==== 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 OXIDOREDUCTASE 30-APR-06 2GUG . COMPND 2 MOLECULE: FORMATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS SP.; . AUTHOR E.V.FILIPPOVA,K.M.POLYAKOV,T.V.TIKHONOVA,K.M.BOIKO,V.I.TISHK . 1468 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 54883.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 974 66.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 218 14.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 2.2 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 . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 4 0.3 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 . 98 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 176 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 337 23.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 31 2.1 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 6 6 16 2 0 4 8 0 0 0 0 0 2 2 0 2 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 16 3 3 19 11 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 . 7 5 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 3 5 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 A 0 0 52 0, 0.0 68,-3.1 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 154.5 22.5 -13.4 49.3 2 2 A K E -a 69 0A 29 87,-0.3 89,-2.4 66,-0.2 90,-1.4 -0.952 360.0-165.0-106.0 122.2 20.2 -13.0 52.3 3 3 A V E -ab 70 92A 0 66,-3.0 68,-2.7 -2,-0.5 2,-0.6 -0.951 3.0-159.7-110.5 126.7 16.6 -12.1 51.3 4 4 A L E -ab 71 93A 0 88,-3.4 90,-2.6 -2,-0.5 2,-0.5 -0.949 10.7-173.5-115.0 117.2 14.3 -10.8 54.1 5 5 A C E -ab 72 94A 0 66,-3.5 68,-2.8 -2,-0.6 2,-0.4 -0.942 8.6-161.7-122.2 111.2 10.7 -11.1 53.2 6 6 A V E +a 73 0A 0 88,-3.1 90,-0.4 -2,-0.5 2,-0.3 -0.850 20.1 167.8 -97.3 133.9 7.9 -9.7 55.5 7 7 A L - 0 0 0 66,-2.3 45,-0.2 -2,-0.4 46,-0.1 -0.934 34.9 -97.9-141.5 160.7 4.4 -11.0 54.9 8 8 A Y B -g 52 0B 4 43,-1.7 45,-2.0 -2,-0.3 91,-0.1 -0.277 53.1 -82.7 -77.1 160.3 0.9 -10.9 56.7 9 9 A D - 0 0 90 43,-0.2 911,-0.5 65,-0.1 -1,-0.1 -0.293 44.5-104.9 -58.0 151.2 -0.3 -13.7 59.0 10 10 A D - 0 0 34 1,-0.1 911,-0.2 42,-0.1 5,-0.1 -0.199 55.8 -73.6 -56.1 161.3 -2.0 -16.8 57.7 11 11 A P > - 0 0 7 0, 0.0 3,-2.5 0, 0.0 -1,-0.1 -0.288 45.5-112.0 -59.9 152.8 -5.8 -17.1 58.1 12 12 A V T 3 S+ 0 0 100 1,-0.3 3,-0.1 -3,-0.1 -2,-0.1 0.741 119.8 52.9 -66.6 -22.4 -6.9 -17.8 61.7 13 13 A D T 3 S- 0 0 