==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 09-SEP-11 2LJA . COMPND 2 MOLECULE: PUTATIVE THIOL-DISULFIDE OXIDOREDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES VULGATUS; . AUTHOR R.HARRIS,R.D.SEIDEL,B.HILLERICH,A.GIZZI,A.KAR,J.LAFLEUR,S.CH . 152 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8358.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 105 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 9.2 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 . 2 1.3 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 . 1 0.7 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 17.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 21.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.6 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 1 0 0 0 0 1 2 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 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 0 PARALLEL BRIDGES PER LADDER . 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 0 183 0, 0.0 5,-0.2 0, 0.0 6,-0.1 0.000 360.0 360.0 360.0-154.6 134.6 36.5 180.2 2 2 A S > + 0 0 78 1,-0.2 2,-2.5 4,-0.1 5,-1.4 -0.049 360.0 1.6 -50.2 144.7 132.7 33.4 179.0 3 3 A L T 5S- 0 0 107 1,-0.2 -1,-0.2 3,-0.2 0, 0.0 -0.467 130.7 -63.6 73.5 -67.5 134.9 30.4 177.8 4 4 A R T 5S+ 0 0 207 -2,-2.5 -1,-0.2 3,-0.1 -2,-0.1 0.088 131.8 35.8-175.7 -38.0 138.0 32.4 178.7 5 5 A S T 5S- 0 0 73 -3,-0.4 -2,-0.1 2,-0.0 -3,-0.1 0.875 118.3 -78.7 -90.0 -78.4 138.1 35.4 176.4 6 6 A G T 5S+ 0 0 42 -5,-0.2 -3,-0.2 -4,-0.1 -4,-0.1 0.128 71.1 146.5 174.6 47.1 134.5 36.6 175.9 7 7 A N < - 0 0 71 -5,-1.4 2,-0.7 -6,-0.1 -3,-0.1 -0.802 47.1-124.4-104.1 137.3 132.7 34.4 173.4 8 8 A P + 0 0 124 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 -0.694 52.3 141.1 -79.8 113.6 129.0 33.5 173.5 9 9 A S + 0 0 44 -2,-0.7 2,-1.5 4,-0.0 -6,-0.1 -0.982 50.4 16.2-151.9 156.6 128.6 29.8 173.5 10 10 A A S S+ 0 0 29 -2,-0.3 2,-2.0 1,-0.1 3,-0.3 -0.050 89.7 106.9 73.8 -35.0 126.6 26.9 175.0 11 11 A A S S- 0 0 84 -2,-1.5 -1,-0.1 1,-0.2 109,-0.1 -0.540 104.7 -38.4 -80.5 78.9 123.9 29.3 176.2 12 12 A S S S- 0 0 84 -2,-2.0 -1,-0.2 107,-0.3 2,-0.2 0.959 73.8-160.7 68.7 95.5 121.2 28.5 173.7 13 13 A F - 0 0 21 -3,-0.3 12,-1.2 -4,-0.0 2,-0.3 -0.553 6.2-151.8 -98.1 166.0 122.5 27.7 170.2 14 14 A S E +A 24 0A 79 10,-0.2 10,-0.3 -2,-0.2 8,-0.1 -0.942 20.6 167.0-142.5 120.4 120.7 27.7 166.9 15 15 