==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-DEC-07 3BKH . COMPND 2 MOLECULE: LYTIC TRANSGLYCOSYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PHAGE PHIKZ; . AUTHOR A.FOKINE,K.A.MIROSHNIKOV,M.M.SHNEIDER,V.V.MESYANZHINOV, . 268 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13442.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 180 67.2 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 . 12 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 14 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 113 42.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.9 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 0 2 1 0 0 2 2 1 2 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 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 . 6 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 -7 A H > 0 0 190 0, 0.0 4,-0.7 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0-151.1 22.6 44.1 83.9 2 -6 A H H > + 0 0 57 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.581 360.0 70.5 -84.5 -13.9 22.9 40.6 85.6 3 -5 A H H > S+ 0 0 75 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.794 92.6 52.5 -71.9 -31.4 20.5 39.7 82.8 4 -4 A H H > S+ 0 0 127 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.890 110.7 46.7 -73.4 -38.7 23.2 40.0 80.1 5 -3 A H H >< S+ 0 0 17 -4,-0.7 3,-0.9 1,-0.2 4,-0.4 0.915 113.5 47.3 -68.5 -41.3 25.6 37.7 82.0 6 -2 A G H >< S+ 0 0 2 -4,-2.0 3,-0.6 1,-0.2 -1,-0.2 0.755 103.8 67.5 -68.6 -21.8 22.8 35.2 82.6 7 -1 A S H 3< S+ 0 0 65 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.793 103.5 40.9 -65.5 -32.8 22.1 35.7 78.9 8 0 A I T << S+ 0 0 107 -3,-0.9 -1,-0.2 -4,-0.8 -2,-0.2 0.373 93.5 106.8 -99.2 0.4 25.4 34.1 77.9 9 1 A X S < S- 0 0 28 -3,-0.6 2,-0.2 -4,-0.4 58,-0.1 -0.398 84.3 -93.2 -75.7 158.5 25.2 31.3 80.5 10 2 A K - 0 0 85 -2,-0.1 2,-0.7 1,-0.1 -1,-0.1 -0.540 36.5-120.3 -73.8 137.4 24.4 27.8 79.3 11 3 A V - 0 0 66 -2,-0.2 2,-0.3 -4,-0.1 55,-0.2 -0.714 37.3-152.5 -80.6 115.1 20.7 27.0 79.4 12 4 A L B +A 65 0A 0 53,-1.7 53,-2.5 -2,-0.7 2,-0.3 -0.681 19.7 175.7 -98.2 146.2 20.5 24.0 81.8 13 5 A R > - 0 0 127 -2,-0.3 3,-2.1 51,-0.2 29,-0.2 -0.917 47.0 -76.7-137.9 161.5 18.0 21.1 82.0 14 6 A K T 3 S+ 0 0 124 -2,-0.3 29,-0.2 1,-0.2 3,-0.1 -0.420 119.1 38.3 -60.7 128.0 17.7 18.0 84.1 15 7 A G T 3 S+ 0 0 46 27,-2.2 -1,-0.2 1,-0.4 28,-0.1 0.107 88.7 114.1 116.4 -21.8 20.2 15.5 82.6 16 8 A D < - 0 0 45 -3,-2.1 26,-2.0 26,-0.1 -1,-0.4 -0.210 41.5-173.0 -76.1 172.0 23.0 17.9 81.8 17 9 A R B +B 41 0B 166 24,-0.2 2,-0.3 -3,-0.1 24,-0.2 -0.959 26.9 74.9-165.9 147.1 26.4 17.8 83.5 18 10 A G S > S- 0 0 31 22,-2.3 4,-1.5 -2,-0.3 3,-0.2 -0.876 90.4 -38.4 141.6-174.4 29.6 19.8 83.6 19 11 A D H > S+ 0 0 98 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.821 130.7 56.2 -52.4 -35.7 31.2 23.0 85.1 20 12 A E H > S+ 0 0 60 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.942 106.2 46.8 -63.8 -50.7 27.9 24.9 84.4 21 13 A V H > S+ 0 0 0 19,-0.3 4,-1.9 1,-0.2 19,-0.3 0.763 113.0 54.0 -62.6 -24.3 25.7 22.5 86.4 22 14 A C H X S+ 0 0 39 -4,-1.5 4,-1.7 18,-0.3 -1,-0.2 0.897 107.6 46.4 -76.0 -43.0 28.4 22.8 89.1 23 15 A Q H X S+ 0 0 18 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.858 111.9 55.4 -66.1 -34.7 28.3 26.6 89.1 24 16 A L H X S+ 0 0 1 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.973 107.2 45.6 -61.1 -58.6 24.5 26.3 89.3 25 17 A Q H X S+ 0 0 5 -4,-1.9 4,-2.1 1,-0.2 10,-0.2 0.820 110.3 55.0 -56.7 -35.8 24.4 24.0 92.4 26 18 A T H X S+ 0 0 30 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.973 110.3 46.0 -62.0 -52.6 26.9 26.2 94.2 27 19 A L H < S+ 0 0 2 -4,-2.1 4,-0.3 1,-0.2 -2,-0.2 0.871 110.2 54.0 -56.8 -41.7 24.6 29.3 93.6 28 20 A L H ><>S+ 0 0 1 -4,-2.4 5,-3.1 1,-0.2 3,-0.7 0.900 112.2 43.4 -61.8 -42.0 21.5 27.4 94.7 29 21 A N H ><5S+ 0 0 45 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.881 112.1 53.7 -69.0 -39.0 23.2 26.4 98.0 30 22 A L T 3<5S+ 0 0 40 -4,-2.6 48,-2.6 1,-0.2 -1,-0.2 0.452 107.7 53.1 -73.8 -3.1 24.5 30.0 98.3 31 23 A C T < 5S- 0 0 26 -3,-0.7 -1,-0.2 -4,-0.3 -2,-0.2 0.504 126.6 -97.3-106.7 -11.9 20.9 31.2 97.9 32 24 A G T < 5S+ 0 0 67 -3,-0.9 2,-0.8 -4,-0.5 -3,-0.2 0.488 90.1 120.1 106.0 7.6 19.5 29.0 100.6 33 25 A Y < - 0 0 38 -5,-3.1 2,-0.3 -6,-0.2 -1,-0.2 -0.819 57.2-145.7-108.9 92.6 18.3 26.2 98.3 34 26 A D + 0 0 123 -2,-0.8 -5,-0.1 1,-0.2 3,-0.1 -0.403 37.5 153.7 -63.9 119.3 20.1 23.1 99.5 35 27 A V - 0 0 14 1,-0.4 2,-0.2 -2,-0.3 -1,-0.2 0.450 54.0-118.7-118.8 -13.1 21.0 20.7 96.7 36 28 A G - 0 0 27 -11,-0.1 -1,-0.4 9,-0.1 -7,-0.1 -0.570 62.5 -10.4 104.3-170.5 24.0 19.2 98.4 37 29 A K S S- 0 0 178 -2,-0.2 2,-0.1 1,-0.1 -11,-0.1 -0.472 81.2-109.1 -65.3 125.5 27.6 19.1 97.5 38 30 A P + 0 0 46 0, 0.0 -16,-0.1 0, 0.0 -1,-0.1 -0.371 47.2 164.2 -58.9 126.0 28.0 20.3 93.9 39 31 A D - 0 0 97 -18,-0.2 -17,-0.2 2,-0.1 3,-0.1 0.526 53.0-112.4-118.9 -15.1 28.9 17.4 91.7 40 32 A G S S+ 0 0 6 -19,-0.3 -22,-2.3 1,-0.2 2,-0.5 0.580 80.9 113.9 92.3 10.5 28.2 18.8 88.2 41 33 A I B -B 17 0B 69 -24,-0.2 2,-1.3 -20,-0.2 -24,-0.2 -0.948 61.2-140.9-122.5 113.8 25.2 16.5 87.5 42 34 A F + 0 0 6 -26,-2.0 -27,-2.2 -2,-0.5 -26,-0.1 -0.551 44.5 148.6 -72.7 93.4 21.7 18.1 87.2 43 35 A G > - 0 0 30 -2,-1.3 4,-1.2 -29,-0.2 -27,-0.1 0.141 61.4 -67.4-103.1-142.1 19.5 15.5 88.8 44 36 A N H > S+ 0 0 92 2,-0.2 4,-2.8 3,-0.1 5,-0.3 0.883 125.4 54.6 -83.3 -43.5 16.3 15.5 90.8 45 37 A N H > S+ 0 0 116 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.915 113.8 44.4 -56.4 -42.9 17.5 17.4 94.0 46 38 A T H > S+ 0 0 4 -5,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.902 112.0 52.6 -68.7 -41.3 18.7 20.1 91.7 47 39 A F H X S+ 0 0 66 -4,-1.2 4,-2.3 1,-0.2 -2,-0.2 0.914 108.7 48.5 -61.4 -46.0 15.6 20.2 89.6 48 40 A N H X S+ 0 0 98 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.810 112.8 48.1 -66.4 -30.5 13.2 20.5 92.6 49 41 A Q H X S+ 0 0 44 -4,-1.2 4,-2.6 -5,-0.3 -1,-0.2 0.812 109.9 52.3 -78.7 -32.3 15.2 23.4 94.0 50 42 A V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.935 111.5 47.4 -66.3 -46.7 15.4 25.2 90.7 51 43 A V H X S+ 0 0 18 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.944 115.1 44.0 -59.7 -52.5 11.6 24.9 90.4 52 44 A K H X S+ 0 0 113 -4,-1.9 4,-3.4 1,-0.2 5,-0.3 0.947 112.5 52.6 -58.3 -51.3 10.9 26.1 93.9 53 45 A F H X S+ 0 0 2 -4,-2.6 4,-0.9 1,-0.2 -1,-0.2 0.862 111.0 48.6 -52.3 -40.2 13.5 28.9 93.5 54 46 A Q H <>S+ 0 0 1 -4,-2.2 5,-2.3 2,-0.2 4,-0.5 0.894 112.2 47.2 -68.8 -42.3 11.7 30.0 90.3 55 47 A K H ><5S+ 0 0 130 -4,-2.5 3,-1.1 1,-0.2 -2,-0.2 0.922 109.6 53.6 -65.1 -44.2 8.3 29.9 92.0 56 48 A D H 3<5S+ 0 0 88 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.761 117.3 39.3 -61.0 -24.6 9.6 31.9 95.0 57 49 A N T 3<5S- 0 0 37 -4,-0.9 -1,-0.2 -5,-0.3 -2,-0.2 0.337 111.6-111.9-111.2 7.8 10.9 34.5 92.6 58 50 A C T < 5 + 0 0 123 -3,-1.1 2,-0.3 -4,-0.5 -3,-0.2 0.951 68.5 137.8 61.1 54.4 8.1 34.7 89.9 59 51 A L S - 0 0 16 -2,-1.0 4,-2.9 -55,-0.2 5,-0.2 -0.307 64.4 -55.9-113.5-162.9 17.9 30.3 81.4 67 59 A K H > S+ 0 0 98 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.885 131.0 44.0 -42.1 -59.4 18.8 34.0 81.4 68 60 A N H > S+ 0 0 75 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.875 114.3 47.6 -59.5 -44.5 16.2 35.0 84.0 69 61 A T H > S+ 0 0 8 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.914 114.3 48.9 -66.0 -39.9 16.8 32.2 86.4 70 62 A W H X S+ 0 0 1 -4,-2.9 4,-2.8 1,-0.2 5,-0.3 0.949 110.2 49.9 -62.6 -50.4 20.6 32.8 86.1 71 63 A A H X S+ 0 0 5 -4,-2.9 4,-1.0 -5,-0.2 -1,-0.2 0.866 109.5 52.7 -56.7 -36.9 20.3 36.5 86.7 72 64 A E H X S+ 0 0 39 -4,-1.9 4,-2.1 -5,-0.2 3,-0.3 0.935 109.8 47.6 -65.7 -46.2 18.1 35.8 89.8 73 65 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 3,-0.2 0.943 110.9 50.6 -59.0 -48.8 20.8 33.5 91.3 74 66 A F H < S+ 0 0 9 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.767 114.6 48.5 -60.3 -22.7 23.5 36.0 90.6 75 67 A S H < S+ 0 0 70 -4,-1.0 -2,-0.2 -5,-0.3 -1,-0.2 0.798 119.5 31.7 -88.4 -31.4 21.3 38.5 92.3 76 68 A K H < S+ 0 0 107 -4,-2.1 -2,-0.2 -3,-0.2 -3,-0.2 0.771 87.2 108.6 -99.4 -29.6 20.3 36.5 95.5 77 69 A Y < - 0 0 20 -4,-2.6 -46,-0.2 -5,-0.2 -50,-0.1 -0.079 61.6-135.0 -52.7 147.5 23.4 34.3 96.3 78 70 A S - 0 0 83 -48,-2.6 -1,-0.1 -51,-0.2 -46,-0.1 -0.939 18.2-128.2-111.1 113.2 25.5 35.2 99.3 79 71 A P - 0 0 45 0, 0.0 79,-0.2 0, 0.0 80,-0.1 -0.421 9.9-148.8 -61.2 117.8 29.3 35.1 98.7 80 72 A P S S+ 0 0 73 0, 0.0 79,-0.2 0, 0.0 78,-0.1 0.779 90.9 16.3 -60.8 -27.8 30.9 33.0 101.4 81 73 A I S S- 0 0 43 77,-1.6 5,-0.1 76,-0.3 27,-0.0 -0.555 78.9-154.6-147.9 77.9 34.1 35.1 101.3 82 74 A P > - 0 0 53 0, 0.0 3,-3.1 0, 0.0 4,-0.3 -0.291 23.9-126.0 -55.3 132.1 33.8 38.5 99.6 83 75 A Y G > S+ 0 0 42 76,-2.5 3,-1.3 1,-0.3 77,-0.1 0.648 106.1 74.6 -56.6 -13.3 37.2 39.6 98.3 84 76 A K G 3 S+ 0 0 127 1,-0.3 -1,-0.3 75,-0.2 4,-0.1 0.659 81.4 69.7 -73.3 -14.9 36.7 42.8 100.2 85 77 A T G < S+ 0 0 85 -3,-3.1 -1,-0.3 2,-0.1 -2,-0.2 0.666 85.7 79.5 -75.1 -15.2 37.5 40.8 103.3 86 78 A I S < S- 0 0 4 -3,-1.3 88,-0.1 -4,-0.3 15,-0.1 -0.818 92.0-122.6 -90.5 126.4 41.0 40.6 102.0 87 79 A P - 0 0 63 0, 0.0 17,-0.1 0, 0.0 -2,-0.1 -0.400 17.9-115.5 -73.6 148.1 42.8 43.9 102.8 88 80 A X - 0 0 85 -4,-0.1 2,-0.2 -2,-0.1 84,-0.0 -0.456 38.5-104.0 -74.0 150.3 44.4 46.0 100.1 89 81 A P - 0 0 9 0, 0.0 9,-0.1 0, 0.0 8,-0.1 -0.595 23.3-126.0 -78.2 143.5 48.1 46.3 100.3 90 82 A T S S+ 0 0 141 7,-0.3 2,-0.3 -2,-0.2 8,-0.1 0.780 89.4 12.1 -57.7 -27.1 49.3 49.7 101.7 91 83 A A S S- 0 0 46 3,-0.2 3,-0.5 0, 0.0 2,-0.2 -0.966 76.2-113.4-148.7 162.8 51.5 50.2 98.7 92 84 A N S S+ 0 0 42 -2,-0.3 35,-0.2 1,-0.2 3,-0.1 -0.548 94.9 22.1 -95.0 160.8 52.2 48.8 95.2 93 85 A K S S+ 0 0 142 33,-2.2 2,-0.5 -2,-0.2 34,-0.2 0.671 95.0 126.1 57.6 18.3 55.5 47.1 94.1 94 86 A S > - 0 0 36 32,-0.5 4,-1.6 -3,-0.5 -1,-0.2 -0.929 48.6-166.3-114.2 119.2 56.1 46.3 97.8 95 87 A R H > S+ 0 0 75 -2,-0.5 4,-0.9 1,-0.2 -1,-0.1 0.856 95.8 52.1 -66.4 -35.6 56.7 42.8 99.0 96 88 A A H 4 S+ 0 0 74 1,-0.2 -1,-0.2 2,-0.2 3,-0.2 0.852 108.8 49.0 -69.2 -34.8 56.1 43.9 102.6 97 89 A A H > S+ 0 0 4 1,-0.2 4,-0.6 2,-0.2 -7,-0.3 