==== 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 OXIDOREDUCTASE 08-SEP-00 1FS7 . COMPND 2 MOLECULE: CYTOCHROME C NITRITE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: WOLINELLA SUCCINOGENES; . AUTHOR O.EINSLE,P.STACH,A.MESSERSCHMIDT,J.SIMON,A.KROEGER,R.HUBER, . 471 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22055.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 324 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 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 . 25 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 178 37.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 6 2 0 3 1 2 2 0 1 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 0 1 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 5 1 0 1 0 0 0 1 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 . 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 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 37 A K 0 0 232 0, 0.0 139,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 165.7 35.1 66.7 49.3 2 38 A T > - 0 0 33 137,-0.4 3,-0.6 1,-0.0 138,-0.0 -0.231 360.0-105.6 -93.1-174.2 35.9 63.4 47.7 3 39 A A T 3 S+ 0 0 80 1,-0.2 137,-0.1 -2,-0.1 3,-0.1 0.267 121.3 45.0 -95.5 9.4 38.7 60.9 48.3 4 40 A H T > + 0 0 6 135,-0.3 3,-2.7 4,-0.0 -1,-0.2 -0.167 67.0 147.4-143.4 39.5 40.3 61.9 45.1 5 41 A S T < S+ 0 0 38 -3,-0.6 3,-0.1 1,-0.3 -2,-0.1 0.626 72.1 55.5 -54.9 -18.0 40.0 65.7 45.3 6 42 A Q T 3 S- 0 0 164 1,-0.4 -1,-0.3 132,-0.1 2,-0.2 0.434 119.9 -97.6 -96.9 0.2 43.2 66.2 43.4 7 43 A G < - 0 0 20 -3,-2.7 2,-0.5 131,-0.3 -1,-0.4 -0.452 37.9 -78.8 110.3 174.5 42.1 64.2 40.4 8 44 A I > - 0 0 12 -2,-0.2 3,-1.5 -3,-0.1 2,-0.3 -0.970 31.5-130.9-123.5 123.8 42.5 60.6 39.2 9 45 A E T 3 S+ 0 0 181 -2,-0.5 -2,-0.0 1,-0.3 0, 0.0 -0.545 100.3 13.8 -68.9 127.6 45.6 59.3 37.5 10 46 A G T > S+ 0 0 31 -2,-0.3 3,-2.7 2,-0.1 6,-0.3 0.771 80.8 166.0 75.7 26.0 44.5 57.4 34.4 11 47 A K T < + 0 0 60 -3,-1.5 122,-0.4 1,-0.3 -2,-0.1 0.724 64.4 67.3 -45.4 -32.5 41.0 58.9 34.7 12 48 A A T 3 S+ 0 0 4 -4,-0.1 2,-0.9 1,-0.1 -1,-0.3 0.713 87.3 76.3 -66.7 -19.6 40.0 57.8 31.1 13 49 A M S X S- 0 0 31 -3,-2.7 3,-2.8 1,-0.2 4,-0.2 -0.840 75.4-152.9 -96.1 108.0 40.1 54.2 32.3 14 50 A S G >> S+ 0 0 2 -2,-0.9 3,-2.3 1,-0.3 4,-0.6 0.765 90.0 71.7 -50.7 -30.4 37.0 53.6 34.3 15 51 A E G >4 S+ 0 0 45 1,-0.3 3,-0.7 2,-0.2 4,-0.3 0.752 86.4 67.4 -60.1 -20.9 38.7 50.9 36.2 16 52 A E G <4 S+ 0 0 81 -3,-2.8 -1,-0.3 -6,-0.3 -2,-0.2 0.610 97.1 53.6 -73.3 -12.7 40.7 53.6 37.9 17 53 A W G X> S+ 0 0 8 -3,-2.3 4,-2.3 -4,-0.2 3,-1.4 0.600 85.1 85.9 -95.6 -14.8 37.5 54.8 39.6 18 54 A A T << S+ 0 0 26 -3,-0.7 -2,-0.1 -4,-0.6 -1,-0.1 0.775 79.0 62.6 -58.8 -31.1 36.6 51.4 41.1 19 55 A R T 34 S+ 0 0 200 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.763 115.1 33.4 -68.7 -21.3 38.7 52.0 44.2 20 56 A Y T <4 S+ 0 0 74 -3,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.781 133.4 24.7-100.5 -35.6 36.5 54.9 45.2 21 57 A Y X + 0 0 67 -4,-2.3 4,-2.0 1,-0.1 5,-0.2 -0.575 62.9 159.3-132.2 69.9 33.1 53.8 43.8 22 58 A P H > S+ 0 0 89 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.828 75.8 55.7 -62.0 -31.7 33.0 50.0 43.6 23 59 A R H > S+ 0 0 92 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.954 111.3 40.6 -66.5 -51.7 29.2 49.9 43.6 24 60 A Q H > S+ 0 0 46 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.834 114.5 54.2 -66.8 -32.8 28.7 52.2 40.6 25 61 A F H X S+ 0 0 36 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.925 106.9 52.1 -66.1 -43.7 31.6 50.5 38.8 26 62 A D H X S+ 0 0 84 -4,-2.1 4,-0.7 1,-0.2 -2,-0.2 0.912 114.9 39.3 -59.3 -46.6 30.0 47.1 39.3 27 63 A S H < S+ 0 0 15 -4,-1.9 3,-0.5 2,-0.2 -1,-0.2 0.867 112.4 57.7 -73.4 -35.0 26.7 48.1 37.8 28 64 A W H >< S+ 0 0 41 -4,-2.3 3,-1.3 1,-0.2 -2,-0.2 0.903 104.5 52.2 -58.8 -43.2 28.3 50.2 35.1 29 65 A K H >< S+ 0 0 71 -4,-2.3 3,-1.5 1,-0.3 -1,-0.2 0.757 92.7 77.5 -66.3 -24.8 30.2 47.1 33.9 30 66 A K G >< + 0 0 84 -4,-0.7 3,-2.1 -3,-0.5 -1,-0.3 0.518 64.8 86.3 -67.2 -5.8 26.9 45.2 33.7 31 67 A T G X S+ 0 0 2 -3,-1.3 3,-1.4 1,-0.3 -1,-0.3 0.634 71.1 82.6 -69.7 -5.7 25.9 