==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 22-APR-06 2GQX . COMPND 2 MOLECULE: CYTOCHROME P450-CAM; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR Z.RAO,L.L.WONG,F.XU,S.G.BELL . 810 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33572.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 552 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 63 7.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 4 0.5 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 . 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 . 33 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 109 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 305 37.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.1 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 3 2 6 0 0 4 0 4 3 1 1 1 2 0 1 0 0 2 1 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 2 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 9 3 4 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 ANTIPARALLEL BRIDGES PER LADDER . 6 2 0 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 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 10 A N 0 0 186 0, 0.0 2,-0.6 0, 0.0 50,-0.4 0.000 360.0 360.0 360.0 -95.2 -9.3 28.9 18.8 2 11 A L - 0 0 71 47,-0.1 47,-0.2 48,-0.1 3,-0.1 -0.813 360.0-138.0 -97.7 119.8 -9.3 26.1 21.3 3 12 A A - 0 0 26 45,-2.9 49,-0.0 -2,-0.6 46,-0.0 -0.522 39.4 -94.0 -71.9 137.7 -12.5 25.2 23.2 4 13 A P - 0 0 120 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.244 47.4-102.4 -53.4 135.2 -11.9 24.5 26.9 5 14 A L - 0 0 46 1,-0.1 6,-0.1 -3,-0.1 43,-0.0 -0.438 35.9-121.4 -64.7 117.9 -11.4 20.8 27.5 6 15 A P > - 0 0 35 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 -0.168 23.3-114.7 -55.1 153.0 -14.6 19.2 29.0 7 16 A P T 3 S+ 0 0 135 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.852 113.0 54.2 -60.8 -32.8 -14.0 17.6 32.4 8 17 A H T 3 S+ 0 0 49 2,-0.1 294,-0.2 0, 0.0 -3,-0.0 0.627 87.3 93.0 -78.6 -12.2 -14.8 14.1 31.1 9 18 A V S < S- 0 0 2 -3,-1.0 2,-0.1 292,-0.1 5,-0.1 -0.734 81.0-121.4 -88.4 121.5 -12.3 14.2 28.2 10 19 A P > - 0 0 37 0, 0.0 3,-1.8 0, 0.0 4,-0.2 -0.343 11.9-135.3 -62.6 130.2 -8.8 12.7 29.1 11 20 A E G > S+ 0 0 142 1,-0.3 3,-1.5 2,-0.2 35,-0.1 0.878 102.8 57.0 -53.1 -41.8 -6.0 15.2 28.7 12 21 A H G 3 S+ 0 0 151 1,-0.3 -1,-0.3 33,-0.0 -3,-0.0 0.563 98.2 60.3 -71.6 -8.0 -3.8 12.6 26.9 13 22 A L G < S+ 0 0 18 -3,-1.8 33,-3.0 32,-0.1 2,-0.4 0.315 77.9 118.9 -99.6 8.1 -6.4 11.9 24.2 14 23 A V B < +a 46 0A 38 -3,-1.5 2,-0.3 31,-0.2 33,-0.2 -0.620 28.3 162.4 -80.4 126.9 -6.3 15.5 23.0 15 24 A F - 0 0 62 31,-3.1 2,-2.4 -2,-0.4 30,-0.1 -0.885 31.9-143.9-143.7 103.1 -5.2 16.1 19.4 16 25 A D + 0 0 58 -2,-0.3 2,-0.3 31,-0.2 31,-0.1 -0.358 32.8 166.7 -74.7 66.5 -6.1 19.5 18.1 17 26 A F - 0 0 8 -2,-2.4 2,-0.7 32,-0.1 32,-0.3 -0.623 25.4-150.9 -80.6 137.4 -6.9 18.6 14.5 18 27 A D > - 0 0 47 -2,-0.3 3,-2.4 3,-0.1 -2,-0.1 -0.864 4.8-164.4-113.4 97.4 -8.8 21.3 12.6 19 28 A M T 3 S+ 0 0 0 -2,-0.7 -1,-0.1 1,-0.3 14,-0.0 0.671 89.3 50.8 -55.2 -19.9 -11.0 19.7 9.9 20 29 A Y T 3 S+ 0 0 46 1,-0.2 364,-0.3 365,-0.0 -1,-0.3 0.485 130.6 13.0 -97.5 -3.0 -11.4 23.1 8.1 21 30 A N S < S- 0 0 102 -3,-2.4 -1,-0.2 362,-0.1 -2,-0.2 -0.304 79.6-165.8-167.9 68.6 -7.7 23.9 8.0 22 31 A P > - 0 0 2 0, 0.0 3,-1.6 0, 0.0 11,-0.1 -0.347 26.9-120.8 -65.2 144.2 -5.5 20.9 8.8 23 32 A S T 3 S+ 0 0 128 1,-0.3 3,-0.4 9,-0.1 10,-0.1 0.853 108.4 45.0 -51.5 -46.9 -1.8 21.6 9.6 24 33 A N T > S+ 0 0 63 8,-0.3 3,-1.7 1,-0.2 -1,-0.3 0.086 74.7 125.1 -92.7 28.5 -0.2 19.4 6.9 25 34 A L G X + 0 0 33 -3,-1.6 3,-3.4 1,-0.3 -1,-0.2 0.850 59.3 69.0 -53.0 -43.9 -2.6 20.6 4.2 26 35 A S G 3 S+ 0 0 122 -3,-0.4 -1,-0.3 1,-0.3 3,-0.1 0.723 95.0 58.3 -50.6 -24.0 0.1 21.8 1.8 27 36 A A G < S- 0 0 49 -3,-1.7 -1,-0.3 1,-0.3 4,-0.2 0.428 130.8 -76.9 -87.1 1.1 1.0 18.1 1.3 28 37 A G <> - 0 0 8 -3,-3.4 4,-2.0 -4,-0.1 -1,-0.3 -0.025 41.0 -96.7 111.9 141.3 -2.5 17.3 0.1 29 38 A V H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.935 122.3 50.2 -56.7 -52.9 -5.7 17.0 2.0 30 39 A Q H > S+ 0 0 1 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.923 113.4 48.3 -53.3 -43.3 -5.7 13.2 2.2 31 40 A E H 4 S+ 0 0 54 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.843 109.3 53.8 -64.6 -34.4 -2.1 13.4 3.5 32 41 A A H >< S+ 0 0 1 -4,-2.0 3,-0.8 -3,-0.2 -8,-0.3 0.898 111.5 42.9 -68.5 -41.9 -3.2 16.1 6.0 