==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 15-SEP-98 1BVA . COMPND 2 MOLECULE: PROTEIN (CYTOCHROME C PEROXIDASE); . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR S.K.WILCOX,D.E.MCREE,D.B.GOODIN . 291 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12060.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 63.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 14 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 35.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 3 0 0 0 3 1 0 1 0 2 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 4 A L 0 0 132 0, 0.0 2,-0.5 0, 0.0 269,-0.0 0.000 360.0 360.0 360.0 104.0 12.3 89.2 74.1 2 5 A V - 0 0 97 269,-0.0 2,-0.6 2,-0.0 269,-0.1 -0.927 360.0-162.3-120.4 134.9 10.2 86.7 72.1 3 6 A H E -a 271 0A 25 267,-0.6 269,-3.9 -2,-0.5 2,-0.5 -0.940 13.6-159.7-110.9 103.4 8.9 87.2 68.6 4 7 A V E -a 272 0A 68 -2,-0.6 269,-0.2 267,-0.2 2,-0.2 -0.768 22.9-117.7 -91.1 127.4 6.0 84.8 67.9 5 8 A A - 0 0 9 267,-4.0 2,-0.5 -2,-0.5 122,-0.2 -0.454 30.3-166.2 -60.7 128.1 5.3 84.1 64.2 6 9 A S - 0 0 72 120,-2.4 120,-0.2 -2,-0.2 3,-0.1 -0.949 19.8-128.9-121.7 104.6 1.8 85.3 63.4 7 10 A V - 0 0 51 -2,-0.5 3,-0.2 118,-0.1 121,-0.0 -0.322 34.8-104.1 -51.8 121.7 0.4 84.0 60.1 8 11 A E > - 0 0 21 1,-0.2 3,-2.9 2,-0.1 -1,-0.1 -0.341 65.0 -75.9 -43.3 120.3 -0.9 87.0 58.1 9 12 A K T 3 S- 0 0 166 1,-0.3 -1,-0.2 -3,-0.1 3,-0.1 0.095 107.1 -13.6 -44.0 116.8 -4.7 86.6 58.7 10 13 A G T 3 S+ 0 0 63 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.331 99.4 138.7 81.6 -5.6 -6.2 83.8 56.6 11 14 A R < + 0 0 80 -3,-2.9 -1,-0.2 87,-0.1 2,-0.2 -0.263 22.4 165.3 -76.6 158.9 -3.1 83.5 54.4 12 15 A S >> - 0 0 62 -3,-0.1 4,-1.4 266,-0.0 3,-1.1 -0.832 53.4 -59.6-153.5-172.2 -1.7 80.2 53.2 13 16 A Y H 3> S+ 0 0 61 1,-0.3 4,-2.6 -2,-0.2 3,-0.4 0.845 125.6 55.6 -46.9 -51.7 0.7 78.7 50.7 14 17 A E H 3> S+ 0 0 58 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.827 105.5 53.3 -54.4 -37.4 -1.1 80.0 47.6 15 18 A D H <> S+ 0 0 24 -3,-1.1 4,-1.7 1,-0.2 -1,-0.2 0.926 112.1 42.6 -67.0 -41.4 -0.9 83.6 48.8 16 19 A F H X S+ 0 0 0 -4,-1.4 4,-3.8 -3,-0.4 -2,-0.2 0.873 108.5 58.4 -75.9 -33.6 2.8 83.5 49.3 17 20 A Q H X S+ 0 0 12 -4,-2.6 4,-3.0 1,-0.2 -1,-0.2 0.901 105.5 52.9 -61.0 -33.3 3.4 81.7 46.1 18 21 A K H X S+ 0 0 118 -4,-1.5 4,-2.7 -5,-0.3 -1,-0.2 0.918 109.5 46.2 -67.3 -41.1 1.6 84.6 44.5 19 22 A V H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.964 112.0 52.5 -66.0 -44.9 4.0 87.0 46.2 20 23 A Y H X S+ 0 0 0 -4,-3.8 4,-3.4 1,-0.2 -2,-0.2 0.913 