==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 10-JUL-96 1HRO . COMPND 2 MOLECULE: CYTOCHROME C2; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOPILA GLOBIFORMIS; . AUTHOR M.M.BENNING,T.E.MEYER,H.M.HOLDEN . 210 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10906.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 57.6 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 . 8 3.8 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 . 10 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 61 29.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 2 0 2 0 2 2 0 2 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 2 A S 0 0 119 0, 0.0 62,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-177.4 -9.5 50.6 -6.7 2 3 A A - 0 0 29 1,-0.2 63,-0.1 93,-0.0 3,-0.1 -0.055 360.0 -63.8 -76.5 173.8 -12.0 51.0 -3.8 3 4 A P - 0 0 58 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.214 67.3 -85.8 -60.3 148.5 -15.8 51.9 -3.5 4 5 A P - 0 0 121 0, 0.0 2,-0.2 0, 0.0 92,-0.1 -0.348 55.0-176.7 -62.8 122.9 -16.9 55.4 -4.7 5 6 A G - 0 0 33 90,-0.3 91,-0.2 -2,-0.2 88,-0.1 -0.604 30.0-115.1-118.7 177.3 -16.6 58.2 -2.1 6 7 A D > - 0 0 73 86,-0.3 4,-2.4 -2,-0.2 94,-0.2 -0.973 15.7-160.9-116.2 107.3 -17.3 61.9 -1.4 7 8 A P H > S+ 0 0 53 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.639 89.0 60.3 -63.2 -23.8 -14.1 64.0 -0.8 8 9 A V H > S+ 0 0 112 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.932 113.1 35.1 -70.3 -50.5 -16.1 66.8 0.8 9 10 A E H > S+ 0 0 61 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.896 114.0 61.1 -69.8 -35.0 -17.4 64.6 3.6 10 11 A G H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 -2,-0.2 0.875 104.0 49.5 -57.3 -38.7 -14.0 62.7 3.5 11 12 A K H X S+ 0 0 109 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.890 109.4 52.6 -67.3 -37.3 -12.4 66.0 4.4 12 13 A H H < S+ 0 0 97 -4,-1.5 -2,-0.2 2,-0.2 -1,-0.2 0.928 112.9 42.1 -65.8 -42.0 -14.9 66.3 7.1 13 14 A L H >X>S+ 0 0 7 -4,-2.6 4,-1.5 1,-0.2 3,-1.4 0.889 112.1 55.1 -70.2 -40.7 -14.0 62.8 8.5 14 15 A F H 3<>S+ 0 0 0 -4,-3.1 5,-2.7 1,-0.3 3,-0.4 0.939 110.8 46.7 -53.8 -46.3 -10.3 63.4 8.0 15 16 A H T 3<5S+ 0 0 72 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.309 116.6 42.5 -83.0 7.7 -10.6 66.5 10.1 16 17 A T T <45S+ 0 0 76 -3,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.479 133.8 10.4-125.4 -11.7 -12.6 65.0 12.8 17 18 A I T ><5S+ 0 0 43 -4,-1.5 3,-1.1 -3,-0.4 4,-0.2 0.591 127.0 40.3-130.5 -67.7 -10.7 61.7 13.1 18 19 A C G >> S- 0 0 108 3,-0.2 3,-1.1 11,-0.1 11,-0.4 -0.761 82.3 -99.2-101.1 137.4 -0.0 68.9 4.7 26 27 A K T 3 S- 0 0 150 -2,-0.4 3,-0.1 1,-0.2 -2,-0.1 -0.321 98.6 -6.3 -59.6 124.4 3.0 67.9 2.8 27 28 A G T 3 S+ 0 0 21 9,-0.2 2,-0.8 1,-0.2 -1,-0.2 0.283 94.2 127.8 77.3 -9.9 6.0 66.9 4.9 28 29 A A < - 0 0 24 -3,-1.1 2,-0.3 5,-0.1 -5,-0.3 -0.723 38.2-172.8 -88.1 112.1 4.4 67.8 8.2 29 30 A N B +A 135 0A 0 106,-2.6 106,-2.8 -2,-0.8 2,-0.1 -0.796 14.7 159.5-105.2 141.2 4.6 64.9 10.6 30 31 A K S S- 0 0 57 2,-2.8 -8,-0.1 -2,-0.3 -1,-0.1 -0.018 75.6 -33.3-126.6-125.5 3.0 64.6 14.0 31 32 A V S S+ 0 0 102 -10,-0.4 -9,-0.2 -11,-0.1 -10,-0.1 0.839 141.2 31.4 -70.1 -35.3 2.2 61.4 16.0 32 33 A G S S- 0 0 6 -11,-2.7 -2,-2.8 1,-0.1 -9,-0.1 -0.763 103.1 -91.7-116.2 163.2 1.6 59.9 12.6 33 34 A P - 0 0 16 0, 0.0 -10,-0.3 0, 0.0 -4,-0.1 -0.329 55.9 -81.2 -74.7 157.3 3.3 60.7 9.2 34 35 A S - 0 0 0 1,-0.2 -10,-0.2 -12,-0.1 -5,-0.1 -0.395 31.5-152.8 -58.0 137.6 1.8 63.3 6.8 35 36 A L > + 0 0 25 -12,-2.8 3,-1.9 -7,-0.1 4,-0.3 0.359 57.9 121.4 -90.3 1.3 -1.1 61.7 4.8 36 37 A Y T 3 S+ 0 0 60 -11,-0.4 -9,-0.2 -13,-0.3 69,-0.1 -0.478 88.0 3.4 -64.9 129.9 -0.4 64.2 2.0 37 38 A G T 3 S+ 0 0 28 67,-2.2 -1,-0.3 64,-0.3 4,-0.1 0.747 90.4 135.9 64.7 24.8 0.3 62.3 -1.1 38 39 A V X + 0 0 5 -3,-1.9 3,-1.6 63,-0.2 2,-0.4 0.818 37.5 97.4 -71.9 -31.1 -0.3 59.0 0.6 39 40 A V T 3 S+ 0 0 45 62,-0.4 24,-0.2 -4,-0.3 3,-0.1 -0.454 102.5 4.2 -64.9 112.9 -2.4 57.3 -2.2 40 41 A G T 3 S+ 0 0 45 22,-2.8 -1,-0.3 -2,-0.4 23,-0.2 0.261 100.8 131.1 95.1 -14.4 -0.0 55.2 -4.1 41 42 A R < - 0 0 29 -3,-1.6 21,-3.9 21,-0.4 -1,-0.4 -0.416 61.9-114.5 -74.0 152.2 2.9 55.8 -1.9 42 43 A H B > -B 61 0B 81 19,-0.3 3,-0.7 1,-0.1 19,-0.3 -0.645 41.1 -99.6 -80.4 143.6 4.9 53.0 -0.5 43 44 A S T 3 S+ 0 0 3 17,-3.3 -1,-0.1 -2,-0.3 16,-0.1 -0.149 98.5 21.9 -60.9 158.4 4.7 52.5 3.2 44 45 A G T 3 S+ 0 0 22 1,-0.1 -1,-0.2 -3,-0.1 7,-0.1 0.662 89.3 107.2 58.0 30.2 7.5 53.8 5.5 45 46 A I < + 0 0 96 -3,-0.7 -2,-0.1 2,-0.1 -1,-0.1 0.587 31.0 121.9-115.6 -3.0 8.9 56.4 3.3 46 47 A E S > S- 0 0 26 1,-0.1 3,-1.9 2,-0.1 5,-0.1 -0.417 72.0-108.4 -63.3 117.4 7.9 59.8 4.6 47 48 A P T 3 S+ 0 0 81 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.097 93.0 3.0 -49.5 132.9 11.0 61.7 5.3 48 49 A G T 3 S+ 0 0 9 1,-0.2 108,-2.5 108,-0.1 2,-0.3 0.335 94.2 130.4 76.4 -7.5 12.0 62.2 8.9 49 50 A Y B < -C 155 0C 17 -3,-1.9 2,-1.4 106,-0.2 -1,-0.2 -0.561 59.5-130.0 -82.8 138.1 