==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 06-DEC-12 4IAJ . COMPND 2 MOLECULE: CONSERVED DOMAIN PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 596 8 4 0 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30900.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 416 69.8 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 . 180 30.2 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 . 8 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.3 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 . 45 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 17.6 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+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 7 0 0 8 0 0 0 0 0 0 0 0 0 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 . 8 4 8 0 8 8 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 . 4 0 8 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 25 A V 0 0 133 0, 0.0 3,-0.1 0, 0.0 49,-0.0 0.000 360.0 360.0 360.0 122.3 21.4 7.2 14.5 2 26 A L + 0 0 163 1,-0.2 2,-0.4 2,-0.0 0, 0.0 0.985 360.0 16.6 -64.2 -60.0 20.3 4.3 16.8 3 27 A N - 0 0 51 1,-0.1 48,-0.3 20,-0.0 19,-0.2 -0.942 65.9-138.0-122.0 141.9 17.5 6.3 18.7 4 28 A X S S+ 0 0 55 18,-1.1 46,-3.3 -2,-0.4 2,-0.4 0.850 93.2 34.3 -65.0 -39.4 15.8 9.5 17.8 5 29 A I E +AB 21 49A 0 16,-2.4 16,-2.7 44,-0.2 2,-0.4 -0.982 63.4 176.0-123.5 127.3 15.9 10.9 21.4 6 30 A E E -AB 20 48A 79 42,-2.1 42,-2.7 -2,-0.4 2,-0.4 -0.999 6.9-175.7-129.1 126.9 18.7 10.3 23.9 7 31 A I E -AB 19 47A 0 12,-2.6 12,-2.5 -2,-0.4 2,-0.5 -0.990 8.1-169.4-127.8 128.1 18.6 12.0 27.3 8 32 A T E +AB 18 46A 11 38,-2.7 37,-2.3 -2,-0.4 38,-1.8 -0.976 18.5 165.9-115.1 130.0 21.2 11.9 30.0 9 33 A Y E -AB 17 44A 31 8,-2.5 8,-2.9 -2,-0.5 2,-0.5 -0.876 36.6-113.3-137.2 167.0 20.4 13.3 33.5 10 34 A I E -A 16 0A 35 33,-2.0 6,-0.2 -2,-0.3 2,-0.1 -0.933 32.0-153.4-107.8 119.3 21.7 13.2 37.0 11 35 A D > - 0 0 6 4,-2.6 3,-2.1 -2,-0.5 4,-0.2 -0.212 37.3 -85.7 -86.4-178.0 19.6 11.4 39.6 12 36 A A T 3 S+ 0 0 37 1,-0.3 -1,-0.1 2,-0.2 350,-0.1 0.675 127.3 58.2 -66.5 -19.6 19.4 12.0 43.4 13 37 A S T 3 S- 0 0 21 2,-0.2 -1,-0.3 333,-0.1 3,-0.1 0.268 119.1-111.7 -87.9 12.5 22.3 9.7 44.0 14 38 A K S < S+ 0 0 173 -3,-2.1 2,-0.4 1,-0.2 -2,-0.2 0.871 73.8 137.0 54.0 43.3 24.4 12.0 41.7 15 39 A N - 0 0 50 -4,-0.2 -4,-2.6 2,-0.0 2,-0.3 -0.934 57.7-115.8-114.0 145.5 24.7 9.3 39.1 16 40 A E E -A 10 0A 120 -2,-0.4 2,-0.4 -6,-0.2 -6,-0.2 -0.611 32.9-173.8 -76.9 131.4 24.3 9.8 35.4 17 41 A R E -A 9 0A 71 -8,-2.9 -8,-2.5 -2,-0.3 2,-0.4 -0.986 7.3-158.0-127.5 140.4 21.4 7.9 33.8 18 42 A T E -A 8 0A 77 