==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-FEB-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 25-JAN-11 3QH4 . COMPND 2 MOLECULE: ESTERASE LIPW; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM MARINUM; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 314 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12466.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 4.8 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 18 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 110 35.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 1 0 0 0 0 0 1 1 1 0 2 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 2 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 PARALLEL BRIDGES PER LADDER . 0 0 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 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 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 0 A S > 0 0 131 0, 0.0 4,-0.5 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 -90.7 80.5 35.0 42.3 2 1 A M T >4 + 0 0 79 1,-0.2 3,-0.7 2,-0.2 0, 0.0 0.789 360.0 63.7 -68.0 -30.4 82.7 32.4 44.1 3 2 A V T 34 S+ 0 0 108 1,-0.2 -1,-0.2 3,-0.0 20,-0.0 0.902 100.9 51.5 -61.9 -39.6 79.5 30.9 45.6 4 3 A T T 34 S+ 0 0 70 -3,-0.3 19,-2.2 18,-0.1 -1,-0.2 0.643 83.3 109.2 -67.5 -19.9 78.4 30.0 42.0 5 4 A Q S << S- 0 0 134 -3,-0.7 17,-0.1 -4,-0.5 2,-0.1 -0.449 71.4-125.6 -66.7 125.3 81.7 28.3 41.2 6 5 A P - 0 0 16 0, 0.0 3,-0.3 0, 0.0 202,-0.2 -0.418 14.8-138.5 -80.9 151.7 81.0 24.5 41.0 7 6 A E S S+ 0 0 100 200,-2.8 198,-0.0 1,-0.2 0, 0.0 -0.642 76.9 24.8 -97.9 158.5 82.8 21.7 42.9 8 7 A A > + 0 0 23 -2,-0.2 3,-1.8 200,-0.1 -1,-0.2 0.641 67.5 141.7 69.5 21.7 84.0 18.3 41.6 9 8 A V G > + 0 0 47 -3,-0.3 3,-1.7 1,-0.3 8,-0.1 0.810 65.0 66.0 -65.0 -26.5 84.2 19.3 38.0 10 9 A D G 3 S+ 0 0 118 1,-0.3 -1,-0.3 7,-0.0 7,-0.0 0.690 94.1 60.9 -64.4 -19.3 87.4 17.2 37.6 11 10 A R G < S+ 0 0 94 -3,-1.8 2,-0.3 2,-0.1 -1,-0.3 0.411 91.6 86.7 -90.7 3.1 85.1 14.1 38.2 12 11 A L S < S- 0 0 0 -3,-1.7 271,-0.2 -4,-0.1 270,-0.1 -0.745 92.4 -95.4-102.3 149.9 83.0 14.9 35.1 13 12 A D >> - 0 0 31 269,-2.4 4,-3.4 -2,-0.3 3,-0.6 -0.349 39.1-118.4 -52.7 138.0 83.7 13.8 31.5 14 13 A P H 3> S+ 0 0 65 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.842 114.0 55.6 -54.7 -32.5 85.5 16.7 29.7 15 14 A L H 34 S+ 0 0 108 2,-0.2 4,-0.4 1,-0.2 -2,-0.0 0.911 114.6 38.9 -67.7 -38.6 82.6 17.1 27.2 16 15 A L H X> S+ 0 0 0 -3,-0.6 4,-1.9 1,-0.2 3,-1.6 0.900 108.8 61.9 -77.2 -38.0 80.2 17.5 30.1 17 16 A R H 3< S+ 0 0 93 -4,-3.4 -2,-0.2 1,-0.3 -1,-0.2 0.802 95.2 63.9 -52.2 -35.2 82.6 19.6 32.1 18 17 A A T 3< S+ 0 0 74 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.752 115.2 28.3 -65.3 -25.0 82.6 22.2 29.3 19 18 A V T <4 S+ 0 0 64 -3,-1.6 2,-1.4 -4,-0.4 3,-0.2 0.585 103.4 76.8-110.7 -16.8 78.8 22.9 29.8 20 19 A A < + 0 0 3 -4,-1.9 -1,-0.1 1,-0.2 -8,-0.1 -0.531 58.2 133.3 -93.8 67.9 78.4 22.2 33.5 21 20 A T + 0 0 91 -2,-1.4 2,-0.4 -3,-0.1 -1,-0.2 0.435 53.0 51.0-104.9 -1.2 80.0 25.4 34.6 22 21 A A - 0 0 45 -3,-0.2 188,-2.5 -17,-0.1 2,-0.2 -0.996 67.2-128.7-142.8 142.5 77.6 26.8 37.3 23 22 A R - 0 0 37 -19,-2.2 2,-0.2 -2,-0.4 188,-0.1 -0.501 36.0-116.2 -71.1 151.4 75.8 25.8 40.4 24 23 A I - 0 0 39 184,-0.4 2,-0.5 -2,-0.2 191,-0.1 -0.584 15.3-140.8 -80.3 156.3 72.1 26.5 