==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE(CYTOCHROME) 22-JAN-02 1GU2 . COMPND 2 MOLECULE: CYTOCHROME C''; . SOURCE 2 ORGANISM_SCIENTIFIC: METHYLOPHILUS METHYLOTROPHUS; . AUTHOR F.J.ENGUITA,E.POHL,A.RODRIGUES,H.SANTOS,M.A.CARRONDO . 247 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14637.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 161 65.2 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 . 12 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 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-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 . 13 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 42.1 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 0 2 0 0 0 2 0 1 0 1 0 0 2 0 2 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 . 0 4 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 . 4 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 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 D > 0 0 54 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-180.0 4.0 1.4 -1.8 2 2 A V H > + 0 0 24 73,-0.4 4,-3.0 1,-0.2 5,-0.2 0.885 360.0 59.9 -59.6 -37.6 1.5 -1.2 -0.7 3 3 A T H > S+ 0 0 82 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.929 108.4 41.6 -58.0 -51.1 2.2 -3.3 -3.8 4 4 A N H > S+ 0 0 22 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.878 114.1 53.2 -67.8 -36.3 5.9 -3.7 -3.0 5 5 A A H X S+ 0 0 0 -4,-2.1 4,-1.7 76,-0.2 -2,-0.2 0.937 108.7 49.3 -62.5 -47.7 5.2 -4.3 0.7 6 6 A E H X S+ 0 0 85 -4,-3.0 4,-1.4 1,-0.2 3,-0.2 0.923 110.0 50.3 -58.8 -45.1 2.8 -7.1 -0.1 7 7 A K H X S+ 0 0 122 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.874 106.3 56.8 -62.6 -34.0 5.2 -8.8 -2.4 8 8 A L H X S+ 0 0 7 -4,-1.9 4,-2.8 1,-0.2 5,-0.3 0.865 98.8 60.7 -65.1 -34.4 7.9 -8.6 0.3 9 9 A V H X S+ 0 0 11 -4,-1.7 4,-2.3 -3,-0.2 -1,-0.2 0.949 107.5 44.6 -59.2 -43.7 5.7 -10.5 2.7 10 10 A Y H X S+ 0 0 125 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.935 112.6 52.0 -64.3 -42.6 5.6 -13.5 0.3 11 11 A K H X S+ 0 0 94 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.962 114.2 41.0 -57.5 -53.1 9.4 -13.3 -0.3 12 12 A Y H X S+ 0 0 14 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.862 112.1 56.8 -69.4 -30.7 10.2 -13.3 3.4 13 13 A T H X S+ 0 0 10 -4,-2.3 4,-2.8 -5,-0.3 -1,-0.2 0.939 108.4 46.6 -62.6 -44.0 7.6 -16.0 4.1 14 14 A N H X S+ 0 0 109 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.905 113.0 48.5 -68.1 -39.3 9.1 -18.3 1.6 15 15 A I H X S+ 0 0 45 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.926 113.7 48.6 -60.8 -45.0 12.7 -17.7 2.9 16 16 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 7,-0.2 0.915 108.6 52.3 -63.2 -42.3 11.4 -18.2 6.5 17 17 A H H < S+ 0 0 83 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.858 107.8 52.1 -66.3 -32.9 9.6 -21.5 5.7 18 18 A S H < S+ 0 0 36 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.902 118.5 36.8 -64.6 -40.4 12.8 -22.9 4.1 19 19 A A H < S+ 0 0 2 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.717 132.3 26.1 -82.6 -25.3 14.8 -22.1 7.2 20 20 A N S >< S- 0 0 5 -4,-2.2 3,-2.4 3,-0.2 -1,-0.3 -0.761 70.6-168.0-145.0 78.4 12.1 -22.9 9.8 21 21 A P T 3 S+ 0 0 30 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.727 82.2 63.8 -56.7 -26.4 9.7 -25.4 8.3 22 22 A M T 3 S+ 0 0 89 220,-0.2 2,-0.6 2,-0.0 -5,-0.1 0.743 86.1 86.5 -69.6 -17.7 7.0 -25.0 11.1 23 23 A Y < + 0 0 25 -3,-2.4 -3,-0.2 -7,-0.2 -4,-0.0 -0.750 49.1 155.1 -82.1 121.2 6.6 -21.4 9.9 24 24 A E + 0 0 149 -2,-0.6 -1,-0.2 1,-0.4 -7,-0.1 0.684 56.8 5.6-118.5 -30.0 4.1 -21.5 7.1 25 25 A A S S- 0 0 63 -8,-0.0 -1,-0.4 -11,-0.0 86,-0.1 -0.986 83.8 -79.8-157.2 153.7 2.4 -18.1 6.9 26 26 A P - 0 0 50 0, 0.0 2,-0.6 0, 0.0 3,-0.1 -0.245 30.7-149.8 -60.5 147.9 2.6 -14.6 8.5 27 27 A S > - 0 0 32 80,-0.2 4,-2.0 1,-0.1 88,-0.2 -0.958 7.8-169.1-116.6 109.5 1.1 -13.8 11.8 28 28 A I H > S+ 0 0 68 -2,-0.6 4,-2.3 1,-0.2 5,-0.2 0.817 90.0 58.8 -68.7 -28.0 0.0 -10.3 12.2 29 29 A T H > S+ 0 0 99 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.922 108.1 45.2 -59.2 -47.3 -0.4 -10.8 15.9 30 30 A D H > S+ 0 0 83 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.883 110.4 54.1 -68.2 -34.6 3.3 -11.8 16.2 31 31 A G H X S+ 0 0 0 -4,-2.0 4,-1.9 80,-0.3 -2,-0.2 0.914 110.1 47.2 -63.0 -41.3 4.3 -8.8 14.0 32 32 A K H X S+ 0 0 104 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.899 112.0 49.7 -65.6 -41.8 2.4 -6.5 16.4 33 33 A I H X S+ 0 0 85 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.936 110.0 51.6 -62.6 -42.1 4.0 -8.1 19.5 34 34 A F H < S+ 0 0 24 -4,-2.6 15,-0.4 1,-0.2 -1,-0.2 0.902 109.2 50.9 -58.9 -43.0 7.4 -7.8 17.9 35 35 A F H < S+ 0 0 0 -4,-1.9 15,-1.7 1,-0.2 14,-0.3 0.843 120.0 34.0 -65.7 -35.3 6.8 -4.0 17.2 36 36 A N H < S+ 0 0 53 -4,-1.8 -1,-0.2 -3,-0.2 -2,-0.2 0.515 87.9 119.7 -97.6 -10.4 5.7 -3.3 20.8 37 37 A R < - 0 0 122 -4,-1.6 2,-0.6 -3,-0.2 12,-0.3 -0.351 62.2-128.8 -67.3 133.8 