==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 06-MAY-07 2YZQ . COMPND 2 MOLECULE: PUTATIVE UNCHARACTERIZED PROTEIN PH1780; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR M.KANAGAWA,Y.MINAMI,N.WATANABE,S.YOKOYAMA,S.KURAMITSU,RIKEN . 225 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12791.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 150 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 19.6 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 . 4 1.8 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 . 14 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 39 17.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.2 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 0 1 0 1 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 . 1 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 PARALLEL BRIDGES PER LADDER . 6 1 0 0 3 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 . 0 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 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 M 0 0 92 0, 0.0 58,-2.9 0, 0.0 59,-0.4 0.000 360.0 360.0 360.0 142.2 33.4 18.5 -0.4 2 2 A R B >> -A 58 0A 122 56,-0.2 3,-1.1 57,-0.1 4,-1.1 -0.757 360.0-116.2-101.8 160.3 29.9 19.4 0.8 3 3 A V H >> S+ 0 0 0 54,-2.8 4,-2.6 -2,-0.3 3,-1.0 0.864 110.0 64.1 -60.3 -42.4 27.2 17.5 2.1 4 4 A K H 34 S+ 0 0 86 51,-2.9 -1,-0.3 53,-0.3 52,-0.1 0.771 102.1 51.8 -50.6 -31.3 25.0 18.2 -1.0 5 5 A T H <4 S+ 0 0 89 -3,-1.1 -1,-0.3 50,-0.2 -2,-0.2 0.812 118.1 33.3 -78.9 -30.5 27.4 16.3 -3.2 6 6 A I H << S+ 0 0 5 -4,-1.1 82,-0.2 -3,-1.0 -2,-0.2 0.700 97.7 94.2-100.6 -22.1 27.6 13.1 -1.2 7 7 A M S < S- 0 0 9 -4,-2.6 2,-0.6 -5,-0.2 80,-0.2 -0.170 76.8-116.8 -69.7 163.5 24.1 12.9 0.3 8 8 A T E -B 86 0B 59 78,-2.9 78,-1.9 1,-0.0 -1,-0.1 -0.913 39.2-133.9 -99.2 122.0 21.2 10.9 -1.2 9 9 A Q E S+B 85 0B 115 -2,-0.6 76,-0.3 76,-0.2 75,-0.0 -0.351 70.3 16.0 -80.6 160.1 18.4 13.5 -2.0 10 10 A N S S- 0 0 136 74,-1.8 -1,-0.2 1,-0.1 75,-0.1 0.913 76.7-159.2 48.8 62.4 14.7 13.3 -1.3 11 11 A P - 0 0 26 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.372 23.6-107.8 -69.7 146.5 14.6 10.5 1.3 12 12 A V - 0 0 93 -2,-0.1 2,-0.2 1,-0.0 -2,-0.0 -0.592 46.7-169.5 -72.8 132.4 11.4 8.7 1.9 13 13 A T - 0 0 58 -2,-0.3 2,-0.4 11,-0.2 13,-0.2 -0.703 19.2-129.3-119.9 173.2 10.0 9.9 5.3 14 14 A I E -e 26 0C 58 11,-2.0 13,-2.0 -2,-0.2 2,-0.5 -0.992 15.8-146.7-128.5 126.6 7.3 8.8 7.7 15 15 A T E -e 27 0C 69 -2,-0.4 13,-0.2 11,-0.2 14,-0.1 -0.791 33.3 -96.1 -95.3 131.2 4.7 11.3 9.1 16 16 A L S S+ 0 0 51 11,-1.8 2,-0.1 -2,-0.5 13,-0.1 -0.600 98.2 60.5 -86.9 151.0 3.4 10.7 12.6 17 17 A P S S+ 0 0 137 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 0.500 80.5 149.7 -70.1 151.9 1.1 9.4 13.8 18 18 A A 0 0 63 -2,-0.1 -2,-0.1 -4,-0.1 -4,-0.0 -0.976 360.0 360.0-150.0 159.2 2.0 6.1 12.3 19 19 A T 0 0 195 -2,-0.3 -3,-0.0 -3,-0.0 0, 0.0 -0.329 360.0 360.0 -66.0 360.0 1.6 2.3 13.0 20 ! 