==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/ELECTRON TRANSPORT 14-APR-93 2PCC . COMPND 2 MOLECULE: CYTOCHROME C PEROXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR H.PELLETIER,J.KRAUT . 804 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34977.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 503 62.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 4.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 31 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 128 15.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 265 33.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.2 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 10 2 0 0 5 4 1 1 3 2 2 2 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 7 3 0 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 T 0 0 184 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -25.1 -7.2 55.4 -7.2 2 2 A T - 0 0 111 2,-0.0 3,-0.1 3,-0.0 59,-0.1 0.086 360.0 -50.6 73.3 167.5 -6.3 51.9 -6.3 3 3 A P - 0 0 53 0, 0.0 59,-0.2 0, 0.0 2,-0.1 0.085 69.9 -77.8 -66.4 177.0 -4.7 51.1 -3.0 4 4 A L - 0 0 88 57,-1.1 2,-0.5 58,-0.1 -2,-0.0 -0.452 41.5-134.8 -73.0 151.1 -1.7 52.7 -1.4 5 5 A V - 0 0 108 -2,-0.1 2,-0.6 -3,-0.1 269,-0.1 -0.988 15.8-167.8-118.3 127.4 1.7 51.6 -2.7 6 6 A H - 0 0 27 -2,-0.5 269,-5.1 267,-0.5 2,-0.5 -0.957 6.2-164.2-115.5 97.6 4.5 50.9 -0.1 7 7 A V B -a 275 0A 67 -2,-0.6 2,-0.3 267,-0.2 269,-0.2 -0.734 21.4-125.8 -90.4 130.9 7.9 50.6 -1.7 8 8 A A - 0 0 9 267,-2.5 2,-0.5 -2,-0.5 122,-0.2 -0.608 27.1-165.0 -71.7 132.3 10.5 48.9 0.5 9 9 A S - 0 0 75 120,-2.9 120,-0.2 -2,-0.3 3,-0.1 -0.969 18.7-125.9-126.7 116.0 13.5 51.3 0.7 10 10 A V - 0 0 54 -2,-0.5 3,-0.2 118,-0.2 2,-0.1 -0.288 36.7 -98.5 -57.8 145.2 16.8 49.9 2.0 11 11 A E > - 0 0 19 1,-0.2 3,-1.0 2,-0.0 -1,-0.1 -0.464 65.8 -69.2 -66.8 136.6 18.2 51.8 4.9 12 12 A K T 3 S- 0 0 196 1,-0.2 -1,-0.2 89,-0.1 89,-0.0 0.007 107.0 -29.8 -40.2 106.4 20.9 54.2 3.6 13 13 A G T 3 S+ 0 0 76 -3,-0.2 2,-0.3 1,-0.1 -1,-0.2 0.925 96.0 141.8 45.2 68.7 23.7 51.9 2.5 14 14 A R < - 0 0 84 -3,-1.0 2,-0.3 3,-0.0 -1,-0.1 -0.660 26.0-174.9-119.6 176.2 23.2 49.0 5.0 15 15 A S > - 0 0 48 -2,-0.3 4,-1.5 1,-0.2 5,-0.2 -0.889 44.6 -68.4-161.2-176.4 23.7 45.4 3.9 16 16 A Y H >> S+ 0 0 67 -2,-0.3 3,-3.2 1,-0.2 4,-1.7 0.974 128.2 51.6 -45.1 -69.5 23.3 41.9 5.2 17 17 A E H 3> S+ 0 0 105 1,-0.3 4,-1.4 2,-0.3 -1,-0.2 0.831 105.6 54.8 -38.7 -45.4 26.1 42.2 7.7 18 18 A D H 3> S+ 0 0 44 1,-0.3 4,-0.8 2,-0.2 -1,-0.3 0.882 114.1 43.6 -60.5 -35.9 24.6 45.4 9.1 19 19 A F H < S+ 0 0 40 -4,-0.9 3,-0.6 -3,-0.2 -2,-0.2 0.911 116.8 44.1 -69.4 -41.6 20.2 34.1 25.7 32 32 A E H 3< S+ 0 0 50 -4,-3.3 2,-0.6 1,-0.2 -2,-0.2 0.950 112.1 43.6 -71.4 -54.6 20.7 36.6 28.4 33 33 A D T >< S+ 0 0 45 -4,-3.0 3,-1.4 1,-0.2 -1,-0.2 -0.195 70.4 142.3 -89.2 47.4 17.2 37.5 29.8 34 34 A D T < + 0 0 22 -2,-0.6 -1,-0.2 -3,-0.6 -2,-0.1 0.417 51.5 78.9 -67.3 -2.1 16.1 33.8 29.9 35 35 A E T 