147 1,-0.3 -1,-0.3 0, 0.0 2,-0.1 0.202 123.1 -97.8 -92.5 16.7 -8.0 -21.3 60.5 14 14 A G < - 0 0 35 -3,-2.5 -1,-0.3 2,-0.1 3,-0.1 -0.148 55.7 -38.6 102.7 169.0 -4.7 -22.0 59.0 15 15 A Y S S- 0 0 47 -5,-0.1 2,-0.1 1,-0.1 -5,-0.0 -0.544 81.7 -94.0 -70.6 136.9 -3.0 -21.9 55.7 16 16 A P - 0 0 23 0, 0.0 33,-0.1 0, 0.0 -1,-0.1 -0.321 31.4-167.5 -64.5 131.6 -5.6 -23.1 53.1 17 17 A K S S+ 0 0 175 1,-0.2 2,-0.3 -2,-0.1 -2,-0.0 0.966 79.4 10.6 -74.6 -59.7 -5.6 -26.8 52.2 18 18 A T S S- 0 0 111 30,-0.0 2,-0.3 2,-0.0 -1,-0.2 -0.843 76.5-137.7-115.8 156.9 -7.9 -26.3 49.2 19 19 A Y - 0 0 34 -2,-0.3 906,-0.1 2,-0.2 29,-0.1 -0.774 26.2-107.6-108.8 159.3 -9.1 -23.2 47.4 20 20 A A S S+ 0 0 11 904,-0.4 2,-0.2 -2,-0.3 905,-0.1 0.838 99.9 21.6 -41.8 -49.2 -12.4 -22.0 46.0 21 21 A R S S- 0 0 14 26,-0.1 -2,-0.2 995,-0.1 995,-0.1 -0.780 70.8-125.1-127.0 171.7 -11.4 -22.4 42.3 22 22 A D S S- 0 0 114 993,-0.4 2,-0.3 -2,-0.2 994,-0.1 0.504 82.1 -11.5 -97.6 -7.5 -8.7 -24.4 40.2 23 23 A D - 0 0 82 24,-0.1 -1,-0.1 22,-0.0 24,-0.1 -0.971 66.0 -98.9-171.9-178.8 -7.0 -21.5 38.4 24 24 A L - 0 0 33 -2,-0.3 907,-0.1 22,-0.1 903,-0.0 -0.837 41.5 -95.4-119.4 151.3 -7.0 -17.8 37.4 25 25 A P - 0 0 27 0, 0.0 2,-0.4 0, 0.0 907,-0.1 -0.283 41.7-108.4 -56.3 150.1 -8.2 -16.1 34.2 26 26 A K - 0 0 183 905,-0.3 2,-0.4 0, 0.0 0, 0.0 -0.707 30.9-162.7 -76.2 132.8 -5.6 -15.2 31.5 27 27 A I - 0 0 24 -2,-0.4 9,-0.2 1,-0.2 3,-0.1 -0.986 7.0-160.0-117.6 131.7 -4.8 -11.6 31.2 28 28 A D - 0 0 133 -2,-0.4 8,-0.6 1,-0.2 2,-0.2 0.992 62.9 -38.8 -73.1 -59.1 -3.1 -10.4 28.1 29 29 A H B -H 35 0C 93 6,-0.2 6,-0.2 7,-0.0 -1,-0.2 -0.717 66.5 -86.9-150.4-173.6 -1.6 -7.1 29.2 30 30 A Y > - 0 0 0 4,-2.5 3,-2.4 -2,-0.2 4,-0.1 -0.820 61.3 -77.1-105.7 149.6 -2.5 -4.1 31.3 31 31 A P T 3 S+ 0 0 50 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 -0.265 126.3 32.7 -39.7 117.2 -4.5 -1.2 29.9 32 32 A G T 3 S- 0 0 89 1,-0.1 0, 0.0 -2,-0.0 0, 0.0 0.458 127.5 -84.6 100.3 0.6 -2.0 0.8 27.9 33 33 A G S < S+ 0 0 45 -3,-2.4 -1,-0.1 1,-0.3 0, 0.0 0.210 74.2 150.4 91.9 -13.4 0.0 -2.3 26.9 34 34 A Q - 0 0 28 -3,-0.2 -4,-2.5 -4,-0.1 -1,-0.3 -0.326 46.7-123.8 -50.3 132.3 2.4 -2.9 29.8 35 35 A T B -H 29 0C 72 -6,-0.2 -6,-0.2 1,-0.1 3,-0.1 -0.342 21.9 -97.0 -80.2 161.8 3.0 -6.6 29.8 36 36 A L - 0 0 38 -8,-0.6 -1,-0.1 1,-0.2 -6,-0.0 -0.288 62.9 -69.6 -67.6 159.1 2.4 -9.0 32.7 37 37 A P - 0 0 18 0, 0.0 -1,-0.2 0, 