==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 06-JAN-97 1UDA . COMPND 2 MOLECULE: UDP-GALACTOSE-4-EPIMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.B.THODEN,H.M.HOLDEN . 338 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14136.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 229 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 49 14.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 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 . 27 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 110 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.7 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 0 0 1 1 0 1 2 0 2 0 1 1 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 3 1 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 PARALLEL 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 ANTIPARALLEL BRIDGES PER LADDER . 2 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 1 A M 0 0 56 0, 0.0 25,-2.5 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 164.9 35.0 -18.1 41.2 2 2 A R E -a 26 0A 78 23,-0.2 73,-2.8 71,-0.2 74,-1.7 -0.915 360.0-175.6 -99.9 117.4 37.6 -15.9 39.4 3 3 A V E -ab 27 76A 0 23,-3.1 25,-2.4 -2,-0.6 2,-0.6 -0.962 25.9-153.7-128.4 129.3 36.0 -12.8 38.3 4 4 A L E -ab 28 77A 0 72,-1.9 74,-3.0 -2,-0.5 2,-0.7 -0.819 16.4-165.5 -90.5 125.8 37.1 -9.8 36.3 5 5 A V E > -ab 29 78A 0 23,-3.4 25,-2.1 -2,-0.6 3,-1.1 -0.903 3.7-159.3-113.3 103.4 35.2 -6.7 37.3 6 6 A T E 3 S+ab 30 79A 0 72,-1.9 74,-1.6 -2,-0.7 25,-0.2 -0.556 83.1 20.2 -76.9 149.0 35.5 -3.9 34.8 7 7 A G T > S+ 0 0 7 23,-2.3 3,-2.1 73,-0.2 6,-0.4 0.724 85.3 146.9 70.2 10.1 34.7 -0.5 36.2 8 8 A G T < + 0 0 0 -3,-1.1 9,-0.2 22,-0.7 -2,-0.1 0.669 61.8 56.5 -61.9 -12.8 35.3 -2.1 39.6 9 9 A S T 3 S+ 0 0 3 21,-0.2 28,-0.3 4,-0.1 -1,-0.3 0.526 93.4 92.6 -95.0 -4.0 36.7 1.0 41.2 10 10 A G S <> S- 0 0 20 -3,-2.1 4,-2.6 26,-0.1 5,-0.3 -0.034 96.4 -84.3 -74.2-177.1 33.5 3.0 40.4 11 11 A Y H > S+ 0 0 26 2,-0.2 4,-1.5 1,-0.2 5,-0.2 0.981 124.8 29.0 -58.6 -65.9 30.5 3.5 42.6 12 12 A I H > S+ 0 0 25 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.934 122.0 52.1 -63.6 -43.7 28.5 0.3 41.8 13 13 A G H > S+ 0 0 1 -6,-0.4 4,-2.8 2,-0.2 5,-0.2 0.921 105.5 54.0 -58.8 -48.8 31.6 -1.8 41.1 14 14 A S H X S+ 0 0 2 -4,-2.6 4,-2.3 -7,-0.3 -1,-0.2 0.947 110.5 46.3 -53.8 -49.4 33.4 -1.0 44.3 15 15 A H H X S+ 0 0 0 -4,-1.5 4,-1.8 -5,-0.3 -1,-0.2 0.889 112.8 50.2 -62.2 -38.2 30.5 -2.1 46.4 16 16 A T H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.867 106.9 55.4 -69.4 -31.7 30.1 -5.2 44.4 17 17 A C H X S+ 0 0 0 -4,-2.8 4,-3.1 -9,-0.2 5,-0.3 0.953 105.6 52.1 -66.1 -41.6 33.7 -6.0 44.7 18 18 A V H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.946 113.2 43.6 -55.2 -52.0 33.4 -5.8 48.5 19 19 A Q H X S+ 0 0 19 -4,-1.8 4,-0.9 1,-0.2 -1,-0.2 0.858 112.5 53.4 -61.8 -41.2 30.5 -8.2 48.5 20 20 A L H ><>S+ 0 0 0 -4,-2.6 5,-2.0 1,-0.2 3,-0.9 0.948 109.7 46.8 -59.7 -48.3 32.2 -10.5 46.0 21 21 A L H ><5S+ 0 0 6 -4,-3.1 3,-2.5 1,-0.3 -2,-0.2 0.901 106.7 59.3 -60.4 -38.4 35.3 -10.7 48.2 22 22 A Q H 3<5S+ 0 0 105 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.757 102.9 52.7 -61.9 -24.2 33.2 -11.4 51.2 23 23 A N T <<5S- 0 0 92 -3,-0.9 -1,-0.3 -4,-0.9 -2,-0.2 0.331 122.6-109.4 -93.6 8.4 31.9 -14.4 49.5 24 24 A G T < 5 + 0 0 45 -3,-2.5 -3,-0.2 1,-0.2 -2,-0.1 0.609 66.7 146.8 74.9 19.0 35.4 -15.6 48.9 25 25 A H < - 0 0 14 -5,-2.0 2,-0.6 1,-0.0 -1,-0.2 -0.453 53.5-113.9 -81.2 161.5 35.6 -15.0 45.1 26 26 A D E -a 2 0A 57 -25,-2.5 -23,-3.1 -2,-0.1 2,-0.5 -0.911 38.4-157.0 -98.5 115.9 39.0 -14.0 43.5 27 27 A V E -a 3 0A 3 -2,-0.6 26,-2.5 24,-0.3 2,-0.5 -0.906 20.8-176.2-109.7 130.4 38.6 -10.5 42.2 28 28 A I E -ac 4 53A 3 -25,-2.4 -23,-3.4 -2,-0.5 2,-0.5 -0.973 16.8-155.0-117.3 117.0 40.5 -8.7 39.4 29 29 A I E -ac 5 54A 0 24,-3.8 26,-2.7 -2,-0.5 2,-0.5 -0.849 7.6-168.8 -98.9 132.1 39.5 -5.1 38.9 30 30 A L E +ac 6 55A 2 -25,-2.1 -23,-2.3 -2,-0.5 -22,-0.7 -0.978 22.6 152.2-116.6 118.2 40.0 -3.5 35.6 31 31 A D E - c 0 56A 12 24,-2.0 26,-1.9 -2,-0.5 27,-0.1 -0.992 41.8-153.6-151.1 145.5 39.5 0.3 35.5 32 32 A N - 0 0 48 -2,-0.3 26,-0.1 24,-0.2 24,-0.1 0.386 39.8-132.1 -97.5 -0.7 40.9 3.2 33.6 33 33 A L + 0 0 34 24,-0.1 3,-0.3 1,-0.1 5,-0.1 0.624 65.7 131.9 60.2 22.5 40.3 5.6 36.4 34 34 A C S S+ 0 0 77 1,-0.2 -1,-0.1 3,-0.0 3,-0.1 0.787 87.8 20.3 -72.1 -22.9 38.5 8.2 34.3 35 35 A N S S+ 0 0 93 158,-0.0 2,-0.3 2,-0.0 -1,-0.2 0.155 126.2 41.5-131.6 20.5 35.8 8.4 36.9 36 36 A S S S- 0 0 24 -3,-0.3 2,-0.3 -26,-0.1 -26,-0.1 -0.935 70.7-120.1-154.8 170.7 37.3 7.0 40.1 37 37 A K > - 0 0 50 -28,-0.3 3,-1.7 -2,-0.3 4,-0.3 -0.857 21.6-122.4-120.4 151.7 40.6 7.1 42.1 38 38 A R T > S+ 0 0 133 -2,-0.3 3,-1.6 1,-0.3 300,-0.1 0.753 101.6 82.3 -65.2 -21.5 43.0 4.4 43.2 39 39 A S T 3> S+ 0 0 27 298,-0.3 4,-0.5 1,-0.3 -1,-0.3 0.720 80.5 64.6 -56.7 -15.9 42.4 5.5 46.8 40 40 A V H X> S+ 0 0 0 -3,-1.7 4,-2.5 1,-0.2 3,-0.7 0.824 85.1 76.3 -77.8 -25.5 39.3 3.3 46.8 41 41 A L H <> S+ 0 0 25 -3,-1.6 4,-2.4 -4,-0.3 5,-0.2 0.902 91.7 48.7 -49.4 -51.5 41.3 0.2 46.4 42 42 A P H 