3> + 0 0 114 -3,-0.2 4,-1.6 4,-0.1 3,-0.4 0.647 64.0 125.0 -83.0 -20.0 14.1 34.1 33.1 36 36 A Y H X>>S- 0 0 45 -3,-1.4 4,-2.8 1,-0.2 5,-2.2 -0.034 79.6 -1.0 -46.4 135.9 11.1 35.8 31.5 37 37 A D H >45S- 0 0 34 1,-0.3 3,-0.7 2,-0.2 -1,-0.2 0.877 138.1 -43.2 46.7 68.1 7.8 34.2 32.1 38 38 A N H 345S- 0 0 109 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.2 0.754 116.0 -51.6 53.3 33.1 8.9 31.2 34.3 39 39 A Y H <<5S+ 0 0 23 -4,-1.6 -1,-0.3 -3,-0.6 -2,-0.2 0.792 106.9 121.4 76.8 36.9 11.8 30.6 32.0 40 40 A I T <<5 - 0 0 18 -4,-2.8 3,-0.3 -3,-0.7 -3,-0.2 0.809 63.7-149.1 -90.7 -37.0 10.0 30.5 28.7 41 41 A G < - 0 0 11 -5,-2.2 4,-0.3 1,-0.2 -1,-0.2 -0.368 31.2 -65.5 101.1-177.2 12.1 33.4 27.5 42 42 A Y S > S+ 0 0 40 -12,-0.2 4,-1.6 1,-0.1 -1,-0.2 0.219 105.3 98.0 -91.9 4.0 11.2 36.2 25.1 43 43 A G H >> S+ 0 0 3 -3,-0.3 4,-1.8 2,-0.2 3,-0.6 0.993 82.5 41.4 -51.5 -76.2 10.9 33.8 22.2 44 44 A P H >> S+ 0 0 16 0, 0.0 4,-2.6 0, 0.0 3,-1.1 0.937 115.6 51.0 -47.7 -54.0 7.1 33.2 22.0 45 45 A V H 3> S+ 0 0 18 -4,-0.3 4,-2.4 1,-0.3 -2,-0.2 0.873 108.5 50.7 -57.4 -38.4 6.2 36.9 22.7 46 46 A L H X S+ 0 0 0 -4,-1.4 4,-0.8 -5,-0.2 3,-0.7 0.961 111.4 45.6 -58.0 -47.4 5.9 39.8 14.7 51 51 A W H >X S+ 0 0 51 -4,-1.9 4,-2.7 1,-0.2 3,-0.9 0.921 110.6 52.5 -62.8 -49.2 2.4 38.4 13.8 52 52 A H H 3< S+ 0 0 9 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.557 107.4 49.1 -62.9 -22.1 0.4 41.2 15.3 53 53 A I H << S+ 0 0 5 -4,-0.9 12,-0.3 -3,-0.7 -1,-0.3 0.625 119.9 40.3 -94.2 -22.9 2.1 44.0 13.5 54 54 A S H X< S+ 0 0 1 -3,-0.9 3,-1.6 -4,-0.8 -2,-0.2 0.681 102.2 70.8 -96.1 -33.0 1.7 42.2 10.3 55 55 A G T 3< S+ 0 0 0 -4,-2.7 -1,-0.1 1,-0.3 -3,-0.1 0.274 80.2 73.6 -68.7 -1.3 -1.9 40.9 10.9 56 56 A T T 3 S+ 0 0 8 -3,-0.2 -1,-0.3 -5,-0.1 7,-0.1 0.479 70.3 121.9 -85.7 -11.8 -3.6 44.2 10.6 57 57 A W < - 0 0 20 -3,-1.6 2,-0.4 7,-0.1 7,-0.2 -0.198 46.2-163.1 -53.3 148.9 -3.0 44.1 6.8 58 58 A D B >>> -B 63 0B 29 5,-1.6 4,-2.0 6,-0.2 3,-0.9 -0.921 7.3-158.1-130.7 101.1 -6.2 44.3 4.6 59 59 A K T 345S+ 0 0 71 101,-2.6 102,-0.1 -2,-0.4 -1,-0.1 0.658 84.7 68.2 -60.7 -21.2 -5.5 43.2 1.1 60 60 A H T 345S+ 0 0 137 1,-0.2 -1,-0.2 100,-0.2 100,-0.0 0.864 125.4 7.0 -64.9 -42.8 -8.6 45.1 -0.3 61 61 A D T <45S- 0 0 63 -3,-0.9 -57,-1.1 2,-0.1 -2,-0.2 0.386 99.1-124.0-117.4 3.9 -7.1 48.5 0.3 62 62 A N T <5 + 0 0 16 -4,-2.0 2,-0.3 1,-0.2 -3,-0.2 0.885 59.6 142.7 57.0 42.4 -3.6 47.5 1.4 63 63 A T B < +B 58 0B 29 -5,-0.8 -5,-1.6 -7,-0.1 -1,-0.2 -0.757 48.8 23.7-104.6 165.7 -3.6 49.3 4.8 64 64 A G S S+ 0 0 15 73,-0.4 -6,-0.2 -2,-0.3 2,-0.1 -0.310 72.7 122.0 72.2-168.3 -2.1 47.8 8.0 65 65 A G S S- 0 0 5 -12,-0.3 3,-0.4 -8,-0.2 5,-0.3 -0.248 80.0 -70.1 96.9 168.1 0.8 45.3 7.5 66 66 A S S > S+ 0 0 1 206,-0.4 3,-2.5 203,-0.3 4,-0.2 0.842 106.1 91.8 -69.4 -38.6 4.4 45.5 8.8 67 67 A Y T 3 S+ 0 0 23 205,-0.4 64,-0.5 1,-0.3 38,-0.3 0.660 86.6 41.5 -24.8 -70.2 5.5 48.2 6.5 68 68 A G T 3 S- 0 0 6 -3,-0.4 65,-1.6 62,-0.1 -1,-0.3 0.315 86.6-136.6 -72.6 -3.8 4.8 51.3 8.7 69 69 A G X + 0 0 2 -3,-2.5 3,-0.8 63,-0.2 -2,-0.1 0.879 49.2 153.4 42.5 42.6 5.9 50.2 12.2 70 70 A T G > + 0 0 7 -5,-0.3 3,-2.1 1,-0.2 6,-0.3 0.576 45.5 88.7 -79.3 -4.1 2.7 51.8 13.4 71 71 A Y G 3 S+ 0 0 1 1,-0.3 6,-0.2 -5,-0.2 -1,-0.2 0.774 76.9 71.5 -64.1 -20.6 2.5 49.5 16.5 72 72 A R G < S+ 0 0 74 -3,-0.8 2,-0.3 4,-0.1 -1,-0.3 0.535 80.2 87.0 -72.1 -1.1 4.6 52.1 18.1 73 73 A F S <> S- 0 0 31 -3,-2.1 4,-2.8 1,-0.1 5,-0.2 -0.823 87.1-121.7-103.6 148.9 1.7 54.6 18.2 74 74 A K H > S+ 0 0 151 -2,-0.3 4,-3.0 2,-0.2 -1,-0.1 0.711 107.9 61.5 -54.2 -43.0 -0.6 54.4 21.3 75 75 A K H 4 S+ 0 0 80 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.972 117.9 29.4 -51.4 -56.8 -3.7 53.7 19.3 76 76 A E H >4 S+ 0 0 6 -6,-0.3 3,-1.8 1,-0.2 -2,-0.2 0.949 119.4 54.9 -68.8 -46.0 -2.2 50.5 17.9 77 77 A F H 3< S+ 0 0 49 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.815 110.4 49.2 -56.0 -35.3 -0.0 49.8 21.0 78 78 A N T 3< S+ 0 0 96 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.423 75.1 130.0 -91.6 -3.0 -3.1 50.0 23.1 79 79 A D X - 0 0 12 -3,-1.8 3,-2.1 -4,-0.4 -3,-0.0 -0.363 62.2-132.5 -51.5 127.5 -5.3 47.7 21.0 80 80 A P G > S+ 0 0 97 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.626 104.9 61.3 -60.1 -19.8 -6.7 45.2 23.6 81 81 A S G 3 S+ 0 0 36 1,-0.3 -2,-0.1 -29,-0.0 -29,-0.0 0.447 98.2 63.7 -86.2 4.3 -5.9 42.2 21.4 82 82 A N G X S+ 0 0 2 -3,-2.1 3,-1.6 -6,-0.1 4,-0.3 0.110 72.3 139.0-104.0 12.8 -2.4 43.4 21.8 83 83 A A T < + 0 0 28 -3,-1.1 101,-0.1 1,-0.2 -5,-0.1 -0.465 68.1 22.4 -66.0 136.2 -2.3 42.9 25.5 84 84 A G T > S+ 0 0 5 -2,-0.2 3,-0.6 99,-0.1 -1,-0.2 0.220 93.7 98.2 96.9 -12.9 1.1 41.4 26.6 85 85 A L T X> + 0 0 0 -3,-1.6 4,-2.3 1,-0.2 3,-1.2 0.597 61.9 80.3 -82.3 -12.2 3.1 42.6 23.7 86 86 A Q H 3> S+ 0 0 61 -4,-0.3 4,-2.3 1,-0.3 -1,-0.2 0.882 88.2 59.5 -58.5 -34.6 4.4 45.6 25.6 87 87 A N H <> S+ 0 0 56 -3,-0.6 4,-1.1 1,-0.2 -1,-0.3 0.730 106.8 45.7 -58.9 -31.1 6.8 43.1 27.1 88 88 A G H <> S+ 0 0 0 -3,-1.2 4,-1.1 -4,-0.2 -1,-0.2 0.822 109.8 54.8 -83.6 -36.1 8.1 42.4 23.6 89 89 A F H >X S+ 0 0 41 -4,-2.3 4,-0.9 1,-0.2 3,-0.5 0.929 108.6 47.3 -62.5 -45.6 8.3 46.1 22.8 90 90 A K H >< S+ 0 0 116 -4,-2.3 3,-1.0 1,-0.2 -1,-0.2 0.919 103.9 61.9 -58.5 -47.5 10.5 46.9 25.8 91 91 A F H 3< S+ 0 0 4 -4,-1.1 4,-0.5 1,-0.3 -1,-0.2 0.749 112.7 36.8 -55.7 -30.8 12.8 44.0 25.1 92 92 A L H > S+ 0 0 39 0, 0.0 4,-1.5 0, 0.0 3,-1.3 0.919 110.3 47.1 -45.9 -65.7 17.3 48.9 24.0 95 95 A I H 3> S+ 0 0 4 -4,-0.5 4,-2.1 1,-0.3 -2,-0.2 0.685 107.2 59.2 -49.8 -29.1 18.5 47.3 20.8 96 96 A H H << S+ 0 0 40 -4,-1.4 -1,-0.3 -3,-0.6 6,-0.2 0.925 103.3 49.7 -71.3 -38.0 16.7 50.0 18.9 97 97 A K H << S+ 0 0 94 -4,-1.7 -2,-0.2 -3,-1.3 -1,-0.2 0.804 108.8 54.5 -64.9 -35.7 18.9 52.7 20.6 98 98 A E H < S+ 0 0 123 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.967 124.1 24.5 -62.8 -52.6 21.9 50.6 19.7 99 99 A F >< + 0 0 24 -4,-2.1 3,-1.3 