==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 13-NOV-00 1GEM . COMPND 2 MOLECULE: CYTOCHROME P450CAM; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR D.-S.LEE,S.-Y.PARK,K.YAMANE,Y.SHIRO . 405 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17230.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 274 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 7.9 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 . 2 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 . 15 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 153 37.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 1 2 0 0 2 0 2 1 1 1 0 1 0 1 0 0 1 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 4 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 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 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 0 192 0, 0.0 2,-0.4 0, 0.0 49,-0.4 0.000 360.0 360.0 360.0 94.7 46.7 25.9 32.4 2 11 A L - 0 0 80 47,-0.1 47,-0.2 48,-0.1 3,-0.1 -0.759 360.0-129.0 -97.9 140.4 44.9 23.9 29.8 3 12 A A - 0 0 23 45,-3.1 -1,-0.0 -2,-0.4 46,-0.0 -0.659 39.0 -90.7 -86.8 142.2 41.1 24.2 29.2 4 13 A P - 0 0 121 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.215 49.7-102.2 -53.0 135.5 39.0 20.9 29.2 5 14 A L - 0 0 59 1,-0.1 6,-0.1 -3,-0.1 43,-0.0 -0.398 36.3-120.3 -64.1 126.5 38.7 19.5 25.7 6 15 A P > - 0 0 32 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.360 24.8-110.7 -67.0 147.6 35.3 20.2 24.1 7 16 A P T 3 S+ 0 0 141 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.787 113.7 53.8 -47.2 -38.1 33.1 17.1 23.1 8 17 A H T 3 S+ 0 0 41 2,-0.1 294,-0.2 1,-0.0 -3,-0.0 0.476 86.2 96.6 -82.4 -0.6 33.5 17.7 19.4 9 18 A V S < S- 0 0 9 -3,-2.0 2,-0.2 292,-0.1 5,-0.1 -0.799 71.0-137.4 -96.0 115.6 37.3 17.8 19.4 10 19 A P > - 0 0 50 0, 0.0 3,-2.3 0, 0.0 4,-0.2 -0.507 15.4-132.5 -68.2 130.7 39.1 14.4 18.5 11 20 A E G > S+ 0 0 168 1,-0.3 3,-1.1 -2,-0.2 35,-0.1 0.702 103.0 65.3 -60.7 -18.7 42.0 13.9 20.9 12 21 A H G 3 S+ 0 0 147 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.585 97.8 56.7 -78.8 -6.9 44.3 13.0 18.0 13 22 A L G < S+ 0 0 15 -3,-2.3 33,-2.5 28,-0.1 2,-0.3 0.339 83.7 114.5-101.1 4.2 43.9 16.6 16.8 14 23 A V B < +a 46 0A 36 -3,-1.1 2,-0.3 31,-0.2 33,-0.2 -0.614 29.6 159.5 -82.3 133.0 45.1 18.0 20.1 15 24 A F - 0 0 59 31,-2.9 2,-1.7 -2,-0.3 30,-0.1 -0.804 32.7-142.2-152.5 103.2 48.3 20.0 20.1 16 25 A D + 0 0 58 -2,-0.3 2,-0.4 31,-0.2 31,-0.1 -0.498 33.6 163.8 -76.6 84.1 48.8 22.4 23.1 17 26 A F - 0 0 8 -2,-1.7 2,-0.7 32,-0.1 32,-0.3 -0.847 26.8-151.2-101.4 132.0 50.5 25.4 21.6 18 27 A D > - 0 0 43 -2,-0.4 3,-1.3 3,-0.2 -2,-0.0 -0.899 2.9-163.5-107.3 106.7 50.5 28.6 23.5 19 28 A M T 3 S+ 0 0 0 -2,-0.7 -1,-0.1 1,-0.3 14,-0.0 0.688 90.9 50.4 -61.5 -19.2 50.7 31.6 21.2 20 29 A Y T 3 S+ 0 0 40 1,-0.2 364,-0.4 -3,-0.1 -1,-0.3 0.564 128.9 17.4 -96.0 -10.3 51.7 33.9 24.0 21 30 A N S < S- 0 0 102 -3,-1.3 -1,-0.2 362,-0.1 -3,-0.2 -0.371 78.6-172.0-158.8 70.4 54.5 31.7 25.2 22 31 A P > - 0 0 2 0, 0.0 3,-1.0 0, 0.0 11,-0.1 -0.297 29.8-117.6 -66.8 154.1 55.6 29.0 22.7 23 32 A S T 3 S+ 0 0 117 1,-0.2 3,-0.5 9,-0.2 9,-0.1 0.904 106.2 43.5 -57.8 -55.6 58.1 26.3 23.7 24 33 A N T > S+ 0 0 89 8,-0.3 3,-1.7 1,-0.2 4,-0.4 -0.006 71.1 132.0 -86.9 32.7 61.1 26.9 21.5 25 34 A L G X + 0 0 34 -3,-1.0 3,-1.9 