==== 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 UNKNOWN FUNCTION 18-SEP-07 2RB5 . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; . AUTHOR Z.LU,D.DUNAWAY-MARIANO,K.N.ALLEN . 261 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11569.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 10.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 10.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 3 1.1 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 . 12 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 66 25.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 4.6 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 2 2 2 0 1 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 1 3 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 0 2 3 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 0 0 0 1 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 1 A M 0 0 185 0, 0.0 2,-0.3 0, 0.0 259,-0.0 0.000 360.0 360.0 360.0 163.9 19.3 21.8 62.8 2 2 A T + 0 0 27 1,-0.1 204,-0.2 204,-0.0 203,-0.1 -0.486 360.0 158.0 -75.0 130.2 19.3 22.4 59.1 3 3 A K + 0 0 105 202,-3.1 35,-2.4 -2,-0.3 2,-0.4 0.577 63.2 46.4-117.0 -23.4 19.9 19.5 56.8 4 4 A A E -ab 38 206A 0 201,-1.8 203,-2.0 33,-0.2 2,-0.4 -0.996 59.0-162.6-135.2 129.9 18.3 20.5 53.5 5 5 A L E -ab 39 207A 0 33,-2.9 35,-2.9 -2,-0.4 2,-0.5 -0.931 6.1-162.1-110.9 132.3 18.6 23.8 51.6 6 6 A F E -ab 40 208A 0 201,-2.5 203,-2.2 -2,-0.4 2,-0.5 -0.965 10.6-169.6-120.0 116.5 16.0 24.7 48.9 7 7 A F E -ab 41 209A 0 33,-2.9 35,-2.7 -2,-0.5 203,-0.2 -0.920 17.3-145.7-114.4 122.1 17.0 27.4 46.4 8 8 A D - 0 0 1 201,-2.3 5,-0.4 -2,-0.5 35,-0.2 -0.380 19.3-144.8 -59.3 157.1 14.9 29.1 43.8 9 9 A I S >>>S+ 0 0 0 33,-0.2 5,-2.4 3,-0.2 4,-2.0 0.904 72.3 63.1 -91.7 -71.1 17.0 30.0 40.7 10 10 A D B 345S-h 14 0B 3 1,-0.3 201,-0.3 2,-0.2 5,-0.2 -0.389 123.8 -1.2 -74.5 121.4 15.9 33.3 39.2 11 11 A G T 345S+ 0 0 0 3,-3.1 -1,-0.3 -2,-0.3 235,-0.2 0.429 134.3 59.3 84.5 -2.8 16.5 36.2 41.5 12 12 A T T <45S+ 0 0 0 -3,-2.0 239,-0.2 2,-0.3 -3,-0.2 0.693 125.8 3.8-121.3 -60.5 17.8 33.9 44.2 13 13 A L T <5S+ 0 0 0 -4,-2.0 2,-0.5 -5,-0.4 -3,-0.2 0.820 133.8 46.8 -89.3 -47.9 20.8 32.1 42.9 14 14 A V B - 0 0 0 5,-2.4 4,-2.0 -2,-0.5 5,-0.2 -0.442 0.4-148.0 -69.5 135.4 20.8 37.6 39.2 16 16 A F T 4 S+ 0 0 28 -2,-0.2 -1,-0.2 2,-0.2 -6,-0.0 0.751 99.6 52.3 -69.2 -23.5 18.3 39.0 36.8 17 17 A E T 4 S+ 0 0 131 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.893 126.2 18.2 -80.4 -44.2 20.7 42.0 36.4 18 18 A T T 4 S- 0 0 71 2,-0.2 -2,-0.2 0, 0.0 -1,-0.1 0.616 89.3-135.1-103.7 -15.8 23.9 40.2 35.6 19 19 A H S < S+ 0 0 83 -4,-2.0 2,-0.3 1,-0.2 -3,-0.1 0.742 72.6 102.9 61.6 26.0 22.5 36.8 34.6 20 20 A R S S- 0 0 147 -5,-0.2 -5,-2.4 -7,-0.0 -1,-0.2 -0.915 78.1-108.6-131.7 161.7 25.2 35.2 36.8 21 21 A I - 0 0 8 -2,-0.3 -7,-0.2 -7,-0.2 5,-0.1 -0.748 45.2-109.3 -83.6 129.2 25.5 