==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 20-MAY-11 3AYZ . COMPND 2 MOLECULE: MEMBRANE-BOUND HYDROGENASE LARGE SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: HYDROGENOVIBRIO MARINUS; . AUTHOR Y.SHOMURA,K.S.YOON,H.NISHIHARA,Y.HIGUCHI . 1730 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49217.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1207 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 66 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 178 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 0.7 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 0.2 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 . 111 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 226 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 522 30.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 40 2.3 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 7 10 8 6 0 2 3 5 0 0 6 0 2 0 0 0 2 4 0 0 0 2 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 8 0 0 2 5 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 PARALLEL BRIDGES PER LADDER . 29 4 6 2 2 0 4 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 8 6 4 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 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 81 0, 0.0 12,-1.7 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 156.4 26.0 -36.0 -14.9 2 3 A V E -A 12 0A 71 10,-0.2 2,-0.6 11,-0.1 10,-0.2 -0.982 360.0-166.0-125.0 111.6 27.7 -32.8 -15.8 3 4 A L E -A 11 0A 80 8,-2.6 8,-3.0 -2,-0.5 2,-0.9 -0.908 9.2-155.9-105.9 119.3 25.4 -30.0 -16.6 4 5 A N E -A 10 0A 104 -2,-0.6 6,-0.2 6,-0.2 553,-0.0 -0.812 22.3-150.9 -92.0 101.8 26.9 -26.9 -18.3 5 6 A T > - 0 0 12 4,-3.0 3,-1.7 -2,-0.9 552,-0.1 -0.319 21.0-121.9 -77.7 153.2 24.5 -24.1 -17.5 6 7 A P T 3 S+ 0 0 62 0, 0.0 -1,-0.1 0, 0.0 551,-0.1 0.807 113.9 61.4 -63.1 -23.5 23.9 -21.1 -19.7 7 8 A N T 3 S- 0 0 24 549,-0.1 -2,-0.1 2,-0.1 549,-0.0 0.204 125.7-100.5 -96.0 25.5 24.9 -18.9 -16.7 8 9 A H S < S+ 0 0 166 -3,-1.7 2,-0.3 1,-0.3 -4,-0.1 0.756 77.9 127.7 77.0 36.5 28.3 -20.6 -16.8 9 10 A Y - 0 0 50 2,-0.0 -4,-3.0 -6,-0.0 2,-0.6 -0.829 49.1-144.1-115.8 151.3 28.3 -23.2 -14.0 10 11 A K E -A 4 0A 115 -2,-0.3 2,-0.7 -6,-0.2 -6,-0.2 -0.926 16.2-158.8-114.9 98.6 29.2 -26.9 -14.4 11 12 A M E -A 3 0A 2 -8,-3.0 -8,-2.6 -2,-0.6 2,-0.5 -0.746 14.4-179.1 -88.2 114.5 26.9 -28.8 -12.1 12 13 A D E +A 2 0A 42 31,-2.8 3,-0.4 -2,-0.7 -10,-0.2 -0.953 17.2 178.2-122.7 109.8 28.5 -32.2 -11.4 13 14 A N + 0 0 53 -12,-1.7 -11,-0.1 -2,-0.5 -1,-0.1 0.108 