110.7 47.7 -45.9 -55.9 6.9 84.7 45.1 21 24 A N H X S+ 0 0 21 -4,-3.0 4,-3.0 2,-0.2 5,-0.3 0.909 108.8 52.5 -61.8 -42.6 5.6 84.8 41.5 22 25 A A H X S+ 0 0 17 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.944 115.2 42.5 -58.4 -46.0 5.2 88.6 41.5 23 26 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 -5,-0.2 -2,-0.2 0.948 115.9 48.9 -63.4 -46.0 8.8 89.0 42.7 24 27 A A H X S+ 0 0 0 -4,-3.4 4,-2.1 -5,-0.2 -2,-0.2 0.872 111.2 49.3 -61.1 -38.8 10.0 86.3 40.4 25 28 A L H X S+ 0 0 71 -4,-3.0 4,-2.1 2,-0.2 -1,-0.2 0.876 112.6 47.6 -70.5 -39.0 8.3 87.8 37.4 26 29 A K H X S+ 0 0 59 -4,-2.0 4,-3.6 -5,-0.3 5,-0.3 0.871 108.3 54.7 -73.3 -34.2 9.7 91.3 38.2 27 30 A L H X S+ 0 0 10 -4,-2.6 4,-3.3 2,-0.2 -2,-0.2 0.954 110.0 46.6 -59.1 -47.3 13.2 89.8 38.6 28 31 A R H < S+ 0 0 133 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.927 118.2 44.7 -57.8 -39.6 12.8 88.3 35.1 29 32 A E H < S+ 0 0 156 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.883 124.1 31.6 -71.4 -37.7 11.6 91.8 34.1 30 33 A D H < S+ 0 0 39 -4,-3.6 2,-0.4 -5,-0.1 -2,-0.2 0.712 101.5 79.6-101.2 -22.4 14.2 93.8 35.9 31 34 A D < + 0 0 25 -4,-3.3 2,-0.4 -5,-0.3 7,-0.1 -0.728 40.1 168.2 -99.5 136.7 17.4 91.8 36.0 32 35 A E > - 0 0 73 -2,-0.4 3,-3.5 5,-0.3 161,-0.1 -0.964 39.7-126.5-139.4 130.1 19.9 91.3 33.2 33 36 A Y T 3 S+ 0 0 56 -2,-0.4 160,-0.2 1,-0.3 -1,-0.1 0.776 110.0 55.3 -40.5 -43.5 23.3 89.7 34.0 34 37 A E T 3 S+ 0 0 97 158,-0.1 -1,-0.3 -3,-0.1 4,-0.1 0.616 84.8 113.5 -69.2 -14.2 25.1 92.7 32.4 35 38 A N < - 0 0 81 -3,-3.5 -4,-0.0 1,-0.1 0, 0.0 -0.298 66.4-138.4 -72.2 145.3 23.3 95.3 34.7 36 39 A Y S S+ 0 0 142 1,-0.1 2,-0.6 2,-0.0 -1,-0.1 0.951 96.4 55.7 -58.1 -53.1 25.2 97.3 37.3 37 40 A I S S- 0 0 25 47,-0.0 2,-0.9 4,-0.0 -5,-0.3 -0.745 73.6-160.6 -83.6 117.2 22.3 96.8 39.8 38 41 A G > - 0 0 8 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 -0.850 6.8-174.6 -96.1 101.0 21.5 93.1 40.4 39 42 A Y H > S+ 0 0 58 -2,-0.9 4,-2.1 2,-0.2 -1,-0.2 0.962 85.6 49.2 -63.6 -47.0 18.0 93.2 41.8 40 43 A G H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.915 113.5 47.7 -54.9 -42.7 18.0 89.5 42.5 41 44 A D H > S+ 0 0 24 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.913 110.1 52.1 -65.5 -38.3 21.4 89.8 44.2 42 45 A D H X S+ 0 0 11 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.821 106.3 56.1 -64.6 -32.7 20.2 92.8 46.2 43 46 A L H X S+ 0 0 1 -4,-2.1 4,-2.3 2,-0.2 66,-0.4 0.876 110.2 41.5 -70.5 -41.1 17.2 90.7 47.3 44 47 A V H X S+ 0 0 9 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.912 