0.0 305,-0.1 -0.172 46.2-151.3 -54.3 151.9 5.4 -9.9 34.9 38 38 A T + 0 0 85 -3,-0.1 304,-0.1 304,-0.1 2,-0.0 -0.501 24.5 164.8-126.2 64.4 8.0 -12.1 33.0 39 39 A P - 0 0 32 0, 0.0 3,-0.1 0, 0.0 306,-0.1 -0.355 49.2-116.3 -75.3 166.2 9.9 -14.3 35.5 40 40 A K S S- 0 0 172 1,-0.3 2,-0.3 304,-0.1 305,-0.0 0.822 91.7 -22.9 -68.9 -31.3 11.9 -17.2 34.0 41 41 A A - 0 0 46 300,-0.1 2,-0.3 2,-0.0 -1,-0.3 -0.975 59.5-133.8-164.5 160.6 9.6 -19.5 36.0 42 42 A I - 0 0 60 -2,-0.3 16,-0.1 -3,-0.1 17,-0.1 -0.924 2.0-156.5-119.7 157.7 7.2 -19.6 39.0 43 43 A D S S+ 0 0 67 15,-0.4 2,-0.3 -2,-0.3 18,-0.1 -0.210 70.1 70.7-117.7 39.8 6.9 -22.2 41.7 44 44 A F S S- 0 0 18 13,-0.1 -2,-0.1 293,-0.0 6,-0.0 -0.929 81.1-114.5-143.3 169.3 3.4 -21.7 42.8 45 45 A T > - 0 0 85 -2,-0.3 3,-2.3 -22,-0.0 -2,-0.0 -0.961 42.7-111.8-107.3 119.2 0.0 -22.3 41.2 46 46 A P T 3 S+ 0 0 51 0, 0.0 288,-0.1 0, 0.0 3,-0.1 -0.251 106.4 46.2 -54.2 128.1 -1.6 -19.0 40.6 47 47 A G T 3 S+ 0 0 9 1,-0.6 -26,-0.1 286,-0.4 287,-0.1 0.044 84.0 117.3 117.6 -25.1 -4.6 -18.8 43.0 48 48 A Q S < S- 0 0 61 -3,-2.3 2,-0.6 1,-0.1 -1,-0.6 -0.370 80.4 -99.3 -65.7 157.5 -2.6 -20.0 46.1 49 49 A L + 0 0 0 1,-0.2 -1,-0.1 -33,-0.1 284,-0.1 -0.732 54.1 161.6 -82.3 116.2 -2.3 -17.7 49.0 50 50 A L + 0 0 1 -2,-0.6 7,-3.3 7,-0.1 8,-0.2 0.627 57.2 65.1-114.2 -22.0 1.2 -16.2 48.5 51 51 A G S S+ 0 0 0 5,-0.2 -43,-1.7 280,-0.1 2,-0.3 0.336 86.1 81.8 -96.3 2.7 1.3 -13.0 50.6 52 52 A S B >> S-g 8 0B 0 -45,-0.2 4,-1.6 868,-0.1 3,-1.6 -0.711 97.8 -95.5 -97.9 163.1 0.9 -14.7 54.0 53 53 A V T 34 S+ 0 0 39 -45,-2.0 -44,-0.1 1,-0.3 3,-0.1 0.783 123.0 47.1 -49.4 -40.4 3.9 -16.2 55.9 54 54 A S T 34 S+ 0 0 60 1,-0.2 -1,-0.3 2,-0.1 -45,-0.1 0.714 108.9 55.6 -80.4 -17.1 3.3 -19.8 54.7 55 55 A G T X4 S- 0 0 7 -3,-1.6 3,-3.0 2,-0.1 -1,-0.2 0.755 79.7-169.1 -79.8 -30.6 2.9 -18.7 51.1 56 56 A E G >< - 0 0 42 -4,-1.6 3,-2.6 1,-0.3 4,-0.2 0.715 63.9 -78.8 54.3 29.5 6.3 -17.0 51.1 57 57 A L G 3 S- 0 0 1 -7,-3.3 -1,-0.3 -5,-0.4 287,-0.1 0.693 75.7 -81.4 45.8 21.0 5.5 -15.3 47.7 58 58 A G G < S+ 0 0 15 -3,-3.0 -15,-0.4 -8,-0.2 4,-0.3 0.731 104.3 125.0 62.1 26.8 6.5 -18.8 46.4 59 59 A L <> + 0 0 1 -3,-2.6 4,-2.7 -4,-0.1 5,-0.3 0.516 37.4 87.6 -95.1 -11.6 10.1 -17.8 46.7 60 60 A R H > S+ 0 0 70 -4,-0.2 4,-2.7 2,-0.2 5,-0.4 0.976 90.2 40.8 -58.0 -65.6 11.7 -20.6 48.9 61 61 A K H > S+ 0 0 143 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.922 