==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 04-MAR-11 2LA7 . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA XENOVORANS; . AUTHOR K.JAUDZEMS,P.SERRANO,G.MICHAEL,H.RETO,K.WUTHRICH,JOINT CENTE . 145 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9507.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 85 58.6 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 . 45 31.0 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 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.4 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 . 17 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 4.8 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 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 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 . 1 1 1 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 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 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 I 0 0 215 0, 0.0 3,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 86.2 24.8 -26.2 -5.3 2 2 A P - 0 0 119 0, 0.0 2,-0.0 0, 0.0 0, 0.0 -0.068 360.0 -72.9 -70.9-170.5 27.1 -23.6 -6.8 3 3 A K - 0 0 194 1,-0.2 0, 0.0 2,-0.0 0, 0.0 -0.297 56.1 -84.0 -70.5 170.9 29.0 -21.1 -4.5 4 4 A H - 0 0 177 -3,-0.1 -1,-0.2 1,-0.1 3,-0.1 -0.301 46.2-111.4 -53.9 160.8 27.6 -18.2 -2.6 5 5 A P - 0 0 126 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.627 48.6-133.2 -75.9 -15.0 27.3 -15.1 -4.9 6 6 A D - 0 0 140 1,-0.1 2,-0.7 2,-0.0 0, 0.0 -0.140 36.0 -58.2 66.9 178.4 30.1 -13.3 -2.9 7 7 A S + 0 0 101 1,-0.1 -1,-0.1 -3,-0.1 3,-0.0 -0.846 64.0 142.1 -98.3 109.5 29.7 -9.6 -1.7 8 8 A E + 0 0 184 -2,-0.7 2,-0.3 1,-0.1 -1,-0.1 -0.222 49.7 87.6-136.6 45.8 29.1 -6.9 -4.4 9 9 A A + 0 0 86 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.865 31.2 152.0-150.6 110.0 26.7 -4.6 -2.6 10 10 A V + 0 0 147 -2,-0.3 -3,-0.0 -3,-0.0 0, 0.0 -0.876 38.2 108.3-134.7 97.4 27.6 -1.6 -0.4 11 11 A A - 0 0 84 -2,-0.3 -2,-0.0 0, 0.0 0, 0.0 -0.943 66.9 -88.8-164.9 156.2 24.9 1.1 -0.5 12 12 A P - 0 0 128 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.108 54.2 -92.5 -64.2 161.8 22.0 2.7 1.6 13 13 A D - 0 0 141 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.356 