1,-0.3 357,-0.3 0.823 63.7 65.3 -52.6 -35.4 61.0 30.7 22.0 26 35 A S G 3 S+ 0 0 123 -3,-0.5 -1,-0.3 1,-0.3 3,-0.1 0.818 96.4 56.9 -58.2 -31.9 64.8 30.7 22.7 27 36 A A G < S- 0 0 56 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.551 131.1 -74.4 -76.4 -8.1 65.4 29.6 19.1 28 37 A G <> - 0 0 7 -3,-1.9 4,-2.1 -4,-0.4 -1,-0.3 -0.233 40.5 -99.2 122.0 146.6 63.6 32.6 17.7 29 38 A V H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.915 121.6 48.7 -66.5 -43.0 59.9 33.4 17.6 30 39 A Q H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.927 113.7 48.6 -61.9 -42.3 59.4 32.3 13.9 31 40 A E H 4 S+ 0 0 60 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.879 108.5 54.9 -63.1 -38.5 61.2 29.0 14.7 32 41 A A H >< S+ 0 0 1 -4,-2.1 3,-0.8 1,-0.2 -8,-0.3 0.898 111.4 43.0 -62.4 -42.4 59.1 28.5 17.8 33 42 A W H >< S+ 0 0 0 -4,-2.1 3,-2.1 1,-0.2 -1,-0.2 0.819 101.0 70.9 -73.2 -32.3 55.9 28.8 15.7 34 43 A A G >< S+ 0 0 22 -4,-2.0 3,-1.6 1,-0.3 -1,-0.2 0.571 76.2 80.3 -63.2 -9.8 57.3 26.6 12.9 35 44 A V G X S+ 0 0 32 -3,-0.8 3,-1.7 -4,-0.4 -1,-0.3 0.797 80.9 69.0 -67.0 -23.4 57.0 23.6 15.1 36 45 A L G < S+ 0 0 0 -3,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.632 95.4 55.3 -67.3 -13.4 53.3 23.6 14.2 37 46 A Q G < S+ 0 0 8 -3,-1.6 -1,-0.3 -4,-0.1 -2,-0.2 0.222 79.2 122.4-105.4 14.2 54.5 22.6 10.7 38 47 A E S X S- 0 0 103 -3,-1.7 3,-2.2 1,-0.1 -3,-0.0 -0.408 77.6-107.7 -73.2 154.3 56.4 19.5 11.7 39 48 A S T 3 S+ 0 0 124 1,-0.3 -1,-0.1 -2,-0.1 -3,-0.0 0.785 116.9 59.8 -52.6 -33.9 55.4 16.2 10.1 40 49 A N T 3 S+ 0 0 116 2,-0.0 -1,-0.3 1,-0.0 -4,-0.0 0.553 91.3 84.5 -75.0 -6.7 53.8 14.9 13.3 41 50 A V S < S- 0 0 6 -3,-2.2 -28,-0.1 -6,-0.1 4,-0.1 -0.850 78.3-129.2-103.7 125.4 51.4 17.8 13.5 42 51 A P - 0 0 47 0, 0.0 3,-0.1 0, 0.0 15,-0.1 -0.162 26.5-109.6 -62.9 165.1 48.1 17.7 11.5 43 52 A D S S+ 0 0 55 1,-0.2 14,-3.0 13,-0.1 15,-0.5 0.788 109.0 34.3 -66.5 -29.2 47.1 20.6 9.2 44 53 A L E S+ B 0 56A 6 12,-0.2 2,-0.3 13,-0.1 -1,-0.2 -0.982 79.3 169.7-130.8 117.5 44.4 21.7 11.6 45 54 A V E - B 0 55A 0 10,-2.2 10,-2.2 -2,-0.4 2,-0.4 -0.776 27.7-132.0-125.6 171.1 44.8 21.3 15.3 46 55 A W E -aB 14 54A 10 -33,-2.5 -31,-2.9 -2,-0.3 2,-0.4 -0.984 16.8-160.6-124.0 131.8 43.2 22.3 18.6 47 56 A T E - B 0 53A 0 6,-2.8 6,-1.9 -2,-0.4 -31,-0.2 -0.905 14.0-153.0-113.3 142.9 45.1 23.7 21.5 48 57 A R > + 0 0 80 -2,-0.4 -45,-3.1 4,-0.2 3,-0.5 0.435 67.4 100.8 -91.3 -1.1 43.8 23.8 25.1 49 58 A C G > S+ 0 0 13 -32,-0.3 3,-2.3 1,-0.2 -2,-0.1 -0.377 79.4 20.8 -80.2 163.1 45.8 26.9 26.0 50 59 A N G 3 S- 0 0 46 -49,-0.4 31,-0.3 1,-0.3 -1,-0.2 0.842 141.8 -48.5 47.2 42.1 44.4 30.3 26.1 51 60 A G G < S- 0 0 62 -3,-0.5 -1,-0.3 -50,-0.3 -2,-0.1 0.159 101.9 -72.3 90.1 -19.6 40.8 29.0 26.5 52 61 A G < + 0 0 6 -3,-2.3 256,-0.3 1,-0.1 2,-0.3 0.476 65.0 158.1 99.0 120.3 41.0 26.5 23.7 53 62 A H E -B 47 0A 1 -6,-1.9 -6,-2.8 254,-0.1 256,-0.2 -0.981 37.8 -98.5-165.1 163.6 40.9 27.2 20.0 54 63 A W E -Bc 46 309A 0 254,-2.4 256,-3.2 -2,-0.3 2,-0.4 -0.461 27.5-159.1 -85.9 161.3 41.8 25.8 16.6 55 64 A I E -Bc 45 310A 0 -10,-2.2 -10,-2.2 254,-0.2 2,-0.5 -0.961 9.7-146.8-144.4 122.4 44.9 26.6 14.7 56 65 A A E -B 44 0A 0 254,-2.1 -12,-0.2 -2,-0.4 259,-0.1 -0.809 14.2-172.5 -88.4 127.9 45.4 26.2 10.9 57 66 A T + 0 0 0 -14,-3.0 2,-0.4 -2,-0.5 -13,-0.1 0.376 55.5 73.2-104.5 