==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 16-NOV-07 2VGZ . COMPND 2 MOLECULE: KYNURENINE/ALPHA-AMINOADIPATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.ROSSI,S.GARAVAGLIA,V.MONTALBANO,M.A.WALSH,M.RIZZI . 827 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30680.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 581 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 46 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 77 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 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 . 53 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 91 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 254 30.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.5 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 2 5 0 4 2 0 0 1 2 2 0 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 1 3 1 5 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 PARALLEL BRIDGES PER LADDER . 2 5 3 2 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 2 1 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 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 A M 0 0 102 0, 0.0 3,-0.5 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 -47.2 54.1 38.2 35.6 2 -2 A L >> + 0 0 32 1,-0.2 3,-3.9 2,-0.1 4,-1.0 0.816 360.0 98.1 -84.0 -43.2 51.6 37.4 32.8 3 -1 A E T 34 S+ 0 0 190 1,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.627 91.1 50.8 -39.6 -29.3 52.9 37.4 29.2 4 2 A N T 34 S+ 0 0 89 -3,-0.5 -1,-0.3 91,-0.3 -2,-0.1 0.696 119.9 33.5-106.8 35.0 53.3 33.6 29.2 5 3 A Y T X> S+ 0 0 10 -3,-3.9 3,-1.9 -4,-0.1 4,-1.0 0.331 91.2 100.4-111.3 0.8 49.7 32.8 30.4 6 4 A A G >< S+ 0 0 48 -4,-1.0 3,-0.6 1,-0.3 -3,-0.1 0.860 74.0 62.7 -56.4 -38.1 48.2 35.9 28.6 7 5 A R G 34 S+ 0 0 67 -4,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.698 107.1 43.7 -60.0 -23.3 47.0 33.6 25.9 8 6 A F G <4 S+ 0 0 7 -3,-1.9 2,-0.3 2,-0.1 -1,-0.2 0.719 99.4 89.1 -90.5 -23.7 44.8 31.8 28.4 9 7 A I S << S- 0 0 13 -4,-1.0 109,-0.2 -3,-0.6 108,-0.1 -0.534 74.1-125.8 -87.6 133.9 43.5 35.0 30.2 10 8 A T > - 0 0 17 107,-3.0 4,-1.7 -2,-0.3 5,-0.1 -0.117 27.4-110.6 -62.8 169.2 40.4 37.0 29.2 11 9 A A H > S+ 0 0 84 2,-0.2 4,-1.3 1,-0.2 -1,-0.1 0.906 119.8 48.5 -73.2 -42.8 40.7 40.8 28.5 12 10 A A H > S+ 0 0 33 2,-0.2 4,-0.8 1,-0.2 3,-0.2 0.908 109.4 53.5 -60.1 -43.5 38.7 41.6 31.6 13 11 A S H >4 S+ 0 0 5 