46.2-101.1 -80.8 158.6 18.5 1.2 1.4 14 14 A P S S+ 0 0 93 0, 0.0 -1,-0.1 0, 0.0 106,-0.1 0.127 77.5 44.9 -73.8-173.0 15.8 2.5 -1.1 15 15 A F - 0 0 64 104,-0.1 106,-0.2 1,-0.1 104,-0.1 -0.056 68.3-126.5 64.2-178.2 12.9 4.9 -0.6 16 16 A N - 0 0 91 104,-1.2 4,-0.4 67,-0.1 104,-0.2 -0.879 7.4-140.6-161.5 143.4 13.1 8.2 1.4 17 17 A P S > S+ 0 0 84 0, 0.0 2,-2.5 0, 0.0 3,-1.0 0.834 94.7 76.7 -80.9 -31.8 11.0 9.7 4.3 18 18 A A T 3 S+ 0 0 62 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.321 93.8 55.2 -73.2 56.8 11.1 13.3 2.8 19 19 A A T > S+ 0 0 5 -2,-2.5 3,-2.2 -3,-0.1 2,-0.5 0.247 82.9 77.7-154.6 -41.2 8.4 12.0 0.4 20 20 A T T < S+ 0 0 4 -3,-1.0 61,-0.1 -4,-0.4 63,-0.1 0.152 87.5 66.1 -68.1 21.4 5.7 10.7 2.8 21 21 A Q T 3 S+ 0 0 120 -2,-0.5 -1,-0.3 62,-0.1 59,-0.1 0.180 95.4 54.6-120.3 1.5 4.8 14.5 3.4 22 22 A L S X S+ 0 0 97 -3,-2.2 2,-2.0 2,-0.0 3,-0.7 0.124 74.4 111.5-113.2 2.3 3.5 14.8 -0.3 23 23 A L T 3 + 0 0 0 1,-0.2 34,-0.1 -4,-0.2 -3,-0.1 -0.499 54.2 87.8 -81.5 67.7 1.1 11.8 0.2 24 24 A D T 3 S+ 0 0 50 -2,-2.0 2,-0.3 32,-0.2 -1,-0.2 0.606 92.1 26.0-134.6 -48.5 -2.0 14.1 0.0 25 25 A D S < S+ 0 0 101 -3,-0.7 2,-0.3 32,-0.1 32,-0.2 -0.664 101.0 107.6-122.1 65.7 -3.0 14.5 -3.7 26 26 A T E -A 56 0A 11 30,-1.0 30,-3.0 -2,-0.3 2,-0.3 -0.833 50.1-152.1-135.7 171.1 -1.6 11.2 -5.0 27 27 A S E +A 55 0A 33 -2,-0.3 116,-2.4 28,-0.2 2,-0.3 -0.989 14.3 173.9-156.1 148.9 -3.0 7.8 -6.2 28 28 A W E -AB 54 142A 0 26,-2.1 26,-2.9 114,-0.3 2,-0.4 -0.968 20.6-139.7-158.7 154.5 -1.5 4.3 -6.2 29 29 A V E -AB 53 141A 33 112,-2.2 112,-2.4 -2,-0.3 2,-0.4 -0.988 22.3-126.0-134.9 129.2 -2.5 0.7 -7.0 30 30 A L E + B 0 140A 6 22,-2.5 22,-0.5 -2,-0.4 110,-0.3 -0.728 35.2 164.3 -76.8 130.3 -1.5 -2.4 -4.9 31 31 A S E + 0 0 76 108,-2.6 2,-0.3 -2,-0.4 109,-0.2 0.567 61.8 17.4-123.0 -16.4 0.1 -5.0 -7.1 32 32 A A E - B 0 139A 45 107,-1.5 107,-2.1 10,-0.1 2,-0.4 -0.980 53.9-163.4-156.6 147.3 1.9 -7.3 -4.6 33 33 A W E - B 0 138A 4 8,-0.3 8,-2.8 -2,-0.3 2,-0.3 -0.980 10.6-168.2-135.7 115.2 1.7 -8.1 -0.9 34 34 A K E -CB 40 137A 107 103,-2.6 103,-2.8 -2,-0.4 6,-0.3 -0.811 20.3-124.0-100.3 145.7 4.5 -10.0 0.9 35 35 A Q - 0 0 76 4,-2.1 -1,-0.0 -2,-0.3 5,-0.0 -0.403 34.6 -97.3 -79.5 167.1 