58.1 95.8-104.4 27.5 26.8 -34.7 -9.1 14 15 A S + 0 0 93 -13,-0.3 -1,-0.2 29,-0.1 3,-0.1 0.736 69.5 79.2 -85.6 -19.9 29.4 -37.5 -9.4 15 16 A G S S- 0 0 26 -3,-0.4 22,-0.2 1,-0.2 2,-0.1 -0.087 101.9 -56.8 -76.9-178.6 31.2 -36.6 -6.1 16 17 A R E -B 36 0B 111 20,-1.2 20,-2.1 19,-0.1 2,-0.4 -0.309 55.6-130.7 -60.9 136.4 30.1 -37.4 -2.6 17 18 A R E -B 35 0B 36 18,-0.2 2,-0.4 -3,-0.1 18,-0.2 -0.772 18.6-167.9 -96.6 132.4 26.6 -36.2 -1.7 18 19 A V E -B 34 0B 7 16,-2.9 16,-2.6 -2,-0.4 2,-0.5 -0.982 7.5-158.1-120.1 128.3 26.0 -34.2 1.5 19 20 A V E -B 33 0B 20 -2,-0.4 2,-0.5 14,-0.2 627,-0.4 -0.929 8.5-171.1-114.6 130.5 22.4 -33.6 2.7 20 21 A I E +B 32 0B 2 12,-3.0 12,-2.3 -2,-0.5 3,-0.3 -0.924 16.1 175.2-118.4 101.6 21.3 -30.8 5.0 21 22 A D + 0 0 9 -2,-0.5 10,-0.1 1,-0.4 628,-0.1 -0.821 67.9 33.5-155.0 106.9 17.7 -31.3 6.1 22 23 A P S S- 0 0 7 0, 0.0 623,-3.1 0, 0.0 2,-0.8 0.312 75.8-159.8 -84.1 146.9 16.6 -29.4 8.1 23 24 A V - 0 0 3 7,-2.2 7,-0.4 -3,-0.3 3,-0.2 -0.862 25.6-160.9 -79.5 113.9 18.5 -26.2 7.3 24 25 A T + 0 0 0 -2,-0.8 615,-0.2 1,-0.2 614,-0.1 -0.344 59.9 49.4 -94.6 176.3 18.1 -24.4 10.6 25 26 A R S S+ 0 0 2 613,-3.0 2,-0.3 1,-0.3 -1,-0.2 0.878 92.1 97.5 53.1 46.1 18.4 -20.8 11.5 26 27 A I S S- 0 0 4 612,-0.3 2,-0.6 2,-0.2 -1,-0.3 -0.850 86.1 -97.1-133.1 169.6 16.2 -19.7 8.7 27 28 A E B S-d 589 0C 2 561,-1.8 563,-2.6 -2,-0.3 564,-0.2 -0.864 89.5 -12.3 -85.4 138.2 12.5 -18.9 8.6 28 29 A G S S- 0 0 6 -2,-0.6 2,-0.4 562,-0.2 -2,-0.2 -0.496 103.6 -36.2 81.8-150.5 10.6 -21.9 7.6 29 30 A H + 0 0 6 -2,-0.2 21,-1.6 -7,-0.1 22,-0.4 -0.962 53.3 163.5-128.6 126.6 11.8 -25.2 6.0 30 31 A M E - C 0 49B 1 -2,-0.4 -7,-2.2 -7,-0.4 2,-0.4 -0.988 19.1-158.8-138.1 148.2 14.6 -25.8 3.6 31 32 A R E - C 0 48B 4 17,-2.6 17,-2.8 -2,-0.3 2,-0.4 -0.972 12.3-172.3-117.6 138.2 16.6 -28.8 2.4 32 33 A C E -BC 20 47B 2 -12,-2.3 -12,-3.0 -2,-0.4 2,-0.4 -0.999 2.2-174.4-128.6 135.1 20.0 -28.3 0.7 33 34 A E E -BC 19 46B 0 13,-1.8 13,-2.6 -2,-0.4 2,-0.3 -0.983 7.3-179.2-123.7 142.0 22.1 -31.1 -1.0 34 35 A V E -BC 18 45B 0 -16,-2.6 -16,-2.9 -2,-0.4 2,-0.4 -0.922 20.1-141.5-129.8 161.4 25.6 -30.6 -2.3 35 36 A N E -BC 17 44B 4 9,-1.8 8,-3.0 -2,-0.3 9,-1.0 -0.981 19.1-161.0-117.7 136.3 28.2 -32.8 -4.1 36 37 A V E -BC 16 42B 3 -20,-2.1 -20,-1.2 -2,-0.4 6,-0.2 -0.912 10.6-133.3-116.8 144.2 31.9 -32.4 -3.2 37 38 A D > - 0 0 47 4,-2.4 3,-2.3 -2,-0.4 -1,-0.0 -0.162 44.9 -81.9 -79.5-175.7 34.9 -33.4 -5.2 38 39 A E T 3 S+ 0 0 180 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.621 132.1 55.6 -69.8 -14.2 37.9 -35.3 -3.9 