==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 23-APR-07 2YX0 . COMPND 2 MOLECULE: RADICAL SAM ENZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR S.GOTO-ITO,R.ISHII,T.ITO,R.SHIBATA,E.FUSATOMI,S.SEKINE, . 324 3 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14508.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 228 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 25 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.9 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 0 1 2 1 2 1 1 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 0 3 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 PARALLEL BRIDGES PER LADDER . 1 1 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 1 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 11 A K 0 0 247 0, 0.0 2,-0.3 0, 0.0 109,-0.1 0.000 360.0 360.0 360.0 73.0 9.6 65.9 45.2 2 12 A I - 0 0 62 108,-0.1 2,-0.4 107,-0.1 104,-0.0 -0.637 360.0-160.2 -89.2 148.1 12.6 63.5 45.5 3 13 A T - 0 0 106 -2,-0.3 2,-0.5 2,-0.0 104,-0.0 -0.979 4.1-153.4-128.2 140.8 13.9 61.8 42.5 4 14 A V - 0 0 18 -2,-0.4 2,-0.3 102,-0.1 21,-0.1 -0.953 20.0-126.2-115.2 128.3 16.1 58.6 42.3 5 15 A Q + 0 0 110 -2,-0.5 22,-2.2 2,-0.0 2,-0.3 -0.549 47.6 158.5 -68.9 131.2 18.5 57.9 39.5 6 16 A A B +a 27 0A 51 -2,-0.3 22,-0.2 20,-0.2 20,-0.1 -0.984 33.3 162.8-160.0 147.0 17.6 54.5 38.1 7 17 A N - 0 0 103 20,-2.2 19,-0.0 -2,-0.3 -2,-0.0 -0.411 38.0-137.4-165.3 76.5 17.9 52.1 35.1 8 18 A P - 0 0 25 0, 0.0 2,-2.7 0, 0.0 21,-0.2 -0.125 3.0-144.6 -44.1 106.2 17.2 48.5 36.2 9 19 A N S S+ 0 0 61 19,-3.0 19,-0.1 84,-0.1 3,-0.0 -0.436 74.3 75.3 -76.6 68.4 19.6 46.1 34.6 10 20 A M S S- 0 0 22 -2,-2.7 5,-0.1 76,-0.0 19,-0.0 -0.978 99.1 -58.1-167.0 164.5 16.9 43.5 34.3 11 21 A P > - 0 0 63 0, 0.0 4,-2.1 0, 0.0 3,-0.5 -0.253 49.6-125.8 -53.7 138.3 13.7 42.6 32.3 12 22 A K H > S+ 0 0 176 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.838 109.9 60.4 -55.4 -34.0 11.3 45.5 32.6 13 23 A E H > S+ 0 0 153 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.930 105.8 46.4 -60.5 -45.5 8.6 43.0 33.8 14 24 A V H > S+ 0 0 17 -3,-0.5 4,-1.8 2,-0.2 3,-0.5 0.972 110.3 52.7 -62.4 -53.9 10.8 42.1 36.8 15 25 A A H X S+ 0 0 2 -4,-2.1 4,-2.0 1,-0.3 -1,-0.2 0.890 108.2 51.5 -49.0 -45.1 11.5 45.7 37.6 16 26 A E H X S+ 0 0 76 -4,-2.5 4,-2.4 1,-0.2 -1,-0.3 0.899 105.0 56.6 -61.8 -39.0 7.8 46.5 37.6 17 27 A L H X S+ 0 0 64 -4,-1.9 4,-0.9 -3,-0.5 -1,-0.2 0.876 106.6 49.7 -58.5 -40.5 7.2 43.5 40.0 18 28 A F H ><>S+ 0 0 2 -4,-1.8 5,-2.1 -3,-0.2 3,-0.6 0.920 109.4 52.2 -64.7 -42.7 9.6 45.1 42.5 19 29 A R H ><5S+ 0 0 109 -4,-2.0 