==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-NOV-06 2E1Y . COMPND 2 MOLECULE: PROPIONATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR D.K.SIMANSHU,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) . 17967.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 296 75.1 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 . 43 10.9 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 . 28 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 10.2 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 0 1 1 1 0 1 0 0 0 1 0 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 . 2 2 0 2 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 0 118 0, 0.0 75,-0.0 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 76.2 -4.9 62.8 65.0 2 5 A P - 0 0 59 0, 0.0 19,-2.5 0, 0.0 20,-0.5 -0.205 360.0-154.8 -78.7 160.9 -5.6 60.1 62.3 3 6 A V E -Ab 20 77A 4 73,-2.8 75,-1.7 17,-0.2 76,-1.1 -0.913 12.1-134.3-133.1 154.7 -3.5 57.1 61.3 4 7 A V E -Ab 19 79A 0 15,-2.5 15,-2.4 -2,-0.3 2,-0.7 -0.909 16.4-146.0-105.6 137.0 -2.9 54.8 58.3 5 8 A L E -Ab 18 80A 5 74,-2.6 76,-1.7 -2,-0.4 2,-0.3 -0.921 15.9-160.8-104.7 111.3 -2.8 51.0 58.8 6 9 A V E -Ab 17 81A 4 11,-2.5 11,-2.2 -2,-0.7 2,-0.4 -0.749 7.1-168.9 -96.4 142.4 -0.3 49.4 56.4 7 10 A I E -Ab 16 82A 16 74,-1.9 76,-2.3 -2,-0.3 2,-0.7 -0.977 19.8-175.7-140.6 116.4 -0.6 45.7 55.7 8 11 A N E -A 15 0A 41 7,-3.1 7,-1.9 -2,-0.4 2,-1.3 -0.883 16.7-171.4-110.4 97.6 1.8 43.3 53.9 9 12 A C + 0 0 3 -2,-0.7 113,-0.3 74,-0.4 5,-0.2 -0.641 14.1 174.8 -99.0 81.2 -0.1 40.1 53.9 10 13 A G - 0 0 11 -2,-1.3 112,-0.0 108,-0.1 105,-0.0 0.093 46.0 -89.8 -76.0-170.7 2.3 37.4 52.6 11 14 A S S S+ 0 0 62 1,-0.2 -1,-0.1 25,-0.0 3,-0.0 0.836 122.9 21.9 -72.3 -36.7 2.0 33.6 52.2 12 15 A S S S+ 0 0 63 22,-0.1 23,-2.6 24,-0.1 22,-0.2 0.625 128.5 17.2-103.9 -19.8 3.2 32.7 55.7 13 16 A S - 0 0 12 20,-0.2 20,-0.2 21,-0.2 2,-0.2 -0.700 58.4-126.0-140.5-178.6 2.6 36.0 57.7 14 17 A I - 0 0 5 -2,-0.2 18,-1.1 -5,-0.2 2,-0.6 -0.667 25.2-167.4-140.0 87.2 0.8 39.4 58.0 15 18 A K E +AC 8 31A 120 -7,-1.9 -7,-3.1 16,-0.2 2,-0.3 -0.640 20.2 174.6 -74.8 115.1 3.4 42.1 58.6 16 19 A F E -AC 7 30A 5 14,-1.2 14,-1.8 -2,-0.6 2,-0.3 -0.775 16.5-178.4-120.8 165.9 1.5 45.2 59.6 17 20 A S E -AC 6 29A 12 -11,-2.2 -11,-2.5 -2,-0.3 2,-0.4 -0.975 18.4-142.1-153.7 158.7 2.3 48.8 60.8 18 21 A V E -AC 5 28A 0 10,-2.9 9,-2.9 -2,-0.3 10,-1.3 -0.980 21.2-170.8-127.2 117.0 0.4 51.9 61.9 19 22 A L E -AC 4 26A 0 -15,-2.4 -15,-2.5 -2,-0.4 2,-0.4 -0.824 26.0-117.8-108.3 146.7 1.7 55.3 60.9 20 23 A D E > -A 3 0A 24 5,-2.2 4,-2.8 -2,-0.3 -17,-0.2 -0.692 18.3-142.1 -79.0 132.3 0.6 58.7 62.1 21 24 A V T 4 S+ 0 0 36 -19,-2.5 -18,-0.1 -2,-0.4 -1,-0.1 0.850 97.5 53.8 -63.9 -35.2 -0.8 60.7 59.1 22 25 A A T 4 S+ 0 0 83 -20,-0.5 -1,-0.2 1,-0.2 -19,-0.1 0.960 129.9 10.3 -64.6 -53.5 0.7 63.9 60.4 23 26 A T T 4 S- 0 0 69 2,-0.1 -2,-0.2 0, 0.0 -1,-0.2 0.537 87.6-130.6-108.6 -11.3 4.3 62.7 60.9 24 27 A C < + 0 0 11 -4,-2.8 2,-0.2 1,-0.2 -3,-0.1 0.630 58.0 147.1 63.6 17.4 4.4 59.3 59.1 25 28 A D - 0 0 97 -5,-0.2 -5,-2.2 1,-0.1 2,-0.6 -0.493 56.9-106.3 -80.4 150.3 6.1 57.9 62.2 26 29 A V E +C 19 0A 80 -7,-0.2 -7,-0.2 1,-0.2 3,-0.1 -0.710 37.1 173.8 -81.1 116.4 5.3 54.3 63.2 27 30 A L E S+ 0 0 101 -9,-2.9 2,-0.3 -2,-0.6 -1,-0.2 0.674 72.2 8.2 -89.2 -23.1 3.1 54.2 66.3 28 31 A M E +C 18 0A 8 -10,-1.3 -10,-2.9 2,-0.0 -1,-0.3 -0.981 60.7 178.4-159.8 144.1 2.7 50.4 66.2 29 32 A A E +C 17 0A 38 -2,-0.3 16,-1.5 -12,-0.3 2,-0.3 -0.969 14.4 147.6-144.7 157.1 4.1 47.4 64.3 30 33 A G E -CD 16 44A 13 -14,-1.8 -14,-1.2 -2,-0.3 2,-0.2 -0.946 29.1-132.1-170.4-172.5 3.6 43.7 64.5 31 34 A