==== 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 20-OCT-06 2NLV . COMPND 2 MOLECULE: XISI PROTEIN-LIKE; . SOURCE 2 ORGANISM_SCIENTIFIC: ANABAENA VARIABILIS; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 221 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11245.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 77.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 58 26.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 4 1.8 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 . 26 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 49 22.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 0 2 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 2 0 2 0 2 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 1 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 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 0 A G > 0 0 84 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-161.0 32.3 12.9 -3.5 2 1 A X H > + 0 0 137 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.884 360.0 53.7 -67.5 -38.2 33.3 15.2 -0.7 3 2 A D H > S+ 0 0 145 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.911 111.6 47.5 -61.4 -38.9 29.9 15.7 0.9 4 3 A K H > S+ 0 0 102 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.913 110.8 50.8 -68.7 -40.2 29.5 11.9 1.1 5 4 A L H X S+ 0 0 39 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.955 113.3 44.8 -62.3 -49.9 32.9 11.4 2.6 6 5 A V H X S+ 0 0 62 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.898 110.8 54.8 -65.9 -37.3 32.4 14.0 5.3 7 6 A K H X S+ 0 0 120 -4,-2.4 4,-2.3 -5,-0.3 -1,-0.2 0.948 111.8 43.6 -53.8 -51.4 28.9 12.6 6.0 8 7 A Y H X S+ 0 0 5 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.884 110.9 54.5 -65.3 -41.8 30.4 9.2 6.6 9 8 A Q H X S+ 0 0 25 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.938 111.1 46.4 -53.9 -50.8 33.3 10.5 8.6 10 9 A E H X S+ 0 0 113 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.924 112.2 49.2 -61.3 -44.7 30.8 12.3 10.9 11 10 A L H X S+ 0 0 27 -4,-2.3 4,-2.5 -5,-0.2 5,-0.2 0.919 111.9 48.5 -62.1 -42.9 28.5 9.4 11.3 12 11 A V H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.942 113.1 47.3 -64.7 -44.3 31.4 7.0 12.1 13 12 A K H X S+ 0 0 48 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.917 112.4 49.8 -64.6 -36.9 32.8 9.4 14.7 14 13 A K H X S+ 0 0 84 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.926 113.2 45.9 -66.4 -47.5 29.4 9.9 16.3 15 14 A L H X S+ 0 0 14 -4,-2.5 4,-3.3 -5,-0.2 -2,-0.2 0.962 114.3 47.5 -58.3 -52.9 28.7 6.2 16.5 16 15 A L H X S+ 0 0 0 -4,-2.7 4,-2.9 -5,-0.2 5,-0.2 0.913 112.5 48.7 -58.2 -41.9 32.1 5.3 17.9 17 16 A T H X S+ 0 0 57 -4,-2.4 4,-2.2 -5,-0.3 -1,-0.2 0.931 112.6 49.6 -62.7 -41.6 31.9 8.2 20.4 18 17 A N H X S+ 0 0 78 -4,-2.5 4,-0.9 2,-0.2 3,-0.3 0.975 112.7 47.1 -53.8 -62.2 28.4 6.8 21.4 19 18 A Y H >< S+ 0 0 6 -4,-3.3 3,-0.8 1,-0.2 -2,-0.2 0.887 115.1 46.0 -44.4 -53.5 29.8 3.3 21.7 20 19 A A H >< S+ 0 0 11 -4,-2.9 