116.6 49.1 -78.4 -32.9 19.2 87.9 48.8 45 48 A R H X S+ 0 0 63 -4,-2.5 4,-3.1 -5,-0.2 -2,-0.2 0.922 112.0 50.3 -65.0 -35.8 21.7 90.3 50.3 46 49 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.2 5,-0.3 0.946 108.4 51.1 -66.3 -41.7 18.8 92.3 51.7 47 50 A A H X S+ 0 0 0 -4,-2.3 4,-0.9 1,-0.2 -1,-0.2 0.891 114.0 46.1 -60.2 -35.4 17.3 89.1 53.2 48 51 A W H X S+ 0 0 42 -4,-2.1 4,-3.2 2,-0.2 3,-0.5 0.948 112.9 48.0 -72.3 -46.9 20.7 88.4 54.8 49 52 A H H < S+ 0 0 14 -4,-3.1 4,-0.3 1,-0.3 -2,-0.2 0.794 108.7 52.9 -69.4 -27.5 21.2 91.9 56.1 50 53 A I H < S+ 0 0 3 -4,-2.4 -1,-0.3 -5,-0.2 3,-0.2 0.796 119.9 36.9 -71.7 -28.4 17.8 92.2 57.6 51 54 A S H >< S+ 0 0 0 -4,-0.9 3,-1.8 -3,-0.5 -2,-0.2 0.788 105.3 67.8 -87.2 -34.4 18.5 88.9 59.4 52 55 A G T 3< S+ 0 0 0 -4,-3.2 -3,-0.1 1,-0.3 -1,-0.1 0.476 83.5 72.5 -73.3 -2.5 22.2 89.5 60.1 53 56 A T T 3 S+ 0 0 3 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.442 76.5 122.7 -80.9 -5.6 21.5 92.3 62.6 54 57 A W < - 0 0 22 -3,-1.8 2,-0.5 7,-0.2 7,-0.3 -0.254 47.9-162.7 -63.9 143.4 20.3 89.5 64.9 55 58 A D B >>> -B 60 0B 28 5,-2.3 4,-1.9 1,-0.1 3,-0.7 -0.947 8.7-159.8-124.3 113.8 21.9 89.0 68.3 56 59 A K T 345S+ 0 0 82 101,-2.6 -1,-0.1 -2,-0.5 102,-0.1 0.752 85.9 70.1 -57.6 -23.0 21.2 85.6 69.8 57 60 A H T 345S+ 0 0 130 1,-0.2 -1,-0.2 100,-0.2 -3,-0.0 0.882 124.3 1.1 -68.0 -41.6 22.0 87.1 73.3 58 61 A D T <45S- 0 0 77 -3,-0.7 -1,-0.2 2,-0.1 -2,-0.2 0.254 96.4-114.9-128.6 7.7 18.9 89.3 73.6 59 62 A N T <5 + 0 0 19 -4,-1.9 2,-0.2 1,-0.2 -3,-0.2 0.843 63.4 149.2 55.7 34.8 17.0 88.6 70.4 60 63 A T B < +B 55 0B 38 -5,-0.6 -5,-2.3 -7,-0.1 -1,-0.2 -0.553 52.7 12.7 -85.6 167.4 17.5 92.1 69.1 61 64 A G S S+ 0 0 12 73,-0.5 4,-0.3 -7,-0.3 -7,-0.2 -0.272 75.6 127.2 64.6-150.1 17.7 92.7 65.3 62 65 A G S S- 0 0 3 -13,-0.2 3,-0.4 1,-0.2 5,-0.4 0.012 74.9 -77.9 85.5 162.6 16.7 89.7 63.1 63 66 A S S > S+ 0 0 1 206,-0.5 3,-1.2 203,-0.3 -1,-0.2 0.664 104.5 88.5 -75.1 -18.2 14.3 89.6 60.2 64 67 A Y T 3 S+ 0 0 21 205,-0.4 38,-0.4 1,-0.3 -1,-0.2 0.862 88.3 42.7 -50.8 -53.7 11.1 89.4 62.3 65 68 A G T 3 S- 0 0 4 -3,-0.4 65,-2.6 -4,-0.3 -1,-0.3 0.513 92.8-136.3 -76.6 -10.5 10.3 93.1 62.8 66 69 A G X + 0 0 2 -3,-1.2 3,-1.7 63,-0.2 4,-0.1 0.821 44.9 158.6 56.5 37.4 11.0 94.2 59.2 67 70 A T G > + 0 0 5 -5,-0.4 3,-1.9 1,-0.3 6,-0.4 0.580 50.4 87.5 -76.6 -4.7 12.9 97.2 60.6 68 71 A Y G 3 S+ 0 0 0 1,-0.3 -1,-0.3 5,-0.2 8,-0.1 0.722 76.7 71.0 -61.1 -19.0 14.9 97.7 57.4 69 72 A R G < S+ 0 0 82 -3,-1.7 2,-0.3 4,-0.1 -1,-0.3 0.676 86.4 88.3 -67.9 -17.4 11.8 99.8 56.4 70 73 A F S