I E -CD 15 43A 49 12,-0.6 12,-1.7 -2,-0.3 2,-1.0 -0.823 4.9-154.0-167.1 119.6 3.5 40.3 62.7 32 35 A A E + D 0 42A 3 -18,-1.1 10,-0.2 -2,-0.2 3,-0.2 -0.750 36.0 179.0 -97.6 87.8 1.0 37.4 62.6 33 36 A D E + D 0 41A 55 -2,-1.0 8,-1.5 8,-0.8 -20,-0.2 -0.223 48.6 46.9 -90.1 173.6 3.3 34.5 61.7 34 37 A G S > S- 0 0 19 -22,-0.2 3,-0.7 6,-0.2 20,-0.2 0.854 74.3-177.0 65.7 38.1 2.6 30.7 61.2 35 38 A M T 3 + 0 0 17 -23,-2.6 -1,-0.2 1,-0.2 21,-0.1 -0.440 64.1 12.0 -74.3 139.5 -0.4 31.3 59.1 36 39 A N T 3 S+ 0 0 95 19,-1.1 -1,-0.2 1,-0.3 2,-0.1 0.092 108.7 102.6 79.1 -21.7 -2.4 28.3 57.8 37 40 A T S < S- 0 0 48 -3,-0.7 17,-0.7 -25,-0.2 18,-0.4 -0.445 84.3-121.3 -80.4 161.9 -0.4 26.1 60.3 38 41 A E S S+ 0 0 72 1,-0.2 2,-1.4 16,-0.2 16,-0.8 0.850 106.9 69.9 -68.7 -36.0 -1.9 25.0 63.6 39 42 A N S S+ 0 0 82 14,-0.2 2,-0.4 15,-0.1 -1,-0.2 -0.640 71.5 151.9 -83.9 82.7 1.0 26.8 65.3 40 43 A A + 0 0 8 -2,-1.4 12,-1.4 -3,-0.1 2,-0.3 -0.950 15.9 174.0-120.5 134.8 -0.1 30.5 64.6 41 44 A F E -D 33 0A 75 -8,-1.5 -8,-0.8 -2,-0.4 2,-0.5 -0.950 25.2-141.6-140.7 156.8 0.8 33.5 66.8 42 45 A L E -D 32 0A 11 -2,-0.3 8,-2.4 -10,-0.2 2,-0.5 -0.984 17.7-174.6-121.4 121.6 0.5 37.3 66.8 43 46 A S E -D 31 0A 12 -12,-1.7 -12,-0.6 -2,-0.5 2,-0.6 -0.907 8.0-161.2-124.2 104.6 3.4 39.4 68.3 44 47 A I E > S-D 30 0A 8 -2,-0.5 3,-0.5 4,-0.3 -14,-0.2 -0.737 82.9 -12.6 -86.6 119.7 3.0 43.2 68.6 45 48 A N T 3 S- 0 0 100 -16,-1.5 -1,-0.2 -2,-0.6 -15,-0.1 0.571 118.4 -75.6 66.0 12.9 6.4 44.9 69.0 46 49 A G T 3 S+ 0 0 69 -3,-0.5 -1,-0.2 -17,-0.1 -2,-0.1 0.961 106.8 118.0 61.7 55.8 8.0 41.5 69.6 47 50 A D S < S+ 0 0 99 -3,-0.5 -2,-0.1 1,-0.1 -4,-0.1 0.478 72.1 10.1-132.1 -8.2 6.6 41.3 73.1 48 51 A K - 0 0 54 2,-0.0 2,-0.7 -4,-0.0 -4,-0.3 -0.239 60.8-137.2-179.7 82.2 4.2 38.3 73.5 49 52 A P - 0 0 101 0, 0.0 -6,-0.2 0, 0.0 3,-0.1 -0.228 42.5-152.6 -40.5 90.9 3.6 35.5 71.0 50 53 A I - 0 0 50 -8,-2.4 2,-0.8 -2,-0.7 -8,-0.1 0.058 19.1 -88.6 -71.2 177.3 -0.2 35.5 71.5 51 54 A N + 0 0 106 -10,-0.1 -10,-0.2 1,-0.1 -1,-0.1 -0.824 67.8 129.6 -92.6 108.9 -2.8 32.7 71.0 52 55 A L > + 0 0 23 -12,-1.4 3,-0.6 -2,-0.8 -1,-0.1 -0.065 33.1 168.4-145.7 35.9 -4.0 32.6 67.4 53 56 A A T 3 + 0 0 68 1,-0.2 -14,-0.2 -14,-0.1 -15,-0.2 -0.189 61.4 0.8 -68.9 142.3 -3.6 28.9 66.6 54 57 A H T 3 S+ 0 0 78 -16,-0.8 2,-0.3 -17,-0.7 -1,-0.2 0.896 95.2 144.6 50.8 50.0 -5.0 27.3 63.5 55 58 A S < - 0 0 18 -3,-0.6 -19,-1.1 -18,-0.4 -1,-0.2 -0.873 43.1-126.4-120.8 152.1 -6.6 30.6 62.2 56 59 A N > - 0 0 85 -2,-0.3 4,-2.5 -21,-0.1 3,-0.3 -0.217 37.9 -88.9 -88.4 178.2 -7.1 32.0 58.7 57 60 A Y H > S+ 0 0 47 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.834 126.3 50.3 -55.6 -38.8 -6.0 35.3 57.2 58 61 A E H > S+ 0 0 68 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.812 110.4 49.5 -74.4 -30.5 -9.3 37.0 58.2 59 62 A D H > S+ 0 0 82 -3,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.944 109.1 51.9 -69.6 -50.7 -9.0 35.8 61.8 60 63 A A H X S+ 0 0 5 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.916 112.2 46.2 -48.0 -50.6 -5.3 37.0 62.1 61 64 A L H X S+ 0 0 20 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.826 110.8 52.3 -66.4 -34.6 -6.4 40.5 60.9 62 65 A K H X S+ 0 0 37 -4,-1.5 4,-3.0 2,-0.2 -1,-0.2 0.864 107.2 53.6 -66.6 -38.1 -9.4 40.5 63.3 63 66 A A H X S+ 0 0 33 -4,-2.8 4,-1.6 2,-0.2 -2,-0.2 0.936 113.3 41.9 -57.8 -49.7 -6.9 39.7 66.1 64 67 A I H X S+ 0 0 8 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.860 112.1 57.4 -63.9 -38.1 -4.9 42.7 65.0 65 68 A A H X S+ 0 0 17 -4,-2.4 4,-2.0 1,-0.2 3,-0.3 0.935 107.8 44.9 -57.5 -50.7 -8.2 44.6 64.6 66 69 A F H X S+ 0 0 55 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.817 