1,-0.1 -1,-0.2 -0.488 69.1 165.9-114.5 64.3 20.8 50.7 15.9 100 100 A P T 3 + 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.464 67.6 69.6 -61.0 -2.3 18.6 53.7 15.4 101 101 A W T 3 S+ 0 0 61 2,-0.1 -89,-0.1 -5,-0.0 2,-0.1 0.779 76.8 86.8 -83.9 -34.5 18.8 53.5 11.6 102 102 A I S < S- 0 0 3 -3,-1.3 2,-0.1 -6,-0.2 29,-0.1 -0.477 85.0-116.6 -63.5 143.5 16.7 50.3 11.2 103 103 A S > - 0 0 13 27,-0.3 4,-1.6 1,-0.1 3,-0.4 -0.492 20.2-111.6 -81.5 162.6 12.9 51.2 10.9 104 104 A S H > S+ 0 0 9 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.828 118.6 52.6 -57.1 -41.9 10.4 50.0 13.5 105 105 A G H > S+ 0 0 0 -38,-0.3 4,-1.6 1,-0.2 -1,-0.3 0.854 108.6 49.7 -61.4 -40.6 8.8 47.7 11.0 106 106 A D H > S+ 0 0 0 -3,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.806 113.0 48.3 -72.4 -31.0 12.1 46.1 10.1 107 107 A L H X S+ 0 0 3 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.895 108.6 50.5 -74.3 -47.7 12.9 45.6 13.8 108 108 A F H X S+ 0 0 8 -4,-2.6 4,-0.6 1,-0.2 -2,-0.2 0.916 118.1 39.7 -63.0 -39.7 9.6 44.0 14.9 109 109 A S H >X S+ 0 0 0 -4,-1.6 4,-1.7 2,-0.2 3,-0.9 0.893 111.6 53.7 -76.2 -40.6 9.7 41.5 12.0 110 110 A L H 3X S+ 0 0 0 -4,-1.8 4,-2.6 1,-0.3 5,-0.2 0.922 106.6 59.3 -56.3 -38.1 13.5 40.7 12.2 111 111 A G H 3X S+ 0 0 1 -4,-2.1 4,-1.4 1,-0.3 -1,-0.3 0.790 103.1 46.8 -58.9 -36.7 12.7 40.0 15.8 112 112 A G H S+ 0 0 0 -4,-1.6 5,-3.6 2,-0.2 82,-0.3 0.912 118.3 41.1 -66.6 -52.2 12.0 31.2 15.4 117 117 A Q H ><5S+ 0 0 7 -4,-1.9 3,-1.7 3,-0.2 -2,-0.2 0.957 114.7 52.7 -60.8 -49.9 15.6 30.5 14.2 118 118 A E H 3<5S+ 0 0 49 -4,-3.7 -2,-0.2 1,-0.3 -1,-0.2 0.797 107.0 53.2 -59.3 -32.7 17.0 30.9 17.7 119 119 A M T 3<5S- 0 0 17 -4,-1.8 79,-1.8 -5,-0.2 -1,-0.3 0.220 128.2 -98.9 -84.0 15.9 14.4 28.3 19.0 120 120 A Q T < 5S+ 0 0 77 -3,-1.7 -3,-0.2 77,-0.2 -2,-0.2 0.769 78.4 139.4 75.2 25.1 15.5 25.9 16.4 121 121 A G < - 0 0 13 -5,-3.6 -1,-0.1 1,-0.2 3,-0.1 -0.177 61.7 -73.3 -84.3-171.5 12.7 26.5 13.9 122 122 A P - 0 0 19 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 -0.276 57.7 -85.7 -76.9 173.1 13.6 26.6 10.2 123 123 A K - 0 0 64 -3,-0.1 164,-0.1 -2,-0.1 162,-0.1 -0.443 37.9-153.1 -78.4 141.3 15.3 29.5 8.5 124 124 A I - 0 0 0 -2,-0.2 162,-0.2 -11,-0.2 160,-0.1 -0.855 10.7-137.4-127.9 105.0 13.2 32.3 7.4 125 125 A P - 0 0 33 0, 0.0 2,-0.3 0, 0.0 160,-0.2 -0.100 32.4-169.3 -47.5 151.3 14.4 34.4 4.5 126 126 A W B -C 284 0C 3 158,-1.7 158,-3.0 156,-0.1 2,-0.3 -0.977 13.4-151.9-148.6 156.6 13.8 38.0 5.4 127 127 A R - 0 0 53 -2,-0.3 3,-0.3 156,-0.2 2,-0.2 -0.921 4.7-147.5-132.2 155.5 13.9 41.4 3.7 128 128 A C + 0 0 8 -2,-0.3 -118,-0.2 153,-0.2 -120,-0.1 -0.669 57.0 92.6-108.4 173.9 14.5 45.0 4.7 129 129 A G + 0 0 0 1,-0.4 -120,-2.9 -120,-0.2 -1,-0.2 0.177 40.7 145.6 126.2 -13.0 13.0 48.2 3.4 130 130 A R - 0 0 2 -3,-0.3 -1,-0.4 -122,-0.2 2,-0.3 -0.203 35.4-154.2 -52.3 149.8 10.1 48.7 5.7 131 131 A V - 0 0 52 -64,-0.5 2,-0.2 -29,-0.1 -29,-0.0 -0.956 16.4-111.1-129.4 