0.824 110.4 52.9 -73.0 -30.0 52.8 45.5 101.7 98 90 A A H X S+ 0 0 0 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.683 91.5 78.4 -78.0 -19.8 51.8 42.3 99.9 99 91 A T H X S+ 0 0 47 -4,-0.9 4,-1.7 1,-0.2 5,-0.2 0.940 91.7 46.3 -58.4 -55.3 52.5 40.1 103.0 100 92 A P H > S+ 0 0 66 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.900 112.6 54.0 -57.1 -36.5 49.4 40.7 105.0 101 93 A V H X S+ 0 0 0 -4,-0.6 4,-2.4 1,-0.2 -2,-0.2 0.955 108.3 47.0 -60.2 -51.0 47.3 40.2 101.9 102 94 A X H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.753 108.5 56.7 -64.4 -24.9 48.9 36.8 101.2 103 95 A N H X S+ 0 0 70 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.945 108.8 45.7 -70.1 -47.2 48.3 35.8 104.8 104 96 A A H X S+ 0 0 24 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.893 113.0 51.1 -61.0 -40.4 44.6 36.6 104.5 105 97 A V H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 5,-0.5 0.864 107.4 52.9 -67.6 -34.1 44.6 34.7 101.2 106 98 A E H X S+ 0 0 59 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.919 109.1 49.0 -66.3 -42.3 46.3 31.7 102.8 107 99 A N H < S+ 0 0 149 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.864 116.9 44.1 -62.6 -34.2 43.6 31.6 105.5 108 100 A A H < S+ 0 0 25 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.836 131.5 17.3 -80.2 -37.3 41.0 31.8 102.8 109 101 A T H < S- 0 0 12 -4,-2.7 -3,-0.2 2,-0.2 -2,-0.2 0.607 95.0-121.5-112.5 -18.6 42.3 29.3 100.3 110 102 A G < + 0 0 51 -4,-2.6 2,-0.4 -5,-0.5 -4,-0.2 0.259 66.6 133.5 94.4 -13.9 44.8 27.3 102.3 111 103 A V - 0 0 5 -6,-0.4 -1,-0.3 1,-0.1 -2,-0.2 -0.611 64.2-107.2 -78.4 127.6 47.8 28.1 100.0 112 104 A R >> - 0 0 158 -2,-0.4 4,-1.8 1,-0.1 3,-0.6 -0.224 17.5-139.3 -54.6 129.9 51.0 29.2 101.8 113 105 A S H 3> S+ 0 0 8 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.771 100.4 64.8 -63.1 -28.4 51.7 32.9 101.5 114 106 A Q H 3> S+ 0 0 107 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.926 106.7 45.3 -60.3 -41.1 55.4 32.3 101.0 115 107 A L H <> S+ 0 0 24 -3,-0.6 4,-2.4 2,-0.2 -2,-0.2 0.931 111.9 49.5 -66.8 -47.9 54.4 30.6 97.8 116 108 A L H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.859 112.4 50.7 -59.9 -35.0 52.0 33.4 96.8 117 109 A L H X S+ 0 0 14 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.938 107.9 50.5 -69.5 -46.2 54.7 35.9 97.5 118 110 A T H X S+ 0 0 7 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.917 114.0 45.9 -57.1 -46.4 57.3 34.0 95.4 119 111 A F H X S+ 0 0 1 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.919 111.3 49.5 -64.1 -48.5 54.9 33.9 92.4 120 112 A A H X S+ 0 0 0 -4,-2.3 4,-1.8 -5,-0.2 6,-1.7 0.803 113.5 50.4 -61.9 -27.6 53.8 37.5 92.6 121 113 A S H X S+ 0 0 13 -4,-1.8 4,-1.7 4,-0.2 -2,-0.2 0.929 112.9 41.8 -76.1 -48.1 57.5 38.5 92.8 122 114 A I H < S+ 0 0 33 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.825 120.7 45.3 -68.0 -33.4 58.6 36.5 89.7 123 115 A E H < S- 0 0 40 -4,-2.4 -2,-0.2 17,-0.2 -1,-0.2 0.879 138.9 -6.2 -80.4 -40.9 55.5 37.5 87.8 124 116 A S H >< S- 0 0 11 -4,-1.8 3,-2.1 16,-0.3 -3,-0.2 0.285 81.8-116.6-141.2 10.2 55.3 41.2 88.4 125 117 A A T 3< S- 0 0 65 -4,-1.7 -4,-0.2 1,-0.3 -3,-0.1 0.885 83.2 -57.8 49.0 36.3 57.9 42.2 91.0 126 118 A F T 3 S+ 0 0 10 -6,-1.7 -33,-2.2 14,-0.2 2,-0.9 0.565 101.3 135.8 70.9 15.8 54.8 43.1 93.1 127 119 A D < - 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0 