==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 11-JUL-05 2CZ7 . COMPND 2 MOLECULE: NITRILE HYDRATASE SUBUNIT ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOCOCCUS ERYTHROPOLIS; . AUTHOR M.NOJIRI,Y.KAWANO,K.HASHIMOTO,N.KAMIYA,RIKEN STRUCTURAL . 409 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16656.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 258 63.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 4.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 6.8 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 24 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.4 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 2 2 3 1 2 2 0 2 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 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 PARALLEL BRIDGES PER LADDER . 3 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 9 A E 0 0 217 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 5.2 124.5 12.6 -4.7 2 10 A N + 0 0 120 1,-0.2 2,-0.0 0, 0.0 0, 0.0 0.564 360.0 155.3 66.8 10.8 121.7 14.2 -2.6 3 11 A A - 0 0 59 1,-0.1 -1,-0.2 0, 0.0 260,-0.1 -0.306 48.9-101.2 -68.6 149.0 120.9 10.8 -1.0 4 12 A A - 0 0 63 1,-0.1 -1,-0.1 259,-0.1 2,-0.1 -0.379 41.1-106.7 -63.3 145.9 119.2 10.4 2.4 5 13 A P - 0 0 49 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.428 41.6 -94.4 -67.6 152.5 121.5 9.5 5.3 6 14 A A + 0 0 75 -2,-0.1 2,-0.3 295,-0.0 293,-0.0 -0.520 55.6 176.5 -62.5 134.5 121.3 6.0 6.7 7 15 A Q - 0 0 46 -2,-0.2 294,-0.2 294,-0.1 3,-0.1 -0.991 32.2-120.9-147.2 138.1 118.9 5.9 9.6 8 16 A A - 0 0 8 292,-2.8 5,-0.1 -2,-0.3 290,-0.1 -0.260 62.8 -68.8 -62.4 159.7 117.4 3.3 11.9 9 17 A P >> - 0 0 82 0, 0.0 4,-2.1 0, 0.0 3,-0.6 -0.264 46.8-122.0 -53.6 139.1 113.5 3.1 11.8 10 18 A V H 3> S+ 0 0 33 1,-0.3 4,-3.1 2,-0.2 5,-0.2 0.880 112.1 56.4 -56.0 -38.4 112.0 6.2 13.3 11 19 A S H 3> S+ 0 0 47 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.905 107.9 48.6 -58.0 -40.7 110.1 4.2 15.9 12 20 A D H <> S+ 0 0 75 -3,-0.6 4,-1.9 2,-0.2 -1,-0.2 0.890 113.2 47.7 -67.9 -38.7 113.4 2.7 17.1 13 21 A R H X S+ 0 0 7 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.919 112.5 47.5 -65.5 -47.3 115.0 6.1 17.2 14 22 A A H X S+ 0 0 0 -4,-3.1 4,-2.1 2,-0.2 -2,-0.2 0.938 115.1 45.1 -61.6 -47.1 112.1 7.8 19.1 15 23 A W H X S+ 0 0 74 -4,-2.4 4,-3.0 -5,-0.2 -1,-0.2 0.859 109.6 56.8 -67.1 -32.4 111.9 4.9 21.7 16 24 A A H X S+ 0 0 0 -4,-1.9 4,-2.8 -5,-0.2 -1,-0.2 0.918 106.3 49.9 -61.2 -45.3 115.7 5.0 22.0 17 25 A L H X S+ 0 0 2 -4,-2.3 4,-1.8 2,-0.2 5,-0.2 0.938 112.8 47.5 -56.8 -49.1 115.5 8.7 23.0 18 26 A F H X S+ 0 0 26 -4,-2.1 4,-3.2 1,-0.2 