9.1 60.1 10.3 50 51 A N - 0 0 58 104,-2.0 104,-0.1 -2,-0.3 105,-0.1 -0.632 34.9-173.8 -91.1 85.7 9.8 57.5 12.9 51 52 A Y - 0 0 23 -2,-1.4 2,-0.1 1,-0.1 103,-0.0 -0.226 24.4-105.8 -71.2 160.9 8.0 54.4 11.5 52 53 A S > - 0 0 5 1,-0.1 4,-2.0 -2,-0.0 5,-0.2 -0.413 27.2-111.1 -84.8 164.7 7.6 51.2 13.3 53 54 A E H > S+ 0 0 139 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.889 117.8 54.3 -61.5 -40.7 9.5 48.1 12.3 54 55 A A H > S+ 0 0 27 26,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.949 108.3 46.5 -61.9 -50.9 6.2 46.5 11.1 55 56 A N H > S+ 0 0 14 2,-0.2 4,-0.6 1,-0.2 5,-0.4 0.910 114.5 46.9 -60.1 -45.5 5.3 49.3 8.8 56 57 A I H >< S+ 0 0 94 -4,-2.0 3,-0.6 1,-0.2 -1,-0.2 0.973 115.6 44.1 -62.8 -52.2 8.8 49.5 7.2 57 58 A K H 3< S+ 0 0 171 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.742 93.5 89.8 -66.5 -20.2 9.1 45.8 6.8 58 59 A S H 3< S- 0 0 44 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.1 0.827 74.9-147.5 -46.1 -53.5 5.5 45.5 5.4 59 60 A G << + 0 0 52 -3,-0.6 2,-0.2 -4,-0.6 -1,-0.1 0.760 43.5 152.2 85.2 21.2 6.2 46.0 1.8 60 61 A I - 0 0 24 -5,-0.4 -17,-3.3 -4,-0.1 2,-0.4 -0.606 35.2-157.9 -88.6 150.9 2.8 47.7 1.4 61 62 A V B -B 42 0B 60 -19,-0.3 2,-2.3 -2,-0.2 -19,-0.3 -0.983 28.1-120.3-124.7 129.3 2.0 50.3 -1.2 62 63 A W + 0 0 16 -21,-3.9 -22,-2.8 -2,-0.4 -21,-0.4 -0.356 47.6 159.7 -75.2 66.1 -1.0 52.4 -0.3 63 64 A T > - 0 0 44 -2,-2.3 4,-2.6 -24,-0.2 3,-0.5 -0.521 55.2-104.1 -82.5 164.2 -3.4 51.8 -3.1 64 65 A P H > S+ 0 0 21 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.827 120.1 55.0 -54.1 -37.9 -7.1 52.6 -2.6 65 66 A D H > S+ 0 0 73 2,-0.2 4,-1.2 1,-0.2 5,-0.1 0.922 113.0 41.0 -61.9 -43.6 -8.0 48.9 -2.2 66 67 A V H > S+ 0 0 29 -3,-0.5 4,-2.8 2,-0.2 3,-0.3 0.908 111.1 54.2 -71.5 -47.6 -5.5 48.4 0.6 67 68 A L H X S+ 0 0 10 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.902 104.7 58.7 -54.7 -39.8 -6.2 51.7 2.4 68 69 A F H X S+ 0 0 37 -4,-2.0 4,-0.7 -5,-0.3 -1,-0.2 0.920 112.3 38.0 -58.3 -40.5 -9.9 50.5 2.4 69 70 A K H X S+ 0 0 101 -4,-1.2 4,-2.4 -3,-0.3 -2,-0.2 0.885 116.2 51.9 -75.9 -42.4 -8.9 47.4 4.3 70 71 A Y H < S+ 0 0 20 -4,-2.8 -2,-0.2 2,-0.2 -3,-0.2 0.891 104.5 54.1 -60.5 -48.6 -6.4 49.0 6.6 71 72 A I H < S+ 0 0 16 -4,-2.6 17,-2.0 -5,-0.2 -1,-0.2 0.830 111.5 49.2 -59.6 -29.1 -8.6 51.8 7.7 72 73 A E H < S+ 0 0 74 -4,-0.7 -2,-0.2 -5,-0.3 -1,-0.2 0.948 135.4 2.5 -75.2 -51.2 -11.1 49.1 8.8 73 74 A H >X - 0 0 73 -4,-2.4 4,-1.3 14,-0.1 3,-1.1 -0.700 64.3-177.9-143.4 