39 40 A N T 3 S- 0 0 109 2,-0.2 -1,-0.3 0, 0.0 531,-0.2 0.164 119.9-109.4 -98.6 11.3 39.3 -31.9 -2.7 40 41 A N S < S+ 0 0 54 -3,-2.3 530,-2.5 1,-0.3 2,-0.4 0.741 72.3 142.5 62.8 28.1 36.1 -31.2 -0.7 41 42 A V B -E 569 0D 26 528,-0.3 -4,-2.4 1,-0.0 2,-0.3 -0.837 57.4-112.2 -97.8 135.3 35.1 -28.5 -3.0 42 43 A I E +C 36 0B 0 526,-2.5 525,-2.6 -2,-0.4 -6,-0.3 -0.446 39.5 167.6 -71.3 124.9 31.4 -28.1 -3.8 43 44 A Q E + 0 0 57 -8,-3.0 -31,-2.8 1,-0.3 2,-0.3 0.319 67.1 27.1-121.7 3.9 30.7 -29.0 -7.5 44 45 A N E -C 35 0B 2 -9,-1.0 -9,-1.8 -33,-0.2 2,-0.3 -0.947 61.7-171.1-159.8 148.3 26.9 -29.2 -7.3 45 46 A A E -C 34 0B 0 -2,-0.3 2,-0.4 -11,-0.2 -11,-0.2 -0.995 3.9-164.3-144.9 139.3 24.2 -27.5 -5.1 46 47 A V E -C 33 0B 1 -13,-2.6 -13,-1.8 -2,-0.3 2,-0.6 -0.990 5.3-158.2-134.2 117.4 20.5 -28.2 -4.9 47 48 A S E -C 32 0B 2 -2,-0.4 2,-0.5 -15,-0.2 -15,-0.2 -0.887 13.8-177.2 -98.2 116.0 18.1 -25.7 -3.2 48 49 A T E -C 31 0B 0 -17,-2.8 -17,-2.6 -2,-0.6 2,-0.6 -0.953 19.4-151.1-119.5 118.4 14.8 -27.3 -2.0 49 50 A G E -C 30 0B 0 -2,-0.5 347,-2.2 -19,-0.2 -19,-0.2 -0.756 13.8-165.2 -81.5 121.3 12.0 -25.4 -0.4 50 51 A T + 0 0 1 -21,-1.6 631,-2.8 -2,-0.6 2,-0.3 0.134 57.4 56.9-102.1 18.0 10.3 -27.9 1.8 51 52 A M B +F 680 0E 0 -22,-0.4 2,-0.3 629,-0.2 629,-0.2 -0.992 48.1 175.5-141.6 158.1 7.0 -26.3 2.6 52 53 A W + 0 0 0 627,-2.0 543,-0.1 -2,-0.3 539,-0.1 -0.968 9.7 172.8-156.5 144.1 3.9 -24.8 0.9 53 54 A R - 0 0 1 542,-2.6 668,-0.4 -2,-0.3 670,-0.1 0.571 40.4-127.1-120.4 -35.0 0.7 -23.4 2.1 54 55 A G >> + 0 0 0 541,-1.6 4,-2.4 540,-0.2 3,-0.6 0.878 41.7 162.0 89.4 35.7 -1.1 -22.0 -0.9 55 56 A L H 3> S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.867 76.7 59.1 -52.8 -36.0 -2.0 -18.4 -0.1 56 57 A E H 34 S+ 0 0 3 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.881 110.1 43.1 -62.0 -35.6 -2.5 -17.6 -3.8 57 58 A V H X4 S+ 0 0 36 -3,-0.6 3,-1.2 1,-0.2 -1,-0.2 0.920 111.2 54.6 -73.1 -46.8 -5.2 -20.4 -3.9 58 59 A I H 3< S+ 0 0 1 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.869 101.3 59.7 -60.2 -31.5 -6.8 -19.3 -0.6 59 60 A L T >< S+ 0 0 1 -4,-2.1 3,-2.1 -5,-0.2 477,-0.3 0.694 76.2 116.5 -69.8 -26.6 -7.3 -15.7 -1.8 60 61 A R T < S+ 0 0 129 -3,-1.2 477,-0.2 -4,-0.4 3,-0.1 -0.276 82.9 9.9 -54.9 132.3 -9.4 -16.6 -4.8 61 62 A G T 3 S+ 0 0 42 475,-2.9 -1,-0.3 1,-0.3 476,-0.1 0.359 101.2 119.2 87.4 -8.7 -13.0 -15.2 -4.5 62 63 A R S < S- 0 0 44 -3,-2.1 474,-2.2 474,-0.1 -1,-0.3 -0.285 74.1 -86.6 -88.7 175.4 -12.2 -13.0 -1.5 63 64 A D >> - 0 0 29 472,-0.2 3,-2.1 1,-0.1 4,-0.7 -0.675 27.9-135.1 -82.8 130.4 -12.5 -9.2 -1.2 64 65 A P G >4 S+ 0 0 0 0, 0.0 3,-0.8 0, 0.0 4,-0.4 0.794 104.5 63.7 -53.7 -31.7 -9.3 -7.3 -2.3 65 66 A R G 34 S+ 0 0 26 1,-0.2 169,-0.3 2,-0.1 3,-0.2 0.715 104.2 46.8 -65.6 -24.2 -9.7 -5.1 0.8 66 67 A D G X> S+ 0 0 7 -3,-2.1 3,-1.1 1,-0.1 4,-1.0 0.512 88.3 89.4 -86.7 -18.7 -9.1 -8.2 3.0 67 68 A A H S+ 0 0 0 -4,-0.4 4,-1.8 1,-0.2 -1,-0.3 0.828 101.4 50.4 -56.9 -36.6 -3.4 -7.7 3.0 69 70 A A H <> S+ 0 0 0 -3,-1.1 4,-0.9 2,-0.2 -1,-0.2 0.872 111.6 47.4 -73.7 -36.8 -4.2 -9.5 6.2 70 71 A F H >< S+ 0 0 4 -4,-1.0 3,-0.7 -3,-0.4 -2,-0.2 0.955 116.4 43.0 -62.3 -55.8 -4.1 -13.0 4.5 71 72 A V H >< S+ 0 0 0 -4,-2.7 3,-2.3 1,-0.3 4,-0.4 0.779 100.8 68.6 -72.8 -22.1 -0.8 -12.3 2.7 72 73 A E H >< S+ 0 0 1 -4,-1.8 3,-1.7 -5,-0.3 8,-0.3 0.901 93.7 61.8 -55.3 -36.9 0.7 -10.7 5.8 73 74 A R T << S+ 0 0 4 -4,-0.9 -1,-0.3 -3,-0.7 -2,-0.2 0.364 75.5 89.9 -76.3 6.1 0.7 -14.2 7.2 74 75 A I T < S+ 0 0 0 -3,-2.3 2,-0.3 1,-0.2 -1,-0.3 0.863 105.8 9.5 -57.6 -34.1 3.0 -15.4 4.4 75 76 A C < - 0 0 0 -3,-1.7 5,-0.3 -4,-0.4 -1,-0.2 -0.949 46.9-171.1-160.7 126.8 5.7 -14.4 6.9 76 77 A G S S+ 0 0 0 533,-3.0 3,-0.4 -2,-0.3 534,-0.2 0.534 94.0 55.9 -92.8 -6.3 6.1 -13.4 10.5 77 78 A V S S+ 0 0 11 532,-0.5 2,-1.4 1,-0.2 -1,-0.1 0.923 115.1 35.9 -87.1 -59.2 9.8 -12.5 10.1 78 79 A C S >> S+ 0 0 4 2,-0.1 3,-1.3 39,-0.1 4,-0.6 -0.281 95.8 179.9 -86.3 56.4 9.3 -10.0 7.3 79 80 A T T 34 + 0 0 2 -2,-1.4 -3,-0.1 -3,-0.4 -6,-0.1 -0.377 59.1 12.7 -74.4 122.8 6.0 -9.0 9.0 80 81 A G T 3> S+ 0 0 0 -5,-0.3 4,-2.6 -8,-0.3 -1,-0.2 -0.056 95.2 98.0 105.0 -27.7 4.2 -6.3 7.2 81 82 A C H <> S+ 0 0 5 -3,-1.3 4,-2.3 1,-0.2 -2,-0.1 0.877 87.3 47.7 -65.1 -34.2 6.0 -6.2 3.9 82 83 A H H X S+ 0 0 0 -4,-0.6 4,-2.1 2,-0.2 -1,-0.2 0.848 109.8 53.1 -70.9 -33.6 3.3 -8.4 2.2 83 84 A A H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.934 110.3 48.4 -61.7 -42.2 0.6 -6.3 3.7 84 85 A L H X S+ 0 0 3 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.919 111.0 49.3 -65.8 -42.9 2.3 -3.3 2.2 85 86 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 -5,-0.2 442,-0.2 0.894 112.4 50.9 -59.3 -42.5 2.7 -5.0 -1.2 86 87 A S H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.941 109.7 45.1 -60.9 -53.6 -1.0 -5.9 -1.1 87 88 A V H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.911 114.4 51.6 -62.1 -38.7 -2.5 -2.6 -0.3 88 89 A R H X S+ 0 0 70 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 0.891 109.2 50.0 -64.7 -37.0 -0.2 -1.1 -3.0 89 90 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.920 112.9 45.7 -68.2 -40.3 -1.3 -3.7 -5.5 90 91 A V H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.909 112.8 50.4 -67.4 -42.6 -5.0 -3.0 -4.8 91 92 A E H X>S+ 0 0 7 -4,-2.6 5,-2.4 -5,-0.2 4,-0.7 0.883 110.9 50.9 -63.5 -37.5 -4.4 0.8 -4.9 92 93 A D H ><5S+ 0 0 49 -4,-2.3 3,-0.8 -5,-0.2 -2,-0.2 0.934 110.8 46.8 -61.5 -49.9 -2.6 0.3 -8.2 93 94 A A H 3<5S+ 0 0 13 -4,-2.4 420,-0.3 1,-0.2 -2,-0.2 0.859 120.6 38.6 -59.2 -37.2 -5.5 -1.7 -9.7 94 95 A L H 3<5S- 0 0 4 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.347 108.1-118.3-101.4 4.5 -8.1 0.9 -8.5 95 96 A D T <<5 + 0 0 105 -3,-0.8 2,-0.5 -4,-0.7 -3,-0.2 0.912 54.0 163.7 56.4 50.0 -6.1 4.1 -9.1 96 97 A I < - 0 0 6 -5,-2.4 2,-0.4 -8,-0.1 -1,-0.2 -0.882 23.3-163.3 -97.0 121.8 -6.1 5.1 -5.4 97 98 A K - 0 0 103 -2,-0.5 -5,-0.0 138,-0.1 0, 0.0 -0.884 15.7-145.6-101.5 135.0 -3.6 7.8 -4.3 98 99 A I - 0 0 16 -2,-0.4 138,-0.1 1,-0.1 400,-0.1 -0.657 24.5 -89.8 -97.5 159.5 -3.1 7.8 -0.6 99 100 A P >> - 0 0 22 0, 0.0 4,-2.1 0, 0.0 3,-0.9 -0.251 38.3-110.0 -63.0 153.9 -2.4 10.9 1.6 100 101 A H H 3> S+ 0 0 105 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.872 118.1 53.7 -44.7 -49.4 1.2 12.0 2.3 101 102 A N H 3> S+ 0 0 0 395,-0.4 4,-2.7 1,-0.2 -1,-0.3 0.821 105.9 53.1 -67.5 -30.8 1.1 11.0 5.9 102 103 A A H <> S+ 0 0 0 -3,-0.9 4,-2.4 2,-0.2 -1,-0.2 0.911 109.1 49.5 -67.5 -45.2 -0.0 7.4 4.9 103 104 A T H X S+ 0 0 18 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.927 114.6 45.3 -52.1 -50.5 2.9 7.1 2.5 104 105 A L H X S+ 0 0 19 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.902 112.5 49.1 -64.5 -46.2 5.3 8.3 5.3 105 106 A I H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.907 110.8 50.7 -64.6 -39.4 3.8 6.1 8.0 106 107 A R H X S+ 0 0 3 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.915 111.9 48.3 -58.8 -43.3 4.0 3.0 5.7 107 108 A E H X S+ 0 0 9 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.866 109.7 52.1 -65.0 -39.7 7.7 3.9 5.0 108 109 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.930 111.4 47.2 -58.8 -46.9 8.4 4.3 8.7 109 110 A M H X S+ 0 0 3 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.900 112.0 51.1 -60.1 -41.2 6.9 0.9 9.3 110 111 A A H X S+ 0 0 12 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.903 111.2 46.0 -64.8 -42.0 8.9 -0.5 6.4 111 112 A K H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.857 109.4 55.7 -72.6 -32.6 12.2 0.9 7.7 112 113 A T H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.932 109.3 48.1 -56.8 -47.1 11.4 -0.3 11.2 113 114 A 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