5,-0.2 0.949 114.6 44.9 -55.1 -53.5 112.8 7.8 25.6 19 27 A R H X S+ 0 0 109 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.865 108.9 56.0 -64.6 -37.9 114.8 4.9 27.0 20 28 A A H < S+ 0 0 5 -4,-2.8 -1,-0.2 -5,-0.2 4,-0.2 0.907 117.4 35.3 -60.1 -43.9 118.1 6.8 27.2 21 29 A L H ><>S+ 0 0 1 -4,-1.8 5,-2.0 -5,-0.2 3,-1.2 0.896 118.8 49.6 -76.0 -43.8 116.5 9.5 29.3 22 30 A D H ><5S+ 0 0 69 -4,-3.2 3,-1.7 1,-0.3 5,-0.2 0.883 105.0 59.0 -67.0 -35.2 114.2 7.3 31.2 23 31 A G T 3<5S+ 0 0 66 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.617 103.9 52.9 -66.3 -15.3 117.1 4.9 32.1 24 32 A K T < 5S- 0 0 101 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.2 0.290 118.2-110.2-103.3 6.6 118.9 7.8 33.7 25 33 A G T < 5S+ 0 0 68 -3,-1.7 -3,-0.2 -4,-0.1 -2,-0.1 0.643 84.2 124.0 74.5 18.8 115.9 8.7 36.0 26 34 A L < + 0 0 57 -5,-2.0 -4,-0.2 1,-0.1 -3,-0.1 0.530 56.5 67.4 -90.5 -8.2 115.3 12.0 34.0 27 35 A V S S- 0 0 7 -6,-0.4 3,-0.1 -5,-0.2 -1,-0.1 -0.956 84.4-129.2-115.8 113.5 111.7 11.3 33.1 28 36 A P > - 0 0 52 0, 0.0 3,-2.0 0, 0.0 4,-0.3 -0.154 42.8 -79.1 -55.5 151.5 109.2 11.3 36.0 29 37 A D T 3 S+ 0 0 167 1,-0.3 0, 0.0 2,-0.1 0, 0.0 -0.311 116.5 2.5 -50.9 132.6 106.8 8.3 36.3 30 38 A G T 3> S+ 0 0 46 -3,-0.1 4,-2.3 1,-0.1 -1,-0.3 0.579 93.5 133.4 66.5 12.8 103.9 8.5 33.9 31 39 A Y H <> S+ 0 0 32 -3,-2.0 4,-1.8 2,-0.2 5,-0.1 0.953 72.9 33.5 -64.2 -58.0 105.3 11.8 32.4 32 40 A V H > S+ 0 0 1 -4,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.860 117.8 56.4 -68.3 -32.7 105.1 11.2 28.7 33 41 A E H > S+ 0 0 108 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.906 106.4 50.4 -63.6 -41.3 101.9 9.1 29.2 34 42 A G H X S+ 0 0 34 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.905 111.4 47.2 -63.1 -44.2 100.3 12.1 30.9 35 43 A W H X S+ 0 0 41 -4,-1.8 4,-3.2 2,-0.2 5,-0.3 0.904 108.5 55.1 -62.2 -43.1 101.3 14.5 28.1 36 44 A K H X S+ 0 0 39 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.946 109.5 48.3 -54.3 -47.2 99.9 12.0 25.5 37 45 A K H X>S+ 0 0 115 -4,-2.2 4,-2.7 1,-0.2 5,-0.6 0.914 112.9 46.9 -59.5 -48.2 96.6 12.1 27.4 38 46 A T H X>S+ 0 0 39 -4,-2.2 5,-2.4 1,-0.2 4,-1.5 0.919 113.7 48.0 -58.0 -48.9 96.6 15.9 27.5 39 47 A F H <5S+ 0 0 1 -4,-3.2 75,-0.4 1,-0.2 -1,-0.2 0.864 119.9 38.6 -60.4 -39.7 97.5 16.2 23.8 40 48 A E H <5S+ 0 0 69 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.830 131.8 19.0 -82.0 -33.6 94.8 13.7 22.8 41 49 A E H <5S+ 0 0 110 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.758 125.5 36.4-116.2 -34.2 92.0 14.6 25.2 42 50 A D T <> - 0 0 28 66,-1.5 3,-1.5 -2,-0.6 4,-0.8 -0.996 61.2-132.3-156.4 137.6 90.7 20.3 21.5 45 