119.8 48.2 -51.0 -45.9 12.7 -23.3 46.5 62 62 A Y H > S+ 0 0 12 -4,-0.3 4,-0.6 1,-0.2 -1,-0.2 0.940 114.1 42.4 -64.2 -51.0 13.9 -20.8 44.0 63 63 A L H ><>S+ 0 0 0 -4,-2.7 5,-2.3 1,-0.2 3,-0.9 0.949 119.4 43.9 -61.4 -49.8 16.0 -18.6 46.3 64 64 A E H ><5S+ 0 0 93 -4,-2.7 3,-2.5 -5,-0.3 -2,-0.2 0.869 106.1 58.7 -67.7 -42.2 17.6 -21.6 48.1 65 65 A S H 3<5S+ 0 0 86 -4,-3.0 -1,-0.3 -5,-0.4 -2,-0.2 0.657 105.7 54.3 -60.6 -15.0 18.3 -23.6 45.0 66 66 A N T <<5S- 0 0 95 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.264 126.7-101.1-101.6 14.8 20.4 -20.6 44.0 67 67 A G T < 5S+ 0 0 68 -3,-2.5 -3,-0.2 1,-0.3 2,-0.2 0.491 81.1 129.5 82.0 5.1 22.4 -20.6 47.1 68 68 A H < - 0 0 28 -5,-2.3 2,-0.4 -6,-0.2 -1,-0.3 -0.519 54.6-126.9 -89.1 159.7 20.5 -17.8 48.8 69 69 A T E -a 2 0A 79 -68,-3.1 -66,-3.0 -2,-0.2 2,-0.4 -0.858 17.9-162.7 -98.3 141.3 18.9 -17.5 52.2 70 70 A L E -a 3 0A 6 -2,-0.4 2,-0.6 -68,-0.2 -66,-0.2 -0.982 4.3-171.9-122.4 113.8 15.2 -16.5 52.6 71 71 A V E -a 4 0A 34 -68,-2.7 -66,-3.5 -2,-0.4 2,-0.5 -0.945 9.0-167.0-100.1 119.4 13.9 -15.3 56.0 72 72 A V E +a 5 0A 27 -2,-0.6 2,-0.3 -68,-0.2 -66,-0.2 -0.920 18.0 160.9-106.7 126.2 10.1 -14.9 56.0 73 73 A T E -a 6 0A 15 -68,-2.8 -66,-2.3 -2,-0.5 -2,-0.0 -0.992 43.3-164.9-142.8 153.4 8.6 -13.0 58.9 74 74 A S S S+ 0 0 33 -2,-0.3 2,-1.0 -68,-0.2 -65,-0.1 0.503 73.7 98.4-102.8 -6.0 5.5 -11.2 60.1 75 75 A D + 0 0 73 1,-0.2 8,-2.5 8,-0.0 9,-0.2 -0.669 39.9 132.7 -87.3 99.7 7.4 -9.7 62.9 76 76 A K + 0 0 10 -2,-1.0 2,-0.5 6,-0.2 26,-0.2 0.367 30.6 101.4-132.7 -2.2 8.3 -6.1 61.7 77 77 A D S S- 0 0 104 3,-0.1 3,-0.2 24,-0.1 5,-0.1 -0.830 79.7 -6.4-100.1 128.7 7.5 -3.5 64.3 78 78 A G S > S- 0 0 34 -2,-0.5 3,-1.0 1,-0.2 6,-0.5 0.107 88.8 -71.3 83.1 169.5 10.4 -2.1 66.5 79 79 A P T 3 S+ 0 0 87 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.593 126.4 58.8 -76.8 -15.6 14.2 -3.0 66.9 80 80 A D T 3 S+ 0 0 143 -3,-0.2 2,-0.2 4,-0.1 -2,-0.1 0.097 85.4 111.3 -97.6 21.7 13.5 -6.2 68.7 81 81 A S S <> S- 0 0 1 -3,-1.0 4,-2.4 1,-0.1 5,-0.3 -0.599 81.6-117.7 -90.3 157.5 11.6 -7.6 65.8 82 82 A V H > S+ 0 0 50 -2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.902 115.3 55.9 -54.1 -38.4 12.7 -10.4 63.5 83 83 A F H > S+ 0 0 0 -8,-2.5 4,-1.3 2,-0.2 -1,-0.2 0.960 111.1 38.1 -61.4 -55.7 12.7 -7.8 60.7 84 84 A E H > S+ 0 0 33 -6,-0.5 4,-1.1 1,-0.2 3,-0.3 0.940 117.5 50.7 -67.4 -41.2 15.0 -5.3 62.2 85 85 A R H < S+ 0 0 177 -4,-2.4 -1,-0.2 1,-0.2 4,-0.2 0.863 117.0 39.9 -61.8 -35.0 17.3 -7.9 63.7 86 86 A E H >< S+ 0 0 51 -4,-2.1 3,-0.6 -5,-0.3 4,-0.3 0.635 103.8 74.9 -88.3 -12.0 17.6 -9.8 60.4 87 87 A L H >< S+ 0 0 0 -4,-1.3 3,-2.1 -3,-0.3 26,-0.3 0.906 73.4 75.2 -66.0 -49.5 17.8 -6.5 58.5 88 88 A V T 3< S+ 0 0 50 -4,-1.1 24,-1.4 1,-0.3 25,-0.8 0.717 112.8 25.2 -36.8 -39.5 21.5 -5.4 59.4 89 89 A D T < S+ 0 0 72 -3,-0.6 -1,-0.3 -4,-0.2 -87,-0.3 0.291 91.7 122.4-115.0 11.2 22.9 -8.1 56.9 90 90 A A < - 0 0 0 -3,-2.1 23,-0.2 -4,-0.3 -87,-0.2 -0.527 41.8-165.8 -74.2 136.3 20.0 -8.5 54.4 91 91 A D S S+ 0 0 21 -89,-2.4 24,-2.6 1,-0.3 25,-1.7 0.678 78.7 30.3 -87.5 -27.3 20.9 -7.8 50.8 92 92 A V E -bc 3 116A 0 -90,-1.4 -88,-3.4 23,-0.2 2,-0.4 -0.997 63.7-166.4-141.6 129.5 17.2 -7.7 49.7 93 93 A V E -bc 4 117A 2 23,-2.5 25,-3.8 -2,-0.4 2,-0.4 -0.982 8.8-176.5-116.8 130.7 14.0 -6.7 51.6 94 94 A I E +bc 5 118A 0 -90,-2.6 -88,-3.1 -2,-0.4 2,-0.3 -0.986 12.7 151.0-120.3 132.6 10.6 -7.4 50.4 95 95 A S E - c 0 119A 2 23,-1.8 25,-2.6 -2,-0.4 -88,-0.1 -0.971 34.4-124.6-148.0 169.7 7.3 -6.4 51.9 96 96 A Q B > -I 99 0D 0 3,-0.6 3,-1.6 -90,-0.4 25,-0.2 -0.814 25.8-120.5-107.2 148.4 3.7 -5.6 50.7 97 97 A P T 3 S+ 0 0 26 0, 0.0 24,-0.1 0, 0.0 -1,-0.1 0.682 114.1 68.1 -57.5 -14.8 1.8 -2.4 51.3 98 98 A F T 3 S+ 0 0 11 1,-0.3 821,-0.1 232,-0.1 229,-0.1 0.693 124.2 8.0 -82.2 -14.1 -0.7 -4.8 53.0 99 99 A W B < S-I 96 0D 38 -3,-1.6 -3,-0.6 -93,-0.1 -1,-0.3 -0.498 94.9-163.9-157.0 72.6 1.8 -5.6 55.8 100 100 A P - 0 0 21 0, 0.0 2,-0.9 0, 0.0 -93,-0.1 -0.415 17.8-146.4 -82.5 137.6 4.6 -3.0 55.1 101 101 A A - 0 0 0 -2,-0.1 -24,-0.1 -95,-0.1 -95,-0.1 -0.856 30.7-132.4 -95.1 100.2 8.2 -3.3 56.6 102 102 A Y - 0 0 99 -2,-0.9 2,-0.8 -26,-0.2 25,-0.2 -0.249 14.0-158.2 -61.0 130.6 9.1 0.4 57.0 103 103 A L B +j 127 0E 1 23,-2.5 25,-2.6 4,-0.1 29,-0.1 -0.870 24.3 177.6-108.5 86.9 12.5 1.3 55.8 104 104 A T > - 0 0 46 -2,-0.8 4,-3.0 23,-0.2 5,-0.2 -0.442 45.7-100.1 -80.1 161.8 12.9 4.4 57.9 105 105 A P H > S+ 0 0 47 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.867 125.3 51.0 -57.2 -35.2 16.2 6.3 57.6 106 106 A E H > S+ 0 0 136 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.906 112.0 47.9 -69.7 -34.9 17.6 4.8 60.8 107 107 A R H > S+ 0 0 14 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.926 111.3 49.2 -67.8 -43.8 16.7 1.3 59.5 108 