46.8 30.4 32 68 A K G < S+ 0 0 68 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.777 77.9 69.0 -62.9 -25.4 28.0 43.9 29.1 33 69 A E G < S+ 0 0 122 -3,-2.1 2,-1.4 1,-0.2 -1,-0.3 0.740 83.3 71.8 -66.1 -26.1 24.8 41.9 29.6 34 70 A S < + 0 0 38 -3,-1.4 31,-2.4 -4,-0.2 -1,-0.2 -0.674 58.3 138.8 -92.6 81.2 23.0 43.8 26.8 35 71 A D + 0 0 28 -2,-1.4 -1,-0.2 29,-0.2 436,-0.1 0.336 20.5 131.8-107.9 5.2 25.0 42.1 23.9 36 72 A N - 0 0 102 -3,-0.2 2,-0.6 1,-0.1 29,-0.1 -0.343 42.8-154.0 -63.6 134.7 22.2 41.5 21.4 37 73 A I - 0 0 28 426,-0.1 2,-0.7 -2,-0.1 426,-0.1 -0.938 9.8-171.6-111.8 109.1 22.9 42.7 17.9 38 74 A T - 0 0 44 -2,-0.6 24,-2.4 24,-0.3 2,-1.0 -0.916 18.1-142.2-103.9 114.9 19.7 43.5 16.0 39 75 A D B >> -A 61 0A 14 -2,-0.7 4,-2.0 22,-0.2 3,-0.6 -0.673 14.4-169.6 -77.2 102.8 20.5 44.1 12.3 40 76 A M H 3> S+ 0 0 25 20,-1.3 4,-2.9 -2,-1.0 7,-0.2 0.755 84.6 58.0 -67.8 -24.6 18.1 46.9 11.4 41 77 A L H 34 S+ 0 0 0 19,-0.9 -1,-0.2 2,-0.2 7,-0.2 0.788 109.7 45.9 -74.3 -26.5 18.7 46.6 7.7 42 78 A K H <4 S+ 0 0 118 -3,-0.6 370,-0.2 2,-0.1 -2,-0.2 0.872 117.5 42.7 -79.9 -40.2 17.6 43.0 8.0 43 79 A E H < S+ 0 0 122 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.2 0.896 131.8 23.2 -71.2 -42.4 14.5 43.9 10.1 44 80 A K >< + 0 0 29 -4,-2.9 3,-2.0 -5,-0.2 4,-0.3 -0.687 66.0 172.9-128.2 77.5 13.7 47.0 7.9 45 81 A P T >> S+ 0 0 15 0, 0.0 3,-1.2 0, 0.0 4,-1.0 0.700 72.8 76.0 -59.1 -19.3 15.2 46.5 4.4 46 82 A A H 3> S+ 0 0 19 1,-0.3 4,-2.1 2,-0.2 3,-0.2 0.831 85.6 65.5 -61.1 -29.0 13.3 49.7 3.2 47 83 A L H <> S+ 0 0 1 -3,-2.0 4,-2.2 -7,-0.2 -1,-0.3 0.809 92.8 60.1 -62.5 -31.1 16.0 51.5 5.2 48 84 A V H <4 S+ 0 0 0 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.934 107.3 44.5 -62.5 -46.1 18.7 50.2 2.7 49 85 A V H >< S+ 0 0 0 -4,-1.0 3,-1.3 1,-0.2 -2,-0.2 0.910 111.4 54.2 -64.7 -41.2 16.9 51.9 -0.2 50 86 A A H 3< S+ 0 0 0 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.890 115.3 39.8 -59.6 -39.1 16.4 55.1 1.9 51 87 A W T >< S+ 0 0 1 -4,-2.2 3,-2.0 -5,-0.1 6,-0.5 0.179 80.1 147.4 -99.9 19.5 20.2 55.2 2.6 52 88 A A T < S+ 0 0 0 -3,-1.3 178,-2.2 1,-0.3 179,-0.3 -0.283 72.1 24.1 -55.5 133.6 21.4 54.2 -0.9 53 89 A G T 3 S+ 0 0 53 366,-0.4 -1,-0.3 1,-0.3 175,-0.2 0.491 111.1 91.7 87.1 4.6 24.7 55.9 -1.6 54 90 A Y S X S- 0 0 40 -3,-2.0 3,-2.3 173,-0.1 -1,-0.3 -0.936 87.6-110.8-130.9 151.9 25.4 56.3 2.1 55 91 A P G >> S+ 0 0 32 0, 0.0 3,-2.1 0, 0.0 4,-1.2 0.776 110.4 69.5 -52.9 -30.6 27.3 54.1 4.7 56 92 A F G 34 S+ 0 0 18 1,-0.3 -5,-0.1 2,-0.2 -4,-0.1 0.641 86.4 67.9 -65.1 -12.8 24.1 53.2 6.6 57 93 A S G <4 S+ 0 0 5 -3,-2.3 -1,-0.3 -6,-0.5 3,-0.1 0.604 103.6 46.8 -80.5 -8.6 23.0 51.1 3.5 58 94 A K T <4 S- 0 0 26 -3,-2.1 2,-0.3 1,-0.3 -2,-0.2 0.843 127.7 -2.5 -96.4 -44.5 25.9 48.8 4.5 59 95 A D < + 0 0 1 -4,-1.2 -1,-0.3 17,-0.1 2,-0.3 -0.943 60.7 153.4-157.4 127.8 25.5 48.3 8.2 60 96 A Y + 0 0 26 -2,-0.3 -20,-1.3 -3,-0.1 -19,-0.9 -0.836 15.0 176.0-158.0 114.9 23.1 49.7 10.8 61 97 A N B -A 39 0A 34 -2,-0.3 -22,-0.2 -22,-0.2 3,-0.1 -0.797 34.9 -96.1-120.4 164.0 22.2 47.9 14.0 62 98 A A - 0 0 23 -24,-2.4 -24,-0.3 -2,-0.3 -1,-0.1 -0.314 54.2 -87.2 -72.3 160.3 20.0 48.7 17.0 63 99 A P + 0 0 95 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.345 49.4 176.8 -69.0 148.1 21.8 50.1 20.1 64 100 A R - 0 0 30 1,-0.2 -29,-0.2 -3,-0.1 -32,-0.1 -0.704 42.9 -30.2-134.4-169.0 23.1 47.7 22.7 65 101 A G > - 0 0 5 -31,-2.4 3,-2.3 -34,-0.3 4,-0.3 -0.035 49.6-122.9 -50.9 145.6 25.1 48.1 26.0 66 102 A H G > S+ 0 0 49 213,-0.4 3,-1.7 1,-0.3 4,-0.4 0.801 109.1 74.5 -54.7 -30.7 27.5 51.0 26.6 67 103 A Y G 3 S+ 0 0 15 1,-0.3 -1,-0.3 -39,-0.1 4,-0.3 0.757 100.9 42.1 -53.3 -28.0 30.1 48.2 27.2 68 104 A Y G <> S+ 0 0 0 -3,-2.3 4,-2.8 -34,-0.2 5,-0.3 0.395 82.8 102.3-103.0 0.9 30.1 47.7 23.4 69 105 A A H <> S+ 0 0 19 -3,-1.7 4,-1.7 -4,-0.3 5,-0.1 0.917 86.0 41.4 -52.3 -53.6 30.1 51.3 22.1 70 106 A L H > S+ 0 0 9 -4,-0.4 4,-1.7 28,-0.3 -1,-0.2 0.933 117.4 47.4 -62.7 -46.6 33.8 51.5 21.2 71 107 A Q H > S+ 0 0 6 -4,-0.3 4,-2.9 1,-0.2 -1,-0.2 0.856 110.5 51.5 -66.4 -34.8 33.9 48.0 19.7 72 108 A D H X S+ 0 0 41 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.854 