40.6 25 24 A D - 0 0 85 -2,-0.2 9,-0.1 2,-0.1 -21,-0.0 -0.989 17.0-174.0-116.2 118.3 70.7 28.9 43.1 26 25 A F + 0 0 3 -2,-0.5 2,-0.1 4,-0.1 -1,-0.1 0.079 35.8 127.5-110.3 26.9 67.5 27.5 44.4 27 26 A T S > S- 0 0 61 1,-0.1 4,-2.5 195,-0.0 5,-0.1 -0.405 74.5-108.1 -68.8 157.9 66.2 30.4 46.6 28 27 A A H > S+ 0 0 49 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.905 120.0 50.6 -54.6 -46.1 62.7 31.5 45.9 29 28 A E H > S+ 0 0 71 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.896 111.5 47.6 -59.2 -42.7 63.9 34.8 44.3 30 29 A S H > S+ 0 0 22 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.889 104.4 61.6 -66.0 -39.5 66.3 32.9 42.0 31 30 A I H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.905 101.9 52.1 -54.2 -43.8 63.5 30.4 41.1 32 31 A L H X S+ 0 0 92 -4,-1.6 4,-1.3 1,-0.2 -1,-0.2 0.910 111.7 45.8 -60.1 -40.2 61.5 33.3 39.6 33 32 A T H X S+ 0 0 100 -4,-1.2 4,-1.7 1,-0.2 -2,-0.2 0.880 111.3 52.0 -71.9 -38.5 64.4 34.4 37.4 34 33 A I H X S+ 0 0 34 -4,-2.7 4,-3.0 1,-0.2 5,-0.4 0.925 103.2 59.1 -63.8 -43.4 65.3 30.9 36.3 35 34 A R H X S+ 0 0 30 -4,-2.3 4,-2.3 1,-0.2 5,-0.3 0.914 106.8 47.6 -51.6 -46.6 61.7 30.2 35.2 36 35 A E H X S+ 0 0 142 -4,-1.3 4,-1.6 2,-0.2 -1,-0.2 0.934 118.3 37.4 -64.0 -48.5 61.8 33.1 32.7 37 36 A S H X S+ 0 0 69 -4,-1.7 4,-2.4 2,-0.2 5,-0.2 0.926 119.2 47.3 -72.7 -44.0 65.2 32.3 31.1 38 37 A M H X S+ 0 0 24 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.919 112.7 49.1 -64.2 -45.0 64.7 28.5 31.1 39 38 A N H X S+ 0 0 41 -4,-2.3 4,-2.2 -5,-0.4 -1,-0.2 0.891 111.1 49.8 -66.1 -37.8 61.2 28.6 29.7 40 39 A Q H X S+ 0 0 152 -4,-1.6 4,-1.9 -5,-0.3 -2,-0.2 0.949 113.9 45.2 -64.1 -46.6 62.2 31.1 26.9 41 40 A R H X S+ 0 0 150 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.931 115.0 46.8 -62.8 -46.5 65.2 28.9 25.9 42 41 A R H X S+ 0 0 26 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.844 107.9 55.8 -70.0 -33.8 63.2 25.6 26.0 43 42 A R H X S+ 0 0 51 -4,-2.2 4,-1.0 -5,-0.2 -1,-0.2 0.948 110.5 47.0 -59.1 -45.4 60.3 27.1 24.0 44 43 A E H X S+ 0 0 72 -4,-1.9 4,-0.7 1,-0.2 -2,-0.2 0.880 116.0 43.6 -62.4 -39.6 62.7 28.0 21.2 45 44 A A H X S+ 0 0 28 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.823 100.6 69.3 -80.8 -30.2 64.4 24.6 21.2 46 45 A A H X S+ 0 0 5 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.872 95.5 52.9 -61.8 -38.9 61.3 22.5 21.4 47 46 A A H X S+ 0 0 71 -4,-1.0 4,-2.2 1,-0.2 -1,-0.2 0.911 110.2 47.8 -63.2 -43.8 60.0 23.3 17.9 48 47 A T H X S+ 0 0 104 -4,-0.7 4,-1.4 2,-0.2 -1,-0.2 0.882 111.8 51.8 -61.4 -40.6 63.4 22.2 16.3 49 48 A E H X S+ 0 0 29 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.899 108.8 48.7 -64.9 -44.9 63.3 19.0 18.4 50 49 A T H X S+ 0 0 45 -4,-2.5 4,-1.3 1,-0.2 5,-0.4 0.905 108.2 55.1 -60.6 -43.0 59.8 18.1 17.3 51 50 A A H < S+ 0 0 88 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.852 112.4 43.8 -59.5 -34.8 60.7 18.8 13.6 52 51 A A H < S+ 0 0 90 -4,-1.4 -1,-0.2 1,-0.1 -2,-0.2 0.842 108.4 55.2 -79.4 -33.9 63.6 16.3 13.9 53 52 A A H < S- 0 0 26 -4,-1.8 -2,-0.2 -5,-0.1 -1,-0.1 0.800 83.6-143.5 -79.1 -29.6 62.0 13.4 15.8 54 53 A G < + 0 0 72 -4,-1.3 2,-0.5 1,-0.3 -3,-0.1 0.735 53.8 136.8 68.8 23.0 59.0 12.7 13.6 55 54 A V - 0 0 7 -5,-0.4 -1,-0.3 22,-0.0 22,-0.2 -0.895 60.6-116.8-100.8 127.5 56.9 12.0 16.7 56 55 A