1,-0.2 3,-1.2 104,-0.2 -2,-0.2 0.955 109.6 46.7 -64.4 -44.1 40.9 39.3 33.7 14 12 A A H 3< S+ 0 0 50 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.757 105.5 61.6 -69.6 -22.8 44.2 40.9 32.6 15 13 A A H 3< S+ 0 0 33 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.721 79.3 111.6 -73.8 -17.5 42.8 44.4 33.2 16 14 A R << - 0 0 20 -3,-1.2 261,-0.1 -4,-0.8 260,-0.1 -0.314 50.8-161.4 -64.7 138.6 42.2 43.8 36.9 17 15 A N - 0 0 76 536,-0.3 -2,-0.0 259,-0.1 -1,-0.0 -0.820 34.2 -77.7-113.5 157.3 44.5 45.7 39.4 18 16 A P + 0 0 91 0, 0.0 -1,-0.1 0, 0.0 258,-0.1 -0.248 46.1 174.4 -52.6 131.7 45.3 45.1 43.1 19 17 A S 0 0 14 1,-0.1 -3,-0.0 -3,-0.0 531,-0.0 -0.481 360.0 360.0-140.4 62.1 42.4 46.2 45.4 20 18 A P 0 0 150 0, 0.0 -1,-0.1 0, 0.0 530,-0.0 0.687 360.0 360.0 -76.1 360.0 43.3 45.2 49.1 21 ! 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 22 32 A S 0 0 80 0, 0.0 763,-0.1 0, 0.0 759,-0.1 0.000 360.0 360.0 360.0 52.4 54.8 54.3 60.7 23 33 A M + 0 0 185 758,-0.1 2,-0.5 1,-0.1 762,-0.2 0.801 360.0 54.8 -62.9 -30.5 53.6 53.5 64.3 24 34 A I E -a 785 0A 24 760,-2.7 762,-2.3 794,-0.0 2,-0.5 -0.926 67.9-178.0-110.9 120.7 50.4 55.5 63.8 25 35 A S E +a 786 0A 63 -2,-0.5 762,-0.2 760,-0.2 786,-0.1 -0.965 23.9 160.0-117.5 124.1 48.1 54.6 60.8 26 36 A L + 0 0 2 760,-4.0 781,-3.0 -2,-0.5 762,-0.3 0.091 68.7 84.6-112.2 15.7 44.9 56.5 60.0 27 37 A A + 0 0 18 759,-0.5 2,-0.1 760,-0.2 760,-0.1 0.478 66.3 101.5 -95.8 -7.7 45.1 55.1 56.4 28 38 A G - 0 0 36 758,-0.2 760,-0.1 779,-0.1 758,-0.0 -0.448 60.3-149.0 -87.2 154.8 43.4 51.8 57.2 29 39 A G + 0 0 34 -2,-0.1 -1,-0.1 778,-0.1 731,-0.0 0.058 51.6 127.4-110.7 26.1 39.8 50.9 56.3 30 40 A L - 0 0 84 1,-0.1 779,-0.2 33,-0.0 2,-0.1 -0.614 54.4-130.1 -86.1 139.0 39.0 48.5 59.2 31 41 A P - 0 0 0 0, 0.0 33,-0.1 0, 0.0 642,-0.1 -0.440 41.0 -88.8 -72.2 161.1 36.0 48.8 61.5 32 42 A N > - 0 0 8 1,-0.1 3,-1.4 637,-0.1 4,-0.2 -0.636 31.9-157.0 -70.5 117.1 36.6 48.6 65.3 33 43 A P G > S+ 0 0 27 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.660 84.7 76.5 -72.1 -14.9 36.4 44.9 66.3 34 44 A N G 3 S+ 0 0 73 1,-0.2 -2,-0.0 3,-0.0 25,-0.0 0.688 87.9 59.4 -65.1 -19.2 35.6 46.0 69.9 35 45 A M G < S+ 0 0 42 -3,-1.4 -1,-0.2 634,-0.1 693,-0.1 0.613 79.9 102.2 -87.4 -15.1 32.1 46.8 68.8 36 46 A F S < S- 0 0 0 -3,-1.1 635,-0.2 -4,-0.2 426,-0.1 -0.532 71.4-135.8 -76.9 138.3 31.3 43.3 67.6 37 47 A P S S+ 0 0 2 0, 0.0 425,-2.6 