33.5 40.1 22 22 A P >> - 0 0 17 0, 0.0 4,-1.8 0, 0.0 3,-0.9 -0.253 20.9-125.6 -56.5 141.7 27.4 35.7 42.6 23 23 A S H 3> S+ 0 0 86 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.872 110.9 56.7 -56.1 -37.4 30.8 34.4 43.5 24 24 A S H 3> S+ 0 0 12 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.787 102.6 55.9 -70.4 -25.3 30.0 34.5 47.2 25 25 A T H <> S+ 0 0 0 -3,-0.9 4,-2.5 2,-0.2 5,-0.2 0.922 107.6 48.1 -68.4 -44.5 27.0 32.2 46.5 26 26 A I H X S+ 0 0 21 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.944 113.2 48.0 -60.9 -45.2 29.2 29.6 44.9 27 27 A E H X S+ 0 0 130 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.906 111.1 50.9 -62.6 -40.7 31.6 29.8 47.8 28 28 A A H X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.903 111.3 47.0 -62.7 -43.4 28.8 29.5 50.3 29 29 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.884 109.9 54.3 -69.2 -35.3 27.4 26.4 48.6 30 30 A E H X S+ 0 0 65 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.944 111.6 45.1 -55.1 -49.9 30.9 24.8 48.4 31 31 A A H X S+ 0 0 41 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.920 113.8 48.5 -64.8 -42.4 31.2 25.3 52.1 32 32 A A H <>S+ 0 0 0 -4,-2.5 5,-2.2 1,-0.2 4,-0.4 0.905 108.0 55.0 -64.1 -42.2 27.7 24.0 52.9 33 33 A H H ><5S+ 0 0 76 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.922 106.8 50.1 -56.8 -45.3 28.3 20.9 50.7 34 34 A A H 3<5S+ 0 0 87 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.798 106.8 55.5 -66.6 -28.5 31.4 20.0 52.6 35 35 A K T 3<5S- 0 0 144 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.464 124.3-105.3 -79.0 -6.7 29.6 20.3 55.9 36 36 A G T < 5 + 0 0 46 -3,-1.4 -3,-0.2 -4,-0.4 -2,-0.1 0.516 65.9 152.1 94.2 8.2 27.0 17.8 54.6 37 37 A L < - 0 0 15 -5,-2.2 2,-0.4 223,-0.1 -1,-0.3 -0.451 45.1-127.7 -61.5 141.8 24.1 20.1 53.8 38 38 A K E -a 4 0A 78 -35,-2.4 -33,-2.9 -2,-0.1 2,-0.5 -0.804 23.0-151.7 -88.3 135.4 21.9 18.7 51.0 39 39 A I E -a 5 0A 0 -2,-0.4 24,-3.2 22,-0.2 25,-0.8 -0.940 16.7-179.4-118.1 119.0 21.4 21.4 48.3 40 40 A F E -ac 6 64A 0 -35,-2.9 -33,-2.9 -2,-0.5 2,-0.4 -0.912 23.4-134.7-122.6 144.9 18.3 21.3 46.2 41 41 A I E -ac 7 65A 0 23,-2.1 25,-2.8 -2,-0.4 2,-0.4 -0.781 17.4-172.6 -90.1 139.3 17.0 23.5 43.4 42 42 A A E + c 0 66A 0 -35,-2.7 2,-0.3 -2,-0.4 -33,-0.2 -0.861 25.3 153.6-135.4 98.5 13.3 24.5 43.6 43 43 A T - 0 0 0 23,-2.7 26,-2.2 -2,-0.4 27,-0.4 -0.898 55.0-138.9-134.6 150.2 12.3 26.2 40.4 44 44 A G S S+ 0 0 1 -2,-0.3 23,-0.1 24,-0.3 -1,-0.1 0.631 81.3 99.7 -72.7 -19.7 9.3 27.0 38.2 45 45 A R S S- 0 0 2 23,-0.1 23,-1.6 22,-0.1 -2,-0.2 -0.479 76.6-125.5 -65.1 141.8 11.6 26.3 35.2 46 46 A P > - 0 0 6 0, 0.0 3,-2.2 0, 0.0 4,-0.3 -0.518 30.3-107.8 -72.6 154.3 11.3 22.9 33.6 47 47 A K G > S+ 0 0 126 1,-0.3 3,-1.9 2,-0.2 -2,-0.1 0.847 116.1 70.0 -49.3 -39.8 14.6 21.0 33.3 48 48 A A G 3 S+ 0 0 74 1,-0.3 -1,-0.3 63,-0.1 64,-0.1 0.709 106.5 36.6 -55.0 -24.4 14.6 