108 A I H < S+ 0 0 1 -4,-3.0 3,-0.4 1,-0.2 6,-0.2 0.919 110.1 52.0 -63.3 -40.4 18.3 1.9 56.1 109 109 A A H < S+ 0 0 58 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.849 111.7 46.3 -63.7 -36.4 21.4 3.2 57.8 110 110 A K H < S+ 0 0 87 -4,-1.7 2,-1.7 -5,-0.2 -1,-0.3 0.673 90.2 91.3 -75.9 -16.6 21.5 0.0 59.9 111 111 A A >< + 0 0 0 -4,-1.2 3,-0.9 -3,-0.4 -23,-0.2 -0.570 54.9 173.6 -83.7 85.3 20.9 -2.0 56.8 112 112 A K T 3 S+ 0 0 156 -2,-1.7 -1,-0.2 -24,-1.4 -23,-0.2 0.802 76.4 35.1 -73.4 -33.3 24.6 -2.6 56.0 113 113 A N T 3 S+ 0 0 68 -25,-0.8 -1,-0.3 -26,-0.3 2,-0.1 0.359 81.7 141.4 -94.8 2.9 24.1 -5.0 53.0 114 114 A L < + 0 0 9 -3,-0.9 -23,-0.2 -6,-0.2 -22,-0.2 -0.273 5.2 148.3 -57.4 115.6 20.9 -3.4 51.6 115 115 A K + 0 0 91 -24,-2.6 23,-3.3 1,-0.3 2,-0.4 0.688 64.8 31.0-109.5 -38.2 21.0 -3.5 47.8 116 116 A L E -cd 92 138A 0 -25,-1.7 -23,-2.5 21,-0.2 2,-0.6 -0.989 51.4-169.8-137.1 122.8 17.2 -3.9 46.9 117 117 A A E -cd 93 139A 3 21,-3.7 23,-1.9 -2,-0.4 2,-0.5 -0.956 25.2-166.5-111.5 109.4 14.1 -2.7 48.6 118 118 A L E -cd 94 140A 3 -25,-3.8 -23,-1.8 -2,-0.6 2,-0.8 -0.842 16.8-149.3-109.9 124.4 11.3 -4.4 46.8 119 119 A T E -cd 95 141A 0 21,-3.8 2,-1.5 -2,-0.5 23,-0.8 -0.818 5.3-155.1 -89.7 114.3 7.6 -3.7 47.0 120 120 A A S S+ 0 0 0 -25,-2.6 2,-0.3 -2,-0.8 219,-0.1 -0.673 85.9 11.5 -77.9 86.6 5.5 -6.8 46.5 121 121 A G S S- 0 0 0 -2,-1.5 21,-1.8 -25,-0.2 2,-0.3 -0.983 115.4 -28.8 130.9-146.4 2.6 -4.5 45.3 122 122 A I S S- 0 0 59 -2,-0.3 3,-0.3 19,-0.2 -2,-0.1 -0.815 88.0 -7.6-124.5 140.7 2.7 -0.8 44.4 123 123 A G - 0 0 16 -2,-0.3 19,-0.1 1,-0.2 239,-0.1 -0.144 63.0-102.6 81.1-169.1 4.6 2.2 45.4 124 124 A S > + 0 0 15 3,-0.1 3,-3.1 17,-0.1 -1,-0.2 -0.020 61.8 139.3-150.8 21.5 7.2 2.9 48.1 125 125 A D T 3 S+ 0 0 125 1,-0.3 -2,-0.1 -3,-0.3 4,-0.1 0.802 78.1 47.6 -46.2 -34.4 5.1 4.7 50.6 126 126 A H T 3 S+ 0 0 13 2,-0.1 -23,-2.5 -24,-0.1 2,-0.5 0.367 99.0 81.3 -92.2 1.5 6.8 2.8 53.4 127 127 A V B < S-j 103 0E 8 -3,-3.1 2,-1.1 -25,-0.2 -23,-0.2 -0.945 78.7-129.4-115.8 126.7 10.4 3.4 52.1 128 128 A D > - 0 0 59 -25,-2.6 4,-1.4 -2,-0.5 5,-0.2 -0.677 23.6-164.9 -73.1 100.2 12.3 6.6 52.8 129 129 A L H > S+ 0 0 44 -2,-1.1 4,-2.2 1,-0.2 -1,-0.2 0.825 80.8 58.4 -62.5 -38.0 13.4 7.4 49.2 130 130 A Q H > S+ 0 0 110 1,-0.2 4,-3.1 2,-0.2 3,-0.4 0.965 109.1 45.5 -53.7 -54.7 16.0 10.0 50.1 131 131 A S H > S+ 0 0 16 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.810 