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.961 9.3-178.4-121.8 131.9 20.6 7.7 30.1 19 43 A V E -A 7 0A 43 -12,-2.5 -12,-2.6 -2,-0.4 2,-0.3 -0.942 9.1-159.1-124.1 151.2 17.2 7.0 28.6 20 44 A T E -A 6 0A 60 -2,-0.3 2,-0.4 -14,-0.2 -14,-0.2 -0.951 10.1-159.3-131.0 150.5 16.3 6.6 24.9 21 45 A F E -A 5 0A 30 -16,-2.7 -16,-2.4 -2,-0.3 -17,-0.3 -0.998 11.8-151.9-127.4 128.7 13.3 6.8 22.7 22 46 A E S S+ 0 0 129 -2,-0.4 -18,-1.1 -19,-0.2 2,-0.3 0.910 82.9 15.4 -63.9 -42.0 13.2 5.3 19.3 23 47 A S S > S- 0 0 23 -20,-0.1 4,-1.5 -19,-0.1 5,-0.1 -0.853 74.9-116.2-127.7 163.6 10.7 7.8 18.0 24 48 A Y H > S+ 0 0 33 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.897 118.4 57.4 -60.5 -39.6 9.3 11.2 19.0 25 49 A E H > S+ 0 0 91 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.849 102.5 53.7 -64.1 -33.8 5.9 9.4 19.4 26 50 A D H > S+ 0 0 55 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.897 109.6 49.2 -61.3 -42.1 7.5 7.0 21.9 27 51 A F H X S+ 0 0 0 -4,-1.5 4,-1.4 2,-0.2 -2,-0.2 0.915 111.4 48.4 -64.0 -44.4 8.6 10.1 23.9 28 52 A E H X S+ 0 0 20 -4,-2.6 4,-1.9 1,-0.2 3,-0.2 0.904 109.0 52.9 -62.1 -45.6 5.2 11.7 23.8 29 53 A R H X S+ 0 0 137 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.841 107.2 52.7 -58.9 -35.6 3.5 8.4 24.9 30 54 A S H X S+ 0 0 30 -4,-1.6 4,-0.9 2,-0.2 -1,-0.2 0.808 108.8 49.8 -72.2 -29.6 5.8 8.3 27.9 31 55 A Q H < S+ 0 0 37 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.806 112.7 47.1 -76.1 -30.7 4.9 11.9 28.9 32 56 A Q H < S+ 0 0 70 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.790 107.1 59.9 -73.2 -27.3 1.2 11.0 28.6 33 57 A A H < S+ 0 0 44 -4,-1.4 83,-2.4 -5,-0.2 84,-0.5 0.801 94.5 67.6 -78.6 -29.7 1.6 7.8 30.6 34 58 A a E < -D 115 0B 22 -4,-0.9 81,-0.3 81,-0.3 3,-0.2 -0.788 54.0-163.5 -97.6 131.1 3.0 9.3 33.9 35 59 A L E S+ 0 0 35 79,-2.2 2,-0.4 -2,-0.5 80,-0.2 0.931 99.1 4.8 -65.9 -47.4 1.0 11.5 36.3 36 60 A I E S-D 114 0B 18 78,-1.6 77,-2.5 -3,-0.1 78,-1.5 -0.990 82.9-135.9-134.8 128.7 4.5 12.4 37.6 37 61 A G E > -D 112 0B 7 -2,-0.4 3,-1.4 75,-0.3 75,-0.3 -0.643 16.4-129.3 -81.5 140.7 7.7 11.1 36.0 38 62 A V T 3 S+ 0 0 35 73,-2.9 3,-0.4 -2,-0.3 74,-0.1 0.886 109.2 41.1 -53.5 -38.4 10.4 9.8 38.4 39 63 A A T > S+ 0 0 7 72,-0.5 3,-2.3 1,-0.2 21,-0.5 0.351 78.4 112.9 -94.7 4.7 13.0 12.0 36.6 40 64 A D T < S+ 0 0 29 -3,-1.4 21,-2.5 1,-0.3 22,-0.3 0.725 82.6 40.8 -57.8 -32.2 11.0 15.2 36.1 41 65 A Y T 3 S+ 0 0 81 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.276 90.9 113.2 -99.2 7.6 13.0 17.4 38.5 42 66 A Y S < S- 0 0 23 -3,-2.3 18,-2.4 1,-0.1 2,-0.2 -0.604 71.5-113.8 -84.7 139.2 16.4 16.0 