4.2 -11.4 4.4 36 36 A A S S+ 0 0 45 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.800 126.7 40.6 -58.7 -33.7 6.6 -10.5 7.2 37 37 A D S S- 0 0 163 2,-0.1 -1,-0.2 0, 0.0 99,-0.0 0.838 131.5 -88.7 -85.4 -30.2 8.7 -13.7 6.6 38 38 A G S S+ 0 0 36 1,-0.2 2,-0.7 99,-0.0 -2,-0.1 0.356 72.8 146.0 139.6 -0.7 8.4 -13.4 2.8 39 39 A T - 0 0 78 -5,-0.1 -4,-2.1 1,-0.1 2,-0.6 -0.511 45.3-137.9 -64.8 108.6 5.2 -15.3 1.6 40 40 A A B -C 34 0A 70 -2,-0.7 -6,-0.3 -6,-0.3 -1,-0.1 -0.619 23.8-143.5 -61.5 110.1 3.9 -13.5 -1.4 41 41 A R - 0 0 92 -8,-2.8 2,-0.5 -2,-0.6 -8,-0.3 -0.159 21.1 -98.2 -63.7 171.7 0.1 -13.4 -0.7 42 42 A A + 0 0 89 -10,-0.1 -1,-0.1 58,-0.1 -10,-0.1 -0.873 47.9 175.9 -97.8 127.1 -2.4 -13.8 -3.6 43 43 A V - 0 0 34 -2,-0.5 2,-1.0 -12,-0.2 58,-0.1 -0.895 39.3 -95.0-129.8 155.2 -3.9 -10.4 -4.7 44 44 A P - 0 0 12 0, 0.0 8,-0.6 0, 0.0 26,-0.1 -0.640 38.1-154.1 -74.3 103.5 -6.3 -9.4 -7.6 45 45 A S > - 0 0 59 -2,-1.0 3,-2.4 6,-0.1 4,-0.4 -0.397 34.8-101.4 -61.1 158.2 -4.2 -8.4 -10.6 46 46 A A T 3 S+ 0 0 79 1,-0.3 3,-0.4 2,-0.2 -1,-0.1 0.669 121.3 66.5 -63.7 -17.1 -6.0 -6.0 -12.9 47 47 A D T 3 S+ 0 0 154 1,-0.2 -1,-0.3 3,-0.1 -2,-0.0 0.544 89.5 68.9 -72.4 -12.1 -6.8 -8.9 -15.3 48 48 A Q S < S- 0 0 150 -3,-2.4 -1,-0.2 53,-0.0 -2,-0.2 0.703 111.6-106.2 -94.0 -22.0 -9.1 -10.4 -12.6 49 49 A G S S+ 0 0 68 -3,-0.4 -3,-0.1 -4,-0.4 -2,-0.1 0.261 99.0 44.8 124.4 -9.4 -11.9 -7.8 -12.6 50 50 A A S S- 0 0 18 -5,-0.4 20,-0.3 18,-0.0 -4,-0.1 -0.464 70.8-168.8-157.8 76.2 -11.6 -5.6 -9.4 51 51 A P - 0 0 36 0, 0.0 2,-0.8 0, 0.0 -6,-0.1 -0.211 32.3-101.5 -67.9 161.0 -8.0 -4.5 -8.7 52 52 A I + 0 0 0 -8,-0.6 -22,-2.5 -22,-0.5 2,-0.3 -0.760 49.5 174.8 -89.2 107.0 -6.9 -2.9 -5.4 53 53 A T E -AD 29 68A 40 15,-1.7 15,-1.4 -2,-0.8 2,-0.3 -0.826 16.3-160.3-112.4 154.3 -6.6 0.9 -5.9 54 54 A L E -AD 28 67A 3 -26,-2.9 -26,-2.1 -2,-0.3 2,-0.4 -0.979 4.4-169.5-131.2 143.1 -5.9 3.8 -3.4 55 55 A T E -AD 27 66A 48 11,-2.8 11,-2.4 -2,-0.3 2,-0.5 -0.999 3.5-170.4-137.3 128.6 -6.7 7.5 -4.0 56 56 A L E +AD 26 65A 1 -30,-3.0 -30,-1.0 -2,-0.4 2,-0.3 -0.998 37.1 111.6-120.1 118.6 -5.5 10.4 -1.7 57 57 A S E S- D 0 64A 31 7,-0.7 2,-1.7 -2,-0.5 7,-1.0 -0.923 81.8 -88.0-168.7 168.4 -7.0 13.8 -2.4 58 58 A T S > S+ 0 0 72 -2,-0.3 3,-1.6 1,-0.2 5,-0.2 -0.266 70.3 146.4 -75.3 48.7 -9.4 16.3 -0.8 59 59 A S T 3 S+ 0 0 86 -2,-1.7 -1,-0.2 5,-0.5 4,-0.1 0.714 75.6 36.5 -69.9 -20.7 -12.1 14.3 -2.5 60 60 A T T 3 S- 0 0 88 2,-0.8 -1,-0.3 -3,-0.3 3,-0.1 0.286 128.2 -97.2 -98.2 -0.0 -14.6 15.0 0.3 61 61 A G S < S+ 0 0 49 -3,-1.6 2,-0.2 1,-0.3 -2,-0.1 0.064 106.3 75.2 91.4 -17.2 -13.1 18.5 0.7 62 62 A Q S S- 0 0 139 -5,-0.1 2,-1.9 2,-0.0 -2,-0.8 -0.694 106.5 -76.8-122.5 170.2 -11.0 17.0 3.6 63 63 A R S S+ 0 0 146 -2,-0.2 15,-1.4 -5,-0.2 2,-0.5 -0.476 73.1 153.9 -71.5 81.5 -7.9 14.7 3.9 64 64 A H E -DE 57 77A 52 -2,-1.9 -7,-0.7 -7,-1.0 -5,-0.5 -0.969 36.9-146.8-126.3 113.4 -9.9 11.5 3.1 65 65 A A E +DE 56 76A 0 11,-2.5 11,-1.7 -2,-0.5 2,-0.3 -0.490 23.6 175.9 -66.6 148.6 -8.4 8.5 1.6 66 66 A S E +DE 55 75A 26 -11,-2.4 -11,-2.8 9,-0.2 2,-0.3 -0.935 12.0 124.3-147.2 165.7 -10.7 6.5 -0.8 67 67 A G E -DE 54 74A 2 7,-1.5 7,-1.9 -2,-0.3 2,-0.5 -0.970 56.4 -83.7 165.5-174.7 -10.2 3.4 -2.9 68 68 A F E +DE 53 73A 46 -15,-1.4 -15,-1.7 -2,-0.3 2,-0.5 -0.996 39.0 178.5-122.7 114.0 -11.3 -0.1 -3.9 69 69 A S - 0 0 0 3,-2.2 2,-0.7 -2,-0.5 3,-0.2 -0.863 67.9 -26.3-125.6 94.4 -9.8 -2.8 -1.6 70 70 A G S S- 0 0 1 -2,-0.5 33,-0.2 -20,-0.3 32,-0.1 -0.921 122.2 -42.1 111.0-101.9 -11.0 -6.3 -2.4 71 71 A a S S+ 0 0 21 31,-0.8 2,-0.4 -2,-0.7 -1,-0.2 -0.055 126.1 76.6-138.1 26.0 -14.4 -6.0 -4.1 72 72 A N S S- 0 0 10 30,-0.2 -3,-2.2 -3,-0.2 2,-0.2 -0.996 80.1-121.7-140.8 128.5 -15.7 -3.3 -1.7 73 73 A R E -E 68 0A 131 -2,-0.4 20,-0.6 -5,-0.3 -5,-0.3 -0.598 28.7-162.7 -73.4 147.8 -14.8 0.4 -1.7 74 74 A Y E +EF 67 92A 3 -7,-1.9 -7,-1.5 -2,-0.2 2,-0.3 -0.673 11.8 172.9-123.7 169.3 -13.2 1.9 1.4 75 75 A M E +EF 66 91A 81 16,-1.9 16,-1.6 -9,-0.2 -9,-0.2 -0.948 11.4 132.4-161.2 169.1 -12.7 5.5 2.8 76 76 A G E -E 65 0A 3 -11,-1.7 -11,-2.5 -2,-0.3 14,-0.2 -0.794 50.4 -70.1 156.2 173.6 -11.4 7.3 5.9 77 77 A S E -E 64 0A 51 12,-0.4 11,-2.7 -13,-0.3 2,-0.3 -0.344 41.8-166.7 -79.5 165.4 -9.2 10.2 7.1 78 78 A Y E -I 87 0B 8 -15,-1.4 2,-0.3 9,-0.3 9,-0.3 -0.861 8.9-162.9-140.3 174.5 -5.3 10.2 7.1 79 79 A A E -I 86 0B 27 7,-2.2 7,-2.4 -2,-0.3 2,-0.5 -0.952 17.5-130.0-155.7 150.8 -2.3 12.2 8.5 80 80 A L E +I 85 0B 45 