==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 05-APR-06 2GLU . COMPND 2 MOLECULE: YCGJ; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR T.BURKE,J.GORMAN,L.SHAPIRO,S.K.BURLEY,NEW YORK SGX RESEARCH . 470 4 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21331.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 364 77.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 51 10.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 11.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 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 . 25 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 148 31.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.7 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 4 0 2 1 1 4 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 1 1 5 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 PARALLEL BRIDGES PER LADDER . 1 2 0 0 0 0 2 0 0 0 0 0 2 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 1 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 -3 A H > 0 0 139 0, 0.0 4,-1.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 27.6 4.6 51.8 101.0 2 -2 A H H > + 0 0 172 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.626 360.0 60.5 -64.5 -14.6 0.9 50.7 101.0 3 -1 A H H > S+ 0 0 91 2,-0.2 4,-2.4 3,-0.2 5,-0.2 0.969 102.4 46.0 -81.6 -55.4 1.3 48.4 98.0 4 0 A S H > S+ 0 0 3 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.938 117.4 48.2 -47.6 -48.5 3.8 45.9 99.3 5 1 A L H X S+ 0 0 23 -4,-1.4 4,-1.3 1,-0.2 -1,-0.2 0.863 109.6 49.4 -65.1 -43.9 1.7 45.8 102.5 6 2 A G H X S+ 0 0 38 -4,-1.7 4,-2.6 1,-0.2 3,-0.2 0.911 107.6 56.0 -62.4 -44.0 -1.7 45.3 100.9 7 3 A L H X S+ 0 0 22 -4,-2.4 4,-3.2 1,-0.2 -1,-0.2 0.843 103.0 55.0 -54.0 -40.6 -0.4 42.4 98.7 8 4 A X H X S+ 0 0 0 -4,-1.3 4,-1.9 -5,-0.2 -1,-0.2 0.911 109.0 47.5 -63.9 -39.0 0.7 40.6 101.8 9 5 A I H X S+ 0 0 41 -4,-1.3 4,-0.8 -3,-0.2 5,-0.4 0.914 114.0 46.6 -71.5 -42.9 -2.8 40.8 103.2 10 6 A K H < S+ 0 0 161 -4,-2.6 3,-0.5 1,-0.2 -2,-0.2 0.945 119.9 40.5 -56.3 -49.2 -4.3 39.6 100.0 11 7 A T H < S+ 0 0 19 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.720 102.4 69.0 -76.5 -21.1 -1.8 36.8 99.7 12 8 A A H < S- 0 0 0 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.1 0.793 82.9-149.7 -74.8 -27.0 -1.7 35.8 103.3 13 9 A E < - 0 0 121 -4,-0.8 -3,-0.1 -3,-0.5 -2,-0.1 0.993 25.7-149.1 54.7 70.6 -5.2 34.3 103.3 14 10 A C - 0 0 38 -5,-0.4 2,-0.3 24,-0.0 24,-0.1 -0.150 16.2-158.8 -72.1 163.7 -5.9 35.1 107.0 15 11 A R > - 0 0 149 1,-0.1 3,-2.3 22,-0.0 24,-0.4 -0.993 30.5-117.6-141.0 144.3 -8.0 33.3 109.6 16 12 A A T 3 S+ 0 0 81 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.876 114.9 49.6 -40.5 -45.6 -9.6 34.4 112.8 17 13 A E T 3 S+ 0 0 104 21,-0.2 -1,-0.3 22,-0.1 21,-0.1 0.359 85.6 