3,-2.4 1,-0.2 -2,-0.2 0.917 103.7 54.7 -61.3 -45.4 7.9 48.4 42.2 20 30 A K H 3<5S+ 0 0 117 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.770 105.0 55.8 -61.5 -22.6 4.5 47.0 42.9 21 31 A Q T <<5S- 0 0 96 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.252 125.1-106.2 -90.5 11.5 5.9 45.5 46.1 22 32 A H T < 5 + 0 0 137 -3,-2.4 12,-0.4 1,-0.2 2,-0.3 0.716 69.4 147.1 73.2 25.7 7.0 49.0 47.1 23 33 A Y < - 0 0 18 -5,-2.1 2,-0.7 10,-0.1 -1,-0.2 -0.678 41.8-142.0 -87.4 145.8 10.8 48.7 46.4 24 34 A E E -B 32 0B 31 8,-3.6 8,-1.8 -2,-0.3 2,-0.1 -0.935 21.4-136.1-110.9 112.3 12.5 51.8 45.2 25 35 A I E -B 31 0B 4 -2,-0.7 2,-0.5 6,-0.2 6,-0.3 -0.431 14.9-157.1 -72.4 139.7 15.1 50.8 42.6 26 36 A V E > -B 30 0B 0 4,-2.4 4,-2.2 -2,-0.1 3,-0.4 -0.959 48.8 -46.5-123.1 119.4 18.5 52.4 42.8 27 37 A G B 4 S-a 6 0A 0 -22,-2.2 -20,-2.2 -2,-0.5 -18,-0.0 -0.284 106.0 -34.4 65.3-142.7 20.9 52.6 39.8 28 38 A R T 4 S+ 0 0 58 -22,-0.2 -19,-3.0 -20,-0.2 -1,-0.2 0.873 136.3 6.1 -82.9 -35.9 21.3 49.5 37.8 29 39 A H T 4 S+ 0 0 1 -3,-0.4 39,-2.8 -21,-0.2 40,-0.3 0.261 103.1 84.4-139.7 14.8 21.1 46.8 40.4 30 40 A S E < -B 26 0B 0 -4,-2.2 -4,-2.4 37,-0.2 2,-0.3 -0.612 44.0-172.7-115.5 176.7 20.1 48.0 43.9 31 41 A G E -BC 25 65B 0 34,-1.9 34,-1.7 -6,-0.3 2,-0.3 -0.989 13.6-149.6-165.8 161.1 17.0 48.8 45.9 32 42 A V E +BC 24 64B 0 -8,-1.8 -8,-3.6 -2,-0.3 2,-0.3 -0.960 16.0 175.5-136.1 148.5 15.5 50.3 49.1 33 43 A K - 0 0 51 30,-1.7 30,-0.5 -2,-0.3 2,-0.4 -0.982 35.6-104.1-152.1 147.6 12.3 49.4 50.9 34 44 A L - 0 0 31 -12,-0.4 5,-0.1 -2,-0.3 28,-0.1 -0.621 49.7 -95.5 -79.5 130.9 10.7 50.5 54.2 35 45 A C > - 0 0 22 -2,-0.4 4,-0.7 26,-0.3 -1,-0.1 -0.101 26.1-129.5 -41.9 131.3 11.0 48.0 57.1 36 46 A H T >4 S+ 0 0 185 1,-0.2 3,-0.7 2,-0.2 4,-0.4 0.928 114.5 49.4 -48.0 -42.9 7.8 45.9 57.2 37 47 A W T >> S+ 0 0 52 1,-0.2 3,-0.9 2,-0.1 4,-0.9 0.981 90.7 76.8 -55.7 -69.3 8.0 47.0 60.8 38 48 A L H 3> S+ 0 0 5 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.510 84.2 65.8 -20.2 -35.8 8.6 50.7 60.4 39 49 A K H XX S+ 0 0 96 -4,-0.7 4,-2.0 -3,-0.7 3,-1.4 0.997 106.6 37.3 -59.1 -70.1 5.0 51.5 59.6 40 50 A K H <> S+ 0 0 97 -3,-0.9 4,-2.2 -4,-0.4 6,-1.6 0.701 112.8 62.1 -55.4 -21.1 3.5 50.6 63.0 41 51 A S H 3X S+ 0 0 1 -4,-0.9 4,-0.6 4,-0.2 -1,-0.3 0.867 109.3 39.0 -72.8 -36.5 6.6 52.1 64.6 42 52 A L H << S+ 0 0 1 -4,-1.7 79,-2.8 -3,-1.4 -2,-0.2 0.771 129.2 31.9 -83.3 -26.3 5.9 55.5 63.2 43 53 A T H < S+ 0 0 31 -4,-2.0 -2,-0.2 77,-0.2 -3,-0.2 0.583 130.6 28.1-108.5 -13.6 2.2 55.3 63.8 44 54 A E H < S- 0 0 97 -4,-2.2 -3,-0.2 -5,-0.3 -2,-0.1 0.294 100.3-109.2-132.1 13.6 1.8 53.1 