110.9 55.5 -64.8 -32.2 -9.1 44.0 68.2 67 70 A E H X S+ 0 0 69 -4,-1.6 4,-1.0 2,-0.2 -1,-0.2 0.795 105.9 50.9 -71.0 -30.0 -5.6 44.9 69.3 68 71 A L H <>S+ 0 0 0 -4,-1.8 5,-2.3 -3,-0.3 3,-0.4 0.916 111.9 47.1 -68.8 -44.5 -5.9 48.3 67.5 69 72 A E H ><5S+ 0 0 127 -4,-2.0 3,-1.8 1,-0.2 -2,-0.2 0.858 105.2 60.5 -62.4 -38.0 -9.2 48.8 69.4 70 73 A K H 3<5S+ 0 0 69 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.833 106.2 47.1 -59.4 -33.3 -7.6 47.8 72.6 71 74 A R T 3<5S- 0 0 117 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 -0.056 118.1-114.0 -99.5 31.5 -5.1 50.7 72.2 72 75 A D T < 5S+ 0 0 156 -3,-1.8 -3,-0.2 1,-0.1 -2,-0.1 0.753 88.2 111.2 41.7 38.4 -8.0 53.1 71.4 73 76 A L < + 0 0 22 -5,-2.3 -4,-0.2 -6,-0.1 3,-0.1 0.023 43.2 92.2-125.4 30.0 -6.8 53.6 67.8 74 77 A T S > S+ 0 0 52 -6,-0.3 3,-1.7 -5,-0.2 -5,-0.1 0.924 87.0 48.1 -81.8 -50.5 -9.6 51.9 65.8 75 78 A D T 3 S+ 0 0 113 1,-0.3 -1,-0.2 -6,-0.1 -2,-0.1 0.279 107.9 60.7 -75.7 14.5 -11.8 55.0 65.3 76 79 A S T 3 S+ 0 0 41 -3,-0.1 -73,-2.8 -74,-0.1 2,-1.3 0.396 70.4 111.2-115.1 -3.2 -8.6 56.8 64.2 77 80 A V E < +b 3 0A 10 -3,-1.7 -73,-0.2 -75,-0.2 3,-0.1 -0.615 33.2 165.6 -80.4 94.0 -7.8 54.6 61.1 78 81 A A E + 0 0 47 -75,-1.7 56,-0.8 -2,-1.3 2,-0.3 0.831 63.2 22.2 -74.8 -36.3 -8.5 56.9 58.2 79 82 A L E -be 4 134A 12 -76,-1.1 -74,-2.6 54,-0.1 2,-0.5 -0.976 58.4-153.8-138.8 142.5 -6.7 54.8 55.5 80 83 A I E -be 5 135A 0 54,-2.2 56,-2.6 -2,-0.3 2,-0.4 -0.979 14.7-159.2-119.0 120.1 -5.6 51.2 54.9 81 84 A G E -be 6 136A 0 -76,-1.7 -74,-1.9 -2,-0.5 2,-0.5 -0.833 5.2-160.7 -96.3 132.1 -2.7 50.6 52.6 82 85 A H E -be 7 137A 3 54,-2.7 56,-3.0 -2,-0.4 2,-0.5 -0.951 10.2-142.2-115.5 129.4 -2.2 47.2 51.1 83 86 A R E - e 0 138A 30 -76,-2.3 -74,-0.4 -2,-0.5 2,-0.4 -0.779 17.8-166.0 -87.7 128.2 1.0 45.9 49.6 84 87 A I E - e 0 139A 0 54,-3.0 56,-2.4 -2,-0.5 57,-0.2 -0.962 15.2-149.2-116.4 134.0 0.6 43.8 46.5 85 88 A A S S+ 0 0 18 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.909 78.8 23.7 -65.6 -44.8 3.4 41.7 45.1 86 89 A H + 0 0 0 54,-0.1 -1,-0.2 26,-0.1 26,-0.1 -0.985 45.6 173.3-138.7 129.7 2.5 41.9 41.4 87 90 A G >> - 0 0 0 -2,-0.4 3,-1.3 1,-0.3 4,-1.3 0.338 27.2-156.6-116.1 4.1 0.6 44.3 39.2 88 91 A G T 34 - 0 0 0 1,-0.2 -1,-0.3 20,-0.2 3,-0.1 -0.227 60.9 -46.6 53.6-141.2 1.2 43.0 35.7 89 92 A E T 34 S+ 0 0 88 1,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.259 128.9 77.4-103.2 8.0 0.8 45.7 33.0 90 93 A L T <4 S+ 0 0 71 -3,-1.3 2,-0.6 1,-0.2 -2,-0.2 0.744 85.6 60.4 -90.6 -26.0 -2.5 47.0 34.5 91 94 A F < + 0 0 8 -4,-1.3 -1,-0.2 1,-0.1 54,-0.1 -0.901 43.1 157.6-116.7 111.3 -1.1 48.9 37.4 92 95 A T S S+ 0 0 90 -2,-0.6 2,-0.3 1,-0.1 -1,-0.1 0.434 73.6 10.1-105.4 -5.5 1.2 51.9 36.8 93 96 A Q S S- 0 0 133 44,-0.0 -1,-0.1 52,-0.0 2,-0.1 -0.966 94.3 -68.4-160.5 171.0 0.5 53.6 40.1 94 97 A S - 0 0 11 -2,-0.3 2,-0.3 44,-0.1 44,-0.2 -0.400 54.6-167.3 -67.9 148.8 -1.1 53.2 43.5 95 98 A V E -F 137 0A 28 42,-1.8 42,-3.1 -2,-0.1 2,-0.4 -0.960 28.3-102.9-143.0 151.7 -4.9 53.1 43.4 96 99 A I E -F 136 0A 33 -2,-0.3 40,-0.3 40,-0.2 2,-0.2 -0.641 50.3-112.3 -74.4 129.3 -8.0 53.3 45.6 97 100 A I + 0 0 12 38,-2.8 38,-0.3 -2,-0.4 2,-0.3 -0.470 52.3 150.2 -74.0 127.5 -9.3 49.7 46.1 98 101 A T > - 0 0 57 -2,-0.2 4,-2.0 1,-0.0 5,-0.1 -0.852 62.5 -88.1-140.3 176.2 -12.7 49.0 44.5 99 102 A D H > S+ 0 0 107 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.888 126.9 55.3 -56.9 -41.5 -14.4 46.0 43.0 100 103 A E H > S+ 0 0 126 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.918 107.8 49.7 -55.2 -44.4 -12.8 46.7 39.6 101 104 A I H > S+ 0 0 15 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.862 