21.7 29.6 49 49 A I G < S+ 0 0 11 -3,-2.2 2,-1.7 82,-0.1 -1,-0.3 0.205 78.4 116.1-116.8 14.2 15.2 25.4 30.2 50 50 A I < + 0 0 20 -3,-1.9 3,-0.2 -4,-0.3 -3,-0.0 -0.647 31.0 141.0 -82.3 86.6 17.6 25.2 33.2 51 51 A N + 0 0 77 -2,-1.7 -1,-0.2 1,-0.1 3,-0.1 0.182 52.8 66.9-111.5 11.5 20.5 26.7 31.3 52 52 A N S S+ 0 0 27 1,-0.1 3,-0.2 -3,-0.1 -1,-0.1 0.176 79.1 73.4-127.3 14.2 21.9 28.9 34.1 53 53 A L >> + 0 0 0 -3,-0.2 4,-2.7 1,-0.1 3,-1.1 0.223 52.3 116.9-114.7 12.2 23.3 26.6 36.7 54 54 A S H 3> S+ 0 0 62 1,-0.3 4,-3.3 2,-0.2 5,-0.3 0.842 72.4 60.0 -57.5 -31.1 26.4 25.2 35.1 55 55 A E H 3> S+ 0 0 47 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.896 114.2 36.3 -62.2 -37.6 28.7 26.7 37.7 56 56 A L H <4>S+ 0 0 0 -3,-1.1 5,-2.1 2,-0.2 6,-0.3 0.881 118.8 50.2 -78.3 -40.4 26.9 24.6 40.4 57 57 A Q H ><5S+ 0 0 67 -4,-2.7 3,-1.5 1,-0.2 -2,-0.2 0.904 108.6 50.3 -66.6 -44.4 26.4 21.6 38.2 58 58 A D H 3<5S+ 0 0 125 -4,-3.3 -1,-0.2 -5,-0.3 -2,-0.2 0.783 109.8 52.9 -67.9 -22.1 30.0 21.4 37.0 59 59 A R T 3<5S- 0 0 138 -4,-0.7 -1,-0.3 -5,-0.3 -2,-0.2 0.357 109.6-127.5 -86.1 -0.2 31.0 21.6 40.7 60 60 A N T < 5 + 0 0 130 -3,-1.5 -3,-0.2 -4,-0.1 -2,-0.1 0.873 65.6 136.0 57.2 41.4 28.7 18.7 41.5 61 61 A L < + 0 0 2 -5,-2.1 2,-0.5 -23,-0.0 -22,-0.2 0.551 38.5 88.8 -96.3 -11.3 27.0 20.7 44.3 62 62 A I - 0 0 26 -6,-0.3 -22,-0.2 1,-0.1 3,-0.1 -0.811 46.8-175.0 -98.6 130.1 23.3 19.9 43.6 63 63 A D - 0 0 42 -24,-3.2 2,-0.3 -2,-0.5 -23,-0.2 0.525 65.6 -16.5 -98.6 -11.5 21.7 16.9 45.3 64 64 A G E -c 40 0A 1 -25,-0.8 -23,-2.1 11,-0.2 2,-0.4 -0.948 59.8-118.3 176.8 167.4 18.3 17.0 43.7 65 65 A Y E -cD 41 74A 34 9,-3.0 9,-2.4 -2,-0.3 2,-0.6 -0.979 8.3-168.6-131.9 133.0 15.7 19.1 41.7 66 66 A I E +cD 42 73A 0 -25,-2.8 -23,-2.7 -2,-0.4 2,-0.3 -0.986 32.7 172.6-108.2 114.2 12.2 20.4 42.2 67 67 A T E > > + D 0 72A 0 5,-2.4 5,-1.7 -2,-0.6 3,-1.4 -0.774 50.6 30.5-122.8 167.0 11.2 21.6 38.8 68 68 A M G > 5S- 0 0 4 -23,-1.6 3,-2.1 1,-0.3 -24,-0.3 0.908 131.4 -62.1 49.4 43.8 7.9 22.9 37.3 69 69 A N G 3 5S- 0 0 10 -26,-2.2 -1,-0.3 1,-0.3 121,-0.2 0.772 107.8 -42.1 59.7 30.0 6.9 24.3 40.7 70 70 A G G < 5S+ 0 0 0 -3,-1.4 -1,-0.3 -27,-0.4 3,-0.2 0.268 116.4 107.7 99.8 -11.1 6.9 20.8 42.3 71 71 A A T < 5S+ 0 0 0 -3,-2.1 12,-1.6 -4,-0.3 2,-0.3 0.546 85.7 34.2 -78.8 -5.2 5.2 19.0 39.4 72 72 A Y E S- E 0 78A 22 3,-2.4 3,-2.1 -2,-0.3 2,-0.3 -0.984 77.9 -39.4-131.9 111.9 17.2 13.0 42.4 76 76 A G T 3 S- 0 0 57 -2,-0.4 -11,-0.1 1,-0.3 -12,-0.0 -0.508 126.8 -26.4 63.6-127.5 20.1 12.0 40.1 77 77 A E T 3 S+ 0 0 182 -2,-0.3 2,-0.6 -3,-0.1 -1,-0.3 0.484 117.8 103.5 -90.1 -3.4 18.4 10.1 37.3 78 78 A E E < -E 75 0A 110 -3,-2.1 -3,-2.4 2,-0.0 2,-0.5 -0.714 63.7-145.2 -95.1 116.7 15.5 9.0 39.5 79 79 A V E +E 74 0A 55 -2,-0.6 -5,-0.3 -5,-0.2 3,-0.1 -0.671 18.9 179.4 -71.3 122.1 12.1 10.7 39.1 80 80 A I E + 0 0 21 -7,-2.3 2,-0.3 -2,-0.5 -6,-0.2 0.611 64.7 1.5-101.8 -16.4 