105.6 56.2 -70.3 -31.0 30.8 48.5 17.7 73 109 A N H < S+ 0 0 14 -4,-1.7 6,-0.2 -5,-0.3 -2,-0.2 0.915 113.7 41.4 -62.7 -42.7 32.3 51.8 16.3 74 110 A I H < S+ 0 0 4 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.894 117.3 47.2 -71.2 -42.5 35.2 49.6 15.2 75 111 A N H < S+ 0 0 3 -4,-2.9 -2,-0.2 -5,-0.1 -3,-0.2 0.830 83.2 104.2 -72.3 -36.2 33.1 46.7 13.9 76 112 A T S >< S- 0 0 13 -4,-2.6 3,-1.4 1,-0.2 4,-0.3 -0.180 73.0-132.9 -52.2 137.3 30.5 48.5 11.9 77 113 A L G > S+ 0 0 2 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 0.738 99.9 78.6 -63.1 -18.9 31.1 48.3 8.1 78 114 A R G 3 S+ 0 0 61 1,-0.3 -1,-0.3 -19,-0.1 -2,-0.1 0.839 89.5 51.9 -60.7 -32.0 30.5 52.1 8.1 79 115 A T G < S- 0 0 3 -3,-1.4 11,-0.3 -6,-0.2 -1,-0.3 0.540 98.2-162.3 -83.0 -4.1 34.0 52.8 9.4 80 116 A G < - 0 0 6 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.1 -0.139 31.8 -54.9 63.6-152.4 35.5 50.6 6.6 81 117 A A - 0 0 16 352,-0.1 7,-0.2 -4,-0.0 -1,-0.2 -0.668 51.8-172.0-133.3 79.4 38.9 49.1 6.5 82 118 A P - 0 0 3 0, 0.0 355,-0.2 0, 0.0 3,-0.1 -0.292 14.1-158.3 -66.7 156.5 41.7 51.7 6.9 83 119 A V S S- 0 0 107 1,-0.2 2,-0.3 354,-0.1 5,-0.0 0.483 74.9 -5.2-110.9 -10.6 45.3 50.4 6.4 84 120 A D S > S- 0 0 71 0, 0.0 3,-1.0 0, 0.0 -1,-0.2 -0.887 92.7 -72.8-161.5-171.4 46.9 53.2 8.4 85 121 A G T 3 S+ 0 0 31 -2,-0.3 33,-0.6 1,-0.2 36,-0.2 0.468 124.7 53.3 -78.4 0.2 46.1 56.5 10.2 86 122 A K T 3 S+ 0 0 176 34,-0.1 -1,-0.2 31,-0.1 2,-0.2 0.331 101.3 68.0-114.0 3.5 45.5 58.4 6.9 87 123 A T < + 0 0 47 -3,-1.0 33,-0.6 31,-0.1 34,-0.1 -0.675 54.0 82.0-120.0 175.3 43.0 56.0 5.3 88 124 A G S S- 0 0 20 -2,-0.2 -8,-0.1 -7,-0.2 -9,-0.1 -0.109 74.6 -95.7 108.5 150.9 39.4 54.9 5.8 89 125 A P S S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 -9,-0.1 0.806 95.5 64.5 -71.5 -33.0 36.1 56.5 4.8 90 126 A L S S- 0 0 37 -11,-0.3 29,-2.8 1,-0.1 30,-0.4 -0.599 74.8-118.4-102.2 158.8 35.2 58.3 8.0 91 127 A P B > -B 118 0B 22 0, 0.0 3,-1.9 0, 0.0 27,-0.3 -0.285 34.1 -98.4 -85.5 169.5 36.7 61.2 10.1 92 128 A S G > S+ 0 0 0 25,-2.1 3,-2.1 1,-0.3 4,-0.5 0.759 111.4 78.5 -57.7 -28.2 38.0 61.4 13.6 93 129 A A G > S+ 0 0 4 24,-0.3 3,-0.7 1,-0.3 4,-0.3 0.692 74.7 78.0 -58.1 -17.3 34.7 62.8 14.8 94 130 A C G < S+ 0 0 22 -3,-1.9 -1,-0.3 1,-0.2 3,-0.2 0.672 89.0 55.6 -68.7 -13.1 33.3 59.3 14.8 95 131 A W G X> S+ 0 0 0 -3,-2.1 3,-2.3 1,-0.2 4,-0.7 0.749 81.6 96.7 -84.8 -27.4 35.0 58.5 18.1 96 132 A T T <4 S+ 0 0 4 -3,-0.7 3,-0.3 -4,-0.5 -1,-0.2 0.694 89.7 31.3 -31.7 -51.5 33.5 61.5 19.9 97 133 A C T 34 S+ 0 0 29 -4,-0.3 -1,-0.3 -3,-0.2 33,-0.1 -0.060 111.3 66.8-107.2 34.5 30.5 59.8 21.6 98 134 A K T <4 S+ 0 0 58 -3,-2.3 32,-0.8 1,-0.2 -28,-0.3 0.513 96.6 34.0-127.2 -11.3 32.1 56.4 22.1 99 135 A S >< - 0 0 0 -4,-0.7 3,-1.2 -3,-0.3 -1,-0.2 -0.998 56.7-135.5-154.3 149.2 34.9 56.8 24.6 100 136 A P T 3> S+ 0 0 0 0, 0.0 4,-1.0 0, 0.0 29,-0.1 0.590 103.4 75.7 -77.1 -7.3 36.2 58.7 27.7 101 137 A D H 3> S+ 0 0 2 27,-0.4 4,-2.3 1,-0.2 5,-0.2 0.676 81.6 71.4 -74.1 -17.1 39.5 59.0 25.8 102 138 A V H <> S+ 0 0 0 -3,-1.2 4,-2.8 2,-0.2 5,-0.2 0.970 99.6 41.0 -65.2 -55.3 37.8 61.7 23.7 103 139 A P H > S+ 0 0 2 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.873 113.1 58.3 -62.3 -29.8 37.7 64.4 26.4 104 140 A R H < S+ 0 0 23 -4,-1.0 4,-0.4 1,-0.2 -2,-0.2 0.937 111.4 39.7 -61.1 -47.1 41.2 63.2 27.3 105 141 A I H >X S+ 0 0 2 -4,-2.3 4,-3.3 2,-0.2 3,-0.7 0.879 114.9 51.9 -71.2 -39.1 42.5 63.9 23.8 106 142 A I H 3X S+ 0 0 18 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.940 108.9 50.4 -62.5 -46.1 40.5 67.1 23.4 107 143 A E H 3< S+ 0 0 105 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.602 119.2 40.6 -67.1 -11.1 41.9 68.5 26.7 108 144 A Q H <4 S+ 0 0 115 -3,-0.7 -2,-0.2 -4,-0.4 -1,-0.2 0.826 130.0 18.8-104.2 -46.6 45.4 67.6 25.5 109 145 A D H < S- 0 0 75 -4,-3.3 4,-0.4 1,-0.2 -3,-0.2 0.419 109.1-105.9-109.1 0.1 45.5 68.6 21.8 110 146 A G X - 0 0 33 -4,-2.1 4,-2.0 -5,-0.4 -1,-0.2 0.107 30.5 -85.6 90.1 152.9 42.6 71.0 21.5 111 147 A E H > S+ 0 0 40 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.928 123.6 49.4 -60.2 -51.5 39.1 70.6 20.0 