3,-1.7 1,-0.2 -1,-0.2 0.778 101.9 62.4 -71.1 -31.3 32.8 4.5 23.8 21 20 A S H 3< S+ 0 0 98 -4,-2.2 -1,-0.2 -3,-0.3 -2,-0.2 0.671 102.0 55.0 -73.8 -14.5 30.8 6.7 26.2 22 21 A D T << S+ 0 0 114 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.298 79.9 137.2 -89.3 3.5 29.0 3.6 27.3 23 22 A D < - 0 0 43 -3,-1.7 8,-0.1 1,-0.1 -3,-0.0 -0.269 38.6-165.6 -53.1 143.3 32.2 1.8 28.2 24 23 A V + 0 0 141 2,-0.0 -1,-0.1 0, 0.0 -3,-0.0 0.296 40.5 133.0-112.4 -1.1 32.1 -0.1 31.5 25 24 A S - 0 0 37 1,-0.1 6,-0.1 2,-0.1 2,-0.0 0.047 59.7 -96.7 -54.2 160.8 35.9 -0.6 32.0 26 25 A D > - 0 0 77 1,-0.1 3,-1.6 4,-0.1 -1,-0.1 -0.188 34.3-104.1 -64.2 166.4 37.8 0.0 35.2 27 26 A Q T 3 S+ 0 0 100 1,-0.3 -1,-0.1 3,-0.0 -2,-0.1 0.748 122.1 62.9 -64.1 -22.0 39.8 3.3 36.0 28 27 A D T 3 S+ 0 0 109 1,-0.1 21,-1.9 21,-0.1 2,-0.5 0.385 95.9 71.0 -82.6 1.2 43.0 1.2 35.2 29 28 A V E < S-A 48 0A 8 -3,-1.6 19,-0.3 19,-0.2 2,-0.1 -0.982 77.0-145.5-121.6 119.2 41.8 0.8 31.7 30 29 A E E -A 47 0A 70 17,-2.8 17,-1.8 -2,-0.5 2,-0.6 -0.458 8.2-137.2 -73.8 149.3 41.8 3.7 29.3 31 30 A V E -A 46 0A 60 15,-0.2 2,-0.6 -2,-0.1 15,-0.2 -0.973 24.7-160.9-101.7 113.3 39.1 4.2 26.6 32 31 A Q E -A 45 0A 2 13,-2.7 13,-2.6 -2,-0.6 2,-0.7 -0.877 14.2-164.2-102.3 124.3 40.9 5.3 23.5 33 32 A L E -A 44 0A 30 -2,-0.6 2,-0.9 11,-0.2 11,-0.2 -0.823 14.3-169.4-103.5 92.8 39.1 7.0 20.7 34 33 A I E +A 43 0A 0 9,-1.8 9,-2.8 -2,-0.7 2,-0.6 -0.716 11.7 171.7 -95.5 100.5 41.6 6.7 17.8 35 34 A L E +A 42 0A 16 -2,-0.9 2,-0.7 7,-0.2 113,-0.3 -0.923 13.0 177.4-122.1 104.0 40.4 8.9 15.0 36 35 A D E >> +A 41 0A 2 5,-3.0 5,-1.8 -2,-0.6 4,-0.9 -0.902 1.8 175.6-103.8 101.6 42.6 9.5 11.9 37 36 A T T 45S+ 0 0 58 -2,-0.7 -1,-0.1 3,-0.2 109,-0.1 0.615 75.7 59.0 -84.4 -14.9 40.6 11.7 9.6 38 37 A E T 45S+ 0 0 119 107,-0.3 -1,-0.2 1,-0.1 108,-0.1 0.886 121.9 23.8 -74.7 -44.5 43.4 12.0 7.0 39 38 A R T 45S- 0 0 98 106,-0.2 25,-0.2 2,-0.1 -2,-0.2 0.460 107.7-122.6-100.3 -3.9 43.7 8.3 6.4 40 39 A N T <5 + 0 0 22 -4,-0.9 24,-2.0 1,-0.2 2,-0.4 0.951 59.2 142.9 60.5 55.1 40.2 7.4 7.5 41 40 A H E < -AB 36 63A 10 -5,-1.8 -5,-3.0 22,-0.2 2,-0.4 -0.996 23.4-179.0-124.0 131.1 40.9 5.0 10.3 42 41 A Y E +AB 35 62A 0 20,-2.7 20,-2.9 -2,-0.4 2,-0.3 -0.978 5.2 168.4-140.1 119.9 38.7 5.0 13.3 43 42 A Q E -AB 34 61A 0 -9,-2.8 -9,-1.8 -2,-0.4 2,-0.5 -0.933 28.4-154.0-131.4 151.6 38.9 2.8 16.4 44 43 A W E +AB 33 60A 16 16,-2.4 15,-2.3 -2,-0.3 16,-1.2 -0.994 33.5 173.3-116.6 116.8 37.6 2.4 20.0 45 44 A X E -AB 32 58A 5 -13,-2.6 -13,-2.7 -2,-0.5 2,-0.5 -0.862 30.6-141.6-117.4 155.5 40.1 0.5 22.1 46 45 A N E +AB 31 57A 7 11,-2.7 11,-2.2 -2,-0.3 2,-0.4 -0.988 27.2 179.3-111.9 130.0 40.5 -0.4 25.7 47 46 A V E +AB 30 56A 2 -17,-1.8 -17,-2.8 -2,-0.5 2,-0.3 -0.981 30.9 59.9-136.8 119.1 44.1 -0.2 26.9 48 47 A G E S-AB 29 55A 7 7,-2.7 7,-2.7 -2,-0.4 2,-0.3 -0.965 70.7 -58.8 168.3-144.2 45.5 -0.9 30.4 49 48 A W E - B 0 54A 30 -21,-1.9 2,-0.5 -2,-0.3 5,-0.2 -0.987 12.7-165.2-140.4 139.7 45.9 -3.4 33.1 50 49 A Q E > S- B 0 53A 102 3,-2.5 3,-2.5 -2,-0.3 2,-0.1 -0.940 81.6 -57.7-118.7 98.1 43.6 -5.6 35.3 51 50 A G T 3 S- 0 0 60 -2,-0.5 -1,-0.0 1,-0.3 0, 0.0 -0.459 119.9 -20.4 57.2-131.9 46.1 -6.6 37.9 52 51 A L T 3 S+ 0 0 124 -2,-0.1 2,-0.5 -3,-0.1 -1,-0.3 0.324 116.4 105.6 -88.6 9.4 48.9 -8.3 35.9 53 52 A N E < S-B 50 0A 109 -3,-2.5 -3,-2.5 1,-0.0 2,-0.4 -0.798 70.2-132.6 -92.3 122.1 46.7 -9.0 33.0 54 53 A R E -B 49 0A 65 -2,-0.5 2,-0.6 -5,-0.2 -5,-0.2 -0.572 13.8-157.1 -73.6 126.3 47.2 -6.8 30.0 55 54 A I E +B 48 0A 26 -7,-2.7 -7,-2.7 -2,-0.4 2,-0.2 -0.930 31.6 146.1-102.4 117.5 44.1 -5.2 28.5 56 55 A Y E +B 47 0A 42 -2,-0.6 2,-0.4 -9,-0.2 -9,-0.2 -0.690 20.5 136.6-153.1 98.8 44.7 -4.3 24.9 57 56 A R E -B 46 0A 99 -11,-2.2 -11,-2.7 -2,-0.2 2,-0.6 -1.000 47.6-134.3-154.7 142.9 41.7 -4.7 22.6 58 57 A C E -B 45 0A 7 -2,-0.4 -13,-0.3 -13,-0.2 3,-0.1 -0.903 16.7-174.1 -97.8 117.5 39.9 -3.0 19.8 59 58 A V E S+ 0 0 5 -15,-2.3 16,-2.8 -2,-0.6 17,-0.4 0.905 72.8 1.0 -80.0 -47.2 36.2 -3.1 20.5 60 59 A I E -BC 44 74A 0 -16,-1.2 -16,-2.4 14,-0.2 2,-0.4 -0.997 62.6-173.4-139.8 146.9 35.1 -1.5 17.1 61 60 A H E -BC 43 73A 0 12,-1.7 11,-2.9 -2,-0.3 12,-1.1 -0.985 3.1-178.6-139.6 126.7 37.1 -0.4 14.1 62 61 A F E -BC 42 71A 1 -20,-2.9 -20,-2.7 -2,-0.4 2,-0.3 -0.986 2.8-172.4-117.8 137.6 35.8 1.4 11.0 63 62 A D E -BC 41 70A 0 7,-2.2 7,-2.9 -2,-0.4 2,-0.5 -0.848 17.9-142.6-110.8 161.1 37.8 2.5 7.9 64 63 A I E + C 0 69A 8 -24,-2.0 2,-0.4 -2,-0.3 5,-0.2 -0.990 28.0 175.4-121.0 115.5 36.6 4.6 5.0 65 64 A K E > - C 0 68A 51 3,-2.7 3,-2.3 -2,-0.5 -2,-0.0 -0.994 68.1 -14.8-128.7 119.8 38.1 3.3 1.8 66 65 A D T 3 S- 0 0 165 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.877 130.1 -54.3 51.3 38.3 37.3 4.6 -1.6 67 66 A G T 3 S+ 0 0 32 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.457 115.2 113.9 79.2 4.0 34.3 6.3 0.1 68 67 A K E < -C 65 0A 45 -3,-2.3 -3,-2.7 26,-0.0 2,-0.6 -0.856 66.8-123.3-108.8 141.0 32.9 3.1 1.6 69 68 A I E -Cd 64 94A 0 24,-2.6 26,-2.8 -2,-0.3 2,-0.6 -0.723 25.1-159.3 -84.8 115.8 32.6 2.4 5.3 70 69 A W E -Cd 63 95A 23 -7,-2.9 -7,-2.2 -2,-0.6 2,-0.7 -0.909 7.8-150.3 -96.6 119.8 34.4 -0.9 6.2 71 70 A L E +Cd 62 96A 8 24,-2.5 27,-1.8 -2,-0.6 26,-0.8 -0.824 25.4 167.9 -83.3 112.7 33.5 -2.6 9.5 72 71 A Q E + 0 0 4 -11,-2.9 2,-0.3 -2,-0.7 -10,-0.2 0.662 59.1 12.0-104.4 -21.5 36.7 -4.3 10.6 73 72 A Q E +C 61 0A 39 -12,-1.1 -12,-1.7 93,-0.0 -1,-0.3 -0.966 52.0 172.6-158.1 139.5 36.1 -5.4 14.1 74 73 A N E +C 60 0A 38 -2,-0.3 -14,-0.2 -14,-0.2 -15,-0.1 -0.746 7.4 167.6-153.0 101.8 33.0 -5.6 16.4 75 74 A L + 0 0 81 -16,-2.8 -15,-0.1 -2,-0.2 2,-0.1 0.353 57.4 91.3 -92.2 3.0 33.3 -7.2 19.9 76 75 A T S S- 0 0 36 -17,-0.4 -2,-0.0 2,-0.1 0, 0.0 -0.371 83.1-123.7 -86.5 172.6 30.0 -5.9 21.1 77 76 A D S S+ 0 0 170 -2,-0.1 2,-0.1 2,-0.0 -1,-0.1 0.208 84.2 101.2-100.0 14.0 26.7 -7.7 20.7 78 77 A R S S- 0 0 77 3,-0.0 3,-0.1 4,-0.0 -2,-0.1 -0.404 76.2-125.8 -81.2 167.4 25.3 -4.5 18.8 79 78 A N > + 0 0 87 -2,-0.1 4,-1.8 1,-0.1 