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.913 44.0 129.4-109.7 128.6 1.4 12.4 7.7 81 81 A K E > +I 84 0B 107 3,-1.5 3,-2.8 -2,-0.5 -2,-0.1 -0.935 58.7 21.5-164.1 162.2 4.1 12.0 10.3 82 82 A D T 3 S- 0 0 130 1,-0.3 3,-0.1 -2,-0.3 -2,-0.0 0.624 125.0 -63.9 52.2 22.6 7.4 10.1 11.1 83 83 A G T 3 S+ 0 0 18 1,-0.3 -1,-0.3 -63,-0.1 2,-0.2 0.601 118.0 98.8 76.6 12.8 7.9 9.4 7.3 84 84 A K E < S-I 81 0B 45 -3,-2.8 -3,-1.5 -64,-0.1 2,-0.6 -0.731 76.0-117.3-125.0 171.0 4.7 7.3 7.3 85 85 A L E -I 80 0B 2 -2,-0.2 2,-0.2 -5,-0.2 -5,-0.2 -0.937 31.4-166.6-109.9 100.1 1.0 7.6 6.4 86 86 A S E -I 79 0B 27 -7,-2.4 -7,-2.2 -2,-0.6 2,-0.3 -0.628 7.6-149.7 -79.2 156.0 -1.2 7.2 9.4 87 87 A F E -I 78 0B 33 25,-0.3 -9,-0.3 -9,-0.3 3,-0.1 -0.826 2.3-144.2-120.4 159.1 -4.9 6.6 9.0 88 88 A G - 0 0 35 -11,-2.7 2,-1.1 -2,-0.3 -1,-0.1 0.009 66.7 -32.1 -88.9-156.0 -8.0 7.5 11.1 89 89 A T S S- 0 0 137 -2,-0.1 -12,-0.4 -11,-0.1 -1,-0.2 -0.622 76.6-178.2 -63.2 95.6 -11.2 5.4 11.5 90 90 A L + 0 0 40 -2,-1.1 2,-0.2 -14,-0.2 -14,-0.2 -0.346 13.9 133.8 -79.4 175.5 -11.3 3.8 8.0 91 91 A G E -F 75 0A 23 -16,-1.6 -16,-1.9 -2,-0.1 2,-0.1 -0.847 24.6-166.7 160.9 177.3 -14.0 1.4 6.7 92 92 A G E -F 74 0A 24 -2,-0.2 2,-0.3 -18,-0.2 -18,-0.2 -0.396 37.5 -65.7-150.3-132.2 -16.3 0.6 3.8 93 93 A T - 0 0 71 -20,-0.6 2,-1.3 -2,-0.1 -2,-0.0 -0.962 34.6-114.0-143.8 156.2 -19.4 -1.7 3.2 94 94 A R + 0 0 238 -2,-0.3 2,-0.1 -22,-0.1 -22,-0.1 -0.459 50.4 152.3-103.5 61.3 -20.2 -5.4 3.2 95 95 A M - 0 0 102 -2,-1.3 2,-0.4 -24,-0.0 -24,-0.1 -0.298 40.2-123.9 -71.0 172.1 -21.0 -6.1 -0.4 96 96 A A + 0 0 97 1,-0.1 -2,-0.0 -2,-0.1 -1,-0.0 -0.989 37.0 164.1-131.7 124.8 -20.3 -9.7 -1.7 97 97 A a - 0 0 47 -2,-0.4 4,-0.1 2,-0.2 -1,-0.1 0.240 41.4-136.4-118.2 8.4 -18.1 -10.8 -4.6 98 98 A M + 0 0 194 1,-0.1 3,-0.1 2,-0.1 -2,-0.1 0.781 66.3 114.9 44.7 41.1 -17.7 -14.6 -3.7 99 99 A T S >> S- 0 0 60 1,-0.1 4,-2.1 0, 0.0 3,-0.6 -0.945 78.0-123.0-142.0 156.1 -14.0 -14.4 -4.6 100 100 A P H 3> S+ 0 0 114 0, 0.0 4,-0.8 0, 0.0 -1,-0.1 0.875 118.2 48.7 -71.2 -36.9 -10.5 -14.6 -3.0 101 101 A G H 34 S+ 0 0 17 2,-0.1 -3,-0.1 1,-0.1 -31,-0.0 0.499 111.8 54.5 -80.3 -4.0 -9.7 -11.1 -4.3 102 102 A G H X4 S+ 0 0 3 -3,-0.6 3,-1.7 -31,-0.1 -31,-0.8 0.915 