112 148 A L H 4 S+ 0 0 63 1,-0.2 -1,-0.2 2,-0.2 88,-0.2 0.893 111.3 49.0 -58.8 -43.0 40.1 71.5 16.4 113 149 A E H >4 S+ 0 0 40 -4,-0.4 3,-1.6 1,-0.2 -1,-0.2 0.917 109.7 52.5 -63.9 -43.0 43.1 69.1 16.3 114 150 A Y H 3< S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.911 109.5 49.5 -58.0 -43.6 40.9 66.3 17.6 115 151 A F T 3< S+ 0 0 1 -4,-2.2 85,-2.7 -5,-0.1 2,-0.5 0.322 95.7 93.5 -79.6 8.5 38.4 66.9 14.9 116 152 A T B < S+C 199 0C 18 -3,-1.6 83,-0.2 83,-0.2 2,-0.2 -0.886 76.1 13.0-107.2 130.5 41.1 66.9 12.2 117 153 A G S S- 0 0 39 81,-0.5 -25,-2.1 -2,-0.5 -24,-0.3 -0.510 91.8 -37.3 109.5-176.6 42.0 63.8 10.3 118 154 A K B > -B 91 0B 74 -33,-0.6 3,-1.3 -27,-0.3 4,-0.4 -0.403 49.3-113.9 -85.0 161.8 40.7 60.3 9.7 119 155 A W G > S+ 0 0 2 -29,-2.8 3,-1.5 1,-0.3 4,-0.1 0.924 118.5 61.4 -58.0 -43.2 38.9 58.0 12.2 120 156 A A G > S+ 0 0 4 -33,-0.6 3,-1.3 -30,-0.4 -1,-0.3 0.666 82.6 84.1 -59.3 -17.5 42.0 55.7 11.9 121 157 A K G < S+ 0 0 62 -3,-1.3 -1,-0.3 1,-0.3 3,-0.2 0.839 99.0 33.4 -55.5 -37.6 44.1 58.6 13.3 122 158 A Y G X> S+ 0 0 13 -3,-1.5 4,-2.7 -4,-0.4 3,-2.4 0.184 78.2 124.1-107.8 17.1 43.3 57.7 16.9 123 159 A G T <4 S+ 0 0 3 -3,-1.3 -1,-0.2 1,-0.3 -2,-0.1 0.780 82.0 37.8 -47.2 -36.3 43.0 53.9 16.6 124 160 A D T 34 S+ 0 0 41 -3,-0.2 -1,-0.3 -4,-0.2 3,-0.1 0.262 120.4 46.4-103.7 14.4 45.6 53.2 19.3 125 161 A E T <4 S+ 0 0 39 -3,-2.4 2,-1.2 1,-0.2 3,-0.2 0.675 101.1 59.8-117.9 -41.7 44.6 56.1 21.6 126 162 A I < + 0 0 1 -4,-2.7 -1,-0.2 1,-0.2 325,-0.1 -0.766 65.3 128.5 -96.1 93.1 40.8 56.0 21.8 127 163 A V + 0 0 15 -2,-1.2 2,-0.3 323,-0.2 -1,-0.2 0.390 39.5 86.9-128.9 -0.9 40.4 52.5 23.3 128 164 A N - 0 0 5 -3,-0.2 -27,-0.4 323,-0.1 3,-0.1 -0.823 68.0-132.1-103.6 144.9 38.1 52.8 26.3 129 165 A T - 0 0 25 -2,-0.3 -115,-0.2 1,-0.2 -30,-0.2 -0.466 57.5 -38.4 -93.1 168.6 34.3 52.6 26.0 130 166 A I S S+ 0 0 24 -32,-0.8 -1,-0.2 -64,-0.4 2,-0.2 0.147 84.2 174.4 -23.5 108.7 31.7 54.9 27.6 131 167 A G >> - 0 0 5 -3,-0.1 3,-2.2 1,-0.0 4,-0.6 -0.673 49.0 -88.6-127.7 179.7 33.2 55.6 31.0 132 168 A C H >> S+ 0 0 21 1,-0.3 4,-2.2 -2,-0.2 3,-1.5 0.862 120.5 59.4 -49.2 -43.0 33.0 57.4 34.3 133 169 A Y H 34 S+ 0 0 7 -122,-0.4 -1,-0.3 1,-0.3 5,-0.1 0.631 92.6 66.4 -66.2 -15.8 35.0 60.3 32.8 134 170 A N H <4 S+ 0 0 12 -3,-2.2 12,-0.5 1,-0.1 -1,-0.3 0.743 120.9 17.9 -76.8 -20.4 32.4 60.9 30.1 135 171 A C H << S+ 0 0 37 -3,-1.5 9,-1.9 -4,-0.6 2,-0.3 0.559 116.9 63.5-125.7 -13.3 29.9 62.0 32.7 136 172 A H B < S-E 143 0D 42 -4,-2.2 2,-0.4 7,-0.2 7,-0.2 -0.895 72.0-121.2-123.2 150.9 31.8 62.9 35.9 137 173 A D > - 0 0 30 5,-2.3 4,-1.9 -2,-0.3 -130,-0.1 -0.687 25.1-139.0 -80.5 132.4 34.5 65.4 37.1 138 174 A D T 4 S+ 0 0 16 -2,-0.4 -131,-0.3 1,-0.2 -1,-0.1 0.425 98.1 43.4 -78.1 5.0 37.5 63.4 38.3 139 175 A K T 4 S+ 0 0 115 -133,-0.1 -137,-0.4 -132,-0.1 -135,-0.3 0.742 131.1 16.7-111.6 -45.1 38.0 65.7 41.3 140 176 A S T 4 S- 0 0 48 2,-0.1 -2,-0.2 -139,-0.1 3,-0.1 0.572 88.2-133.6-105.0 -13.9 34.4 66.3 42.6 141 177 A A < + 0 0 24 -4,-1.9 -3,-0.1 1,-0.2 3,-0.1 0.566 57.0 147.6 69.3 8.5 32.7 63.4 40.9 142 178 A E - 0 0 88 1,-0.1 -5,-2.3 -6,-0.1 -1,-0.2 -0.347 58.8 -91.1 -72.7 156.0 30.0 65.9 40.0 143 179 A L B +E 136 0D 32 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.428 56.0 168.8 -67.6 141.1 28.1 65.6 36.7 144 180 A K - 0 0 71 -9,-1.9 2,-0.5 -2,-0.1 19,-0.0 -0.992 38.0-124.8-155.7 147.6 29.7 67.4 33.8 145 181 A S - 0 0 26 -2,-0.3 -10,-0.1 1,-0.1 29,-0.1 -0.836 20.3-170.5 -91.8 127.2 29.5 67.7 30.0 146 182 A K + 0 0 23 -2,-0.5 -1,-0.1 -12,-0.5 -11,-0.1 0.401 62.7 79.4 -99.5 2.0 32.9 67.0 28.6 147 183 A V >> - 0 0 9 -13,-0.1 3,-1.4 1,-0.1 4,-0.6 -0.944 64.6-153.0-117.5 120.5 32.1 68.1 25.0 148 184 A P H 3> S+ 0 0 51 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.732 88.5 71.2 -58.9 -26.3 31.9 71.8 24.0 149 185 A Y H 3> S+ 0 0 7 1,-0.2 4,-2.0 2,-0.2 55,-0.4 0.751 89.8 61.7 -67.3 -21.4 29.4 71.3 21.2 150 186 A L H <> S+ 0 0 0 -3,-1.4 4,-3.2 2,-0.2 -1,-0.2 0.968 106.3 41.4 -69.7 -52.3 26.6 70.6 23.7 151 187 A D H X S+ 0 0 51 -4,-0.6 4,-3.0 1,-0.2 5,-0.3 0.891 113.1 57.0 -60.6 -36.7 26.6 74.0 25.4 152 188 A R H X S+ 0 0 125 