107.3 52.9 -69.4 -36.2 -9.4 46.7 41.2 102 105 A I H X S+ 0 0 9 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.967 110.7 48.0 -61.4 -50.4 -9.9 43.4 42.9 103 106 A D H X S+ 0 0 84 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.900 112.2 49.9 -52.9 -45.3 -10.9 41.8 39.6 104 107 A N H X S+ 0 0 24 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.876 111.4 46.9 -67.3 -39.2 -7.8 43.4 38.0 105 108 A I H X S+ 0 0 0 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.892 110.8 53.7 -64.4 -41.2 -5.5 42.1 40.7 106 109 A R H < S+ 0 0 116 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.792 106.8 53.4 -64.1 -28.5 -7.2 38.7 40.4 107 110 A R H < S+ 0 0 164 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.905 114.3 38.3 -72.2 -45.0 -6.4 38.7 36.7 108 111 A V H >< S+ 0 0 12 -4,-1.6 3,-2.0 1,-0.2 4,-0.2 0.534 92.0 94.8 -82.7 -8.1 -2.7 39.4 37.0 109 112 A S G >< + 0 0 0 -4,-1.1 3,-3.2 1,-0.3 7,-0.3 0.858 69.4 68.3 -55.4 -41.3 -2.4 37.1 40.0 110 113 A P G 3 S+ 0 0 80 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.729 89.2 67.9 -52.2 -21.5 -1.3 34.1 38.0 111 114 A L G < S+ 0 0 36 -3,-2.0 -2,-0.2 1,-0.3 -24,-0.1 0.594 119.2 18.4 -71.3 -13.9 1.9 36.0 37.3 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33,-0.2 32,-1.6 34,-0.2 2,-0.4 0.418 118.7 94.7-117.4 -4.1 18.9 31.9 49.1 233 236 A R - 0 0 56 31,-0.1 -3,-2.9 30,-0.1 28,-0.2 -0.770 65.9-143.2 -97.4 134.4 18.1 32.8 45.5 234 237 A S - 0 0 21 26,-2.4 -1,-0.1 -2,-0.4 2,-0.1 0.827 27.4-160.5 -59.7 -40.0 20.6 32.1 42.7 235 238 A G + 0 0 2 -10,-0.5 -7,-0.2 25,-0.3 -6,-0.2 -0.430 59.7 17.0 76.2-163.2 20.1 35.2 40.6 236 239 A D S S+ 0 0 49 -9,-2.7 2,-0.3 -2,-0.1 -10,-0.1 -0.031 74.6 176.4 -40.2 127.4 21.2 35.1 37.0 237 240 A V - 0 0 69 4,-0.0 2,-0.1 0, 0.0 -2,-0.1 -0.937 36.1-114.0-147.6 121.9 21.7 31.5 35.8 238 241 A D >> - 0 0 116 -2,-0.3 4,-1.9 1,-0.2 3,-0.7 -0.290 21.9-147.6 -46.5 114.7 22.6 30.1 32.3 239 242 A F H 3> S+ 0 0 151 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.816 98.1 62.0 -60.9 -30.6 19.5 28.2 31.2 240 243 A G H 3> S+ 0 0 40 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.881 104.8 47.3 -58.9 -39.6 21.8 25.7 29.4 241 244 A A H <> S+ 0 0 35 -3,-0.7 4,-3.1 2,-0.2 -2,-0.2 0.923 110.7 49.9 -68.4 -45.9 23.3 24.9 32.8 242 245 A M H X S+ 0 0 31 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.885 114.1 47.0 -61.3 -37.7 19.9 24.4 34.5 243 246 A A H X S+ 0 0 29 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.909 112.4 49.0 -66.3 -46.4 18.9 22.2 31.6 244 247 A W H X S+ 0 0 157 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.920 108.8 52.9 -59.7 -48.1 22.2 20.2 31.8 245 248 A I H >X S+ 0 0 56 -4,-3.1 4,-2.9 1,-0.2 3,-0.6 0.915 105.2 56.0 -53.6 -47.1 21.8 19.8 35.5 246 249 A A H 3X>S+ 0 0 28 -4,-1.7 4,-1.0 1,-0.3 5,-0.8 0.888 110.4 43.9 -53.0 -44.9 18.3 18.3 35.0 247 250 A K H 3<5S+ 0 0 173 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.682 117.2 46.6 -75.2 -21.1 19.6 15.6 32.6 248 251 A E H <<5S+ 0 0 127 -4,-1.4 -2,-0.2 -3,-0.6 -1,-0.2 0.847 123.5 28.5 -91.4 -39.4 22.6 14.8 34.9 249 252 A T H <5S- 0 0 81 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.421 101.6-123.8-100.9 -3.6 20.9 14.6 38.3 250 253 A G T <5 + 0 0 69 -4,-1.0 2,-0.2 -5,-0.4 -3,-0.2 0.877 57.5 151.9 61.3 42.1 17.5 13.5 37.0 251 254 A Q < - 0 0 58 -5,-0.8 -1,-0.2 -6,-0.3 -2,-0.1 -0.672 39.8-126.7-103.3 157.1 15.6 16.4 38.6 252 255 A T > - 0 0 73 -2,-0.2 4,-1.8 1,-0.1 -1,-0.1 -0.207 29.6-106.4 -84.8-179.4 12.4 18.1 37.7 253 256 A L H > S+ 0 0 132 2,-0.2 4,-2.5 3,-0.2 5,-0.2 0.798 124.5 54.7 -74.9 -33.4 11.8 21.9 37.2 254 257 A S H > S+ 0 