A E -A 76 0A 65 20,-1.7 20,-2.8 -2,-0.5 2,-0.4 -0.439 35.7-168.6 -66.1 135.3 53.3 13.4 16.5 57 56 A V E +A 75 0A 47 18,-0.2 2,-0.3 -2,-0.1 18,-0.2 -0.994 12.4 172.8-129.5 134.6 52.8 16.0 19.3 58 57 A A E -A 74 0A 45 16,-2.3 16,-3.2 -2,-0.4 2,-0.4 -0.988 23.1-140.0-142.2 131.5 49.6 17.7 20.5 59 58 A D E +A 73 0A 95 -2,-0.3 14,-0.2 14,-0.2 2,-0.2 -0.770 34.3 159.4 -88.3 137.6 49.0 20.0 23.5 60 59 A D E -A 72 0A 63 12,-2.6 12,-2.6 -2,-0.4 2,-0.3 -0.741 29.8-123.6-142.3-176.5 45.7 19.4 25.4 61 60 A V E -A 71 0A 68 10,-0.3 2,-0.7 -2,-0.2 -2,-0.0 -0.996 2.9-150.5-139.1 142.6 44.1 20.1 28.8 62 61 A V E -A 70 0A 4 8,-2.8 8,-3.4 -2,-0.3 2,-0.4 -0.963 29.7-153.6-106.8 105.5 42.6 17.9 31.5 63 62 A T E -A 69 0A 69 -2,-0.7 2,-0.1 6,-0.3 -2,-0.0 -0.716 9.2-143.4 -92.8 134.5 40.1 20.4 32.9 64 63 A G > - 0 0 22 4,-0.7 3,-1.3 -2,-0.4 -1,-0.0 -0.342 26.0-100.2 -94.4 172.6 39.2 19.8 36.5 65 64 A E T 3 S+ 0 0 203 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.840 119.1 59.1 -58.1 -34.7 35.9 20.1 38.5 66 65 A A T 3 S- 0 0 110 2,-0.2 -1,-0.2 1,-0.1 -3,-0.0 0.496 120.5-102.9 -83.7 -3.4 37.0 23.5 39.9 67 66 A G S < S+ 0 0 66 -3,-1.3 -2,-0.1 1,-0.2 -1,-0.1 0.398 88.8 93.6 108.0 -0.3 37.4 25.0 36.5 68 67 A R - 0 0 77 -6,-0.0 -4,-0.7 2,-0.0 -2,-0.2 -0.989 63.2-136.6-120.4 129.1 41.1 25.2 35.6 69 68 A P E -A 63 0A 56 0, 0.0 -6,-0.3 0, 0.0 -8,-0.0 -0.260 11.4-123.7 -77.8 164.0 42.7 22.4 33.6 70 69 A V E -A 62 0A 12 -8,-3.4 -8,-2.8 65,-0.1 51,-0.1 -0.959 36.8-132.6 -97.9 116.1 46.0 20.7 34.0 71 70 A P E -A 61 0A 42 0, 0.0 49,-2.5 0, 0.0 2,-0.3 -0.416 27.2-172.3 -68.4 148.9 47.7 21.1 30.6 72 71 A V E -AB 60 119A 0 -12,-2.6 -12,-2.6 47,-0.2 2,-0.5 -0.950 20.7-143.3-135.7 155.5 49.3 18.1 29.0 73 72 A R E -AB 59 118A 25 45,-1.8 45,-2.8 -2,-0.3 2,-0.5 -0.996 19.2-154.3-118.5 127.8 51.5 17.4 26.0 74 73 A I E -AB 58 117A 3 -16,-3.2 -16,-2.3 -2,-0.5 2,-0.4 -0.897 7.5-168.3-109.5 125.9 50.7 14.2 24.1 75 74 A Y E -AB 57 116A 0 41,-3.1 41,-2.2 -2,-0.5 2,-0.5 -0.913 4.1-169.1-110.4 129.2 53.4 12.4 22.1 76 75 A R E +AB 56 115A 77 -20,-2.8 -20,-1.7 -2,-0.4 39,-0.2 -0.964 24.8 151.4-126.8 119.6 52.4 9.6 19.8 77 76 A A + 0 0 33 37,-1.5 38,-0.1 -2,-0.5 -1,-0.1 -0.088 63.5 56.1-132.3 31.4 55.0 7.3 18.1 78 77 A A S S- 0 0 22 35,-0.1 4,-0.2 4,-0.0 36,-0.1 -0.969 87.3 -95.1-155.6 152.5 52.9 4.1 17.7 79 78 A P - 0 0 114 0, 0.0 -2,-0.1 0, 0.0 72,-0.0 -0.305 66.1 -52.8 -67.5 155.4 49.6 3.1 16.1 80 79 A T S S+ 0 0 109 1,-0.2 72,-0.1 2,-0.1 71,-0.1 -0.405 123.4 40.3 -66.1 142.8 46.3 3.1 18.1 81 80 A P S S- 0 0 85 0, 0.0 71,-0.3 0, 0.0 -1,-0.2 0.504 87.9-178.8 -84.7 125.7 45.8 1.6 20.6 82 81 A A E -c 152 0A 3 69,-2.9 71,-3.1 -4,-0.2 74,-0.1 -0.659 33.1-112.6 -93.1 140.2 49.3 2.6 21.8 83 82 A P E - 0 0 1 0, 0.0 32,-2.6 0, 0.0 2,-0.4 -0.394 45.7-145.9 -60.3 153.1 50.9 1.6 25.2 84 83 A V E -cd 157 115A 0 72,-2.5 74,-2.5 69,-0.5 2,-0.4 -0.976 19.9-157.8-139.7 141.0 51.2 4.9 27.1 85 84 A V E -cd 158 116A 0 30,-2.3 32,-3.2 -2,-0.4 2,-0.6 -0.964 12.8-147.2-114.4 130.7 53.5 6.5 29.6 86 85 A V E -cd 159 117A 0 72,-2.7 74,-2.1 -2,-0.4 2,-0.4 -0.901 29.2-165.6 -95.7 120.8 52.4 9.3 32.0 87 86 A Y E -cd 160 118A 0 30,-2.8 32,-2.7 -2,-0.6 2,-0.4 -0.881 18.5-163.0-117.3 138.8 55.5 11.5 32.4 88 87 A C E -cd 161 119A 0 72,-1.8 74,-1.4 -2,-0.4 81,-0.1 -0.990 24.3-129.3-121.8 125.5 