118.8 -86.3 4.8 -7.5 31.9 114.7 18 14 A H < - 0 0 22 -3,-2.3 21,-2.0 19,-0.2 22,-1.3 -0.388 50.2-147.6 -78.3 150.6 -4.0 32.6 113.2 19 15 A R E -a 40 0A 119 20,-0.2 65,-1.6 19,-0.1 66,-1.3 -0.954 19.7-158.4-111.5 132.9 -0.8 33.7 115.0 20 16 A V E -ab 41 85A 0 20,-3.4 22,-3.1 -2,-0.4 2,-0.5 -0.910 10.2-160.7-119.6 137.5 1.6 36.0 113.0 21 17 A L E -ab 42 86A 0 64,-2.1 66,-1.6 -2,-0.4 2,-0.6 -0.945 4.7-163.3-119.8 117.6 5.3 36.8 113.4 22 18 A D E > -ab 43 87A 1 20,-2.6 22,-2.1 -2,-0.5 3,-0.6 -0.846 11.4-156.2-100.3 113.7 6.8 39.9 111.8 23 19 A I E 3 S+ab 44 88A 2 64,-2.7 66,-0.5 -2,-0.6 22,-0.2 -0.766 78.1 10.9 -99.1 132.3 10.6 39.8 111.5 24 20 A G T 3 S+ 0 0 2 20,-1.7 -1,-0.3 -2,-0.4 21,-0.3 0.903 85.4 175.7 68.3 46.8 12.6 43.0 111.3 25 21 A A X> - 0 0 1 19,-2.5 3,-1.3 -3,-0.6 4,-0.5 0.669 5.2-178.2 -70.4 -25.6 9.3 44.6 112.2 26 22 A G T 34 S- 0 0 1 1,-0.3 28,-0.3 2,-0.2 -1,-0.2 -0.322 71.4 -5.7 72.9-145.7 10.5 48.2 112.5 27 23 A A T 34 S- 0 0 31 26,-0.1 -1,-0.3 27,-0.1 -2,-0.1 0.378 110.0-112.7 -63.7 3.5 8.1 50.9 113.6 28 24 A G T <> + 0 0 0 -3,-1.3 4,-1.4 -4,-0.1 -2,-0.2 0.768 67.3 149.0 83.3 33.0 5.9 47.8 113.2 29 25 A H H X S+ 0 0 85 -4,-0.5 4,-1.9 2,-0.2 5,-0.1 0.854 73.9 44.4 -74.4 -36.5 3.7 48.7 110.2 30 26 A T H > S+ 0 0 0 -5,-0.4 4,-2.1 441,-0.3 5,-0.2 0.952 110.0 57.3 -69.2 -46.0 3.2 45.2 108.8 31 27 A A H > S+ 0 0 1 -6,-0.3 4,-0.6 1,-0.3 -2,-0.2 0.816 111.7 42.0 -57.2 -32.7 2.5 43.9 112.3 32 28 A L H >< S+ 0 0 25 -4,-1.4 3,-0.8 2,-0.2 -1,-0.3 0.897 106.1 61.3 -81.7 -38.2 -0.3 46.3 112.7 33 29 A A H 3< S+ 0 0 30 -4,-1.9 4,-0.2 1,-0.3 -2,-0.2 0.899 108.6 44.8 -55.6 -42.5 -1.7 45.9 109.2 34 30 A F H >X S+ 0 0 0 -4,-2.1 3,-2.2 1,-0.2 4,-0.9 0.755 89.9 91.2 -69.2 -26.7 -2.4 42.3 109.9 35 31 A S G X< S+ 0 0 8 -3,-0.8 3,-0.6 -4,-0.6 -1,-0.2 0.791 78.2 54.9 -52.4 -43.5 -3.9 42.8 113.3 36 32 A P G 34 S+ 0 0 94 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.797 113.5 43.8 -59.4 -22.3 -7.6 43.1 112.5 37 33 A Y G <4 S+ 0 0 127 -3,-2.2 -19,-0.2 -4,-0.2 2,-0.2 0.615 110.3 47.8-102.8 -17.3 -7.6 39.8 110.7 38 34 A V S << S- 0 0 8 -4,-0.9 -22,-0.2 -3,-0.6 -21,-0.2 -0.712 79.4-114.5-124.1 170.6 -5.6 37.4 112.8 39 35 A Q S S- 0 0 105 -21,-2.0 2,-0.4 -24,-0.4 -20,-0.2 0.965 90.3 -0.3 -70.0 -53.3 -5.6 36.4 116.6 40 36 A E E -a 19 0A 35 -22,-1.3 -20,-3.4 2,-0.0 2,-0.4 -0.999 54.4-158.5-148.3 132.9 -2.1 37.7 117.6 41 37 A C E -ac 20 66A 1 24,-2.1 26,-1.8 -2,-0.4 2,-0.4 -0.943 9.9-172.9-109.0 133.7 0.8 39.4 116.0 42 38 A I E -ac 21 67A 13 -22,-3.1 -20,-2.6 -2,-0.4 2,-0.4 -0.954 8.7-166.8-117.3 144.8 4.2 39.1 117.5 43 39 A G E -ac 22 68A 0 24,-1.7 26,-1.4 -2,-0.4 2,-0.4 -0.998 6.8-161.5-135.2 137.1 7.1 41.2 116.1 44 40 A V E +ac 23 69A 2 -22,-2.1 -19,-2.5 -2,-0.4 -20,-1.7 -0.919 12.3 169.1-116.6 147.3 10.8 41.1 116.5 45 41 