0 91 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.920 109.2 47.9 -63.3 -44.9 9.9 21.8 40.5 255 258 A D H > S+ 0 0 51 1,-0.2 4,-2.1 2,-0.2 3,-0.4 0.954 116.5 42.4 -54.7 -53.9 13.0 20.3 42.1 256 259 A L H X S+ 0 0 9 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.782 108.0 59.7 -70.0 -28.6 15.3 22.9 40.5 257 260 A E H X S+ 0 0 124 -4,-2.5 4,-0.6 2,-0.2 -1,-0.2 0.820 108.5 46.2 -68.2 -32.9 12.9 25.7 41.2 258 261 A R H >X>S+ 0 0 103 -4,-1.5 4,-3.6 -3,-0.4 3,-0.9 0.946 112.3 50.1 -67.4 -52.9 13.2 24.9 44.9 259 262 A V H 3X5S+ 0 0 35 -4,-2.1 4,-0.9 1,-0.3 5,-0.4 0.878 111.9 47.3 -53.5 -44.6 17.0 24.6 44.7 260 263 A V H 3<5S+ 0 0 13 -4,-2.4 -26,-2.4 1,-0.2 -25,-0.3 0.689 123.2 33.8 -73.9 -20.6 17.3 28.0 42.9 261 264 A N H <<5S+ 0 0 35 -3,-0.9 -2,-0.2 -4,-0.6 -1,-0.2 0.759 132.5 21.1-104.0 -33.7 15.0 29.7 45.4 262 265 A K H <5S+ 0 0 130 -4,-3.6 -3,-0.2 -5,-0.1 -2,-0.1 0.732 128.7 33.0-115.2 -32.9 15.7 27.9 48.7 263 266 A E S <> + 0 0 21 -32,-1.6 4,-1.2 -5,-0.4 3,-0.6 -0.087 66.5 47.2-107.5-164.3 21.0 28.6 46.4 265 268 A G H 3> S- 0 0 6 2,-0.2 4,-2.3 1,-0.2 5,-0.3 -0.276 118.9 -10.9 71.9-149.0 22.6 32.1 46.7 266 269 A L H 3> S+ 0 0 1 -36,-3.2 4,-2.4 1,-0.2 5,-0.3 0.906 144.1 47.7 -51.5 -45.4 24.8 33.1 49.6 267 270 A L H <>>S+ 0 0 54 -36,-2.4 4,-3.1 -3,-0.6 5,-0.5 0.922 108.8 54.2 -60.3 -47.4 23.7 30.0 51.4 268 271 A G H <5S+ 0 0 36 -4,-1.2 -2,-0.2 -37,-0.3 -1,-0.2 0.873 115.6 36.9 -59.0 -43.7 24.4 27.8 48.3 269 272 A I H <5S+ 0 0 54 -4,-2.3 -1,-0.2 1,-0.1 -2,-0.2 0.943 123.0 41.3 -75.4 -49.7 28.0 28.9 47.8 270 273 A S H <5S- 0 0 1 -4,-2.4 -2,-0.2 -5,-0.3 -3,-0.2 0.876 86.0-149.8 -66.8 -37.9 28.9 29.2 51.5 271 274 A G T <5S+ 0 0 51 -4,-3.1 -3,-0.1 -5,-0.3 -4,-0.1 0.868 83.0 70.0 64.9 39.5 27.2 26.0 52.6 272 275 A L S - 0 0 46 1,-0.2 4,-2.0 -3,-0.1 3,-0.2 -0.630 66.1-152.5 -79.5 120.8 23.0 35.9 56.7 276 279 A L H > S+ 0 0 7 -2,-0.5 4,-3.6 1,-0.2 5,-0.2 0.831 94.0 59.4 -57.9 -37.7 25.8 38.3 55.8 277 280 A R H > S+ 0 0 188 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.925 107.6 45.9 -60.3 -45.0 26.8 38.9 59.5 278 281 A V H > S+ 0 0 66 -3,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.940 118.0 42.8 -59.7 -49.0 27.4 35.1 59.9 279 282 A L H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.877 109.1 56.7 -69.5 -40.4 29.4 34.9 56.7 280 283 A E H X S+ 0 0 50 -4,-3.6 4,-2.0 2,-0.2 -1,-0.2 0.897 113.8 41.1 -57.1 -42.6 31.3 38.2 57.3 281 284 A K H X S+ 0 0 47 -4,-1.9 4,-2.9 -5,-0.2 -2,-0.2 0.885 110.6 58.3 -70.5 -40.6 32.6 36.8 60.6 282 285 A A H <>S+ 0 0 12 -4,-2.4 5,-3.3 2,-0.2 -2,-0.2 0.882 109.1 45.0 -54.1 -41.5 33.1 33.4 58.9 283 286 A W H ><5S+ 0 0 66 -4,-2.7 3,-2.1 3,-0.2 -2,-0.2 0.941 111.2 51.5 -68.5 -47.6 35.5 35.2 56.4 284 287 A H H 3<5S+ 0 0 171 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.869 109.3 52.1 -56.4 -37.7 37.2 37.1 59.3 285 288 A E T 3<5S- 0 0 164 -4,-2.9 -1,-0.3 -5,-0.1 -2,-0.2 0.457 129.7-101.6 -77.8 -3.2 37.6 33.6 60.9 286 289 A G T < 5 + 0 0 62 -3,-2.1 2,-0.5 1,-0.3 -3,-0.2 0.630 64.6 156.2 97.0 17.8 39.2 32.4 57.7 287 290 A H >< - 0 0 75 -5,-3.3 4,-1.4 -6,-0.2 -1,-0.3 -0.656 26.1-162.1 -76.3 120.5 36.4 30.4 56.0 288 291 A E H > S+ 0 0 103 -2,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.905 86.0 53.1 -74.0 -42.4 37.2 30.4 52.2 289 292 A R H > S+ 0 0 126 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.761 108.6 50.6 -66.5 -26.5 33.7 29.5 51.0 290 293 A A H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.883 109.9 51.0 -73.7 -41.0 32.1 32.3 53.0 291 294 A R H X S+ 0 0 76 -4,-1.4 4,-2.5 1,-0.2 -2,-0.2 0.908 111.3 47.9 -57.9 -45.5 34.7 34.7 51.4 292 295 A L H X S+ 0 0 68 