A Y E -A 23 0A 21 8,-2.7 8,-3.3 -2,-0.3 2,-0.5 -0.845 37.7-101.7-128.2 161.7 121.7 25.6 163.9 16 16 A P E -A 22 0A 57 0, 0.0 77,-1.4 0, 0.0 6,-0.2 -0.774 32.9-136.4 -86.2 124.9 120.1 24.5 160.6 17 17 A D E >> -A 21 0A 25 4,-3.4 3,-2.5 -2,-0.5 4,-0.5 -0.382 36.6 -92.5 -69.6 159.0 118.6 21.0 160.4 18 18 A I T 34 S+ 0 0 12 1,-0.3 61,-0.1 2,-0.2 -1,-0.1 0.820 127.4 50.5 -40.9 -49.7 119.3 18.9 157.3 19 19 A N T 34 S- 0 0 121 1,-0.1 -1,-0.3 2,-0.0 -2,-0.0 0.688 130.7 -92.8 -69.5 -16.5 116.2 20.0 155.5 20 20 A G T <4 S+ 0 0 49 -3,-2.5 2,-0.5 1,-0.2 -2,-0.2 0.699 74.2 152.3 107.7 33.8 117.1 23.6 156.2 21 21 A K E < -A 17 0A 82 -4,-0.5 -4,-3.4 2,-0.0 2,-0.8 -0.832 49.1-125.2-102.3 129.0 115.2 24.2 159.4 22 22 A T E -A 16 0A 110 -2,-0.5 2,-0.6 -6,-0.2 70,-0.0 -0.593 35.7-177.8 -64.7 104.9 116.3 26.7 162.0 23 23 A V E -A 15 0A 11 -8,-3.3 -8,-2.7 -2,-0.8 2,-0.1 -0.963 3.8-174.9-111.8 118.5 116.5 24.4 165.1 24 24 A S E -A 14 0A 26 -2,-0.6 3,-0.3 -10,-0.3 -10,-0.2 -0.286 44.2 -97.7-100.5-173.8 117.4 26.2 168.3 25 25 A L S > S+ 0 0 3 -12,-1.2 4,-0.6 1,-0.2 -11,-0.1 0.485 123.5 62.6 -82.4 -1.0 118.1 25.2 171.8 26 26 A A T 4 S+ 0 0 67 -13,-0.2 -1,-0.2 2,-0.2 -12,-0.1 0.682 89.9 65.6 -96.0 -21.7 114.4 26.1 172.5 27 27 A D T 4 S+ 0 0 76 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.685 116.2 29.6 -65.7 -22.4 113.3 23.4 170.1 28 28 A L T >4 S+ 0 0 3 -4,-0.2 3,-1.4 90,-0.1 -2,-0.2 0.547 95.3 116.1-112.4 -15.7 114.8 21.0 172.6 29 29 A K T 3< + 0 0 94 -4,-0.6 89,-0.2 1,-0.2 88,-0.1 -0.325 63.8 43.7 -69.7 133.4 114.3 23.0 175.8 30 30 A G T 3 S+ 0 0 49 87,-3.0 2,-0.3 1,-0.2 -1,-0.2 0.088 109.1 59.6 119.2 -18.9 112.0 21.5 178.4 31 31 A K S < S- 0 0 64 -3,-1.4 -1,-0.2 86,-0.6 33,-0.1 -0.982 99.7 -83.2-140.2 147.5 113.3 18.0 178.1 32 32 A Y E -b 64 0B 64 31,-0.7 33,-2.0 -2,-0.3 2,-0.4 -0.151 45.1-141.7 -54.0 140.8 116.9 16.6 178.7 33 33 A I E -bC 65 115B 0 82,-1.7 82,-3.1 31,-0.2 2,-0.5 -0.903 14.3-167.4-112.2 132.2 119.2 17.0 175.7 34 34 A Y E -bC 66 114B 0 31,-3.1 33,-3.2 -2,-0.4 2,-0.7 -0.975 10.8-160.0-115.6 116.5 121.8 14.5 174.5 35 35 A I E +bC 67 113B 7 78,-1.8 78,-1.8 -2,-0.5 2,-0.3 -0.864 15.0 172.7-103.3 109.7 124.2 15.9 172.0 36 36 A D E -bC 68 112B 1 31,-1.7 33,-2.9 -2,-0.7 2,-0.4 -0.749 29.7-119.6-105.6 158.3 126.0 13.4 169.9 37 37 A V E -b 69 0B 2 74,-0.7 2,-0.4 -2,-0.3 33,-0.2 -0.866 26.8-173.9-103.3 136.7 128.3 14.2 166.9 38 38 A W + 0 