X> S- 0 0 28 -3,-1.9 4,-3.3 -4,-0.1 3,-0.8 -0.644 87.6-121.3 -88.7 137.8 13.0 102.4 59.0 71 74 A K H 3> S+ 0 0 54 -2,-0.3 4,-2.6 1,-0.2 -1,-0.1 0.792 106.5 58.7 -46.1 -44.8 15.6 105.1 58.2 72 75 A K H 34 S+ 0 0 81 1,-0.2 -1,-0.2 2,-0.2 -4,-0.1 0.919 119.3 29.1 -59.6 -42.7 18.2 104.1 60.8 73 76 A E H X4 S+ 0 0 2 -3,-0.8 3,-2.3 -6,-0.4 -2,-0.2 0.871 116.4 59.4 -82.3 -43.1 18.6 100.6 59.3 74 77 A F H 3< S+ 0 0 52 -4,-3.3 -2,-0.2 -7,-0.4 -3,-0.2 0.883 110.7 45.1 -50.4 -38.1 17.7 101.7 55.7 75 78 A N T 3< S+ 0 0 95 -4,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.265 79.0 136.0 -96.3 15.6 20.6 104.1 56.0 76 79 A D X - 0 0 6 -3,-2.3 3,-2.6 1,-0.2 4,-0.2 -0.484 59.0-135.8 -59.5 127.4 23.0 101.6 57.5 77 80 A P G > S+ 0 0 92 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.848 107.7 61.1 -50.2 -36.2 26.3 102.0 55.6 78 81 A S G 3 S+ 0 0 34 1,-0.3 -2,-0.1 3,-0.0 -29,-0.0 0.610 100.6 54.6 -63.8 -19.8 26.4 98.2 55.5 79 82 A N G X S+ 0 0 0 -3,-2.6 3,-1.9 -6,-0.2 4,-0.4 0.267 74.1 143.1-103.2 9.4 23.1 98.3 53.6 80 83 A A T < S+ 0 0 22 -3,-1.6 101,-0.1 101,-0.3 -5,-0.1 -0.281 72.9 18.6 -55.0 126.7 24.4 100.6 50.8 81 84 A G T > S+ 0 0 5 99,-0.1 3,-2.1 100,-0.0 4,-0.5 -0.123 96.0 99.3 102.9 -33.7 22.9 99.5 47.5 82 85 A L T X> + 0 0 0 -3,-1.9 4,-1.9 1,-0.3 3,-1.5 0.774 61.3 82.0 -58.9 -21.3 20.1 97.5 49.1 83 86 A Q H 3> S+ 0 0 66 -4,-0.4 4,-2.7 1,-0.3 -1,-0.3 0.830 84.9 61.3 -53.3 -30.3 17.7 100.5 48.5 84 87 A N H <> S+ 0 0 63 -3,-2.1 4,-2.6 2,-0.2 -1,-0.3 0.871 103.5 48.5 -62.0 -36.7 17.4 99.1 45.0 85 88 A G H <> S+ 0 0 0 -3,-1.5 4,-2.3 -4,-0.5 -2,-0.2 0.922 110.6 50.6 -71.5 -39.4 16.0 95.9 46.5 86 89 A F H X S+ 0 0 36 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.915 112.7 46.1 -58.2 -47.3 13.6 98.0 48.6 87 90 A K H < S+ 0 0 69 -4,-2.7 -2,-0.2 1,-0.3 3,-0.2 0.879 110.3 54.1 -68.7 -39.6 12.5 99.9 45.6 88 91 A F H X S+ 0 0 3 -4,-2.6 4,-0.6 1,-0.2 -1,-0.3 0.936 112.3 44.5 -52.7 -47.6 12.1 96.7 43.6 89 92 A L H X S+ 0 0 2 -4,-2.3 4,-3.1 1,-0.2 5,-0.3 0.707 91.5 82.2 -79.5 -17.7 9.9 95.3 46.3 90 93 A E H X S+ 0 0 105 -4,-1.4 4,-2.6 1,-0.2 -1,-0.2 0.923 92.4 47.4 -57.0 -46.9 7.7 98.3 46.9 91 94 A P H > S+ 0 0 60 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.854 113.4 51.7 -63.3 -28.8 5.3 97.6 43.9 92 95 A I H X S+ 0 0 5 -4,-0.6 4,-2.2 2,-0.2 -2,-0.2 0.957 109.3 47.0 -72.9 -42.1 5.2 94.1 45.1 93 96 A H H < S+ 0 0 46 -4,-3.1 -1,-0.2 1,-0.2 6,-0.2 0.869 110.6 55.2 -63.2 -34.6 4.3 95.2 48.7 94 97 A K H < S+ 0 0 100 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.926 109.2 