33 42 A W H >< S+ 0 0 0 -4,-2.5 3,-2.0 1,-0.2 -1,-0.2 0.827 102.5 70.8 -72.0 -30.8 -5.9 14.0 7.5 34 43 A A G >< S+ 0 0 23 -4,-2.0 3,-2.0 -5,-0.3 -1,-0.2 0.640 76.4 80.0 -61.3 -15.8 -3.6 11.0 7.5 35 44 A V G X S+ 0 0 24 -3,-0.8 3,-1.5 -4,-0.4 -1,-0.3 0.796 81.3 68.2 -61.6 -25.8 -1.6 12.6 10.3 36 45 A L G < S+ 0 0 0 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.586 97.4 52.9 -69.3 -10.3 -4.3 11.2 12.6 37 46 A Q G < S+ 0 0 15 -3,-2.0 -1,-0.3 -4,-0.1 -2,-0.2 0.205 81.3 124.8-110.3 13.9 -3.1 7.7 11.8 38 47 A E S X S- 0 0 115 -3,-1.5 3,-2.1 1,-0.1 -3,-0.0 -0.241 79.3 -84.1 -71.0 164.7 0.6 8.2 12.7 39 48 A S T 3 S+ 0 0 123 1,-0.3 -1,-0.1 0, 0.0 -3,-0.0 0.746 122.4 37.6 -36.3 -50.4 2.4 5.9 15.2 40 49 A N T 3 S+ 0 0 160 2,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.138 88.1 107.3-100.0 23.6 1.5 7.7 18.4 41 50 A V < - 0 0 15 -3,-2.1 4,-0.1 -6,-0.1 -28,-0.1 -0.879 66.2-126.6-104.0 127.9 -2.1 8.7 17.7 42 51 A P - 0 0 48 0, 0.0 3,-0.2 0, 0.0 15,-0.1 -0.097 23.4-109.3 -62.8 165.2 -4.9 6.8 19.5 43 52 A D S S+ 0 0 48 1,-0.2 14,-2.8 14,-0.1 15,-0.7 0.748 110.4 31.7 -66.5 -26.2 -7.9 5.1 17.7 44 53 A L E S+ B 0 56A 5 12,-0.2 2,-0.3 13,-0.1 -1,-0.2 -0.966 75.4 170.2-139.8 119.5 -10.1 7.8 19.2 45 54 A V E - B 0 55A 1 10,-2.1 10,-2.1 -2,-0.4 2,-0.4 -0.793 26.2-130.4-124.6 167.9 -9.0 11.4 20.0 46 55 A W E -aB 14 54A 10 -33,-3.0 -31,-3.1 -2,-0.3 2,-0.4 -0.972 16.4-160.9-119.7 132.3 -10.6 14.7 21.0 47 56 A T E - B 0 53A 0 6,-2.8 6,-2.1 -2,-0.4 -31,-0.2 -0.910 13.8-154.3-111.2 141.7 -9.8 18.0 19.3 48 57 A R > + 0 0 75 -2,-0.4 -45,-2.9 4,-0.2 3,-0.6 0.424 66.3 105.8 -91.3 1.2 -10.5 21.3 20.9 49 58 A C G > S+ 0 0 14 -32,-0.3 3,-3.0 1,-0.2 -2,-0.1 -0.299 76.9 17.6 -76.7 164.1 -10.9 22.9 17.5 50 59 A N G 3 S- 0 0 43 -49,-0.3 31,-0.3 1,-0.3 -1,-0.2 0.794 143.0 -44.4 44.3 41.7 -14.2 23.9 16.0 51 60 A G G < S- 0 0 62 -3,-0.6 -1,-0.3 -50,-0.4 -2,-0.2 0.249 104.3 -76.8 92.6 -14.3 -16.0 23.8 19.3 52 61 A G < + 0 0 5 -3,-3.0 2,-0.3 1,-0.1 256,-0.3 0.474 64.2 157.9 91.7 127.2 -14.5 20.5 20.5 53 62 A H E -B 47 0A 0 -6,-2.1 -6,-2.8 254,-0.1 256,-0.2 -0.976 38.3 -94.7-171.4 162.6 -15.4 17.0 19.4 54 63 A W E -Bc 46 309A 0 254,-3.0 256,-2.8 -2,-0.3 2,-0.3 -0.398 28.4-158.1 -82.5 164.2 -14.2 13.4 19.1 55 64 A I E -Bc 45 310A 0 -10,-2.1 -10,-2.1 254,-0.2 2,-0.5 -0.928 10.4-145.5-146.4 118.9 -12.6 11.9 16.0 56 65 A A E -B 44 0A 0 254,-2.4 -12,-0.2 -2,-0.3 259,-0.1 -0.765 16.9-172.8 -82.8 124.6 -12.4 8.2 15.2 57 66 A T + 0 0 0 -14,-2.8 2,-0.3 -2,-0.5 -13,-0.1 0.580 55.9 63.6 -99.0 -10.6 -9.1 7.7 13.4 58 67 A R S > S- 0 0 6 -15,-0.7 4,-2.5 1,-0.1 3,-0.2 -0.887 77.8-124.2-119.3 149.3 -9.3 4.1 12.3 59 68 A G H > S+ 0 0 0 -2,-0.3 4,-3.2 257,-0.3 5,-0.3 0.861 107.9 61.8 -53.1 -40.4 -11.6 2.2 9.9 60 69 A Q H > S+ 0 0 115 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.956 111.4 35.9 -52.9 -57.4 -12.6 -0.3 12.6 61 70 A L H > S+ 0 0 0 -3,-0.2 4,-3.1 2,-0.2 5,-0.3 0.930 116.2 55.6 -63.3 -45.4 -14.1 2.4 14.9 62 71 A I H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.933 110.6 43.7 -53.4 -51.8 -15.5 4.4 12.0 63 72 A R H X S+ 0 0 50 -4,-3.2 4,-1.4 1,-0.2 -1,-0.2 0.905 114.3 51.7 -62.1 -41.5 -17.4 1.4 10.5 64 73 A E H X S+ 0 0 71 -4,-2.1 4,-1.9 -5,-0.3 3,-0.4 0.947 109.9 47.4 -60.5 -51.0 -18.6 0.4 14.0 65 74 A A H < S+ 0 0 0 -4,-3.1 7,-0.3 1,-0.2 3,-0.2 0.929 110.8 52.0 -58.6 -45.0 -19.9 3.9 14.9 66 75 A Y H < S+ 0 0 6 -4,-2.2 279,-0.5 -5,-0.3 -1,-0.2 0.788 109.7 50.5 -63.6 -25.7 -21.7 4.2 11.5 67 76 A E H < S+ 0 0 112 -4,-1.4 2,-1.4 -3,-0.4 -1,-0.2 0.843 100.0 67.5 -78.7 -33.5 -23.4 0.8 12.1 68 77 A D >X + 0 0 40 -4,-1.9 4,-2.5 -3,-0.2 3,-0.8 -0.588 54.4 161.6 -91.2 76.8 -24.6 1.8 15.6 69 78 A Y T 34 + 0 0 68 -2,-1.4 -1,-0.2 1,-0.2 5,-0.1 0.783 68.9 67.2 -65.6 -26.6 -27.2 4.5 14.9 70 79 A R T 34 S+ 0 0 169 -3,-0.2 -1,-0.2 1,-0.2 3,-0.2 0.840 115.6 26.4 -64.6 -32.5 -28.8 4.0 18.3 71 80 A H T <4 S+ 0 0 53 -3,-0.8 222,-2.0 1,-0.2 2,-0.7 0.784 128.0 45.9 -96.7 -34.6 -25.7 5.4 20.0 72 81 A F E < S-D 292 0A 1 -4,-2.5 -1,-0.2 -7,-0.3 220,-0.2 -0.830 81.3-166.0-114.6 89.8 -24.4 7.5 17.1 73 82 A S E > -D 291 0A 5 218,-2.2 218,-2.0 -2,-0.7 3,-0.6 -0.461 27.2-143.0 -80.7 145.9 -27.4 9.5 15.7 74 83 A S T 3 S+ 0 0 0 1,-0.2 -1,-0.1 216,-0.2 4,-0.1 0.409 79.4 104.0 -83.8 2.8 -27.4 11.4 12.4 75 84 A E T 3 S+ 0 0 132 1,-0.3 -1,-0.2 216,-0.2 215,-0.1 0.900 94.5 21.5 -48.2 -49.6 -29.5 14.0 14.2 76 85 A