3> S+ 0 0 79 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.849 111.5 52.2 -61.8 -30.2 42.5 -0.1 49.9 43 43 A V H S+ 0 0 76 -4,-2.4 4,-1.9 2,-0.2 5,-1.2 0.908 115.0 48.5 -61.9 -42.2 40.2 -4.7 50.4 46 46 A R H <5S+ 0 0 141 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.976 120.7 34.9 -62.1 -55.5 39.6 -3.6 53.9 47 47 A L H <5S+ 0 0 26 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.854 120.3 51.1 -68.2 -30.9 35.8 -3.8 53.7 48 48 A G H <5S- 0 0 5 -4,-3.3 -1,-0.2 -5,-0.4 -2,-0.2 0.756 100.3-139.7 -76.9 -24.0 36.1 -6.8 51.4 49 49 A G T <5S+ 0 0 64 -4,-1.9 2,-0.3 -5,-0.2 -3,-0.2 0.768 73.4 67.3 70.8 27.2 38.4 -8.5 53.9 50 50 A K S - 0 0 35 -2,-0.3 3,-2.5 1,-0.1 7,-0.2 -0.896 17.4-140.7-113.6 135.4 40.9 0.4 29.2 59 59 A I T 3 S+ 0 0 8 -2,-0.4 -1,-0.1 1,-0.3 6,-0.1 0.782 103.6 67.8 -59.6 -24.1 38.2 -2.0 28.0 60 60 A R T 3 S+ 0 0 79 1,-0.1 2,-1.2 46,-0.1 -1,-0.3 0.687 78.7 86.2 -71.8 -11.2 38.7 -0.7 24.6 61 61 A N <> - 0 0 78 -3,-2.5 4,-2.2 1,-0.2 5,-0.2 -0.743 58.3-179.4 -90.6 90.1 42.2 -2.3 24.5 62 62 A E H > S+ 0 0 63 -2,-1.2 4,-2.7 2,-0.2 -1,-0.2 0.811 76.6 55.3 -60.7 -34.0 41.2 -5.8 23.3 63 63 A A H > S+ 0 0 71 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.941 111.0 45.0 -65.4 -44.8 44.8 -7.2 23.5 64 64 A L H > S+ 0 0 38 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.890 112.0 52.3 -66.2 -38.0 45.1 -6.2 27.0 65 65 A M H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.940 108.7 49.8 -63.8 -46.4 41.7 -7.6 27.9 66 66 A T H X S+ 0 0 27 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.901 111.1 50.3 -58.0 -41.4 42.6 -10.9 26.3 67 67 A E H X S+ 0 0 104 -4,-2.0 4,-3.4 1,-0.2 5,-0.2 0.924 109.9 48.3 -64.1 -46.4 45.8 -11.0 28.3 68 68 A I H X S+ 0 0 5 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.923 109.9 53.7 -60.8 -41.2 44.2 -10.3 31.6 69 69 A L H <>S+ 0 0 2 -4,-2.5 5,-1.9 -5,-0.2 4,-0.4 0.907 116.6 37.3 -60.1 -43.0 41.5 -12.9 30.9 70 70 A H H ><5S+ 0 0 110 -4,-2.0 3,-1.3 -5,-0.2 -2,-0.2 0.940 114.0 55.3 -72.0 -50.5 44.1 -15.6 30.2 71 71 A D H 3<5S+ 0 0 106 -4,-3.4 -2,-0.2 1,-0.3 -1,-0.2 0.824 116.7 35.6 -52.2 -38.3 46.6 -14.5 32.8 72 72 A H T 3<5S- 0 0 44 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.362 101.4-127.1-104.2 9.8 44.0 -14.6 35.6 73 73 A A T < 5 - 0 0 59 -3,-1.3 2,-0.2 -4,-0.4 -3,-0.2 0.954 36.9-161.0 46.3 55.9 42.1 -17.7 34.4 74 74 A I < - 0 0 10 -5,-1.9 -71,-0.2 -6,-0.2 -1,-0.2 -0.497 22.1-172.8 -71.5 139.7 38.9 -15.7 34.7 75 75 A D S S+ 0 0 71 -73,-2.8 42,-0.4 1,-0.3 2,-0.3 0.720 70.8 11.9-100.8 -28.1 35.7 -17.7 34.8 76 76 A T E -b 3 0A 2 -74,-1.7 -72,-1.9 41,-0.1 2,-0.4 -0.994 63.3-145.4-149.6 150.9 33.2 -14.8 34.6 77 77 A V E -bd 4 119A 0 41,-2.0 43,-1.8 -2,-0.3 2,-0.6 -0.981 1.7-160.7-124.2 132.7 33.3 -11.1 33.8 78 78 A I E -bd 5 120A 0 -74,-3.0 -72,-1.9 -2,-0.4 2,-0.9 -0.967 16.8-153.6-111.4 114.5 31.1 -8.4 35.4 79 79 A H E +bd 6 121A 1 41,-2.7 43,-1.7 -2,-0.6 -72,-0.1 -0.747 39.0 141.3 -97.2 90.5 31.1 -5.4 33.1 80 80 A F + 0 0 26 -74,-1.6 -73,-0.2 -2,-0.9 -1,-0.2 0.616 39.9 111.5 -97.8 -17.1 30.4 -2.1 34.9 81 81 A A + 0 0 18 -51,-0.1 2,-0.2 22,-0.0 41,-0.1 -0.310 42.2 84.4 -67.6 142.3 32.9 0.1 33.0 82 82 A G S S- 0 0 33 21,-0.0 2,-0.3 -2,-0.0 18,-0.1 -0.878 75.9 -71.4 156.0-179.3 31.6 2.8 30.7 83 83 A L + 0 0 25 -2,-0.2 -48,-0.0 13,-0.2 17,-0.0 -0.781 38.0 175.3-101.4 146.4 30.4 6.5 30.6 84 84 A K + 0 0 94 -2,-0.3 2,-0.9 66,-0.0 -1,-0.1 0.319 30.9 124.5-137.0 11.8 27.0 7.3 32.1 85 85 A A > - 0 0 19 1,-0.2 4,-2.3 2,-0.1 5,-0.2 -0.667 41.4-162.8 -79.8 108.2 26.4 11.1 32.1 86 86 A V H > S+ 0 0 73 -2,-0.9 4,-1.3 1,-0.2 63,-0.3 0.935 85.9 42.8 -53.9 -58.8 23.1 11.5 30.2 87 87 A G H >> S+ 0 0 46 1,-0.2 4,-1.4 2,-0.2 3,-0.6 0.929 113.6 52.6 -55.8 -45.5 23.3 15.1 29.4 88 88 A E H 3> S+ 0 0 70 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.885 102.8 59.9 -58.1 -39.5 27.0 14.9 28.4 89 89 A S H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.837 102.3 53.0 -58.5 -32.1 26.1 12.0 26.0 90 90 A V H << S+ 0 0 81 -4,-1.3 -1,-0.2 -3,-0.6 -2,-0.2 0.878 115.5 40.2 -69.5 -32.8 23.8 14.4 24.2 91 91 A Q H < S+ 0 0 151 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.809 130.2 26.7 -83.1 -31.4 26.7 16.8 23.8 92 92 A K X + 0 0 86 -4,-3.0 4,-0.9 -5,-0.2 -1,-0.2 -0.558 67.8 160.9-133.0 67.6 29.4 14.2 23.1 93 93 A P H >> + 0 0 49 0, 0.0 4,-2.5 0, 0.0 3,-0.5 0.850 68.8 59.9 -58.2 -45.4 27.8 11.2 21.5 94 94 A L H 3> S+ 0 0 141 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.927 101.9 54.2 -53.3 -46.3 30.8 9.6 20.0 95 95 A E H 3> S+ 0 0 90 -3,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.837 110.2 48.0 -57.2 -34.2 32.6 9.2 23.3 96 96 A Y H S+ 0 0 2 -4,-0.9 4,-2.5 -3,-0.5 5,-0.6 0.935 113.3 45.5 -73.7 -46.0 29.5 7.3 24.6 97 97 A Y H X>S+ 0 0 63 -4,-2.5 5,-2.5 3,-0.2 4,-0.8 0.893 116.3 48.2 -64.4 -38.3 29.3 5.0 21.6 98 98 A D H <>S+ 0 0 61 -4,-3.4 5,-2.4 -5,-0.2 -2,-0.2 0.987 117.5 38.9 -67.5 -51.7 33.1 4.4 21.8 99 99 A N H <5S+ 0 0 11 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.893 129.8 28.1 -65.7 -38.6 33.3 3.7 25.4 100 100 A N H X5S+ 0 0 4 -4,-2.5 4,-1.6 -5,-0.2 -3,-0.2 0.935 130.6 28.2 -91.7 -52.7 30.1 1.7 25.7 101 101 A V H XS+ 0 0 0 -4,-2.0 5,-3.0 1,-0.2 4,-0.4 0.934 106.4 49.7 -59.5 -46.6 36.5 -13.1 26.0 112 112 A R H ><5S+ 0 0 95 -4,-2.2 3,-1.0 1,-0.2 -1,-0.2 0.917 111.0 50.3 -56.9 -45.6 35.9 -15.0 22.8 113 113 A A H 3<5S+ 0 0 52 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.874 115.2 41.5 -60.9 -42.0 39.6 -15.1 22.3 114 114 A A T 3<5S- 0 0 11 -4,-2.8 -1,-0.2 2,-0.1 -2,-0.2 0.296 112.5-115.9 -90.4 7.2 40.3 -16.3 25.8 115 115 A N T < 5 + 0 0 124 -3,-1.0 2,-0.5 -4,-0.4 -3,-0.2 0.859 62.6 150.0 62.7 35.4 37.4 -18.8 25.8 116 116 A V < + 0 0 8 -5,-3.0 -1,-0.2 -6,-0.2 -2,-0.1 -0.883 15.6 171.7 -99.0 131.8 35.6 -17.0 28.7 117 117 A K + 0 0 61 -2,-0.5 54,-2.4 -42,-0.4 2,-0.5 0.109 43.7 88.0-131.9 21.5 31.8 -17.4 28.3 118 118 A N E + e 0 171A 6 -43,-0.2 -41,-2.0 52,-0.2 2,-0.3 -0.993 51.8 171.7-120.6 121.0 30.0 -16.1 31.4 119 119 A F E -de 77 172A 2 52,-2.8 54,-2.6 -2,-0.5 2,-0.4 -0.964 22.3-167.4-136.7 147.5 29.1 -12.4 31.4 120 120 A I E -de 78 173A 5 -43,-1.8 -41,-2.7 -2,-0.3 2,-0.4 -0.992 18.6-158.4-130.2 121.8 27.1 -9.9 33.5 121 121 A F E -de 79 174A 2 52,-2.8 54,-2.1 -2,-0.4 2,-1.1 -0.910 19.4-129.2-112.7 137.9 26.2 -6.5 32.0 122 122 A S E + e 0 175A 9 -43,-1.7 54,-0.1 -2,-0.4 2,-0.1 -0.631 46.1 164.7 -74.0 97.3 25.3 -3.2 33.7 123 123 A S E - e 0 176A 2 52,-2.4 54,-1.7 -2,-1.1 2,-0.3 -0.342 22.4-132.2-103.7-164.2 22.2 -2.3 31.8 124 124 A S E > - e 0 177A 20 52,-0.3 3,-2.2 -2,-0.1 54,-0.2 -0.999 25.1-118.7-154.0 151.5 19.4 0.2 32.5 125 125 A A G > S+ 0 0 2 52,-2.2 3,-1.3 -2,-0.3 4,-0.3 0.551 104.0 84.5 -58.9 -11.5 15.6 0.8 32.7 126 126 A T G > S+ 0 0 35 51,-0.3 3,-2.1 1,-0.2 -1,-0.3 0.870 74.4 70.8 -61.7 -27.9 16.4 3.4 29.9 127 127 A V G < S+ 0 0 0 -3,-2.2 16,-2.1 1,-0.3 -1,-0.2 0.763 85.4 66.1 -63.7 -18.2 16.1 0.4 27.5 128 128 A Y G < S- 0 0 2 -3,-1.3 -1,-0.3 14,-0.2 16,-0.2 0.662 91.2-164.6 -76.3 -16.3 12.4 0.3 28.1 129 129 A G < - 0 0 8 -3,-2.1 2,-2.1 -4,-0.3 -1,-0.2 -0.189 54.5 -13.3 68.0-155.9 12.1 3.6 26.4 130 130 A D S S+ 0 0 128 14,-0.4 -1,-0.2 -3,-0.1 -4,-0.1 -0.485 81.9 170.5 -80.2 72.8 9.0 5.8 26.7 131 131 A N - 0 0 28 -2,-2.1 -2,-0.1 1,-0.2 -3,-0.1 -0.759 26.4-167.4 -89.7 116.8 6.8 2.9 28.1 132 132 A P + 0 0 114 0, 0.0 2,-0.7 0, 0.0 -1,-0.2 0.810 69.6 88.8 -69.8 -24.9 3.4 4.0 29.4 133 133 A K S S- 0 0 120 4,-0.0 4,-0.1 166,-0.0 -2,-0.1 -0.580 75.8-140.2 -78.0 117.5 3.0 0.6 31.0 134 134 A I S S+ 0 0 60 -2,-0.7 2,-0.2 2,-0.1 167,-0.1 -0.978 72.5 42.0-134.1 146.8 4.4 0.6 34.5 135 135 A P S S- 0 0 40 0, 0.0 