45.7 -63.3 -42.7 1.7 97.5 47.1 95 98 A E H < S+ 0 0 122 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.830 126.8 31.6 -67.0 -33.1 0.1 94.6 45.3 96 99 A F >< + 0 0 17 -4,-2.2 3,-1.4 -5,-0.2 -1,-0.3 -0.579 69.1 163.2-125.3 72.8 0.2 92.5 48.4 97 100 A P T 3 + 0 0 94 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.687 68.3 69.1 -64.5 -18.4 -0.2 95.0 51.2 98 101 A W T 3 S+ 0 0 55 -3,-0.1 2,-0.2 -4,-0.1 -89,-0.1 0.664 76.6 90.2 -78.5 -20.2 -1.1 92.2 53.7 99 102 A I S < S- 0 0 2 -3,-1.4 29,-0.1 -6,-0.2 -3,-0.0 -0.553 82.4-116.9 -76.4 143.3 2.3 90.5 53.8 100 103 A S > - 0 0 13 27,-0.3 4,-2.4 -2,-0.2 5,-0.1 -0.379 21.0-114.5 -70.6 161.9 4.6 91.9 56.6 101 104 A S H > S+ 0 0 6 1,-0.2 4,-3.6 2,-0.2 5,-0.3 0.937 115.9 51.9 -61.3 -51.4 7.8 93.7 55.7 102 105 A G H > S+ 0 0 0 -38,-0.4 4,-2.4 1,-0.2 5,-0.3 0.878 111.8 46.9 -50.7 -44.1 10.0 91.0 57.3 103 106 A D H > S+ 0 0 0 24,-0.2 4,-3.1 -39,-0.2 -1,-0.2 0.928 114.8 46.7 -68.3 -40.9 8.2 88.3 55.3 104 107 A L H X S+ 0 0 1 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.939 114.7 45.2 -68.1 -43.9 8.5 90.2 52.1 105 108 A F H X S+ 0 0 4 -4,-3.6 4,-1.3 2,-0.2 -1,-0.2 0.924 118.5 43.1 -64.1 -44.7 12.2 91.0 52.6 106 109 A S H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.3 3,-0.3 0.933 113.3 51.7 -68.5 -40.9 13.0 87.5 53.6 107 110 A L H X S+ 0 0 0 -4,-3.1 4,-3.2 -5,-0.3 5,-0.2 0.863 102.4 62.3 -64.7 -29.7 10.8 86.1 50.8 108 111 A G H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.928 105.2 44.6 -59.7 -45.0 12.6 88.3 48.3 109 112 A G H X S+ 0 0 0 -4,-1.3 4,-2.9 -66,-0.4 5,-0.3 0.904 113.9 50.2 -67.2 -40.7 15.9 86.6 49.0 110 113 A V H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.971 113.2 45.9 -59.7 -49.5 14.3 83.2 48.9 111 114 A T H X S+ 0 0 0 -4,-3.2 4,-2.7 1,-0.2 5,-0.3 0.927 113.1 50.0 -58.8 -45.3 12.6 84.0 45.6 112 115 A A H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 6,-0.2 0.927 110.7 49.0 -62.9 -47.0 15.8 85.4 44.2 113 116 A V H <>S+ 0 0 0 -4,-2.9 5,-2.7 1,-0.2 82,-0.2 0.940 114.4 45.0 -57.2 -44.8 17.9 82.5 45.1 114 117 A Q H ><5S+ 0 0 5 -4,-2.5 3,-1.6 -5,-0.3 -2,-0.2 0.948 112.6 50.1 -68.9 -39.7 15.4 80.0 43.7 115 118 A E H 3<5S+ 0 0 34 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.790 104.6 58.5 -70.6 -26.8 14.9 81.9 40.5 116 119 A M T 3<5S- 0 0 10 -4,-1.9 79,-4.0 -5,-0.3 -1,-0.3 0.195 127.8-100.6 -90.3 23.5 18.7 82.2 40.0 117 120 A Q T < 5S+ 0 0 103 -3,-1.6 -3,-0.2 77,-0.2 -2,-0.2 0.698 78.6 138.9 76.9 21.4 18.7 78.3 40.0 118 121 A G < - 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