7.9 -5.7 22.7 38 38 A K - 0 0 148 10,-0.1 2,-0.2 -2,-0.1 10,-0.2 -0.704 30.1-173.2 -82.2 120.5 10.3 -4.1 25.2 39 39 A F E -A 47 0A 52 8,-3.1 8,-2.0 -2,-0.6 2,-0.6 -0.683 27.0-106.1-107.2 165.1 13.8 -5.4 24.7 40 40 A K E -A 46 0A 171 -2,-0.2 6,-0.2 6,-0.2 5,-0.1 -0.819 26.7-151.8 -98.1 118.9 16.9 -4.7 26.8 41 41 A T > - 0 0 37 4,-2.6 3,-2.1 -2,-0.6 59,-0.0 -0.413 38.0 -97.5 -76.6 163.5 19.5 -2.3 25.5 42 42 A P T 3 S+ 0 0 146 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.861 124.5 57.2 -51.6 -35.3 23.1 -2.9 26.7 43 43 A S T 3 S- 0 0 103 2,-0.1 3,-0.1 1,-0.1 -3,-0.0 0.655 118.9-108.3 -67.5 -20.7 22.6 -0.2 29.4 44 44 A G S < S+ 0 0 38 -3,-2.1 2,-0.2 1,-0.4 -1,-0.1 0.145 79.9 128.7 102.5 -14.9 19.7 -2.0 30.9 45 45 A K - 0 0 147 -5,-0.1 -4,-2.6 1,-0.1 -1,-0.4 -0.471 57.6-127.0 -70.7 140.5 17.2 0.6 29.7 46 46 A E E +A 40 0A 110 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.618 32.8 169.9 -84.8 147.3 14.2 -1.0 27.8 47 47 A A E -A 39 0A 15 -8,-2.0 -8,-3.1 -2,-0.2 2,-0.3 -0.947 12.0-166.4-146.1 166.3 13.2 0.1 24.3 48 48 A A >> - 0 0 10 -2,-0.3 3,-1.7 -10,-0.2 4,-0.5 -0.944 42.3-103.8-142.6 163.3 10.8 -1.1 21.6 49 49 A C H >> S+ 0 0 28 -15,-0.4 4,-2.3 -12,-0.3 3,-1.3 0.908 124.2 60.4 -52.2 -40.4 10.2 -0.3 17.9 50 50 A A H 3> S+ 0 0 18 -15,-1.7 4,-1.6 1,-0.2 -1,-0.3 0.642 83.6 79.0 -63.3 -16.4 7.3 1.7 19.2 51 51 A S H <4 S+ 0 0 53 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.883 115.0 16.4 -58.9 -38.7 9.6 3.9 21.3 52 52 A C H << S+ 0 0 28 -3,-1.3 10,-2.4 -4,-0.5 -2,-0.2 0.725 134.2 42.9-101.4 -35.0 10.4 5.8 18.1 53 53 A H H < S- 0 0 24 -4,-2.3 3,-0.3 8,-0.2 6,-0.3 0.481 105.1-126.5 -95.1 0.2 7.6 4.8 15.7 54 54 A T < - 0 0 46 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.1 0.042 38.1 -72.4 70.0 173.8 4.8 5.1 18.4 55 55 A N S S+ 0 0 111 1,-0.2 -1,-0.2 -4,-0.1 -5,-0.1 0.392 125.2 57.1 -83.4 9.2 2.4 2.2 19.0 56 56 A N > - 0 0 10 -3,-0.3 3,-2.2 -6,-0.1 -1,-0.2 -0.899 69.1-157.4-133.8 108.5 0.7 2.9 15.7 57 57 A P T 3 S+ 0 0 1 0, 0.0 17,-2.3 0, 0.0 16,-1.6 0.561 90.2 70.5 -72.7 -1.6 2.9 2.7 12.6 58 58 A A T 3 S+ 0 0 2 63,-0.2 2,-0.2 15,-0.2 -4,-0.1 0.577 91.2 80.3 -81.2 -11.6 0.3 4.9 10.7 59 59 A N S < S- 0 0 39 -3,-2.2 2,-0.4 -6,-0.3 14,-0.3 -0.530 93.4 -96.8 -94.9 163.6 1.4 7.8 12.9 60 60 A V - 0 0 68 -2,-0.2 2,-0.1 12,-0.1 -2,-0.1 -0.627 45.6-152.6 -74.2 131.6 4.4 10.2 12.6 61 61 A G E -B 70 0B 5 9,-2.5 9,-2.2 -2,-0.4 2,-0.3 -0.277 6.2-138.8 -96.1-179.1 7.1 9.0 14.9 62 62 A K E -B 69 0B 135 -10,-2.4 2,-0.4 7,-0.3 7,-0.2 -0.943 19.7-122.1-149.5 125.0 10.0 10.7 16.8 63 63 A N > - 0 0 53 5,-2.8 4,-2.8 -2,-0.3 5,-0.2 -0.545 16.5-152.3 -68.9 122.4 13.5 9.5 17.2 64 64 A I T 4 S+ 0 0 109 -2,-0.4 -1,-0.2 1,-0.2 -12,-0.0 0.727 92.5 49.9 -73.4 -21.7 14.3 9.3 20.9 65 65 A V T 4 S+ 0 0 126 3,-0.1 -1,-0.2 1,-0.1 -2,-0.0 0.918 128.4 16.5 -74.2 -47.9 18.0 9.9 20.4 66 66 A T T 4 S- 0 0 93 2,-0.1 -2,-0.2 0, 0.0 3,-0.1 0.530 90.5-126.1-111.6 -12.7 17.8 13.0 18.1 67 67 A G < + 0 0 47 -4,-2.8 2,-0.2 1,-0.3 -3,-0.1 0.459 60.2 142.1 82.5 1.5 14.3 14.4 18.5 68 68 A K - 0 0 157 -5,-0.2 -5,-2.8 1,-0.1 -1,-0.3 -0.533 54.2-113.7 -83.9 133.2 13.6 14.4 14.7 69 69 A E E -B 62 0B 143 -7,-0.2 -7,-0.3 -2,-0.2 -1,-0.1 -0.325 25.6-147.9 -66.7 154.9 10.2 13.4 13.4 70 70 A I E -B 61 0B 31 -9,-2.2 -9,-2.5 -18,-0.2 3,-0.1 -0.983 16.9-119.7-124.2 122.3 9.9 10.1 11.4 71 71 A P - 0 0 72 0, 0.0 -12,-0.1 0, 0.0 -11,-0.1 -0.189 48.7 -80.7 -56.7 157.7 7.4 9.7 8.6 72 72 A P - 0 0 20 0, 0.0 -14,-0.2 0, 0.0 -12,-0.1 -0.150 28.5-145.9 -58.1 153.9 4.9 6.8 9.2 73 73 A L S S+ 0 0 25 -16,-1.6 -15,-0.2 -14,-0.3 -13,-0.1 0.735 70.0 99.2 -87.6 -27.6 5.8 3.2 8.4 74 74 A A >> - 0 0 0 -17,-2.3 4,-2.9 1,-0.2 3,-1.0 -0.457 65.5-148.8 -70.0 120.7 2.4 2.0 7.2 75 75 A P T 34 S+ 0 0 0 0, 0.0 -73,-0.4 0, 0.0 -1,-0.2 0.723 93.4 60.8 -72.0 -15.4 2.5 2.0 3.3 76 76 A R T 34 S+ 0 0 154 40,-0.3 3,-0.3 43,-0.2 44,-0.1 0.822 116.5 34.5 -72.4 -27.6 -1.2 2.8 2.9 77 77 A V T <4 S+ 0 0 54 -3,-1.0 2,-0.7 1,-0.3 -1,-0.1 0.890 130.7 31.3 -91.3 -47.4 -0.6 6.0 4.8 78 78 A N S >< S- 0 0 29 -4,-2.9 3,-1.8 1,-0.1 -1,-0.3 -0.863 71.6-172.6-111.8 95.1 2.9 6.8 3.6 79 79 A T T 3 S+ 0 0 80 -2,-0.7 -1,-0.1 1,-0.3 4,-0.1 0.595 76.3 72.2 -72.5 -9.9 3.0 5.4 0.1 80 80 A K T >> S+ 0 0 165 2,-0.1 3,-2.0 3,-0.1 4,-0.6 0.762 72.2 106.0 -70.2 -25.3 6.7 6.1 -0.3 81 81 A R T <4 S+ 0 0 74 -3,-1.8 -76,-0.2 1,-0.3 -77,-0.1 -0.405 95.4 0.8 -61.1 125.1 7.5 3.3 2.1 82 82 A F T 34 S+ 0 0 20 -2,-0.2 -1,-0.3 -78,-0.1 3,-0.1 0.333 98.9 109.8 76.8 3.0 8.8 0.3 0.1 83 83 A T T <4 + 0 0 71 -3,-2.0 2,-2.4 1,-0.2 3,-0.2 0.846 65.7 70.0 -71.1 -31.4 8.7 2.1 -3.3 84 84 A D >X + 0 0 73 -4,-0.6 4,-2.1 1,-0.2 3,-1.9 -0.448 67.4 164.3 -81.0 62.2 12.5 2.2 -3.4 85 85 A I H 3> + 0 0 59 -2,-2.4 4,-0.6 1,-0.3 -1,-0.2 0.781 62.3 62.4 -66.6 -23.6 12.5 -1.5 -3.9 86 86 A D H 34 S+ 0 0 143 -3,-0.2 -1,-0.3 1,-0.2 4,-0.2 0.753 121.1 23.7 -67.7 -20.8 16.2 -1.7 -5.0 87 87 A K H <> S+ 0 0 118 -3,-1.9 4,-2.5 