2,-0.3 0, 0.0 166,-0.2 0.503 90.4-124.2 -68.6 162.5 5.9 -1.2 36.3 136 136 A Y B -g 301 0B 2 164,-2.0 166,-2.0 -2,-0.2 2,-0.4 -0.603 27.1-162.9 -80.1 133.0 8.3 -2.3 33.6 137 137 A V > - 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0 0 1 -3,-2.9 85,-2.1 -6,-0.3 2,-0.5 -0.461 60.9-149.8 -76.7 147.2 27.6 -18.4 26.8 171 171 A S E -ef 118 255A 3 -54,-2.4 -52,-2.8 83,-0.3 2,-0.5 -0.959 22.1-179.9-106.9 118.4 25.6 -17.3 29.9 172 172 A I E -ef 119 256A 0 83,-3.0 85,-2.7 -2,-0.5 2,-0.5 -0.968 13.6-158.1-127.4 118.0 24.9 -13.6 29.7 173 173 A A E -ef 120 257A 1 -54,-2.6 -52,-2.8 -2,-0.5 2,-0.8 -0.857 2.4-158.9 -93.2 129.5 23.0 -11.6 32.3 174 174 A L E -ef 121 258A 1 83,-2.7 85,-2.3 -2,-0.5 2,-0.9 -0.901 13.6-166.8-105.3 99.7 21.4 -8.3 31.3 175 175 A L E -ef 122 259A 1 -54,-2.1 -52,-2.4 -2,-0.8 2,-0.9 -0.777 5.1-157.5 -94.3 107.5 20.9 -6.5 34.6 176 176 A R E -ef 123 260A 7 83,-1.9 85,-2.6 -2,-0.9 -52,-0.3 -0.697 11.9-158.2 -88.4 106.2 18.6 -3.5 34.2 177 177 A Y E -ef 124 261A 15 -54,-1.7 -52,-2.2 -2,-0.9 -51,-0.3 -0.523 9.0-164.8 -84.5 152.3 19.3 -1.1 37.0 178 178 A F - 0 0 13 83,-1.1 55,-0.2 -54,-0.2 -1,-0.1 0.582 64.4 -29.2 -97.3-112.5 16.8 1.5 38.1 179 179 A N E -h 233 0C 38 53,-2.3 55,-2.3 -55,-0.1 2,-0.2 -0.805 64.6-155.1-116.5 95.9 18.1 4.4 40.3 180 180 A P E +h 234 0C 34 0, 0.0 2,-0.3 0, 0.0 55,-0.2 -0.471 26.8 149.3 -74.8 135.2 21.1 3.3 42.5 181 181 A V E +h 235 0C 8 53,-2.5 55,-3.0 -2,-0.2 56,-0.3 -0.901 22.4 62.0-151.2 171.5 21.7 5.2 45.6 182 182 A G - 0 0 2 -2,-0.3 9,-0.4 53,-0.2 2,-0.3 -0.413 57.9-116.8 100.8-177.0 23.1 4.7 49.1 183 183 A A - 0 0 0 7,-0.1 7,-0.2 -2,-0.1 54,-0.2 -0.954 40.8 -66.5-156.5 164.5 26.6 3.8 50.3 184 184 A H > - 0 0 17 5,-0.8 3,-1.9 -2,-0.3 5,-0.3 -0.312 51.1-117.6 -58.4 142.6 28.3 1.1 52.3 185 185 A P T 3 S+ 0 0 71 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.710 108.9 68.7 -57.7 -22.5 27.1 1.0 55.9 186 186 A S T 3 S- 0 0 32 1,-0.1 -2,-0.1 3,-0.0 138,-0.0 0.755 100.1-131.2 -72.8 -19.0 30.5 1.8 57.2 187 187 A G S < S+ 0 0 0 -3,-1.9 144,-0.1 2,-0.2 -1,-0.1 0.577 85.0 99.7 82.8 5.1 30.3 5.3 55.8 188 188 A D S S+ 0 0 22 1,-0.1 2,-0.3 -145,-0.1 -141,-0.1 0.313 78.8 43.0-106.3 -0.3 33.8 4.8 54.3 189 189 A M S S+ 0 0 0 -5,-0.3 -5,-0.8 -146,-0.0 2,-0.3 -0.987 70.1 123.1-141.7 144.8 32.8 3.9 50.7 190 190 A G - 0 0 1 -2,-0.3 2,-0.3 -7,-0.2 -7,-0.1 -0.967 64.5 -47.6-178.4-173.3 30.1 5.7 48.5 191 191 A E - 0 0 27 -9,-0.4 144,-0.1 -2,-0.3 -181,-0.0 -0.643 45.8-173.2 -78.6 134.3 29.4 7.5 45.3 192 192 A D - 0 0 34 -2,-0.3 144,-0.1 -157,-0.2 -1,-0.1 -0.548 8.2-177.4-128.3 65.6 32.1 10.2 44.7 193 193 A P - 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0 0 107 -74,-0.4 3,-1.5 -3,-0.1 2,-0.1 -0.709 39.7 -93.7 -85.8 142.4 14.3 18.6 32.8 293 293 A E T 3 S+ 0 0 189 -2,-0.3 -1,-0.1 1,-0.2 0, 0.0 -0.372 107.1 10.9 -57.7 129.0 14.5 17.6 29.1 294 294 A G T 3 S+ 0 0 62 1,-0.3 2,-0.5 -2,-0.1 -1,-0.2 0.460 88.9 145.0 84.2 4.5 13.7 13.9 28.4 295 295 A D < - 0 0 40 -3,-1.5 -1,-0.3 1,-0.0 -4,-0.0 -0.649 40.9-144.0 -78.9 123.2 12.5 13.2 31.9 296 296 A L - 0 0 40 -2,-0.5 -66,-0.1 1,-0.1 3,-0.1 -0.505 13.9-129.3 -80.7 156.2 9.7 10.6 32.2 297 297 A P S S- 0 0 45 0, 0.0 -67,-2.5 0, 0.0 2,-0.3 0.926 76.3 -5.5 -70.5 -50.3 7.0 11.3 34.9 298 298 A A B +k 230 0E 25 -69,-0.2 2,-0.3 -30,-0.0 -67,-0.2 -0.965 66.1 142.7-154.4 132.5 6.8 8.0 36.8 299 299 A Y + 0 0 34 -69,-1.5 2,-0.3 -2,-0.3 -67,-0.1 -0.959 8.7 169.2-164.4 155.2 8.2 4.5 36.5 300 300 A W - 0 0 72 -2,-0.3 -164,-2.0 -69,-0.2 2,-0.3 -0.921 35.1 -91.0-158.5 171.4 9.5 1.7 38.7 301 301 A A B -g 136 0B 1 -2,-0.3 2,-0.7 -36,-0.2 -164,-0.1 -0.631 12.1-139.8 -98.3 154.4 10.4 -1.9 38.2 302 302 A D + 0 0 45 -166,-2.0 -164,-0.3 -2,-0.3 -42,-0.3 -0.979 27.4 177.8-100.7 113.4 8.5 -5.1 38.5 303 303 A A > + 0 0 20 -2,-0.7 4,-1.2 1,-0.2 5,-0.1 -0.032 43.5 111.4-108.3 27.5 11.2 -7.1 40.2 304 304 A S H > S+ 0 0 75 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.865 71.3 61.2 -67.9 -34.9 9.2 -10.4 40.6 305 305 A K H > S+ 0 0 59 -3,-0.2 4,-3.1 1,-0.2 5,-0.4 0.931 105.0 44.6 -58.0 -47.6 11.3 -12.3 38.1 306 306 A A H >>S+ 0 0 0 -46,-0.3 4,-2.2 2,-0.2 6,-1.8 0.871 113.5 52.6 -67.0 -29.0 14.5 -11.9 40.0 307 307 A D H X5S+ 0 0 57 -4,-1.2 4,-1.1 4,-0.2 -2,-0.2 0.977 115.1 40.8 -68.1 -47.1 12.7 -12.8 43.2 308 308 A R H <5S+ 0 0 218 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.958 126.5 30.8 -63.3 -56.7 11.3 -15.9 41.6 309 309 A E H <5S+ 0 0 107 -4,-3.1 -3,-0.2 -5,-0.2 -1,-0.2 0.758 134.5 24.1 -77.9 -32.6 14.4 -17.1 39.7 310 310 A L H <5S- 0 0 5 -4,-2.2 -3,-0.2 -5,-0.4 -2,-0.2 0.396 93.8-126.4-116.0 0.9 17.3 -15.8 41.8 311 311 A N << + 0 0 99 -4,-1.1 2,-0.4 -5,-0.5 -4,-0.2 0.874 64.6 139.8 56.5 33.5 15.6 -15.6 45.1 312 312 A W + 0 0 15 -6,-1.8 2,-0.3 -9,-0.1 -1,-0.2 -0.916 18.5 153.2-116.7 136.6 16.8 -12.0 45.3 313 313 A R - 0 0 109 -2,-0.4 -50,-0.1 -3,-0.1 2,-0.1 -0.978 47.7 -88.9-147.2 160.2 14.9 -9.0 46.6 314 314 A V + 0 0 37 -52,-0.3 3,-0.0 -2,-0.3 -80,-0.0 -0.407 33.4 179.0 -70.1 152.2 15.9 -5.8 48.1 315 315 A T + 0 0 98 -80,-0.1 2,-0.2 -2,-0.1 -1,-0.1 0.530 53.7 84.3-124.1 -12.4 