10.6 10.8 42.6 81 81 A Y E +E 73 0A 52 -8,-1.4 -8,-3.0 2,-0.0 -1,-0.4 -0.912 61.8 165.4-168.8 141.4 7.3 12.5 41.8 82 82 A K E -E 72 0A 103 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.965 9.4-168.9-150.0 164.0 5.5 14.0 38.8 83 83 A S - 0 0 21 -12,-1.6 2,-0.3 -2,-0.3 -2,-0.0 -0.911 9.8-144.8-145.5 172.6 2.0 15.1 37.9 84 84 A A - 0 0 42 -2,-0.3 64,-0.2 98,-0.0 3,-0.1 -0.991 25.7-110.4-141.1 149.4 -0.1 16.1 35.0 85 85 A I - 0 0 5 62,-3.0 62,-0.4 -2,-0.3 5,-0.1 -0.554 43.6 -95.7 -79.2 137.0 -2.8 18.7 34.5 86 86 A P >> - 0 0 53 0, 0.0 4,-1.8 0, 0.0 3,-1.1 -0.263 35.0-127.7 -49.6 133.2 -6.5 17.5 34.0 87 87 A Q H 3> S+ 0 0 66 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.852 106.5 60.2 -62.4 -32.9 -7.0 17.5 30.3 88 88 A E H 3> S+ 0 0 168 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.884 107.7 46.3 -59.5 -35.0 -10.2 19.6 30.5 89 89 A E H <> S+ 0 0 13 -3,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.863 109.5 53.2 -78.0 -33.1 -8.1 22.4 32.1 90 90 A V H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.949 112.7 45.8 -59.4 -50.4 -5.3 22.1 29.6 91 91 A K H X S+ 0 0 104 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.898 111.4 51.2 -62.0 -40.5 -8.0 22.5 26.8 92 92 A A H X S+ 0 0 26 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.884 110.4 48.3 -69.7 -38.8 -9.6 25.4 28.6 93 93 A M H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.918 111.6 50.3 -64.2 -44.4 -6.3 27.3 29.0 94 94 A A H X S+ 0 0 3 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.921 112.6 47.0 -59.0 -43.7 -5.5 26.7 25.3 95 95 A A H X S+ 0 0 59 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.902 112.3 50.2 -64.3 -41.5 -8.9 28.0 24.2 96 96 A F H X S+ 0 0 9 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.954 113.5 44.2 -61.0 -50.2 -8.6 31.0 26.5 97 97 A C H X>S+ 0 0 0 -4,-2.7 5,-2.3 1,-0.2 4,-1.2 0.912 112.8 51.5 -67.0 -39.7 -5.2 32.0 25.2 98 98 A E H <5S+ 0 0 124 -4,-2.5 3,-0.3 -5,-0.2 -1,-0.2 0.904 113.4 44.9 -62.1 -43.5 -6.1 31.4 21.6 99 99 A K H <5S+ 0 0 159 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.870 115.8 46.8 -66.6 -41.6 -9.2 33.6 21.9 100 100 A K H <5S- 0 0 77 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.581 109.1-121.2 -74.1 -17.8 -7.4 36.3 23.8 101 101 A G T <5 + 0 0 60 -4,-1.2 -3,-0.2 -3,-0.3 -4,-0.1 0.892 66.5 131.3 76.8 35.9 -4.4 36.4 21.5 102 102 A V < - 0 0 18 -5,-2.3 -1,-0.3 -6,-0.1 -2,-0.1 -0.939 55.3-113.8-121.8 151.4 -1.8 35.6 24.0 103 103 A P - 0 0 2 0, 0.0 50,-2.7 0, 0.0 2,-0.3 -0.356 27.3-168.7 -75.9 159.6 1.0 33.0 23.9 104 104 A C E -IJ 115 152C 0 11,-1.3 11,-2.4 48,-0.2 2,-0.4 -0.970 14.1-143.0-149.7 133.3 1.2 29.9 26.1 105 105 A I E -IJ 114 151C 4 46,-2.0 46,-2.6 -2,-0.3 2,-0.5 -0.766 13.1-159.1 -89.8 138.9 4.0 27.4 26.7 106 106 A F E -IJ 113 150C 0 7,-2.6 7,-2.0 -2,-0.4 2,-0.5 -0.984 7.2-159.9-122.4 119.0 3.0 23.8 27.2 107 107 A V E -IJ 112 149C 3 