0 30 -3,-1.9 2,-0.4 1,-0.2 -5,-0.2 0.940 35.4-168.4 43.5 67.6 50.0 38.0 85.2 143 135 A F B < -D 138 0C 5 -5,-2.0 -5,-1.4 -7,-0.2 -1,-0.2 -0.701 14.4-134.4 -87.5 134.6 46.7 36.5 84.2 144 136 A L > - 0 0 76 -2,-0.4 4,-2.2 -7,-0.2 5,-0.2 -0.436 27.2-109.1 -79.3 161.5 45.8 36.3 80.5 145 137 A T H > S+ 0 0 69 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.908 116.7 50.8 -58.7 -42.4 42.3 37.4 79.5 146 138 A G H > S+ 0 0 42 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.978 113.4 39.7 -59.7 -61.8 41.4 33.8 78.6 147 139 A T H > S+ 0 0 67 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.829 114.5 55.8 -59.6 -34.0 42.5 32.1 81.8 148 140 A W H X S+ 0 0 2 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.936 106.2 49.5 -64.3 -47.4 41.2 34.9 83.9 149 141 A K H X S+ 0 0 120 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.919 112.1 49.1 -57.0 -46.1 37.7 34.6 82.4 150 142 A T H X S+ 0 0 59 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.909 111.1 49.7 -61.0 -44.0 37.8 30.9 83.1 151 143 A X H X>S+ 0 0 8 -4,-2.3 4,-1.4 2,-0.2 5,-0.6 0.872 108.6 53.0 -65.1 -37.6 38.9 31.5 86.7 152 144 A I H X5S+ 0 0 6 -4,-2.5 4,-2.6 1,-0.2 3,-0.5 0.964 110.3 45.5 -62.9 -52.7 36.1 34.0 87.4 153 145 A E H <5S+ 0 0 66 -4,-2.1 -1,-0.2 1,-0.2 4,-0.2 0.818 118.7 43.1 -62.0 -31.1 33.3 31.8 86.2 154 146 A N H <5S+ 0 0 38 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.633 136.3 8.7 -92.5 -12.6 34.6 28.8 88.2 155 147 A Y H >X5S+ 0 0 54 -4,-1.4 3,-0.7 -3,-0.5 4,-0.5 0.470 100.0 97.0-139.4 -16.4 35.6 30.4 91.5 156 148 A G G >45S+ 0 0 17 -5,-0.4 3,-1.8 1,-0.3 -76,-0.3 0.848 96.2 69.6 -49.5 -39.8 31.0 33.6 93.2 158 150 A K G <45S+ 0 0 67 -3,-0.7 -77,-1.6 1,-0.3 -1,-0.3 0.788 113.8 29.1 -48.9 -29.5 32.9 32.1 96.1 159 151 A Y G <<5S- 0 0 0 -3,-2.5 -76,-2.5 -4,-0.5 -1,-0.3 0.227 124.3 -93.7-119.7 11.8 34.3 35.6 96.5 160 152 A G T < 5S+ 0 0 27 -3,-1.8 2,-0.4 -4,-0.3 -3,-0.2 0.822 89.1 112.6 82.3 33.2 31.5 37.8 95.2 161 153 A V < + 0 0 7 -5,-1.5 -2,-0.2 -9,-0.1 -1,-0.2 -0.912 29.0 168.6-140.7 108.3 32.5 38.3 91.6 162 154 A L + 0 0 23 -2,-0.4 2,-0.3 1,-0.3 -5,-0.2 0.859 68.9 5.9 -86.0 -40.8 30.4 36.7 88.9 163 155 A T - 0 0 58 -7,-0.1 -1,-0.3 -6,-0.0 3,-0.1 -0.995 39.6-176.1-148.6 151.7 31.9 38.4 85.9 164 156 A D > + 0 0 22 -2,-0.3 3,-1.2 -3,-0.1 6,-0.1 -0.542 15.8 173.5-144.5 66.7 34.7 40.7 84.8 165 157 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.1 0, 0.0 -16,-0.1 0.844 83.0 47.1 -43.8 -45.8 34.0 41.3 81.1 166 158 A T T 3 S- 0 0 116 1,-0.1 -21,-0.0 -3,-0.1 -2,-0.0 0.771 100.5-135.6 -71.2 -26.9 36.8 43.9 80.9 167 159 A G X + 0 0 3 -3,-1.2 3,-1.4 -19,-0.1 -1,-0.1 0.604 65.3 134.7 76.4 10.6 39.2 41.6 82.8 168 160 A A G > + 0 0 49 1,-0.3 3,-1.4 2,-0.1 4,-0.1 0.672 50.4 71.7 -66.4 -22.0 39.9 44.9 84.5 169 161 A L G > S+ 0 0 40 1,-0.3 3,-2.2 2,-0.2 7,-0.3 0.601 73.3 85.8 -72.8 -8.9 39.8 43.4 88.0 170 162 A R G < S+ 0 0 21 -3,-1.4 -30,-0.3 1,-0.3 -1,-0.3 0.665 83.4 61.5 -63.6 -12.6 43.1 41.7 87.2 171 163 A K G < S+ 0 0 108 -3,-1.4 -1,-0.3 -32,-0.1 -2,-0.2 0.547 83.9 90.5 -88.4 -10.4 44.6 45.0 88.4 172 164 A D <> - 0 0 22 -3,-2.2 4,-2.0 1,-0.1 5,-0.2 -0.799 68.6-152.8 -89.2 116.3 43.0 44.5 91.9 173 165 A P H > S+ 0 0 1 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.817 88.8 56.7 -57.0 -36.3 45.6 42.7 94.1 174 166 A R H > S+ 0 0 28 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.976 