2,-0.1 -2,-0.2 0.644 99.7 82.2-116.0 -21.8 17.3 -0.4 -1.7 88 88 A V H X S+ 0 0 18 -4,-2.1 4,-2.4 1,-0.2 5,-0.2 0.835 90.1 53.3 -70.4 -30.7 14.7 -1.0 1.0 89 89 A E H X S+ 0 0 44 -4,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.950 113.8 43.5 -64.9 -44.3 15.7 -4.7 1.7 90 90 A D H > S+ 0 0 104 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.889 113.6 52.2 -64.6 -40.4 19.3 -3.6 2.4 91 91 A E H X S+ 0 0 95 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.901 108.8 49.4 -65.3 -37.9 18.1 -0.6 4.4 92 92 A F H X S+ 0 0 33 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.919 110.4 50.9 -68.3 -39.6 15.9 -2.8 6.6 93 93 A T H X S+ 0 0 42 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.946 111.6 47.6 -58.3 -47.3 18.8 -5.1 7.2 94 94 A K H X S+ 0 0 122 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.929 112.5 50.0 -61.0 -42.8 21.0 -2.2 8.2 95 95 A H H X S+ 0 0 83 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.925 108.9 50.1 -66.7 -42.8 18.3 -0.8 10.5 96 96 A a H X>S+ 0 0 5 -4,-2.7 4,-3.0 1,-0.2 6,-0.7 0.942 111.4 50.4 -57.8 -45.2 17.7 -4.1 12.3 97 97 A N H X5S+ 0 0 71 -4,-2.4 4,-1.4 -5,-0.2 -2,-0.2 0.917 112.2 47.5 -57.8 -44.0 21.4 -4.3 12.8 98 98 A D H <5S+ 0 0 134 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.955 121.2 34.0 -60.4 -51.6 21.5 -0.8 14.2 99 99 A I H <5S+ 0 0 84 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.927 134.7 21.1 -77.3 -42.4 18.6 -1.2 16.6 100 100 A L H <5S- 0 0 74 -4,-3.0 -3,-0.2 2,-0.3 -2,-0.2 0.572 100.7-112.0-107.6 -13.6 18.9 -4.8 17.7 101 101 A G S < - 0 0 0 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.377 26.8-109.2 -76.8 158.7 14.9 -12.9 10.9 106 106 A P H > S+ 0 0 11 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.909 120.6 49.4 -53.9 -41.2 12.9 -13.6 7.7 107 107 A S H > S+ 0 0 8 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.895 108.8 52.5 -67.1 -37.3 9.8 -14.6 9.8 108 108 A E H > S+ 0 0 28 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.919 111.8 46.8 -60.9 -41.9 10.1 -11.4 11.8 109 109 A K H X S+ 0 0 10 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.927 113.5 47.3 -68.4 -43.8 10.2 -9.3 8.6 110 110 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 -5,-0.2 5,-0.2 0.946 115.4 45.3 -60.4 -46.8 7.3 -11.2 7.0 111 111 A N H X S+ 0 0 13 -4,-2.6 4,-2.2 -5,-0.2 -80,-0.3 0.911 114.8 48.2 -65.1 -40.6 5.2 -10.9 10.2 112 112 A F H X S+ 0 0 15 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.925 