53 A P H 3> S+ 0 0 25 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.643 103.0 78.0 -65.5 -14.3 89.1 22.5 18.8 46 54 A R H 3> S+ 0 0 104 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.826 91.4 53.0 -58.9 -32.2 85.8 21.8 20.7 47 55 A R H <> S+ 0 0 51 -3,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.947 108.3 47.3 -68.7 -47.9 87.1 24.5 23.2 48 56 A G H X S+ 0 0 0 63,-1.7 4,-2.3 -4,-0.8 -2,-0.2 0.909 110.8 54.1 -56.2 -42.4 87.6 27.0 20.4 49 57 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 62,-0.2 -1,-0.2 0.899 106.5 50.8 -58.2 -44.2 84.1 26.1 19.2 50 58 A E H X S+ 0 0 51 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.898 109.7 50.7 -58.7 -44.5 82.7 26.8 22.6 51 59 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.899 110.9 48.3 -62.8 -42.2 84.4 30.2 22.7 52 60 A V H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.930 110.7 49.9 -64.1 -48.0 83.0 31.2 19.2 53 61 A A H X S+ 0 0 0 -4,-2.5 4,-1.1 2,-0.2 -1,-0.2 0.880 112.3 48.7 -60.3 -40.1 79.5 30.1 20.1 54 62 A R H >X S+ 0 0 57 -4,-2.1 4,-1.3 2,-0.2 3,-0.7 0.943 111.5 48.8 -63.1 -48.8 79.7 32.2 23.3 55 63 A A H 3< S+ 0 0 0 -4,-2.6 3,-0.3 1,-0.2 7,-0.3 0.880 108.7 55.2 -55.2 -40.9 81.0 35.2 21.4 56 64 A W H 3< S+ 0 0 7 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.776 119.0 31.3 -65.7 -27.1 78.2 34.8 18.8 57 65 A T H << S+ 0 0 54 -4,-1.1 -1,-0.2 -3,-0.7 -2,-0.2 0.415 116.1 57.4-111.9 -3.1 75.5 35.0 21.5 58 66 A D X - 0 0 43 -4,-1.3 4,-2.5 -3,-0.3 3,-0.2 -0.833 56.9-169.9-137.1 93.3 77.1 37.3 24.1 59 67 A P H > S+ 0 0 103 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.841 90.0 54.0 -52.6 -37.5 78.2 40.8 22.8 60 68 A E H > S+ 0 0 166 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.925 111.7 42.8 -64.3 -47.1 80.1 41.5 26.1 61 69 A F H > S+ 0 0 4 -3,-0.2 4,-3.2 2,-0.2 -1,-0.2 0.864 110.4 57.2 -65.3 -37.4 82.1 38.3 25.8 62 70 A R H X S+ 0 0 74 -4,-2.5 4,-2.1 -7,-0.3 -2,-0.2 0.923 108.1 47.9 -59.8 -43.4 82.7 38.9 22.1 63 71 A Q H X S+ 0 0 122 -4,-2.1 4,-1.0 -5,-0.2 -2,-0.2 0.894 112.9 47.3 -64.2 -42.0 84.2 42.3 23.0 64 72 A L H >X S+ 0 0 47 -4,-2.0 4,-3.2 2,-0.2 3,-0.6 0.932 110.6 52.8 -62.8 -46.2 86.4 40.7 25.7 65 73 A L H 3< S+ 0 0 0 -4,-3.2 23,-0.7 1,-0.2 -2,-0.2 0.902 112.5 44.9 -56.3 -43.3 87.5 37.9 23.3 66 74 A L H 3< S+ 0 0 48 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.638 122.6 35.4 -77.9 -16.0 88.6 40.5 20.6 67 75 A T H << S+ 0 0 89 -4,-1.0 -2,-0.2 -3,-0.6 -3,-0.2 0.766 136.4 12.8-108.1 -35.7 90.4 42.9 23.1 68 76 A D X + 0 0 78 -4,-3.2 4,-2.0 -5,-0.2 3,-0.2 -0.640 66.1 173.0-142.0 77.3 92.0 40.5 25.6 69 77 A G H > S+ 0 0 3 17,-0.5 4,-2.8 