3,-0.3 -0.817 27.1 178.4-117.5 81.5 25.0 -4.4 15.0 80 79 A P H > S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.831 79.1 59.9 -58.9 -30.1 27.0 -1.2 14.0 81 80 A A H > S+ 0 0 2 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.955 107.3 44.6 -61.3 -47.8 26.2 -1.9 10.3 82 81 A E H > S+ 0 0 61 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.825 110.4 55.7 -64.4 -31.9 22.5 -1.7 10.9 83 82 A E H X S+ 0 0 51 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.927 106.1 50.1 -66.8 -42.5 23.0 1.4 13.0 84 83 A L H <>S+ 0 0 3 -4,-2.5 5,-2.4 1,-0.2 4,-0.3 0.908 109.8 51.6 -59.3 -41.2 24.8 3.1 10.2 85 84 A V H ><5S+ 0 0 34 -4,-2.0 3,-1.6 3,-0.2 -1,-0.2 0.920 105.5 55.0 -60.9 -43.4 21.9 2.2 7.9 86 85 A X H 3<5S+ 0 0 153 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.911 107.9 51.6 -50.4 -45.4 19.4 3.7 10.4 87 86 A X T 3<5S- 0 0 110 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.378 133.5 -85.1 -80.6 -0.1 21.4 6.9 10.2 88 87 A G T < 5S+ 0 0 48 -3,-1.6 -3,-0.2 1,-0.3 -2,-0.1 0.549 79.0 138.4 114.7 6.2 21.4 7.1 6.4 89 88 A V < - 0 0 3 -5,-2.4 -1,-0.3 -6,-0.1 5,-0.1 -0.765 54.5-121.1 -83.1 124.9 24.3 5.0 5.1 90 89 A P > - 0 0 44 0, 0.0 3,-1.9 0, 0.0 4,-0.1 -0.366 16.1-127.8 -59.3 143.2 23.3 2.9 2.0 91 90 A R G > S+ 0 0 85 1,-0.3 3,-1.9 2,-0.2 19,-0.2 0.887 110.0 60.4 -54.7 -39.9 23.9 -0.9 2.6 92 91 A E G 3 S+ 0 0 121 1,-0.3 19,-0.4 17,-0.2 -1,-0.3 0.690 98.3 57.7 -67.0 -13.9 25.9 -1.0 -0.5 93 92 A D G < S+ 0 0 24 -3,-1.9 -24,-2.6 17,-0.1 2,-0.4 0.242 91.6 83.4-101.1 13.2 28.4 1.5 1.0 94 93 A I E < -d 69 0A 0 -3,-1.9 16,-3.0 -26,-0.2 2,-0.5 -0.966 61.6-164.6-112.6 129.7 29.2 -0.7 4.0 95 94 A V E -de 70 110A 0 -26,-2.8 -24,-2.5 -2,-0.4 2,-1.8 -0.981 18.5-138.4-113.9 127.1 31.7 -3.5 3.6 96 95 A L E > +d 71 0A 20 14,-0.5 3,-2.0 -2,-0.5 -24,-0.1 -0.602 29.1 171.0 -83.2 80.5 32.0 -6.2 6.2 97 96 A G T 3 S+ 0 0 0 -2,-1.8 -25,-0.2 -26,-0.8 -1,-0.2 0.824 75.4 64.6 -60.4 -26.9 35.7 -6.4 6.4 98 97 A L T 3 S+ 0 0 46 -27,-1.8 2,-0.3 -3,-0.2 -1,-0.3 0.447 94.4 73.2 -77.8 -1.9 35.3 -8.7 9.4 99 98 A Q S < S- 0 0 78 -3,-2.0 5,-0.1 1,-0.1 -4,-0.0 -0.800 101.2 -91.6-103.0 153.6 33.7 -11.3 7.0 100 99 A A >> - 0 0 7 -2,-0.3 3,-1.6 1,-0.1 4,-0.7 -0.382 35.6-115.8 -65.2 147.3 35.7 -13.2 4.5 101 100 A P G >4 S+ 0 0 65 0, 0.0 3,-1.2 0, 0.0 4,-0.5 0.836 110.6 59.5 -52.6 -41.7 36.1 -11.7 1.1 102 101 A Y G 34 S+ 0 0 152 1,-0.3 3,-0.2 2,-0.1 4,-0.1 0.774 106.7 49.4 -62.4 -22.2 34.3 -14.4 -0.8 103 102 A K G X4 S+ 0 0 47 -3,-1.6 3,-2.2 1,-0.2 -1,-0.3 0.669 85.4 86.1 -89.6 -18.8 31.1 -13.8 1.3 104 103 A R G X< S+ 0 0 24 -3,-1.2 3,-1.7 -4,-0.7 5,-0.2 0.854 84.8 54.0 -62.2 -38.3 30.8 -10.1 1.0 105 104 A Q G 3 S+ 0 0 136 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.602 110.3 51.6 -68.1 -10.5 28.8 -10.0 -2.3 106 105 A Y G < S+ 0 0 172 -3,-2.2 -1,-0.3 4,-0.1 -2,-0.2 0.197 94.7 92.1-110.8 6.9 26.4 -12.4 -0.6 107 106 A T S < S- 0 0 33 -3,-1.7 -3,-0.0 -4,-0.1 0, 0.0 -0.432 92.1-103.6 -86.6 177.5 25.8 -10.2 2.5 108 