112.5 37.2 -62.1 -59.0 42.9 41.1 96.4 175 167 A I H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.863 115.9 54.7 -65.0 -35.3 40.9 39.3 93.7 176 168 A S H X S+ 0 0 0 -4,-2.0 4,-3.1 -7,-0.3 -1,-0.2 0.913 109.6 47.2 -64.0 -42.1 44.1 38.4 91.7 177 169 A A H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.913 112.6 49.0 -65.4 -43.9 45.6 36.7 94.8 178 170 A L H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.964 116.9 41.6 -58.8 -53.0 42.4 34.8 95.5 179 171 A X H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.897 112.5 55.9 -62.2 -40.9 42.2 33.7 91.9 180 172 A G H X S+ 0 0 1 -4,-3.1 4,-2.3 -5,-0.2 -1,-0.2 0.915 107.7 48.0 -57.9 -44.6 46.0 33.1 91.9 181 173 A A H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 -1,-0.2 0.861 109.8 52.6 -65.9 -34.9 45.7 30.7 94.9 182 174 A E H X S+ 0 0 7 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.926 109.2 49.9 -65.7 -42.0 42.8 28.8 93.2 183 175 A L H X S+ 0 0 30 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.940 111.1 48.8 -60.1 -47.1 44.9 28.3 90.1 184 176 A I H X S+ 0 0 3 -4,-2.3 4,-3.2 1,-0.2 5,-0.3 0.863 108.4 55.3 -60.2 -37.8 47.8 27.0 92.3 185 177 A K H X S+ 0 0 93 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.945 106.7 48.7 -60.7 -51.4 45.4 24.7 94.1 186 178 A E H X S+ 0 0 65 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.935 115.7 46.0 -53.9 -48.0 44.2 23.1 90.8 187 179 A N H X S+ 0 0 5 -4,-2.1 4,-2.3 2,-0.2 3,-0.3 0.916 111.4 47.1 -64.9 -47.9 47.8 22.6 89.8 188 180 A X H X S+ 0 0 28 -4,-3.2 4,-2.1 1,-0.2 -1,-0.2 0.832 112.0 55.6 -65.4 -25.1 49.2 21.2 93.0 189 181 A N H < S+ 0 0 101 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.830 109.5 44.1 -73.0 -35.1 46.2 18.9 93.0 190 182 A I H < S+ 0 0 56 -4,-1.5 4,-0.5 -3,-0.3 -2,-0.2 0.849 117.4 45.8 -77.4 -36.8 47.0 17.6 89.5 191 183 A L H >< S+ 0 0 2 -4,-2.3 3,-0.8 1,-0.2 -2,-0.2 0.866 100.6 62.1 -77.5 -39.9 50.7 17.2 90.3 192 184 A R G >< S+ 0 0 84 -4,-2.1 3,-0.9 1,-0.2 5,-0.3 0.844 92.9 65.4 -59.3 -33.9 50.7 15.5 93.7 193 185 A P G 3 S+ 0 0 103 0, 0.0 2,-0.5 0, 0.0 -1,-0.2 0.903 110.9 38.1 -54.7 -40.0 48.9 12.4 92.4 194 186 A V G < S+ 0 0 58 -3,-0.8 2,-0.2 -4,-0.5 -2,-0.1 -0.584 106.7 74.4-111.0 68.3 52.0 11.7 90.3 195 187 A L < - 0 0 35 -3,-0.9 2,-2.9 -2,-0.5 25,-0.0 -0.647 67.3-141.8-178.3 113.9 54.8 12.7 92.6 196 188 A K S S+ 0 0 209 -2,-0.2 2,-0.3 2,-0.1 -4,-0.1 -0.334 89.6 56.4 -77.2 58.6 56.2 11.0 95.7 197 189 A R S S- 0 0 119 -2,-2.9 3,-0.0 -5,-0.3 -3,-0.0 -0.932 97.2 -92.1-178.6 155.7 56.6 14.4 97.1 198 190 A E - 0 0 107 -2,-0.3 -2,-0.1 1,-0.1 -10,-0.0 -0.715 61.4 -96.6 -80.0 130.3 54.5 17.5 97.9 199 191 A P - 0 0 13 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.195 43.1-140.7 -49.6 132.9 54.8 19.8 94.9 200 192 A T > - 0 0 50 1,-0.1 4,-2.3 -3,-0.0 5,-0.2 -0.320 26.0-101.2 -87.7 175.0 57.5 22.4 95.4 201 193 A D H > S+ 0 0 27 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.895 126.0 51.1 -64.9 -37.6 57.3 26.1 94.4 202 194 A T H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.888 109.0 50.4 -65.7 -41.0 59.5 25.2 91.4 203 195 A D H > S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.918 113.3 46.1 -61.4 -45.0 57.1 22.4 90.4 204 196 A L H X S+ 0 0 3 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.756 108.9 55.1 -70.4 -26.9 54.1 24.7 90.7 205 197 A Y H X S+ 0 0 13 