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.889 108.3 54.4 -64.9 -41.8 33.8 33.3 48.0 293 296 A A H X S+ 0 0 0 -4,-1.7 4,-2.7 1,-0.2 -2,-0.2 0.938 113.7 41.6 -56.8 -49.0 30.1 33.8 48.6 294 297 A I H X S+ 0 0 0 -4,-2.2 4,-3.1 2,-0.2 -2,-0.2 0.879 113.9 51.5 -66.9 -42.1 30.6 37.4 49.5 295 298 A K H X S+ 0 0 89 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.885 114.0 44.3 -63.8 -40.0 33.0 38.1 46.7 296 299 A T H X S+ 0 0 46 -4,-2.6 4,-2.4 2,-0.2 5,-0.3 0.940 112.9 51.5 -67.0 -49.7 30.6 36.6 44.2 297 300 A F H X S+ 0 0 2 -4,-2.7 4,-1.6 -5,-0.3 -68,-0.2 0.940 114.9 43.1 -48.2 -53.8 27.7 38.5 45.8 298 301 A V H X S+ 0 0 5 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.864 110.7 56.0 -62.9 -40.9 29.7 41.7 45.5 299 302 A H H X S+ 0 0 87 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.887 109.0 45.7 -61.0 -41.9 30.9 40.9 42.0 300 303 A R H X S+ 0 0 76 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.805 109.1 54.8 -75.4 -31.3 27.4 40.5 40.6 301 304 A I H X S+ 0 0 0 -4,-1.6 4,-2.4 -5,-0.3 -2,-0.2 0.950 111.4 46.0 -62.1 -47.9 26.1 43.7 42.4 302 305 A A H X S+ 0 0 2 -4,-2.3 4,-2.6 2,-0.2 5,-0.3 0.922 110.2 53.9 -57.6 -47.1 28.9 45.6 40.6 303 306 A R H X S+ 0 0 176 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.924 114.7 39.5 -57.0 -49.0 28.2 44.0 37.3 304 307 A H H X S+ 0 0 38 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.795 111.3 57.3 -74.0 -32.0 24.5 45.0 37.4 305 308 A I H X S+ 0 0 0 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.989 112.9 41.0 -59.6 -55.7 25.2 48.4 38.8 306 309 A A H < S+ 0 0 36 -4,-2.6 4,-0.4 1,-0.2 3,-0.3 0.894 115.3 52.0 -58.6 -43.5 27.5 49.3 35.9 307 310 A G H >< S+ 0 0 39 -4,-2.2 3,-1.9 -5,-0.3 4,-0.4 0.932 107.3 50.5 -60.0 -49.1 25.1 47.6 33.4 308 311 A H H >< S+ 0 0 5 -4,-2.6 3,-1.1 1,-0.3 -1,-0.2 0.749 98.4 69.1 -62.3 -23.5 22.1 49.5 34.6 309 312 A A G >< S+ 0 0 18 -4,-1.3 3,-1.4 -3,-0.3 -1,-0.3 0.676 83.6 72.2 -67.0 -18.8 24.1 52.7 34.2 310 313 A A G < S+ 0 0 87 -3,-1.9 -1,-0.2 -4,-0.4 -2,-0.2 0.816 88.1 62.1 -65.8 -29.8 24.0 52.1 30.4 311 314 A S G < S+ 0 0 35 -3,-1.1 2,-0.4 -4,-0.4 -1,-0.3 0.196 95.1 84.3 -80.2 16.4 20.3 53.1 30.5 312 315 A L < - 0 0 20 -3,-1.4 3,-0.2 1,-0.1 -117,-0.1 -0.931 64.8-153.8-119.8 145.5 21.4 56.6 31.8 313 316 A H S S+ 0 0 100 -2,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.840 93.2 10.6 -74.9 -37.1 22.5 59.7 29.9 314 317 A R - 0 0 91 -120,-0.1 2,-0.8 -3,-0.1 -1,-0.3 -0.996 69.4-137.7-145.8 138.0 24.5 60.7 33.0 315 318 A L + 0 0 30 -2,-0.3 -119,-0.2 1,-0.2 3,-0.1 -0.839 33.8 157.0 -98.5 103.2 25.4 58.9 36.3 316 319 A D + 0 0 30 -121,-2.5 54,-1.8 -2,-0.8 2,-0.3 0.784 60.8 11.1 -94.2 -31.4 24.9 61.3 39.2 317 320 A G E -ik 196 370C 0 -122,-1.3 -120,-2.1 52,-0.2 2,-0.4 -0.994 41.8-156.9-152.7 152.2 24.4 58.9 42.0 318 321 A I E -ik 197 371C 1 52,-2.1 54,-2.0 -2,-0.3 2,-0.5 -0.999 25.0-166.9-124.4 128.3 24.5 55.4 43.4 319 322 A I E -ik 198 372C 0 -122,-2.3 -120,-2.5 -2,-0.4 2,-0.3 -0.967 7.1-154.8-123.8 120.4 22.3 54.8 46.5 320 323 A F E +ik 199 373C 0 52,-2.4 54,-2.2 -2,-0.5 2,-0.3 -0.725 26.2 157.7 -91.3 143.6 22.5 51.8 48.7 321 324 A T E > +i 200 0C 0 -122,-2.0 -120,-2.9 -2,-0.3 4,-0.7 -0.958 22.1 60.2-157.7 172.5 19.4 50.7 50.7 322 325 A G H > S- 0 0 3 -2,-0.3 4,-3.4 52,-0.2 5,-0.4 -0.144 96.8 -54.4 88.1 169.6 17.7 47.8 52.4 323 326 A G H > S+ 0 0 44 1,-0.2 4,-1.0 2,-0.2 -121,-0.2 0.883 141.5 34.0 -46.4 -50.2 18.9 45.7 55.4 324 327 A I H > S+ 0 0 28 -123,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.897 119.7 50.6 -76.7 -40.8 22.2 44.8 53.7 325 328 A G H < S+ 0 0 0 -124,-2.2 -2,-0.2 -4,-0.7 -3,-0.2 0.788 115.2 42.3 -69.6 -29.3 