112.9 45.5 -68.4 -45.0 6.1 -7.2 10.7 113 113 A I H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.911 112.1 52.5 -68.1 -36.3 5.4 -6.1 7.1 114 114 A A H X S+ 0 0 8 -4,-2.3 4,-0.6 -5,-0.3 3,-0.3 0.936 109.3 50.2 -62.4 -42.5 2.1 -8.1 7.1 115 115 A Y H >X S+ 0 0 2 -4,-2.2 3,-1.6 1,-0.2 4,-0.7 0.942 106.2 55.4 -60.2 -44.8 1.2 -6.2 10.3 116 116 A L H >< S+ 0 0 3 -4,-2.5 3,-1.0 1,-0.3 -40,-0.3 0.873 100.5 60.3 -55.5 -36.2 2.0 -2.9 8.6 117 117 A L H 3< S+ 0 0 51 -4,-1.8 -1,-0.3 -3,-0.3 -2,-0.2 0.700 104.8 50.3 -63.7 -21.2 -0.5 -3.8 5.8 118 118 A T H << S+ 0 0 69 -3,-1.6 2,-1.0 -4,-0.6 -1,-0.2 0.575 91.1 80.0 -96.2 -10.9 -3.2 -3.9 8.4 119 119 A E << + 0 0 36 -3,-1.0 -42,-0.3 -4,-0.7 -43,-0.2 -0.709 47.6 143.5 -99.5 89.1 -2.5 -0.5 10.0 120 120 A T + 0 0 59 -2,-1.0 -1,-0.2 1,-0.1 -3,-0.0 0.518 51.0 67.5-112.0 -0.3 -4.2 1.9 7.6 121 121 A K S S- 0 0 159 -3,-0.1 -63,-0.2 3,-0.0 -1,-0.1 -0.960 73.2-132.5-128.7 120.2 -5.6 4.5 10.0 122 122 A P - 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0 0 77 -2,-0.2 2,-0.1 12,-0.1 -2,-0.1 -0.666 46.0-150.5 -72.8 127.7 18.0 -33.1 28.4 186 61 B G E -D 195 0D 3 9,-2.6 9,-1.7 -2,-0.4 2,-0.3 -0.213 4.5-136.6 -90.3-176.0 21.1 -35.0 27.2 187 62 B K E -D 194 0D 111 -10,-2.4 2,-0.5 7,-0.3 7,-0.2 -0.952 18.9-123.5-146.0 122.4 23.9 -36.6 29.2 188 63 B N > - 0 0 50 5,-3.0 4,-2.9 -2,-0.3 5,-0.2 -0.591 16.6-151.9 -70.3 118.1 27.6 -36.2 28.4 189 64 B I T 4 S+ 0 0 99 -2,-0.5 -1,-0.2 1,-0.2 -12,-0.0 0.675 92.4 50.7 -67.4 -19.9 28.8 -39.8 28.0 190 65 B V T 4 S+ 0 0 123 3,-0.1 -1,-0.2 1,-0.1 -2,-0.1 0.852 127.1 16.6 -84.8 -37.4 32.3 -38.7 29.0 191 66 B T T 4 S- 0 0 93 2,-0.2 -2,-0.2 -3,-0.1 3,-0.1 0.630 91.4-126.4-114.7 -14.8 31.6 -36.8 32.2 192 67 B G < + 0 0 48 -4,-2.9 2,-0.2 1,-0.3 -3,-0.1 0.404 61.7 138.7 86.2 -1.1 28.1 -37.8 33.2 193 68 B K - 0 0 153 -5,-0.2 -5,-3.0 1,-0.1 -1,-0.3 -0.508 57.0-106.7 -83.5 141.6 26.8 -34.3 33.3 194 69 B E E -D 187 0D 143 -7,-0.2 -7,-0.3 -2,-0.2 -1,-0.1 -0.288 26.7-152.3 -65.7 150.0 23.5 -33.2 32.0 195 70 B I E -D 186 0D 31 -9,-1.7 -9,-2.6 -18,-0.2 3,-0.1 -0.991 20.2-119.2-126.2 120.3 23.2 -31.2 28.8 196 71 B P - 0 0 73 0, 0.0 -12,-0.1 0, 0.0 -11,-0.1 -0.218 48.0 -80.4 -57.3 154.9 20.3 -28.8 28.2 197 72 B P - 0 0 19 0, 0.0 -14,-0.2 0, 0.0 -12,-0.1 -0.151 28.5-147.7 -56.5 150.7 18.1 -29.5 25.2 198 73 B L S S+ 0 0 24 -16,-1.4 -15,-0.2 -14,-0.4 -13,-0.1 0.694 70.4 98.5 -85.3 -27.5 19.3 -28.5 21.7 199 74 B A >> - 0 0 0 -17,-2.3 4,-2.6 -15,-0.2 