37.5 43 67 A P B -E 59 0C 43 0, 0.0 -33,-2.0 0, 0.0 2,-0.5 -0.490 28.5-127.4 -71.3 141.3 18.9 18.2 35.7 44 68 A V E -B 9 0A 17 14,-2.3 14,-0.4 -35,-0.2 -35,-0.3 -0.795 22.9-176.7 -95.6 122.9 19.7 17.2 32.1 45 69 A Q E S+ 0 0 107 -37,-2.3 2,-0.3 -2,-0.5 -36,-0.2 0.798 74.1 7.3 -85.3 -34.4 23.4 16.7 31.2 46 70 A K E -B 8 0A 94 -38,-1.8 -38,-2.7 9,-0.0 2,-0.4 -0.971 53.8-170.3-153.6 137.5 22.7 16.0 27.5 47 71 A L E -B 7 0A 1 7,-0.5 7,-3.0 -2,-0.3 2,-0.5 -0.994 13.4-174.8-126.2 120.0 19.8 16.1 25.1 48 72 A T E -BC 6 53A 17 -42,-2.7 -42,-2.1 -2,-0.4 2,-0.5 -0.973 5.5-171.0-121.4 125.5 20.3 14.6 21.6 49 73 A Y E > S-BC 5 52A 18 3,-2.7 3,-2.3 -2,-0.5 -44,-0.2 -0.972 77.0 -20.6-117.9 119.9 17.7 14.7 18.9 50 74 A K T 3 S- 0 0 57 -46,-3.3 -1,-0.1 -2,-0.5 -46,-0.1 0.851 130.1 -49.7 49.9 38.4 18.3 12.6 15.7 51 75 A G T 3 S+ 0 0 48 -48,-0.3 2,-0.5 -47,-0.3 -1,-0.3 0.358 114.8 119.7 88.7 -6.3 22.1 12.6 16.6 52 76 A H E < -C 49 0A 81 -3,-2.3 -3,-2.7 23,-0.1 2,-0.5 -0.833 64.1-130.8 -99.6 124.6 22.2 16.3 17.1 53 77 A N E -C 48 0A 94 -2,-0.5 -5,-0.2 -5,-0.2 2,-0.2 -0.592 24.1-150.1 -70.7 118.0 23.2 17.7 20.5 54 78 A L - 0 0 4 -7,-3.0 2,-1.9 -2,-0.5 -7,-0.5 -0.543 23.0-116.0 -87.6 157.3 20.6 20.3 21.4 55 79 A D + 0 0 123 -2,-0.2 2,-0.5 -9,-0.1 -1,-0.1 -0.342 53.8 172.6 -92.7 61.4 21.9 23.2 23.6 56 80 A Y + 0 0 17 -2,-1.9 2,-0.5 -9,-0.2 -9,-0.1 -0.620 21.0 173.5 -93.5 123.9 19.6 22.1 26.4 57 81 A H + 0 0 112 -2,-0.5 2,-0.3 -11,-0.0 -12,-0.1 -0.953 47.0 61.9-118.9 104.4 19.8 23.7 29.8 58 82 A G S S- 0 0 2 -2,-0.5 -14,-2.3 -14,-0.4 2,-0.2 -0.993 79.4 -50.7 169.3-172.3 16.9 22.5 32.1 59 83 A T B >> -E 43 0C 5 -2,-0.3 3,-0.8 -16,-0.2 4,-0.5 -0.485 46.9-112.5 -87.7 162.3 15.2 19.8 33.9 60 84 A Y G >4 S+ 0 0 20 -18,-2.4 3,-1.4 -21,-0.5 4,-0.4 0.896 115.5 57.9 -58.5 -44.5 14.0 16.5 32.5 61 85 A G G 34 S+ 0 0 14 -21,-2.5 4,-0.3 -22,-0.3 -1,-0.2 0.697 102.1 54.0 -61.6 -24.3 10.3 17.5 32.9 62 86 A D G <> S+ 0 0 39 -3,-0.8 4,-2.3 -22,-0.3 -1,-0.2 0.557 84.2 86.2 -87.9 -9.6 10.7 20.6 30.8 63 87 A I H S+ 0 0 5 -4,-0.4 4,-1.5 1,-0.2 -1,-0.2 0.909 112.2 40.2 -53.4 -47.9 8.7 18.0 26.4 65 89 A F H > S+ 0 0 25 -4,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.879 112.8 55.5 -71.9 -38.7 7.7 21.6 26.2 66 90 A Y H >X S+ 0 0 60 -4,-2.3 4,-1.1 1,-0.2 3,-0.6 0.950 109.1 46.6 -55.5 -52.7 11.1 22.7 25.0 67 91 A L H 3< S+ 0 0 2 -4,-2.8 3,-0.3 1,-0.2 -1,-0.2 0.850 108.6 56.4 -60.7 -37.0 11.0 20.4 22.0 68 92 A X H 3< S+ 0 0 48 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.782 108.4 47.1 -68.1 -27.3 7.4 21.4 21.2 69 93 A K H << S+ 0 0 114 -4,-1.3 2,-0.2 -3,-0.6 -1,-0.2 