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.929 112.2 41.1 -58.3 -46.5 27.1 75.6 22.0 153 189 A G H X S+ 0 0 3 -4,-2.0 4,-1.6 2,-0.2 6,-0.2 0.925 113.2 53.1 -68.4 -45.6 23.9 73.9 20.8 154 190 A L H <>S+ 0 0 2 -4,-3.2 5,-3.0 1,-0.2 3,-0.4 0.932 111.9 44.8 -55.2 -50.1 22.0 74.6 24.0 155 191 A S H ><5S+ 0 0 64 -4,-3.0 3,-2.4 1,-0.2 -1,-0.2 0.942 109.0 56.7 -60.3 -48.4 22.7 78.3 23.9 156 192 A A H 3<5S+ 0 0 50 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.799 109.4 46.9 -53.3 -32.3 21.9 78.4 20.2 157 193 A A T 3<5S- 0 0 26 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.354 122.5-104.8 -93.3 4.3 18.5 77.0 21.0 158 194 A G T < 5S+ 0 0 73 -3,-2.4 -3,-0.2 1,-0.3 2,-0.2 0.611 77.9 133.4 84.2 10.9 17.9 79.4 23.9 159 195 A F < - 0 0 72 -5,-3.0 -1,-0.3 -6,-0.2 2,-0.1 -0.508 63.0 -99.8 -89.3 162.6 18.5 76.8 26.6 160 196 A K - 0 0 91 -2,-0.2 -1,-0.1 1,-0.1 5,-0.1 -0.477 43.3-106.1 -77.7 153.7 20.7 77.3 29.6 161 197 A T > - 0 0 26 -2,-0.1 4,-0.9 1,-0.1 3,-0.5 -0.231 36.1 -97.9 -72.6 170.9 24.2 75.9 29.4 162 198 A F T >4 S+ 0 0 10 1,-0.2 3,-1.0 2,-0.2 -1,-0.1 0.919 125.2 49.6 -57.3 -46.4 25.1 72.8 31.4 163 199 A A T 34 S+ 0 0 81 1,-0.2 -1,-0.2 -18,-0.1 7,-0.0 0.762 111.5 50.0 -65.6 -25.1 26.6 74.8 34.2 164 200 A E T 34 S+ 0 0 124 -3,-0.5 -1,-0.2 2,-0.0 -2,-0.2 0.553 95.5 96.2 -89.5 -9.3 23.6 77.0 34.4 165 201 A S S << S- 0 0 14 -3,-1.0 -4,-0.0 -4,-0.9 2,-0.0 -0.335 78.9-104.0 -81.7 162.7 21.1 74.1 34.5 166 202 A T > - 0 0 71 1,-0.1 4,-2.0 -2,-0.1 5,-0.1 -0.276 34.9-104.7 -77.3 169.2 19.5 72.5 37.6 167 203 A H H > S+ 0 0 118 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.915 122.4 52.0 -61.6 -43.3 20.7 69.1 39.0 168 204 A Q H 4 S+ 0 0 66 1,-0.2 -1,-0.2 2,-0.2 4,-0.2 0.873 109.2 49.7 -61.6 -38.6 17.6 67.4 37.5 169 205 A E H >> S+ 0 0 59 1,-0.2 4,-2.6 2,-0.2 3,-1.5 0.877 106.8 55.8 -68.1 -36.8 18.3 68.9 34.1 170 206 A K H 3X S+ 0 0 44 -4,-2.0 4,-2.2 1,-0.3 5,-0.2 0.815 94.2 67.9 -64.1 -31.3 21.9 67.7 34.3 171 207 A R H 3< S+ 0 0 14 -4,-1.5 89,-0.8 1,-0.2 -1,-0.3 0.615 113.8 30.9 -64.6 -11.8 20.7 64.2 34.9 172 208 A S H X> S+ 0 0 5 -3,-1.5 4,-1.5 -4,-0.2 3,-0.8 0.686 113.1 61.3-111.8 -38.3 19.5 64.3 31.3 173 209 A L H 3X S+ 0 0 9 -4,-2.6 4,-0.5 1,-0.3 -2,-0.2 0.818 94.4 62.7 -61.9 -32.8 22.1 66.6 29.8 174 210 A V H >< S+ 0 0 15 -4,-2.2 3,-0.7 1,-0.2 -1,-0.3 0.883 107.7 45.6 -60.7 -33.0 24.9 64.3 30.6 175 211 A C H X> S+ 0 0 40 -3,-0.8 4,-2.7 -5,-0.2 3,-2.0 0.857 101.9 66.5 -74.2 -35.7 23.2 61.9 28.2 176 212 A A H 3< S+ 0 0 0 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.538 78.4 82.2 -63.9 -8.0 22.6 64.6 25.6 177 213 A Q T << S+ 0 0 5 -3,-0.7 -1,-0.3 -4,-0.5 -2,-0.1 0.850 119.4 4.1 -64.3 -30.4 26.4 64.8 25.1 178 214 A C T <4 S+ 0 0 34 -3,-2.0 2,-2.0 -4,-0.2 -2,-0.2 0.699 114.9 78.0-123.0 -36.3 25.8 61.9 22.8 179 215 A H S < S+ 0 0 73 -4,-2.7 65,-2.7 63,-0.1 2,-0.3 -0.354 80.9 90.3 -81.2 59.9 22.2 61.0 22.4 180 216 A V S S- 0 0 4 -2,-2.0 2,-0.2 63,-0.2 63,-0.1 -0.916 81.1 -93.6-145.2 167.5 21.3 63.8 20.0 181 217 A E + 0 0 0 -2,-0.3 2,-0.3 61,-0.1 60,-0.1 -0.598 52.1 161.4 -83.5 148.0 21.1 64.6 16.3 182 218 A Y - 0 0 50 -2,-0.2 2,-0.3 22,-0.2 22,-0.2 -0.938 26.0-154.0-155.3 175.1 24.2 66.2 14.8 183 219 A Y E -D 203 0C 8 20,-1.6 20,-2.2 -2,-0.3 2,-0.6 -0.970 30.0-107.1-153.7 156.1 26.1 66.9 11.6 184 220 A F E -D 202 0C 37 -2,-0.3 2,-0.6 18,-0.2 18,-0.2 -0.805 28.6-154.7 -91.7 123.1 29.8 67.4 10.7 185 221 A K E -D 201 0C 94 16,-2.7 16,-2.3 -2,-0.6 2,-0.2 -0.865 17.8-128.3 -99.9 118.6 30.7 71.0 9.9 186 222 A K E -D 200 0C 146 -2,-0.6 2,-0.4 14,-0.2 14,-0.2 -0.488 34.7-171.2 -63.2 125.4 33.7 71.4 7.6 187 223 A T E -D 199 0C 38 12,-3.4 12,-3.3 -2,-0.2 2,-0.3 -0.972 15.8-148.0-131.4 121.4 35.9 73.9 9.5 188 224 A E E +D 198 0C 119 -2,-0.4 2,-0.3 10,-0.2 10,-0.2 -0.652 32.0 151.9 -85.8 138.3 39.0 75.7 8.3 189 225 A W E -D 197 0C 38 8,-2.5 8,-3.4 -2,-0.3 2,-0.4 -0.973 37.2-129.7-157.7 168.9 41.7 76.5 10.8 190 226 A K E -D 196 0C 136 -2,-0.3 6,-0.2 6,-0.2 5,-0.1 -0.996 25.2-136.9-128.8 129.4 45.4 77.1 11.4 191 227 A D > - 0 0 19 4,-2.1 3,-2.2 -2,-0.4 6,-0.0 -0.104 36.9 -88.7 -77.3 179.4 47.4 75.4 