C S < S+ 0 0 5 -3,-0.6 -1,-0.3 1,-0.1 9,-0.1 -0.773 76.0 152.7-125.6 81.2 -26.5 16.4 14.4 77 86 A P + 0 0 1 0, 0.0 212,-2.6 0, 0.0 2,-0.3 0.478 48.8 80.3 -88.7 -6.4 -24.0 15.2 11.7 78 87 A W S S- 0 0 13 210,-0.2 6,-0.5 3,-0.2 210,-0.1 -0.781 74.4-114.7-108.7 149.6 -22.3 18.5 11.0 79 88 A I S S+ 0 0 3 -2,-0.3 2,-0.2 4,-0.1 307,-0.1 -0.979 91.0 52.6-123.3 137.1 -19.5 20.3 12.8 80 89 A P S >> S- 0 0 38 0, 0.0 4,-2.5 0, 0.0 3,-0.7 0.508 90.9-123.1 -65.5 167.8 -19.5 22.9 14.3 81 90 A R H 3> S+ 0 0 72 -31,-0.3 4,-2.9 1,-0.2 5,-0.2 0.853 109.8 60.0 -50.4 -42.0 -22.5 22.0 16.5 82 91 A E H 3> S+ 0 0 127 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.909 109.2 42.7 -54.8 -46.2 -24.4 25.1 15.3 83 92 A A H <> S+ 0 0 7 -3,-0.7 4,-2.2 1,-0.2 -1,-0.2 0.946 114.3 51.8 -64.8 -47.8 -24.2 23.8 11.7 84 93 A G H < S+ 0 0 0 -4,-2.5 -2,-0.2 -6,-0.5 -1,-0.2 0.829 109.3 50.0 -58.7 -34.2 -25.1 20.3 13.0 85 94 A E H < S+ 0 0 130 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.849 113.7 44.0 -74.8 -34.1 -28.1 21.6 14.9 86 95 A A H < S+ 0 0 25 -4,-1.7 2,-0.3 -5,-0.2 -2,-0.2 0.744 89.6 105.0 -79.3 -25.3 -29.4 23.5 11.8 87 96 A F < + 0 0 6 -4,-2.2 -9,-0.1 -5,-0.2 98,-0.0 -0.401 33.0 148.7 -60.1 115.1 -28.7 20.6 9.5 88 97 A D + 0 0 38 -2,-0.3 -1,-0.1 -12,-0.1 147,-0.1 0.150 13.1 146.7-139.5 24.4 -32.1 19.0 8.7 89 98 A F > - 0 0 1 145,-0.1 4,-2.5 3,-0.1 143,-0.2 -0.298 50.7 -93.6 -63.5 148.0 -31.8 17.6 5.2 90 99 A I T 4 S+ 0 0 0 141,-1.4 145,-0.4 1,-0.2 146,-0.2 -0.914 98.2 3.8-111.4 138.5 -33.7 14.4 4.6 91 100 A P T >4 S+ 0 0 9 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 -0.986 123.4 65.8 -89.2 3.6 -32.8 11.5 4.8 92 101 A T T 34 S+ 0 0 41 1,-0.3 -2,-0.2 140,-0.1 -3,-0.1 0.720 100.5 48.9 -58.0 -29.7 -29.4 12.5 6.1 93 102 A S T 3< S+ 0 0 11 -4,-2.5 2,-0.3 -5,-0.1 -1,-0.3 0.327 100.4 86.1 -94.0 8.9 -30.5 14.0 9.4 94 103 A M < - 0 0 39 -3,-1.8 -6,-0.0 -5,-0.1 -5,-0.0 -0.821 62.3-147.6-113.9 151.6 -32.7 11.0 10.3 95 104 A D > - 0 0 35 -2,-0.3 4,-1.5 1,-0.1 3,-0.3 -0.753 43.0 -61.0-109.4 155.9 -32.0 7.6 12.0 96 105 A P T 4 S+ 0 0 8 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.394 110.9 38.7 -63.8 157.2 -33.7 4.3 11.2 97 106 A P T >4 S+ 0 0 86 0, 0.0 3,-1.0 0, 0.0 4,-0.5 -0.934 127.2 34.5 -78.7 -32.3 -36.6 3.4 11.4 98 107 A E T 3> S+ 0 0 117 -3,-0.3 4,-0.7 1,-0.2 3,-0.2 0.748 110.6 66.6 -53.3 -30.8 -38.1 6.8 10.2 99 108 A Q H >X S+ 0 0 0 -4,-1.5 4,-2.0 1,-0.2 3,-0.8 0.903 87.9 68.5 -59.1 -43.9 -35.2 7.3 7.8 100 109 A R H <> S+ 0 0 123 -3,-1.0 4,-2.6 1,-0.2 5,-0.2 0.845 91.9 54.0 -43.4 -58.8 -36.1 4.4 5.6 101 110 A Q H 3> S+ 0 0 35 -4,-0.5 4,-1.3 1,-0.2 119,-0.3 0.850 113.5 44.5 -50.4 -39.2 -39.3 5.6 4.0 102 111 A F H X S+ 0 0 5 -4,-1.3 4,-0.6 2,-0.2 3,-0.6 0.919 114.8 47.5 -66.7 -43.1 -38.3 7.9 -2.2 106 115 A A H >X S+ 0 0 0 -4,-2.6 3,-1.6 1,-0.2 4,-1.3 0.929 106.5 58.4 -63.1 -42.9 -34.9 9.5 -2.7 107 116 A N H 3X S+ 0 0 75 -4,-3.2 4,-1.3 1,-0.3 -1,-0.2 0.778 98.4 63.1 -57.5 -26.0 -33.5 6.3 -4.1 108 117 A Q H << S+ 0 0 126 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.753 105.5 42.0 -73.4 -24.5 -36.2 6.5 -6.8 109 118 A V H << S+ 0 0 5 -3,-1.6 -1,-0.2 -4,-0.6 -2,-0.2 0.699 131.9 20.3 -97.2 -17.9 -34.9 9.8 -8.3 110 119 A V H < S+ 0 0 9 -4,-1.3 243,-0.4 100,-0.1 -2,-0.2 0.259 96.3 123.1-129.6 10.7 -31.2 9.0 -8.3 111 120 A G S >X S- 0 0 2 -4,-1.3 4,-1.9 -5,-0.3 3,-1.0 -0.139 78.8 -90.0 -72.1 169.4 -31.2 5.2 -8.0 112 121 A M H 3> S+ 0 0 73 1,-0.3 4,-2.8 2,-0.2 3,-0.3 0.879 123.8 57.3 -43.3 -55.4 -29.5 2.7 -10.3 113 122 A P H 3> S+ 0 0 95 0, 0.0 4,-1.3 0, 0.0 -1,-0.3 0.889 111.6 44.8 -47.1 -41.4 -32.6 2.3 -12.6 114 123 A V H <> S+ 0 0 38 -3,-1.0 4,-0.9 2,-0.2 -2,-0.2 0.846 111.5 53.3 -71.5 -34.9 -32.4 6.1 -13.2 115 124 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90.3-143.3 -70.2 -25.2 -6.9 23.7 -27.4 137 146 A G T <<5S+ 0 0 9 -3,-0.9 260,-2.7 -4,-0.6 2,-0.3 0.628 70.7 46.0 71.5 13.7 -4.1 21.8 -25.7 138 147 A Q E < +F 396 0B 122 -5,-0.6 2,-0.3 258,-0.3 258,-0.2 -0.972 55.2 171.1-173.7 163.7 -4.9 23.1 -22.2 139 148 A C E -F 395 0B 5 256,-1.9 256,-2.7 -2,-0.3 2,-0.9 -0.967 41.2-113.9-174.0 162.2 -7.7 23.7 -19.7 140 149 A N E >> -F 394 0B 76 -2,-0.3 4,-2.9 254,-0.2 3,-0.7 -0.862 37.4-159.7-105.9 88.7 -8.6 24.7 -16.2 141 150 A F H 3>>S+ 0 0 0 252,-1.8 5,-2.7 -2,-0.9 4,-1.8 0.766 80.4 59.1 -43.0 -40.7 -10.1 21.3 -15.3 142 151 A T H 34>S+ 0 0 10 3,-0.2 5,-2.3 