3.6 49.0 25.3 10.3 58 67 A R S > S- 0 0 6 -15,-0.5 4,-2.4 1,-0.1 3,-0.2 -0.938 74.6-129.7-123.7 145.4 49.2 25.4 6.5 59 68 A G H > S+ 0 0 0 -2,-0.4 4,-2.4 257,-0.3 5,-0.2 0.841 107.1 56.3 -56.1 -38.8 49.2 28.3 4.0 60 69 A Q H > S+ 0 0 105 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.922 111.4 42.4 -61.2 -45.8 46.5 26.8 1.9 61 70 A L H > S+ 0 0 3 -3,-0.2 4,-2.6 2,-0.2 5,-0.2 0.885 112.2 53.9 -69.3 -39.7 44.1 26.5 4.8 62 71 A I H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.924 111.1 46.0 -61.4 -43.6 45.0 30.0 6.2 63 72 A R H X S+ 0 0 48 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.892 112.2 51.1 -65.4 -42.1 44.2 31.6 2.8 64 73 A E H >X S+ 0 0 70 -4,-1.9 4,-1.9 -5,-0.2 3,-0.6 0.945 110.5 47.9 -61.1 -49.7 41.0 29.7 2.4 65 74 A A H 3< S+ 0 0 0 -4,-2.6 7,-0.3 1,-0.2 -1,-0.2 0.896 111.2 51.2 -59.6 -41.6 39.7 30.7 5.8 66 75 A Y H 3< S+ 0 0 7 -4,-2.0 279,-0.5 -5,-0.2 -1,-0.2 0.720 110.8 48.7 -69.8 -21.5 40.6 34.3 5.2 67 76 A E H << S+ 0 0 120 -4,-1.2 2,-1.2 -3,-0.6 -1,-0.2 0.786 101.2 68.2 -86.3 -29.5 38.7 34.3 1.9 68 77 A D >X + 0 0 34 -4,-1.9 4,-2.1 1,-0.2 3,-0.6 -0.622 51.9 160.0 -94.0 77.8 35.6 32.7 3.4 69 78 A Y T 34 + 0 0 78 -2,-1.2 -1,-0.2 1,-0.2 5,-0.1 0.618 65.8 75.1 -73.6 -10.9 34.2 35.4 5.7 70 79 A R T 34 S+ 0 0 173 1,-0.1 -1,-0.2 -3,-0.1 3,-0.2 0.915 113.5 20.3 -66.0 -42.3 30.8 33.7 5.6 71 80 A H T <4 S+ 0 0 49 -3,-0.6 222,-2.2 1,-0.2 2,-0.8 0.784 127.9 50.5 -95.2 -34.9 32.0 30.9 7.9 72 81 A F E < S-D 292 0A 1 -4,-2.1 -1,-0.2 -7,-0.3 220,-0.2 -0.857 79.0-167.2-109.7 96.8 35.0 32.7 9.5 73 82 A S E > -D 291 0A 4 218,-2.9 218,-2.4 -2,-0.8 3,-0.6 -0.568 26.5-141.8 -89.5 150.5 33.9 36.1 10.8 74 83 A S T 3 S+ 0 0 0 -2,-0.2 -1,-0.1 1,-0.2 4,-0.1 0.450 78.4 102.0 -83.6 -3.6 36.1 39.0 11.9 75 84 A E T 3 S+ 0 0 122 1,-0.3 -1,-0.2 216,-0.2 18,-0.1 0.841 95.6 25.9 -49.4 -38.0 33.6 39.8 14.7 76 85 A C S < S+ 0 0 1 -3,-0.6 -1,-0.3 1,-0.1 8,-0.2 -0.752 75.1 155.9-129.8 81.9 35.9 38.1 17.2 77 86 A P + 0 0 1 0, 0.0 212,-3.0 0, 0.0 2,-0.3 0.573 49.3 74.8 -86.3 -11.8 39.5 38.3 15.8 78 87 A F S S- 0 0 16 210,-0.2 6,-0.8 3,-0.2 7,-0.1 -0.819 75.4-112.9-110.6 148.4 41.6 38.0 18.9 79 88 A I S S+ 0 0 2 -2,-0.3 2,-0.2 4,-0.2 -28,-0.1 -0.945 91.7 51.7-115.6 137.3 42.4 35.1 21.2 80 89 A P S >> S- 0 0 28 0, 0.0 4,-2.1 0, 0.0 3,-1.4 0.530 90.1-124.1 -71.3 165.3 41.6 34.7 24.1 81 90 A R H 3> S+ 0 0 80 -31,-0.3 4,-3.1 1,-0.3 5,-0.3 0.823 109.7 60.6 -45.0 -45.2 37.8 35.2 23.6 82 91 A E H 3> S+ 0 0 129 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.892 109.7 43.8 -53.0 -41.2 37.7 38.0 26.2 83 92 A A H <> S+ 0 0 8 -3,-1.4 4,-1.3 2,-0.2 -2,-0.2 0.938 113.6 49.4 -69.7 -48.7 40.2 39.9 24.0 84 93 A G H < S+ 0 0 0 -4,-2.1 -2,-0.2 -6,-0.8 -1,-0.2 0.842 113.8 47.8 -59.7 -33.2 38.4 39.1 20.8 85 94 A E H < S+ 0 0 132 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.893 111.1 47.3 -75.7 -41.9 35.1 40.2 22.4 86 95 A A H < S+ 0 0 19 -4,-2.1 2,-0.4 -5,-0.3 -1,-0.2 0.682 93.6 102.0 -71.7 -16.4 36.4 43.5 23.8 87 96 A Y < + 0 0 14 -4,-1.3 -9,-0.1 -5,-0.1 98,-0.0 -0.558 33.8 149.4 -71.8 121.4 37.9 44.0 20.3 88 97 A D + 0 0 35 -2,-0.4 -1,-0.1 143,-0.1 143,-0.1 0.109 16.5 147.7-141.8 23.2 35.8 46.4 18.3 89 98 A F > - 0 0 4 145,-0.1 4,-2.5 3,-0.1 143,-0.2 -0.321 48.3 -98.8 -64.0 142.5 38.3 48.2 16.0 90 99 A I T 4 S+ 0 0 0 141,-1.3 145,-0.3 