16.4 -5.6 51.8 316 316 A R - 0 0 53 -81,-0.1 -81,-0.2 1,-0.0 2,-0.2 -0.638 69.0-134.9 -92.1 154.0 17.4 -2.0 52.5 317 317 A T > - 0 0 74 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.571 24.1-105.7-102.8 172.0 14.8 0.8 52.9 318 318 A L H > S+ 0 0 30 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.926 122.0 54.9 -59.8 -41.7 14.7 4.3 51.5 319 319 A D H > S+ 0 0 54 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.907 108.5 49.0 -59.9 -39.5 15.5 5.8 54.9 320 320 A E H > S+ 0 0 72 2,-0.2 4,-3.4 1,-0.2 5,-0.4 0.909 106.9 55.5 -62.9 -44.0 18.7 3.6 54.9 321 321 A M H X S+ 0 0 7 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.930 113.8 40.3 -53.5 -46.7 19.6 4.7 51.5 322 322 A A H X S+ 0 0 1 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.916 116.0 50.2 -69.8 -44.8 19.4 8.3 52.7 323 323 A Q H X S+ 0 0 93 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.927 111.7 47.4 -58.6 -47.3 21.1 7.6 56.1 324 324 A D H X S+ 0 0 27 -4,-3.4 4,-1.8 1,-0.2 -1,-0.2 0.876 111.2 51.2 -63.0 -39.5 24.0 5.7 54.5 325 325 A T H X S+ 0 0 14 -4,-1.5 4,-2.9 -5,-0.4 5,-0.2 0.924 111.2 47.9 -63.3 -45.7 24.5 8.4 51.9 326 326 A W H X S+ 0 0 46 -4,-2.4 4,-3.3 1,-0.2 5,-0.3 0.897 108.6 54.9 -63.6 -37.6 24.6 11.1 54.6 327 327 A H H X S+ 0 0 72 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.921 113.3 41.0 -65.2 -39.7 27.0 9.1 56.7 328 328 A W H X S+ 0 0 11 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.925 116.5 49.0 -71.7 -48.0 29.5 8.8 53.9 329 329 A Q H < S+ 0 0 20 -4,-2.9 6,-0.2 1,-0.2 -2,-0.2 0.950 116.8 43.1 -55.5 -49.7 29.0 12.3 52.7 330 330 A S H < S+ 0 0 49 -4,-3.3 -2,-0.2 -5,-0.2 -1,-0.2 0.877 115.4 46.9 -69.3 -37.2 29.5 13.5 56.2 331 331 A R H < S+ 0 0 123 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.860 128.0 25.6 -73.4 -30.2 32.4 11.3 57.0 332 332 A H >< + 0 0 59 -4,-2.6 3,-2.2 -5,-0.2 -1,-0.2 -0.520 63.8 166.2-136.7 71.2 34.2 12.1 53.8 333 333 A P T 3 S+ 0 0 66 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.650 84.5 46.9 -58.1 -20.5 33.1 15.5 52.5 334 334 A Q T 3 S- 0 0 173 1,-0.4 2,-0.1 -3,-0.1 -5,-0.1 0.232 103.5-142.1-105.4 9.4 36.1 15.5 50.0 335 335 A G < - 0 0 9 -3,-2.2 -1,-0.4 -6,-0.2 -143,-0.1 -0.392 59.7 -4.9 68.5-142.6 35.4 12.0 48.9 336 336 A Y S S- 0 0 20 -3,-0.1 2,-0.1 -144,-0.1 -296,-0.1 -0.653 84.6-108.5 -86.0 138.6 38.4 9.8 48.2 337 337 A P 0 0 85 0, 0.0 -298,-0.3 0, 0.0 -1,-0.1 -0.383 360.0 360.0 -70.9 146.0 41.8 11.4 48.4 338 338 A D 0 0 199 -2,-0.1 -301,-0.0 -300,-0.1 0, 0.0 -0.458 360.0 360.0 -79.4 360.0 44.0 12.2 45.5