87.3 -8.6 47.0 10.7 74 75 A P H 3> S+ 0 0 5 0, 0.0 4,-2.8 0, 0.0 3,-0.4 0.847 83.6 53.4 -54.4 -44.0 -5.1 48.4 10.9 75 76 A Q H 34 S+ 0 0 101 1,-0.2 -5,-0.1 2,-0.2 6,-0.0 0.708 104.2 57.2 -65.6 -23.7 -3.7 45.4 12.8 76 77 A K H <4 S+ 0 0 153 -3,-1.1 -1,-0.2 2,-0.2 -6,-0.1 0.879 116.8 33.3 -72.8 -34.6 -5.0 43.0 10.2 77 78 A I H < S+ 0 0 52 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.1 0.814 135.0 24.8 -88.2 -38.1 -3.1 44.8 7.4 78 79 A V S >< S- 0 0 2 -4,-2.8 3,-2.6 -5,-0.2 -1,-0.2 -0.574 82.7-156.4-129.3 74.4 -0.0 45.9 9.3 79 80 A P T 3 S+ 0 0 91 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.220 81.6 19.4 -50.5 119.5 0.3 43.5 12.2 80 81 A G T 3 S+ 0 0 47 1,-0.2 -26,-0.3 -26,-0.1 -25,-0.1 0.483 87.3 153.0 96.7 0.6 2.3 45.2 14.9 81 82 A T < - 0 0 15 -3,-2.6 -1,-0.2 -7,-0.1 -6,-0.0 -0.162 47.5-136.9 -62.6 153.1 1.7 48.8 13.6 82 83 A K + 0 0 109 2,-0.0 2,-0.8 -7,-0.0 -1,-0.1 0.401 67.6 118.2 -94.4 6.0 1.8 51.5 16.1 83 84 A M - 0 0 50 1,-0.1 -2,-0.1 -9,-0.1 -8,-0.1 -0.664 51.2-160.6 -75.8 108.9 -1.3 53.3 14.7 84 85 A G + 0 0 77 -2,-0.8 -1,-0.1 -10,-0.1 -2,-0.0 0.442 46.3 124.2 -68.9 -11.0 -3.7 53.2 17.6 85 86 A Y - 0 0 65 1,-0.2 3,-0.1 -67,-0.0 -2,-0.1 -0.411 57.5-144.7 -57.2 117.8 -7.0 53.8 15.7 86 87 A P - 0 0 117 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 0.749 54.0-100.5 -57.8 -23.2 -9.4 50.8 16.4 87 88 A G - 0 0 13 -14,-0.1 -15,-0.3 -13,-0.1 -14,-0.1 -0.454 27.3 -85.8 120.3 161.5 -10.7 51.1 12.9 88 89 A Q - 0 0 21 -17,-2.0 6,-0.1 -2,-0.2 -15,-0.0 -0.911 30.1-172.4-109.7 106.0 -13.6 52.5 10.9 89 90 A P + 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -17,-0.1 0.769 63.0 86.9 -71.2 -25.7 -16.5 50.2 10.7 90 91 A D > - 0 0 60 1,-0.2 4,-1.4 2,-0.1 3,-0.1 -0.701 62.0-160.5 -81.4 121.0 -18.6 52.3 8.3 91 92 A P H > S+ 0 0 69 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.649 91.9 54.5 -69.7 -25.9 -17.5 51.3 4.7 92 93 A Q H > S+ 0 0 104 2,-0.2 4,-2.2 1,-0.2 -86,-0.3 0.798 107.3 50.0 -77.6 -33.4 -19.0 54.6 3.3 93 94 A K H > S+ 0 0 77 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.839 110.6 50.3 -74.2 -33.8 -16.9 56.6 5.8 94 95 A R H X S+ 0 0 12 -4,-1.4 4,-2.6 2,-0.2 5,-0.2 0.966 111.2 48.0 -69.3 -42.5 -13.9 54.6 4.7 95 96 A A H X S+ 0 0 2 -4,-1.8 4,-2.2 1,-0.2 -90,-0.3 0.894 113.6 48.5 -63.6 -35.9 -14.7 55.3 0.9 96 97 A D H X S+ 0 0 12 -4,-2.2 4,-2.0 -91,-0.2 -86,-0.2 0.938 110.2 50.5 -71.3 -40.9 -15.2 59.0 1.7 97 98 A I H X S+ 0 0 2 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.947 