56.4 14.3 34.9 89 88 A H - 0 0 0 30,-0.6 4,-0.2 -2,-0.4 2,-0.1 -0.109 19.2-104.0 -73.1 165.5 59.3 16.7 34.1 90 89 A A + 0 0 14 74,-0.2 73,-0.1 75,-0.1 -1,-0.1 -0.260 62.7 116.1 -77.4 168.6 62.3 17.7 36.2 91 90 A G S >> S- 0 0 15 5,-0.1 4,-1.9 3,-0.1 3,-1.5 0.524 85.9 -92.1 140.8 15.2 62.7 21.1 37.9 92 91 A G T 34 S- 0 0 1 1,-0.3 131,-0.1 2,-0.2 -2,-0.1 0.749 76.1 -72.0 57.0 31.3 62.9 20.5 41.7 93 92 A F T 34 S+ 0 0 3 2,-0.2 31,-2.8 -4,-0.2 -1,-0.3 0.255 135.5 68.5 68.8 -8.7 59.1 20.9 42.1 94 93 A A T <4 S+ 0 0 0 -3,-1.5 2,-0.3 29,-0.2 -2,-0.2 0.523 91.1 53.3-114.7 -17.7 59.6 24.6 41.4 95 94 A L S < S+ 0 0 7 -4,-1.9 -2,-0.2 -61,-0.0 29,-0.1 -0.843 74.9 35.1-120.8 159.7 60.6 25.0 37.7 96 95 A G - 0 0 4 -2,-0.3 2,-0.2 -4,-0.1 -5,-0.1 -0.183 37.5-153.0 103.1 175.6 59.5 24.0 34.3 97 96 A N >> - 0 0 34 -2,-0.1 3,-1.1 25,-0.0 4,-0.5 -0.808 60.1 -48.7-167.3-161.2 56.6 23.3 32.0 98 97 A L T 34 S+ 0 0 13 1,-0.2 20,-0.0 -2,-0.2 22,-0.0 0.672 131.5 54.2 -67.2 -18.1 55.8 21.1 28.9 99 98 A D T >4 S+ 0 0 25 1,-0.1 3,-1.1 2,-0.1 4,-0.3 0.663 88.3 81.0 -85.1 -18.1 59.0 22.3 27.1 100 99 A T T <4 S+ 0 0 17 -3,-1.1 3,-0.3 1,-0.3 -2,-0.1 0.932 109.9 16.4 -59.8 -56.1 61.4 21.4 29.9 101 100 A D T 3X S+ 0 0 10 -4,-0.5 4,-2.2 1,-0.2 -1,-0.3 -0.119 86.7 126.2-108.9 30.6 61.8 17.6 29.3 102 101 A H H <> S+ 0 0 1 -3,-1.1 4,-2.4 1,-0.2 5,-0.2 0.918 74.3 51.4 -55.3 -44.2 60.4 17.7 25.7 103 102 A R H > S+ 0 0 46 -4,-0.3 4,-2.3 -3,-0.3 -1,-0.2 0.934 108.9 50.6 -60.2 -48.0 63.6 16.0 24.3 104 103 A Q H > S+ 0 0 5 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.898 110.9 49.4 -54.8 -42.8 63.3 13.2 26.9 105 104 A C H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.901 109.9 50.3 -65.9 -42.5 59.6 12.7 26.0 106 105 A L H X S+ 0 0 2 -4,-2.4 4,-2.2 1,-0.2 5,-0.3 0.887 111.5 49.4 -61.6 -41.2 60.4 12.5 22.3 107 106 A E H X S+ 0 0 13 -4,-2.3 4,-2.5 -5,-0.2 5,-0.3 0.926 111.8 47.5 -66.3 -44.3 63.1 10.0 22.9 108 107 A L H X S+ 0 0 1 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.948 113.1 47.9 -60.8 -49.9 60.8 7.8 25.1 109 108 A A H X>S+ 0 0 0 -4,-2.6 5,-2.0 1,-0.2 4,-0.7 0.935 118.2 39.8 -57.5 -49.4 57.9 7.8 22.6 110 109 A R H <5S+ 0 0 113 -4,-2.2 3,-0.4 -5,-0.2 -1,-0.2 0.941 120.4 41.4 -69.7 -48.6 60.1 7.0 19.6 111 110 A R H <5S+ 0 0 48 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.843 121.6 39.3 -74.5 -34.0 62.4 4.5 21.1 112 111 A A H <5S- 0 0 0 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.458 105.5-126.6 -90.3 -4.4 59.8 2.6 23.2 113 112 A R T <5 + 0 0 122 -4,-0.7 2,-0.3 -3,-0.4 -3,-0.2 0.979 68.7 107.9 54.9 67.5 57.2 2.8 20.4 114 113 A C S - 0 0 28 -29,-0.1 4,-1.9 8,-0.1 3,-0.3 -0.762 20.0 -96.3-114.2 141.9 54.8 24.5 41.0 124 123 A A T 4 S+ 0 0 2 -31,-2.8 99,-0.1 -2,-0.3 98,-0.1 -0.481 94.3 36.2 -75.8 158.1 56.2 25.2 44.4 125 124 A P T 4 S+ 0 0 48 0, 0.0 -1,-0.3 0, 0.0 -31,-0.1 -0.999 128.7 41.1 -77.1 -9.4 56.6 27.4 46.4 126 125 A E T 4 S+ 0 0 94 1,-0.3 -2,-0.3 -3,-0.3 -32,-0.1 0.840 131.9 26.0 -68.0 -33.0 53.2 28.8 45.2 127 126 A H S < S- 0 0 83 -4,-1.9 5,-0.4 3,-0.0 -1,-0.3 -0.706 85.4-179.4-133.2 80.2 51.6 25.3 45.1 128 127 A P > - 0 0 34 0, 0.0 3,-2.7 0, 0.0 96,-0.2 -0.021 39.8 -13.7 -72.4 178.7 53.4 23.0 47.5 129 128 A Y T 3 S+ 0 0 39 94,-2.7 98,-0.1 1,-0.3 104,-0.1 -0.241 124.7 23.9 -45.6 135.8 52.7 19.3 48.2 