A D E - c 0 70A 4 24,-1.3 26,-2.4 -2,-0.4 6,-0.1 -0.966 32.7-133.7-145.7 153.1 13.3 43.8 115.8 46 42 A A S S+ 0 0 31 -2,-0.3 2,-0.2 24,-0.2 -1,-0.1 0.934 85.9 71.3 -78.7 -45.2 17.0 43.9 116.7 47 43 A T >> - 0 0 41 1,-0.1 4,-1.0 23,-0.1 3,-0.6 -0.520 68.9-150.2 -77.6 132.2 17.2 47.5 118.0 48 44 A K H >> S+ 0 0 113 -2,-0.2 4,-1.8 1,-0.2 3,-0.5 0.898 97.0 65.2 -69.5 -36.9 15.4 48.2 121.3 49 45 A E H 3> S+ 0 0 124 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.808 103.3 49.3 -50.9 -29.4 14.7 51.8 120.2 50 46 A X H <> S+ 0 0 57 -3,-0.6 4,-2.6 2,-0.2 -1,-0.2 0.790 101.7 59.4 -84.8 -31.2 12.5 50.2 117.5 51 47 A V H S+ 0 0 6 -4,-2.1 5,-1.2 -5,-0.3 3,-0.4 0.958 112.0 45.5 -49.1 -54.2 0.5 50.1 118.6 59 55 A Q H ><5S+ 0 0 159 -4,-1.7 3,-1.5 1,-0.2 -2,-0.2 0.821 107.4 57.1 -60.8 -38.8 -0.9 51.8 121.8 60 56 A E H 3<5S+ 0 0 143 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.848 113.2 40.1 -63.5 -37.3 -1.4 55.1 119.9 61 57 A K T 3<5S- 0 0 153 -4,-2.0 -1,-0.3 -3,-0.4 -2,-0.2 0.106 112.4-131.1 -92.0 17.9 -3.6 53.1 117.4 62 58 A G T < 5 + 0 0 55 -3,-1.5 2,-0.5 1,-0.1 -3,-0.2 0.792 46.7 158.3 18.6 73.2 -5.0 51.2 120.4 63 59 A V < - 0 0 33 -5,-1.2 3,-0.2 1,-0.1 -1,-0.1 -0.974 25.0-166.7-111.0 131.5 -4.7 47.7 119.1 64 60 A E S S+ 0 0 184 -2,-0.5 -1,-0.1 1,-0.1 -2,-0.1 0.839 76.2 59.7 -80.9 -37.3 -4.6 45.0 121.9 65 61 A N S S+ 0 0 45 -27,-0.1 -24,-2.1 -33,-0.1 2,-0.4 0.333 86.3 76.2 -89.7 4.5 -3.4 42.0 119.9 66 62 A V E +c 41 0A 7 -3,-0.2 2,-0.3 -26,-0.2 -24,-0.2 -0.917 54.0 177.2-110.4 142.9 -0.0 43.0 118.5 67 63 A R E -c 42 0A 110 -26,-1.8 -24,-1.7 -2,-0.4 2,-0.2 -0.969 13.9-147.8-144.5 139.9 3.1 43.1 120.7 68 64 A F E +c 43 0A 23 -2,-0.3 2,-0.3 -26,-0.2 -24,-0.2 -0.489 17.8 170.3-101.8 163.1 6.7 43.9 119.9 69 65 A Q E -c 44 0A 61 -26,-1.4 -24,-1.3 -2,-0.2 2,-0.4 -0.971 33.2 -96.7-165.6 163.6 9.9 42.6 121.3 70 66 A Q E +c 45 0A 116 -2,-0.3 2,-0.3 -26,-0.2 -24,-0.2 -0.731 59.8 104.1 -94.0 140.3 13.6 42.6 120.7 71 67 A G - 0 0 20 -26,-2.4 2,-0.3 -2,-0.4 -47,-0.1 -0.918 55.9 -98.5 175.1-179.6 15.6 39.9 119.0 72 68 A T > - 0 0 62 3,-0.4 3,-1.0 -2,-0.3 -27,-0.1 -0.836 21.3-128.5-115.4 156.0 17.3 38.9 115.7 73 69 A A G > S+ 0 0 4 -2,-0.3 3,-0.6 1,-0.2 31,-0.1 0.807 106.8 63.7 -73.0 -28.1 16.1 36.8 112.8 74 70 A E G 3 S+ 0 0 30 1,-0.3 -1,-0.2 30,-0.1 29,-0.0 0.577 117.9 26.6 -72.0 -9.5 19.2 34.5 112.9 75 71 A S G < S- 0 0 78 -3,-1.0 -3,-0.4 26,-0.0 -1,-0.3 -0.443 77.0-175.5-152.4 71.4 18.1 33.4 116.4 76 72 A L < - 0 0 6 -3,-0.6 -3,-0.1 1,-0.1 -5,-0.1 -0.499 21.5-143.4 -76.1 138.8 14.4 33.6 117.1 77 73 A P + 0 0 83 0, 0.0 -1,-0.1 0, 0.0 -6,-0.0 0.793 66.5 103.4 -65.0 -28.7 13.3 32.7 120.6 78 74 A F S S- 0 0 23 1,-0.1 3,-0.1 4,-0.0 2,-0.1 0.012 73.8-102.9 -72.7 162.6 10.2 31.0 119.5 79 75 A P > - 0 0 86 