112.1 47.0 -62.6 -42.3 -12.0 59.2 3.6 98 99 A I H X S+ 0 0 4 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.899 106.7 58.1 -65.5 -35.0 -10.2 57.6 0.8 99 100 A A H < S+ 0 0 11 -4,-2.2 4,-0.4 1,-0.2 -1,-0.2 0.911 109.2 45.6 -58.1 -43.1 -11.9 59.9 -1.8 100 101 A Y H >< S+ 0 0 19 -4,-2.0 3,-1.4 -94,-0.2 4,-0.4 0.880 107.6 57.1 -67.3 -39.6 -10.4 62.9 0.2 101 102 A L H >< S+ 0 0 4 -4,-2.1 3,-1.5 1,-0.3 -62,-0.4 0.863 99.5 62.7 -57.5 -37.1 -6.9 61.2 0.4 102 103 A E T 3< S+ 0 0 79 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.734 94.7 57.7 -63.4 -24.3 -7.0 61.0 -3.3 103 104 A T T < S+ 0 0 77 -3,-1.4 2,-1.4 -4,-0.4 -1,-0.3 0.559 82.4 92.8 -81.6 -10.4 -7.1 64.8 -3.8 104 105 A L < 0 0 15 -3,-1.5 -67,-2.2 -4,-0.4 -65,-0.2 -0.517 360.0 360.0 -87.1 64.0 -3.9 65.2 -1.8 105 106 A K 0 0 209 -2,-1.4 -67,-0.0 -69,-0.1 -3,-0.0 -0.740 360.0 360.0-153.9 360.0 -1.5 65.1 -4.7 106 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 107 2 B S 0 0 118 0, 0.0 62,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -4.6 24.7 81.1 29.3 108 3 B A - 0 0 19 1,-0.1 63,-0.1 93,-0.1 3,-0.1 -0.643 360.0 -68.4-103.7 165.5 25.4 81.7 25.6 109 4 B P - 0 0 58 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.378 64.2-101.8 -59.6 137.9 26.1 85.4 24.6 110 5 B P + 0 0 123 0, 0.0 2,-0.2 0, 0.0 92,-0.1 -0.348 51.3 173.7 -62.8 141.2 22.8 87.4 25.0 111 6 B G - 0 0 30 90,-0.3 91,-0.2 91,-0.1 88,-0.1 -0.627 35.7 -85.2-132.3-168.5 21.0 88.1 21.7 112 7 B D > - 0 0 65 86,-0.2 4,-2.7 -2,-0.2 94,-0.2 -0.938 20.6-160.2-110.3 114.7 17.8 89.6 20.2 113 8 B P H > S+ 0 0 54 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.800 96.4 55.0 -62.3 -29.1 14.8 87.2 20.0 114 9 B V H > S+ 0 0 109 2,-0.2 4,-1.4 1,-0.2 3,-0.1 0.938 110.0 44.2 -69.4 -48.4 13.3 89.6 17.3 115 10 B E H > S+ 0 0 78 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.947 113.6 54.4 -56.2 -47.6 16.5 89.3 15.3 116 11 B G H X S+ 0 0 0 -4,-2.7 4,-2.4 86,-0.4 -2,-0.2 0.786 102.2 56.5 -58.3 -37.3 16.3 85.4 16.0 117 12 B K H X S+ 0 0 111 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.928 110.3 43.4 -63.3 -48.5 12.8 85.0 14.7 118 13 B H H < S+ 0 0 114 -4,-1.4 -2,-0.2 1,-0.2 4,-0.2 0.930 114.9 50.4 -63.8 -43.4 13.7 86.4 11.4 119 14 B L H >X>S+ 0 0 8 -4,-2.3 4,-1.1 1,-0.2 3,-1.0 0.882 112.0 47.5 -62.4 -41.0 16.9 84.4 11.3 120 15 B F H ><>S+ 0 0 0 -4,-2.4 5,-2.9 1,-0.2 3,-0.6 0.951 111.0 51.8 -65.2 -44.3 15.0 81.2 12.2 121 16 B H T 3<5S+ 0 0 77 