0.665 98.7 87.1 -88.3 -17.2 8.4 25.1 20.9 70 94 A Q S < S- 0 0 81 -4,-1.1 2,-0.9 -3,-0.3 3,-0.0 -0.573 78.6-128.3 -79.6 143.3 11.5 24.4 18.7 71 95 A D + 0 0 112 -2,-0.2 3,-0.4 1,-0.1 -3,-0.1 -0.849 32.4 178.4 -78.1 107.8 11.4 24.2 15.0 72 96 A L > + 0 0 23 -2,-0.9 3,-1.8 1,-0.2 -1,-0.1 0.348 51.5 99.9 -96.0 4.2 13.2 20.8 14.7 73 97 A S G > + 0 0 62 1,-0.3 3,-2.0 2,-0.2 -1,-0.2 0.796 69.0 68.8 -66.7 -28.6 13.0 20.5 10.9 74 98 A Q G 3 S+ 0 0 137 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.708 96.8 57.4 -60.0 -19.5 16.6 21.7 10.5 75 99 A Y G < 0 0 49 -3,-1.8 -1,-0.3 -23,-0.0 -2,-0.2 0.402 360.0 360.0 -94.2 1.5 17.5 18.3 12.1 76 100 A N < 0 0 155 -3,-2.0 -3,-0.0 -4,-0.1 -26,-0.0 -0.511 360.0 360.0 -74.4 360.0 15.7 16.2 9.5 77 !* 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 78 24 B G 0 0 139 0, 0.0 2,-0.4 0, 0.0 51,-0.0 0.000 360.0 360.0 360.0 -48.4 2.6 -13.5 15.0 79 25 B V - 0 0 72 1,-0.1 3,-0.1 49,-0.0 49,-0.0 -0.912 360.0-144.8-110.7 134.1 1.5 -10.7 17.2 80 26 B L S S+ 0 0 156 -2,-0.4 2,-0.5 1,-0.2 -1,-0.1 0.940 88.0 34.7 -63.3 -47.1 2.6 -7.1 16.7 81 27 B N - 0 0 23 1,-0.1 48,-0.4 20,-0.0 19,-0.2 -0.931 62.2-154.7-116.8 126.2 2.7 -6.2 20.5 82 28 B X S S+ 0 0 62 18,-1.3 46,-3.4 -2,-0.5 2,-0.4 0.848 88.4 35.8 -61.5 -35.3 3.6 -8.6 23.3 83 29 B I E +FG 99 127D 0 16,-2.2 16,-3.1 44,-0.2 2,-0.4 -0.987 60.7 170.1-127.3 127.3 1.5 -6.5 25.7 84 30 B E E -FG 98 126D 55 42,-1.9 42,-2.8 -2,-0.4 2,-0.4 -0.998 10.7-171.8-129.1 133.2 -1.8 -4.7 25.1 85 31 B I E -FG 97 125D 0 12,-2.9 12,-2.5 -2,-0.4 2,-0.5 -0.993 5.7-169.2-129.8 127.5 -3.8 -3.2 28.0 86 32 B T E +FG 96 124D 4 38,-2.9 37,-2.5 -2,-0.4 38,-1.9 -0.965 16.7 167.6-117.1 131.4 -7.3 -1.8 27.8 87 33 B Y E -FG 95 122D 27 8,-2.5 8,-2.9 -2,-0.5 2,-0.5 -0.884 34.4-116.5-137.8 166.6 -8.7 0.1 30.8 88 34 B I E -F 94 0D 37 33,-1.7 6,-0.2 -2,-0.3 2,-0.0 -0.947 30.7-154.1-110.5 122.8 -11.6 2.4 31.7 89 35 B D > - 0 0 5 4,-2.4 3,-2.1 -2,-0.5 28,-0.0 -0.172 37.5 -86.8 -89.9-175.3 -10.7 5.9 32.7 90 36 B A T 3 S+ 0 0 35 1,-0.3 -1,-0.1 2,-0.2 420,-0.1 0.645 127.6 59.8 -72.1 -14.0 -12.7 8.4 34.9 91 37 B S T 3 S- 0 0 21 2,-0.2 -1,-0.3 403,-0.1 3,-0.1 0.374 118.1-115.0 -86.4 2.3 -14.7 9.6 31.9 92 38 B K S < S+ 0 0 168 -3,-2.1 2,-0.3 1,-0.3 -2,-0.2 0.754 72.9 135.1 65.0 30.8 -15.8 6.0 31.5 93 39 B N - 0 0 51 416,-0.0 -4,-2.4 0, 0.0 2,-0.3 -0.843 58.9-113.8-108.0 145.1 -14.0 5.7 28.2 94 40 B E E -F 88 0D 111 -2,-0.3 2,-0.4 -6,-0.2 -6,-0.2 -0.598 31.1-171.0 -77.8 132.3 -11.9 2.7 27.1 95 41 B R E -F 87 0D 67 -8,-2.9 -8,-2.5 -2,-0.3 2,-0.4 -0.981 4.9-159.1-120.8 138.8 -8.2 3.5 26.6 96 42 B T E -F 86 0D 