0 2 31,-1.5 34,-0.4 -2,-0.4 2,-0.3 -0.962 7.1 175.0-128.5 141.8 127.6 13.0 163.4 39 39 A A - 0 0 0 -2,-0.4 6,-0.0 3,-0.2 31,-0.0 -0.982 37.5-137.8-146.2 158.1 129.8 13.4 160.3 40 40 A T S S+ 0 0 35 -2,-0.3 -1,-0.1 1,-0.2 30,-0.0 0.916 110.3 45.6 -76.4 -46.2 130.1 12.4 156.6 41 41 A W S S+ 0 0 152 2,-0.0 2,-0.8 1,-0.0 -1,-0.2 0.445 93.7 95.9 -80.8 -1.2 133.8 11.7 156.9 42 42 A C + 0 0 5 1,-0.2 4,-0.3 2,-0.1 -3,-0.2 -0.826 41.5 167.5 -95.3 110.9 133.3 9.7 160.1 43 43 A G > + 0 0 46 -2,-0.8 3,-1.4 2,-0.1 4,-0.3 0.879 69.2 62.4 -85.3 -44.0 133.1 6.0 159.4 44 44 A P G > S+ 0 0 101 0, 0.0 3,-1.9 0, 0.0 4,-0.4 0.848 97.6 59.7 -53.0 -38.3 133.4 4.6 163.0 45 45 A C G >> S+ 0 0 0 1,-0.3 3,-1.7 64,-0.2 4,-1.6 0.849 93.0 67.0 -58.9 -32.5 130.2 6.4 164.1 46 46 A R G <4 S+ 0 0 58 -3,-1.4 -1,-0.3 -4,-0.3 -3,-0.1 0.584 88.8 67.4 -69.4 -8.2 128.3 4.4 161.4 47 47 A G G <4 S+ 0 0 68 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.789 115.4 24.7 -78.3 -27.8 129.0 1.3 163.4 48 48 A E T <> S+ 0 0 9 -3,-1.7 4,-2.1 -4,-0.4 -2,-0.2 0.474 97.9 91.5-114.5 -8.0 126.8 2.4 166.2 49 49 A L H X S+ 0 0 8 -4,-1.6 4,-1.9 1,-0.2 5,-0.1 0.912 88.7 50.3 -55.2 -47.1 124.5 4.8 164.3 50 50 A P H > S+ 0 0 81 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.886 111.9 49.3 -55.0 -37.5 122.0 1.9 163.7 51 51 A A H > S+ 0 0 45 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.791 103.9 58.9 -73.5 -28.6 122.2 1.2 167.4 52 52 A L H X S+ 0 0 14 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.891 106.7 48.0 -64.6 -39.6 121.6 4.9 168.1 53 53 A K H X S+ 0 0 29 -4,-1.9 4,-3.2 2,-0.2 5,-0.3 0.936 110.2 51.2 -63.8 -47.0 118.3 4.5 166.2 54 54 A E H X S+ 0 0 104 -4,-2.1 4,-2.0 1,-0.2 5,-0.3 0.896 108.5 52.8 -53.1 -43.6 117.6 1.4 168.2 55 55 A L H X S+ 0 0 16 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.918 113.9 42.9 -59.5 -44.4 118.3 3.5 171.3 56 56 A E H < S+ 0 0 47 -4,-2.1 3,-0.3 2,-0.2 6,-0.2 0.976 117.8 42.1 -65.5 -56.0 115.8 6.1 170.2 57 57 A E H < S+ 0 0 122 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.702 116.5 49.9 -72.7 -19.2 113.0 3.8 169.0 58 58 A K H < S+ 0 0 124 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.787 119.2 37.6 -82.4 -31.6 113.5 1.6 172.1 59 59 A Y S >< S+ 0 0 30 -4,-1.5 3,-2.9 -3,-0.3 -2,-0.2 0.180 83.1 153.4-103.9 13.0 113.3 4.6 174.4 60 60 A A T 3 + 0 0 72 1,-0.3 -3,-0.1 -4,-0.2 3,-0.1 -0.236 69.2 28.8 -47.2 113.8 