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.437 114.9 41.9 -74.4 4.4 12.4 82.0 9.5 122 17 B T T <45S+ 0 0 77 -3,-1.0 -1,-0.2 -4,-0.2 -2,-0.2 0.423 133.2 11.3-123.3 -11.9 15.0 82.5 6.9 123 18 B I T X<5S+ 0 0 41 -4,-1.1 3,-1.2 -3,-0.6 4,-0.3 0.603 127.8 38.7-129.5 -69.5 17.4 79.6 7.7 124 19 B C G >> S- 0 0 108 3,-0.3 3,-1.6 11,-0.1 11,-0.3 -0.961 81.4-102.8-115.2 131.5 5.6 74.7 16.4 132 27 B K T 3 S- 0 0 156 -2,-0.4 3,-0.1 1,-0.3 -2,-0.1 -0.158 99.3 -0.5 -53.3 129.5 5.1 72.1 19.1 133 28 B G T 3 S+ 0 0 31 1,-0.2 2,-0.6 9,-0.2 -1,-0.3 0.759 97.5 128.8 61.5 23.5 4.9 68.5 18.0 134 29 B A < - 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0 0 31 -3,-1.6 21,-3.1 21,-0.4 -1,-0.3 -0.657 61.2-111.7 -89.0 143.5 16.2 69.4 26.1 148 43 B H B > -D 167 0D 88 -2,-0.3 3,-0.7 19,-0.3 19,-0.3 -0.360 44.5-105.5 -62.0 141.4 18.0 66.0 25.9 149 44 B S T 3 S+ 0 0 3 17,-3.7 -1,-0.1 1,-0.2 16,-0.1 -0.357 94.9 20.7 -72.3 155.3 18.9 65.3 22.3 150 45 B G T 3 S+ 0 0 20 -3,-0.1 -1,-0.2 1,-0.1 7,-0.1 0.775 86.9 112.1 65.3 34.0 17.0 62.7 20.3 151 46 B I < + 0 0 92 -3,-0.7 -2,-0.1 2,-0.1 -1,-0.1 0.499 28.4 116.9-114.2 -8.9 13.8 62.7 22.3 152 47 B E > - 0 0 34 -12,-0.1 3,-1.6 1,-0.1 5,-0.1 -0.460 68.5-129.0 -60.0 114.2 11.0 64.2 20.1 153 48 B P T 3 S+ 0 0 106 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.467 89.7 30.1 -67.7 145.1 8.8 61.3 19.7 154 49 B G T 3 S+ 0 0 7 1,-0.3 -104,-2.0 -104,-0.1 2,-0.4 0.309 92.0 112.5 92.8 -11.1 7.9 60.6 16.1 155 50 B Y B < -C 49 0C 18 -3,-1.6 2,-1.2 -106,-0.2 -1,-0.3 -0.831 67.0-131.6 -99.0 135.6 11.1 62.0 14.7 156 51 B N - 0 0 73 -108,-2.5 -108,-0.1 -2,-0.4 2,-0.1 -0.685 34.0-167.2 -88.2 85.7 13.6 59.6 12.9 157 52 B Y - 0 0 25 -2,-1.2 2,-0.1 -5,-0.1 -19,-0.0 -0.353 21.3-110.3 -75.5 152.7 16.9 60.5 14.6 158 53 B S > - 0 0 20 1,-0.1 4,-2.6 -2,-0.1 5,-0.2 -0.387 26.6-117.5 -75.1 155.8 20.3 59.5 13.5 159 54 B E H > S+ 0 0 142 1,-0.2 4,-3.8 2,-0.2 5,-0.2 0.934 114.6 58.5 -57.6 -45.3 22.2 57.1 15.6 160 55 B A H > S+ 0 0 27 26,-0.3 4,-0.8 1,-0.2 -1,-0.2 0.905 109.5 42.0 -54.0 -43.6 24.8 59.8 16.2 161 56 B N H >> S+ 0 0 12 2,-0.2 3,-1.1 25,-0.2 4,-0.5 0.957 115.1 51.7 -66.8 -48.3 22.3 62.1 17.6 162 57 B I H 3< S+ 0 0 93 -4,-2.6 3,-0.5 1,-0.3 -2,-0.2 0.908 116.0 40.4 -51.3 -49.4 20.7 59.3 19.6 163 58 B K H 3< S+ 0 0 163 -4,-3.8 -1,-0.3 1,-0.2 -2,-0.2 0.467 91.0 90.3 -83.3 -6.1 24.0 58.2 21.0 164 59 B S H << S- 0 0 46 -3,-1.1 -1,-0.2 -4,-0.8 -2,-0.1 0.779 75.3-144.1 -62.1 -34.1 25.5 61.7 21.7 165 60 