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 21 32 A V 0 0 129 0, 0.0 18,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0-145.2 15.6 0.9 3.6 22 33 A R - 0 0 116 1,-0.3 17,-2.2 16,-0.1 18,-0.4 0.902 360.0 -19.8 -80.0 -45.4 17.8 1.0 6.7 23 34 A S E - F 0 38C 14 15,-0.2 -1,-0.3 16,-0.1 15,-0.2 -0.979 59.7-133.0-159.6 159.3 15.9 3.8 8.5 24 35 A F E - F 0 37C 64 13,-2.6 13,-2.4 -2,-0.3 -11,-0.2 -0.952 24.0-117.9-122.5 138.7 13.4 6.6 7.7 25 36 A P E - F 0 36C 3 0, 0.0 -11,-2.0 0, 0.0 2,-0.5 -0.502 32.5-136.4 -70.5 144.9 13.5 10.2 8.8 26 37 A V E +eF 14 35C 1 9,-3.8 8,-3.4 -13,-0.2 9,-1.2 -0.904 26.3 177.5-108.6 131.5 10.5 11.1 10.9 27 38 A V E -eF 15 33C 4 -13,-2.0 -11,-1.8 -2,-0.5 6,-0.2 -0.850 22.6-125.2-128.6 163.0 8.5 14.3 10.4 28 39 A N > - 0 0 56 4,-1.7 3,-1.5 -2,-0.3 -1,-0.0 -0.288 49.7 -79.7 -94.6-174.5 5.4 16.0 11.8 29 40 A K T 3 S+ 0 0 185 1,-0.3 -14,-0.0 2,-0.1 -1,-0.0 0.890 132.5 53.6 -54.3 -43.1 2.4 17.3 9.9 30 41 A E T 3 S- 0 0 122 1,-0.1 -1,-0.3 2,-0.1 52,-0.0 0.691 118.6-114.7 -65.4 -18.8 4.3 20.5 8.9 31 42 A G < + 0 0 18 -3,-1.5 2,-0.2 1,-0.3 -2,-0.1 0.546 65.9 145.5 95.9 7.6 7.0 18.2 7.5 32 43 A K - 0 0 83 50,-0.2 -4,-1.7 1,-0.1 -1,-0.3 -0.542 57.7-100.0 -80.3 145.6 9.7 19.2 10.0 33 44 A L E +F 27 0C 33 48,-2.6 -6,-0.3 -6,-0.2 -1,-0.1 -0.438 45.3 164.2 -66.4 131.7 12.2 16.6 11.2 34 45 A V E - 0 0 59 -8,-3.4 2,-0.3 1,-0.4 -7,-0.2 0.360 61.0 -57.2-126.7 -2.2 11.4 15.2 14.6 35 46 A G E -F 26 0C 0 -9,-1.2 -9,-3.8 14,-0.1 -1,-0.4 -0.977 52.5 -86.8 155.1-168.0 13.6 12.1 14.6 36 47 A I E -FG 25 47C 2 11,-1.6 11,-2.0 -2,-0.3 2,-0.4 -0.992 21.6-152.7-140.8 147.1 14.6 8.9 12.8 37 48 A I E -F 24 0C 34 -13,-2.4 -13,-2.6 -2,-0.3 2,-0.3 -0.982 10.1-153.2-124.7 130.4 13.3 5.3 13.0 38 49 A S E -F 23 0C 29 -2,-0.4 -15,-0.2 7,-0.3 3,-0.2 -0.766 18.8-134.7-102.5 147.1 15.3 2.2 12.2 39 50 A V S S+ 0 0 95 -17,-2.2 3,-0.1 -2,-0.3 -16,-0.1 0.865 106.2 59.3 -65.1 -36.7 14.0 -1.1 10.9 40 51 A K S S+ 0 0 148 -18,-0.4 2,-2.6 1,-0.3 -1,-0.2 0.861 89.7 73.1 -60.7 -36.5 16.2 -3.0 13.4 41 52 A R 0 0 101 -3,-0.2 -1,-0.3 4,-0.1 -3,-0.1 -0.328 360.0 360.0 -77.6 59.5 14.5 -1.2 16.3 42 53 A I 0 0 173 -2,-2.6 -4,-0.1 -3,-0.1 -2,-0.1 0.006 360.0 360.0 -60.3 360.0 11.3 -3.2 15.8 43 ! 