110.7 6.4 172.3 61 61 A G T 3 S+ 0 0 78 1,-0.3 -1,-0.3 3,-0.2 -4,-0.1 0.211 90.7 133.0 115.0 -12.2 108.9 8.6 174.8 62 62 A K S < S- 0 0 27 -3,-2.9 2,-0.9 -6,-0.2 -1,-0.3 -0.066 71.1-106.0 -65.9 169.5 111.8 9.1 177.1 63 63 A D S S+ 0 0 20 75,-0.1 -31,-0.7 -3,-0.1 2,-0.3 -0.378 88.4 97.0 -94.8 55.8 112.8 12.5 178.5 64 64 A I E -b 32 0B 3 -2,-0.9 2,-0.6 -5,-0.2 -31,-0.2 -0.995 60.0-148.5-146.0 134.1 115.8 12.7 176.2 65 65 A H E -b 33 0B 38 -33,-2.0 -31,-3.1 -2,-0.3 2,-0.9 -0.930 12.9-145.8-101.6 120.8 116.5 14.4 172.9 66 66 A F E +b 34 0B 7 -2,-0.6 24,-0.8 -33,-0.2 2,-0.6 -0.794 26.6 179.8 -83.3 108.9 119.0 12.7 170.6 67 67 A V E -bd 35 90B 2 -33,-3.2 -31,-1.7 -2,-0.9 2,-0.5 -0.916 13.1-161.0-120.8 105.2 120.7 15.7 168.9 68 68 A S E -bd 36 91B 12 22,-1.9 24,-3.5 -2,-0.6 2,-0.5 -0.729 5.7-162.4 -88.1 124.5 123.4 15.0 166.4 69 69 A L E -bd 37 92B 10 -33,-2.9 -31,-1.5 -2,-0.5 2,-0.5 -0.926 4.4-155.3-110.0 130.0 125.7 17.9 165.6 70 70 A S E - d 0 93B 0 22,-1.3 24,-3.1 -2,-0.5 25,-0.5 -0.909 17.7-169.5-112.1 122.4 127.8 17.9 162.5 71 71 A C + 0 0 20 -2,-0.5 27,-0.1 -33,-0.3 -1,-0.1 0.307 48.9 133.2 -85.4 9.3 131.0 19.8 162.1 72 72 A D - 0 0 0 -34,-0.4 -2,-0.1 1,-0.2 3,-0.0 -0.355 47.3-159.3 -64.6 136.5 131.0 18.9 158.4 73 73 A K S S+ 0 0 122 1,-0.2 2,-1.6 23,-0.1 -1,-0.2 0.833 79.0 78.4 -82.8 -33.7 131.6 21.8 156.1 74 74 A N > + 0 0 69 1,-0.2 4,-1.7 2,-0.1 5,-0.2 -0.566 56.8 168.2 -77.9 85.8 130.0 20.0 153.2 75 75 A K H > S+ 0 0 56 -2,-1.6 4,-4.0 2,-0.2 3,-0.5 0.989 73.7 45.6 -62.5 -63.0 126.3 20.5 154.0 76 76 A K H > S+ 0 0 143 1,-0.3 4,-1.7 2,-0.2 5,-0.2 0.838 115.3 49.2 -53.2 -37.7 124.7 19.4 150.7 77 77 A A H > S+ 0 0 45 2,-0.2 4,-1.0 1,-0.2 -1,-0.3 0.890 118.2 40.3 -66.5 -38.1 126.9 16.3 150.7 78 78 A W H X S+ 0 0 0 -4,-1.7 4,-3.1 -3,-0.5 5,-0.3 0.892 111.7 54.0 -80.6 -41.9 126.0 15.6 154.2 79 79 A E H X S+ 0 0 28 -4,-4.0 4,-1.3 1,-0.2 -3,-0.2 0.897 113.7 43.1 -62.4 -39.1 122.3 16.4 154.1 80 80 A N H X S+ 0 0 73 -4,-1.7 4,-1.7 -5,-0.3 -1,-0.2 0.815 112.3 56.7 -75.1 -28.6 121.9 14.0 151.1 81 81 A M H X S+ 0 0 52 -4,-1.0 4,-4.3 2,-0.2 5,-0.3 0.959 105.9 46.6 -64.7 -52.0 124.0 11.5 152.9 82 82 A V H X>S+ 0 0 4 -4,-3.1 5,-1.1 1,-0.3 4,-1.0 0.835 111.1 54.5 -61.2 -30.6 121.8 11.5 156.1 83 83 A T H <5S+ 0 0 88 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.894 116.3 37.8 -64.4 -38.1 118.9 11.1 153.6 84 84 A K H <5S+ 0 0 122 -4,-1.7 -2,-0.2 -3,-0.2 -3,-0.2 0.899 117.2 49.4 -77.5 -44.8 120.8 8.1 152.2 85 85 A D H <5S- 0 0 45 -4,-4.3 -3,-0.2 -5,-0.1 -2,-0.2 0.619 101.0-139.7 -69.6 -16.4 122.1 6.9 155.5 86 86 A Q T <5 + 0 0 105 -4,-1.0 2,-0.8 -5,-0.3 -3,-0.2 0.760 48.4 151.7 59.5 31.1 118.5 7.2 156.8 87 87 A L < + 0 0 23 -5,-1.1 -1,-0.2 -6,-0.1 -4,-0.1 -0.106 19.6 161.9 -85.0 39.8 119.8 8.6 160.1 88 88 A K + 0 0 95 -2,-0.8 2,-0.3 -6,-0.2 -5,-0.0 -0.250 20.8 92.7 -65.6 150.5 116.6 10.6 160.7 89 89 A G S S- 0 0 49 2,-0.0 2,-0.6 -21,-0.0 -22,-0.1 -0.846 90.3 -24.4 166.4-134.8 115.9 11.9 164.2 90 90 A I E S+d 67 0B 72 -24,-0.8 -22,-1.9 -2,-0.3 2,-0.3 -0.960 78.6 163.6-111.2 114.1 116.8 15.2 165.8 91 91 A Q E -d 68 0B 16 -2,-0.6 2,-0.3 -24,-0.2 -73,-0.2 -0.966 24.2-171.5-141.9 146.8 119.8 16.6 164.0 92 92 A L E -d 69 0B 0 -24,-3.5 -22,-1.3 -2,-0.3 2,-0.4 -0.956 12.3-146.9-134.1 153.9 121.8 19.8 163.5 93 93 A H E -d 70 0B 8 -77,-1.4 -22,-0.2 -2,-0.3 -24,-0.1 -0.982 9.1-174.7-129.4 125.1 124.6 20.8 161.2 94 94 A M + 0 0 13 -24,-3.1 2,-0.5 -2,-0.4 -23,-0.2 0.952 11.4 177.3 -76.3 -85.3 127.4 23.3 162.0 95 95 A G S S- 0 0 6 -25,-0.5 -1,-0.1 1,-0.1 3,-0.1 -0.601 71.1 -4.7 117.8 -74.0 129.4 23.8 158.9 96 96 A T S S+ 0 0 100 -2,-0.5 2,-1.1 -23,-0.1 -1,-0.1 0.454 105.3 90.7-135.7 -8.1 132.1 26.3 159.5 97 97 A D > + 0 0 64 1,-0.2 3,-1.7 2,-0.1 4,-0.2 -0.171 44.7 149.0 -90.0 48.2 131.5 27.6 163.0 98 98 A R T 3> + 0 0 104 -2,-1.1 4,-1.3 1,-0.3 -1,-0.2 0.217 41.7 97.5 -75.9 20.5 133.8 25.0 164.4 99 99 A T H 3> S+ 0 0 96 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.822 84.0 53.3 -70.2 -30.2 134.8 27.2 167.3 100 100 A F H <> S+ 0 0 15 -3,-1.7 4,-0.9 2,-0.2 6,-0.2 0.758 99.4 64.5 -73.6 -25.7 132.1 25.4 169.3 101 101 A M H >4>S+ 0 0 15 -4,-0.2 5,-2.4 1,-0.2 3,-0.7 0.955 109.3 36.3 -58.8 -52.3 134.0 22.2 168.2 102 102 A D H 3<5S+ 0 0 86 -4,-1.3 3,-0.4 1,-0.2 -2,-0.2 0.770 104.9 72.0 -73.4 -26.7 137.0 23.2 170.2 103 103 A A H 3<5S+ 0 0 33 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.783 112.7 28.8 -60.7 -26.8 134.9 24.7 172.9 104 104 A Y T <<5S- 0 0 25 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.421 108.8-121.2-108.5 -3.3 134.0 21.2 173.9 105 105 A L T 5 + 0 0 140 -3,-0.4 -3,-0.2 -4,-0.4 2,-0.2 0.825 47.6 179.7 60.4 32.2 137.2 19.6 172.7 106 106 A I < + 0 0 8 -5,-2.4 2,-0.3 -6,-0.2 -1,-0.2 -0.459 10.4 149.8 -64.2 131.1 135.1 17.5 170.4 107 107 A N + 0 0 139 -2,-0.2 