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 -0.305 44.6 -84.8 -74.8 164.7 9.5 27.2 119.4 80 76 A D T 3 S+ 0 0 92 1,-0.2 28,-0.3 2,-0.1 27,-0.1 -0.239 108.1 12.2 -62.8 149.5 9.4 25.1 116.2 81 77 A D T 3 S+ 0 0 92 26,-3.0 -1,-0.2 28,-0.5 28,-0.2 0.896 88.3 127.8 51.6 51.5 6.1 24.9 114.3 82 78 A S < + 0 0 28 26,-2.5 2,-0.3 -3,-0.5 27,-0.2 0.112 48.5 62.8-132.4 26.8 4.5 27.8 116.1 83 79 A F - 0 0 6 25,-0.5 27,-2.8 1,-0.1 -63,-0.2 -0.980 48.6-161.2-145.6 142.0 3.3 30.4 113.5 84 80 A D S S+ 0 0 31 -65,-1.6 30,-2.3 -2,-0.3 2,-0.3 0.791 87.4 20.6 -82.2 -29.0 0.7 30.2 110.7 85 81 A I E -bd 20 114A 0 -66,-1.3 -64,-2.1 28,-0.2 2,-0.4 -0.997 61.1-167.4-141.6 140.9 2.2 33.3 108.9 86 82 A I E -bd 21 115A 0 28,-2.0 30,-2.8 -2,-0.3 2,-0.4 -0.993 9.5-162.0-128.6 128.0 5.5 35.1 109.0 87 83 A T E +bd 22 116A 0 -66,-1.6 -64,-2.7 -2,-0.4 2,-0.3 -0.871 11.8 175.0-106.1 139.7 6.0 38.4 107.4 88 84 A C E -bd 23 117A 3 28,-2.1 30,-2.9 -2,-0.4 2,-0.5 -0.885 11.0-177.4-141.0 115.0 9.4 39.9 106.5 89 85 A R E - d 0 118A 12 -66,-0.5 30,-0.2 -2,-0.3 -59,-0.1 -0.932 62.6 -33.5-127.4 118.5 9.3 43.3 104.7 90 86 A Y S S+ 0 0 13 28,-2.5 29,-0.2 -2,-0.5 -1,-0.1 0.836 113.4 97.6 43.1 37.1 12.3 45.3 103.4 91 87 A A > + 0 0 0 27,-0.5 3,-1.9 -68,-0.1 4,-0.3 0.644 54.2 77.7-120.0 -30.8 14.3 44.0 106.3 92 88 A A G > S+ 0 0 5 26,-0.3 3,-1.5 1,-0.3 53,-0.2 0.771 83.3 65.2 -58.3 -32.1 16.2 41.0 104.9 93 89 A H G 3 S+ 0 0 14 1,-0.3 51,-2.3 51,-0.1 52,-1.6 0.585 103.5 52.8 -71.1 -4.0 18.9 43.1 103.2 94 90 A H G < S+ 0 0 18 -3,-1.9 -1,-0.3 49,-0.2 -2,-0.2 0.509 81.8 107.2 -99.2 -15.4 19.8 44.2 106.7 95 91 A F < - 0 0 17 -3,-1.5 3,-0.3 -4,-0.3 50,-0.1 -0.415 63.6-144.7 -68.7 145.9 20.2 40.7 108.2 96 92 A S S S+ 0 0 102 1,-0.2 -1,-0.1 48,-0.1 2,-0.1 0.619 95.6 24.3 -85.9 -12.9 23.8 39.7 108.9 97 93 A D > + 0 0 72 1,-0.1 4,-2.1 2,-0.0 -1,-0.2 -0.564 63.9 172.1-152.0 82.4 23.2 36.1 108.0 98 94 A V H > S+ 0 0 29 -3,-0.3 4,-2.2 1,-0.2 5,-0.2 0.848 79.0 63.5 -67.1 -35.0 20.2 35.7 105.7 99 95 A R H > S+ 0 0 101 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.954 107.5 41.2 -49.6 -57.5 20.9 32.0 105.3 100 96 A K H > S+ 0 0 59 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.941 109.4 59.5 -59.5 -47.4 20.3 31.3 109.0 101 97 A A H X S+ 0 0 3 -4,-2.1 4,-3.4 1,-0.3 -1,-0.2 0.880 105.8 48.3 -48.9 -43.7 17.3 33.6 109.1 102 98 A V H X S+ 0 0 2 -4,-2.2 4,-3.2 1,-0.2 -1,-0.3 0.931 109.5 53.6 -65.9 -39.7 15.5 31.5 106.5 103 99 A R H X S+ 0 0 116 -4,-1.7 4,-2.7 1,-0.2 -2,-0.2 0.897 111.7 44.7 -61.3 -41.7 16.4 28.4 108.4 104 100 A E H X S+ 0 0 18 -4,-2.8 4,-2.6 2,-0.2 5,-0.3 0.934 110.0 53.7 -68.7 -44.3 14.8 29.9 111.5 105 101 A V H X S+ 0 0 5 -4,-3.4 4,-1.7 -5,-0.2 -2,-0.2 0.950 110.5 50.2 -51.4 -48.7 11.8 31.1 109.5 106 102 A A H >< S+ 0 0 10 -4,-3.2 3,-0.5 1,-0.2 -25,-0.2 0.947 111.5 