1,-0.2 -2,-0.1 -0.904 94.5 5.0-109.0 139.5 37.0 49.3 12.6 91 100 A P T >4 S+ 0 0 8 0, 0.0 3,-1.7 0, 0.0 -1,-0.2 -0.982 124.0 60.6 -92.6 4.0 37.3 47.9 9.9 92 101 A T T 34 S+ 0 0 33 1,-0.3 -2,-0.2 140,-0.1 -3,-0.1 0.779 102.3 53.5 -63.3 -28.4 39.0 44.8 11.2 93 102 A S T 3< S+ 0 0 20 -4,-2.5 2,-0.3 -18,-0.1 -1,-0.3 0.325 101.4 79.8 -89.2 10.5 36.1 43.7 13.5 94 103 A M < - 0 0 13 -3,-1.7 -6,-0.0 -5,-0.1 -5,-0.0 -0.873 66.6-144.1-119.4 152.5 33.7 43.9 10.6 95 104 A D >> - 0 0 35 -2,-0.3 4,-1.7 1,-0.1 3,-0.5 -0.708 44.0 -57.9-106.6 157.9 32.8 41.6 7.7 96 105 A P T 34 S+ 0 0 24 0, 0.0 -1,-0.1 0, 0.0 249,-0.0 -0.352 112.4 32.3 -68.2 160.8 31.9 42.7 4.2 97 106 A P T 3> S+ 0 0 110 0, 0.0 4,-0.6 0, 0.0 3,-0.5 -0.991 127.5 44.9 -80.3 -12.1 29.9 44.4 2.8 98 107 A E H X> S+ 0 0 118 -3,-0.5 3,-1.0 1,-0.2 4,-0.8 0.913 109.1 57.4 -53.8 -49.7 29.9 46.6 5.9 99 108 A Q H 3X S+ 0 0 5 -4,-1.7 4,-2.6 1,-0.2 3,-0.4 0.839 93.2 70.7 -51.0 -41.3 33.7 46.6 6.2 100 109 A R H 3> S+ 0 0 166 -3,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.815 94.0 51.8 -48.5 -44.1 34.1 48.0 2.7 101 110 A Q H X S+ 0 0 4 -4,-1.0 4,-0.7 -3,-0.2 3,-0.6 0.902 111.4 51.2 -69.8 -44.0 37.9 56.0 4.5 106 115 A A H >X S+ 0 0 4 -4,-2.5 4,-1.5 1,-0.3 3,-0.9 0.855 104.7 58.0 -62.3 -35.4 40.9 54.5 6.3 107 116 A N H 3X S+ 0 0 70 -4,-2.2 4,-1.8 1,-0.2 -1,-0.3 0.797 96.2 65.5 -64.9 -26.6 42.6 54.1 2.9 108 117 A Q H << S+ 0 0 129 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.812 108.2 38.0 -64.4 -31.8 42.2 57.9 2.5 109 118 A V H << S+ 0 0 4 -3,-0.9 -2,-0.2 -4,-0.7 -1,-0.2 0.735 132.0 20.4 -94.7 -25.8 44.5 58.5 5.5 110 119 A V H < S+ 0 0 14 -4,-1.5 243,-0.4 100,-0.1 242,-0.2 0.359 95.6 115.6-124.5 3.9 47.2 55.8 5.1 111 120 A G S >X S- 0 0 0 -4,-1.8 4,-1.6 -5,-0.3 3,-0.7 0.079 83.4 -79.1 -66.0-177.8 47.0 54.8 1.5 112 121 A M H 3> S+ 0 0 100 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.869 124.2 55.3 -50.1 -52.9 49.5 55.3 -1.3 113 122 A P H 3> S+ 0 0 100 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.824 108.3 51.3 -54.9 -32.9 49.0 59.0 -2.1 114 123 A V H <> S+ 0 0 25 -3,-0.7 4,-1.5 2,-0.2 -2,-0.2 0.909 108.9 49.7 -71.2 -42.2 49.6 59.8 1.6 115 124 A V H X S+ 0 0 8 -4,-1.6 4,-0.9 1,-0.2 3,-0.2 0.911 108.5 53.9 -62.1 -41.8 52.9 57.8 1.5 116 125 A D H < S+ 0 0 105 -4,-2.5 3,-0.5 1,-0.2 4,-0.3 0.888 109.2 48.1 -58.6 -42.6 54.0 59.7 -1.6 117 126 A K H < S+ 0 0 152 -4,-1.6 -1,-0.2 1,-0.2 3,-0.2 0.774 114.5 45.4 -71.6 -26.4 53.4 63.0 0.1 118 127 A L H >X S+ 0 0 12 -4,-1.5 4,-2.4 -3,-0.2 3,-0.6 0.476 82.6 102.9 -95.5 -4.0 55.3 62.0 3.2 119 128 A E H 3X S+ 0 0 53 -4,-0.9 4,-2.4 -3,-0.5 5,-0.2 0.869 80.4 47.7 -45.2 -53.1 58.3 60.4 1.4 120 129 A N H 3> S+ 0 0 138 -4,-0.3 4,-2.1 -3,-0.2 -1,-0.3 0.846 112.3 51.4 -61.1 -34.5 60.7 63.3 1.9 121 130 A R H <> S+ 0 0 119 -3,-0.6 4,-2.3 2,-0.2 -1,-0.2 0.906 108.9 49.7 -68.1 -44.4 59.8 63.4 5.6 122 131 A I H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.929 113.8 46.5 -60.2 -46.1 60.4 59.7 6.0 123 132 A Q H X S+ 0 0 58 -4,-2.4 4,-2.3 -5,-0.2 5,-0.2 0.881 111.2 51.5 -64.6 -41.3 63.8 60.0 4.3 124 133 A E H X S+ 0 0 105 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.922 112.3 45.4 -63.7 -45.3 64.8 63.1 6.3 125 134 A L H X S+ 0 0 25 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.887 112.5 50.5 -66.9 -40.7 64.0 