66.9 45 55 A G < + 0 0 37 -4,-0.6 -4,-0.2 1,-0.2 -3,-0.1 0.669 59.8 170.4 67.8 16.2 4.9 53.6 69.0 46 56 A R - 0 0 121 -6,-1.6 2,-0.2 -9,-0.1 -1,-0.2 -0.267 21.1-151.6 -63.9 145.1 6.0 50.1 68.1 47 57 A F - 0 0 114 11,-0.1 2,-0.3 10,-0.0 10,-0.1 -0.668 7.9-133.9-109.3 166.1 9.5 48.8 68.9 48 58 A C >> - 0 0 15 -2,-0.2 4,-1.4 8,-0.2 3,-1.0 -0.848 21.6-119.0-118.6 157.8 11.5 46.1 67.1 49 59 A Y H 3> S+ 0 0 7 -2,-0.3 4,-3.3 1,-0.3 5,-0.2 0.772 111.1 67.3 -67.4 -27.2 13.4 43.2 68.7 50 60 A K H 3> S+ 0 0 34 2,-0.2 4,-2.2 1,-0.2 6,-1.7 0.765 100.3 51.6 -64.4 -24.4 16.7 44.6 67.3 51 61 A Q H <> S+ 0 0 44 -3,-1.0 4,-2.5 4,-0.3 -2,-0.2 0.966 111.8 44.0 -75.0 -53.3 16.2 47.5 69.7 52 62 A K H < S+ 0 0 95 -4,-1.4 -2,-0.2 1,-0.2 -3,-0.1 0.914 121.3 41.6 -54.2 -47.0 15.7 45.2 72.7 53 63 A F H < S+ 0 0 0 -4,-3.3 -1,-0.2 1,-0.1 -2,-0.2 0.938 136.8 3.0 -69.1 -49.2 18.6 43.0 71.7 54 64 A Y H < S- 0 0 0 -4,-2.2 270,-2.8 -5,-0.2 -3,-0.2 0.409 95.9-101.8-125.2 2.9 21.3 45.5 70.6 55 65 A G < + 0 0 24 -4,-2.5 2,-0.5 -5,-0.4 -4,-0.3 0.755 68.4 150.8 80.1 23.0 20.0 49.0 71.1 56 66 A I - 0 0 2 -6,-1.7 2,-1.3 -7,-0.1 -1,-0.3 -0.796 41.9-144.4 -90.1 124.8 19.2 49.5 67.3 57 67 A H > - 0 0 80 -2,-0.5 3,-3.0 1,-0.2 75,-0.2 -0.698 11.2-162.2 -90.8 91.3 16.3 51.9 66.6 58 68 A S G > S+ 0 0 5 -2,-1.3 3,-1.7 1,-0.3 -23,-0.2 0.719 82.8 68.2 -46.8 -28.1 14.7 50.2 63.7 59 69 A H G 3 S+ 0 0 12 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.514 100.8 49.7 -73.7 -1.7 12.8 53.4 62.7 60 70 A R G < S+ 0 0 62 -3,-3.0 73,-2.1 71,-0.1 72,-2.1 -0.036 87.8 116.2-119.1 27.4 16.2 55.0 61.8 61 71 A C E < - d 0 133B 9 -3,-1.7 2,-0.8 70,-0.2 -26,-0.3 -0.840 55.1-152.8 -99.1 131.7 17.2 51.9 59.7 62 72 A L E - d 0 134B 0 71,-3.5 73,-2.4 -2,-0.4 2,-0.6 -0.928 19.1-157.2-104.4 105.8 17.8 52.4 56.0 63 73 A Q E + d 0 135B 41 -2,-0.8 -30,-1.7 -30,-0.5 2,-0.3 -0.772 32.8 127.8 -91.6 122.7 17.0 48.9 54.6 64 74 A M E -Cd 32 136B 0 71,-2.8 74,-1.7 -2,-0.6 73,-1.3 -0.905 40.8-141.6-158.5-179.0 18.6 48.2 51.3 65 75 A T E -C 31 0B 0 -34,-1.7 -34,-1.9 -2,-0.3 3,-0.2 -0.967 14.5-150.9-156.7 141.7 20.7 45.9 49.1 66 76 A P S S+ 0 0 0 0, 0.0 2,-0.2 0, 0.0 29,-0.1 0.288 98.8 57.5 -93.3 6.8 23.3 46.5 46.4 67 77 A V + 0 0 0 72,-0.3 -37,-0.2 -36,-0.1 3,-0.1 -0.702 66.5 169.8-138.5 80.4 22.2 43.1 44.9 68 78 A L S S+ 0 0 0 -39,-2.8 72,-0.1 -2,-0.2 -38,-0.1 0.833 72.5 10.6 -67.4 -37.1 18.5 43.3 44.2 69 79 A A S S+ 0 0 0 -40,-0.3 17,-2.5 70,-0.1 18,-0.4 0.279 104.8 83.4-133.7 15.9 17.7 40.3 42.1 70 80 A W + 0 0 9 15,-0.2 71,-1.9 16,-0.2 2,-0.3 -0.895 44.0 148.7-122.7 150.1 20.6 37.9 42.2 71 81 A C - 0 0 7 16,-1.9 