22.6 48.1 51.9 326 329 A E H < S+ 0 0 21 -4,-3.4 -1,-0.2 -125,-0.3 -2,-0.2 0.759 126.6 29.4 -84.2 -27.2 22.0 50.3 55.0 327 330 A N H < S+ 0 0 97 -4,-1.0 2,-1.0 -5,-0.4 -2,-0.2 0.584 92.5 91.5-114.8 -12.5 24.1 48.2 57.5 328 331 A S X + 0 0 6 -4,-2.1 4,-1.9 1,-0.2 5,-0.2 -0.735 38.8 174.3 -98.5 98.1 26.9 46.5 55.6 329 332 A V H > S+ 0 0 51 -2,-1.0 4,-1.6 2,-0.2 -1,-0.2 0.867 81.7 48.3 -64.8 -38.7 30.1 48.6 55.6 330 333 A L H > S+ 0 0 60 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.968 110.3 48.3 -69.3 -55.2 32.2 45.9 53.9 331 334 A I H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.931 111.8 51.3 -52.3 -49.7 29.8 45.1 51.1 332 335 A R H X S+ 0 0 1 -4,-1.9 4,-2.3 -8,-0.2 -1,-0.2 0.883 113.5 44.8 -54.0 -42.7 29.4 48.8 50.3 333 336 A Q H X S+ 0 0 42 -4,-1.6 4,-3.1 2,-0.2 5,-0.2 0.942 113.6 48.0 -68.9 -49.0 33.2 49.3 50.2 334 337 A L H X S+ 0 0 33 -4,-3.1 4,-1.2 2,-0.2 -2,-0.2 0.900 114.4 47.5 -59.2 -42.1 33.9 46.2 48.1 335 338 A V H < S+ 0 0 0 -4,-2.8 3,-0.5 -5,-0.3 4,-0.3 0.952 114.3 45.7 -63.4 -49.9 31.1 47.1 45.7 336 339 A I H >< S+ 0 0 3 -4,-2.3 3,-1.6 -5,-0.3 -2,-0.2 0.899 111.2 52.3 -62.9 -40.0 32.3 50.7 45.3 337 340 A E H >< S+ 0 0 116 -4,-3.1 3,-0.8 1,-0.3 -1,-0.3 0.768 104.0 59.2 -66.9 -23.8 35.9 49.6 45.0 338 341 A H T 3< S+ 0 0 85 -4,-1.2 -1,-0.3 -3,-0.5 3,-0.2 0.502 101.5 56.5 -78.4 -7.1 34.7 47.3 42.2 339 342 A L T X > + 0 0 3 -3,-1.6 3,-1.2 -4,-0.3 5,-1.1 -0.133 61.8 122.8-117.2 36.9 33.4 50.3 40.3 340 343 A G G X 5 + 0 0 46 -3,-0.8 3,-1.4 1,-0.3 -1,-0.1 0.735 66.1 71.8 -67.1 -22.0 36.6 52.3 40.1 341 344 A V G 3 5S+ 0 0 131 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.804 95.0 51.6 -61.5 -30.6 36.0 52.3 36.3 342 345 A L G < 5S- 0 0 52 -3,-1.2 -1,-0.3 2,-0.1 -2,-0.2 0.422 123.6-107.1 -86.5 1.1 33.2 54.7 36.9 343 346 A G T < 5 + 0 0 19 -3,-1.4 25,-2.2 1,-0.2 26,-0.4 0.740 59.0 166.8 82.4 25.7 35.5 57.0 38.9 344 347 A L < - 0 0 17 -5,-1.1 2,-0.5 23,-0.2 -1,-0.2 -0.601 16.1-171.4 -76.5 126.7 34.0 56.3 42.3 345 348 A T - 0 0 61 -2,-0.4 19,-1.1 24,-0.4 2,-0.3 -0.991 12.4-150.1-115.2 128.9 36.0 57.4 45.4 346 349 A L B -M 363 0D 26 -2,-0.5 2,-0.6 17,-0.3 17,-0.3 -0.677 9.6-142.2 -96.8 146.9 34.8 56.2 48.8 347 350 A D > - 0 0 58 15,-2.6 4,-2.7 -2,-0.3 5,-0.2 -0.947 15.4-163.9-106.0 110.4 35.1 58.0 52.1 348 351 A V H > S+ 0 0 70 -2,-0.6 4,-1.8 2,-0.2 -1,-0.1 0.867 85.5 51.3 -70.5 -38.8 35.8 55.2 54.6 349 352 A E H > S+ 0 0 139 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.907 115.2 45.0 -62.6 -39.5 35.1 57.2 57.8 350 353 A M H 4 S+ 0 0 72 1,-0.2 3,-0.3 2,-0.2 -2,-0.2 0.878 114.6 47.4 -69.3 -39.4 31.7 58.2 56.2 351 354 A N H < S+ 0 0 0 -4,-2.7 -2,-0.2 11,-0.3 -1,-0.2 0.716 105.1 63.4 -70.9 -21.4 31.1 54.7 55.0 352 355 A K H < S+ 0 0 45 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.838 78.9 106.3 -69.2 -33.4 32.1 53.5 58.6 353 356 A Q S < S- 0 0 59 -4,-1.0 -3,-0.0 -3,-0.3 -4,-0.0 -0.132 72.5-120.0 -54.4 135.6 29.1 55.3 60.2 354 357 A P > - 0 0 74 0, 0.0 3,-1.9 0, 0.0 4,-0.1 -0.166 32.5 -93.5 -70.4 172.9 26.2 53.0 61.3 355 358 A N G > S+ 0 0 39 1,-0.3 3,-2.2 2,-0.2 -28,-0.1 0.648 114.0 81.9 -66.0 -18.3 22.6 53.3 60.1 356 359 A S G 3 S+ 0 0 103 1,-0.3 -1,-0.3 2,-0.1 -3,-0.0 0.780 82.4 64.9 -51.1 -31.3 21.7 55.6 63.0 357 360 A H G < S- 0 0 103 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.524 90.2-172.1 -75.6 -7.2 23.2 58.4 60.8 358 361 A G < + 0 0 18 -3,-2.2 2,-0.5 -4,-0.1 -1,-0.2 -0.137 53.5 26.9 62.2-136.4 20.4 57.8 58.3 359 362 A E S S+ 0 0 62 15,-0.1 2,-0.3 16,-0.1 15,-0.2 -0.492 84.8 153.9 -70.1 113.4 20.5 59.5 54.9 360 363 A R E -L 373 0C 13 13,-2.3 13,-3.0 -2,-0.5 2,-0.2 -0.998 46.8-122.8-153.0 