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.862 105.0 53.2 -74.7 -35.2 55.9 27.4 88.7 206 198 A L H X S+ 0 0 0 -4,-1.8 4,-3.6 2,-0.2 5,-0.4 0.925 110.6 47.0 -62.5 -43.1 56.5 25.0 85.9 207 199 A A H X S+ 0 0 1 -4,-1.6 4,-1.5 1,-0.2 -2,-0.2 0.887 113.6 48.8 -64.9 -37.4 52.8 24.2 85.9 208 200 A H H < S+ 0 0 37 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.850 118.3 40.9 -69.2 -33.7 52.1 27.9 86.0 209 201 A F H < S+ 0 0 80 -4,-2.5 -2,-0.2 2,-0.1 -3,-0.2 0.915 131.3 20.3 -81.8 -48.6 54.5 28.5 83.1 210 202 A F H < S- 0 0 30 -4,-3.6 4,-0.4 1,-0.2 -3,-0.2 0.428 116.2 -96.1-103.8 -0.3 53.8 25.6 80.8 211 203 A G X - 0 0 25 -4,-1.5 4,-2.5 -5,-0.4 -1,-0.2 0.000 37.7 -86.6 98.5 150.0 50.3 24.6 82.0 212 204 A P H > S+ 0 0 41 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.885 127.9 48.3 -60.6 -38.8 49.4 21.9 84.5 213 205 A G H > S+ 0 0 22 2,-0.2 4,-1.6 1,-0.2 5,-0.2 0.940 112.0 47.9 -67.1 -47.2 49.3 19.2 81.8 214 206 A A H > S+ 0 0 8 -4,-0.4 4,-2.3 1,-0.2 3,-0.2 0.943 114.0 46.8 -58.3 -50.1 52.6 20.2 80.3 215 207 A A H X S+ 0 0 0 -4,-2.5 4,-3.6 1,-0.2 5,-0.2 0.852 104.6 61.5 -61.5 -38.5 54.3 20.3 83.7 216 208 A R H < S+ 0 0 106 -4,-2.0 4,-0.2 -5,-0.2 -1,-0.2 0.928 110.3 39.6 -55.3 -49.2 52.9 17.0 84.8 217 209 A R H >< S+ 0 0 121 -4,-1.6 3,-1.5 -3,-0.2 -2,-0.2 0.958 117.9 49.9 -65.6 -49.5 54.6 15.1 81.9 218 210 A F H >< S+ 0 0 7 -4,-2.3 3,-1.1 1,-0.3 -2,-0.2 0.936 101.0 59.4 -54.5 -56.0 57.8 17.2 82.3 219 211 A L T 3< S+ 0 0 29 -4,-3.6 -1,-0.3 1,-0.3 -2,-0.2 0.583 118.7 35.2 -52.4 -7.8 58.2 16.8 86.1 220 212 A T T < S+ 0 0 85 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.1 -0.435 88.4 104.1-145.7 64.2 58.4 13.0 85.3 221 213 A T S < S- 0 0 31 -3,-1.1 4,-0.2 4,-0.0 31,-0.1 -0.302 89.8 -67.0-147.0 60.1 60.1 12.6 81.9 222 214 A G > - 0 0 33 2,-0.1 3,-1.1 30,-0.1 30,-0.4 0.873 39.7-129.5 59.4 112.4 63.7 11.4 82.2 223 215 A Q T 3 S+ 0 0 122 1,-0.3 30,-2.5 29,-0.2 2,-0.7 0.933 104.8 41.9 -54.0 -57.3 66.3 13.6 83.7 224 216 A N T 3 S+ 0 0 132 28,-0.2 2,-0.3 27,-0.2 -1,-0.3 -0.225 93.0 116.7 -89.6 46.7 69.0 13.4 81.0 225 217 A E S < S- 0 0 84 -3,-1.1 27,-2.0 -2,-0.7 2,-0.7 -0.828 75.4-101.0-113.6 153.4 66.5 13.7 78.1 226 218 A L B >> -E 251 0D 75 -2,-0.3 4,-1.0 25,-0.2 3,-0.6 -0.618 29.9-160.8 -75.9 112.8 66.1 16.4 75.5 227 219 A A H >> S+ 0 0 0 23,-1.8 4,-2.8 -2,-0.7 3,-0.5 0.935 85.2 58.6 -58.9 -53.8 63.3 18.6 76.5 228 220 A A H 34 S+ 0 0 11 22,-0.4 -1,-0.2 14,-0.4 7,-0.2 0.755 100.5 62.1 -50.4 -26.8 62.5 20.3 73.2 229 221 A T H <4 S+ 0 0 90 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.977 115.2 28.2 -63.2 -56.3 61.9 16.8 71.8 230 222 A H H << S+ 0 0 71 -4,-1.0 -2,-0.2 -3,-0.5 -1,-0.2 0.732 127.5 45.6 -78.5 -24.4 59.0 16.1 74.1 231 223 A F X + 0 0 6 -4,-2.8 4,-2.7 -5,-0.2 -1,-0.2 -0.552 62.4 152.0-124.8 69.4 57.9 19.7 74.5 232 224 A P H > S+ 0 0 63 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.883 76.2 46.6 -61.8 -48.7 57.9 21.3 71.0 233 225 A K H > S+ 0 0 148 2,-0.2 4,-1.1 1,-0.2 5,-0.1 0.912 118.7 43.8 -63.3 -42.3 55.2 23.9 71.6 234 226 A E H > S+ 0 0 22 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.893 115.4 48.2 -68.1 -42.3 56.9 24.9 74.9 235 227 A A H < S+ 0 0 0 -4,-2.7 7,-0.3 1,-0.2 -2,-0.2 0.851 112.5 47.7 -67.5 -37.3 60.3 24.8 73.3 236 228 A Q H < S+ 0 0 157 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.753 112.6 51.9 -75.9 -22.1 59.3 26.9 70.4 