61.4 9.7 126 135 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 5,-0.2 0.950 114.6 43.6 -62.0 -50.5 65.8 58.2 8.8 127 136 A C H X S+ 0 0 27 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.925 114.8 50.2 -60.7 -45.9 68.9 60.0 7.7 128 137 A S H X S+ 0 0 72 -4,-2.6 4,-1.5 -5,-0.2 -2,-0.2 0.908 112.1 46.9 -60.2 -44.4 68.8 62.3 10.7 129 138 A L H X S+ 0 0 14 -4,-2.7 4,-1.1 2,-0.2 -2,-0.2 0.919 115.9 44.2 -65.2 -45.0 68.4 59.4 13.1 130 139 A I H X S+ 0 0 0 -4,-2.4 4,-3.1 -5,-0.2 3,-0.4 0.915 110.4 52.9 -68.7 -43.8 71.2 57.3 11.6 131 140 A E H < S+ 0 0 60 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.883 108.2 52.9 -60.6 -36.0 73.7 60.1 11.2 132 141 A S H < S+ 0 0 67 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.828 115.6 39.8 -69.0 -30.7 73.2 61.0 14.9 133 142 A L H >X S+ 0 0 10 -4,-1.1 3,-2.3 -3,-0.4 4,-0.6 0.859 95.5 83.5 -84.5 -38.5 73.9 57.4 15.9 134 143 A R G >< S+ 0 0 40 -4,-3.1 3,-0.7 1,-0.3 -2,-0.1 0.753 89.6 47.5 -35.2 -51.8 76.8 56.7 13.5 135 144 A P G 34 S+ 0 0 71 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.690 98.4 71.7 -71.9 -15.4 79.6 58.2 15.5 136 145 A Q G <4 S- 0 0 112 -3,-2.3 -2,-0.2 -4,-0.2 -3,-0.1 0.787 87.4-143.1 -71.3 -28.7 78.7 56.4 18.7 137 146 A G S << S+ 0 0 10 -3,-0.7 260,-2.0 -4,-0.6 2,-0.3 0.654 72.1 43.0 75.3 13.4 79.7 53.0 17.6 138 147 A Q E +F 396 0B 126 -5,-0.4 2,-0.3 258,-0.3 258,-0.2 -0.927 55.1 158.2-179.8 156.4 76.8 51.4 19.4 139 148 A C E -F 395 0B 12 256,-2.0 256,-3.4 -2,-0.3 2,-0.9 -0.971 46.2-104.6-175.0 166.7 73.1 51.5 20.2 140 149 A N E > -F 394 0B 33 -2,-0.3 4,-3.1 254,-0.2 5,-0.3 -0.907 36.3-159.3-104.8 96.8 70.0 49.6 21.3 141 150 A F H >>S+ 0 0 0 252,-2.4 5,-2.6 -2,-0.9 4,-2.1 0.828 83.1 59.0 -47.7 -41.9 68.3 49.5 17.9 142 151 A T H 4>S+ 0 0 8 1,-0.2 5,-1.6 3,-0.2 -1,-0.2 0.957 120.6 24.0 -57.7 -53.0 64.9 48.8 19.4 143 152 A E H 45S+ 0 0 116 -3,-0.3 -2,-0.2 3,-0.2 -1,-0.2 0.739 125.0 51.2 -87.8 -19.9 64.8 52.0 21.4 144 153 A D H <5S- 0 0 55 -4,-3.1 -3,-0.2 3,-0.1 -2,-0.2 0.698 135.0 -11.8 -89.2 -21.7 67.2 54.1 19.4 145 154 A Y T X5S+ 0 0 0 -4,-2.1 4,-2.3 -5,-0.3 -3,-0.2 0.521 122.0 63.9-141.3 -55.9 65.8 53.6 15.9 146 155 A A T 4 S+ 0 0 25 0, 0.0 4,-2.5 0, 0.0 5,-0.4 0.892 109.7 57.0 -56.0 -44.3 61.4 56.5 17.2 149 158 A F H X S+ 0 0 0 -4,-2.3 4,-1.3 1,-0.2 -3,-0.1 0.969 117.0 28.5 -55.8 -62.8 61.6 56.3 13.4 150 159 A P H > S+ 0 0 2 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.902 122.6 51.5 -68.3 -38.7 58.2 54.7 12.6 151 160 A I H X S+ 0 0 2 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.909 108.1 49.3 -65.7 -44.0 56.3 56.2 15.6 152 161 A R H X S+ 0 0 85 -4,-2.5 4,-2.0 -5,-0.3 -1,-0.2 0.874 110.2 53.0 -64.4 -34.5 57.4 59.8 15.0 153 162 A I H X S+ 0 0 4 -4,-1.3 4,-1.7 -5,-0.4 -1,-0.2 0.886 111.4 46.2 -67.2 -36.7 56.3 59.5 11.4 154 163 A F H X S+ 0 0 12 -4,-1.7 4,-2.6 2,-0.2 5,-0.2 0.909 109.9 51.7 -72.0 -42.3 52.9 58.3 12.6 155 164 A M H X>S+ 0 0 3 -4,-2.8 5,-1.9 1,-0.2 4,-1.6 0.896 109.7 52.5 -60.5 -37.3 52.5 61.0 15.2 156 165 A L H <5S+ 0 0 80 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.912 111.7 44.7 -63.4 -43.6 53.3 63.5 12.5 157 166 A L H <5S+ 0 0 17 -4,-1.7 53,-2.6 1,-0.2 -2,-0.2 0.824 118.4 43.7 -70.5 -31.8 50.6 62.0 10.2 158 167 A A H <5S- 0 0 1 -4,-2.6 53,-0.4 51,-0.2 -2,-0.2 0.601 104.9-126.8 -89.6 -14.1 48.1 61.8 