134.2 24.2 60.1 54.3 361 364 A I E -L 372 0C 53 -2,-0.3 11,-0.3 11,-0.3 -42,-0.0 -0.538 21.9-175.6 -71.9 140.6 26.8 60.6 51.5 362 365 A I + 0 0 0 9,-2.6 -15,-2.6 -2,-0.2 2,-0.3 0.210 50.3 91.8-124.9 15.3 29.6 58.0 51.7 363 366 A S B S-M 346 0D 13 8,-0.8 -17,-0.3 -17,-0.3 7,-0.0 -0.847 72.8-116.0-114.6 147.2 31.9 59.2 48.8 364 367 A A > - 0 0 22 -19,-1.1 3,-0.8 -2,-0.3 -19,-0.3 -0.263 34.0-106.9 -69.7 165.1 34.9 61.6 48.9 365 368 A N T 3 S+ 0 0 162 1,-0.2 -1,-0.1 -19,-0.1 -18,-0.0 0.854 116.6 60.8 -66.3 -39.4 34.7 64.9 46.9 366 369 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.739 79.7 115.2 -56.0 -25.0 37.1 63.8 44.1 367 370 A S < - 0 0 14 -3,-0.8 -23,-0.2 -22,-0.2 -24,-0.1 -0.262 62.5-150.3 -50.0 127.3 34.5 61.1 43.4 368 371 A Q S S+ 0 0 163 -25,-2.2 2,-0.4 1,-0.1 -24,-0.2 0.746 85.4 42.1 -76.2 -23.6 33.0 61.7 39.9 369 372 A V S S- 0 0 9 -26,-0.4 -24,-0.4 -24,-0.0 2,-0.3 -0.985 89.7-121.3-124.6 136.4 29.8 60.1 41.1 370 373 A I E -k 317 0C 63 -54,-1.8 -52,-2.1 -2,-0.4 2,-0.4 -0.584 23.7-161.8 -76.9 130.1 28.1 60.6 44.4 371 374 A C E +k 318 0C 0 -2,-0.3 -9,-2.6 -54,-0.2 -8,-0.8 -0.906 18.1 163.4-108.3 144.9 27.5 57.6 46.6 372 375 A A E -kL 319 361C 0 -54,-2.0 -52,-2.4 -2,-0.4 2,-0.4 -0.967 34.6-129.4-152.2 161.6 25.1 57.6 49.5 373 376 A V E +kL 320 360C 0 -13,-3.0 -13,-2.3 -2,-0.3 -52,-0.2 -0.985 24.8 179.5-115.6 131.2 23.1 55.4 51.9 374 377 A I - 0 0 0 -54,-2.2 -52,-0.2 -2,-0.4 -15,-0.1 -0.936 27.3-129.4-134.6 106.9 19.4 56.1 52.1 375 378 A P - 0 0 30 0, 0.0 2,-0.1 0, 0.0 -54,-0.1 -0.349 27.7-127.1 -52.8 127.4 17.3 54.0 54.5 376 379 A T - 0 0 27 -2,-0.0 2,-0.1 1,-0.0 -201,-0.1 -0.435 23.0-172.0 -74.0 154.6 14.2 52.6 52.6 377 380 A N > + 0 0 47 -203,-0.2 4,-1.9 -202,-0.1 5,-0.1 -0.594 13.1 167.4-148.8 80.9 10.8 53.2 54.1 378 381 A E H > S+ 0 0 28 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.872 80.0 54.8 -67.0 -38.0 8.2 51.2 52.1 379 382 A E H > S+ 0 0 59 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.855 108.0 49.0 -62.4 -39.5 5.6 51.7 54.8 380 383 A K H > S+ 0 0 61 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.875 111.2 50.0 -68.2 -37.8 6.0 55.5 54.7 381 384 A M H X S+ 0 0 15 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.883 110.5 50.0 -67.3 -39.3 5.8 55.5 50.9 382 385 A I H X S+ 0 0 3 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.910 112.7 47.6 -63.3 -43.1 2.6 53.4 51.1 383 386 A A H X S+ 0 0 1 -4,-2.2 4,-3.8 2,-0.2 5,-0.2 0.966 107.6 54.1 -62.2 -52.7 1.2 55.9 53.6 384 387 A L H X S+ 0 0 72 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.811 112.1 46.0 -53.4 -34.7 2.1 59.0 51.5 385 388 A D H X S+ 0 0 17 -4,-1.6 4,-3.3 2,-0.2 -1,-0.2 0.944 113.3 48.1 -68.0 -51.1 0.2 57.4 48.6 386 389 A A H X S+ 0 0 0 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.906 112.5 49.5 -58.3 -43.5 -2.7 56.5 50.8 387 390 A I H >X S+ 0 0 45 -4,-3.8 3,-1.0 2,-0.2 4,-0.6 0.978 112.7 46.5 -58.3 -58.1 -2.8 60.0 52.3 388 391 A H H >< S+ 0 0 124 -4,-2.0 3,-1.7 1,-0.3 4,-0.2 0.925 112.9 49.7 -47.6 -53.0 -2.6 61.6 48.8 389 392 A L H >< S+ 0 0 20 -4,-3.3 3,-1.4 1,-0.3 -1,-0.3 0.723 95.5 74.3 -63.5 -21.6 -5.4 59.3 47.6 390 393 A G H << S+ 0 0 31 -4,-1.4 -1,-0.3 -3,-1.0 -2,-0.2 0.739 88.6 60.3 -60.6 -24.4 -7.4 60.2 50.7 391 394 A N T << S+ 0 0 120 -3,-1.7 -1,-0.2 -4,-0.6 -2,-0.2 0.590 84.8 108.0 -78.0 -11.5 -8.2 63.6 49.0 392 395 A V < - 0 0 60 -3,-1.4 2,-0.6 -4,-0.2 -3,-0.0 -0.297 64.0-139.7 -73.5 149.0 -9.9 62.0 46.0 393 396 A K 0 0 189 1,-0.0 -1,-0.1 -2,-0.0 -2,-0.1 -0.940 360.0 360.0-106.8 107.5 -13.7 62.1 45.4 394 397 A A 0 0 123 -2,-0.6 -2,-0.0 0, 0.0 -1,-0.0 -0.217 360.0 360.0 -78.2 360.0 -14.7 58.6 44.1