111.3 52.2 -59.2 -33.9 17.9 7.5 52.3 132 132 A A H <>S+ 0 0 1 -4,-1.4 5,-2.9 2,-0.2 -1,-0.3 0.870 112.8 45.7 -70.6 -35.0 17.6 4.8 49.6 133 133 A I H ><5S+ 0 0 22 -4,-2.2 3,-2.0 -3,-0.4 -2,-0.2 0.980 115.6 45.2 -69.9 -56.3 19.1 7.3 47.1 134 134 A D H 3<5S+ 0 0 120 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.856 117.3 46.5 -49.9 -42.5 21.9 8.4 49.5 135 135 A R T 3<5S- 0 0 80 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.277 109.9-120.1 -94.3 16.0 22.6 4.8 50.4 136 136 A N T < 5 + 0 0 106 -3,-2.0 2,-0.4 1,-0.2 -3,-0.2 0.848 58.6 153.0 48.6 40.9 22.6 3.5 46.8 137 137 A V < - 0 0 2 -5,-2.9 2,-0.4 -6,-0.1 -21,-0.2 -0.834 41.6-132.1 -94.0 134.7 19.6 1.1 47.4 138 138 A T E -d 116 0A 18 -23,-3.3 -21,-3.7 -2,-0.4 2,-0.5 -0.769 18.2-158.9 -88.7 134.5 17.5 0.1 44.5 139 139 A V E +dE 117 363A 0 224,-2.5 223,-3.0 -2,-0.4 224,-1.4 -0.970 14.8 175.7-119.0 121.2 13.7 0.4 45.1 140 140 A A E -dE 118 361A 0 -23,-1.9 -21,-3.8 -2,-0.5 2,-0.3 -0.903 12.0-169.8-128.7 153.6 11.4 -1.5 42.9 141 141 A E E -d 119 0A 30 219,-2.2 2,-1.4 -2,-0.3 -19,-0.2 -0.927 36.1-114.5-134.9 157.6 7.6 -2.1 42.7 142 142 A V > - 0 0 0 -21,-1.8 3,-2.0 -23,-0.8 4,-0.2 -0.608 46.7-147.3 -96.3 75.2 5.6 -4.5 40.7 143 143 A T T 3 S+ 0 0 2 -2,-1.4 217,-0.1 1,-0.3 -21,-0.1 0.002 71.5 6.5 -49.8 140.6 3.9 -1.7 38.8 144 144 A Y T > S+ 0 0 21 1,-0.1 3,-1.0 -108,-0.0 4,-0.5 0.254 86.4 128.5 70.1 -10.3 0.2 -2.3 37.7 145 145 A C T < S+ 0 0 0 -3,-2.0 193,-0.2 1,-0.3 194,-0.2 0.698 87.7 11.8 -55.2 -28.8 -0.1 -5.6 39.5 146 146 A N T 3> S+ 0 0 7 -4,-0.2 4,-2.3 2,-0.1 -1,-0.3 0.178 89.1 110.9-138.1 20.4 -3.3 -4.7 41.3 147 147 A S H <> S+ 0 0 4 -3,-1.0 4,-1.9 1,-0.2 -2,-0.1 0.890 87.5 46.6 -59.3 -39.8 -4.6 -1.5 39.7 148 148 A I H > S+ 0 0 1 -4,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.904 109.3 56.0 -72.8 -34.1 -7.5 -3.4 38.2 149 149 A S H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.890 108.4 46.0 -62.1 -45.2 -8.1 -5.1 41.6 150 150 A V H X S+ 0 0 10 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.953 109.7 55.8 -66.5 -40.1 -8.5 -1.8 43.4 151 151 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 5,-0.2 0.875 108.3 47.5 -59.9 -42.6 -10.8 -0.5 40.6 152 152 A E H X S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 5,-0.2 0.956 109.8 51.8 -59.5 -49.7 -13.2 -3.3 41.0 153 153 A H H X S+ 0 0 1 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.896 