3,-1.2 -0.526 65.0-151.3 -70.2 116.3 15.8 -27.8 20.3 200 75 B P T 34 S+ 0 0 0 0, 0.0 -73,-0.2 0, 0.0 -1,-0.2 0.730 90.9 61.0 -70.5 -20.7 15.3 -24.1 20.5 201 76 B R T 34 S+ 0 0 89 43,-0.4 3,-0.2 40,-0.4 44,-0.1 0.808 116.6 36.3 -69.4 -25.7 11.5 -24.1 20.8 202 77 B V T <4 S+ 0 0 53 -3,-1.2 2,-0.6 1,-0.3 -1,-0.1 0.829 129.9 30.4 -91.2 -44.1 12.1 -26.1 24.0 203 78 B N >< - 0 0 27 -4,-2.6 3,-1.9 1,-0.1 -1,-0.3 -0.833 68.3-176.4-116.7 93.6 15.2 -24.4 25.2 204 79 B T T 3 S+ 0 0 89 -2,-0.6 -1,-0.1 1,-0.3 -3,-0.1 0.571 74.8 74.1 -75.3 -2.5 15.0 -20.8 24.0 205 80 B K T > S+ 0 0 173 -79,-0.1 3,-0.7 -3,-0.1 -1,-0.3 0.711 74.9 100.1 -77.8 -20.0 18.4 -20.0 25.4 206 81 B R T < S+ 0 0 74 -3,-1.9 -76,-0.2 1,-0.2 -77,-0.1 -0.421 86.1 19.3 -63.3 142.5 20.0 -21.9 22.6 207 82 B F T 3 S+ 0 0 22 2,-0.1 3,-0.3 -2,-0.1 -1,-0.2 0.899 76.4 144.2 64.6 45.4 21.2 -19.7 19.8 208 83 B T S < S+ 0 0 98 -3,-0.7 2,-0.6 1,-0.3 -2,-0.1 0.955 77.0 24.8 -75.8 -49.3 21.4 -16.5 21.8 209 84 B D S > S- 0 0 90 1,-0.1 4,-2.2 2,-0.0 -1,-0.3 -0.917 72.3-170.0-113.4 102.3 24.5 -15.2 20.1 210 85 B I H > S+ 0 0 25 -2,-0.6 4,-2.0 -3,-0.3 -1,-0.1 0.775 84.9 57.7 -77.0 -18.7 24.7 -16.7 16.6 211 86 B D H > S+ 0 0 106 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.924 109.7 45.7 -68.5 -42.1 28.2 -15.4 15.9 212 87 B K H > S+ 0 0 125 1,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.906 109.9 55.4 -61.5 -40.2 29.3 -17.3 19.0 213 88 B V H X S+ 0 0 28 -4,-2.2 4,-3.4 1,-0.2 5,-0.3 0.919 104.0 53.5 -60.3 -44.0 27.3 -20.3 17.9 214 89 B E H X S+ 0 0 42 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.944 113.5 43.2 -55.9 -46.2 29.1 -20.4 14.5 215 90 B D H X S+ 0 0 101 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.925 116.8 46.2 -63.6 -44.7 32.4 -20.4 16.4 216 91 B E H X S+ 0 0 87 -4,-3.0 4,-2.9 2,-0.2 -2,-0.2 0.891 109.1 53.8 -70.2 -37.3 31.3 -23.0 18.9 217 92 B F H X S+ 0 0 29 -4,-3.4 4,-2.6 -5,-0.2 5,-0.2 0.919 109.7 49.0 -65.6 -40.0 29.7 -25.3 16.3 218 93 B T H X S+ 0 0 46 -4,-1.8 4,-2.3 -5,-0.3 -2,-0.2 0.940 113.6 46.2 -60.9 -47.8 33.0 -25.4 14.4 219 94 B K H X S+ 0 0 124 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.909 112.9 50.3 -61.3 -40.7 34.9 -26.1 17.6 220 95 B H H X S+ 0 0 83 -4,-2.9 4,-3.0 2,-0.2 5,-0.3 0.920 109.4 49.3 -67.7 -43.1 32.5 -28.8 18.6 221 96 B b H X>S+ 0 0 5 -4,-2.6 4,-2.7 1,-0.2 6,-0.8 0.929 111.7 51.0 -59.1 -43.2 32.6 -30.6 15.2 222 97 B N H X5S+ 0 0 75 -4,-2.3 4,-1.3 -5,-0.2 -2,-0.2 0.915 113.6 