107 A D S S+ 0 0 124 -2,-0.1 -3,-0.1 2,-0.0 -4,-0.1 0.608 104.2 49.8 -74.2 -10.2 23.2 -7.6 3.1 109 108 A Y S S- 0 0 34 -5,-0.2 -14,-0.2 1,-0.2 2,-0.2 0.302 89.7 -74.2-110.0-133.6 25.8 -4.9 2.6 110 109 A G B -e 95 0A 8 -16,-3.0 -14,-0.5 -19,-0.2 2,-0.3 -0.559 19.9-132.1-130.7-176.4 28.5 -4.1 -0.0 111 110 A V 0 0 59 -19,-0.4 -16,-0.0 -2,-0.2 -17,-0.0 -0.857 360.0 360.0-130.2 169.0 31.8 -4.8 -1.6 112 111 A A 0 0 112 -2,-0.3 -1,-0.1 -44,-0.0 -17,-0.0 0.958 360.0 360.0 -56.8 360.0 34.8 -2.7 -2.6 113 !* 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 0.0 114 3 B K > 0 0 88 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 -1.7 58.5 18.4 23.5 115 4 B L H > + 0 0 86 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.951 360.0 41.8 -61.1 -53.5 55.1 17.5 22.1 116 5 B V H > S+ 0 0 102 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.926 116.0 51.6 -60.8 -42.0 55.6 18.5 18.5 117 6 B K H > S+ 0 0 69 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.918 112.7 43.7 -56.7 -50.8 59.2 16.9 18.6 118 7 B Y H X S+ 0 0 17 -4,-2.8 4,-2.6 2,-0.2 5,-0.3 0.880 110.3 56.5 -69.6 -35.9 57.9 13.6 19.9 119 8 B Q H X S+ 0 0 24 -4,-2.7 4,-2.5 -5,-0.3 -1,-0.2 0.932 109.4 47.1 -56.5 -43.8 54.9 13.6 17.5 120 9 B E H X S+ 0 0 105 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.922 112.4 47.9 -70.6 -38.6 57.4 13.9 14.6 121 10 B L H X S+ 0 0 31 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.907 112.9 47.3 -67.0 -45.8 59.7 11.1 15.8 122 11 B V H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 5,-0.3 0.944 113.3 49.8 -63.5 -44.5 56.9 8.6 16.5 123 12 B K H X S+ 0 0 40 -4,-2.5 4,-2.5 -5,-0.3 -2,-0.2 0.913 111.0 49.8 -59.3 -42.1 55.4 9.4 13.1 124 13 B K H X S+ 0 0 120 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.936 112.3 45.8 -63.6 -47.4 58.7 8.9 11.4 125 14 B L H X S+ 0 0 5 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.949 115.4 46.0 -60.4 -49.2 59.4 5.5 13.1 126 15 B L H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.895 110.4 53.3 -64.7 -39.6 56.0 4.2 12.4 127 16 B T H X S+ 0 0 50 -4,-2.5 4,-2.6 -5,-0.3 -1,-0.2 0.902 107.2 53.0 -58.7 -42.7 56.0 5.3 8.9 128 17 B N H X S+ 0 0 94 -4,-2.2 4,-1.1 -5,-0.2 -2,-0.2 0.947 112.8 43.4 -57.3 -48.1 59.4 3.5 8.3 129 18 B Y H >X S+ 0 0 23 -4,-2.1 4,-0.6 1,-0.2 3,-0.6 0.940 115.6 47.0 -64.2 -45.7 58.0 0.3 9.6 130 19 B A H >< S+ 0 0 13 -4,-2.9 3,-0.8 1,-0.2 -1,-0.2 0.888 111.5 51.0 -65.8 -39.5 54.7 0.6 7.7 131 20 B S H 3< S+ 0 0 101 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.698 111.0 49.6 -67.8 -21.5 56.4 1.5 4.5 132 21 B D H << S+ 0 0 133 -4,-1.1 2,-0.5 -3,-0.6 -1,-0.2 0.472 83.7 113.3 -95.9 -2.4 58.7 -1.5 4.8 133 22 B D << - 0 0 33 -3,-0.8 8,-0.1 -4,-0.6 -3,-0.0 -0.573 47.8-166.4 -80.8 119.6 55.9 -4.1 5.5 134 23 B V + 0 0 136 -2,-0.5 -1,-0.1 0, 0.0 -3,-0.0 0.048 26.6 154.6 -96.0 24.3 55.5 -6.6 2.7 135 24 B S - 0 0 39 1,-0.1 6,-0.1 2,-0.1 -2,-0.0 -0.234 48.7-104.5 -47.4 141.9 52.1 -8.1 3.7 136 25 B D > - 0 0 67 1,-0.1 3,-2.4 4,-0.1 -1,-0.1 0.005 37.1 -86.4 -70.5 174.7 50.4 -9.5 0.6 137 26 B Q T 3 S+ 0 0 159 1,-0.3 -1,-0.1 3,-0.1 -2,-0.1 0.703 125.3 60.8 -60.2 -17.9 47.5 -7.9 -1.3 138 27 B D T 3 S+ 0 0 86 1,-0.1 21,-2.1 21,-0.1 2,-0.5 0.501 98.8 62.4 -89.7 -4.3 45.0 -9.6 1.0 139 28 B V E < S-F 158 0B 8 -3,-2.4 2,-0.4 19,-0.3 19,-0.3 -0.978 77.2-143.9-124.5 117.8 46.3 -7.8 4.1 140 29 B E E -F 157 0B 59 17,-2.7 17,-2.4 -2,-0.5 2,-0.6 -0.674 6.9-143.7 -78.5 133.4 46.1 -4.1 4.3 141 30 B V E -F 156 0B 43 -2,-0.4 2,-0.4 15,-0.2 15,-0.2 -0.860 25.2-164.6 -92.8 117.6 49.0 -2.3 6.0 142 31 B Q E -F 155 0B 1 13,-2.0 13,-2.6 -2,-0.6 2,-0.5 -0.886 18.1-162.4-112.5 139.8 47.5 0.7 7.9 143 32 B L E -F 154 0B 33 -2,-0.4 2,-0.6 11,-0.2 11,-0.2 -0.985 14.1-168.7-112.9 124.1 49.2 3.7 9.4 144 33 B I E +F 153 0B 0 9,-2.9 9,-2.7 -2,-0.5 2,-0.5 -0.949 9.2 175.8-124.1 115.1 47.0 5.4 11.9 145 34 B L E +F 152 0B 14 -2,-0.6 2,-0.8 7,-0.2 -107,-0.3 -0.905 5.9 179.6-124.9 103.6 48.0 8.8 13.2 146 35 B D E >> +F 151 0B 1 5,-2.9 5,-1.6 -2,-0.5 4,-0.7 -0.882 2.4 177.1-105.0 102.1 45.6 10.6 15.6 147 36 B T T 45S+ 0 0 68 -2,-0.8 -1,-0.1 3,-0.2 -111,-0.1 0.503 73.4 59.0 -85.6 -4.7 47.3 13.8 16.4 148 37 B E T 45S+ 0 0 95 -113,-0.3 -1,-0.2 3,-0.1 -112,-0.1 0.802 122.6 21.1 -91.1 -39.7 44.5 15.2 18.5 149 38 B R T 45S- 0 0 101 -114,-0.2 25,-0.2 2,-0.1 -2,-0.2 0.374 107.7-122.8-107.0 1.9 44.4 12.4 21.1 150 39 B N T <5 + 0 0 19 -4,-0.7 24,-1.8 1,-0.2 2,-0.4 0.933 57.5 145.3 56.9 59.4 48.0 11.3 20.3 151 40 B H E < -FG 146 173B 20 -5,-1.6 -5,-2.9 22,-0.2 2,-0.4 -0.990 22.5-177.4-125.0 128.8 47.5 7.7 19.4 152 41 B Y E +FG 145 172B 0 20,-2.6 20,-2.9 -2,-0.4 2,-0.3 -0.992 6.2 171.9-137.7 125.8 49.7 6.2 16.6 153 42 B Q E -FG 144 171B 0 -9,-2.7 -9,-2.9 -2,-0.4 2,-0.4 -0.958 29.3-154.9-138.7 150.7 49.6 2.7 15.2 154 43 B W E +FG 143 170B 16 16,-2.2 15,-2.6 -2,-0.3 16,-1.2 -1.000 35.6 174.8-117.0 121.1 50.9 0.4 12.5 155 44 B X E -FG 142 168B 2 -13,-2.6 -13,-2.0 -2,-0.4 2,-0.4 -0.806 32.5-143.1-125.6 167.1 48.4 -2.4 11.8 156 45 B N E +FG 141 167B 7 11,-2.6 11,-2.4 -2,-0.3 2,-0.4 -0.995 26.1 175.4-126.1 127.4 47.8 -5.3 9.5 157 46 B V E +FG 140 166B 5 -17,-2.4 -17,-2.7 -2,-0.4 2,-0.3 -0.962 33.9 61.7-140.0 113.1 44.1 -5.9 8.6 158 47 B G E S-FG 139 165B 6 7,-3.0 7,-2.6 -2,-0.4 2,-0.3 -0.911 70.3 -67.0 171.4-144.6 42.8 -8.5 6.1 159 48 B W E - G 0 164B 26 -21,-2.1 2,-0.4 -2,-0.3 5,-0.2 -0.981 11.3-164.7-142.3 144.4 42.6 -12.2 5.4 160 49 B Q E > S- G 0 163B 73 3,-2.3 3,-2.3 -2,-0.3 2,-0.1 -0.930 80.0 -52.9-127.5 108.8 44.9 -15.1 4.6 161 50 B G T 3 S- 0 0 63 -2,-0.4 -1,-0.1 1,-0.3 0, 0.0 -0.402 121.1 -22.1 56.4-127.1 42.4 -17.8 3.4 162 51 B L T 3 S+ 0 0 132 -3,-0.1 2,-0.6 -62,-0.1 -1,-0.3 0.236 116.1 106.2 -92.6 6.8 39.7 -18.2 6.0 163 52 B N E < -G 160 0B 113 -3,-2.3 -3,-2.3 2,-0.0 2,-0.4 -0.835 68.7-135.5 -90.7 123.4 42.0 -16.7 8.7 164 53 B R E -G 159 0B 65 -2,-0.6 2,-0.6 -5,-0.2 -5,-0.3 -0.601 13.1-156.4 -74.4 127.7 41.2 -13.2 9.8 165 54 B I E +G 158 0B 43 -7,-2.6 -7,-3.0 -2,-0.4 