16,-0.1 -2,-0.3 18,-0.1 -0.952 49.2-122.4-166.9 171.7 21.5 35.3 44.8 72 82 A T S S+ 0 0 7 -2,-0.3 134,-3.0 16,-0.0 135,-0.6 0.443 94.6 54.8-106.3 -5.8 23.1 31.9 45.2 73 83 A H B -K 205 0C 5 132,-0.2 131,-0.2 133,-0.1 12,-0.1 -0.929 57.1-159.5-124.6 148.8 20.0 30.3 46.8 74 84 A N - 0 0 15 129,-1.6 130,-0.1 130,-1.4 4,-0.0 -0.478 38.1-171.4-117.6 56.0 16.4 30.0 45.7 75 85 A a > - 0 0 7 1,-0.1 3,-1.5 2,-0.1 128,-0.2 -0.179 29.3-129.0 -56.1 140.5 15.4 29.4 49.3 76 86 A I T 3 S+ 0 0 11 126,-2.1 192,-0.3 1,-0.3 -1,-0.1 0.602 109.2 44.9 -66.5 -16.7 11.8 28.3 50.1 77 87 A F T 3 S+ 0 0 32 125,-0.4 2,-0.8 190,-0.1 -1,-0.3 0.288 89.4 111.3-108.1 9.0 11.3 31.0 52.8 78 88 A a < - 0 0 33 -3,-1.5 2,-0.3 2,-0.0 61,-0.0 -0.747 59.9-146.3 -90.3 108.6 12.9 33.7 50.6 79 89 A W + 0 0 195 -2,-0.8 -2,-0.1 2,-0.0 -4,-0.1 -0.550 30.5 156.0 -78.0 133.5 10.5 36.4 49.4 80 90 A R - 0 0 25 -2,-0.3 -11,-0.0 2,-0.1 -62,-0.0 -0.876 48.1-126.6-156.8 116.5 11.3 37.7 46.0 81 91 A P S S+ 0 0 36 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 0.699 92.9 61.8 -41.1 -21.4 8.7 39.4 43.7 82 92 A M S S- 0 0 21 1,-0.1 -2,-0.1 -3,-0.0 3,-0.1 -0.677 94.2-105.8-110.2 166.3 9.7 36.9 41.0 83 93 A E S S- 0 0 140 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.934 97.0 -7.8 -47.1 -65.6 9.7 33.1 40.5 84 94 A N S S- 0 0 70 1,-0.1 -1,-0.1 -3,-0.0 -10,-0.1 -0.895 88.0 -85.5-132.0 163.1 13.5 32.5 40.9 85 95 A F - 0 0 17 -2,-0.3 -15,-0.2 -12,-0.1 3,-0.1 -0.247 40.3-116.8 -64.5 161.4 16.4 34.9 41.2 86 96 A L S S- 0 0 63 -17,-2.5 2,-0.3 1,-0.2 -16,-0.2 0.698 75.3 -43.1 -75.0 -22.4 17.9 36.1 37.9 87 97 A G - 0 0 21 -18,-0.4 -16,-1.9 -16,-0.1 -1,-0.2 -0.967 55.3 -88.7 171.1 176.7 21.3 34.5 38.3 88 98 A T S S+ 0 0 42 -2,-0.3 2,-0.3 -18,-0.2 -18,-0.1 0.242 99.1 48.8 -95.8 11.4 24.3 33.8 40.6 89 99 A E S S- 0 0 143 -18,-0.1 -18,-0.1 -17,-0.0 56,-0.1 -0.988 86.1-104.8-148.4 153.9 26.3 36.9 40.0 90 100 A L - 0 0 8 54,-0.4 4,-0.0 -2,-0.3 -2,-0.0 -0.695 42.7-134.2 -78.5 113.0 25.8 40.6 39.9 91 101 A P - 0 0 47 0, 0.0 -82,-0.1 0, 0.0 -21,-0.0 -0.342 36.7 -80.6 -67.5 154.0 25.8 41.6 36.2 92 102 A Q S S+ 0 0 130 2,-0.1 2,-0.1 -64,-0.0 3,-0.0 -0.455 95.0 70.9 -88.0 166.2 27.9 44.6 35.1 93 103 A P S S- 0 0 84 0, 0.0 2,-0.5 0, 0.0 -84,-0.1 0.552 72.7-155.2 -74.1 145.3 28.1 47.5 34.9 94 104 A W - 0 0 78 -2,-0.1 -2,-0.1 -66,-0.1 2,-0.1 -0.800 11.3-126.7 -93.4 127.5 28.4 47.8 38.6 95 105 A D - 0 0 17 -2,-0.5 -1,-0.0 -29,-0.1 -68,-0.0 -0.371 29.6-107.1 -71.4 152.8 27.5 51.1 40.3 96 106 A D > - 0 0 86 1,-0.1 4,-2.1 -2,-0.1 3,-0.1 -0.534 24.6-115.8 -81.5 151.5 30.0 52.7 42.5 97 107 A P H > S+ 0 0 15 