45.1 -60.6 -42.9 36.3 -30.5 15.5 223 98 B D H <5S+ 0 0 135 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.944 122.3 34.1 -62.9 -52.5 36.2 -32.0 19.0 224 99 B I H <5S+ 0 0 88 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.903 136.5 18.8 -73.7 -39.4 33.6 -34.7 18.3 225 100 B L H <5S- 0 0 79 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.586 98.3-115.0-113.8 -15.3 34.5 -35.6 14.7 226 101 B G S < - 0 0 39 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.440 23.2-114.1 -83.7 158.8 29.9 -28.9 6.3 231 106 B P H > S+ 0 0 52 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.907 118.3 52.8 -57.7 -40.7 27.6 -25.9 5.8 232 107 B S H > S+ 0 0 40 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.903 109.1 50.1 -63.7 -38.6 24.9 -28.2 4.3 233 108 B E H > S+ 0 0 55 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.920 111.7 47.9 -60.2 -42.6 25.1 -30.4 7.4 234 109 B K H X S+ 0 0 9 -4,-2.3 4,-2.4 2,-0.2 5,-0.3 0.913 113.9 46.2 -66.0 -42.8 24.8 -27.4 9.7 235 110 B A H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.942 115.5 46.2 -63.6 -49.3 21.8 -26.0 7.7 236 111 B N H X S+ 0 0 12 -4,-2.6 4,-2.2 -5,-0.2 -80,-0.3 0.897 114.8 48.2 -59.2 -42.9 20.1 -29.4 7.6 237 112 B F H X S+ 0 0 16 -4,-2.5 4,-2.7 -5,-0.2 -2,-0.2 0.928 113.1 43.8 -68.3 -45.7 20.7 -30.0 11.3 238 113 B I H X S+ 0 0 1 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.910 112.2 53.9 -72.9 -33.7 19.5 -26.7 12.7 239 114 B A H < S+ 0 0 0 -4,-2.3 4,-0.3 -5,-0.3 3,-0.2 0.934 110.0 48.8 -60.9 -44.8 16.5 -26.8 10.4 240 115 B Y H >< S+ 0 0 6 -4,-2.2 3,-2.2 1,-0.2 4,-0.4 0.932 107.1 55.0 -54.5 -48.9 15.8 -30.2 11.9 241 116 B L H >< S+ 0 0 4 -4,-2.7 3,-1.3 1,-0.3 -40,-0.4 0.865 100.5 60.8 -55.1 -35.0 16.2 -28.9 15.4 242 117 B L T 3< S+ 0 0 0 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.561 101.7 54.2 -70.1 -8.7 13.6 -26.2 14.7 243 118 B T T < S+ 0 0 32 -3,-2.2 2,-0.5 -4,-0.3 -1,-0.3 0.420 84.9 94.5-106.2 -0.9 11.0 -29.0 14.1 244 119 B E < + 0 0 41 -3,-1.3 -43,-0.4 -4,-0.4 -42,-0.3 -0.828 38.5 153.9 -97.9 123.1 11.4 -30.8 17.4 245 120 B T + 0 0 77 -2,-0.5 -1,-0.1 1,-0.2 -4,-0.0 0.412 45.4 65.6-129.3 -3.3 8.9 -29.7 20.0 246 121 B K - 0 0 152 -62,-0.0 -63,-0.2 0, 0.0 -1,-0.2 -0.918 63.7-138.7-140.3 109.7 8.2 -32.4 22.5 247 122 B P 0 0 72 0, 0.0 -63,-0.1 0, 0.0 -2,-0.0 -0.404 360.0 360.0 -58.8 132.3 10.5 -34.0 25.2 248 123 B T 0 0 129 -67,-0.1 -64,-0.0 -2,-0.0 0, 0.0 0.498 360.0 360.0 -94.4 360.0 10.1 -37.7 25.5