1,-0.2 -1,-0.2 0.952 121.2 23.5 -60.4 -49.4 -12.2 22.5 -12.3 143 152 A E H <45S+ 0 0 112 -3,-0.7 -2,-0.2 3,-0.2 -1,-0.2 0.743 124.3 51.8 -90.7 -21.5 -14.3 25.0 -14.3 144 153 A D H <5S- 0 0 53 -4,-2.9 -3,-0.2 3,-0.1 -2,-0.2 0.732 136.3 -14.1 -86.0 -22.6 -13.9 23.4 -17.8 145 154 A Y T X5S+ 0 0 0 -4,-1.8 4,-2.2 -5,-0.4 -3,-0.2 0.504 121.9 64.6-141.9 -58.2 -14.9 19.9 -16.8 146 155 A A T 4 S+ 0 0 15 0, 0.0 4,-2.6 0, 0.0 5,-0.4 0.889 108.0 59.5 -58.6 -43.4 -19.9 21.6 -15.6 149 158 A F H X S+ 0 0 0 -4,-2.2 4,-1.4 1,-0.2 -3,-0.1 0.975 118.7 24.6 -52.3 -67.5 -19.9 17.8 -16.4 150 159 A P H > S+ 0 0 1 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.886 123.0 54.3 -69.7 -34.8 -21.6 16.5 -13.2 151 160 A I H X S+ 0 0 2 -4,-2.1 4,-3.0 -5,-0.2 5,-0.3 0.947 108.0 48.0 -64.0 -46.9 -23.5 19.7 -12.4 152 161 A R H X S+ 0 0 88 -4,-2.6 4,-1.7 -5,-0.3 -1,-0.2 0.865 111.9 52.4 -61.6 -33.7 -25.2 20.0 -15.8 153 162 A I H X S+ 0 0 3 -4,-1.4 4,-2.3 -5,-0.4 -1,-0.2 0.938 111.4 45.7 -66.4 -44.6 -26.1 16.4 -15.4 154 163 A F H X S+ 0 0 8 -4,-2.6 4,-3.0 86,-0.3 5,-0.2 0.946 111.2 50.4 -63.8 -49.9 -27.6 17.0 -12.0 155 164 A M H X>S+ 0 0 1 -4,-3.0 5,-2.6 1,-0.2 4,-1.0 0.868 111.3 51.6 -56.6 -36.1 -29.5 20.2 -13.1 156 165 A L H ><5S+ 0 0 66 -4,-1.7 3,-0.6 -5,-0.3 -1,-0.2 0.949 111.7 44.5 -64.7 -50.0 -30.9 18.1 -16.0 157 166 A L H 3<5S+ 0 0 25 -4,-2.3 53,-2.7 1,-0.2 -2,-0.2 0.888 117.4 46.4 -61.7 -38.3 -32.1 15.3 -13.7 158 167 A A H 3<5S- 0 0 0 -4,-3.0 53,-0.7 51,-0.2 -1,-0.2 0.583 108.0-124.4 -80.7 -12.0 -33.5 17.9 -11.3 159 168 A G T <<5 + 0 0 33 -4,-1.0 -3,-0.2 -3,-0.6 -4,-0.1 0.845 62.0 142.6 70.3 33.4 -35.2 19.9 -14.0 160 169 A L < - 0 0 9 -5,-2.6 -1,-0.2 -6,-0.2 -2,-0.1 -0.912 55.4-110.1-112.0 134.5 -33.4 23.1 -12.9 161 170 A P > - 0 0 61 0, 0.0 3,-1.7 0, 0.0 4,-0.1 -0.335 20.7-130.9 -62.2 136.6 -32.1 25.8 -15.2 162 171 A E G > S+ 0 0 101 1,-0.3 3,-1.6 2,-0.2 -7,-0.0 0.642 98.9 77.4 -63.9 -17.2 -28.3 26.0 -15.5 163 172 A E G 3 S+ 0 0 158 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.745 88.6 59.8 -65.6 -22.1 -28.4 29.8 -15.0 164 173 A D G <> S+ 0 0 41 -3,-1.7 4,-2.4 1,-0.2 -1,-0.3 0.503 79.3 94.4 -82.6 -5.9 -28.9 29.1 -11.3 165 174 A I H <> S+ 0 0 31 -3,-1.6 4,-3.3 1,-0.2 5,-0.4 0.910 76.8 53.9 -56.3 -50.6 -25.7 27.2 -11.0 166 175 A P H > S+ 0 0 97 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.904 114.4 43.1 -52.1 -43.8 -23.3 29.9 -9.8 167 176 A H H > S+ 0 0 95 -4,-0.3 4,-2.2 -3,-0.2 -2,-0.2 0.959 117.3 45.2 -66.1 -53.0 -25.7 30.8 -6.9 168 177 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.901 112.4 50.2 -58.7 -45.9 -26.4 27.1 -5.9 169 178 A K H X S+ 0 0 15 -4,-3.3 4,-2.6 -5,-0.2 -1,-0.2 0.902 109.9 51.9 -62.7 -39.9 -22.7 26.0 -6.1 170 179 A Y H X S+ 0 0 78 -4,-1.6 4,-1.8 -5,-0.4 -1,-0.2 0.925 110.5 48.2 -62.9 -43.8 -21.7 28.9 -3.9 171 180 A L H X S+ 0 0 3 -4,-2.2 4,-0.9 2,-0.2 -2,-0.2 0.925 113.0 46.8 -63.5 -43.6 -24.3 28.0 -1.3 172 181 A T H >X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 3,-0.9 0.918 109.6 54.6 -64.9 -41.1 -23.3 24.3 -1.3 173 182 A D H 3X S+ 0 0 42 -4,-2.6 4,-3.6 1,-0.3 3,-0.3 0.877 104.9 55.0 -57.9 -38.7 -19.6 25.3 -1.1 174 183 A Q H 3< S+ 0 0 8 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.749 106.0 51.7 -68.1 -23.6 -20.5 27.4 2.0 175 184 A M H << S+ 0 0 3 -4,-0.9 -1,-0.2 -3,-0.9 -2,-0.2 0.765 124.2 26.5 -83.0 -25.9 -22.0 24.3 3.6 176 185 A T H < S+ 0 0 0 -4,-1.4 210,-1.7 -3,-0.3 211,-0.4 0.809 140.1 14.6-103.3 -41.9 -18.9 22.2 3.0 177 186 A R S < S- 0 0 16 -4,-3.6 -2,-0.2 -5,-0.2 -1,-0.1 -0.547 80.7-161.6-135.9 67.3 -16.0 24.6 2.9 178 187 A P - 0 0 50 0, 0.0 -4,-0.1 0, 0.0 5,-0.1 -0.188 14.4-158.9 -54.3 137.4 -17.2 27.9 4.3 179 188 A D - 0 0 92 3,-0.1 -5,-0.1 0, 0.0 -6,-0.0 0.335 51.8-103.3 -97.7 4.0 -15.2 31.0 3.4 180 189 A G S S+ 0 0 66 2,-0.4 3,-0.1 -6,-0.1 -6,-0.0 0.177 97.1 111.2 96.4 -17.9 -16.7 32.8 6.4 181 190 A S S S+ 0 0 67 1,-0.2 2,-0.3 2,-0.0 -7,-0.0 0.665 89.4 7.1 -63.9 -17.6 -19.1 34.9 4.4 182 191 A M S S- 0 0 31 -8,-0.1 -2,-0.4 4,-0.0 -1,-0.2 -0.943 72.6-114.2-168.1 146.6 -21.9 32.9 5.9 183 192 A T > - 0 0 74 -2,-0.3 4,-2.3 -3,-0.1 5,-0.2 -0.209 37.9-108.4 -71.8 165.4 -22.9 30.2 8.4 184 193 A F H > S+ 0 0 15 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.913 122.0 57.6 -61.0 -40.5 -24.2 26.8 7.5 185 194 A A H > S+ 0 0 46 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.937 107.6 45.4 -53.4 -52.0 -27.6 28.1 8.8 186 195 A E H > S+ 0 0 96 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.902 113.2 48.8 -60.3 -45.6 -27.6 31.0 6.4 187 196 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.884 111.7 50.6 -64.8 -36.5 -26.6 28.9 3.4 188 197 A K H X S+ 0 0 31 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.940 109.0 50.7 -64.9 -47.9 -29.3 26.4 4.3 189 198 A E H X S+ 0 0 135 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.899 111.1 49.2 -56.5 -43.1 -31.9 29.0 4.6 190 199 A A H X S+ 0 0 24 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.886 109.3 51.4 -66.5 -38.3 -30.9 30.4 1.1 191 200 A L H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.951 113.7 44.9 -62.3 -46.4 -31.0 26.9 -0.4 192 201 A Y H X S+ 0 0 13 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.869 107.8 57.3 -64.6 -37.1 -34.5 26.5 1.0 193 202 A D H < S+ 0 0 120 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.847 110.0 47.4 -62.2 -32.1 -35.5 30.0 -0.1 194 203 A Y H X S+ 0 0 30 -4,-1.6 4,-0.7 -3,-0.2 -2,-0.2 0.918 114.8 43.9 -73.7 -45.0 -34.6 28.9 -3.6 195 204 A L H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.841 94.7 76.8 -71.0 -38.2 -36.4 25.5 -3.5 196 205 A I H X S+ 0 0 88 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.881 99.0 39.1 -43.1 -61.2 -39.7 26.6 -1.9 197 206 A P H > S+ 0 0 81 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.883 116.6 53.1 -60.6 -37.1 -41.4 28.2 -5.0 198 207 A I H X S+ 0 0 29 -4,-0.7 4,-1.3 2,-0.2 -2,-0.2 0.904 110.5 45.8 -63.9 -43.3 -40.1 25.6 -7.3 199 208 A I H X S+ 0 0 4 -4,-2.8 4,-1.9 2,-0.2 5,-0.3 0.911 111.4 53.5 -66.0 -43.7 -41.4 22.7 -5.2 200 209 A E H X S+ 0 0 124 -4,-2.3 4,-1.3 -5,-0.3 3,-0.3 0.937 111.1 44.9 -56.7 -49.1 -44.8 24.5 -4.9 201 210 A Q H X S+ 0 0 108 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.741 111.7 54.2 -70.3 -21.1 -45.1 24.9 -8.6 202 211 A R H < S+ 0 0 31 -4,-1.3 -1,-0.2 2,-0.2 -2,-0.2 0.783 106.3 48.9 -82.1 -30.4 -44.0 21.3 -9.2 203 212 A R H < S+ 0 0 81 -4,-1.9 -2,-0.2 -3,-0.3 -1,-0.2 0.797 114.3 50.8 -74.3 -30.0 -46.6 19.7 -6.9 204 213 A Q H < S+ 0 0 152 -4,-1.3 -2,-0.2 -5,-0.3 -3,-0.1 0.940 127.5 18.1 -71.2 -54.2 -49.1 21.9 -8.8 205 214 A K S < S- 0 0 163 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.1 -0.701 91.4-152.1-123.9 76.3 -48.1 20.9 -12.3 206 215 A P + 0 0 81 0, 0.0 -3,-0.1 0, 0.0 2,-0.1 -0.216 20.0 172.4 -55.7 127.9 -46.2 17.6 -11.9 207 216 A G - 0 0 31 -5,-0.2 207,-0.0 2,-0.1 -48,-0.0 -0.207 45.5 -90.0-115.8-154.4 -43.5 16.6 -14.4 208 217 A T S S+ 0 0 94 -2,-0.1 -49,-0.1 4,-0.1 2,-0.0 0.357 82.7 110.5-107.3 3.0 -40.8 13.9 -14.8 209 218 A D S > S- 0 0 24 -51,-0.1 4,-2.4 1,-0.1 -51,-0.2 -0.304 81.4-106.7 -77.7 164.2 -37.9 15.7 -13.1 210 219 A A H > S+ 0 0 8 -53,-2.7 4,-2.3 1,-0.2 5,-0.2 0.899 119.6 51.5 -55.6 -45.8 -36.3 14.7 -9.7 211 220 A I H > S+ 0 0 2 -53,-0.7 4,-3.1 1,-0.2 -1,-0.2 0.925 110.3 48.5 -60.0 -46.0 -37.9 17.7 -7.9 212 221 A S H > S+ 0 0 2 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.907 110.4 51.6 -61.1 -43.2 -41.4 16.8 -9.3 213 222 A I H < S+ 0 0 65 -4,-2.4 4,-0.3 2,-0.2 -1,-0.2 0.920 115.6 40.7 -60.7 -46.7 -41.0 13.2 -8.3 214 223 A V H >< S+ 0 0 0 -4,-2.3 3,-1.4 2,-0.2 -2,-0.2 0.963 114.9 51.1 -66.4 -51.5 -40.0 14.0 -4.7 215 224 A A H 3< S+ 0 0 1 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.823 120.0 35.3 -55.8 -36.9 -42.6 16.8 -4.4 216 225 A N T 3< S+ 0 0 66 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.311 101.1 115.4 -99.6 6.4 -45.4 14.6 -5.5 217 226 A G < - 0 0 11 -3,-1.4 7,-2.3 -4,-0.3 2,-0.4 -0.068 58.0-129.5 -76.1 174.8 -44.1 11.5 -3.9 218 227 A Q E -H 223 0C 124 5,-0.2 2,-0.6 -117,-0.1 -1,-0.1 -0.932 6.4-145.7-123.9 146.0 -45.3 9.2 -1.1 219 228 A V E > S-H 222 0C 0 3,-3.4 3,-1.9 -2,-0.4 -117,-0.1 -0.950 81.9 -30.8-114.6 110.9 -43.5 8.0 1.9 220 229 A N T 3 S- 0 0 128 -2,-0.6 -1,-0.2 -119,-0.3 -119,-0.1 0.895 130.6 -38.8 46.7 49.4 -44.5 4.5 2.9 221 230 A G T 3 S+ 0 0 62 1,-0.2 -1,-0.3 -3,-0.0 -3,-0.0 0.194 120.7 93.3 93.9 -20.1 -48.0 5.0 1.6 222 231 A R E < S-H 219 0C 92 -3,-1.9 -3,-3.4 1,-0.0 -1,-0.2 -0.873 81.7 -95.2-115.4 147.7 -48.7 8.7 2.6 223 232 A P E -H 218 0C 95 0, 0.0 -5,-0.2 0, 0.0 -6,-0.1 -0.282 39.6-122.7 -56.0 129.1 -48.2 12.0 0.7 224 233 A I - 0 0 4 -7,-2.3 2,-0.1 -10,-0.2 -122,-0.0 -0.414 30.3-119.1 -70.6 150.9 -44.9 13.7 1.5 225 234 A T > - 0 0 61 1,-0.1 4,-2.2 -2,-0.1 5,-0.2 -0.386 