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.816 110.5 52.4 -51.7 -45.3 29.5 52.8 46.3 98 108 A A H > S+ 0 0 28 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.939 110.1 48.3 -64.7 -43.7 29.1 56.5 46.8 99 109 A F H > S+ 0 0 34 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.935 111.3 52.0 -60.7 -45.4 26.4 56.8 44.2 100 110 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.944 112.0 44.3 -57.7 -50.9 24.6 53.8 45.8 101 111 A V H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 5,-0.2 0.951 115.0 48.8 -59.5 -51.3 24.6 55.3 49.3 102 112 A E H X S+ 0 0 80 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.945 115.6 41.9 -54.0 -55.3 23.6 58.8 48.1 103 113 A E H X S+ 0 0 4 -4,-2.8 4,-2.9 1,-0.2 -1,-0.2 0.820 110.1 58.9 -64.6 -32.7 20.7 57.6 45.9 104 114 A S H X S+ 0 0 0 -4,-2.3 4,-3.0 -5,-0.3 -1,-0.2 0.920 104.7 50.1 -62.6 -42.4 19.6 55.1 48.6 105 115 A I H X S+ 0 0 23 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.914 112.0 48.2 -62.3 -40.1 19.2 58.0 51.1 106 116 A K H X S+ 0 0 69 -4,-1.8 4,-2.6 -5,-0.2 -2,-0.2 0.917 111.0 51.0 -66.7 -38.4 17.1 59.7 48.4 107 117 A A H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 5,-0.2 0.913 106.6 54.6 -62.3 -43.1 15.1 56.6 47.9 108 118 A Q H X S+ 0 0 6 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.954 111.7 43.5 -55.3 -52.0 14.5 56.3 51.6 109 119 A R H X S+ 0 0 65 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.916 108.7 57.5 -62.1 -42.9 13.0 59.8 51.7 110 120 A K H < S+ 0 0 83 -4,-2.6 4,-0.5 1,-0.2 -1,-0.2 0.889 111.2 43.2 -54.9 -41.8 11.0 59.3 48.6 111 121 A L H >< S+ 0 0 35 -4,-2.1 3,-1.3 1,-0.2 -1,-0.2 0.895 110.2 57.0 -72.6 -37.8 9.3 56.4 50.2 112 122 A L H >< S+ 0 0 0 -4,-2.4 3,-1.2 1,-0.3 4,-0.2 0.871 89.7 72.4 -60.4 -37.7 8.9 58.2 53.5 113 123 A I T 3< S+ 0 0 97 -4,-2.6 2,-0.3 1,-0.3 -1,-0.3 0.829 76.5 81.3 -45.6 -34.3 7.0 61.1 51.7 114 124 A G T < S+ 0 0 67 -3,-1.3 -1,-0.3 -4,-0.5 -2,-0.1 0.302 100.8 40.5 -60.2 17.5 4.1 58.5 51.5 115 125 A Y < 0 0 49 -3,-1.2 -2,-0.1 -2,-0.3 -3,-0.1 0.174 360.0 360.0-127.9-113.0 3.5 59.6 55.1 116 126 A K 0 0 131 -4,-0.2 -3,-0.1 6,-0.0 -2,-0.1 0.293 360.0 360.0-146.1 360.0 3.7 63.2 56.5 117 ! 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 0.0 118 129 A P 0 0 111 0, 0.0 -2,-0.0 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0-107.7 -1.7 62.2 60.4 119 130 A K + 0 0 182 2,-0.1 2,-0.3 -75,-0.0 0, 0.0 0.243 360.0 119.5 -85.6 10.6 -1.7 59.4 62.9 120 131 A V S S- 0 0 27 1,-0.1 -77,-0.2 -76,-0.1 2,-0.1 -0.636 71.6-118.5 -86.1 134.5 2.0 59.7 62.4 121 132 A D > - 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