42,-3.1 41,-2.7 -2,-0.5 42,-1.4 -0.904 10.0-179.0-108.7 122.5 5.6 21.6 29.0 108 108 A E - 0 0 42 3,-2.8 3,-0.2 -2,-0.5 39,-0.1 -0.536 47.0 -94.7-100.6 175.3 5.5 17.7 28.7 109 109 A E S S+ 0 0 63 37,-0.4 38,-0.1 1,-0.2 3,-0.0 0.922 122.0 13.0 -58.6 -44.4 8.0 15.4 30.5 110 110 A H S S+ 0 0 147 1,-0.0 2,-0.3 -62,-0.0 -1,-0.2 0.163 125.3 53.0-123.7 18.0 10.3 15.2 27.5 111 111 A N - 0 0 102 -3,-0.2 -3,-2.8 2,-0.0 2,-0.4 -0.982 54.4-161.7-148.0 153.4 9.1 18.1 25.1 112 112 A I E +I 107 0C 24 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.996 17.1 174.6-138.8 136.6 8.5 21.8 25.5 113 113 A S E -I 106 0C 11 -7,-2.0 -7,-2.6 -2,-0.4 2,-0.4 -0.956 18.9-148.1-140.2 156.3 6.4 23.8 23.0 114 114 A V E -Ik 105 136C 0 21,-2.5 23,-2.1 -2,-0.3 2,-0.5 -0.983 10.7-146.7-128.8 142.9 5.0 27.3 22.6 115 115 A C E S-I 104 0C 0 -11,-2.4 -11,-1.3 -2,-0.4 23,-0.1 -0.920 76.3 -14.6-111.7 128.4 1.7 28.4 20.9 116 116 A Q S S- 0 0 129 -2,-0.5 -1,-0.2 21,-0.4 22,-0.1 0.880 81.5-159.2 48.6 53.7 1.5 31.7 19.0 117 117 A P - 0 0 53 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.285 8.7-166.6 -61.2 144.9 4.7 33.2 20.4 118 118 A N > - 0 0 51 0, 0.0 4,-1.7 0, 0.0 3,-0.5 -0.556 42.3 -81.5-123.0-171.4 5.0 36.9 20.3 119 119 A E H > S+ 0 0 159 1,-0.3 4,-3.8 2,-0.2 5,-0.1 0.860 124.6 62.4 -72.6 -23.4 7.8 39.3 20.7 120 120 A M H > S+ 0 0 60 2,-0.2 4,-2.5 1,-0.2 5,-0.4 0.800 99.7 53.6 -64.3 -38.0 7.4 39.2 24.5 121 121 A V H >>S+ 0 0 0 -3,-0.5 4,-2.2 2,-0.2 5,-1.1 0.955 115.3 41.1 -52.7 -50.6 8.2 35.6 24.5 122 122 A K H X>S+ 0 0 111 -4,-1.7 5,-3.4 1,-0.2 4,-0.5 0.957 114.2 52.1 -69.7 -40.2 11.4 36.5 22.5 123 123 A K H <>S+ 0 0 115 -4,-3.8 5,-1.2 -5,-0.2 -1,-0.2 0.927 123.6 26.3 -63.5 -42.4 12.1 39.6 24.7 124 124 A I H <>S+ 0 0 4 -4,-2.5 5,-1.6 3,-0.2 -2,-0.2 0.962 129.9 31.5 -87.1 -52.6 11.9 37.8 27.9 125 125 A F H <5S+ 0 0 4 -4,-2.2 6,-3.3 -5,-0.4 -3,-0.2 0.889 131.8 25.9 -73.9 -41.2 12.8 34.1 27.4 126 126 A Y T X - 0 0 48 -2,-0.3 4,-2.7 -23,-0.1 5,-0.2 -0.357 29.4-119.1 -69.2 155.1 -0.6 24.9 17.3 139 139 A F H > S+ 0 0 7 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.885 115.3 58.5 -58.1 -37.9 -3.0 25.3 20.2 140 140 A E H > S+ 0 0 146 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.938 108.8 42.1 -57.5 -52.8 -4.9 22.4 18.9 141 141 A E H >4 S+ 0 0 119 1,-0.2 3,-1.3 2,-0.2 4,-0.2 0.942 115.6 49.5 -63.3 -44.9 -2.0 20.1 19.0 142 142 A A H >< S+ 0 0 0 -4,-2.7 3,-1.8 1,-0.2 -1,-0.2 0.875 101.2 63.9 -60.3 -36.0 -0.8 21.3 22.4 143 143 A S H 3< S+ 0 0 19 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.719 102.5 51.0 -65.9 -14.2 -4.3 21.0 23.9 144 144 A N T << S+ 0 0 100 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.385 90.5 100.7-101.8 -0.6 -4.1 17.2 23.4 145 145 A K S < S- 0 0 27 -3,-1.8 2,-1.0 -4,-0.2 -55,-0.1 -0.424 84.5-103.3 -87.5 162.5 -0.8 16.5 25.0 146 146 A E - 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M 0 