18.3-110.1 -88.3 171.0 -45.3 17.3 2.8 226 235 A S H > S+ 0 0 59 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.896 120.0 46.7 -65.7 -40.9 -44.0 20.5 1.3 227 236 A D H > S+ 0 0 75 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.873 111.9 49.6 -69.9 -39.3 -41.4 20.9 4.0 228 237 A E H > S+ 0 0 28 2,-0.2 4,-2.3 1,-0.2 -138,-0.2 0.906 110.5 51.1 -65.7 -41.2 -40.3 17.3 3.8 229 238 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.918 110.3 49.8 -62.1 -41.7 -39.9 17.6 0.0 230 239 A K H X S+ 0 0 21 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.936 110.7 48.9 -62.1 -45.8 -37.9 20.8 0.6 231 240 A R H X S+ 0 0 55 -4,-2.5 -141,-1.4 1,-0.2 4,-1.0 0.848 112.8 48.2 -63.9 -34.7 -35.6 19.0 3.1 232 241 A M H >X S+ 0 0 0 -4,-2.3 4,-2.2 -143,-0.2 3,-0.5 0.920 108.0 52.5 -72.9 -44.7 -35.1 16.0 0.7 233 242 A C H 3X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.3 -1,-0.2 0.813 105.7 57.4 -61.6 -27.3 -34.3 18.2 -2.3 234 243 A G H 3X S+ 0 0 0 -4,-1.4 4,-2.5 -5,-0.2 -1,-0.3 0.864 105.2 49.6 -70.1 -34.7 -31.7 19.9 -0.2 235 244 A A H X S+ 0 0 20 -4,-2.5 4,-1.0 1,-0.2 3,-0.5 0.898 115.1 47.9 -56.8 -41.0 -25.9 19.1 -1.7 239 248 A G H 3X>S+ 0 0 33 -4,-1.9 4,-0.9 1,-0.2 5,-0.5 0.946 113.4 39.7 -68.2 -52.5 -24.9 15.7 -3.0 240 249 A G H 3<5S+ 0 0 21 -4,-2.5 -86,-0.3 1,-0.2 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-64.8 -21.7 -48.0 19.0 -82.1 542 145 B Q G <4 S- 0 0 109 -3,-1.7 -2,-0.2 -4,-0.3 -3,-0.1 0.739 88.5-144.2 -65.8 -23.4 -46.7 21.9 -79.9 543 146 B G S << S+ 0 0 10 -3,-1.2 260,-2.3 -4,-0.6 2,-0.3 0.641 72.0 47.2 68.6 13.8 -43.6 20.0 -78.9 544 147 B Q E +Q 802 0H 122 -5,-0.5 2,-0.3 258,-0.3 258,-0.2 -0.974 56.0 168.6-173.5 162.4 -43.8 21.5 -75.4 545 148 B C E -Q 801 0H 9 256,-2.1 256,-2.9 -2,-0.3 2,-0.9 -0.965 42.2-113.3-175.2 162.4 -46.0 22.2 -72.4 546 149 B N E >> -Q 800 0H 79 -2,-0.3 4,-2.4 254,-0.2 3,-1.3 -0.830 37.6-159.4-105.2 84.6 -46.2 23.3 -68.8 547 150 B F H 3>>S+ 0 0 0 252,-1.7 5,-2.4 -2,-0.9 4,-1.6 0.736 81.1 58.1 -38.9 -41.0 -47.4 19.9 -67.6 548 151 B T H 34>S+ 0 0 11 1,-0.2 5,-1.3 3,-0.2 -1,-0.3 0.898 119.7 26.5 -63.8 -41.0 -48.9 21.2 -64.3 549 152 B E H <45S+ 0 0 117 -3,-1.3 -2,-0.2 3,-0.2 -1,-0.2 0.705 122.5 51.4 -94.9 -21.4 -51.3 23.7 -65.9 550 153 B D H <5S- 0 0 51 -4,-2.4 -3,-0.2 3,-0.1 -2,-0.2 0.682 135.1 -14.8 -89.6 -18.3 -51.8 22.1 -69.3 551 154 B Y T X5S+ 0 0 0 -4,-1.6 4,-2.5 -5,-0.3 -3,-0.2 0.475 120.8 65.6-146.1 -57.1 -52.7 18.6 -68.1 552 155 B A T 4 S+ 0 0 24 0, 0.0 4,-2.2 0, 0.0 5,-0.3 0.839 109.9 56.6 -54.0 -38.5 -57.3 20.4 -65.9 555 158 B F H X S+ 0 0 0 -4,-2.5 4,-1.3 2,-0.2 -3,-0.1 0.975 117.7 28.1 -60.9 -60.5 -57.6 16.6 -66.4 556 159 B P H > S+ 0 0 2 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.919 124.1 50.0 -68.2 -43.7 -58.4 15.5 -62.8 557 160 B I H X S+ 0 0 4 -4,-2.2 4,-3.2 -5,-0.2 5,-0.2 0.909 109.7 48.4 -63.6 -45.2 -60.1 18.7 -61.8 558 161 B R H X S+ 0 0 86 -4,-2.2 4,-1.7 -5,-0.4 -1,-0.2 0.854 111.4 51.1 -67.0 -31.6 -62.4 19.0 -64.8 559 162 B I H X S+ 0 0 2 -4,-1.3 4,-2.2 -5,-0.3 -1,-0.2 0.914 113.4 46.4 -68.7 -39.9 -63.4 15.3 -64.3 560 163 B F H X S+ 0 0 10 -4,-2.2 4,-2.6 86,-0.2 5,-0.2 0.947 111.0 49.4 -67.4 -48.3 -64.1 16.2 -60.7 561 164 B M H X>S+ 0 0 1 -4,-3.2 5,-2.6 1,-0.2 4,-1.0 0.850 111.8 51.4 -59.1 -33.4 -66.1 19.4 -61.4 562 165 B L H <5S+ 0 0 76 -4,-1.7 3,-0.2 -5,-0.2 -1,-0.2 0.932 112.1 44.9 -68.1 -45.5 -68.1 17.4 -64.0 563 166 B L H <5S+ 0 0 21 -4,-2.2 53,-3.0 1,-0.2 -2,-0.2 0.832 117.3 45.4 -65.7 -35.6 -68.9 14.7 -61.4 564 167 B A H <5S- 0 0 2 -4,-2.6 53,-0.5 51,-0.2 -1,-0.2 0.610 108.3-125.7 -85.0 -12.8 -69.7 17.3 -58.8 565 168 B G T <5 + 0 0 36 -4,-1.0 -3,-0.2 -5,-0.2 -4,-0.1 0.875 59.2 145.3 70.4 36.8 -71.8 19.3 -61.2 566 169 B L < - 0 0 9 -5,-2.6 -1,-0.2 -6,-0.1 -2,-0.1 -0.894 54.0-105.6-111.8 139.6 -69.8 22.5 -60.5 567 170 B P > - 0 0 61 0, 0.0 3,-1.7 0, 0.0 4,-0.2 -0.301 21.7-130.8 -61.0 139.3 -69.0 25.2 -63.1 568 171 B E G > S+ 0 0 99 1,-0.3 3,-1.4 2,-0.2 -7,-0.0 0.707 103.0 71.5 -64.6 -20.5 -65.4 25.3 -64.3 569 172 B E G 3 S+ 0 0 165 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.675 90.8 62.0 -70.2 -13.6 -65.2 29.0 -63.7 570 173 B D G <> S+ 0 0 43 -3,-1.7 4,-2.4 1,-0.2 -1,-0.3 0.591 78.9 90.7 -85.8 -11.3 -65.1 28.1 -60.0 571 174 B I H <> S+ 0 0 33 -3,-1.4 4,-3.2 1,-0.2 5,-0.4 0.897 80.2 53.6 -52.9 -51.2 -61.9 26.2 -60.3 572 175 B P H > S+ 0 0 94 