80 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.975 9.1-178.8-121.1 129.5 -5.7 1.1 25.1 97 43 B V E -F 85 0D 44 -12,-2.5 -12,-2.9 -2,-0.4 2,-0.3 -0.932 9.9-160.0-119.6 150.5 -1.9 1.2 25.5 98 44 B T E -F 84 0D 62 -2,-0.3 2,-0.4 -14,-0.2 -14,-0.2 -0.940 10.3-158.5-131.3 151.2 0.5 -1.2 23.9 99 45 B F E -F 83 0D 26 -16,-3.1 -16,-2.2 -2,-0.3 -17,-0.2 -1.000 11.6-152.1-130.6 128.5 4.1 -2.4 24.6 100 46 B E S S+ 0 0 129 -2,-0.4 -18,-1.3 -19,-0.2 2,-0.3 0.902 83.8 15.8 -67.0 -40.8 6.2 -3.9 21.8 101 47 B S S > S- 0 0 34 -20,-0.1 4,-1.5 -19,-0.1 3,-0.1 -0.867 75.7-115.5-128.4 164.9 8.2 -5.9 24.3 102 48 B Y H > S+ 0 0 43 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.889 119.1 56.5 -60.8 -42.6 8.0 -6.9 28.0 103 49 B E H > S+ 0 0 41 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.820 101.6 56.2 -57.1 -36.0 11.1 -4.8 28.6 104 50 B D H > S+ 0 0 44 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.913 109.2 47.2 -64.3 -38.6 9.2 -1.8 27.2 105 51 B F H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.945 112.1 48.6 -66.3 -47.8 6.5 -2.4 29.8 106 52 B E H X S+ 0 0 55 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.910 109.6 53.1 -58.5 -45.5 9.0 -2.8 32.6 107 53 B R H X S+ 0 0 144 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.892 108.0 51.2 -54.1 -44.8 10.8 0.4 31.5 108 54 B S H X S+ 0 0 26 -4,-1.9 4,-1.3 1,-0.2 -2,-0.2 0.869 108.1 52.0 -64.8 -35.8 7.4 2.3 31.6 109 55 B Q H < S+ 0 0 38 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.898 112.4 45.5 -68.2 -36.1 6.8 1.0 35.2 110 56 B Q H < S+ 0 0 60 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.809 107.9 58.9 -73.0 -29.0 10.2 2.3 36.3 111 57 B A H < S+ 0 0 47 -4,-1.8 -73,-2.9 -5,-0.2 -72,-0.5 0.810 94.4 71.4 -77.4 -27.9 9.8 5.7 34.5 112 58 B a E < -D 37 0B 22 -4,-1.3 -75,-0.3 -75,-0.3 3,-0.2 -0.734 54.5-165.3 -94.6 130.0 6.6 6.8 36.4 113 59 B L E S+ 0 0 34 -77,-2.5 2,-0.3 -2,-0.4 -76,-0.2 0.914 97.6 0.5 -64.9 -49.0 6.6 7.9 40.0 114 60 B I E S-D 36 0B 18 -78,-1.5 -79,-2.2 -3,-0.1 -78,-1.6 -0.978 82.4-136.5-138.3 131.0 2.8 7.5 39.6 115 61 B G E > -D 34 0B 6 -2,-0.3 3,-1.2 -81,-0.3 -81,-0.3 -0.631 17.3-126.6 -86.8 144.9 1.2 6.4 36.3 116 62 B V T 3 S+ 0 0 31 -83,-2.4 3,-0.4 -2,-0.3 -82,-0.1 0.879 109.1 41.2 -52.9 -43.8 -1.9 8.2 35.2 117 63 B A T > S+ 0 0 6 -84,-0.5 3,-2.6 1,-0.2 21,-0.6 0.386 78.7 114.6 -90.5 1.9 -3.9 5.0 34.8 118 64 B D T < S+ 0 0 27 -3,-1.2 21,-2.0 1,-0.3 22,-0.3 0.701 81.5 40.2 -54.0 -32.3 -2.7 3.2 38.0 119 65 B Y T 3 S+ 0 0 81 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.249 92.3 110.4 -99.2 13.8 -6.1 3.1 39.8 120 66 B Y S < S- 