1,-0.2 5,-0.2 0.871 79.1 58.6 -54.0 -42.0 91.7 37.0 24.2 70 78 A T H > S+ 0 0 27 16,-1.0 4,-2.3 1,-0.2 -1,-0.2 0.921 107.2 45.5 -53.6 -51.9 93.9 35.7 27.0 71 79 A A H > S+ 0 0 32 -3,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.902 112.9 51.0 -59.0 -44.6 91.4 36.9 29.7 72 80 A A H >X S+ 0 0 0 -4,-2.0 3,-0.5 -8,-0.3 4,-0.5 0.940 112.9 44.5 -58.8 -50.8 88.4 35.6 27.7 73 81 A V H ><>S+ 0 0 0 -4,-2.8 5,-2.0 1,-0.2 3,-1.3 0.871 107.2 60.5 -62.0 -38.6 90.0 32.1 27.3 74 82 A A H ><5S+ 0 0 46 -4,-2.3 3,-0.9 1,-0.3 -1,-0.2 0.800 92.8 66.2 -60.8 -31.9 91.1 32.1 31.0 75 83 A Q H <<5S+ 0 0 117 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.797 106.3 42.1 -60.0 -31.0 87.4 32.4 32.1 76 84 A Y T <<5S- 0 0 50 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.2 0.478 115.6-117.5 -89.4 -8.7 86.9 28.9 30.6 77 85 A G T < 5S+ 0 0 54 -3,-0.9 -3,-0.2 -4,-0.5 -2,-0.1 0.760 75.1 131.3 74.4 28.1 90.2 27.6 32.1 78 86 A Y < + 0 0 40 -5,-2.0 -4,-0.2 -31,-0.1 2,-0.1 0.275 26.0 115.0-102.1 10.0 91.5 27.0 28.6 79 87 A L + 0 0 68 -6,-0.2 5,-0.2 -5,-0.1 3,-0.0 -0.474 40.3 130.9 -68.8 150.1 95.0 28.6 28.8 80 88 A G B > -A 83 0A 16 3,-1.2 3,-1.8 -2,-0.1 31,-0.1 -0.971 56.3 -24.7-175.9-173.1 97.8 26.2 28.4 81 89 A P T 3 S+ 0 0 39 0, 0.0 28,-0.0 0, 0.0 0, 0.0 -0.287 130.8 10.2 -53.2 134.5 101.1 25.3 26.7 82 90 A Q T 3 S+ 0 0 24 27,-0.1 27,-0.8 26,-0.1 25,-0.1 0.758 125.7 70.3 59.6 29.5 101.3 27.1 23.3 83 91 A G B < +A 80 0A 2 -3,-1.8 -3,-1.2 25,-0.2 3,-0.2 -0.093 54.7 111.0-165.4 50.7 98.2 29.1 24.3 84 92 A E S S+ 0 0 145 1,-0.3 2,-0.5 73,-0.3 74,-0.1 0.655 82.0 41.3-104.5 -25.2 99.2 31.5 27.1 85 93 A Y S S- 0 0 18 72,-0.5 74,-2.1 2,-0.0 2,-0.4 -0.937 81.4-170.9-125.5 104.4 98.9 34.8 25.1 86 94 A I E -b 159 0B 3 -2,-0.5 -16,-1.0 72,-0.2 -17,-0.5 -0.829 15.8-177.8-107.4 133.0 95.7 34.6 22.9 87 95 A V E -b 160 0B 23 72,-1.9 74,-1.6 -2,-0.4 2,-0.4 -0.992 12.3-157.2-123.9 121.6 94.5 36.9 20.2 88 96 A A E -b 161 0B 5 -23,-0.7 2,-0.5 -2,-0.4 74,-0.2 -0.817 11.0-149.2 -93.1 135.9 91.2 36.2 18.4 89 97 A V E -b 162 0B 9 72,-2.7 74,-3.1 -2,-0.4 2,-0.5 -0.933 10.7-132.7-115.7 130.2 90.9 37.8 15.0 90 98 A E E -b 163 0B 94 -2,-0.5 2,-0.2 72,-0.2 75,-0.1 -0.680 7.8-148.4 -92.5 118.0 87.5 38.8 13.7 91 99 A D - 0 0 11 72,-2.4 5,-0.2 -2,-0.5 98,-0.0 -0.537 23.5-176.9 -69.5 147.9 86.2 37.9 10.2 92 100 A T B > -C 95 0C 34 3,-2.4 3,-1.6 -2,-0.2 73,-0.1 -0.842 46.9 -87.8-137.7 171.8 83.9 40.6 8.7 93 101 A P T 3 S+ 0 0 91 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 0.750 132.4 33.4 -55.6 -18.9 81.8 40.9 5.5 94 102 A T T 3 S+ 0 0 87 1,-0.1 54,-2.3 53,-0.1 2,-0.4 0.217 115.3 60.7-119.7 12.5 85.0 