237 229 A A H < S+ 0 0 63 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.785 125.2 21.9 -83.6 -30.2 57.6 29.3 72.8 238 230 A N >X + 0 0 37 -4,-1.7 3,-1.5 1,-0.1 4,-1.3 -0.545 66.9 159.9-137.9 69.5 60.6 29.8 75.1 239 231 A P H 3> S+ 0 0 67 0, 0.0 4,-2.8 0, 0.0 3,-0.2 0.868 70.4 70.8 -58.5 -37.2 63.7 28.9 73.0 240 232 A S H 34 S+ 0 0 98 1,-0.2 -5,-0.1 2,-0.2 5,-0.1 0.730 110.2 30.9 -53.2 -26.1 65.9 30.9 75.4 241 233 A I H <4 S+ 0 0 13 -3,-1.5 -1,-0.2 -6,-0.1 17,-0.1 0.637 121.9 47.5-108.2 -18.5 65.3 28.2 78.1 242 234 A F H < S+ 0 0 1 -4,-1.3 8,-2.5 -7,-0.3 -14,-0.4 0.672 110.5 52.8 -94.3 -19.5 64.9 25.1 76.0 243 235 A Y B < S-F 249 0E 78 -4,-2.8 -1,-0.1 6,-0.2 5,-0.1 -0.951 78.2-123.6-125.0 140.5 68.0 25.7 73.8 244 236 A N > - 0 0 57 4,-3.9 3,-2.6 -2,-0.4 -2,-0.1 -0.220 44.4 -93.6 -69.9 165.1 71.6 26.4 74.4 245 237 A K T 3 S+ 0 0 221 1,-0.3 -1,-0.1 2,-0.1 -5,-0.0 0.738 126.9 54.6 -53.9 -23.5 73.2 29.5 73.0 246 238 A D T 3 S- 0 0 128 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.396 123.4-100.7 -92.8 3.1 74.4 27.4 70.0 247 239 A G S < S+ 0 0 50 -3,-2.6 -2,-0.1 1,-0.3 -1,-0.0 0.297 79.2 132.6 98.0 -10.1 70.9 26.2 69.1 248 240 A S - 0 0 43 -5,-0.1 -4,-3.9 1,-0.1 -1,-0.3 -0.506 61.2-105.6 -78.7 146.0 71.2 22.7 70.7 249 241 A P B -F 243 0E 45 0, 0.0 -6,-0.2 0, 0.0 2,-0.1 -0.477 30.8-131.6 -72.5 133.8 68.5 21.4 73.0 250 242 A K - 0 0 29 -8,-2.5 -23,-1.8 -2,-0.2 -22,-0.4 -0.391 24.8-104.0 -80.7 160.6 69.1 21.2 76.7 251 243 A T B > -E 226 0D 23 -25,-0.2 4,-2.0 -24,-0.1 -25,-0.2 -0.320 32.0-106.8 -78.3 165.8 68.3 18.2 78.9 252 244 A I H > S+ 0 0 9 -27,-2.0 4,-2.7 -29,-0.5 -28,-0.2 0.937 121.5 50.6 -57.9 -49.2 65.3 18.0 81.2 253 245 A Q H > S+ 0 0 68 -30,-2.5 4,-3.4 1,-0.2 5,-0.3 0.870 108.2 52.9 -58.2 -39.9 67.5 18.5 84.3 254 246 A E H > S+ 0 0 78 -31,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.891 110.3 47.3 -63.8 -40.3 69.1 21.5 82.7 255 247 A V H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.918 115.0 46.8 -66.7 -43.3 65.7 23.1 82.0 256 248 A Y H X S+ 0 0 43 -4,-2.7 4,-3.7 2,-0.2 5,-0.3 0.968 112.9 47.0 -62.1 -55.5 64.6 22.3 85.6 257 249 A N H X S+ 0 0 92 -4,-3.4 4,-1.5 1,-0.2 -1,-0.2 0.872 111.9 52.7 -55.1 -38.2 67.7 23.6 87.2 258 250 A L H X S+ 0 0 74 -4,-2.0 4,-1.2 -5,-0.3 -1,-0.2 0.929 114.5 41.5 -63.2 -44.8 67.4 26.7 85.0 259 251 A X H X S+ 0 0 2 -4,-2.3 4,-2.1 1,-0.2 3,-0.4 0.928 110.1 55.7 -68.5 -47.4 63.8 27.2 86.2 260 252 A D H X S+ 0 0 42 -4,-3.7 4,-2.4 1,-0.3 -1,-0.2 0.820 107.7 52.1 -55.7 -31.1 64.5 26.3 89.9 261 253 A G H X S+ 0 0 38 -4,-1.5 4,-1.4 -5,-0.3 -1,-0.3 0.852 105.1 53.2 -74.7 -35.3 67.1 29.0 89.8 262 254 A K H < S+ 0 0 101 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.872 114.3 43.6 -65.5 -35.9 64.7 31.6 88.4 263 255 A V H >< S+ 0 0 0 -4,-2.1 3,-2.9 1,-0.2 4,-0.3 0.918 105.6 62.2 -72.3 -46.0 62.4 30.8 91.3 264 256 A A H >< S+ 0 0 45 -4,-2.4 3,-1.3 1,-0.3 -2,-0.2 0.822 93.4 64.3 -49.4 -37.9 65.2 30.7 93.9 265 257 A A T 3< S+ 0 0 80 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.686 107.0 43.8 -63.3 -16.1 65.8 34.4 93.2 266 258 A H T < S+ 0 0 51 -3,-2.9 -1,-0.2 -4,-0.2 -2,-0.2 0.307 88.2 105.8-115.1 11.2 62.4 35.2 94.5 267 259 A R < 0 0 81 -3,-1.3 -152,-0.1 -4,-0.3 -153,-0.0 -0.423 360.0 360.0 -85.5 166.2 62.1 33.1 97.7 268 260 A K 0 0 241 -2,-0.1 -3,-0.0 -154,-0.1 -4,-0.0 0.080 360.0 360.0 26.1 360.0 62.3 34.4 101.2