0, 0.0 2,-0.5 0.592 76.8 88.3 -76.6 -17.7 29.1 41.3 70.1 38 48 A F E +B 461 0B 3 633,-0.4 423,-0.3 423,-0.2 3,-0.1 -0.755 48.4 173.7 -86.1 129.5 30.8 37.8 70.1 39 49 A K E + 0 0 65 421,-2.5 2,-0.3 -2,-0.5 19,-0.3 0.757 55.7 0.9-109.9 -36.1 33.5 37.8 72.7 40 50 A T E -B 460 0B 49 420,-0.5 420,-2.3 18,-0.1 -1,-0.3 -0.973 57.6-157.8-151.9 157.9 35.0 34.2 73.0 41 51 A A E -BC 459 53B 1 12,-1.8 12,-3.6 -2,-0.3 2,-0.4 -0.994 6.6-169.1-146.8 142.0 34.5 30.8 71.4 42 52 A V E -BC 458 52B 51 416,-2.3 416,-2.6 -2,-0.3 2,-0.4 -0.999 8.7-178.9-128.5 125.0 35.1 27.2 72.3 43 53 A I E -BC 457 51B 0 8,-2.7 8,-3.3 -2,-0.4 2,-0.2 -0.993 19.2-139.5-126.9 124.5 34.8 24.4 69.7 44 54 A T E -B 456 0B 46 412,-2.1 411,-2.5 -2,-0.4 412,-0.5 -0.585 8.2-152.5 -86.3 147.4 35.4 20.8 70.7 45 55 A V E > -B 454 0B 8 3,-0.3 3,-2.8 409,-0.2 409,-0.2 -0.972 33.5-100.5-119.0 130.5 37.2 18.4 68.4 46 56 A E T 3 S- 0 0 116 407,-2.3 3,-0.1 -2,-0.4 408,-0.0 -0.323 101.7 -18.5 -62.0 117.4 36.4 14.7 68.6 47 57 A N T 3 S+ 0 0 171 1,-0.2 -1,-0.3 -2,-0.2 2,-0.2 0.694 125.5 101.3 53.4 24.7 39.2 13.1 70.7 48 58 A G S < S- 0 0 30 -3,-2.8 -3,-0.3 405,-0.1 2,-0.3 -0.636 84.2 -72.9-121.4-178.7 41.2 16.2 69.9 49 59 A K - 0 0 138 -2,-0.2 2,-0.1 -3,-0.1 250,-0.1 -0.582 54.8-104.8 -77.3 137.3 42.2 19.4 71.7 50 60 A T - 0 0 60 -2,-0.3 2,-0.6 -6,-0.1 -6,-0.2 -0.370 27.1-127.8 -63.3 134.9 39.5 22.0 72.1 51 61 A I E -C 43 0B 4 -8,-3.3 -8,-2.7 -2,-0.1 2,-0.4 -0.807 31.6-169.8 -86.2 120.2 39.7 25.0 69.8 52 62 A Q E -C 42 0B 129 -2,-0.6 2,-0.7 -10,-0.2 -10,-0.2 -0.934 19.7-166.9-118.5 125.7 39.6 28.2 71.9 53 63 A F E -C 41 0B 2 -12,-3.6 -12,-1.8 -2,-0.4 -2,-0.0 -0.916 20.0-167.8-106.3 98.8 39.2 31.8 70.8 54 64 A G > - 0 0 41 -2,-0.7 4,-2.2 -14,-0.2 5,-0.2 -0.081 46.4 -73.4 -66.6-176.6 40.1 34.0 73.8 55 65 A E H > S+ 0 0 141 1,-0.2 4,-1.4 2,-0.2 -1,-0.0 0.855 131.1 39.1 -51.7 -46.8 39.4 37.6 73.8 56 66 A E H > S+ 0 0 123 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.819 114.1 51.7 -79.3 -34.1 42.1 38.7 71.3 57 67 A M H > S+ 0 0 61 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.812 107.1 56.0 -73.4 -27.9 41.9 35.8 68.9 58 68 A M H X S+ 0 0 1 -4,-2.2 4,-1.6 -19,-0.3 -2,-0.2 0.916 103.8 53.6 -65.6 -44.7 38.1 36.5 68.7 59 69 A K H < S+ 0 0 46 -4,-1.4 4,-0.3 1,-0.2 -2,-0.2 0.905 111.6 45.5 -55.1 -43.7 38.8 40.0 67.6 60 70 A R H >< S+ 0 0 90 -4,-1.6 3,-1.2 1,-0.2 -2,-0.2 0.914 109.8 54.5 -63.6 -46.4 41.0 38.6 64.9 61 71 A A H 3< S+ 0 0 0 -4,-2.4 227,-1.0 1,-0.2 226,-0.2 0.760 110.9 46.1 -58.7 -26.3 38.3 36.0 63.9 62 72 A L T 3< S+ 0 0 2 -4,-1.6 612,-3.2 -3,-0.2 611,-1.4 0.409 102.8 82.8 -97.0 -2.4 35.6 38.7 63.5 63 73 A Q S < S- 0 0 20 -3,-1.2 224,-0.1 -4,-0.3 -31,-0.0 -0.738 88.7 -88.5-106.2 152.1 37.8 41.1 61.5 64 74 A Y - 0 0 42 -2,-0.3 610,-0.1 604,-0.1 -1,-0.1 -0.123 47.1-173.6 -44.8 150.2 38.8 41.3 57.7 65 75 A S - 0 0 25 220,-0.1 5,-0.1 1,-0.1 -1,-0.1 -0.858 35.1 -51.5-144.7 176.7 41.9 39.3 56.7 66 76 A P > - 0 0 72 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.199 46.1-125.7 -62.0 142.3 44.1 38.8 53.6 67 77 A S T 3 S+ 0 0 18 1,-0.3 3,-0.1 217,-0.1 215,-0.0 0.766 109.1 50.4 -52.8 -38.1 42.4 38.0 50.3 68 78 A A T 3 S- 0 0 22 1,-0.3 35,-2.6 34,-0.1 -1,-0.3 0.509 124.5 -88.1 -80.1 -7.1 44.5 34.9 49.6 69 79 A G < - 0 0 2 -3,-1.7 -1,-0.3 33,-0.2 218,-0.1 -0.438 59.2 -47.3 120.9 165.6 43.8 33.5 53.2 70 80 A I >> - 0 0 0 -2,-0.1 4,-2.5 1,-0.1 3,-0.7 -0.484 55.5-120.8 -67.8 141.2 45.4 33.7 56.7 71 81 A P H 3> S+ 0 0 76 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.776 110.3 52.9 -57.9 -33.7 49.3 33.2 56.5 72 82 A E H 3> S+ 0 0 65 2,-0.2 4,-1.5 3,-0.2 5,-0.1 0.816 109.9 45.8 -74.6 -34.6 49.2 30.2 58.8 73 83 A L H <> S+ 0 0 0 -3,-0.7 4,-2.5 2,-0.2 5,-0.2 0.954 114.6 50.6 -67.3 -47.7 46.5 28.3 56.8 74 84 A L H X S+ 0 0 21 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.907 111.7 45.2 -55.7 -50.6 48.5 29.1 53.6 75 85 A S H X S+ 0 0 53 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.907 113.7 49.7 -64.0 -37.5 51.8 27.9 54.9 76 86 A W H X S+ 0 0 23 -4,-1.5 4,-1.8 1,-0.2 -1,-0.2 0.894 114.1 45.4 -69.0 -36.8 50.3 24.8 56.4 77 87 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.848 109.6 55.2 -72.2 -33.5 48.5 24.0 53.1 78 88 A K H X S+ 0 0 64 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.933 109.9 46.3 -66.4 -43.4 51.7 24.8 51.1 79 89 A Q H X S+ 0 0 107 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.866 110.1 54.7 -66.2 -37.0 53.6 22.2 53.1 80 90 A L H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 5,-0.3 0.956 108.0 48.0 -57.7 -51.6 50.8 19.7 52.7 81 91 A Q H X>S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.9 0.883 111.4 51.2 -57.1 -39.4 50.9 20.0 48.9 82 92 A I H X5S+ 0 0 47 -4,-1.8 4,-1.7 3,-0.2 -2,-0.2 0.971 112.7 46.1 -62.5 -53.4 54.7 19.6 48.9 83 93 A K H <5S+ 0 0 90 