141.7 9.7 52.6 6.2 132 132 A D - 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0 0 88 57,-1.4 2,-0.4 -2,-0.3 -2,-0.0 -0.089 23.1-127.4 -49.0 162.1 64.2 18.3 16.7 409 5 C V - 0 0 119 2,-0.0 2,-0.5 269,-0.0 269,-0.1 -0.971 20.1-171.7-115.2 132.1 61.8 19.3 13.8 410 6 C H E -h 678 0G 31 267,-0.5 269,-2.9 -2,-0.4 2,-0.4 -0.948 13.2-155.4-126.5 106.8 58.1 20.2 14.5 411 7 C V E -h 679 0G 86 -2,-0.5 2,-0.9 267,-0.2 269,-0.2 -0.661 21.0-118.9 -81.6 132.3 56.1 20.6 11.3 412 8 C A - 0 0 5 267,-4.2 2,-0.6 -2,-0.4 122,-0.2 -0.552 37.1-175.3 -74.3 106.9 53.0 22.8 11.4 413 9 C S - 0 0 51 120,-2.1 120,-0.2 -2,-0.9 3,-0.1 -0.871 21.0-129.4-110.8 110.7 50.1 20.4 10.4 414 10 C V - 0 0 35 -2,-0.6 3,-0.1 118,-0.2 2,-0.1 -0.199 33.9 -97.5 -55.1 133.3 46.6 21.8 10.0 415 11 C E > - 0 0 16 1,-0.2 3,-1.9 2,-0.1 -1,-0.1 -0.419 61.5 -86.7 -52.4 125.9 43.8 20.0 11.8 416 12 C K T 3 S- 0 0 164 1,-0.3 -1,-0.2 89,-0.1 89,-0.0 -0.087 104.0 -8.5 -54.1 121.1 42.3 17.7 9.1 417 13 C G T 3 S+ 0 0 76 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.756 102.4 126.6 66.8 30.6 39.8 19.6 7.1 418 14 C R < + 0 0 82 -3,-1.9 2,-0.2 3,-0.0 -1,-0.2 -0.796 27.7 166.3-115.5 160.4 39.5 22.8 9.2 419 15 C S > - 0 0 56 -2,-0.3 4,-2.8 -5,-0.0 5,-0.2 -0.771 51.1 -57.1-151.3-163.5 39.8 26.4 8.4 420 16 C Y H > S+ 0 0 66 1,-0.3 4,-3.3 -2,-0.2 5,-0.2 0.816 127.0 49.8 -48.3 -51.2 39.3 29.9 9.4 421 17 C E H > S+ 0 0 136 2,-0.2 4,-1.4 1,-0.2 -1,-0.3 0.914 112.1 50.3 -63.5 -38.9 35.6 29.7 10.0 422 18 C D H >> S+ 0 0 35 1,-0.2 4,-1.1 2,-0.2 3,-0.6 0.955 111.9 46.9 -59.2 -53.5 36.3 26.6 12.1 423 19 C F H >X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 3,-0.6 0.898 106.5 59.4 -61.9 -38.3 39.0 28.5 14.1 424 20 C Q H 3X S+ 0 0 12 -4,-3.3 4,-2.1 1,-0.3 -1,-0.2 0.846 97.8 58.5 -63.6 -21.5 36.6 31.6 14.6 425 21 C K H X S+ 0 0 10 -4,-3.1 4,-2.3 -5,-0.2 3,-0.7 0.987 116.3 41.5 -52.5 -55.5 33.4 30.4 22.3 430 26 C I H 3X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.3 -2,-0.2 0.925 112.9 53.7 -55.7 -54.6 36.3 31.5 24.4 431 27 C A H 3X S+ 0 0 1 -4,-4.4 4,-0.9 -5,-0.3 -1,-0.3 0.742 110.1 45.0 -55.7 -26.4 35.7 35.2 24.0 432 28 C L H < S+ 0 0 41 -4,-2.4 3,-0.7 1,-0.2 -1,-0.3 -0.307 71.4 144.1 -83.8 56.6 32.5 34.4 33.8 438 34 C D T 3 + 0 0 23 -2,-1.3 -1,-0.2 -3,-0.5 -2,-0.1 0.292 47.6 77.1 -79.4 13.7 33.6 38.0 34.6 439 35 C E T 3> + 0 0 92 -3,-0.1 4,-1.9 5,-0.1 3,-0.3 0.651 62.1 120.1 -93.2 -22.6 33.8 37.5 38.4 440 36 C Y H <>>S+ 0 0 47 -3,-0.7 5,-2.2 1,-0.2 4,-1.6 -0.109 79.9 7.6 -50.2 138.7 37.1 35.7 38.7 441 37 C D H >45S- 0 0 42 1,-0.2 3,-1.1 2,-0.2 -1,-0.2 0.977 140.1 -49.0 51.1 58.5 39.8 37.3 40.7 442 38 C N H 345S- 0 0 118 -3,-0.3 -2,-0.2 1,-0.2 -1,-0.2 0.884 113.0 -45.6 41.5 61.2 37.6 40.0 42.0 443 39 C Y H 3<5S+ 0 0 35 -4,-1.9 -1,-0.2 -6,-0.1 -2,-0.2 0.593 108.8 114.4 62.1 26.2 36.2 41.0 38.6 444 40 C I T <<5 - 0 0 18 -4,-1.6 3,-0.4 -3,-1.1 -3,-0.2 0.745 66.6-149.3 -87.5 -34.4 39.4 41.0 36.7 445 41 C G < - 0 