13.1 159 168 A G T <5 + 0 0 37 -4,-1.6 -3,-0.2 1,-0.2 -4,-0.1 0.882 59.7 142.7 69.6 37.2 48.9 65.3 14.4 160 169 A L < - 0 0 12 -5,-1.9 -1,-0.2 -6,-0.1 -2,-0.1 -0.851 54.9 -98.9-111.5 148.8 49.5 64.0 18.0 161 170 A P > - 0 0 52 0, 0.0 3,-1.4 0, 0.0 4,-0.2 -0.342 18.7-133.2 -67.1 141.2 52.2 65.2 20.4 162 171 A E G > S+ 0 0 101 1,-0.3 3,-1.2 2,-0.2 -7,-0.0 0.705 101.2 72.0 -65.4 -19.7 55.5 63.3 20.8 163 172 A E G 3 S+ 0 0 148 1,-0.2 4,-0.3 2,-0.1 -1,-0.3 0.723 91.0 58.4 -68.9 -21.6 55.1 63.4 24.6 164 173 A D G <> S+ 0 0 46 -3,-1.4 4,-3.0 1,-0.2 5,-0.3 0.481 79.5 93.0 -87.2 -3.0 52.2 60.9 24.5 165 174 A I H <> S+ 0 0 30 -3,-1.2 4,-3.4 1,-0.2 5,-0.3 0.931 82.4 50.0 -58.0 -50.2 54.4 58.2 22.9 166 175 A P H > S+ 0 0 93 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.894 116.7 43.0 -56.9 -40.0 55.5 56.4 26.1 167 176 A H H > S+ 0 0 95 -4,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.951 117.6 44.1 -70.4 -50.9 51.9 56.3 27.3 168 177 A L H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -3,-0.2 0.894 111.9 53.8 -62.0 -41.4 50.4 55.3 23.9 169 178 A K H X S+ 0 0 16 -4,-3.4 4,-2.5 -5,-0.3 5,-0.2 0.921 106.7 51.2 -61.1 -45.6 53.1 52.7 23.3 170 179 A Y H X S+ 0 0 99 -4,-1.6 4,-1.5 -5,-0.3 -1,-0.2 0.919 110.5 48.8 -59.3 -44.2 52.5 50.9 26.6 171 180 A L H X S+ 0 0 5 -4,-1.8 4,-0.7 1,-0.2 -1,-0.2 0.900 111.5 49.9 -62.8 -41.5 48.8 50.7 26.0 172 181 A T H >X S+ 0 0 0 -4,-2.2 4,-1.3 1,-0.2 3,-1.1 0.926 108.2 52.2 -62.7 -47.3 49.4 49.3 22.5 173 182 A D H 3X S+ 0 0 42 -4,-2.5 4,-2.9 1,-0.3 -1,-0.2 0.810 102.8 59.8 -59.9 -31.7 51.9 46.7 23.6 174 183 A Q H 3< S+ 0 0 12 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.765 105.3 50.2 -69.2 -24.2 49.4 45.4 26.2 175 184 A M H << S+ 0 0 5 -3,-1.1 -2,-0.2 -4,-0.7 -1,-0.2 0.808 121.7 29.4 -83.5 -32.5 46.9 44.7 23.4 176 185 A T H < S+ 0 0 2 -4,-1.3 210,-2.4 1,-0.2 211,-0.6 0.794 136.8 22.4 -97.3 -35.2 49.3 42.6 21.2 177 186 A R S < S- 0 0 25 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 -0.497 87.5-146.8-132.9 64.8 51.7 41.2 23.8 178 187 A P - 0 0 57 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.028 11.2-164.9 -37.0 122.1 49.7 41.2 27.1 179 188 A D - 0 0 109 3,-0.2 -5,-0.1 -5,-0.0 -4,-0.0 0.824 40.8-116.2 -79.6 -36.9 52.0 41.8 30.1 180 189 A G S S+ 0 0 70 2,-0.4 3,-0.1 -6,-0.1 -6,-0.0 0.229 91.7 109.5 111.6 -6.5 49.3 40.6 32.6 181 190 A S S S+ 0 0 61 1,-0.2 2,-0.3 2,-0.0 -7,-0.0 0.841 88.1 5.1 -67.8 -37.3 49.3 44.2 34.0 182 191 A M S S- 0 0 44 -8,-0.1 -2,-0.4 3,-0.0 -1,-0.2 -0.996 77.9-107.9-150.4 152.1 45.9 44.9 32.6 183 192 A T > - 0 0 82 -2,-0.3 4,-2.5 -3,-0.1 5,-0.2 -0.336 36.3-109.9 -74.3 159.0 43.1 43.1 30.7 184 193 A F H > S+ 0 0 24 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.911 119.6 54.9 -55.9 -44.2 42.4 43.9 27.1 185 194 A A H > S+ 0 0 45 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.921 110.4 45.1 -55.0 -47.8 39.1 45.6 28.0 186 195 A E H > S+ 0 0 117 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.887 112.5 50.4 -65.1 -41.3 41.0 47.9 30.4 187 196 A A H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.900 112.4 48.2 -64.2 -40.0 43.8 48.7 27.9 188 197 A K H X S+ 0 0 21 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.888 109.1 52.5 -66.9 -41.4 41.2 49.5 25.3 189 198 A E H X S+ 0 0 98 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.936 