109.9 52.4 -59.9 -38.9 -13.2 -2.9 44.7 154 154 A V H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.967 112.5 41.1 -59.6 -52.4 -14.0 0.8 44.2 155 155 A V H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.880 113.5 55.8 -71.0 -33.3 -17.0 0.3 41.9 156 156 A M H X S+ 0 0 0 -4,-3.1 4,-2.4 -5,-0.2 -1,-0.2 0.975 111.6 43.9 -58.1 -53.9 -18.1 -2.6 44.1 157 157 A M H X S+ 0 0 0 -4,-2.8 4,-2.5 -5,-0.2 5,-0.3 0.871 110.5 54.5 -56.3 -38.6 -18.1 -0.1 47.1 158 158 A I H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.931 111.3 44.8 -66.5 -39.4 -19.8 2.6 45.1 159 159 A L H X S+ 0 0 0 -4,-2.2 4,-3.6 2,-0.2 -1,-0.2 0.925 113.7 50.2 -68.8 -41.6 -22.7 0.3 44.2 160 160 A S H X>S+ 0 0 2 -4,-2.4 5,-2.1 1,-0.2 4,-0.8 0.896 112.7 45.1 -70.9 -41.1 -23.0 -1.1 47.7 161 161 A L H ><5S+ 0 0 11 -4,-2.5 3,-0.9 -5,-0.2 -1,-0.2 0.964 116.2 45.8 -64.4 -45.3 -23.0 2.3 49.3 162 162 A V H 3<5S+ 0 0 0 -4,-2.5 25,-2.1 1,-0.3 -2,-0.2 0.959 119.3 40.5 -70.5 -42.2 -25.5 3.7 46.8 163 163 A R H 3<5S- 0 0 2 -4,-3.6 -1,-0.3 23,-0.2 -2,-0.2 0.518 105.4-124.9 -86.2 4.8 -27.8 0.7 47.0 164 164 A N T < + 0 0 0 -5,-2.1 4,-2.7 -6,-0.2 5,-0.2 0.923 58.2 55.9 -63.8 -48.6 -26.3 -3.3 50.2 166 166 A L H > S+ 0 0 7 -6,-0.3 4,-2.0 1,-0.3 -1,-0.2 0.906 112.5 38.3 -63.4 -50.4 -24.6 -4.0 53.5 167 167 A P H > S+ 0 0 37 0, 0.0 4,-2.5 0, 0.0 -1,-0.3 0.856 114.9 56.0 -62.5 -39.6 -27.4 -3.2 55.9 168 168 A S H X S+ 0 0 0 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.902 110.6 46.0 -53.6 -45.2 -29.9 -4.9 53.4 169 169 A H H X S+ 0 0 17 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.831 106.9 56.9 -69.3 -37.8 -27.7 -8.0 53.6 170 170 A E H X S+ 0 0 44 -4,-2.0 4,-1.6 -5,-0.2 6,-0.3 0.909 104.1 54.6 -60.2 -39.8 -27.5 -7.7 57.4 171 171 A W H <>S+ 0 0 77 -4,-2.5 5,-2.2 2,-0.2 3,-0.4 0.950 109.9 45.9 -57.3 -47.1 -31.3 -7.8 57.4 172 172 A A H ><5S+ 0 0 0 -4,-1.6 3,-1.6 897,-0.3 -2,-0.2 0.962 112.9 49.6 -60.2 -50.1 -31.3 -11.1 55.4 173 173 A R H 3<5S+ 0 0 113 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.704 109.4 52.6 -56.9 -30.0 -28.6 -12.7 57.6 174 174 A K T 3<5S- 0 0 164 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.289 121.4 -99.1-100.6 5.5 -30.4 -11.8 60.8 175 175 A G T < 5S+ 0 0 13 -3,-1.6 -3,-0.2 -4,-0.3 -2,-0.1 0.468 82.7 126.7 95.8 5.1 -33.8 -13.4 59.9 176 176 A G < - 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