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.928 113.5 44.1 -52.9 -45.4 -59.4 29.0 -59.6 573 176 B H H > S+ 0 0 96 -4,-0.3 4,-2.1 -3,-0.2 -2,-0.2 0.939 117.5 43.6 -64.8 -48.5 -61.2 29.8 -56.3 574 177 B L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.874 113.6 50.0 -66.6 -40.1 -61.6 26.2 -55.2 575 178 B K H X S+ 0 0 16 -4,-3.2 4,-2.7 -5,-0.2 -1,-0.2 0.916 109.9 52.4 -65.9 -41.4 -58.1 25.2 -56.1 576 179 B Y H X S+ 0 0 83 -4,-2.0 4,-1.3 -5,-0.4 -2,-0.2 0.941 112.1 44.2 -58.1 -50.4 -56.7 28.2 -54.2 577 180 B L H X S+ 0 0 0 -4,-2.1 4,-0.9 1,-0.2 3,-0.3 0.895 113.4 52.0 -61.3 -41.2 -58.6 27.3 -51.1 578 181 B T H >X S+ 0 0 0 -4,-2.4 4,-0.8 1,-0.2 3,-0.8 0.894 104.9 55.7 -63.6 -39.3 -57.6 23.7 -51.5 579 182 B D H 3X S+ 0 0 44 -4,-2.7 4,-2.8 1,-0.2 3,-0.4 0.806 102.1 57.4 -63.2 -30.2 -54.0 24.6 -51.8 580 183 B Q H 3< S+ 0 0 7 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.757 102.6 54.4 -74.1 -22.1 -54.1 26.4 -48.5 581 184 B M H << S+ 0 0 2 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.686 123.6 24.4 -83.3 -18.2 -55.2 23.3 -46.7 582 185 B T H < S+ 0 0 0 -4,-0.8 210,-1.7 -3,-0.4 211,-0.5 0.762 141.6 11.5-113.5 -39.7 -52.3 21.2 -47.9 583 186 B R S < S- 0 0 19 -4,-2.8 -2,-0.2 208,-0.2 -3,-0.1 -0.442 80.1-163.2-140.6 61.2 -49.4 23.6 -48.8 584 187 B P - 0 0 43 0, 0.0 -4,-0.1 0, 0.0 5,-0.1 -0.123 17.0-154.4 -51.3 136.3 -50.4 27.0 -47.3 585 188 B D - 0 0 105 3,-0.0 -5,-0.1 0, 0.0 -6,-0.0 0.425 53.2-101.7 -90.4 -0.9 -48.5 30.1 -48.6 586 189 B G S S+ 0 0 65 2,-0.4 3,-0.0 -6,-0.1 -6,-0.0 0.095 101.5 104.7 103.5 -22.1 -49.3 31.8 -45.3 587 190 B S S S+ 0 0 69 1,-0.1 2,-0.3 2,-0.0 -7,-0.0 0.699 87.7 28.4 -64.3 -20.1 -52.2 34.0 -46.6 588 191 B M S S- 0 0 50 -8,-0.1 -2,-0.4 -11,-0.0 2,-0.1 -1.000 72.0-133.8-146.5 142.2 -54.7 31.7 -45.0 589 192 B T > - 0 0 78 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.468 38.1-107.5 -84.6 163.5 -54.9 29.4 -41.9 590 193 B F H > S+ 0 0 15 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.958 121.4 54.1 -56.0 -49.6 -56.5 26.0 -42.4 591 194 B A H > S+ 0 0 28 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.859 108.2 48.1 -51.9 -42.5 -59.5 27.2 -40.5 592 195 B E H > S+ 0 0 92 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.890 111.0 50.6 -68.8 -38.9 -60.0 30.1 -42.8 593 196 B A H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.895 110.5 50.6 -65.4 -38.2 -59.6 28.0 -45.8 594 197 B K H X S+ 0 0 33 -4,-2.7 4,-3.0 -5,-0.2 5,-0.3 0.971 109.9 49.2 -62.4 -53.3 -62.2 25.6 -44.4 595 198 B E H X S+ 0 0 123 -4,-2.4 4,-2.9 1,-0.3 -2,-0.2 0.902 110.5 50.5 -50.8 -49.2 -64.7 28.4 -43.7 596 199 B A H X S+ 0 0 23 -4,-2.3 4,-1.5 2,-0.2 -1,-0.3 0.871 112.1 47.8 -59.8 -37.8 -64.3 29.7 -47.2 597 200 B L H X S+ 0 0 0 -4,-1.9 4,-2.2 -3,-0.2 -2,-0.2 0.917 113.4 47.1 -70.1 -42.6 -64.9 26.2 -48.7 598 201 B Y H X S+ 0 0 14 -4,-3.0 4,-3.0 1,-0.2 -2,-0.2 0.881 108.3 55.8 -65.4 -37.1 -68.0 25.7 -46.5 599 202 B D H < S+ 0 0 119 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.870 109.4 47.5 -62.7 -36.2 -69.3 29.2 -47.4 600 203 B Y H X S+ 0 0 32 -4,-1.5 4,-0.7 -5,-0.2 -2,-0.2 0.917 116.7 43.6 -69.2 -44.5 -69.1 28.1 -51.1 601 204 B L H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.858 95.9 73.3 -72.1 -40.5 -70.8 24.8 -50.4 602 205 B I H X S+ 0 0 88 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.875 100.3 42.0 -45.3 -54.3 -73.7 25.8 -48.1 603 206 B P H > S+ 0 0 79 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.906 115.4 51.6 -62.4 -40.2 -75.9 27.5 -50.7 604 207 B I H X S+ 0 0 28 -4,-0.7 4,-2.2 1,-0.2 -2,-0.2 0.881 108.3 50.8 -63.3 -40.7 -75.2 24.8 -53.2 605 208 B I H X S+ 0 0 3 -4,-2.6 4,-0.9 1,-0.2 -1,-0.2 0.870 110.3 50.1 -66.4 -37.5 -76.1 22.0 -50.8 606 209 B E H X S+ 0 0 89 -4,-1.8 4,-1.1 -5,-0.3 3,-0.4 0.896 109.1 50.8 -69.0 -40.3 -79.4 23.7 -50.0 607 210 B Q H >X S+ 0 0 97 -4,-2.1 4,-2.0 1,-0.2 3,-0.8 0.957 112.2 47.7 -61.4 -47.9 -80.4 24.2 -53.6 608 211 B R H 3< S+ 0 0 18 -4,-2.2 5,-0.3 1,-0.3 -1,-0.2 0.635 103.4 59.6 -70.3 -15.9 -79.7 20.5 -54.4 609 212 B R H 3< S+ 0 0 72 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.770 112.1 42.6 -78.9 -26.7 -81.7 19.2 -51.3 610 213 B Q H << S+ 0 0 137 -4,-1.1 -2,-0.2 -3,-0.8 -1,-0.1 0.811 126.4 30.8 -84.7 -36.5 -84.7 21.0 -52.9 611 214 B K S < S- 0 0 163 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.1 -0.619 87.7-149.2-125.6 71.5 -84.0 19.9 -56.5 612 215 B P + 0 0 