47.8 -52.0 -55.5 11.6 27.5 108.4 107 103 A R H 3< S+ 0 0 60 -4,-2.7 -26,-3.0 1,-0.2 -2,-0.2 0.924 115.4 39.7 -53.6 -55.8 11.8 26.1 111.9 108 104 A V H 3< S+ 0 0 0 -4,-2.6 -26,-2.5 -28,-0.3 -25,-0.5 0.606 96.6 93.2 -81.5 -13.9 9.3 28.3 113.7 109 105 A L S << S- 0 0 0 -4,-1.7 -28,-0.5 -3,-0.5 -25,-0.2 -0.574 78.0-123.2 -75.1 140.1 6.8 28.3 110.8 110 106 A K > - 0 0 68 -27,-2.8 3,-1.8 -2,-0.2 121,-0.3 -0.308 42.9 -73.7 -72.7 169.3 4.1 25.5 111.0 111 107 A Q T 3 S+ 0 0 78 1,-0.3 121,-0.2 -30,-0.1 -1,-0.1 -0.456 122.9 7.5 -64.5 137.7 3.5 22.9 108.3 112 108 A D T 3 S+ 0 0 70 119,-3.1 -1,-0.3 1,-0.3 2,-0.1 0.588 99.9 142.8 57.1 14.4 1.8 24.5 105.2 113 109 A G < - 0 0 5 -3,-1.8 118,-1.9 118,-0.2 2,-0.4 -0.466 49.2-118.8 -75.2 158.8 2.3 27.8 107.1 114 110 A R E -dE 85 230A 64 -30,-2.3 -28,-2.0 116,-0.2 2,-0.6 -0.834 15.8-157.1-112.2 140.7 3.1 30.7 104.8 115 111 A F E -dE 86 229A 5 114,-3.0 114,-2.0 -2,-0.4 2,-0.9 -0.930 8.7-164.7-116.1 105.7 6.2 33.0 104.7 116 112 A L E -dE 87 228A 0 -30,-2.8 -28,-2.1 -2,-0.6 2,-0.6 -0.835 13.3-179.2 -97.4 104.7 5.5 36.4 103.0 117 113 A L E -dE 88 227A 1 110,-2.2 110,-2.1 -2,-0.9 2,-0.5 -0.924 4.4-178.9-109.5 112.0 8.9 37.9 102.2 118 114 A V E +dE 89 226A 0 -30,-2.9 -28,-2.5 -2,-0.6 -27,-0.5 -0.927 22.9 123.7-108.5 133.4 9.0 41.4 100.6 119 115 A D E - E 0 225A 5 106,-1.0 106,-1.1 -2,-0.5 2,-0.2 -0.966 57.2 -98.0-166.0 169.5 12.2 43.0 99.6 120 116 A H E - E 0 224A 18 -2,-0.3 2,-0.3 104,-0.2 104,-0.2 -0.614 45.7-157.7 -87.1 162.2 14.1 44.6 96.8 121 117 A Y - 0 0 25 102,-1.6 102,-0.3 -2,-0.2 27,-0.2 -0.987 19.1-105.7-148.1 149.2 16.7 42.3 95.1 122 118 A A B -h 148 0B 0 24,-0.7 27,-0.6 25,-0.6 7,-0.1 -0.444 41.9-114.3 -67.3 142.4 19.8 42.2 93.0 123 119 A P - 0 0 20 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 -0.327 31.3-105.2 -69.0 166.1 19.5 41.2 89.4 124 120 A E S S+ 0 0 42 4,-0.1 24,-0.1 -2,-0.1 -2,-0.1 0.842 98.9 90.4 -65.3 -34.9 21.1 37.9 88.3 125 121 A D S > S- 0 0 42 1,-0.2 4,-2.8 116,-0.1 113,-0.1 -0.474 74.4-144.7 -63.5 116.7 23.9 39.7 86.5 126 122 A P H > S+ 0 0 9 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.775 97.3 54.1 -54.4 -28.0 26.7 40.1 89.1 127 123 A V H > S+ 0 0 69 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.954 112.8 41.5 -77.4 -44.9 27.8 43.5 87.7 128 124 A L H > S+ 0 0 13 2,-0.2 4,-2.0 1,-0.2 5,-0.3 0.888 112.2 61.2 -60.4 -35.2 24.3 44.9 88.0 129 125 A D H X S+ 0 0 14 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.971 105.1 43.1 -55.3 -60.6 24.3 43.1 91.3 130 126 A E H X S+ 0 0 85 -4,-2.6 4,-3.7 1,-0.2 5,-0.3 0.884 109.9 61.2 -51.4 -42.2 27.2 45.1 92.7 131 127 A F H X S+ 0 0 22 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.945 109.0 36.9 -54.4 -56.4 25.7 48.2 91.3 132 128 A V H X S+ 0 0 0 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.840 