2,-0.3 -0.918 31.2 148.7-104.2 115.0 44.3 -11.1 10.1 166 55 B Y E +G 157 0B 47 -2,-0.6 2,-0.3 -9,-0.2 -9,-0.2 -0.775 18.1 138.1-150.6 100.3 43.7 -8.2 12.6 167 56 B R E -G 156 0B 95 -11,-2.4 -11,-2.6 -2,-0.3 2,-0.6 -0.981 47.1-138.6-152.8 132.7 46.7 -7.0 14.6 168 57 B C E -G 155 0B 7 -2,-0.3 -13,-0.3 -13,-0.2 3,-0.2 -0.855 20.3-171.7 -87.9 121.3 48.3 -3.9 15.8 169 58 B V E S+ 0 0 2 -15,-2.6 16,-2.9 -2,-0.6 17,-0.5 0.908 70.0 6.0 -83.1 -48.0 52.0 -4.4 15.3 170 59 B I E -GH 154 184B 0 -16,-1.2 -16,-2.2 14,-0.2 2,-0.4 -0.994 65.2-174.5-134.9 138.9 53.2 -1.3 17.1 171 60 B H E -GH 153 183B 0 12,-1.7 11,-2.9 -2,-0.4 12,-1.1 -0.996 3.0-179.8-131.6 127.7 51.3 1.3 19.1 172 61 B F E -GH 152 181B 0 -20,-2.9 -20,-2.6 -2,-0.4 2,-0.3 -0.986 3.6-171.8-123.4 136.6 52.6 4.5 20.6 173 62 B D E -GH 151 180B 1 7,-2.2 7,-2.9 -2,-0.4 2,-0.5 -0.825 15.4-144.7-109.7 159.8 50.7 7.1 22.6 174 63 B I E + H 0 179B 9 -24,-1.8 2,-0.4 -2,-0.3 5,-0.2 -0.990 30.4 163.9-121.3 122.0 52.0 10.5 23.7 175 64 B K E > - H 0 178B 44 3,-2.3 3,-1.4 -2,-0.5 -2,-0.1 -0.984 61.8 -14.2-143.7 124.5 50.6 11.5 27.1 176 65 B D T 3 S- 0 0 144 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.884 128.8 -46.8 52.1 50.4 51.8 14.2 29.5 177 66 B G T 3 S+ 0 0 41 1,-0.2 2,-0.3 45,-0.0 -1,-0.3 0.495 118.2 98.8 77.7 7.0 55.1 14.7 27.8 178 67 B K E < -H 175 0B 34 -3,-1.4 -3,-2.3 26,-0.0 2,-0.6 -0.928 68.3-125.8-127.8 152.6 56.1 11.0 27.4 179 68 B I E -Hi 174 204B 0 24,-3.0 26,-2.8 -2,-0.3 2,-0.6 -0.847 25.7-155.8 -95.8 123.4 55.9 8.4 24.6 180 69 B W E -Hi 173 205B 21 -7,-2.9 -7,-2.2 -2,-0.6 2,-0.7 -0.884 6.7-150.2-103.0 121.4 54.1 5.3 25.7 181 70 B L E +Hi 172 206B 6 24,-2.4 27,-1.7 -2,-0.6 26,-0.8 -0.799 24.3 168.6 -86.3 114.8 54.9 2.0 23.9 182 71 B Q E + 0 0 3 -11,-2.9 2,-0.3 -2,-0.7 -10,-0.2 0.636 60.4 14.2-103.9 -18.0 51.6 0.1 24.2 183 72 B Q E +H 171 0B 41 -12,-1.1 -12,-1.7 0, 0.0 -1,-0.3 -0.959 50.7 174.0-161.1 138.5 52.2 -2.8 21.8 184 73 B N E +H 170 0B 39 -2,-0.3 -14,-0.2 -14,-0.2 -15,-0.1 -0.754 7.8 166.2-151.3 100.7 55.2 -4.4 20.0 185 74 B L + 0 0 77 -16,-2.9 -15,-0.1 -2,-0.2 2,-0.1 0.444 55.1 95.8 -91.0 -4.3 54.6 -7.6 17.9 186 75 B T S S- 0 0 26 -17,-0.5 -2,-0.0 1,-0.1 0, 0.0 -0.367 81.8-124.0 -80.2 168.3 58.0 -7.3 16.2 187 76 B D S S+ 0 0 177 -2,-0.1 2,-0.1 2,-0.0 -1,-0.1 0.324 88.2 88.9 -87.3 7.8 61.3 -9.0 17.2 188 77 B R S S- 0 0 143 1,-0.0 -2,-0.1 4,-0.0 0, 0.0 -0.340 81.6-118.4-102.6-179.6 62.8 -5.5 17.3 189 78 B N > + 0 0 84 1,-0.1 4,-1.8 -2,-0.1 3,-0.2 -0.732 29.5 172.4-124.5 77.6 63.1 -2.9 20.0 190 79 B P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.811 79.2 60.5 -60.2 -28.2 61.2 0.3 18.9 191 80 B A H > S+ 0 0 1 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.962 107.8 44.2 -62.1 -45.5 61.7 1.9 22.3 192 81 B E H > S+ 0 0 52 -3,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.853 108.7 58.4 -69.0 -29.6 65.5 1.7 21.9 193 82 B E H X S+ 0 0 47 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.923 104.8 50.0 -62.6 -42.9 65.1 