172C 4 -8,-2.8 -8,-2.1 -2,-0.3 2,-0.4 -0.927 19.8-160.5-107.5 133.4 3.0 28.9 35.7 181 181 A V E +LM 150 171C 0 -31,-3.0 -31,-2.1 -2,-0.4 2,-0.3 -0.958 17.4 164.0-118.0 126.1 0.0 26.5 36.0 182 182 A T E - M 0 170C 3 -12,-1.9 -12,-2.6 -2,-0.4 3,-0.2 -0.827 39.8 -76.5-136.1 169.1 0.3 23.1 37.5 183 183 A A S > S- 0 0 10 -35,-0.4 3,-2.6 -2,-0.3 -13,-0.1 -0.143 71.9 -54.6 -69.4 167.9 -2.0 20.4 38.9 184 184 A K T 3 S+ 0 0 148 1,-0.3 -1,-0.2 -15,-0.1 -15,-0.1 -0.077 123.2 0.5 -47.6 123.6 -3.8 20.5 42.3 185 185 A G T 3 S+ 0 0 36 -17,-0.2 2,-1.3 1,-0.2 5,-0.3 0.296 89.5 135.2 82.4 -7.8 -1.4 20.9 45.2 186 186 A D < + 0 0 4 -3,-2.6 2,-0.3 4,-0.1 -115,-0.2 -0.617 26.3 124.9 -85.3 91.4 1.8 21.1 43.0 187 187 A T S >> S- 0 0 31 -2,-1.3 4,-1.6 -117,-0.2 3,-0.9 -0.827 81.1 -87.7-128.5 174.7 3.8 24.0 44.4 188 188 A K H 3> S+ 0 0 0 26,-0.5 4,-2.3 -2,-0.3 5,-0.1 0.793 125.8 66.0 -62.7 -23.4 7.3 24.1 45.7 189 189 A Q H 3> S+ 0 0 72 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.909 100.9 49.0 -58.3 -45.8 6.0 23.1 49.1 190 190 A K H <> S+ 0 0 57 -3,-0.9 4,-2.3 -5,-0.3 -2,-0.2 0.895 108.8 54.1 -58.3 -42.4 5.0 19.7 47.5 191 191 A G H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.923 106.4 50.6 -60.1 -44.1 8.5 19.5 46.1 192 192 A I H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.941 109.6 51.4 -56.5 -47.7 10.0 20.0 49.5 193 193 A D H X S+ 0 0 59 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.899 111.7 46.9 -58.7 -43.0 7.8 17.2 50.9 194 194 A E H X S+ 0 0 23 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.927 113.7 47.0 -66.9 -44.6 8.9 14.8 48.1 195 195 A I H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.942 113.8 46.4 -63.8 -47.4 12.6 15.5 48.4 196 196 A I H X>S+ 0 0 14 -4,-2.9 5,-1.8 1,-0.2 4,-1.2 0.869 108.8 56.6 -70.2 -30.7 12.7 15.2 52.2 197 197 A R H ><5S+ 0 0 138 -4,-2.0 3,-0.5 -5,-0.3 -1,-0.2 0.927 107.9 49.4 -56.2 -47.3 10.6 12.0 52.1 198 198 A H H 3<5S+ 0 0 66 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.898 118.4 37.2 -60.4 -40.0 13.3 10.6 49.8 199 199 A F H 3<5S- 0 0 65 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.497 106.6-117.0 -95.5 -1.2 16.2 11.6 52.1 200 200 A G T <<5 + 0 0 63 -4,-1.2 2,-0.3 -3,-0.5 -3,-0.2 0.745 64.1 148.6 70.1 23.2 14.6 10.9 55.5 201 201 A I < - 0 0 17 -5,-1.8 -1,-0.3 -6,-0.2 2,-0.2 -0.697 43.3-129.1 -91.5 141.8 14.9 14.6 56.4 202 202 A K > - 0 0 139 -2,-0.3 3,-2.2 1,-0.1 -199,-0.2 -0.607 17.8-119.6 -87.6 152.7 12.2 16.2 58.7 203 203 A L G > S+ 0 0 41 1,-0.3 3,-1.6 -2,-0.2 20,-0.9 0.859 114.0 64.9 -54.8 -35.5 10.4 19.4 57.8 204 204 A E G 3 S+ 0 0 142 1,-0.3 -1,-0.3 18,-0.1 18,-0.0 0.562 98.0 57.1 -64.2 -10.0 11.9 20.9 60.9 205 205 A E G < S+ 0 0 41 -3,-2.2 -202,-3.1 -203,-0.1 -201,-1.8 0.067 89.2 103.1-108.7 18.0 15.4 20.5 59.3 206 206 A T E < -b 4 0A 1 -3,-1.6 18,-1.3 -204,-0.2 2,-0.3 -0.785 43.9-172.7-110.8 153.1 14.7 22.5 56.1 207 207 A M E -bf 