.9 -35.6 60.4 -12.3 368 371 A Q S S+ 0 0 99 -25,-2.6 2,-0.4 1,-0.2 -24,-0.2 0.704 88.3 38.9 -77.0 -22.6 -36.6 59.1 -15.7 369 372 A V S S- 0 0 9 -26,-0.4 -24,-0.4 -24,-0.0 2,-0.3 -0.999 86.3-122.6-133.0 131.4 -37.0 55.6 -14.4 370 373 A I E -k 317 0B 60 -54,-1.7 -52,-2.3 -2,-0.4 2,-0.4 -0.564 25.0-158.9 -72.7 128.5 -38.4 54.5 -11.0 371 374 A C E +k 318 0B 0 -2,-0.3 -9,-2.4 -54,-0.2 -8,-1.3 -0.924 18.7 166.6-109.4 138.9 -35.9 52.5 -8.8 372 375 A A E -kL 319 361B 0 -54,-2.2 -52,-2.9 -2,-0.4 2,-0.5 -0.948 34.0-132.1-146.6 161.0 -37.2 50.3 -6.0 373 376 A V E -kL 320 360B 0 -13,-3.2 -13,-2.2 -2,-0.3 -52,-0.2 -0.988 23.4-178.1-116.6 121.5 -36.3 47.5 -3.6 374 377 A I - 0 0 0 -54,-2.2 -52,-0.3 -2,-0.5 2,-0.2 -0.968 26.2-131.1-120.9 111.7 -38.8 44.6 -3.4 375 378 A P - 0 0 29 0, 0.0 2,-0.2 0, 0.0 -54,-0.1 -0.453 28.8-128.7 -57.1 121.9 -38.0 41.9 -0.9 376 379 A T - 0 0 26 -2,-0.2 2,-0.3 1,-0.0 -201,-0.1 -0.528 21.7-169.3 -77.6 143.2 -38.3 38.6 -2.7 377 380 A N > + 0 0 46 -2,-0.2 4,-1.8 -202,-0.2 5,-0.1 -0.741 14.1 168.0-134.9 84.9 -40.5 35.8 -1.2 378 381 A E H > S+ 0 0 28 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.821 80.1 55.2 -67.8 -33.0 -40.0 32.6 -3.1 379 382 A E H > S+ 0 0 69 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.850 108.0 48.8 -67.1 -37.9 -41.8 30.6 -0.4 380 383 A K H > S+ 0 0 64 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.894 110.5 50.6 -68.3 -41.1 -44.9 32.8 -0.7 381 384 A M H X S+ 0 0 15 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.859 112.0 47.4 -65.6 -38.2 -44.9 32.5 -4.6 382 385 A I H X S+ 0 0 4 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.905 113.5 48.6 -66.7 -43.1 -44.7 28.7 -4.3 383 386 A A H X S+ 0 0 1 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.921 109.0 52.4 -62.4 -46.2 -47.5 28.7 -1.7 384 387 A L H X S+ 0 0 74 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.822 110.3 48.8 -60.5 -35.0 -49.7 31.0 -3.9 385 388 A D H X S+ 0 0 17 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.890 112.2 48.8 -69.1 -41.8 -49.3 28.6 -6.8 386 389 A A H X S+ 0 0 0 -4,-2.0 4,-0.7 2,-0.2 -2,-0.2 0.901 110.3 50.3 -63.9 -44.5 -50.1 25.6 -4.5 387 390 A I H >< S+ 0 0 41 -4,-2.9 3,-0.6 2,-0.2 4,-0.4 0.907 111.4 49.3 -60.9 -44.0 -53.2 27.3 -3.2 388 391 A H H >< S+ 0 0 128 -4,-1.7 3,-1.3 1,-0.2 -2,-0.2 0.916 111.9 47.5 -59.3 -46.8 -54.4 28.1 -6.7 389 392 A L H >< S+ 0 0 19 -4,-2.2 3,-0.8 1,-0.3 -1,-0.2 0.561 97.2 75.1 -74.4 -8.3 -53.8 24.5 -7.8 390 393 A G T << S+ 0 0 30 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.654 91.7 53.8 -75.1 -18.7 -55.7 23.4 -4.6 391 394 A N T < S+ 0 0 124 -3,-1.3 2,-0.4 -4,-0.4 -1,-0.2 0.390 87.5 109.5 -91.9 0.5 -59.0 24.4 -6.3 392 395 A V < - 0 0 51 -3,-0.8 2,-0.7 -4,-0.1 -3,-0.0 -0.655 64.1-140.7 -87.6 127.4 -58.3 22.2 -9.3 393 396 A K 0 0 184 -2,-0.4 -2,-0.1 1,-0.2 -3,-0.0 -0.787 360.0 360.0 -87.0 112.9 -60.3 19.1 -9.9 394 397 A A 0 0 124 -2,-0.7 -1,-0.2 0, 0.0 -2,-0.0 0.558 360.0 360.0 -96.0 360.0 -57.9 16.4 -11.2