0 10 -5,-2.2 4,-0.3 1,-0.2 -1,-0.2 -0.320 30.4 -69.2 92.3 179.5 38.2 38.1 34.6 446 42 C Y S > S+ 0 0 37 -12,-0.2 4,-0.7 1,-0.1 -1,-0.2 -0.067 103.9 99.1 -91.8 6.5 40.3 35.3 32.9 447 43 C G H >> S+ 0 0 4 -3,-0.4 4,-1.5 2,-0.2 3,-1.2 0.993 84.7 41.1 -66.2 -61.9 41.8 37.6 30.4 448 44 C P H >> S+ 0 0 14 0, 0.0 4,-2.4 0, 0.0 3,-1.0 0.962 114.3 51.5 -54.4 -57.5 45.2 38.1 32.2 449 45 C V H 3> S+ 0 0 17 -4,-0.3 4,-1.3 1,-0.3 -2,-0.2 0.760 108.8 52.2 -56.6 -19.6 45.5 34.5 33.3 450 46 C L H X S+ 0 0 51 -4,-1.5 4,-2.3 1,-0.2 3,-0.7 0.949 110.7 48.8 -61.2 -51.6 53.5 32.8 27.5 456 52 C H H 3< S+ 0 0 11 -4,-2.1 4,-0.2 1,-0.2 -2,-0.2 0.764 109.2 49.5 -63.8 -33.7 54.3 29.9 29.9 457 53 C I H 3< S+ 0 0 4 -4,-1.3 -1,-0.2 1,-0.2 12,-0.2 0.625 121.4 36.4 -78.9 -19.4 53.6 27.1 27.4 458 54 C S H X< S+ 0 0 0 -3,-0.7 3,-1.3 -4,-0.6 -2,-0.2 0.678 104.9 71.3-101.5 -29.8 55.7 28.8 24.8 459 55 C G T 3< S+ 0 0 0 -4,-2.3 -2,-0.1 1,-0.3 -3,-0.1 0.452 81.9 72.0 -67.2 -14.8 58.4 30.1 27.3 460 56 C T T 3 S+ 0 0 5 -4,-0.2 -1,-0.3 -5,-0.1 2,-0.2 0.283 75.4 123.8 -80.4 -1.9 59.8 26.7 27.9 461 57 C W < - 0 0 23 -3,-1.3 2,-0.5 7,-0.3 7,-0.3 -0.486 47.1-159.1 -70.3 145.7 61.4 26.7 24.4 462 58 C D B >>> -I 467 0H 28 5,-2.8 4,-2.5 -2,-0.2 3,-0.6 -0.948 7.0-161.9-125.4 110.9 65.0 26.3 23.8 463 59 C K T 345S+ 0 0 76 101,-2.4 -1,-0.1 -2,-0.5 102,-0.1 0.860 86.2 65.3 -57.8 -34.4 66.4 27.6 20.5 464 60 C H T 345S+ 0 0 129 1,-0.2 -1,-0.2 100,-0.2 100,-0.0 0.834 126.7 4.4 -58.6 -44.6 69.5 25.4 20.8 465 61 C D T <45S- 0 0 63 -3,-0.6 -57,-1.4 2,-0.1 -1,-0.2 0.321 97.5-121.6-122.8 4.8 67.9 22.0 20.6 466 62 C N T <5 + 0 0 16 -4,-2.5 2,-0.2 -59,-0.2 -3,-0.2 0.843 59.3 147.7 53.2 47.7 64.3 23.1 19.9 467 63 C T B < +I 462 0H 35 -5,-0.6 -5,-2.8 -7,-0.1 -1,-0.2 -0.651 50.0 17.1 -99.3 157.8 62.8 21.4 22.9 468 64 C G S S+ 0 0 15 73,-0.4 -7,-0.3 -7,-0.3 3,-0.2 -0.061 72.8 118.3 68.2-168.1 59.8 23.0 24.7 469 65 C G S S- 0 0 5 -12,-0.2 3,-0.3 1,-0.2 5,-0.3 -0.415 79.6 -64.4 98.8 172.7 57.6 25.7 23.1 470 66 C S S > S+ 0 0 0 206,-0.4 3,-1.7 203,-0.3 -1,-0.2 0.852 108.3 86.6 -68.7 -39.2 53.9 25.8 22.1 471 67 C Y T 3 S+ 0 0 20 205,-0.4 38,-0.3 1,-0.3 -1,-0.2 0.744 89.1 42.8 -32.9 -63.1 54.0 23.0 19.5 472 68 C G T 3 S- 0 0 7 -3,-0.3 65,-2.1 -4,-0.1 -1,-0.3 0.477 84.9-138.3 -73.5 -12.8 53.5 20.0 21.8 473 69 C G X + 0 0 4 -3,-1.7 3,-1.2 -4,-0.2 -2,-0.1 0.746 47.6 151.8 59.2 25.1 50.8 20.9 24.2 474 70 C T G > + 0 0 6 -5,-0.3 3,-3.0 1,-0.3 6,-0.4 0.605 46.3 88.6 -64.9 -18.1 52.8 19.2 27.0 475 71 C Y G 3 S+ 0 0 1 1,-0.3 -1,-0.3 5,-0.1 6,-0.1 0.695 76.6 70.3 -56.7 -17.1 51.4 21.5 29.8 476 72 C R G < S+ 0 0 70 -3,-1.2 2,-0.4 4,-0.1 -1,-0.3 0.674 80.7 92.8 -74.6 -15.4 48.6 18.9 30.0 477 73 C F S X> S- 0 0 41 -3,-3.0 4,-2.8 1,-0.1 3,-1.1 -0.643 87.1-122.6 -89.9 134.2 51.1 16.5 31.5 478 74 C K H 3> S+ 0 0 136 -2,-0.4 4,-3.1 1,-0.3 5,-0.2 0.777 106.7 59.8 -36.5 -50.5 51.3 16.5 35.3 479 75 C K H 34 S+ 0 0 84 2,-0.2 4,-0.3 1,-0.2 -1,-0.3 0.820 