B G < + 0 0 54 -4,-0.5 2,-0.1 -3,-0.5 -1,-0.1 0.632 45.0 155.4 77.2 10.8 24.2 62.1 25.2 166 61 B I - 0 0 27 -5,-0.3 -17,-3.7 -18,-0.1 2,-0.5 -0.418 34.4-161.3 -75.6 146.1 23.8 65.8 24.5 167 62 B V B -D 148 0D 61 -19,-0.3 2,-3.0 -2,-0.1 -19,-0.3 -0.998 28.6-123.9-123.9 119.2 21.4 68.1 26.3 168 63 B W + 0 0 15 -21,-3.1 -22,-2.6 -2,-0.5 -21,-0.4 -0.218 45.2 162.6 -68.0 64.1 20.8 71.3 24.3 169 64 B T >> - 0 0 49 -2,-3.0 4,-2.7 -24,-0.2 3,-0.5 -0.415 53.9-100.9 -75.2 165.3 21.8 73.9 26.8 170 65 B P H 3> S+ 0 0 18 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.904 121.8 52.5 -51.1 -50.0 22.5 77.4 25.4 171 66 B D H 3> S+ 0 0 88 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.888 112.8 45.0 -55.7 -39.8 26.2 77.0 25.5 172 67 B V H <> S+ 0 0 38 -3,-0.5 4,-2.1 1,-0.2 3,-0.3 0.925 109.5 53.8 -70.4 -45.6 26.0 73.8 23.6 173 68 B L H X S+ 0 0 9 -4,-2.7 4,-3.3 1,-0.2 5,-0.3 0.885 104.2 58.4 -53.1 -42.6 23.6 75.1 21.0 174 69 B F H X S+ 0 0 21 -4,-2.3 4,-0.5 -5,-0.2 -1,-0.2 0.910 111.4 39.3 -55.8 -45.7 26.0 78.0 20.3 175 70 B K H X S+ 0 0 111 -4,-1.2 4,-1.7 -3,-0.3 -1,-0.2 0.840 116.6 53.0 -72.0 -37.4 28.9 75.7 19.4 176 71 B Y H < S+ 0 0 23 -4,-2.1 -2,-0.2 1,-0.2 7,-0.2 0.944 104.6 50.7 -67.6 -52.0 26.6 73.4 17.5 177 72 B I H < S+ 0 0 18 -4,-3.3 17,-1.9 1,-0.2 -1,-0.2 0.775 109.2 57.5 -62.1 -18.4 24.9 75.8 15.3 178 73 B E H < S+ 0 0 50 -4,-0.5 -1,-0.2 -5,-0.3 -2,-0.2 0.947 131.1 0.7 -73.7 -48.7 28.4 76.9 14.4 179 74 B H >X + 0 0 82 -4,-1.7 4,-1.5 14,-0.1 3,-1.2 -0.584 69.0 177.9-143.9 76.0 29.6 73.7 13.2 180 75 B P H 3> S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 7,-0.2 0.842 80.5 50.4 -46.8 -50.3 26.9 71.0 13.4 181 76 B Q H 34 S+ 0 0 82 10,-0.3 5,-0.2 1,-0.2 6,-0.2 0.733 109.5 51.8 -67.2 -21.9 28.9 68.1 11.9 182 77 B K H <4 S+ 0 0 153 -3,-1.2 -1,-0.2 -6,-0.2 -6,-0.1 0.857 114.1 41.7 -81.2 -37.9 31.9 68.7 14.2 183 78 B I H < S+ 0 0 55 -4,-1.5 -2,-0.2 1,-0.3 -1,-0.1 0.824 128.2 30.0 -81.8 -32.3 29.8 68.6 17.4 184 79 B V S >< S- 0 0 3 -4,-2.4 3,-2.8 -5,-0.2 -1,-0.3 -0.589 85.4-156.0-128.0 72.4 27.6 65.7 16.3 185 80 B P T 3 S+ 0 0 93 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.217 81.9 18.4 -50.4 125.2 29.8 63.6 14.0 186 81 B G T 3 S+ 0 0 66 1,-0.3 -26,-0.3 -5,-0.2 -25,-0.2 0.447 88.9 151.5 90.8 -0.4 27.6 61.6 11.7 187 82 B T < - 0 0 23 -3,-2.8 -1,-0.3 -7,-0.2 -3,-0.0 -0.303 47.3-139.6 -64.3 154.0 24.5 63.8 12.3 188 83 B K + 0 0 105 2,-0.0 2,-0.7 0, 0.0 -1,-0.1 0.325 68.0 116.6 -94.4 5.6 22.1 