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.886 122.7 34.5 -49.8 -51.8 54.4 16.5 51.1 84 94 A L H <5S+ 0 0 23 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.818 137.9 12.0 -78.3 -33.8 51.6 14.9 49.0 85 95 A H H <5S- 0 0 9 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.604 72.3-153.8-122.5 -22.9 52.5 16.1 45.4 86 96 A N << - 0 0 103 -4,-1.7 -4,-0.2 -5,-0.9 -3,-0.1 0.891 25.4-148.7 35.3 64.1 56.0 17.5 45.4 87 97 A P > - 0 0 1 0, 0.0 3,-1.7 0, 0.0 4,-0.2 -0.327 13.5-138.7 -69.3 136.1 55.3 19.7 42.4 88 98 A P G > S+ 0 0 37 0, 0.0 3,-1.0 0, 0.0 153,-0.1 0.770 98.3 70.8 -55.4 -23.6 58.3 20.5 40.1 89 99 A T G > + 0 0 2 148,-0.3 3,-1.7 1,-0.2 10,-0.8 0.579 69.3 86.2 -81.8 -10.7 57.0 24.0 39.9 90 100 A I G < S+ 0 0 38 -3,-1.7 -1,-0.2 1,-0.3 8,-0.1 0.774 92.7 48.8 -64.8 -22.1 57.9 25.1 43.5 91 101 A H G < S+ 0 0 154 -3,-1.0 -1,-0.3 -4,-0.2 -2,-0.2 0.423 91.6 102.3 -96.5 -0.1 61.4 26.0 42.4 92 102 A Y S < S- 0 0 63 -3,-1.7 5,-0.1 5,-0.1 -3,-0.0 -0.488 77.8-103.6 -86.2 155.1 60.5 28.1 39.3 93 103 A P > - 0 0 75 0, 0.0 5,-1.2 0, 0.0 3,-0.4 -0.279 41.3-104.2 -60.2 160.5 60.4 31.9 39.0 94 104 A P T > 5S+ 0 0 52 0, 0.0 3,-2.1 0, 0.0 4,-0.4 0.918 118.1 55.1 -52.2 -53.9 56.8 33.5 39.1 95 105 A S T 3 5S+ 0 0 46 1,-0.3 -91,-0.3 2,-0.2 -3,-0.0 0.800 105.1 54.9 -54.1 -35.0 56.6 34.2 35.3 96 106 A Q T 3 5S- 0 0 100 -3,-0.4 -1,-0.3 -7,-0.1 -4,-0.1 0.124 132.1 -86.8 -89.5 19.4 57.3 30.5 34.5 97 107 A G T < 5 - 0 0 0 -3,-2.1 -2,-0.2 1,-0.2 3,-0.1 0.812 51.0-166.2 87.9 32.0 54.4 29.3 36.8 98 108 A Q < - 0 0 57 -5,-1.2 170,-2.8 -4,-0.4 -8,-0.2 -0.234 38.0 -97.7 -47.8 131.1 55.9 29.0 40.3 99 109 A M E +E 267 0C 16 -10,-0.8 2,-0.3 168,-0.2 -1,-0.1 -0.323 54.0 171.1 -55.5 127.7 53.4 27.0 42.4 100 110 A D E -E 266 0C 28 166,-2.5 166,-2.1 -3,-0.1 2,-0.3 -0.948 19.0-141.3-135.7 163.3 51.2 29.4 44.5 101 111 A L E -E 265 0C 2 -2,-0.3 2,-0.4 164,-0.2 164,-0.2 -0.939 10.2-170.5-129.5 152.2 48.1 28.8 46.6 102 112 A C E -E 264 0C 1 162,-2.3 162,-2.2 -2,-0.3 2,-0.4 -0.999 19.4-138.7-138.0 127.5 44.8 30.6 47.3 103 113 A V E -E 263 0C 0 -35,-2.6 160,-0.3 -2,-0.4 2,-0.3 -0.777 32.7-172.0 -85.1 135.5 42.3 29.7 50.0 104 114 A T E -E 262 0C 1 158,-2.3 158,-2.6 -2,-0.4 2,-1.7 -0.780 37.6 -97.9-125.3 166.0 38.8 30.0 48.5 105 115 A S S S- 0 0 9 -2,-0.3 156,-0.3 156,-0.2 4,-0.2 -0.576 102.4 -28.5 -83.0 73.9 35.2 29.9 49.8 106 116 A G S >> S- 0 0 0 -2,-1.7 4,-0.8 2,-0.1 