5 224A 0 -203,-2.0 -201,-2.5 -2,-0.3 2,-0.3 -0.994 9.2-164.6-139.5 133.4 15.6 26.0 54.9 208 208 A S E -bf 6 225A 0 16,-2.3 18,-2.9 -2,-0.3 2,-0.4 -0.855 4.3-160.5-121.2 156.8 14.2 27.7 51.7 209 209 A F E +bf 7 226A 0 -203,-2.2 -201,-2.3 -2,-0.3 2,-0.3 -1.000 24.3 145.7-137.6 127.3 15.4 30.7 49.8 210 210 A G E - f 0 227A 0 16,-2.2 18,-2.2 -2,-0.4 21,-0.1 -0.990 37.8-162.7-160.6 168.3 13.3 32.8 47.3 211 211 A D + 0 0 20 -2,-0.3 21,-0.5 -201,-0.3 2,-0.2 0.430 68.6 67.7-126.9 -9.6 12.5 36.1 45.7 212 212 A G S > S- 0 0 7 19,-0.1 3,-2.2 23,-0.1 4,-0.4 -0.695 84.2-103.5-126.8 169.4 9.1 35.5 44.0 213 213 A G G > S+ 0 0 38 -40,-0.4 3,-1.3 1,-0.3 4,-0.4 0.854 117.4 60.8 -60.8 -32.0 5.4 34.9 44.5 214 214 A N G 3 S+ 0 0 10 -41,-1.9 -26,-0.5 1,-0.3 -1,-0.3 0.476 100.8 57.4 -75.7 1.1 5.9 31.2 43.5 215 215 A D G <> S+ 0 0 0 -3,-2.2 4,-2.3 -42,-0.3 -1,-0.3 0.481 79.6 90.1 -99.6 -12.4 8.2 30.9 46.5 216 216 A I H <> S+ 0 0 36 -3,-1.3 4,-2.2 -4,-0.4 5,-0.3 0.909 85.0 50.7 -58.2 -41.9 5.7 32.0 49.2 217 217 A S H > S+ 0 0 30 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.903 115.0 43.2 -65.0 -39.1 4.4 28.5 49.9 218 218 A M H > S+ 0 0 0 2,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.778 109.8 56.8 -76.8 -27.2 7.9 27.1 50.4 219 219 A L H < S+ 0 0 0 -4,-2.3 21,-0.2 2,-0.2 -2,-0.2 0.890 115.2 38.8 -64.5 -39.7 9.0 30.1 52.4 220 220 A R H < S+ 0 0 163 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.855 118.0 49.9 -76.4 -34.6 6.2 29.4 54.8 221 221 A H H < S+ 0 0 38 -4,-2.0 -2,-0.2 -5,-0.3 -3,-0.2 0.880 93.2 79.6 -75.6 -42.4 6.5 25.6 54.7 222 222 A A S < S- 0 0 4 -4,-2.2 3,-0.2 1,-0.1 -15,-0.1 -0.273 91.0-115.4 -62.2 157.3 10.2 25.3 55.3 223 223 A A S S+ 0 0 45 -20,-0.9 2,-0.4 1,-0.3 -16,-0.2 0.898 107.7 23.4 -62.0 -39.2 11.4 25.5 59.0 224 224 A I E S-f 207 0A 39 -18,-1.3 -16,-2.3 2,-0.0 2,-0.5 -0.989 75.7-165.4-128.2 120.2 13.3 28.7 58.0 225 225 A G E -f 208 0A 0 -2,-0.4 15,-2.0 -18,-0.2 16,-1.8 -0.931 4.2-162.3-105.3 130.0 12.3 30.7 55.0 226 226 A V E -fg 209 241A 0 -18,-2.9 -16,-2.2 -2,-0.5 2,-0.4 -0.951 2.2-159.8-113.8 119.3 14.7 33.3 53.6 227 227 A A E -fg 210 242A 0 14,-2.4 16,-2.5 -2,-0.5 -16,-0.2 -0.786 24.9-113.8 -95.9 140.9 13.5 36.1 51.3 228 228 A M > - 0 0 0 -18,-2.2 3,-1.9 -2,-0.4 16,-0.1 -0.392 28.3-114.6 -68.7 150.4 16.0 38.0 49.1 229 229 A G T 3 S+ 0 0 12 15,-1.8 -1,-0.1 1,-0.3 15,-0.1 0.763 113.2 50.4 -63.7 -25.7 16.4 41.6 49.9 230 230 A Q T 3 S+ 0 0 72 14,-0.2 -1,-0.3 -219,-0.2 3,-0.1 0.404 84.4 119.1 -93.2 5.3 14.9 42.9 46.7 231 231 A A S < S- 0 0 10 -3,-1.9 -19,-0.1 -21,-0.1 -20,-0.0 -0.269 73.1 -96.5 -65.5 156.2 11.8 40.7 46.9 232 232 A K >> - 0 0 161 -21,-0.5 4,-2.3 1,-0.1 3,-0.6 -0.222 41.3 -99.9 -67.2 163.4 8.4 42.4 47.0 233 233 A E H 3> S+ 0 0 168 1,-0.3 4,-2.5 2,-0.2 5,-0.1 0.839 119.4 54.5 -60.4 -37.8 6.8 42.9 50.4 234 234 A D H 3> S+ 0 0 96 2,-0.2 4,-1.1 1,-0.2 -1,-0.3 0.862 108.9 49.3 -69.1 -30.5 4.5 39.9 50.4 235 235 A V H X> S+ 0 0 3 -3,-0.6 4,-0.8 2,-0.2 3,-0.5 0.931 112.6 48.3 -66.9 -48.5 7.4 37.6 49.6 236 236 A K H >< S+ 0 0 74 -4,-2.3 3,-1.0 1,-0.2 -2,-0.2 0.905 108.1 54.7 -56.0 -41.5 9.3 39.1 52.5 237 237 A A H 3< S+ 0 0 68 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.786 103.9 55.3 -68.7 -25.6 6.3 38.8 54.8 238 238 A A H << S+ 0 0 4 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.630 99.6 79.4 -78.2 -18.6 6.1 35.1 54.1 239 239 A A S << S- 0 0 16 -3,-1.0 -13,-0.2 -4,-0.8 3,-0.1 -0.484 72.1-141.7 -88.0 161.3 9.7 34.5 55.2 240 240 A D S S+ 0 0 108 -15,-2.0 2,-0.3 1,-0.3 -14,-0.2 0.715 90.8 25.3 -84.3 -28.3 11.2 34.3 58.6 241 241 A Y E -g 226 0A 64 -16,-1.8 -14,-2.4 -5,-0.0 2,-0.6 -0.998 65.6-149.2-144.6 133.4 14.3 36.2 57.6 242 242 A V E -g 227 0A 64 -2,-0.3 -14,-0.2 -16,-0.2 2,-0.1 -0.943 22.5-166.0-108.1 118.9 15.0 38.8 54.9 243 243 A T - 0 0 10 -16,-2.5 7,-0.1 -2,-0.6 8,-0.1 -0.255 32.0 -73.4 -91.3-177.9 18.6 38.8 53.7 244 244 A A - 0 0 21 6,-0.3 -15,-1.8 1,-0.2 -14,-0.2 -0.246 66.6 -74.6 -65.4 165.4 20.5 41.3 51.6 245 245 A P > > - 0 0 41 0, 0.0 3,-2.2 0, 0.0 5,-1.4 -0.208 49.8-104.0 -56.1 156.7 19.8 41.8 47.9 246 246 A I G > 5S+ 0 0 2 1,-0.3 3,-0.7 -235,-0.2 4,-0.4 0.871 121.2 47.2 -51.6 -46.5 21.1 39.0 45.6 247 247 A D G 3 5S+ 0 0 72 1,-0.3 -1,-0.3 2,-0.2 -226,-0.0 0.288 103.1 64.9 -91.0 15.6 24.1 41.1 44.3 248 248 A E G < 5S- 0 0 112 -3,-2.2 -1,-0.3 -226,-0.0 -4,-0.1 -0.297 128.1 -89.2-120.4 40.5 25.1 42.2 47.9 249 249 A D T <>5S+ 0 0 68 -3,-0.7 4,-2.8 1,-0.1 5,-0.3 0.785 71.2 159.8 64.4 33.2 25.9 38.7 49.0 250 250 A G H >< + 0 0 0 -5,-1.4 4,-1.9 -4,-0.4 -6,-0.3 0.875 69.3 45.7 -59.4 -42.7 22.4 37.9 50.1 251 251 A I H > S+ 0 0 0 -5,-0.3 4,-2.5 -239,-0.2 5,-0.2 0.968 116.0 44.5 -64.8 -51.1 22.7 34.1 50.0 252 252 A S H > S+ 0 0 9 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.921 112.6 52.0 -60.3 -43.8 26.1 33.9 51.7 253 253 A K H X S+ 0 0 97 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.900 110.9 48.0 -60.6 -40.1 25.1 36.4 54.4 254 254 A A H X S+ 0 0 0 -4,-1.9 4,-1.8 -5,-0.3 6,-0.2 0.925 111.3 49.5 -65.7 -45.2 22.0 34.4 55.2 255 255 A M H X>S+ 0 0 0 -4,-2.5 5,-1.9 1,-0.2 6,-1.0 0.901 113.2 47.1 -62.5 -38.7 23.8 31.1 55.4 256 256 A K H ><5S+ 0 0 130 -4,-2.6 3,-1.1 -5,-0.2 -1,-0.2 0.910 107.2 58.1 -65.8 -42.8 26.4 32.7 57.7 257 257 A H H 3<5S+ 0 0 105 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.876 111.5 40.6 -55.1 -41.5 23.7 34.3 59.9 258 258 A F H 3<5S- 0 0 66 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.524 113.8-114.8 -85.1 -8.4 22.2 30.9 60.6 259 259 A G T <<5S+ 0 0 56 -3,-1.1 -3,-0.2 -4,-0.5 -2,-0.1 0.671 76.3 132.2 76.8 19.4 25.5 29.2 61.1 260 260 A I < 0 0 13 -5,-1.9 -4,-0.2 -6,-0.2 -223,-0.1 0.893 360.0 360.0 -60.6 -41.1 25.0 26.9 58.0 261 261 A I 0 0 62 -6,-1.0 -2,-0.2 -9,-0.1 -1,-0.1 -0.810 360.0 360.0-131.7 360.0 28.5 28.0 57.2