130 129 A P T 3> S+ 0 0 42 0, 0.0 4,-2.8 0, 0.0 -1,-0.3 -0.835 101.7 84.5 -99.9 30.2 50.3 17.8 47.3 131 130 A A H <> S+ 0 0 10 -3,-2.7 4,-2.1 1,-0.2 -9,-0.2 0.938 96.1 40.9 -61.6 -51.6 49.4 20.1 44.3 132 131 A A H > S+ 0 0 3 -5,-0.4 4,-2.8 2,-0.2 -1,-0.2 0.891 115.4 51.9 -63.0 -40.9 51.6 18.6 41.6 133 132 A L H > S+ 0 0 23 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.937 108.7 51.4 -63.5 -41.8 50.9 15.0 42.8 134 133 A H H X S+ 0 0 106 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.903 110.4 49.6 -57.0 -41.9 47.1 15.8 42.6 135 134 A D H X S+ 0 0 11 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.912 109.8 50.1 -64.0 -46.5 47.7 17.1 39.0 136 135 A A H X S+ 0 0 0 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.901 111.5 49.2 -58.1 -40.8 49.6 14.0 38.0 137 136 A I H X S+ 0 0 52 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.916 108.5 53.4 -64.8 -41.9 46.8 11.8 39.4 138 137 A E H X S+ 0 0 78 -4,-2.3 4,-1.9 -5,-0.2 -2,-0.2 0.916 111.5 45.7 -58.9 -44.3 44.2 13.8 37.5 139 138 A V H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.937 111.7 50.5 -67.4 -45.8 46.1 13.3 34.3 140 139 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 5,-0.2 0.917 111.1 48.9 -59.0 -44.3 46.6 9.5 34.9 141 140 A T H X S+ 0 0 72 -4,-2.7 4,-3.1 1,-0.2 -1,-0.2 0.897 112.4 49.3 -59.5 -40.7 42.9 9.1 35.6 142 141 A W H X S+ 0 0 34 -4,-1.9 4,-2.0 -5,-0.2 -2,-0.2 0.883 107.5 54.3 -67.7 -39.8 42.0 11.0 32.5 143 142 A V H < S+ 0 0 2 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.928 116.5 37.6 -58.8 -45.9 44.4 8.9 30.4 144 143 A V H >< S+ 0 0 41 -4,-2.0 3,-1.5 1,-0.2 4,-0.3 0.937 115.8 51.5 -75.6 -43.2 42.8 5.7 31.5 145 144 A G H 3< S+ 0 0 64 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.798 122.0 33.3 -65.9 -27.4 39.2 7.0 31.5 146 145 A N T 3X S+ 0 0 51 -4,-2.0 4,-2.6 -5,-0.2 -1,-0.3 0.105 80.9 122.0-113.6 20.8 39.5 8.3 28.0 147 146 A A H <>>S+ 0 0 9 -3,-1.5 5,-2.7 1,-0.2 4,-1.2 0.842 72.5 52.1 -58.2 -38.1 41.9 5.7 26.6 148 147 A T H >45S+ 0 0 143 -4,-0.3 3,-0.6 2,-0.2 -1,-0.2 0.970 114.9 39.9 -63.5 -54.1 39.6 4.6 23.8 149 148 A R H 345S+ 0 0 160 1,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.858 117.6 49.6 -62.9 -38.0 39.0 8.1 22.4 150 149 A L H 3<5S- 0 0 11 -4,-2.6 -1,-0.2 -7,-0.2 -2,-0.2 0.629 113.4-115.2 -79.6 -13.0 42.7 9.1 22.9 151 150 A G T <<5 + 0 0 9 -4,-1.2 -69,-2.9 -3,-0.6 2,-0.3 0.807 66.6 138.1 83.4 31.2 44.1 5.9 21.2 152 151 A F E < -c 82 0A 8 -5,-2.7 2,-0.9 -71,-0.3 -1,-0.3 -0.809 55.4-132.2-108.2 150.0 45.8 4.3 24.3 153 152 A D E > - 0 0 45 -71,-3.1 3,-2.2 -2,-0.3 -69,-0.5 -0.860 18.0-167.2 -94.0 101.2 46.0 0.8 25.6 154 153 A A E 3 S+ 0 0 36 -2,-0.9 3,-0.4 1,-0.3 -1,-0.1 0.697 84.0 67.8 -64.9 -18.3 45.1 1.2 29.3 155 154 A R E 3 S+ 0 0 76 1,-0.2 -1,-0.3 -3,-0.1 2,-0.2 0.562 101.1 50.9 -74.5 -8.3 46.3 -2.3 30.0 156 155 A R E < S+ 0 0 55 -3,-2.2 -72,-2.5 -74,-0.1 2,-0.5 -0.601 77.4 150.1-128.9 68.5 49.9 -1.1 29.1 157 156 A L E +c 84 0A 0 -3,-0.4 28,-2.8 -2,-0.2 29,-0.7 -0.914 17.3 178.0-108.0 126.5 50.2 2.0 31.3 158 157 A A E -ce 85 186A 0 -74,-2.5 -72,-2.7 -2,-0.5 2,-0.3 -0.821 17.0-144.6-118.8 160.7 53.6 3.1 32.6 159 158 A V E +ce 86 187A 0 27,-2.1 29,-2.7 -2,-0.3 2,-0.3 -0.929 24.1 169.4-124.2 150.0 54.7 6.1 34.7 160 159 A A E +ce 87 188A 0 -74,-2.1 -72,-1.8 -2,-0.3 2,-0.3 -0.990 5.8 158.2-156.2 155.8 57.9 8.0 34.3 161 160 A G E -ce 88 189A 0 27,-1.9 29,-2.7 -2,-0.3 2,-0.4 -0.975 30.4-121.5-168.4 172.9 59.7 11.1 35.4 162 161 A S E > S- e 0 190A 1 -74,-1.4 3,-2.1 -2,-0.3 29,-0.2 -0.988 71.8 -39.5-123.7 133.1 63.1 12.8 35.9 163 162 A S T >> S+ 0 0 4 27,-2.9 30,-1.3 -2,-0.4 4,-1.2 -0.256 137.1 6.0 60.2-128.6 64.3 14.2 39.2 164 163 A A H 3> S+ 0 0 0 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.840 132.6 59.0 -57.3 -32.9 61.4 15.8 41.1 165 164 A G H <> S+ 0 0 0 -3,-2.1 4,-2.2 1,-0.2 -1,-0.3 0.848 100.1 55.9 -63.1 -31.6 59.1 14.5 38.4 166 165 A A H <> S+ 0 0 0 -3,-1.0 4,-2.6 24,-0.3 -1,-0.2 0.835 99.9 60.1 -68.8 -27.9 60.2 11.0 39.2 167 166 A T H X S+ 0 0 5 -4,-1.2 4,-1.4 2,-0.2 -2,-0.2 0.931 108.4 44.1 -59.8 -45.9 59.1 11.7 42.8 168 167 A L H X S+ 0 0 2 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.908 111.3 53.1 -66.7 -43.0 55.6 12.3 41.4 169 168 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.897 106.3 53.4 -58.6 -40.2 55.9 9.2 39.2 170 169 A A H X S+ 0 0 4 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.862 106.4 54.0 -63.9 -33.9 56.8 7.1 42.2 171 170 A G H X S+ 0 0 19 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.922 108.1 48.4 -64.7 -41.8 53.6 8.5 43.9 172 171 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.925 109.5 53.4 -62.2 -44.6 51.5 7.3 40.9 173 172 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.891 109.2 48.9 -57.5 -40.6 53.3 3.9 41.1 174 173 A H H X S+ 0 0 41 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.908 109.3 52.1 -65.8 -43.7 52.3 3.6 44.8 175 174 A G H X>S+ 0 0 7 -4,-2.3 6,-1.6 1,-0.2 5,-1.5 0.889 110.5 48.1 -58.3 -42.2 48.7 4.6 44.1 176 175 A A H ><5S+ 0 0 15 -4,-2.4 3,-0.9 4,-0.2 -1,-0.2 0.931 111.8 50.2 -62.8 -44.8 48.5 1.9 41.5 177 176 A A H 3<5S+ 0 0 48 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.864 112.7 46.1 -62.5 -37.3 50.0 -0.7 43.9 178 177 A D H 3<5S- 0 0 82 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.474 115.3-115.6 -86.9 -2.0 47.6 0.2 46.7 179 178 A G T <<5S+ 0 0 61 -3,-0.9 -3,-0.2 -4,-0.6 -4,-0.1 0.459 86.7 114.1 85.5 5.1 44.6 0.1 44.3 180 179 A S S - 0 0 20 57,-0.1 4,-1.5 -4,-0.1 5,-0.2 -0.762 36.7-101.7-121.7 172.5 72.7 11.1 52.6 200 199 A A H > S+ 0 0 72 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.896 122.6 51.3 -62.1 -43.2 76.5 11.0 52.3 201 200 A S H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.829 103.0 58.8 -66.8 -30.6 76.3 12.0 48.6 202 201 A R H 4 S+ 0 0 20 2,-0.2 11,-0.4 1,-0.2 -1,-0.2 0.920 113.3 39.1 -61.0 -41.6 74.1 15.0 49.3 203 202 A S H >< S+ 0 0 59 -4,-1.5 3,-1.4 1,-0.2 -2,-0.2 0.902 115.8 51.1 -72.3 -44.0 76.9 16.4 51.6 204 203 A E H 3< S+ 0 0 85 -4,-2.8 3,-0.3 1,-0.3 -2,-0.2 0.928 117.2 40.4 -59.2 -44.8 79.7 15.3 49.3 205 204 A F T >< S+ 0 0 2 -4,-2.7 8,-2.3 1,-0.2 3,-0.6 -0.255 73.4 134.1-100.4 46.3 78.0 16.9 46.4 206 205 A R T < S+ 0 0 130 -3,-1.4 8,-1.2 6,-0.3 9,-0.3 0.685 84.3 23.2 -62.7 -18.7 76.9 20.0 48.3 207 206 A A T 3 S+ 0 0 2 -3,-0.3 -200,-2.8 5,-0.1 -1,-0.2 0.108 81.1 140.0-148.3 26.5 78.1 22.2 45.4 208 207 A T < - 0 0 2 -3,-0.6 -184,-0.4 -202,-0.2 -200,-0.1 -0.268 59.6 -91.1 -62.0 157.8 78.3 20.3 42.2 209 208 A P S S+ 0 0 0 0, 0.0 2,-2.4 0, 0.0 76,-0.3 -0.267 102.2 15.5 -66.4 160.6 77.2 22.1 39.0 210 209 A A S S+ 0 0 31 -188,-2.5 