3,-0.6 -0.008 81.2 -89.9 90.3 152.6 34.7 26.4 48.8 107 117 A S H 3> S+ 0 0 1 154,-0.3 4,-2.1 1,-0.2 5,-0.1 0.785 123.5 65.7 -64.9 -27.4 36.6 24.7 45.9 108 118 A Q H 3> S+ 0 0 8 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.806 92.9 58.2 -69.0 -24.2 33.8 25.8 43.6 109 119 A Q H <> S+ 0 0 2 -3,-0.6 4,-2.2 -4,-0.2 -1,-0.2 0.928 108.8 45.8 -67.5 -40.7 34.4 29.5 44.0 110 120 A G H X S+ 0 0 3 -4,-0.8 4,-2.6 2,-0.2 -2,-0.2 0.899 112.3 50.4 -69.9 -44.1 38.0 29.0 42.7 111 121 A L H X S+ 0 0 6 -4,-2.1 4,-2.6 1,-0.2 5,-0.2 0.954 111.0 49.5 -59.3 -50.2 36.8 26.8 39.9 112 122 A C H X S+ 0 0 2 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.889 111.3 48.3 -54.2 -44.6 34.2 29.4 38.9 113 123 A K H X S+ 0 0 22 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.873 111.2 52.5 -67.5 -34.7 36.9 32.3 39.0 114 124 A V H X S+ 0 0 7 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.929 110.2 45.9 -65.2 -47.1 39.2 30.1 36.9 115 125 A F H X S+ 0 0 2 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.893 115.9 47.3 -60.4 -43.0 36.6 29.4 34.2 116 126 A E H < S+ 0 0 34 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.846 109.9 52.6 -64.6 -41.0 35.7 33.1 34.1 117 127 A M H < S+ 0 0 10 -4,-2.2 -107,-3.0 -5,-0.2 -2,-0.2 0.840 121.3 33.3 -61.0 -34.1 39.4 34.2 34.0 118 128 A I H < S+ 0 0 0 -4,-1.6 2,-0.3 -109,-0.2 -2,-0.2 0.917 95.9 84.1 -93.4 -45.4 39.8 31.9 31.0 119 129 A I < + 0 0 9 -4,-2.7 -109,-0.1 -5,-0.2 25,-0.1 -0.479 39.5 178.1 -90.9 127.2 36.8 31.6 28.7 120 130 A N > - 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0 0 15 -3,-0.7 3,-0.1 1,-0.1 -1,-0.1 -0.994 52.4-160.0-136.5 126.8 49.5 71.5 47.6 770 364 B N S S+ 0 0 142 -2,-0.4 2,-0.4 1,-0.3 -1,-0.1 0.920 82.4 17.9 -73.8 -49.4 48.7 70.0 44.2 771 365 B D - 0 0 34 29,-0.2 4,-0.4 31,-0.1 -1,-0.3 -0.995 57.0-172.1-127.1 134.8 49.4 66.4 45.0 772 366 B V > + 0 0 0 29,-2.6 4,-1.5 -2,-0.4 5,-0.2 0.536 67.8 89.9-101.6 -6.1 49.6 65.0 48.4 773 367 B K H > S+ 0 0 80 28,-0.3 4,-2.5 1,-0.2 5,-0.4 0.890 88.5 50.4 -61.3 -45.9 50.9 61.5 47.6 774 368 B E H >>S+ 0 0 110 1,-0.2 4,-1.9 2,-0.2 5,-0.8 0.967 108.5 52.8 -47.0 -62.6 54.6 62.7 47.8 775 369 B L H 4>S+ 0 0 2 -4,-0.4 5,-2.0 1,-0.2 -2,-0.2 0.736 118.1 35.8 -47.7 -34.9 53.9 64.3 51.2 776 370 B I H <>S+ 0 0 5 -4,-1.5 5,-1.7 -3,-0.2 -1,-0.2 0.919 119.2 41.7 -90.1 -52.6 52.5 61.0 52.7 777 371 B E H <5S+ 0 0 121 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.1 