0 0 23 -3,-2.6 18,-2.1 1,-0.1 19,-0.2 -0.699 73.4-112.6 -92.7 141.0 -8.1 2.3 36.7 121 67 B P B -I 137 0E 47 0, 0.0 -33,-1.7 0, 0.0 2,-0.5 -0.439 29.3-123.7 -67.9 142.3 -9.8 -1.1 36.3 122 68 B V E -G 87 0D 17 14,-2.5 14,-0.3 -35,-0.2 -35,-0.3 -0.759 25.2-178.2 -91.8 124.5 -8.4 -3.2 33.5 123 69 B Q E S+ 0 0 104 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36.9 143 89 B F H > S+ 0 0 29 -4,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.909 113.5 54.7 -72.1 -42.4 3.3 -7.5 40.1 144 90 B Y H >X S+ 0 0 58 -4,-2.2 4,-1.2 1,-0.2 3,-0.8 0.938 110.2 46.0 -50.8 -53.8 0.6 -10.0 38.7 145 91 B L H 3< S+ 0 0 3 -4,-2.8 3,-0.4 1,-0.2 -1,-0.2 0.873 107.8 57.5 -61.7 -38.1 2.7 -10.7 35.6 146 92 B X H 3< S+ 0 0 56 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.749 110.3 43.9 -64.8 -27.2 5.9 -11.2 37.6 147 93 B K H << S+ 0 0 141 -4,-1.2 -1,-0.2 -3,-0.8 -2,-0.2 0.618 95.9 94.5 -94.0 -19.3 4.3 -13.9 39.7 148 94 B Q S < S- 0 0 80 -4,-1.2 2,-1.0 -3,-0.4 3,-0.0 -0.478 78.2-125.7 -71.6 143.5 2.6 -15.7 36.7 149 95 B D + 0 0 108 -2,-0.2 3,-0.5 1,-0.1 -1,-0.1 -0.839 33.7 175.9 -83.5 103.1 4.3 -18.7 35.0 150 96 B L > + 0 0 23 -2,-1.0 3,-2.1 1,-0.2 -1,-0.1 0.390 50.7 101.5 -92.1 2.5 4.2 -17.3 31.5 151 97 B S G > + 0 0 69 1,-0.3 3,-2.1 2,-0.2 -1,-0.2 0.769 69.0 69.6 -58.7 -26.0 6.1 -20.2 30.0 152 98 B Q G 3 S+ 0 0 147 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.687 101.7 45.2 -70.3 -14.9 2.9 -21.7 28.7 153 99 B Y G < 0 0 43 -3,-2.1 -1,-0.3 -23,-0.0 -2,-0.2 0.318 360.0 360.0 -98.3 8.0 2.7 -18.8 26.2 154 100 B N < 0 0 166 -3,-2.1 -2,-0.2 -4,-0.1 -3,-0.2 0.797 360.0 360.0 80.7 360.0 6.5 -19.6 25.6 155 !* 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 0.0 156 26 C L 0 0 149 0, 0.0 2,-0.4 0, 0.0 48,-0.0 0.000 360.0 360.0 360.0 111.1 2.2 29.0 76.1 157 27 C N - 0 0 62 1,-0.1 48,-0.3 46,-0.0 19,-0.2 -0.644 360.0-158.9 -81.4 126.6 2.9 26.6 73.2 158 28 C X S S+ 0 0 58 17,-0.6 46,-2.7 -2,-0.4 2,-0.4 0.850 79.3 36.2 -69.6 -36.1 3.7 23.1 74.1 159 29 C I E +JK 175 203F 1 16,-2.3 16,-2.4 44,-0.2 2,-0.4 -0.984 61.1 177.3-126.6 129.1 5.5 22.2 70.8 160 30 C E E -JK 174 202F 80 42,-2.1 42,-2.7 -2,-0.4 2,-0.4 -1.000 6.2-173.3-128.9 130.5 7.7 24.5 68.7 161 31 C I E -JK 173 201F 0 12,-2.9 12,-2.6 -2,-0.4 2,-0.5 -0.993 5.4-169.6-129.0 125.1 9.4 23.3 65.6 162 32 C T E +JK 172 200F 21 38,-2.6 37,-2.9 -2,-0.4 38,-1.8 -0.966 17.5 165.9-111.9 130.1 12.0 25.2 63.6 163 33 C Y E -JK 171 198F 31 8,-2.5 8,-3.0 -2,-0.5 2,-0.6 -0.898 35.6-115.2-137.7 164.9 13.0 23.8 60.2 164 34 C I E -J 170 0F 33 33,-1.8 6,-0.2 -2,-0.3 -2,-0.0 -0.917 31.2-152.1-106.9 124.8 14.8 25.1 