42.4 3.9 95 103 A L E < -Cd 92 148C 21 -3,-1.6 -3,-2.4 52,-0.2 2,-0.5 -0.957 50.3-172.6-148.4 125.5 87.8 40.5 5.7 96 104 A K E - d 0 149C 8 52,-3.2 54,-2.6 -2,-0.4 2,-0.3 -0.981 16.8-153.9-116.3 123.5 88.7 36.8 6.0 97 105 A N E - d 0 150C 2 -2,-0.5 2,-0.3 52,-0.2 54,-0.2 -0.740 12.1-177.2 -97.4 144.8 91.5 35.8 8.4 98 106 A V E - d 0 151C 0 52,-2.3 54,-3.4 -2,-0.3 2,-0.4 -0.994 12.8-144.9-142.6 141.5 93.7 32.8 8.1 99 107 A I E + d 0 152C 4 89,-2.4 2,-0.3 -2,-0.3 54,-0.2 -0.879 25.1 154.3-112.4 140.8 96.5 31.4 10.4 100 108 A V E - d 0 153C 0 52,-2.3 54,-3.2 -2,-0.4 2,-0.4 -0.950 36.8-140.6-146.1 165.4 99.8 29.7 9.6 101 109 A C > - 0 0 0 18,-0.4 3,-0.8 -2,-0.3 52,-0.1 -0.847 21.2-178.9-124.4 95.0 103.2 29.1 11.1 102 110 A S T 3 S+ 0 0 0 -2,-0.4 103,-0.7 1,-0.2 -1,-0.1 0.819 79.6 51.5 -63.3 -29.4 105.5 29.4 8.0 103 111 A L T 3 S- 0 0 4 51,-0.2 -1,-0.2 101,-0.1 52,-0.1 0.606 135.2 -38.9 -86.9 -15.0 108.6 28.7 10.1 104 112 A X S < S- 0 0 9 -3,-0.8 -3,-0.2 50,-0.1 21,-0.1 -0.192 88.9 -61.4-167.1 -91.5 107.4 25.5 11.8 105 113 A S + 0 0 3 49,-0.2 -3,-0.1 -5,-0.1 15,-0.1 0.323 55.5 169.1-165.7 8.6 103.9 24.7 13.2 106 114 A X + 0 0 9 48,-0.3 2,-0.3 2,-0.0 48,-0.2 -0.059 14.7 159.5 -45.7 129.8 103.0 27.2 15.9 107 115 A T - 0 0 6 -25,-0.1 2,-2.2 52,-0.1 54,-0.1 -0.974 55.3-100.8-155.9 144.2 99.3 26.8 16.8 108 116 A A >> - 0 0 1 52,-0.5 4,-2.1 -2,-0.3 3,-1.1 -0.503 48.3-175.1 -71.5 75.3 97.1 27.7 19.8 109 117 A W H 3> + 0 0 9 -2,-2.2 4,-2.2 -27,-0.8 -1,-0.2 0.821 68.3 54.1 -45.5 -50.1 97.2 24.1 21.0 110 118 A P H 34 S+ 0 0 1 0, 0.0 -66,-1.5 0, 0.0 -1,-0.2 0.821 122.0 26.9 -65.8 -26.8 94.8 24.1 24.0 111 119 A I H <4 S+ 0 0 1 -3,-1.1 -63,-1.7 -68,-0.2 -62,-0.2 0.572 133.0 33.1-110.6 -16.2 91.8 25.7 22.1 112 120 A L H < S- 0 0 5 -4,-2.1 -3,-0.2 -65,-0.1 76,-0.1 0.541 105.4-123.1-107.8 -15.9 92.5 24.5 18.5 113 121 A G < - 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0 0 31 -107,-0.1 -1,-0.3 4,-0.0 4,-0.1 -0.247 49.3 -22.1 75.8-166.3 92.6 10.9 11.9 224 26 B P - 0 0 83 0, 0.0 3,-0.1 0, 0.0 -184,-0.0 -0.228 68.6-103.9 -71.7 166.0 93.7 10.6 15.5 225 27 B T S S+ 0 0 56 1,-0.2 2,-0.5 -185,-0.1 -185,-0.0 0.924 112.9 35.4 -54.0 -45.4 96.1 13.1 17.1 226 28 B F - 0 0 11 1,-0.1 -1,-0.2 -190,-0.0 3,-0.0 -0.948 63.9-167.5-118.1 129.6 98.9 10.7 16.8 227 29 B H S S+ 0 0 105 -2,-0.5 2,-0.3 -4,-0.1 -1,-0.1 0.469 77.3 35.5 -96.2 -5.9 99.2 8.4 13.8 228 30 B A S > S- 0 0 30 -217,-0.0 3,-1.4 1,-0.0 4,-0.3 -0.975 85.7-112.5-144.0 158.0 102.0 6.2 15.3 229 31 B E T 3 S+ 0 0 136 -2,-0.3 3,-0.2 1,-0.3 4,-0.0 0.669 114.3 48.7 -67.7 -18.0 102.7 5.0 18.8 230 32 B W T > S+ 0 0 21 1,-0.1 3,-2.0 2,-0.1 -1,-0.3 0.542 82.3 95.3 -91.7 -12.3 105.9 7.0 19.1 231 33 B E T < S+ 0 0 33 -3,-1.4 4,-0.5 1,-0.3 -1,-0.1 0.709 77.9 57.5 -64.7 -21.3 104.5 10.4 17.9 232 34 B H T 3> S+ 0 0 9 -4,-0.3 4,-2.1 -3,-0.2 -1,-0.3 0.653 90.7 79.0 -77.5 -16.5 103.8 11.9 21.4 233 35 B L H <> S+ 0 0 1 -3,-2.0 4,-3.4 2,-0.2 5,-0.4 0.922 83.4 55.4 -64.0 -48.6 107.4 11.4 22.4 234 36 B P H > S+ 0 0 1 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.934 115.9 37.4 -52.0 -50.6 109.1 14.4 20.7 235 37 B Y H > S+ 0 0 4 -4,-0.5 4,-2.3 2,-0.2 -2,-0.2 0.912 118.4 50.3 -65.0 -43.7 106.7 17.0 22.4 236 38 B S H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.931 114.6 43.3 -59.8 -46.9 106.6 15.1 25.7 237 39 B L H X S+ 0 0 0 -4,-3.4 4,-2.7 2,-0.2 -1,-0.2 0.803 109.1 58.1 -74.0 -29.8 110.4 14.8 25.9 238 40 B M H X S+ 0 0 10 -4,-2.1 4,-2.6 -5,-0.4 -1,-0.2 0.945 108.8 46.0 -57.1 -48.3 110.8 18.5 24.8 239 41 B F H X>S+ 0 0 20 -4,-2.3 4,-3.1 2,-0.2 5,-0.8 0.876 109.9 53.4 -66.8 -36.9 108.8 19.5 27.8 240 42 B A H X>S+ 0 0 0 -4,-2.0 5,-2.9 3,-0.2 4,-1.5 0.963 111.8 46.8 -55.9 -51.2 110.8 17.1 30.0 241 43 B G H <5S+ 0 0 0 -4,-2.7 6,-2.3 3,-0.2 7,-0.9 0.892 121.1 36.5 -56.9 -43.8 113.9 18.9 28.7 242 44 B V H <5S+ 0 0 44 -4,-2.6 -2,-0.2 4,-0.2 -3,-0.2 0.970 131.3 22.5 -76.1 -53.2 112.4 22.4 29.2 243 45 B A H <5S+ 0 0 69 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.790 131.6 30.9 -93.0 -33.1 110.4 22.0 32.4 244 46 B E T < - 0 0 17 116,-0.3 4,-1.2 -2,-0.3 3,-0.2 -0.622 33.8-111.4 -98.8 165.1 114.5 26.4 26.0 250 52 B V H >> S+ 0 0 29 1,-0.2 4,-2.0 -2,-0.2 3,-0.5 0.905 120.3 58.1 -58.8 -38.6 111.6 26.0 23.5 251 53 B D H 3> S+ 0 0 16 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.866 100.4 55.7 -62.2 -38.3 113.5 28.4 21.2 252 54 B E H 3> S+ 0 0 16 113,-0.3 4,-2.6 1,-0.2 -1,-0.3 0.823 105.0 53.7 -61.9 -33.0 116.6 26.1 21.3 253 55 B V H < S+ 0 0 5 -4,-1.8 3,-1.7 1,-0.2 -1,-0.2 0.916 107.4 53.5 -67.2 -41.6 115.4 21.7 13.9 258 60 B E H 3< S+ 0 0 12 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.802 103.1 61.5 -58.6 -27.4 116.5 24.7 11.7 259 61 B R T 3< S+ 0 0 13 -4,-1.5 46,-2.3 -5,-0.1 -1,-0.3 0.452 73.9 119.7 -83.7 -1.1 120.0 23.2 12.0 260 62 B M S < S- 0 0 5 -3,-1.7 44,-0.1 44,-0.3 5,-0.1 -0.368 86.3 -91.5 -57.2 140.1 119.0 19.8 10.4 261 63 B E > - 0 0 55 42,-0.3 4,-2.9 1,-0.1 5,-0.2 -0.364 45.7-116.0 -51.2 134.8 121.1 19.3 7.3 262 64 B P H > S+ 0 0 59 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.867 112.6 43.4 -53.3 -47.1 118.9 20.9 4.5 263 65 B R H > S+ 0 0 124 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.901 113.8 53.2 -63.4 -40.0 118.2 17.8 2.5 264 66 B H H >> S+ 0 0 5 