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 44 64 A M 0 0 183 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 136.9 7.9 5.9 21.1 45 65 A L + 0 0 97 2,-0.1 2,-0.4 -8,-0.0 -7,-0.3 0.463 360.0 101.5 -90.0 -2.3 10.5 3.9 19.1 46 66 A V - 0 0 25 -9,-0.1 2,-0.5 -11,-0.0 -9,-0.2 -0.675 68.6-136.6 -86.8 134.4 11.7 7.0 17.3 47 67 A K B -G 36 0C 45 -11,-2.0 -11,-1.6 -2,-0.4 3,-0.1 -0.802 14.8-170.0 -92.5 126.4 15.0 8.6 18.5 48 68 A R S S+ 0 0 204 -2,-0.5 2,-2.1 -13,-0.2 -1,-0.1 0.849 70.1 75.2 -83.1 -38.8 14.9 12.4 18.7 49 69 A D + 0 0 108 -13,-0.1 -1,-0.2 -14,-0.0 -14,-0.1 -0.487 65.7 147.7 -79.1 75.1 18.6 13.2 19.2 50 70 A V - 0 0 16 -2,-2.1 2,-0.1 -3,-0.1 24,-0.1 -0.886 52.8-104.7-112.1 141.5 19.8 12.6 15.7 51 71 A P - 0 0 2 0, 0.0 24,-2.3 0, 0.0 2,-0.3 -0.391 41.9-173.6 -65.0 135.5 22.6 14.5 14.0 52 72 A V E +c 75 0B 65 22,-0.2 2,-0.3 -2,-0.1 24,-0.2 -0.972 10.8 168.2-133.7 147.7 21.5 17.1 11.4 53 73 A V E -c 76 0B 5 22,-2.0 24,-2.6 -2,-0.3 2,-0.3 -0.884 32.8-109.3-145.1 173.4 23.3 19.3 8.9 54 74 A K E > -c 77 0B 114 -2,-0.3 3,-2.0 22,-0.2 -51,-0.3 -0.774 33.9-111.9-106.0 155.0 22.4 21.6 5.9 55 75 A E T 3 S+ 0 0 62 22,-0.5 -51,-2.9 -2,-0.3 -50,-0.2 0.754 115.8 54.6 -60.4 -24.1 23.4 20.6 2.4 56 76 A N T 3 S+ 0 0 80 -53,-0.2 -1,-0.3 -54,-0.1 2,-0.1 0.382 85.2 107.5 -92.2 6.0 25.9 23.4 2.1 57 77 A D S < S- 0 0 40 -3,-2.0 -54,-2.8 1,-0.1 -53,-0.3 -0.392 79.0 -99.7 -76.1 160.6 27.8 22.3 5.2 58 78 A T B > -A 2 0A 64 -56,-0.2 4,-1.5 1,-0.1 -56,-0.2 -0.403 21.3-120.3 -78.7 158.8 31.2 20.7 4.8 59 79 A L H > S+ 0 0 1 -58,-2.9 4,-2.8 1,-0.2 5,-0.2 0.822 115.0 64.7 -66.2 -28.3 31.6 16.9 4.9 60 80 A K H > S+ 0 0 97 -59,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.912 100.2 49.5 -59.6 -43.6 34.0 17.7 7.8 61 81 A K H > S+ 0 0 94 -3,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.914 112.7 46.4 -62.7 -43.7 31.1 19.0 9.8 62 82 A A H X S+ 0 0 0 -4,-1.5 4,-2.1 1,-0.2 -2,-0.2 0.883 111.6 51.9 -66.4 -38.8 28.9 16.0 9.1 63 83 A A H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.915 107.1 53.2 -64.1 -42.4 31.8 13.6 9.9 64 84 A K H X S+ 0 0 108 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.881 109.5 48.6 -60.0 -40.2 32.3 15.4 13.3 65 85 A L H X S+ 0 0 23 -4,-1.7 4,-2.4 2,-0.2 6,-0.2 0.902 109.2 52.1 -68.1 -40.4 28.7 14.9 14.2 66 86 A M H X>S+ 0 0 0 -4,-2.1 5,-1.7 1,-0.2 4,-0.7 0.912 113.2 44.9 -61.5 -41.9 28.8 11.2 13.3 67 87 A L H <5S+ 0 0 56 -4,-2.3 -1,-0.2 3,-0.2 -2,-0.2 0.843 111.8 53.8 -70.0 -34.6 31.8 10.7 15.5 68 88 A E H <5S+ 0 0 125 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.889 120.2 29.8 -67.9 -41.7 30.2 12.8 18.3 69 89 A Y H <5S- 0 0 85 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.399 100.7-128.6 -99.2 2.4 27.0 10.7 18.4 70 90 A D T <5 + 0 0 119 -4,-0.7 2,-0.4 1,-0.2 -3,-0.2 0.928 63.8 140.5 48.1 47.3 