14.2 192 228 A D T 3 S+ 0 0 170 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.755 128.3 57.3 -59.6 -26.5 50.0 76.9 16.5 193 229 A K T 3 S- 0 0 191 2,-0.1 -1,-0.3 1,-0.0 -2,-0.1 0.293 119.7-110.7 -88.7 9.4 52.7 76.0 13.9 194 230 A G < + 0 0 37 -3,-2.2 2,-0.2 1,-0.2 -2,-0.1 0.462 68.3 147.5 77.1 1.6 50.8 78.1 11.3 195 231 A V - 0 0 74 1,-0.1 -4,-2.1 -5,-0.1 2,-0.4 -0.498 48.6-124.4 -74.6 136.4 49.8 75.1 9.3 196 232 A D E + D 0 190C 137 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.674 39.4 170.7 -82.5 127.4 46.4 75.2 7.5 197 233 A K E - D 0 189C 56 -8,-3.4 -8,-2.5 -2,-0.4 2,-0.5 -0.894 28.7-136.2-135.2 164.6 44.1 72.4 8.4 198 234 A T E - D 0 188C 63 -2,-0.3 -81,-0.5 -10,-0.2 2,-0.3 -0.985 20.5-168.2-125.8 124.0 40.5 71.3 7.9 199 235 A A E -CD 116 187C 0 -12,-3.3 -12,-3.4 -2,-0.5 2,-0.7 -0.787 19.9-142.5-111.1 154.2 38.4 69.8 10.7 200 236 A M E - D 0 186C 65 -85,-2.7 2,-0.4 -2,-0.3 -14,-0.2 -0.913 31.3-161.9-114.8 97.7 35.0 68.1 10.6 201 237 A V E - D 0 185C 8 -16,-2.3 -16,-2.7 -2,-0.7 2,-0.2 -0.701 20.8-119.1 -93.0 130.1 33.3 69.4 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248 A T H > S+ 0 0 2 1,-0.2 4,-2.1 2,-0.2 -1,-0.1 0.891 117.5 49.3 -58.0 -41.7 12.3 68.4 13.5 213 249 A E H > S+ 0 0 63 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.839 109.7 51.0 -68.0 -35.1 10.9 71.2 11.4 214 250 A Q H > S+ 0 0 82 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.926 111.5 47.0 -69.5 -41.6 13.2 73.8 12.9 215 251 A M H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.888 109.6 55.1 -65.3 -37.6 16.2 71.6 12.2 216 252 A E H X S+ 0 0 15 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.934 108.5 47.2 -59.8 -46.7 14.9 71.0 8.7 217 253 A A H X S+ 0 0 44 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.879 109.2 56.6 -61.9 -37.4 14.8 74.8 8.1 218 254 A Y H X S+ 0 0 19 -4,-2.0 4,-1.2 1,-0.2 -2,-0.2 0.929 111.0 41.3 -58.8 -49.4 18.3 74.9 9.6 219 255 A Y H <>S+ 0 0 0 -4,-2.4 5,-2.7 1,-0.2 -2,-0.2 0.863 114.7 51.2 -69.5 -36.8 19.7 72.5 7.0 220 256 A D H ><5S+ 0 0 50 -4,-2.5 3,-1.4 3,-0.2 -2,-0.2 0.869 102.9 60.0 -69.0 -36.3 17.8 74.0 4.1 221 257 A E H 3<5S+ 0 0 125 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.890 112.7 37.4 -58.9 -41.7 19.0 77.5 4.9 222 258 A I 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4,-2.7 2,-0.2 5,-0.3 0.923 109.9 52.9 -62.6 -45.1 11.7 63.3 -0.8 351 387 A R H X S+ 0 0 17 -4,-2.7 4,-2.1 1,-0.2 -114,-0.3 0.938 115.3 40.8 -54.8 -48.9 14.4 65.1 1.2 352 388 A H H X S+ 0 0 24 -4,-2.3 4,-2.2 2,-0.2 5,-0.2 0.867 112.7 54.5 -70.0 -37.9 11.8 66.4 3.6 353 389 A A H X S+ 0 0 0 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.939 114.2 40.2 -61.9 -48.3 9.8 63.2 3.7 354 390 A Q H X S+ 0 0 0 -4,-2.7 4,-3.3 2,-0.2 5,-0.3 0.866 111.4 56.5 -71.7 -35.9 12.8 61.1 4.7 355 391 A W H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.3 -1,-0.2 0.946 113.4 41.6 -59.0 -46.7 14.2 63.8 7.1 356 392 A R H X S+ 0 0 33 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.907 117.8 45.5 -67.8 -42.4 11.0 63.7 9.0 357 393 A A H X S+ 0 0 0 -4,-2.3 4,-1.5 -5,-0.2 -2,-0.2 0.916 115.2 47.3 -68.0 -42.2 10.5 59.9 8.9 358 394 A D H X S+ 0 0 1 -4,-3.3 4,-3.1 1,-0.2 5,-0.2 0.912 109.1 54.2 -65.6 -42.5 14.2 59.3 9.9 359 395 A M H < S+ 0 0 0 -4,-2.4 4,-0.4 -5,-0.3 -1,-0.2 0.832 108.5 52.1 -60.6 -29.9 13.9 61.8 12.7 360 396 A A H < S+ 0 0 2 -4,-1.3 -1,-0.2 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-5,-0.2 -1,-0.3 -0.513 75.1 170.0-147.6 70.5 7.3 61.2 22.6 371 407 A P H > S+ 0 0 25 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.889 77.2 46.0 -49.5 -53.0 4.6 58.9 21.1 372 408 A E H > S+ 0 0 172 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.872 111.5 49.6 -66.1 -39.4 2.4 61.5 19.6 373 409 A E H > S+ 0 0 46 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.888 109.8 53.8 -67.7 -35.6 5.2 63.5 17.9 374 410 A V H X S+ 0 0 1 -4,-2.1 4,-2.4 -8,-0.3 -2,-0.2 0.948 110.6 45.1 -62.1 -48.3 6.6 60.3 16.4 375 411 A L H X S+ 0 0 48 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.917 113.8 49.8 -62.5 -42.1 3.3 59.4 14.9 376 412 A R H X S+ 0 0 100 