2,-2.2 -3,-0.1 -5,-0.0 -0.976 47.5 23.6-157.6 161.0 137.2 15.1 168.3 108 108 A G S S- 0 0 50 -2,-0.3 -63,-0.2 1,-0.1 3,-0.1 -0.365 103.4 -93.6 81.4 -60.9 137.0 11.7 166.7 109 109 A I S S+ 0 0 6 -2,-2.2 -64,-0.2 1,-0.1 -71,-0.1 0.582 99.3 63.0 72.1 131.0 133.2 11.6 166.4 110 110 A P - 0 0 6 0, 0.0 2,-0.4 0, 0.0 -72,-0.1 0.478 64.4-172.3 -84.1 145.9 130.8 10.7 167.8 111 111 A R - 0 0 29 -3,-0.1 -74,-0.7 -2,-0.1 2,-0.6 -0.821 16.9-136.3 -97.3 141.7 131.2 12.8 170.9 112 112 A F E +C 36 0B 54 -2,-0.4 14,-2.4 -76,-0.2 2,-0.3 -0.889 30.1 165.5-104.0 117.9 128.8 12.3 173.8 113 113 A I E -C 35 0B 1 -78,-1.8 -78,-1.8 -2,-0.6 2,-0.4 -0.960 14.1-165.7-129.2 149.4 127.2 15.3 175.6 114 114 A L E -CE 34 123B 12 9,-2.6 9,-2.5 -2,-0.3 8,-2.2 -0.999 7.0-179.2-137.1 139.8 124.3 15.6 178.0 115 115 A L E -CE 33 121B 0 -82,-3.1 -82,-1.7 -2,-0.4 6,-0.3 -0.943 29.3-102.8-135.8 156.6 122.4 18.7 179.2 116 116 A D > - 0 0 46 4,-3.2 3,-2.8 -2,-0.3 4,-0.5 -0.335 44.5 -96.4 -73.0 160.7 119.5 19.4 181.6 117 117 A R T 3 S+ 0 0 100 1,-0.3 -87,-3.0 2,-0.2 -86,-0.6 0.786 125.0 58.9 -44.8 -39.9 115.9 20.2 180.4 118 118 A D T 3 S- 0 0 64 -89,-0.2 -1,-0.3 -88,-0.2 -89,-0.1 0.758 128.0 -98.5 -63.4 -23.5 116.7 23.9 180.6 119 119 A G S < S+ 0 0 8 -3,-2.8 2,-0.8 1,-0.2 -107,-0.3 0.547 73.1 154.7 105.5 19.8 119.5 23.5 178.2 120 120 A K - 0 0 118 -4,-0.5 -4,-3.2 -109,-0.1 -1,-0.2 -0.745 48.6-122.8 -91.8 108.0 122.1 23.3 181.0 121 121 A I E +E 115 0B 60 -2,-0.8 -6,-0.3 -6,-0.3 3,-0.2 -0.245 38.5 169.6 -47.2 113.0 125.2 21.4 180.0 122 122 A I E + 0 0 102 -8,-2.2 2,-0.5 1,-0.3 -7,-0.2 0.871 67.9 17.9 -94.3 -53.8 125.4 18.6 182.6 123 123 A S E -E 114 0B 30 -9,-2.5 -9,-2.6 1,-0.1 -1,-0.3 -0.966 52.2-169.2-127.0 114.5 128.1 16.5 181.1 124 124 A A S S+ 0 0 40 -2,-0.5 2,-0.5 1,-0.3 -1,-0.1 0.827 98.1 31.3 -65.0 -32.1 130.5 17.8 178.4 125 125 A N S S+ 0 0 112 -3,-0.1 -1,-0.3 -12,-0.1 -12,-0.2 -0.944 80.2 152.6-127.3 106.9 131.5 14.1 178.1 126 126 A M - 0 0 38 -14,-2.4 2,-0.3 -2,-0.5 -13,-0.1 0.692 53.3 -52.6 -99.5-101.3 128.7 11.7 178.9 127 127 A T - 0 0 19 -14,-0.1 -14,-0.1 -16,-0.1 -1,-0.1 -0.933 46.2-113.9-155.2 122.7 128.4 8.3 177.4 128 128 A R > - 0 0 92 -2,-0.3 3,-2.1 -16,-0.1 6,-0.4 -0.196 29.7-120.2 -49.3 140.8 128.6 7.0 173.8 129 129 A P T 3 S+ 0 0 15 0, 0.0 6,-0.2 0, 0.0 -1,-0.1 0.858 115.9 56.1 -54.7 -38.8 125.3 5.5 172.5 130 130 A S T 3 S+ 0 0 72 4,-0.1 -2,-0.1 3,-0.0 