115.2 29.9 -50.0 -53.0 55.0 17.3 35.3 480 76 C E H X4 S+ 0 0 3 -3,-1.1 3,-0.5 -6,-0.4 -1,-0.2 0.855 119.8 56.9 -75.2 -45.9 54.8 20.6 33.4 481 77 C F H 3< S+ 0 0 34 -4,-2.8 -2,-0.2 -7,-0.3 -3,-0.2 0.850 110.4 44.2 -53.8 -41.6 51.4 21.2 34.8 482 78 C N T 3< S+ 0 0 85 -4,-3.1 -1,-0.2 -5,-0.3 -2,-0.2 0.601 79.4 130.4 -90.1 -6.2 52.8 20.9 38.4 483 79 C D X - 0 0 7 -3,-0.5 3,-2.8 -4,-0.3 -3,-0.1 -0.301 62.4-133.8 -47.8 119.6 55.9 23.1 37.7 484 80 C P G > S+ 0 0 98 0, 0.0 3,-1.4 0, 0.0 -1,-0.2 0.684 105.3 64.4 -53.1 -25.4 55.9 25.6 40.6 485 81 C S G 3 S+ 0 0 42 1,-0.3 -2,-0.1 -29,-0.0 -3,-0.0 0.679 100.0 54.2 -72.2 -19.7 56.6 28.3 38.1 486 82 C N G X S+ 0 0 0 -3,-2.8 3,-1.4 -6,-0.1 -1,-0.3 0.082 76.3 140.2 -97.2 18.9 53.2 27.5 36.7 487 83 C A T < + 0 0 30 -3,-1.4 -5,-0.1 1,-0.2 101,-0.1 -0.503 67.8 23.9 -66.7 140.7 51.3 27.9 40.0 488 84 C G T > S+ 0 0 6 -2,-0.2 3,-0.6 99,-0.1 4,-0.3 0.221 93.3 98.8 99.2 -14.1 48.0 29.6 39.5 489 85 C L T X> + 0 0 0 -3,-1.4 4,-1.9 1,-0.2 3,-1.1 0.663 57.2 84.2 -81.7 -20.6 47.5 28.7 35.8 490 86 C Q H 3> S+ 0 0 58 -4,-0.3 4,-2.0 1,-0.3 -1,-0.2 0.789 83.9 62.2 -53.5 -30.3 45.2 25.8 36.5 491 87 C N H <> S+ 0 0 59 -3,-0.6 4,-1.3 1,-0.2 -1,-0.3 0.896 105.5 47.6 -62.0 -37.6 42.4 28.3 36.6 492 88 C G H <> S+ 0 0 0 -3,-1.1 4,-0.9 -4,-0.3 3,-0.3 0.943 111.7 48.7 -69.2 -44.6 43.3 29.1 33.0 493 89 C F H X S+ 0 0 45 -4,-1.9 4,-0.7 1,-0.2 -1,-0.2 0.782 110.4 50.4 -65.5 -31.0 43.4 25.5 32.0 494 90 C K H < S+ 0 0 99 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.701 103.5 58.5 -80.1 -29.9 40.0 24.7 33.6 495 91 C F H < S+ 0 0 5 -4,-1.3 4,-0.4 -3,-0.3 -2,-0.2 0.696 113.0 42.1 -68.3 -25.3 38.3 27.6 31.9 496 92 C L H X S+ 0 0 3 -4,-0.9 4,-1.9 2,-0.2 -2,-0.2 0.542 92.7 78.5 -99.9 -24.1 39.4 26.0 28.6 497 93 C E H >X S+ 0 0 58 -4,-0.7 3,-1.9 2,-0.2 4,-1.7 0.989 95.5 51.4 -50.5 -61.3 38.6 22.3 29.4 498 94 C P H 3> S+ 0 0 38 0, 0.0 4,-1.8 0, 0.0 3,-0.4 0.856 112.6 46.2 -39.9 -51.1 34.9 23.0 28.7 499 95 C I H 3> S+ 0 0 3 -4,-0.4 4,-0.6 1,-0.2 -2,-0.2 0.727 106.6 57.2 -67.1 -26.1 35.8 24.6 25.4 500 96 C H H << S+ 0 0 54 -3,-1.9 -1,-0.2 -4,-1.9 6,-0.2 0.845 107.5 49.5 -72.8 -34.3 38.2 21.8 24.4 501 97 C K H < S+ 0 0 86 -4,-1.7 -2,-0.2 -3,-0.4 -1,-0.2 0.874 106.4 54.4 -64.9 -51.0 35.3 19.4 24.8 502 98 C E H < S+ 0 0 110 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.676 125.8 24.0 -60.0 -22.7 33.0 21.5 22.7 503 99 C F S >< S+ 0 0 21 -4,-0.6 3,-0.6 -3,-0.1 -1,-0.3 -0.659 73.1 167.6-146.4 85.3 35.6 21.4 19.8 504 100 C P T 3 + 0 0 98 0, 0.0 -3,-0.1 0, 0.0 -2,-0.1 0.437 64.6 73.8 -85.1 -6.5 37.8 18.3 20.4 505 101 C W T 3 S+ 0 0 62 2,-0.1 -89,-0.1 -4,-0.1 2,-0.1 0.700 75.0 97.0 -74.8 -32.0 39.5 18.4 17.1 506 102 C I S < S- 0 0 3 -3,-0.6 -3,-0.1 -6,-0.2 2,-0.1 -0.441 79.4-120.2 -65.1 135.0 41.7 21.3 18.1 507 103 C S > - 0 0 15 27,-0.2 4,-2.3 1,-0.1 5,-0.2 -0.341 22.8-114.2 -69.0 156.5 45.2 20.4 19.3 508 104 C S H > S+ 0 0 5 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.939 