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.912 110.6 50.2 -63.2 -41.7 2.8 62.9 13.6 377 413 A L H X S+ 0 0 0 -4,-2.7 4,-3.1 1,-0.2 5,-0.2 0.917 110.7 48.3 -62.3 -45.4 6.3 62.9 12.1 378 414 A L H X S+ 0 0 1 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.861 113.4 48.3 -64.3 -35.4 5.8 59.6 10.3 379 415 A A H X S+ 0 0 55 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.874 113.6 46.9 -71.5 -38.0 2.4 60.9 9.0 380 416 A S H X S+ 0 0 25 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.917 112.9 48.7 -69.3 -44.6 4.0 64.1 7.8 381 417 A G H X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.912 110.4 51.4 -61.9 -42.4 6.9 62.4 6.2 382 418 A N H X S+ 0 0 32 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.906 107.5 53.1 -61.7 -41.6 4.6 60.0 4.4 383 419 A E H X S+ 0 0 99 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.905 108.9 49.1 -61.4 -41.3 2.5 62.9 3.1 384 420 A E H X S+ 0 0 22 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.900 110.9 51.1 -64.7 -38.7 5.6 64.5 1.6 385 421 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.919 111.1 47.0 -64.0 -43.7 6.6 61.2 0.0 386 422 A Q H X S+ 0 0 60 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.840 107.3 56.1 -68.6 -32.8 3.2 60.7 -1.6 387 423 A K H X S+ 0 0 86 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.913 109.8 47.9 -63.1 -39.7 3.2 64.3 -2.9 388 424 A A H X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.920 111.1 50.1 -64.8 -44.2 6.5 63.4 -4.6 389 425 A R H X S+ 0 0 52 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.854 106.5 53.8 -65.5 -35.9 5.0 60.2 -6.0 390 426 A I H X S+ 0 0 103 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.926 113.0 44.4 -63.9 -42.3 1.9 61.9 -7.4 391 427 A K H X S+ 0 0 71 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.844 109.2 58.1 -69.4 -33.0 4.2 64.3 -9.2 392 428 A L H X S+ 0 0 0 -4,-2.1 4,-3.1 1,-0.2 5,-0.3 0.835 96.4 61.0 -66.3 -33.8 6.4 61.4 -10.3 393 429 A V H X S+ 0 0 65 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.914 106.5 48.3 -59.0 -40.5 3.5 59.6 -12.0 394 430 A K H X S+ 0 0 137 -4,-1.0 4,-2.1 2,-0.2 -1,-0.2 0.888 112.1 46.8 -67.7 -40.2 3.3 62.7 -14.3 395 431 A V H X S+ 0 0 17 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.930 113.1 49.4 -67.7 -43.9 7.0 62.8 -15.0 396 432 A L H <>S+ 0 0 6 -4,-3.1 5,-3.2 1,-0.2 6,-0.3 0.902 110.5 52.1 -60.5 -39.0 7.1 59.1 -15.7 397 433 A A H ><5S+ 0 0 41 -4,-2.2 3,-2.1 4,-0.3 5,-0.2 0.908 102.9 57.0 -63.9 -43.1 4.1 59.6 -18.0 398 434 A K H 3<5S+ 0 0 135 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.870 111.1 44.8 -55.8 -36.7 5.8 62.3 -20.0 399 435 A Y T 3<5S- 0 0 61 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.164 124.4-102.7 -95.4 17.9 8.6 59.8 -20.7 400 436 A G T < 5S+ 0 0 70 -3,-2.1 -3,-0.2 -5,-0.1 3,-0.1 0.709 94.7 101.8 72.8 25.5 6.2 57.0 -21.6 401 437 A A > < + 0 0 19 -5,-3.2 3,-1.9 -6,-0.1 -4,-0.3 -0.172 26.0 136.5-132.1 43.8 6.4 54.9 -18.4 402 438 A I T 3 S+ 0 0 91 1,-0.3 -5,-0.2 -6,-0.3 -1,-0.1 0.783 76.4 53.3 -61.7 -26.3 3.2 55.7 -16.5 403 439 A D T 3 S+ 0 0 147 -7,-0.1 -1,-0.3 -3,-0.1 -2,-0.0 0.208 78.1 138.3 -94.4 15.5 2.7 52.0 -15.7 404 440 A Y < - 0 0 62 -3,-1.9 2,-0.5 -11,-0.1 -3,-0.0 -0.364 40.9-153.6 -61.5 138.0 6.2 51.6 -14.2 405 441 A V - 0 0 121 -2,-0.0 3,-0.1 3,-0.0 -1,-0.1 -0.957 17.6-125.9-118.5 111.3 6.2 49.5 -11.0 406 442 A A - 0 0 8 -2,-0.5 -81,-0.1 1,-0.1 -77,-0.1 -0.258 37.0-103.9 -54.1 135.4 9.1 50.3 -8.6 407 443 A P - 0 0 46 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.210 38.2-103.8 -61.7 155.7 10.9 47.1 -7.8 408 444 A D - 0 0 109 -3,-0.1 3,-0.1 1,-0.1 -3,-0.0 -0.445 28.2-174.9 -80.0 154.2 10.4 45.4 -4.4 409 445 A F + 0 0 15 -2,-0.1 -360,-0.2 1,-0.1 -361,-0.1 -0.272 33.6 136.7-143.2 48.9 12.8 45.6 -1.5 410 446 A E + 0 0 113 -365,-0.1 2,-0.3 -364,-0.1 -364,-0.1 0.538 66.1 49.8 -77.5 -9.6 11.3 43.3 1.1 411 447 A T S > S- 0 0 46 -366,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.940 83.6-122.3-128.3 153.4 14.6 41.6 2.0 412 448 A K H > S+ 0 0 13 -2,-0.3 4,-2.6 -370,-0.2 5,-0.2 0.875 112.9 55.6 -59.1 -38.0 17.9 43.1 2.9 413 449 A E H > S+ 0 0 121 