0.940 129.7 26.2 -66.9 -48.1 54.4 58.1 51.2 778 372 B E T X5S+ 0 0 137 -4,-1.9 4,-1.3 -5,-0.4 -3,-0.2 0.985 134.2 22.5 -72.0 -74.6 57.8 59.8 51.4 779 373 B K H >4 -B 804 0K 13 0, 0.0 3,-0.6 0, 0.0 15,-0.3 -0.395 16.4-127.4 -71.0 151.8 46.0 59.9 49.6 790 384 B G G > S+ 0 0 0 13,-2.5 3,-2.2 1,-0.2 14,-0.1 0.584 84.4 95.9 -78.5 -13.4 42.8 60.5 47.7 791 385 B N G > S+ 0 0 6 1,-0.3 3,-1.4 12,-0.3 -1,-0.2 0.807 76.9 58.5 -45.4 -45.7 44.1 59.4 44.3 792 386 B A G < S+ 0 0 48 -3,-0.6 -1,-0.3 1,-0.3 -240,-0.1 0.507 94.1 68.4 -72.2 -3.0 42.7 55.8 44.5 793 387 B F G < S+ 0 0 2 -3,-2.2 -246,-2.7 3,-0.1 2,-0.3 0.311 91.6 73.7 -97.1 10.7 39.1 57.2 44.9 794 388 B Y S < S- 0 0 59 -3,-1.4 3,-0.2 -248,-0.2 -249,-0.0 -0.842 82.4-124.2-121.9 155.4 39.0 58.6 41.4 795 389 B V S S+ 0 0 76 -2,-0.3 2,-1.1 1,-0.3 -1,-0.1 0.950 114.0 46.6 -64.6 -47.5 38.6 56.9 38.0 796 390 B D S > S+ 0 0 91 1,-0.2 3,-0.7 -3,-0.1 -1,-0.3 -0.767 73.0 173.2 -94.0 96.1 41.7 58.6 36.8 797 391 B S T 3 + 0 0 50 -2,-1.1 -1,-0.2 -3,-0.2 -4,-0.1 0.425 69.6 68.6 -86.7 0.4 43.9 57.8 39.8 798 392 B S T 3 S+ 0 0 100 -3,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.701 77.3 100.8 -87.7 -26.5 47.0 59.2 38.2 799 393 B A S < S- 0 0 41 -3,-0.7 -5,-0.1 -8,-0.1 2,-0.0 -0.272 89.1 -95.4 -49.8 142.3 45.6 62.7 38.4 800 394 B P - 0 0 90 0, 0.0 -29,-0.2 0, 0.0 -1,-0.1 -0.309 40.9-157.7 -57.0 146.1 47.1 64.8 41.3 801 395 B S - 0 0 4 1,-0.1 -29,-2.6 -3,-0.1 -28,-0.3 -0.958 25.2-172.4-136.9 124.1 45.1 64.8 44.5 802 396 B P + 0 0 30 0, 0.0 -36,-2.8 0, 0.0 2,-0.3 0.451 65.7 94.7 -80.7 -0.9 45.1 67.3 47.4 803 397 B Y E -A 765 0K 55 -38,-0.2 -13,-2.5 -40,-0.0 2,-0.3 -0.625 49.9-171.4 -97.0 151.5 42.9 65.1 49.5 804 398 B L E -AB 764 789K 0 -40,-2.4 -40,-3.0 -2,-0.3 2,-0.5 -0.999 18.9-135.8-135.2 146.2 43.5 62.5 52.2 805 399 B R E -AB 763 788K 15 -17,-2.7 -17,-1.5 -2,-0.3 2,-0.5 -0.845 20.0-166.6 -97.9 121.7 41.2 60.0 53.9 806 400 B A E -A 762 0K 0 -44,-3.7 -44,-3.1 -2,-0.5 2,-0.4 -0.945 11.7-141.9-111.2 126.2 41.7 59.8 57.7 807 401 B S E -A 761 0K 8 -781,-3.0 4,-0.3 -2,-0.5 -46,-0.2 -0.754 18.2-179.3 -87.3 134.7 40.1 56.9 59.6 808 402 B F + 0 0 0 -48,-2.3 -47,-0.1 -2,-0.4 -1,-0.1 0.214 55.6 99.2-110.6 16.8 38.7 57.5 63.0 809 403 B S S S+ 0 0 2 -49,-0.5 -1,-0.1 -779,-0.2 -777,-0.1 0.786 99.9 8.9 -72.1 -25.6 37.5 53.9 63.8 810 404 B S S S+ 0 0 73 -3,-0.1 -1,-0.1 2,-0.1 -2,-0.1 0.727 90.7 