119.1 50.4 -72.2 -30.3 22.5 48.1 93.3 133 129 A N H X S+ 0 0 7 -4,-2.2 4,-2.4 -5,-0.3 3,-0.3 0.941 111.1 47.5 -71.7 -44.3 24.1 46.8 96.4 134 130 A H H X S+ 0 0 82 -4,-3.7 4,-1.7 -5,-0.2 -2,-0.2 0.850 107.1 58.3 -64.9 -32.7 26.9 49.4 96.4 135 131 A L H X S+ 0 0 1 -4,-2.0 4,-1.7 -5,-0.3 -1,-0.2 0.876 112.1 41.8 -64.5 -34.0 24.2 52.2 95.8 136 132 A N H X S+ 0 0 7 -4,-1.2 4,-3.4 -3,-0.3 7,-0.2 0.858 109.0 53.1 -85.9 -36.5 22.5 51.1 99.0 137 133 A R H < S+ 0 0 105 -4,-2.4 6,-0.2 2,-0.2 -2,-0.2 0.909 112.0 51.7 -62.8 -35.6 25.5 50.5 101.3 138 134 A L H < S+ 0 0 7 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.961 116.4 37.1 -62.2 -52.0 26.5 54.0 100.3 139 135 A R H < S+ 0 0 39 -4,-1.7 -2,-0.2 1,-0.3 -3,-0.2 0.978 132.5 25.7 -62.7 -55.9 23.1 55.4 101.2 140 136 A D >< - 0 0 44 -4,-3.4 3,-2.6 1,-0.1 -1,-0.3 -0.874 64.7-162.4-116.2 98.7 22.5 53.2 104.3 141 137 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.585 91.5 65.9 -55.8 -11.2 25.7 51.9 106.0 142 138 A S T 3 S+ 0 0 61 -6,-0.1 2,-0.7 -3,-0.0 -5,-0.1 0.283 73.1 115.5 -88.2 7.6 23.5 49.3 107.7 143 139 A H < + 0 0 6 -3,-2.6 -49,-0.2 -7,-0.2 3,-0.1 -0.703 38.1 176.5 -85.0 115.7 22.8 47.6 104.4 144 140 A V - 0 0 59 -51,-2.3 2,-0.3 -2,-0.7 -50,-0.2 0.986 54.7 -43.1 -82.6 -62.4 24.2 44.1 104.4 145 141 A R - 0 0 69 -52,-1.6 2,-0.8 -53,-0.2 -1,-0.2 -0.906 32.8-140.5-170.3 135.5 23.2 42.5 101.1 146 142 A E - 0 0 2 -2,-0.3 -24,-0.7 -17,-0.1 -13,-0.1 -0.900 36.3-145.8-101.5 101.6 20.2 42.3 98.8 147 143 A S - 0 0 6 -2,-0.8 -25,-0.6 -26,-0.1 2,-0.1 -0.200 15.6-107.9 -64.1 158.5 20.4 38.6 97.6 148 144 A S B > -h 122 0B 3 -27,-0.2 4,-2.1 -24,-0.1 5,-0.1 -0.323 25.4-107.9 -85.5 168.4 19.3 37.6 94.1 149 145 A L H > S+ 0 0 21 -27,-0.6 4,-2.5 2,-0.2 5,-0.2 0.886 121.7 53.2 -71.0 -37.1 16.2 35.6 93.1 150 146 A S H > S+ 0 0 23 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.974 109.9 50.9 -55.2 -50.1 18.3 32.5 92.3 151 147 A E H > S+ 0 0 66 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.878 109.1 49.3 -54.5 -40.7 19.7 32.9 95.8 152 148 A W H X S+ 0 0 8 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.929 112.2 47.9 -68.5 -42.0 16.2 33.1 97.4 153 149 A Q H X S+ 0 0 39 -4,-2.5 4,-3.2 1,-0.2 5,-0.3 0.924 110.1 51.5 -61.9 -45.2 15.0 30.1 95.6 154 150 A A H X S+ 0 0 6 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.862 112.8 46.8 -61.0 -34.4 18.1 28.1 96.5 155 151 A X H X S+ 0 0 7 -4,-1.8 4,-0.8 -5,-0.2 -2,-0.2 0.922 112.6 48.8 -73.9 -43.5 17.6 29.1 100.2 156 152 A F H ><>S+ 0 0 0 -4,-2.8 3,-2.1 1,-0.2 5,-1.7 0.977 113.6 45.5 -58.9 -51.6 14.0 28.2 100.1 157 153 A S H ><5S+ 0 0 2 -4,-3.2 3,-1.1 1,-0.3 -1,-0.2 0.853 107.9 58.8 -63.8 -32.7 14.6 24.9 98.5 158 154 A A H 3<5S+ 0 0 21 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.651 110.9 43.4 -66.4 -16.1 17.4 24.3 101.0 159 155 A N T <<5S- 0 0 19 -3,-2.1 -1,-0.2 -4,-0.8 -2,-0.2 -0.033 118.8 -99.9-123.9 33.8 14.8 24.7 103.8 160 156 A Q T < 5S+ 0 0 54 -3,-1.1 72,-1.7 1,-0.2 2,-0.5 0.901 76.8 145.0 50.3 45.6 11.8 22.7 102.5 161 157 A L E < -F 231 0A 1 -5,-1.7 2,-0.7 70,-0.2 -1,-0.2 -0.978 48.7-138.5-124.0 127.7 10.2 25.9 101.4 162 158 A A E -F 230 0A 16 68,-2.1 68,-1.2 -2,-0.5 2,-0.3 -0.781 25.2-145.6 -92.4 110.8 8.0 26.0 98.3 163 159 A Y E +F 229 0A 32 -2,-0.7 2,-0.3 66,-0.2 66,-0.2 -0.628 23.8 170.4 -91.6 135.8 8.9 29.2 96.5 164 160 A Q E -F 228 0A 104 64,-1.6 64,-3.3 -2,-0.3 2,-0.9 -0.985 28.3-141.9-144.4 127.3 6.4 31.3 94.6 165 161 A D E -F 227 0A 57 -2,-0.3 62,-0.2 62,-0.2 3,-0.2 -0.842 18.4-174.5 -90.4 102.9 7.0 34.7 93.2 166 162 A I E - 0 0 50 60,-2.2 2,-0.2 -2,-0.9 -1,-0.2 0.937 64.2 -24.9 -67.2 -49.4 3.6 36.4 93.8 167 163 A Q E -F 226 0A 78 59,-0.9 59,-0.7 -3,-0.1 -1,-0.2 -0.810 52.1-152.4-168.4 134.2 4.5 39.6 91.9 168 164 A K E +F 225 0A 108 -2,-0.2 57,-0.2 57,-0.2 2,-0.2 -0.258 23.5 164.6 -85.7 179.2 7.5 41.7 90.9 169 165 A W E -F 224 0A 48 55,-1.4 55,-2.4 -2,-0.1 2,-0.2 -0.660 39.7 -99.1 166.2 141.4 7.4 45.5 90.3 170 166 A N E -F 223 0A 74 53,-0.2 53,-0.2 -2,-0.2 37,-0.0 -0.511 30.1-143.1 -74.7 137.4 9.8 48.4 90.0 171 167 A L E -F 222 0A 17 51,-3.6 51,-2.6 -2,-0.2 2,-0.1 -0.898 15.9-144.9-104.4 106.1 10.2 50.5 93.2 172 168 A P E -F 221 0A 89 0, 0.0 2,-0.4 0, 0.0 49,-0.2 -0.493 14.7-167.4 -72.1 144.6 10.5 54.2 92.2 173 169 A I E -F 220 0A 12 47,-2.6 47,-1.5 -2,-0.1 2,-0.9 -0.991 18.2-142.9-129.0 135.1 12.8 56.2 94.3 174 170 A Q E >> -F 219 0A 112 -2,-0.4 4,-2.4 45,-0.2 3,-1.4 -0.885 19.9-148.2 -98.8 101.3 12.9 60.0 94.2 175 171 A Y H 3> S+ 0 0 0 -2,-0.9 4,-2.2 43,-0.9 -1,-0.2 0.779 89.0 54.8 -37.5 -49.1 16.6 60.5 94.6 176 172 A D H 3> S+ 0 0 105 42,-0.7 4,-1.5 2,-0.2 -1,-0.3 0.886 115.1 37.0 -59.2 -43.4 16.3 63.7 96.5 177 173 A S H <> S+ 0 0 40 -3,-1.4 4,-2.9 2,-0.2 5,-0.3 0.916 109.4 61.3 -78.6 -47.4 14.0 62.5 99.2 178 174 A W H X S+ 0 0 9 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.894 106.3 50.3 -39.2 -46.5 15.7 59.1 99.4 179 175 A I H X>S+ 0 0 18 -4,-2.2 4,-0.9 -5,-0.3 5,-0.7 0.964 110.9 47.1 -61.3 -56.6 18.8 61.0 100.4 180 176 A K H ><5S+ 0 0 159 -4,-1.5 3,-1.7 1,-0.2 -2,-0.2 0.948 112.5 48.4 -42.2 -62.7 17.0 63.1 103.1 181 177 A R H 3<5S+ 0 0 159 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.857 112.4 50.9 -54.2 -38.3 15.3 60.1 104.6 182 178 A G H 3<5S- 0 0 29 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.552 97.4-140.4 -79.4 -12.7 18.6 58.2 104.7 183 179 A G T <<5 + 0 0 62 -3,-1.7 -3,-0.2 -4,-0.9 -2,-0.1 0.444 37.1 170.9 73.6 3.1 20.6 61.0 106.4 184 180 A T < - 0 0 18 -5,-0.7 -1,-0.2 -45,-0.1 2,-0.1 0.047 32.9-115.5 -52.5 147.7 23.7 60.5 104.3 185 181 A P > - 0 