64.0 9.4 189 84 B M - 0 0 41 1,-0.2 -2,-0.1 -9,-0.1 -3,-0.1 -0.681 50.1-165.4 -72.1 111.4 21.6 67.8 9.9 190 85 B G + 0 0 67 -2,-0.7 -1,-0.2 -10,-0.1 -9,-0.1 0.573 44.3 123.3 -82.2 -9.0 22.9 69.1 6.6 191 86 B Y - 0 0 66 1,-0.2 -10,-0.3 -67,-0.0 3,-0.1 -0.327 57.5-145.3 -53.1 128.9 23.2 72.8 7.6 192 87 B P - 0 0 106 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 0.663 49.7-107.8 -70.9 -16.4 26.9 73.9 7.1 193 88 B G - 0 0 11 -14,-0.1 -15,-0.2 -13,-0.1 -14,-0.1 -0.449 22.1 -86.7 114.4 172.8 26.7 76.1 10.2 194 89 B Q - 0 0 23 -17,-1.9 6,-0.1 -2,-0.2 -15,-0.0 -0.944 28.6-168.4-125.8 101.6 26.5 79.8 11.0 195 90 B P + 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -17,-0.1 0.753 62.3 87.6 -60.3 -35.8 29.9 81.6 11.3 196 91 B D > - 0 0 62 1,-0.1 4,-1.5 2,-0.0 5,-0.1 -0.628 64.0-153.6 -74.9 120.9 28.7 84.9 12.9 197 92 B P H > S+ 0 0 71 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.872 93.5 53.4 -59.5 -45.7 28.5 84.8 16.8 198 93 B Q H > S+ 0 0 94 1,-0.2 4,-2.3 2,-0.2 -86,-0.2 0.915 107.7 51.0 -60.1 -41.2 25.8 87.4 17.0 199 94 B K H > S+ 0 0 81 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.888 111.9 47.3 -61.3 -41.5 23.5 85.6 14.6 200 95 B R H X S+ 0 0 11 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.890 112.9 48.4 -63.0 -48.7 23.9 82.3 16.6 201 96 B A H X S+ 0 0 2 -4,-2.6 4,-1.8 1,-0.2 -90,-0.3 0.855 111.7 50.9 -61.8 -36.7 23.3 84.2 19.9 202 97 B D H X S+ 0 0 9 -4,-2.3 4,-1.5 -5,-0.2 -86,-0.4 0.836 109.3 49.9 -67.4 -41.4 20.2 85.8 18.3 203 98 B I H X S+ 0 0 3 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.939 110.6 51.4 -63.1 -46.6 18.8 82.4 17.1 204 99 B I H X S+ 0 0 3 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.894 105.0 54.1 -57.4 -46.8 19.3 81.0 20.5 205 100 B A H < S+ 0 0 10 -4,-1.8 4,-0.5 1,-0.2 -1,-0.2 0.891 110.4 47.9 -58.2 -41.6 17.4 83.9 22.3 206 101 B Y H >X S+ 0 0 21 -4,-1.5 3,-1.8 -94,-0.2 4,-0.7 0.955 109.4 52.8 -65.8 -41.9 14.5 83.2 20.0 207 102 B L H >< S+ 0 0 8 -4,-2.6 3,-0.9 1,-0.3 -62,-0.4 0.856 100.8 61.6 -58.2 -37.0 14.7 79.6 20.8 208 103 B E T 3< S+ 0 0 71 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.606 98.3 58.8 -65.5 -14.0 14.6 80.3 24.5 209 104 B T T <4 S+ 0 0 68 -3,-1.8 2,-3.7 -4,-0.5 -1,-0.2 0.728 76.4 96.1 -86.4 -22.8 11.2 81.9 24.0 210 105 B L << 0 0 17 -3,-0.9 -67,-1.2 -4,-0.7 -65,-0.2 -0.304 360.0 360.0 -68.0 64.3 9.8 78.7 22.6 211 106 B K 0 0 220 -2,-3.7 -3,-0.0 -69,-0.1 -69,-0.0 -0.978 360.0 360.0-138.6 360.0 8.3 77.7 26.0