3,-0.0 0.496 89.2 95.6 -72.5 -2.2 127.1 2.2 171.8 131 131 A D X> - 0 0 44 -3,-2.1 3,-2.2 1,-0.1 4,-0.8 -0.823 69.3-151.2 -94.5 115.2 128.1 2.3 175.5 132 132 A P H 3> S+ 0 0 97 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.747 92.4 68.4 -56.7 -25.5 125.7 0.2 177.6 133 133 A K H 3> S+ 0 0 119 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.730 92.8 59.2 -70.0 -20.4 126.3 2.4 180.6 134 134 A T H <> S+ 0 0 0 -3,-2.2 4,-2.0 -6,-0.4 -1,-0.2 0.914 104.8 48.6 -72.7 -40.7 124.6 5.3 178.8 135 135 A A H X S+ 0 0 22 -4,-0.8 4,-2.3 1,-0.2 5,-0.2 0.903 108.4 55.0 -62.9 -41.5 121.4 3.2 178.6 136 136 A E H X S+ 0 0 43 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.895 106.5 51.7 -55.7 -42.3 121.8 2.5 182.3 137 137 A K H X S+ 0 0 69 -4,-1.6 4,-3.0 2,-0.2 5,-0.3 0.910 107.2 52.4 -63.4 -42.8 121.9 6.2 182.9 138 138 A F H X S+ 0 0 1 -4,-2.0 4,-1.5 2,-0.2 6,-0.2 0.959 112.6 43.4 -57.9 -54.3 118.7 6.8 180.9 139 139 A N H X>S+ 0 0 28 -4,-2.3 5,-3.6 1,-0.2 4,-0.8 0.924 115.3 51.5 -56.3 -46.2 116.7 4.2 182.9 140 140 A E H ><5S+ 0 0 77 -4,-2.5 3,-1.3 1,-0.2 -2,-0.2 0.945 109.8 45.3 -57.6 -55.2 118.2 5.5 186.1 141 141 A L H 3<5S+ 0 0 71 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.715 116.1 48.1 -68.5 -20.1 117.4 9.1 185.7 142 142 A L H 3<5S- 0 0 70 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.568 112.2-122.2 -89.4 -11.9 113.9 8.2 184.6 143 143 A G T <<5 + 0 0 57 -3,-1.3 -3,-0.2 -4,-0.8 -2,-0.1 0.792 66.6 143.3 71.8 30.1 113.6 5.9 187.6 144 144 A L < + 0 0 105 -5,-3.6 2,-0.3 -6,-0.2 -4,-0.2 0.168 25.1 128.4 -88.8 16.8 112.9 3.1 185.1 145 145 A E - 0 0 40 -6,-0.4 2,-2.3 -5,-0.2 4,-0.2 -0.592 65.8-131.2 -80.0 131.3 114.8 0.6 187.2 146 146 A G S S- 0 0 47 2,-0.5 2,-0.6 -2,-0.3 6,-0.3 -0.518 91.1 -47.8 -76.5 73.7 113.2 -2.7 188.1 147 147 A H S S- 0 0 139 -2,-2.3 2,-0.3 4,-0.1 -1,-0.2 -0.239 136.8 -10.7 77.2 -40.4 114.1 -2.1 191.7 148 148 A H S S- 0 0 104 -2,-0.6 -2,-0.5 1,-0.1 4,-0.1 -0.924 90.8 -79.0-171.8 166.4 117.4 -1.4 190.0 149 149 A H S S+ 0 0 50 -2,-0.3 2,-0.7 -4,-0.2 -3,-0.2 0.852 125.4 34.3 -34.2 -63.5 119.2 -1.7 186.6 150 150 A H S S- 0 0 144 -3,-0.1 -1,-0.2 -5,-0.1 -5,-0.0 -0.907 114.2-100.6-102.5 112.4 119.9 -5.4 186.9 151 151 A H 0 0 163 -2,-0.7 -4,-0.1 1,-0.1 -2,-0.1 -0.022 360.0 360.0 -45.3 103.6 117.0 -6.8 188.9 152 152 A H 0 0 180 -6,-0.3 -1,-0.1 -4,-0.1 -4,-0.1 0.031 360.0 360.0-141.0 360.0 118.1 -7.2 192.5