106.3 43.8 -85.5 -61.1 -13.1 -9.9 -2.9 103 103 A Q H >< S+ 0 0 166 -4,-2.1 3,-2.1 1,-0.3 4,-0.4 0.657 88.5 89.6 -63.0 -18.4 -12.9 -11.0 0.8 104 104 A I T 3X + 0 0 18 -4,-0.8 4,-2.8 1,-0.3 -1,-0.3 0.614 64.5 86.6 -61.3 -8.0 -9.3 -9.7 1.1 105 105 A E H <> S+ 0 0 36 -3,-1.7 4,-2.7 2,-0.2 -1,-0.3 0.927 86.2 54.4 -44.4 -48.7 -11.0 -6.4 2.1 106 106 A G H <> S+ 0 0 37 -3,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.928 112.2 40.0 -57.9 -52.4 -10.9 -7.8 5.6 107 107 A A H > S+ 0 0 30 -4,-0.4 4,-0.6 2,-0.2 -1,-0.2 0.876 113.4 55.9 -61.8 -43.9 -7.2 -8.5 5.6 108 108 A Y H >< S+ 0 0 4 -4,-2.8 3,-1.3 1,-0.2 4,-0.5 0.927 107.5 46.9 -62.2 -48.4 -6.4 -5.2 3.8 109 109 A L H >X S+ 0 0 41 -4,-2.7 3,-1.5 1,-0.3 4,-0.6 0.885 107.2 59.2 -59.8 -37.2 -8.1 -3.1 6.4 110 110 A N H 3< S+ 0 0 109 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.619 105.1 50.5 -66.5 -16.8 -6.3 -5.1 9.1 111 111 A A T << S+ 0 0 7 -3,-1.3 3,-0.4 -4,-0.6 -1,-0.3 0.438 97.2 67.3 -97.3 -7.2 -3.0 -4.0 7.5 112 112 A L T <4 S+ 0 0 10 -3,-1.5 -25,-0.3 -4,-0.5 3,-0.2 0.620 93.8 60.8 -83.7 -13.4 -4.1 -0.2 7.5 113 113 A T S < S+ 0 0 105 -4,-0.6 2,-0.3 1,-0.2 -1,-0.2 0.485 100.2 56.0 -87.1 -5.1 -3.9 -0.2 11.4 114 114 A H + 0 0 70 -3,-0.4 3,-0.2 1,-0.1 -1,-0.2 -0.744 54.6 149.7-134.3 78.6 -0.1 -1.1 11.5 115 115 A I + 0 0 16 -2,-0.3 17,-0.2 -3,-0.2 -30,-0.1 -0.197 17.5 141.3-103.7 35.6 1.9 1.5 9.4 116 116 A D S S+ 0 0 110 -32,-0.1 2,-0.3 14,-0.0 -1,-0.2 0.796 70.8 28.7 -65.0 -23.3 5.1 1.2 11.6 117 117 A R E S-G 131 0A 166 14,-1.3 14,-1.2 -3,-0.2 2,-0.3 -0.879 70.0-170.2-124.5 158.3 7.4 1.5 8.5 118 118 A T E -G 130 0A 20 -2,-0.3 2,-0.4 12,-0.2 12,-0.2 -0.866 6.2-166.3-155.6 124.8 6.8 3.2 5.1 119 119 A G E +G 129 0A 5 10,-3.1 10,-3.0 -2,-0.3 2,-0.3 -0.894 13.5 166.9-101.6 131.2 8.6 3.3 1.8 120 120 A V - 0 0 1 -2,-0.4 -104,-1.2 8,-0.3 2,-0.5 -0.977 16.2-168.4-137.5 138.3 8.0 5.8 -1.0 121 121 A Q + 0 0 57 6,-0.4 6,-0.5 -2,-0.3 -2,-0.0 -0.933 5.9 179.6-117.8 97.3 10.2 6.5 -4.1 122 122 A M + 0 0 53 -2,-0.5 2,-0.3 4,-0.1 4,-0.2 0.552 57.1 106.3 -76.7 -5.5 9.0 9.7 -5.7 123 123 A R S S- 0 0 207 2,-0.1 4,-0.3 4,-0.1 -2,-0.1 -0.569 86.2 -85.8 -58.7 127.1 11.8 9.0 -8.2 124 124 A A S S+ 0 0 75 -2,-0.3 -2,-0.1 1,-0.2 -1,-0.0 -0.724 121.2 55.5 -80.0 138.0 10.1 7.8 -11.4 125 125 A P S S- 0 0 111 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 0.042 97.7-154.3 -83.5 110.2 9.2 5.0 -12.1 126 126 A Q + 0 0 35 -4,-0.2 16,-1.9 15,-0.1 2,-0.4 -0.337 24.7 167.6 -68.7 129.7 7.4 5.6 -8.8 127 127 A Q E - H 0 141A 72 -6,-0.5 -6,-0.4 -4,-0.3 14,-0.2 -0.953 19.3-153.7-141.3 112.1 6.4 2.7 -6.6 128 128 A M E - H 0 140A 2 12,-0.8 12,-2.9 -2,-0.4 2,-0.3 -0.509 9.3-161.5 -76.0 157.1 5.3 3.2 -3.0 129 129 A Q E -GH 119 139A 47 -10,-3.0 -10,-3.1 10,-0.2 10,-0.2 -0.903 2.0-158.3-146.1 112.0 5.8 0.3 -0.5 130 130 A L E -GH 118 138A 5 8,-2.2 8,-2.7 -2,-0.3 2,-0.3 -0.584 8.7-163.9 -86.7 156.8 4.0 0.0 2.8 131 131 A V E -GH 117 137A 29 -14,-1.2 -14,-1.3 6,-0.2 6,-0.2 -0.995 8.0-140.6-142.7 137.8 5.4 -2.1 5.7 132 132 A L > - 0 0 15 4,-2.1 3,-1.3 -2,-0.3 -17,-0.2 -0.572 31.8-102.4 -99.5 167.3 3.7 -3.4 8.8 133 133 A D T 3 S+ 0 0 82 1,-0.3 -18,-0.1 -2,-0.2 -1,-0.1 0.673 122.9 54.6 -62.1 -19.9 4.9 -3.7 12.4 134 134 A N T 3 S- 0 0 116 -20,-0.1 -1,-0.3 2,-0.0 -99,-0.0 0.801 126.4-100.2 -75.3 -32.5 5.5 -7.5 11.8 135 135 A G S < S+ 0 0 31 -3,-1.3 -2,-0.2 1,-0.2 0, 0.0 0.357 71.5 151.5 116.6 0.5 7.7 -6.8 8.8 136 136 A D - 0 0 15 -5,-0.1 -4,-2.1 1,-0.0 2,-0.3 -0.252 31.3-148.0 -61.4 159.1 4.9 -7.5 6.2 137 137 A T E -BH 34 131A 35 -103,-2.8 -103,-2.6 -6,-0.2 2,-0.4 -0.977 16.2-166.9-138.4 141.1 5.3 -5.6 2.8 138 138 A L E -BH 33 130A 5 -8,-2.7 -8,-2.2 -2,-0.3 2,-0.6 -0.948 12.4-154.0-132.8 111.4 2.9 -4.1 0.2 139 139 A T E -BH 32 129A 38 -107,-2.1 -108,-2.6 -2,-0.4 -107,-1.5 -0.786 17.1-175.6 -88.5 118.7 4.2 -3.0 -3.2 140 140 A F E -BH 30 128A 0 -12,-2.9 -12,-0.8 -2,-0.6 -110,-0.3 -0.918 18.4-140.3-110.3 139.8 2.1 -0.3 -4.9 141 141 A D E -BH 29 127A 67 -112,-2.4 -112,-2.2 -2,-0.4 2,-0.3 -0.610 28.4-114.3 -77.0 154.0 2.5 1.3 -8.3 142 142 A R E -B 28 0A 56 -16,-1.9 2,-0.3 -114,-0.2 -114,-0.3 -0.650 29.9-166.1 -69.8 147.5 1.9 5.0 -8.6 143 143 A S + 0 0 58 -116,-2.4 -89,-0.1 -2,-0.3 -2,-0.0 -0.849 21.1 162.6-138.8 101.4 -1.1 5.6 -10.8 144 144 A T 0 0 107 -2,-0.3 -1,-0.1 -118,-0.1 -116,-0.1 0.478 360.0 360.0 -81.3 -5.3 -1.4 9.2 -11.9 145 145 A R 0 0 277 -3,-0.1 -2,-0.0 -118,-0.0 -3,-0.0 0.209 360.0 360.0 57.7 360.0 -3.8 8.5 -14.7