1,-0.2 4,-0.7 2,-0.2 3,-0.6 0.953 109.2 49.2 -57.4 -50.2 117.6 15.9 5.7 265 67 B Y H >< S+ 0 0 4 -4,-2.9 3,-1.2 1,-0.2 -2,-0.2 0.930 109.3 52.8 -52.4 -47.5 115.1 18.5 6.8 266 68 B M H 3< S+ 0 0 90 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.714 113.8 40.3 -69.7 -25.8 113.2 18.3 3.4 267 69 B M H << S+ 0 0 92 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.388 96.6 96.5-102.3 3.6 112.7 14.5 3.5 268 70 B T S << S- 0 0 5 -3,-1.2 5,-0.1 -4,-0.7 -4,-0.0 -0.823 74.3-121.6-104.0 125.4 111.9 14.2 7.2 269 71 B P > - 0 0 80 0, 0.0 4,-1.9 0, 0.0 3,-0.5 -0.238 33.9-105.5 -58.2 150.2 108.3 14.1 8.5 270 72 B Y H > S+ 0 0 22 1,-0.2 4,-1.3 2,-0.2 3,-0.4 0.867 115.9 43.7 -43.0 -60.4 107.4 16.7 11.1 271 73 B Y H > S+ 0 0 13 1,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.845 111.3 55.8 -64.3 -32.8 107.4 14.7 14.3 272 74 B E H > S+ 0 0 16 -3,-0.5 4,-2.6 1,-0.2 -1,-0.3 0.850 99.6 59.9 -66.2 -35.1 110.6 12.9 13.3 273 75 B R H X S+ 0 0 6 -4,-1.9 4,-2.6 -3,-0.4 -1,-0.2 0.915 107.0 47.7 -56.3 -39.3 112.3 16.3 12.9 274 76 B Y H X S+ 0 0 10 -4,-1.3 4,-2.7 2,-0.2 5,-0.3 0.832 107.9 53.2 -74.1 -31.9 111.5 16.9 16.6 275 77 B V H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 5,-0.2 0.953 113.7 44.4 -61.0 -50.1 112.8 13.5 17.7 276 78 B I H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 28,-0.4 0.913 115.5 48.6 -58.7 -43.5 116.0 14.4 15.9 277 79 B G H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.932 112.7 44.8 -64.8 -50.1 116.1 17.9 17.3 278 80 B V H X S+ 0 0 1 -4,-2.7 4,-2.6 2,-0.2 5,-0.2 0.928 113.8 51.1 -63.5 -44.2 115.5 16.9 21.0 279 81 B A H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.3 -1,-0.2 0.926 109.7 51.1 -56.1 -44.0 118.0 14.1 20.7 280 82 B T H X S+ 0 0 2 -4,-2.3 4,-3.2 1,-0.2 -2,-0.2 0.939 110.3 48.3 -59.3 -48.5 120.6 16.6 19.3 281 83 B L H X S+ 0 0 3 -4,-2.5 4,-2.8 1,-0.2 6,-0.3 0.913 109.0 53.5 -58.6 -43.6 120.0 19.0 22.2 282 84 B M H <>S+ 0 0 0 -4,-2.6 5,-2.0 1,-0.2 6,-1.9 0.871 113.4 43.2 -61.6 -38.3 120.4 16.2 24.7 283 85 B V H ><5S+ 0 0 39 -4,-2.1 3,-1.8 4,-0.2 -2,-0.2 0.948 114.0 50.3 -68.2 -48.7 123.7 15.2 23.1 284 86 B E H 3<5S+ 0 0 88 -4,-3.2 -2,-0.2 1,-0.3 -3,-0.2 0.843 109.6 50.8 -59.2 -36.7 124.8 18.9 22.8 285 87 B K T 3<5S- 0 0 89 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.379 116.3-115.0 -84.1 1.8 124.0 19.6 26.5 286 88 B G T < 5S+ 0 0 65 -3,-1.8 -3,-0.2 2,-0.2 -2,-0.1 0.633 86.2 115.1 77.5 15.0 126.0 16.5 27.6 287 89 B I S - 0 0 74 -2,-0.3 4,-1.6 1,-0.1 5,-0.1 -0.864 18.5-129.4-112.8 153.6 125.7 10.5 23.9 290 92 B Q H > S+ 0 0 71 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.884 109.5 59.4 -67.7 -33.1 125.1 9.7 20.3 291 93 B D H > S+ 0 0 119 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.893 104.8 47.2 -63.3 -38.7 126.7 6.4 20.8 292 94 B E H > S+ 0 0 43 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.871 111.8 51.4 -73.2 -32.0 124.1 5.4 23.5 293 95 B L H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.912 112.7 45.3 -65.5 -41.5 121.3 6.6 21.2 294 96 B E H X>S+ 0 0 57 -4,-2.6 5,-1.6 2,-0.2 4,-1.5 0.871 112.5 51.4 -71.8 -35.7 122.6 4.5 18.3 295 97 B S H <5S+ 0 0 87 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.943 114.7 42.6 -61.2 -47.3 123.2 1.5 20.6 296 98 B L H <5S+ 0 0 63 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.874 116.3 48.1 -68.4 -37.0 119.6 1.7 21.9 297 99 B A H <5S- 0 0 4 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.699 104.3-129.9 -76.7 -20.9 118.2 2.4 18.4 298 100 B G T <5S+ 0 0 70 -4,-1.5 -3,-0.2 1,-0.2 -4,-0.1 0.756 76.7 22.7 75.4 27.4 120.1 -0.5 16.9 299 101 B G S - 0 0 90 -2,-0.2 3,-2.0 1,-0.1 29,-0.3 -0.795 33.3 -85.0-113.5 157.0 102.4 52.5 19.0 323 125 B V T 3 S+ 0 0 97 -2,-0.3 29,-0.2 1,-0.2 3,-0.1 -0.344 116.8 26.7 -56.8 132.3 99.4 51.1 17.1 324 126 B G T 3 S+ 0 0 49 27,-3.2 -1,-0.2 1,-0.3 28,-0.1 0.137 90.6 130.0 99.7 -17.7 99.1 52.8 13.7 325 127 B Q < - 0 0 89 -3,-2.0 26,-2.6 25,-0.1 2,-0.4 -0.372 58.6-123.9 -74.2 145.0 102.8 53.6 13.4 326 128 B R E +F 350 0C 138 24,-0.2 83,-1.7 83,-0.1 2,-0.3 -0.774 35.7 178.6 -88.8 131.4 104.7 52.7 10.3 327 129 B V E -FG 349 408C 0 22,-2.9 22,-2.5 -2,-0.4 2,-0.4 -0.936 21.6-142.8-132.6 155.7 107.8 50.5 10.9 328 130 B R E -FG 348 407C 69 79,-3.0 79,-1.6 -2,-0.3 2,-0.5 -0.952 25.9-119.0-115.5 138.7 110.4 48.8 8.7 329 131 B V E - G 0 406C 0 18,-2.4 17,-1.0 -2,-0.4 77,-0.2 -0.665 46.2-101.2 -73.6 124.5 111.9 45.4 9.5 330 132 B R - 0 0 39 75,-2.9 2,-2.0 -2,-0.5 16,-0.3 -0.181 25.7-125.4 -52.9 133.6 115.6 45.9 10.1 331 133 B D + 0 0 113 14,-0.2 2,-0.3 15,-0.1 -1,-0.2 -0.555 63.8 134.9 -83.1 74.5 117.7 45.0 7.0 332 134 B E - 0 0 69 -2,-2.0 2,-0.5 73,-0.1 14,-0.0 -0.923 49.5-142.1-127.1 149.1 119.9 42.6 9.0 333 135 B Y - 0 0 150 -2,-0.3 -2,-0.0 12,-0.0 0, 0.0 -0.966 16.2-171.6-115.2 125.0 121.2 39.1 8.3 334 136 B V - 0 0 12 -2,-0.5 -134,-0.1 2,-0.1 4,-0.1 -0.969 12.9-166.5-121.0 113.9 121.4 36.7 11.3 335 137 B P S S+ 0 0 88 0, 0.0 -27,-0.2 0, 0.0 -26,-0.1 0.753 76.4 54.4 -72.2 -23.8 123.1 33.3 10.8 336 138 B G S S- 0 0 0 1,-0.2 -2,-0.1 -28,-0.1 27,-0.1 -0.026 112.9 -35.4 -92.3-160.2 121.7 31.9 14.1 337 139 B H + 0 0 0 26,-0.2 2,-0.3 25,-0.2 -1,-0.2 -0.317 63.0 163.8 -64.9 135.2 118.1 31.7 15.3 338 140 B I - 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