57.1 165 35 C D > - 0 0 6 4,-2.7 3,-2.1 -2,-0.6 4,-0.1 -0.150 36.5 -86.4 -88.7-175.1 12.8 25.3 53.9 166 36 C A T 3 S+ 0 0 29 1,-0.3 -1,-0.1 2,-0.2 122,-0.1 0.602 127.0 60.1 -74.2 -9.9 13.9 25.1 50.3 167 37 C S T 3 S- 0 0 18 2,-0.2 -1,-0.3 105,-0.1 3,-0.1 0.322 118.5-113.1 -88.8 4.6 14.7 28.8 50.2 168 38 C K S < S+ 0 0 169 -3,-2.1 2,-0.4 1,-0.3 -2,-0.2 0.788 74.3 136.4 64.8 29.1 17.2 28.1 53.0 169 39 C N - 0 0 51 -4,-0.1 -4,-2.7 0, 0.0 2,-0.3 -0.895 58.4-118.4-105.6 140.7 15.1 30.2 55.4 170 40 C E E -J 164 0F 132 -2,-0.4 2,-0.4 -6,-0.2 -6,-0.2 -0.561 32.7-173.0 -72.9 132.1 14.3 29.2 59.0 171 41 C R E -J 163 0F 71 -8,-3.0 -8,-2.5 -2,-0.3 2,-0.4 -0.970 7.4-155.5-127.6 144.6 10.5 28.7 59.6 172 42 C T E -J 162 0F 85 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.985 9.6-177.1-125.4 130.0 8.9 28.1 63.0 173 43 C V E -J 161 0F 44 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> S+ 0 0 7 367,-0.5 3,-2.5 1,-0.2 21,-0.5 0.381 78.3 114.6 -95.7 4.2 7.4 20.7 55.3 194 64 C D T < S+ 0 0 29 -3,-1.4 21,-2.4 1,-0.3 22,-0.3 0.740 81.9 40.7 -55.2 -32.3 7.7 16.9 55.6 195 65 C Y T 3 S+ 0 0 76 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.1 0.319 91.0 111.3 -96.7 9.1 11.1 16.6 53.9 196 66 C Y S < S- 0 0 25 -3,-2.5 18,-2.2 1,-0.1 19,-0.2 -0.633 72.8-110.6 -88.9 141.7 12.7 19.6 55.6 197 67 C P B -N 213 0H 38 0, 0.0 -33,-1.8 0, 0.0 2,-0.4 -0.412 29.6-126.5 -67.8 137.3 15.6 19.3 58.2 198 68 C V E -K 163 0F 13 14,-2.5 14,-0.3 -35,-0.2 -35,-0.3 -0.740 23.6-177.0 -89.5 128.3 14.6 20.2 61.7 199 69 C Q E S+ 0 0 100 -37,-2.9 2,-0.3 -2,-0.4 -36,-0.2 0.767 73.9 5.7 -90.2 -32.8 16.9 22.8 63.4 200 70 C K E -K 162 0F 102 -38,-1.8 -38,-2.6 2,-0.0 2,-0.5 -0.961 54.5-169.6-155.4 133.7 15.1 22.7 66.8 201 71 C L E -K 161 0F 3 7,-0.5 7,-3.0 -2,-0.3 2,-0.4 -0.988 16.9-175.1-125.2 117.7 12.4 20.7 68.4 202 72 C T E -KL 160 207F 11 -42,-2.7 -42,-2.1 -2,-0.5 2,-0.4 -0.943 8.8-174.6-119.3 134.3 11.1 22.0 71.7 203 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213 83 C T B > -N 197 0H 6 -2,-0.3 3,-0.5 -16,-0.2 4,-0.4 -0.412 45.9-114.1 -84.3 163.2 13.1 15.6 59.1 214 84 C Y G > S+ 0 0 18 -18,-2.2 3,-1.9 -21,-0.5 4,-0.4 0.939 115.8 57.2 -58.5 -46.2 9.9 17.4 59.9 215 85 C G G 3 S+ 0 0 15 -21,-2.4 4,-0.3 -22,-0.3 3,-0.3 0.717 102.6 54.7 -62.6 -22.7 7.9 14.3 58.7 216 86 C D G <> S+ 0 0 37 -3,-0.5 4,-2.0 -22,-0.3 -1,-0.3 0.530 83.4 87.2 -88.0 -4.7 9.7 12.0 61.1 217 87 C I H <> S+ 0 0 0 -3,-1.9 4,-2.9 -4,-0.4 5,-0.2 0.891 83.0 57.3 -61.2 -41.2 8.8 14.0 64.2 218 88 C F H > S+ 0 0 4 -4,-0.4 4,-1.5 -3,-0.3 -1,-0.2 0.915 110.7 41.6 -57.2 -47.6 5.5 12.3 64.7 219 89 C F H > S+ 