116.4 51.7 -57.6 -46.6 46.1 21.5 22.9 509 105 C G H > S+ 0 0 0 -38,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.841 109.1 49.1 -61.5 -36.4 48.7 23.9 21.6 510 106 C D H > S+ 0 0 0 24,-0.3 4,-2.4 2,-0.2 5,-0.3 0.919 114.5 47.0 -69.8 -42.8 46.3 25.6 19.2 511 107 C L H X S+ 0 0 2 -4,-2.3 4,-3.4 1,-0.2 -2,-0.2 0.977 111.7 47.9 -60.7 -56.8 43.8 25.9 22.0 512 108 C F H X S+ 0 0 9 -4,-3.0 4,-1.4 1,-0.3 -1,-0.2 0.855 116.3 43.6 -58.8 -39.1 46.2 27.3 24.6 513 109 C S H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -1,-0.3 0.795 112.6 51.9 -74.9 -35.3 47.7 29.9 22.2 514 110 C L H X S+ 0 0 0 -4,-2.4 4,-3.5 2,-0.2 5,-0.4 0.924 101.7 61.5 -61.9 -43.6 44.4 30.9 20.9 515 111 C G H X S+ 0 0 0 -4,-3.4 4,-2.3 -5,-0.3 -2,-0.2 0.974 110.7 41.3 -44.0 -56.6 43.3 31.3 24.5 516 112 C G H X S+ 0 0 0 -4,-1.4 4,-1.7 1,-0.2 -1,-0.2 0.898 111.8 52.7 -62.9 -47.7 46.0 34.0 24.6 517 113 C V H X S+ 0 0 0 -4,-2.8 4,-1.8 2,-0.2 -1,-0.2 0.932 111.7 47.8 -50.4 -46.4 45.3 35.5 21.3 518 114 C T H X S+ 0 0 0 -4,-3.5 4,-3.2 1,-0.2 5,-0.3 0.878 106.8 55.1 -65.7 -46.3 41.6 36.0 22.2 519 115 C A H X S+ 0 0 0 -4,-2.3 4,-1.3 -5,-0.4 -1,-0.2 0.931 108.6 48.0 -57.8 -43.1 42.2 37.5 25.6 520 116 C V H <>S+ 0 0 0 -4,-1.7 5,-3.1 2,-0.2 82,-0.2 0.936 116.7 42.5 -63.3 -48.6 44.4 40.3 24.1 521 117 C Q H ><5S+ 0 0 7 -4,-1.8 3,-2.0 1,-0.2 -2,-0.2 0.978 115.4 48.8 -63.1 -46.3 41.9 41.1 21.3 522 118 C E H 3<5S+ 0 0 40 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.719 108.2 56.8 -66.1 -19.5 38.9 40.9 23.6 523 119 C M T 3<5S- 0 0 13 -4,-1.3 79,-2.0 -5,-0.3 -1,-0.3 0.272 128.2 -96.3 -97.4 10.8 40.7 43.1 26.1 524 120 C Q T < 5S+ 0 0 73 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.457 78.9 141.2 84.8 23.8 41.1 45.9 23.5 525 121 C G < - 0 0 10 -5,-3.1 -1,-0.2 -6,-0.2 2,-0.1 0.031 60.6 -80.0 -78.8 179.6 44.5 44.9 22.5 526 122 C P - 0 0 19 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.274 58.3 -89.9 -76.8 171.3 45.9 45.0 19.0 527 123 C K - 0 0 63 -3,-0.1 -9,-0.1 -2,-0.1 164,-0.0 -0.747 37.3-149.6 -88.2 141.4 45.0 42.1 16.7 528 124 C I - 0 0 0 -2,-0.3 162,-0.3 -11,-0.2 160,-0.1 -0.944 9.0-135.9-117.3 112.8 47.3 39.2 16.7 529 125 C P - 0 0 30 0, 0.0 2,-0.3 0, 0.0 160,-0.2 -0.039 30.8-170.7 -51.1 161.9 47.8 37.1 13.6 530 126 C W B -J 688 0I 2 158,-1.2 158,-2.3 156,-0.1 2,-0.3 -0.995 15.3-155.0-159.5 154.0 47.8 33.4 14.5 531 127 C R - 0 0 46 -2,-0.3 3,-0.2 156,-0.2 2,-0.2 -0.940 11.0-145.2-138.3 147.9 48.5 30.0 12.7 532 128 C C + 0 0 7 -2,-0.3 -118,-0.2 153,-0.2 -26,-0.0 -0.540 56.8 91.4-103.4 179.6 47.2 26.6 13.5 533 129 C G + 0 0 0 1,-0.4 -120,-2.1 -120,-0.2 -1,-0.1 0.369 38.5 145.4 119.0 -6.9 48.8 23.3 13.2 534 130 C R - 0 0 2 -122,-0.2 2,-0.5 -3,-0.2 -1,-0.4 -0.447 38.7-144.9 -65.3 140.9 50.5 22.5 16.5 535 131 C V - 0 0 54 -64,-0.1 -1,-0.1 -2,-0.1 -121,-0.0 -0.937 16.4-112.6-116.2 125.0 50.3 18.7 17.2 536 132 C D - 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