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.939 110.7 41.6 -61.0 -50.5 19.5 41.1 0.0 414 450 A K H > S+ 0 0 87 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.879 115.2 51.7 -66.5 -38.4 17.2 42.6 -2.6 415 451 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.914 108.3 50.3 -65.9 -43.2 17.4 46.1 -1.2 416 452 A Q H <>S+ 0 0 12 -4,-2.6 5,-3.0 1,-0.2 -1,-0.2 0.771 106.9 55.7 -68.2 -23.7 21.2 46.1 -1.1 417 453 A K H ><5S+ 0 0 171 -4,-1.2 3,-1.0 3,-0.2 -1,-0.2 0.921 109.0 46.5 -72.2 -42.7 21.2 45.0 -4.8 418 454 A L H 3<5S+ 0 0 48 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.867 114.4 48.0 -64.8 -35.4 19.1 48.0 -5.7 419 455 A A T 3<5S- 0 0 11 -4,-2.1 -366,-0.4 -5,-0.1 -1,-0.3 0.437 111.8-126.2 -84.3 0.2 21.4 50.1 -3.6 420 456 A K T < 5 + 0 0 191 -3,-1.0 2,-0.7 1,-0.2 -3,-0.2 0.905 50.5 160.2 54.8 49.0 24.4 48.5 -5.3 421 457 A V < - 0 0 20 -5,-3.0 2,-1.6 -364,-0.1 -1,-0.2 -0.895 33.1-153.3-104.4 113.1 26.1 47.5 -2.0 422 458 A D > + 0 0 92 -2,-0.7 4,-2.1 1,-0.2 5,-0.2 -0.637 20.9 174.4 -86.7 83.4 28.7 44.8 -2.5 423 459 A M H > S+ 0 0 29 -2,-1.6 4,-3.1 1,-0.2 5,-0.3 0.886 72.7 57.0 -55.7 -48.0 28.4 43.3 1.0 424 460 A E H > S+ 0 0 166 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.927 109.8 46.5 -51.3 -48.7 30.8 40.4 0.4 425 461 A A H > S+ 0 0 47 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.936 113.6 46.6 -60.7 -50.9 33.5 42.8 -0.6 426 462 A F H X S+ 0 0 65 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.906 114.4 47.8 -60.4 -43.1 33.0 45.2 2.3 427 463 A I H X S+ 0 0 39 -4,-3.1 4,-2.6 2,-0.2 5,-0.2 0.919 111.3 49.8 -64.9 -44.4 32.9 42.4 4.8 428 464 A A H X S+ 0 0 59 -4,-2.5 4,-1.6 -5,-0.3 -2,-0.2 0.930 113.6 46.6 -60.3 -44.2 36.0 40.6 3.4 429 465 A E H X S+ 0 0 100 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.886 111.5 52.5 -64.3 -39.7 37.9 43.9 3.5 430 466 A K H X S+ 0 0 1 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.931 106.2 51.8 -63.1 -47.7 36.7 44.6 7.1 431 467 A L H X S+ 0 0 61 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.885 107.6 52.9 -58.0 -40.2 37.8 41.3 8.4 432 468 A K H X S+ 0 0 143 -4,-1.6 4,-1.0 1,-0.2 5,-0.3 0.892 109.6 49.2 -62.6 -39.9 41.3 41.8 7.0 433 469 A F H <>S+ 0 0 5 -4,-1.7 5,-2.5 1,-0.2 3,-0.5 0.924 112.4 47.7 -63.8 -45.3 41.4 45.2 8.8 434 470 A K H <>S+ 0 0 10 -4,-2.5 5,-0.7 1,-0.2 -2,-0.2 0.861 111.1 50.6 -64.4 -37.7 40.3 43.6 12.1 435 471 A Q H <5S+ 0 0 140 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.671 128.7 17.1 -75.7 -16.9 42.8 40.8 11.8 436 472 A T T X5S+ 0 0 74 -4,-1.0 4,-1.8 -3,-0.5 5,-0.2 0.661 130.0 26.3-117.3 -83.6 45.7 43.3 11.2 437 473 A L H >5S+ 0 0 28 -5,-0.3 4,-2.2 1,-0.2 -3,-0.2 0.868 121.0 53.0 -56.9 -41.3 45.4 47.0 11.9 438 474 A E H >S+ 0 0 0 -4,-2.6 5,-2.6 -5,-0.3 6,-1.4 0.888 112.2 46.2 -60.6 -39.9 47.3 50.6 23.3 446 482 A I H ><5S+ 0 0 67 -4,-2.1 3,-0.5 4,-0.2 -1,-0.2 0.887 112.0 50.9 -70.3 -38.9 47.9 47.9 25.9 447 483 A A H 3<5S+ 0 0 87 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.895 111.0 48.5 -65.2 -39.7 51.7 48.3 25.7 448 484 A K H 3<5S- 0 0 96 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.582 116.2-115.0 -76.6 -11.5 51.4 52.1 26.2 449 485 A G T <<5S+ 0 0 42 -4,-0.6 -3,-0.2 -3,-0.5 -4,-0.1 0.683 86.6 113.7 85.3 18.8 49.1 51.5 29.2 450 486 A R S - 0 0 61 -2,-0.4 3,-2.1 1,-0.1 4,-0.3 -0.916 15.8-142.8-104.7 119.2 43.4 47.2 30.1 453 489 A P G > S+ 0 0 72 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.707 96.2 73.5 -53.6 -21.3 42.8 43.8 28.5 454 490 A E G > S+ 0 0 74 1,-0.3 3,-1.3 2,-0.2 -3,-0.0 0.866 89.3 59.6 -61.6 -34.9 40.2 43.1 31.1 455 491 A S G < S+ 0 0 34 -3,-2.1 -1,-0.3 1,-0.2 -326,-0.1 0.616 96.3 62.9 -69.8 -12.3 37.9 45.5 29.3 456 492 A L G X> + 0 0 47 -3,-1.4 3,-1.8 -4,-0.3 4,-0.5 0.485 68.4 130.7 -92.2 -3.9 38.0 43.4 26.2 457 493 A K T <4 S- 0 0 100 -3,-1.3 -3,-0.0 1,-0.3 14,-0.0 -0.325 92.1 -19.2 -57.0 116.6 36.4 40.3 27.7 458 494 A G T >4 S+ 0 0 19 -2,-0.2 3,-0.7 1,-0.1 -1,-0.3 0.555 102.0 123.7 63.1 10.2 33.6 39.2 25.4 459 495 A V T <4 S+ 0 0 8 -3,-1.8 3,-0.2 1,-0.2 -2,-0.1 0.745 73.1 40.4 -74.4 -22.6 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