107.2-128.4 -42.8 40.4 53.0 66.0 811 405 B A - 0 0 11 -4,-0.3 -72,-0.1 -786,-0.1 -787,-0.0 -0.122 59.7-128.8 -53.1 145.0 43.0 55.7 66.9 812 406 B S > - 0 0 36 1,-0.1 4,-1.8 -74,-0.0 5,-0.2 -0.477 29.1-104.1 -80.1 158.6 43.1 57.1 70.5 813 407 B P H > S+ 0 0 83 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.852 123.1 55.8 -46.7 -43.5 42.9 60.9 71.1 814 408 B E H > S+ 0 0 166 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.939 110.4 45.0 -52.5 -50.9 46.8 60.8 71.9 815 409 B Q H > S+ 0 0 75 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.770 112.1 50.2 -69.0 -33.7 47.4 59.2 68.4 816 410 B M H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 5,-0.2 0.911 110.4 51.0 -66.2 -47.1 45.1 61.6 66.6 817 411 B D H X S+ 0 0 59 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.965 114.4 43.6 -55.2 -53.2 46.8 64.6 68.3 818 412 B V H X S+ 0 0 63 -4,-2.6 4,-1.9 1,-0.2 5,-0.2 0.913 112.2 53.1 -57.3 -47.2 50.3 63.2 67.2 819 413 B A H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.915 111.6 44.8 -57.6 -43.9 49.1 62.4 63.6 820 414 B F H X S+ 0 0 0 -4,-2.4 4,-3.1 2,-0.2 -1,-0.2 0.827 107.7 56.2 -76.2 -32.9 47.7 65.9 63.0 821 415 B Q H X S+ 0 0 75 -4,-1.9 4,-3.0 -5,-0.2 -1,-0.2 0.927 112.0 45.6 -55.1 -48.1 50.8 67.8 64.4 822 416 B V H X S+ 0 0 18 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.921 113.2 47.8 -62.5 -45.7 52.9 65.8 61.9 823 417 B L H X S+ 0 0 7 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.941 113.6 49.2 -61.6 -45.6 50.4 66.5 59.1 824 418 B A H X S+ 0 0 3 -4,-3.1 4,-2.2 2,-0.2 -2,-0.2 0.937 110.7 50.2 -54.0 -51.7 50.4 70.2 60.1 825 419 B Q H X S+ 0 0 90 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.945 114.9 44.3 -51.0 -50.9 54.3 70.3 60.2 826 420 B L H X S+ 0 0 3 -4,-2.9 4,-1.1 2,-0.2 -2,-0.2 0.823 108.3 55.3 -70.3 -35.7 54.4 68.7 56.7 827 421 B I H >< S+ 0 0 4 -4,-2.7 3,-0.7 -5,-0.2 4,-0.4 0.975 112.6 43.8 -59.4 -51.5 51.7 70.9 55.1 828 422 B K H >< S+ 0 0 118 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.918 112.1 51.5 -61.2 -46.1 53.6 74.0 56.1 829 423 B E H 3< S+ 0 0 105 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.662 108.1 53.1 -64.1 -20.6 57.0 72.6 55.1 830 424 B S T << 0 0 42 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.422 360.0 360.0-100.0 -1.0 55.6 71.7 51.7 831 425 B L < 0 0 168 -3,-1.4 -1,-0.2 -4,-0.4 -62,-0.1 -0.573 360.0 360.0 86.1 360.0 54.4 75.3 51.4