85 0, 0.0 2,-0.1 0, 0.0 -3,-0.1 -0.095 24.5 177.2 -43.5 122.3 -82.3 16.5 -56.2 613 216 B G - 0 0 36 -5,-0.3 -5,-0.0 2,-0.1 0, 0.0 -0.288 41.3-103.2-114.2-159.4 -80.0 15.9 -59.2 614 217 B T S S+ 0 0 139 -2,-0.1 -49,-0.1 4,-0.1 5,-0.0 0.535 80.6 106.2-106.4 -12.9 -77.5 13.4 -60.4 615 218 B D S > S- 0 0 27 -51,-0.1 4,-2.3 1,-0.1 -51,-0.2 -0.165 83.0-104.8 -68.5 164.0 -74.3 15.1 -59.4 616 219 B A H > S+ 0 0 4 -53,-3.0 4,-1.9 1,-0.2 -52,-0.2 0.861 118.4 49.8 -57.8 -42.9 -72.0 14.1 -56.5 617 220 B I H > S+ 0 0 8 -53,-0.5 4,-3.1 2,-0.2 -1,-0.2 0.912 110.9 49.7 -66.3 -40.4 -73.1 16.9 -54.2 618 221 B S H > S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.918 109.4 52.1 -63.3 -41.8 -76.8 16.2 -54.8 619 222 B I H < S+ 0 0 61 -4,-2.3 4,-0.2 1,-0.2 -1,-0.2 0.886 114.8 42.3 -61.8 -39.5 -76.2 12.5 -54.1 620 223 B V H >< S+ 0 0 0 -4,-1.9 3,-1.0 -5,-0.2 -2,-0.2 0.944 113.7 50.6 -72.1 -48.5 -74.5 13.4 -50.8 621 224 B A H 3< S+ 0 0 1 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.779 119.1 36.7 -61.5 -30.8 -76.9 16.1 -49.7 622 225 B N T 3< S+ 0 0 67 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.365 99.6 115.2-102.2 3.1 -80.0 13.9 -50.3 623 226 B G < - 0 0 11 -3,-1.0 7,-2.0 -4,-0.2 2,-0.4 -0.069 60.0-126.5 -72.5 170.8 -78.2 10.8 -49.1 624 227 B Q E -S 629 0I 121 5,-0.2 2,-0.7 -116,-0.0 -1,-0.1 -0.931 4.5-146.4-119.5 143.1 -78.9 8.5 -46.1 625 228 B V E > S-S 628 0I 0 3,-2.9 3,-1.0 -2,-0.4 -117,-0.1 -0.908 83.8 -33.5-109.5 100.8 -76.5 7.5 -43.4 626 229 B N T 3 S- 0 0 119 -2,-0.7 -1,-0.2 -119,-0.4 -118,-0.1 0.916 128.3 -37.1 52.2 53.5 -77.5 4.0 -42.4 627 230 B G T 3 S+ 0 0 65 1,-0.2 -1,-0.2 -3,-0.0 -3,-0.0 0.368 121.4 91.0 87.6 -7.3 -81.2 4.5 -42.9 628 231 B R E < S-S 625 0I 73 -3,-1.0 -3,-2.9 1,-0.0 -1,-0.2 -0.925 83.1 -91.6-124.7 151.8 -81.6 8.1 -41.6 629 232 B P E -S 624 0I 97 0, 0.0 -5,-0.2 0, 0.0 2,-0.2 -0.274 37.2-125.1 -58.9 135.6 -81.4 11.5 -43.5 630 233 B I - 0 0 3 -7,-2.0 2,-0.1 -10,-0.1 -122,-0.0 -0.536 30.5-121.9 -76.2 150.1 -78.0 13.1 -43.6 631 234 B T > - 0 0 59 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.462 18.1-111.3 -89.9 167.5 -78.1 16.6 -42.2 632 235 B S H > S+ 0 0 50 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.883 119.9 50.7 -64.8 -37.2 -77.1 19.7 -44.1 633 236 B D H > S+ 0 0 76 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.885 110.2 48.5 -67.6 -40.6 -74.1 20.2 -41.8 634 237 B E H > S+ 0 0 24 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.889 110.8 51.1 -66.1 -39.8 -72.9 16.6 -42.3 635 238 B A H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.863 109.0 51.8 -65.2 -37.4 -73.3 16.9 -46.1 636 239 B K H X S+ 0 0 32 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.959 111.0 46.2 -63.2 -51.5 -71.2 20.0 -46.1 637 240 B R H X S+ 0 0 43 -4,-2.1 -141,-1.7 1,-0.2 4,-1.4 0.797 113.7 50.1 -62.9 -30.0 -68.4 18.3 -44.1 638 241 B M H X S+ 0 0 1 -4,-1.8 4,-2.0 -143,-0.2 -1,-0.2 0.905 108.9 50.0 -75.6 -42.3 -68.6 15.3 -46.4 639 242 B C H X S+ 0 0 3 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.825 105.5 60.6 -64.2 -29.1 -68.4 17.4 -49.6 640 243 B G H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.959 105.1 45.3 -62.0 -50.0 -65.4 19.1 -48.0 641 244 B A H X S+ 0 0 21 -4,-1.4 4,-1.7 -145,-0.3 5,-0.2 0.894 112.4 53.6 -60.4 -38.8 -63.5 15.9 -47.8 642 245 B L H X S+ 0 0 22 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.914 109.2 46.6 -63.2 -44.6 -64.6 15.1 -51.4 643 246 B L H X S+ 0 0 3 -4,-2.5 4,-2.1 2,-0.2 5,-0.4 0.909 107.2 57.2 -65.1 -43.2 -63.3 18.4 -52.8 644 247 B L H X>S+ 0 0 18 -4,-2.2 4,-1.5 1,-0.2 5,-0.6 0.930 115.8 36.2 -54.9 -46.9 -59.9 18.2 -51.0 645 248 B G H <>S+ 0 0 32 -4,-1.7 5,-0.7 1,-0.2 4,-0.4 0.896 117.6 49.7 -75.2 -41.0 -59.2 14.8 -52.6 646 249 B G H <5S+ 0 0 18 -4,-2.6 -86,-0.2 -5,-0.2 -2,-0.2 0.732 118.3 38.4 -72.1 -19.7 -60.7 15.5 -56.0 647 250 B L H <5S+ 0 0 3 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.775 126.2 20.9-101.4 -28.8 -59.0 18.8 -56.5 648 251 B D T X5S+ 0 0 0 -4,-1.5 4,-1.6 -5,-0.4 5,-0.2 0.847 106.7 58.0-112.0 -44.2 -55.5 18.4 -55.1 649 252 B T H > S+ 0 0 3 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.938 109.6 36.4 -47.5 -56.1 -53.1 16.6 -59.8 652 255 B N H X S+ 0 0 11 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.866 112.5 58.0 -71.4 -34.9 -49.8 16.5 -58.0 653 256 B F H X S+ 0 0 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