0 0 26 -4,-0.3 4,-0.6 2,-0.2 -1,-0.2 0.857 114.9 52.5 -72.1 -33.7 7.0 8.8 64.9 220 90 C Y H >X S+ 0 0 48 -4,-2.0 3,-1.2 1,-0.2 4,-0.6 0.942 108.5 49.2 -63.2 -48.5 9.9 10.1 67.1 221 91 C L H >< S+ 0 0 3 -4,-2.9 3,-0.8 1,-0.3 5,-0.2 0.835 105.0 59.5 -64.9 -33.8 7.6 11.7 69.6 222 92 C X H 3< S+ 0 0 53 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.682 105.8 48.1 -66.3 -22.4 5.5 8.6 69.9 223 93 C K H 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H <> S+ 0 0 0 -3,-1.8 4,-3.2 -4,-0.4 5,-0.2 0.916 81.6 57.8 -62.0 -43.9 4.0 33.7 47.7 294 88 D F H > S+ 0 0 7 -4,-0.4 4,-2.4 -3,-0.3 -1,-0.2 0.945 111.3 39.7 -56.3 -54.9 0.2 33.3 47.7 295 89 D F H > S+ 0 0 33 -4,-0.3 4,-1.2 1,-0.2 -1,-0.2 0.892 114.8 55.0 -62.4 -39.1 -0.2 33.5 51.5 296 90 D Y H X S+ 0 0 43 -4,-2.1 4,-1.2 1,-0.2 3,-0.5 0.924 110.0 45.9 -57.0 -46.6 2.5 36.2 51.6 297 91 D L H < S+ 0 0 3 -4,-3.2 3,-0.4 1,-0.2 -2,-0.2 0.916 107.8 57.3 -65.8 -43.3 0.6 38.4 49.1 298 92 D X H < S+ 0 0 52 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.750 107.9 47.7 -55.7 -30.5 -2.8 37.8 50.9 299 93 D K H < S+ 0 0 150 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.745 96.8 86.3 -85.9 -26.8 -1.4 39.2 54.2 300 94 D Q S < S- 0 0 60 -4,-1.2 2,-0.9 -3,-0.4 3,-0.1 -0.465 84.0-119.1 -73.0 145.0 0.3 42.4 52.6 301 95 D D - 0 0 98 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.1 -0.783 34.1-176.5 -76.6 109.0 -1.6 45.6 52.1 302 96 D L > + 0 0 27 -2,-0.9 2,-2.1 1,-0.2 3,-0.6 0.694 58.9 88.2 -88.9 -21.9 -1.3 45.8 48.3 303 97 D S T 3 S+ 0 0 100 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 -0.546 72.3 74.3 -78.4 74.6 -3.0 49.2 47.8 304 98 D Q T 3 0 0 123 -2,-2.1 -1,-0.2 0, 0.0 -2,-0.1 0.074 360.0 360.0-162.3 25.3 0.2 51.2 48.3 305 99 D Y < 0 0 96 -3,-0.6 -25,-0.1 -23,-0.0 -24,-0.1 -0.581 360.0 360.0-141.2 360.0 1.9 50.4 45.0 306 !* 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 0.0 307 27 E N 0 0 107 0, 0.0 48,-0.4 0, 0.0 19,-0.2 0.000 360.0 360.0 360.0 109.5 17.9 -10.4 57.9 308 28 E X + 0 0 52 18,-0.8 46,-3.0 1,-0.2 2,-0.4 0.813 360.0 33.8 -65.9 -36.6 18.1 -11.2 54.2 309 29 E I E +TU 325 353L 0 16,-2.3 16,-2.6 44,-0.2 2,-0.4 -0.988 62.4 174.4-125.4 128.0 18.0 -7.6 53.0 310 30 E E E -TU 324 352L 71 42,-1.9 42,-2.6 -2,-0.4 2,-0.4 -0.999 8.2-172.5-128.9 131.4 19.5 -4.6 54.8 311 31 E I E -TU 323 351L 0 12,-3.2 12,-2.8 -2,-0.4 2,-0.4 -0.988 6.1-168.4-130.2 128.2 19.5 -1.1 53.2 312 32 E T E +TU 322 350L 10 38,-2.9 37,-2.9 -2,-0.4 38,-1.8 -0.958 17.3 164.7-118.2 131.3 21.1 2.0 54.5 313 33 E Y E -TU 321 348L 32 8,-2.7 8,-2.7 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