109.6 50.1 -58.7 -47.6 39.2 51.8 27.6 190 199 A A H X S+ 0 0 26 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.908 110.4 48.9 -57.8 -46.7 42.4 53.7 28.4 191 200 A L H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.886 113.4 47.2 -62.4 -38.9 43.2 54.1 24.7 192 201 A Y H X S+ 0 0 3 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.813 104.4 60.5 -72.6 -30.3 39.7 55.3 24.0 193 202 A D H < S+ 0 0 110 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.811 108.9 45.8 -64.7 -29.5 39.9 57.7 27.0 194 203 A Y H X S+ 0 0 34 -4,-1.2 4,-0.8 -3,-0.2 -2,-0.2 0.932 115.8 43.0 -77.4 -49.5 42.8 59.3 25.2 195 204 A L H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 3,-0.4 0.880 98.5 71.6 -65.9 -44.5 41.2 59.5 21.8 196 205 A I H X S+ 0 0 65 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.871 99.5 44.7 -42.0 -56.6 37.7 60.7 22.7 197 206 A P H > S+ 0 0 62 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.897 114.6 50.8 -59.1 -39.7 38.7 64.3 23.7 198 207 A I H X S+ 0 0 23 -4,-0.8 4,-2.7 -3,-0.4 -2,-0.2 0.915 109.3 48.0 -64.3 -47.0 40.9 64.7 20.6 199 208 A I H X S+ 0 0 3 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.898 108.2 57.0 -62.5 -39.3 38.2 63.5 18.1 200 209 A E H >X S+ 0 0 108 -4,-2.1 4,-1.2 -5,-0.3 3,-0.5 0.946 111.1 42.9 -54.3 -51.3 35.8 65.9 19.8 201 210 A Q H 3X S+ 0 0 118 -4,-1.9 4,-3.1 1,-0.2 3,-0.4 0.911 111.4 53.1 -61.2 -47.7 38.1 68.8 19.1 202 211 A R H 3< S+ 0 0 33 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.661 105.2 57.5 -64.9 -17.3 39.0 67.7 15.6 203 212 A R H << S+ 0 0 83 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.848 114.8 35.3 -80.5 -37.4 35.2 67.5 14.8 204 213 A Q H < S+ 0 0 143 -4,-1.2 -2,-0.2 -3,-0.4 -3,-0.1 0.936 134.0 24.9 -80.2 -53.3 34.7 71.2 15.8 205 214 A K S < S- 0 0 179 -4,-3.1 -1,-0.3 -5,-0.1 -2,-0.1 -0.760 87.5-159.2-115.4 83.0 38.0 72.6 14.5 206 215 A P - 0 0 80 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.238 9.1-171.9 -62.9 147.8 39.2 70.1 11.7 207 216 A G - 0 0 40 2,-0.2 -48,-0.0 -5,-0.2 0, 0.0 -0.399 39.0 -99.7-120.4-161.1 42.8 70.0 10.7 208 217 A T S S+ 0 0 141 -2,-0.2 -49,-0.1 4,-0.1 2,-0.0 0.353 83.7 112.8-106.9 2.7 44.6 68.2 7.9 209 218 A D S > S- 0 0 22 -51,-0.1 4,-2.4 1,-0.1 -51,-0.2 -0.249 83.4-104.6 -73.3 163.2 45.8 65.3 10.1 210 219 A A H > S+ 0 0 7 -53,-2.6 4,-2.5 1,-0.2 -52,-0.2 0.854 120.5 50.9 -55.6 -40.8 44.6 61.7 9.8 211 220 A I H > S+ 0 0 4 -53,-0.4 4,-3.2 2,-0.2 5,-0.2 0.937 109.3 49.3 -66.1 -45.8 42.4 62.0 12.9 212 221 A S H > S+ 0 0 3 1,-0.2 4,-1.2 2,-0.2 -2,-0.2 0.906 112.5 50.4 -58.9 -40.5 40.7 65.2 11.6 213 222 A I H < S+ 0 0 62 -4,-2.4 3,-0.2 2,-0.2 -2,-0.2 0.922 114.4 42.2 -63.5 -46.2 40.2 63.4 8.3 214 223 A V H >< S+ 0 0 0 -4,-2.5 3,-1.7 1,-0.2 -2,-0.2 0.942 111.1 55.2 -67.1 -47.5 38.7 60.3 9.9 215 224 A A H 3< S+ 0 0 0 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.716 116.8 36.5 -59.3 -24.6 36.5 62.2 12.4 216 225 A N T 3< S+ 0 0 69 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.137 92.9 125.7-115.7 18.4 34.8 64.2 9.7 217 226 A G < - 0 0 9 -3,-1.7 7,-2.4 6,-0.1 2,-0.4 -0.268 56.9-123.2 -77.3 164.5 34.6 61.5 7.1 218 227 A Q E -H 223 0C 117 5,-0.2 2,-0.5 -2,-0.0 3,-0.1 -0.911 22.8-173.0-110.5 133.8 31.5 60.3 5.2 219 228 A V E > S-H 222 0C 0 3,-3.4 3,-0.8 -2,-0.4 -117,-0.1 -0.968 72.2 -12.1-130.8 117.1 30.5 56.7 5.3 220 229 A N T 3 S- 0 0 116 -2,-0.5 2,-1.8 1,-0.3 -1,-0.2 0.958 125.9 -57.1 60.9 52.2 27.6 55.4 3.2 221 230 A G T 3 S+ 0 0 63 1,-0.1 -1,-0.3 -3,-0.1 0, 0.0 -0.111 126.5 85.3 75.0 -42.9 26.5 58.9 2.3 222 231 A R E < S-H 219 0C 96 -2,-1.8 -3,-3.4 -3,-0.8 2,-0.2 -0.402 88.4 -91.5 -88.4 167.1 26.0 59.9 5.9 223 232 A P E -H 218 0C 80 0, 0.0 -5,-0.2 0, 0.0 -1,-0.1 -0.481 41.3-104.4 -79.1 147.7 28.7 61.2 8.3 224 233 A I - 0 0 1 -7,-2.4 2,-0.1 -10,-0.2 -4,-0.0 -0.395 37.9-121.3 -67.8 144.3 30.8 58.9 10.6 225 234 A T > - 0 0 59 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.406 20.5-110.9 -83.3 165.5 29.7 58.9 14.2 226 235 A S H > S+ 0 0 53 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.925 120.4 51.0 -59.8 -44.9 32.0 59.9 17.1 227 236 A D H > S+ 0 0 72 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.884 109.9 49.4 -60.1 -41.7 32.0 56.2 18.3 228 237 A E H > S+ 0 0 25 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.889 111.5 47.8 -66.6 -41.2 32.9 55.0 14.8 229 238 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 3,-0.3 0.915 110.3 53.9 -65.3 -42.2 35.8 57.4 14.4 230 239 A K H X S+ 0 0 37 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.926 109.0 47.4 -57.1 -48.5 37.0 56.5 17.8 231 240 A R H X S+ 0 0 44 -4,-2.1 -141,-1.3 1,-0.2 4,-0.8 0.728 113.1 48.9 -68.4 -23.5 37.1 52.8 17.0 232 241 A M H X S+ 0 0 2 -4,-1.2 4,-2.1 -3,-0.3 3,-0.4 0.898 109.8 49.4 -82.1 -42.8 38.9 53.4 13.7 233 242 A C H X S+ 0 0 2 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.814 104.2 62.4 -64.4 -28.9 41.6 55.7 15.1 234 243 A G H X S+ 0 0 0 -4,-1.6 4,-1.6 -5,-0.3 -1,-0.2 0.906 106.3 44.0 -62.7 -40.4 42.1 53.0 17.8 235 244 A L H X S+ 0 0 39 -4,-0.8 4,-2.4 -3,-0.4 5,-0.2 0.903 110.1 54.6 -70.3 -42.2 43.2 50.6 15.0 236 245 A L H X S+ 0 0 23 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.861 106.9 53.6 -58.7 -36.0 45.4 53.2 13.3 237 246 A L H X S+ 0 0 2 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.921 109.4 46.0 -65.1 -47.0 47.2 53.7 16.6 238 247 A V H X S+ 0 0 20 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0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.846 82.8 61.8 -52.4 -37.0 77.6 40.0 6.4 260 269 A E H 3> S+ 0 0 131 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.855 104.3 46.2 -60.3 -37.7 76.9 38.3 3.1 261 270 A H H <> S+ 0 0 26 -3,-1.1 4,-1.6 2,-0.2 -1,-0.2 0.865 111.7 51.4 -75.8 -33.8 73.4 39.6 2.9 262 271 A R H X S+ 0 0 11 -4,-1.6 4,-1.7 -7,-0.3 3,-0.2 0.957 110.6 48.9 -63.8 -49.4 74.5 43.1 3.9 263 272 A Q H X S+ 0 0 88 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.891 106.2 57.9 -55.9 -44.1 77.2 43.1 1.1 264 273 A E H X S+ 0 0 43 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.909 108.9 43.9 -54.2 -46.5 74.6 41.9 -1.4 265 274 A L H < S+ 0 0 4 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.786 112.8 52.6 -72.4 -27.5 72.4 44.9 -0.8 266 275 A I H < S+ 0 0 62 -4,-1.7 -2,-0.2 1,-0.1 -1,-0.2 0.905 116.9 37.0 -74.6 -42.3 75.3 47.3 -0.8 267 276 A E H < S+ 0 0 134 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.833 127.4 34.4 -79.9 -33.7 76.7 46.1 -4.2 268 277 A R >< + 0 0 116 -4,-2.3 3,-2.2 -5,-0.3 -1,-0.2 -0.601 63.1 169.3-124.4 72.8 73.4 45.5 -5.9 269 278 A P G > S+ 0 0 73 0, 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