2,-0.3 74,-0.1 -187,-0.1 -0.319 135.7 5.7 75.6 -54.8 73.6 22.0 37.7 211 210 A F S S+ 0 0 12 -2,-2.4 74,-0.3 74,-0.1 2,-0.3 -0.970 73.9 175.7-153.0 151.8 72.1 20.7 40.9 212 211 A D > - 0 0 2 -2,-0.3 4,-1.8 -5,-0.1 -6,-0.3 -0.847 45.1 -90.8-149.9 177.4 73.6 20.1 44.3 213 212 A G H > S+ 0 0 4 -8,-2.3 4,-1.7 -11,-0.4 -7,-0.2 0.786 120.0 53.9 -68.3 -33.3 73.0 19.1 47.9 214 213 A E H > S+ 0 0 99 -8,-1.2 4,-1.9 -9,-0.2 -1,-0.2 0.941 110.3 46.9 -67.9 -44.4 72.4 22.7 49.1 215 214 A A H > S+ 0 0 4 -9,-0.3 4,-3.0 1,-0.2 -2,-0.2 0.856 107.3 58.8 -60.2 -35.5 69.7 23.2 46.5 216 215 A A H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.908 104.4 50.5 -64.9 -37.4 68.2 19.8 47.4 217 216 A S H X S+ 0 0 41 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.943 113.7 43.8 -62.8 -49.1 67.7 21.1 51.0 218 217 A L H X S+ 0 0 37 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.902 110.1 58.4 -59.9 -43.0 66.0 24.3 49.7 219 218 A M H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.915 106.6 45.8 -52.8 -50.8 64.0 22.2 47.2 220 219 A W H X S+ 0 0 9 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.883 111.7 53.7 -64.8 -37.0 62.4 20.0 50.0 221 220 A R H X S+ 0 0 157 -4,-1.8 4,-2.0 -5,-0.2 5,-0.4 0.940 110.5 44.6 -64.4 -44.5 61.7 23.1 52.0 222 221 A H H < S+ 0 0 33 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.886 117.0 46.8 -64.0 -40.6 59.8 24.9 49.2 223 222 A Y H < S+ 0 0 4 -4,-2.1 -94,-2.7 -5,-0.2 -2,-0.2 0.892 116.9 40.2 -70.1 -46.1 57.9 21.7 48.3 224 223 A L H >< S- 0 0 15 -4,-2.8 3,-1.9 -5,-0.2 -2,-0.2 0.786 83.8-161.3 -76.2 -28.3 56.8 20.6 51.9 225 224 A A T 3< S- 0 0 56 -4,-2.0 -3,-0.1 -5,-0.3 3,-0.1 0.896 75.9 -41.9 44.1 53.3 56.0 24.2 53.0 226 225 A G T 3 S+ 0 0 80 -5,-0.4 -1,-0.3 1,-0.3 2,-0.2 0.417 104.8 135.9 81.6 -3.8 56.2 23.3 56.7 227 226 A Q < - 0 0 80 -3,-1.9 -1,-0.3 1,-0.1 -3,-0.0 -0.558 63.7-108.4 -75.8 142.7 54.4 19.9 56.3 228 227 A T - 0 0 125 -2,-0.2 5,-0.1 -3,-0.1 -1,-0.1 -0.545 39.6-110.6 -72.3 131.4 55.9 17.0 58.1 229 228 A P + 0 0 35 0, 0.0 -1,-0.1 0, 0.0 -5,-0.0 -0.335 46.5 166.6 -62.6 148.9 57.5 14.6 55.7 230 229 A S >> - 0 0 32 -3,-0.0 4,-2.4 8,-0.0 3,-0.7 -0.894 54.6 -90.9-150.1 171.0 55.7 11.3 55.3 231 230 A P T 34 S+ 0 0 43 0, 0.0 7,-0.3 0, 0.0 6,-0.1 0.794 124.1 61.2 -60.7 -23.9 55.8 8.3 52.9 232 231 A E T 34 S+ 0 0 102 1,-0.2 -58,-0.1 5,-0.1 6,-0.0 0.833 116.8 27.1 -71.6 -33.3 53.0 10.1 50.9 233 232 A S T <4 S+ 0 0 3 -3,-0.7 -1,-0.2 1,-0.2 -62,-0.1 0.691 128.3 44.2 -96.1 -20.4 55.2 13.2 50.2 234 233 A V >< - 0 0 0 -4,-2.4 3,-1.9 1,-0.1 4,-0.3 -0.891 64.5-166.3-131.6 95.3 58.6 11.4 50.3 235 234 A P G > S+ 0 0 13 0, 0.0 3,-2.0 0, 0.0 -40,-0.2 0.841 86.3 63.7 -57.1 -32.2 58.7 8.0 48.5 236 235 A G G 3 S+ 0 0 7 -42,-3.0 -41,-0.2 1,-0.3 -42,-0.1 0.706 94.9 61.9 -68.2 -17.6 62.0 7.0 50.1 237 236 A R G < S+ 0 0 82 -3,-1.9 -1,-0.3 -43,-0.4 2,-0.3 0.562 75.0 114.1 -81.5 -7.3 60.3 7.0 53.5 238 237 A R < - 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0 0 0 -3,-0.7 -29,-2.6 -271,-0.2 -1,-0.2 -0.979 46.4-154.3-130.8 134.8 78.0 12.5 34.9 284 283 A C E > -g 254 0A 0 -2,-0.4 3,-1.6 1,-0.2 -29,-0.2 -0.445 46.7 -65.5 -95.5 169.3 76.3 15.2 37.0 285 284 A H T 3 S+ 0 0 13 -31,-0.7 -1,-0.2 -74,-0.3 -74,-0.1 -0.343 124.4 21.5 -53.8 135.1 72.6 15.7 37.6 286 285 A G T >> S+ 0 0 13 -3,-0.1 