3.0 18.4 194 83 B L H <>S+ 0 0 0 -4,-2.2 5,-2.3 2,-0.2 -2,-0.2 0.871 109.5 52.0 -60.1 -38.3 63.4 6.1 19.7 195 84 B V H ><5S+ 0 0 27 -4,-1.7 3,-2.0 3,-0.2 -2,-0.2 0.927 107.7 51.5 -62.7 -46.9 66.3 6.5 22.1 196 85 B X H 3<5S+ 0 0 155 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.950 108.0 54.3 -51.6 -48.0 68.8 6.2 19.3 197 86 B X T 3<5S- 0 0 60 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.400 133.6 -86.2 -73.7 0.0 66.8 8.9 17.6 198 87 B G T < 5S+ 0 0 58 -3,-2.0 -3,-0.2 1,-0.3 -2,-0.1 0.502 81.9 130.9 115.3 4.6 67.1 11.2 20.5 199 88 B V < - 0 0 2 -5,-2.3 -1,-0.3 -6,-0.1 2,-0.1 -0.772 57.2-124.8 -85.0 125.4 64.3 10.5 23.1 200 89 B P > - 0 0 47 0, 0.0 3,-1.9 0, 0.0 4,-0.1 -0.505 18.4-119.6 -68.7 147.1 65.7 10.2 26.6 201 90 B R G > S+ 0 0 109 1,-0.3 3,-1.6 2,-0.2 19,-0.6 0.771 110.8 63.6 -55.9 -32.5 64.8 7.0 28.3 202 91 B E G 3 S+ 0 0 127 1,-0.3 -1,-0.3 17,-0.2 19,-0.3 0.706 98.2 57.3 -66.8 -16.8 63.0 8.8 31.1 203 92 B D G < S+ 0 0 34 -3,-1.9 -24,-3.0 17,-0.1 2,-0.4 0.218 92.9 82.7 -99.9 10.8 60.5 10.1 28.5 204 93 B I E < -i 179 0B 0 -3,-1.6 16,-3.4 -26,-0.2 2,-0.5 -0.963 60.8-165.7-112.7 129.3 59.5 6.6 27.3 205 94 B V E -i 180 0B 0 -26,-2.8 -24,-2.4 -2,-0.4 2,-1.7 -0.981 18.6-139.0-114.6 128.6 57.0 4.6 29.3 206 95 B L E > +i 181 0B 23 -2,-0.5 3,-1.9 14,-0.5 -24,-0.1 -0.604 28.1 172.1 -81.8 81.7 56.6 0.9 28.6 207 96 B G T 3 S+ 0 0 0 -2,-1.7 -25,-0.2 -26,-0.8 -1,-0.2 0.811 75.8 63.5 -59.5 -28.8 52.8 0.7 28.7 208 97 B L T 3 S+ 0 0 60 -27,-1.7 2,-0.3 -3,-0.2 -1,-0.3 0.429 94.2 76.7 -77.8 0.2 53.0 -2.9 27.6 209 98 B Q S < S- 0 0 49 -3,-1.9 5,-0.1 1,-0.1 0, 0.0 -0.866 100.9 -92.5-108.9 143.0 54.9 -3.7 30.9 210 99 B A >> - 0 0 11 -2,-0.3 3,-1.7 1,-0.1 4,-0.6 -0.230 37.4-120.7 -55.3 135.6 53.0 -4.1 34.2 211 100 B P G >4 S+ 0 0 61 0, 0.0 3,-1.2 0, 0.0 4,-0.5 0.840 106.9 60.0 -49.7 -39.6 53.0 -0.7 36.0 212 101 B Y G 34 S+ 0 0 146 1,-0.3 3,-0.2 2,-0.1 4,-0.1 0.748 102.4 55.6 -66.3 -21.4 54.7 -1.8 39.2 213 102 B K G X> S+ 0 0 46 -3,-1.7 3,-2.1 1,-0.2 4,-0.9 0.779 85.7 81.6 -77.6 -25.7 57.8 -2.8 37.1 214 103 B R G X< S+ 0 0 21 -3,-1.2 3,-0.7 -4,-0.6 5,-0.3 0.812 83.0 57.4 -62.4 -38.4 58.4 0.5 35.4 215 104 B Q G 34 S+ 0 0 138 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.635 110.8 47.1 -67.9 -11.7 60.3 2.3 38.3 216 105 B Y G <4 S+ 0 0 173 -3,-2.1 -1,-0.3 -4,-0.1 -2,-0.2 0.565 98.7 85.6-100.9 -19.5 62.8 -0.5 38.2 217 106 B T S << S- 0 0 38 -4,-0.9 -3,-0.0 -3,-0.7 0, 0.0 -0.099 91.9-112.2 -65.4 175.0 63.2 -0.4 34.4 218 107 B D S S+ 0 0 73 2,-0.0 2,-0.1 -17,-0.0 -1,-0.1 0.260 96.7 72.2 -92.9 8.5 65.6 1.9 32.7 219 108 B Y S S- 0 0 46 -5,-0.3 -17,-0.2 1,-0.2 -14,-0.2 -0.172 87.0 -82.0-106.4-156.6 62.7 3.9 31.2 220 109 B G - 0 0 7 -16,-3.4 -14,-0.5 -19,-0.6 2,-0.3 -0.446 21.8-127.5-108.3 176.4 60.2 6.2 32.8 221 110 B V 0 0 73 -19,-0.3 -16,-0.0 -2,-0.1 -1,-0.0 -0.821 360.0 360.0-117.7 163.5 57.0 6.3 34.7 222 111 B A 0 0 87 -2,-0.3 -1,-0.1 -44,-0.0 -46,-0.1 0.058 360.0 360.0 -38.2 360.0 53.8 8.3 33.8