0 76 0, 0.0 4,-2.8 0, 0.0 5,-0.2 -0.471 25.7-111.9 -73.2 157.9 26.6 63.0 104.4 186 182 A A H > S+ 0 0 72 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.685 116.5 63.2 -67.2 -18.6 27.5 65.1 101.3 187 183 A D H >> S+ 0 0 109 2,-0.2 4,-1.2 3,-0.1 3,-0.8 0.993 109.8 36.2 -60.5 -66.0 30.7 63.1 101.1 188 184 A R H >> S+ 0 0 70 1,-0.3 4,-2.5 2,-0.2 3,-1.6 0.935 112.6 61.1 -54.5 -46.5 28.9 59.8 100.5 189 185 A E H 3X S+ 0 0 44 -4,-2.8 4,-2.6 1,-0.3 -1,-0.3 0.865 100.0 54.3 -50.3 -40.2 26.3 61.6 98.4 190 186 A K H < S+ 0 0 37 -4,-2.6 3,-0.6 1,-0.2 -2,-0.2 0.946 111.1 41.4 -55.1 -55.4 27.9 56.1 90.9 196 192 A L H >< S+ 0 0 2 -4,-2.7 3,-0.8 1,-0.2 -1,-0.2 0.792 113.7 54.9 -63.8 -32.9 24.7 56.9 89.1 197 193 A N H 3< S+ 0 0 47 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.708 110.2 44.6 -73.9 -22.7 26.5 59.1 86.5 198 194 A H T << S+ 0 0 145 -4,-1.7 -1,-0.2 -3,-0.6 -2,-0.2 0.159 81.9 144.7-106.8 17.1 28.8 56.3 85.5 199 195 A A < - 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0 0 1 -5,-1.6 2,-0.4 -6,-0.3 11,-0.2 -0.366 12.5-179.4 -67.1 131.6 15.3 18.4 98.2 445 206 B T E + P 0 454C 0 9,-2.2 8,-3.5 -2,-0.1 9,-1.6 -0.998 7.1 163.6-134.2 129.5 11.7 19.6 98.7 446 207 B L E -IP 233 452C 11 -213,-3.0 -213,-1.9 -2,-0.4 5,-0.1 -0.942 35.8-104.4-140.1 156.1 8.6 17.4 98.2 447 208 B N > - 0 0 34 4,-2.6 3,-1.5 -2,-0.3 -215,-0.1 -0.184 43.1 -99.3 -68.2 173.5 4.9 17.5 99.2 448 209 B Q T 3 S+ 0 0 124 1,-0.3 -1,-0.1 2,-0.1 -214,-0.0 0.674 126.2 62.2 -66.1 -20.9 3.4 15.3 101.9 449 210 B N T 3 S- 0 0 114 2,-0.2 -1,-0.3 1,-0.0 -2,-0.0 0.224 119.4-111.2 -87.1 14.2 2.3 13.1 99.0 450 211 B G S < S+ 0 0 11 -3,-1.5 -18,-0.1 1,-0.2 -2,-0.1 0.293 72.4 140.4 77.2 -13.2 5.9 12.5 97.9 451 212 B Q - 0 0 76 -5,-0.1 -4,-2.6 1,-0.1 -1,-0.2 -0.505 54.9-118.6 -66.0 122.7 5.5 14.6 94.7 452 213 B P E +P 446 0C 5 0, 0.0 -6,-0.3 0, 0.0 -41,-0.1 -0.227 34.7 173.9 -67.3 149.1 8.8 16.6 94.3 453 214 B I E - 0 0 34 -8,-3.5 -43,-2.2 1,-0.3 -42,-0.3 0.715 59.0 -13.3-114.1 -52.0 8.8 20.4 94.2 454 215 B S E +PO 445 409C 5 -9,-1.6 -9,-2.2 -45,-0.2 -1,-0.3 -0.997 51.2 167.8-156.7 152.5 12.4 21.6 94.1 455 216 B F E - 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0 0 115 -72,-3.6 2,-0.2 -2,-0.4 -119,-0.1 -0.058 40.1-108.8-113.0-141.0 50.7 28.3 81.0 468 229 B E 0 0 139 -2,-0.1 -1,-0.2 -122,-0.1 -74,-0.1 -0.639 360.0 360.0-126.9-161.1 53.4 25.7 80.3 469 230 B G 0 0 116 -2,-0.2 -74,-0.0 -75,-0.0 0, 0.0 -0.390 360.0 360.0-132.8 360.0 55.2 23.0 82.2 470 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 471 301 A X 0 0 115 0, 0.0 -441,-0.3 0, 0.0 -445,-0.2 0.000 360.0 360.0 360.0 360.0 9.7 47.4 108.7 472 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 473 302 B X 0 0 108 0, 0.0 -208,-0.7 0, 0.0 -209,-0.2 0.000 360.0 360.0 360.0 360.0 24.7 26.6 76.1