4,-2.4 -76,-0.1 3,-1.2 0.609 77.4 145.4 84.9 14.3 70.8 16.7 34.4 287 286 A F H <> S+ 0 0 0 -3,-1.6 4,-2.2 1,-0.3 7,-0.2 0.845 70.6 51.3 -53.9 -39.0 73.6 15.3 32.1 288 287 A D H 34 S+ 0 0 6 1,-0.2 -1,-0.3 2,-0.2 6,-0.1 0.714 112.8 46.4 -77.2 -19.2 71.1 14.2 29.4 289 288 A S H <4 S+ 0 0 68 -3,-1.2 -2,-0.2 2,-0.1 -1,-0.2 0.834 113.3 48.7 -81.2 -41.1 69.6 17.7 29.4 290 289 A L H < S+ 0 0 62 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.860 133.4 12.0 -64.9 -38.2 73.0 19.5 29.3 291 290 A L >< + 0 0 40 -4,-2.2 3,-1.6 -5,-0.2 6,-0.3 -0.596 66.7 169.3-142.6 72.9 74.3 17.3 26.5 292 291 A P T 3 S+ 0 0 27 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.755 80.2 52.5 -68.9 -17.0 71.6 15.3 24.8 293 292 A E T 3 S+ 0 0 130 4,-0.1 -5,-0.1 5,-0.0 -2,-0.0 0.540 81.6 115.6 -89.7 -6.9 73.9 14.2 21.9 294 293 A W S <> S- 0 0 13 -3,-1.6 4,-2.8 -7,-0.2 5,-0.2 -0.330 78.0-119.7 -63.5 143.0 76.6 12.9 24.1 295 294 A T H > S+ 0 0 85 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.878 115.2 52.5 -51.3 -39.0 77.2 9.2 23.9 296 295 A T H > S+ 0 0 8 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.925 109.8 46.8 -66.4 -42.8 76.4 8.8 27.6 297 296 A S H > S+ 0 0 0 -6,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.893 112.5 51.3 -61.6 -41.8 73.1 10.7 27.2 298 297 A Q H X S+ 0 0 59 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.893 106.8 52.5 -64.9 -39.0 72.3 8.6 24.1 299 298 A R H X S+ 0 0 140 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.874 108.6 52.1 -62.6 -38.2 73.0 5.4 26.1 300 299 A L H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.964 111.0 46.2 -57.5 -53.9 70.6 6.6 28.7 301 300 A F H X S+ 0 0 2 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.887 113.8 48.7 -56.8 -41.6 67.9 7.2 26.0 302 301 A A H X S+ 0 0 31 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.908 111.5 50.0 -67.8 -39.7 68.5 3.8 24.4 303 302 A M H X S+ 0 0 39 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.896 111.9 47.2 -65.4 -43.6 68.4 2.1 27.8 304 303 A Q H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 5,-0.3 0.904 111.3 52.1 -63.4 -43.5 65.1 3.8 28.7 305 304 A G H X S+ 0 0 1 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.916 111.2 46.1 -60.5 -42.7 63.6 2.9 25.3 306 305 A H H X S+ 0 0 125 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.869 110.5 53.6 -70.7 -35.5 64.5 -0.8 25.6 307 306 A A H X S+ 0 0 7 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.947 115.4 38.9 -65.9 -48.2 63.2 -1.0 29.2 308 307 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.911 114.2 54.2 -67.7 -42.8 59.8 0.4 28.3 309 308 A A H X S+ 0 0 3 -4,-2.7 4,-2.7 -5,-0.3 -2,-0.2 0.900 108.1 50.1 -62.5 -38.3 59.7 -1.5 25.0 310 309 A D H < S+ 0 0 115 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.862 112.6 47.4 -67.0 -33.1 60.3 -4.8 26.8 311 310 A A H < S+ 0 0 28 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.900 119.5 39.3 -69.9 -41.1 57.5 -4.0 29.2 312 311 A F H < S+ 0 0 2 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.748 126.7 32.5 -81.3 -27.6 55.1 -3.0 26.4 313 312 A Y < 0 0 79 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.1 -0.608 360.0 360.0-134.3 66.0 56.1 -5.7 23.9 314 313 A P 0 0 174 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.716 360.0 360.0 -64.1 360.0 57.0 -8.9 25.8