28.6 7.5 17.3 71 91 A Y < - 0 0 27 -5,-1.7 -1,-0.2 -6,-0.2 -2,-0.2 -0.951 55.9-138.0-122.5 142.2 25.8 7.4 14.7 72 92 A R S S+ 0 0 55 -2,-0.4 17,-2.0 -3,-0.1 2,-0.3 0.277 78.0 35.7 -85.5 10.6 26.2 6.2 11.1 73 93 A R E - D 0 88B 21 15,-0.2 2,-0.4 16,-0.1 15,-0.2 -0.996 56.6-151.8-159.0 159.9 24.1 8.9 9.4 74 94 A V E - D 0 87B 1 13,-2.5 13,-2.6 -2,-0.3 2,-0.4 -0.982 20.9-130.5-133.2 143.3 23.0 12.5 9.4 75 95 A V E -cD 52 86B 2 -24,-2.3 -22,-2.0 -2,-0.4 2,-0.5 -0.807 19.5-142.5 -94.4 135.8 19.8 13.9 8.2 76 96 A V E -cD 53 85B 0 9,-2.7 8,-3.2 -2,-0.4 9,-1.5 -0.881 24.5-176.3-100.3 124.8 20.2 16.9 5.9 77 97 A V E -cD 54 83B 14 -24,-2.6 -22,-0.5 -2,-0.5 2,-0.1 -0.801 17.5-132.6-120.1 163.0 17.5 19.6 6.4 78 98 A D > - 0 0 56 4,-1.9 3,-1.9 -2,-0.3 -1,-0.1 -0.228 49.7 -75.3 -97.1-168.5 16.7 22.9 4.7 79 99 A S T 3 S+ 0 0 119 1,-0.3 -2,-0.0 2,-0.1 -25,-0.0 0.850 132.3 56.5 -58.3 -36.4 15.9 26.3 6.3 80 100 A K T 3 S- 0 0 141 2,-0.1 -1,-0.3 1,-0.1 -3,-0.0 0.415 118.0-112.9 -77.0 2.3 12.5 25.1 7.3 81 101 A G S < S+ 0 0 26 -3,-1.9 -48,-2.6 1,-0.3 -2,-0.1 0.707 72.3 141.8 72.7 19.3 14.1 22.2 9.2 82 102 A K - 0 0 59 -50,-0.2 -4,-1.9 1,-0.1 -1,-0.3 -0.768 59.5-102.7 -96.9 139.0 12.6 19.8 6.7 83 103 A P E + D 0 77B 23 0, 0.0 -6,-0.3 0, 0.0 3,-0.1 -0.390 45.2 161.3 -63.1 124.4 14.5 16.7 5.5 84 104 A V E - 0 0 38 -8,-3.2 -74,-1.8 1,-0.3 2,-0.3 0.392 65.8 -2.9-120.8 -4.5 16.0 17.2 2.0 85 105 A G E -BD 9 76B 0 -9,-1.5 -9,-2.7 -76,-0.3 2,-0.4 -0.984 55.7-131.6-173.8 170.1 18.6 14.4 2.1 86 106 A I E -BD 8 75B 22 -78,-1.9 -78,-2.9 -2,-0.3 2,-0.5 -0.998 15.2-163.7-137.3 136.0 20.3 11.7 4.1 87 107 A L E - D 0 74B 0 -13,-2.6 -13,-2.5 -2,-0.4 2,-0.2 -0.980 11.5-175.5-125.9 121.1 24.1 11.1 4.4 88 108 A T E > - D 0 73B 14 -2,-0.5 4,-1.8 -15,-0.2 -15,-0.2 -0.645 41.0-112.0-110.7 168.7 25.5 7.9 5.7 89 109 A V H > S+ 0 0 0 -17,-2.0 4,-2.3 1,-0.2 5,-0.2 0.908 120.9 57.0 -62.4 -39.8 29.0 6.6 6.4 90 110 A G H > S+ 0 0 11 -18,-0.3 4,-2.9 1,-0.2 5,-0.3 0.897 103.4 52.4 -57.6 -42.7 28.5 4.3 3.5 91 111 A D H >>S+ 0 0 7 1,-0.2 4,-2.7 2,-0.2 5,-0.6 0.903 108.5 50.3 -60.9 -42.6 27.9 7.3 1.2 92 112 A I H X>S+ 0 0 0 -4,-1.8 5,-2.4 3,-0.2 4,-1.2 0.916 114.4 44.6 -63.7 -41.5 31.0 9.0 2.3 93 113 A I H <>S+ 0 0 5 -4,-2.3 5,-2.3 3,-0.2 -2,-0.2 0.968 122.6 34.2 -65.9 -54.2 33.1 5.9 1.7 94 114 A R H <5S+ 0 0 111 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.865 128.5 32.4 -71.7 -41.2 31.6 5.0 -1.7 95 115 A R H <5S+ 0 0 104 -4,-2.7 -3,-0.2 -5,-0.3 -1,-0.2 0.672 133.1 19.4 -93.4 -18.9 30.9 8.4 -3.2 96 116 A Y T >X S+ 0 0 128 1,-0.2 3,-1.6 2,-0.1 4,-0.3 0.738 89.2 77.7 -81.4 -24.2 41.9 12.1 -5.9 102 122 A K G > S+ 0 0 110 1,-0.3 3,-0.5 2,-0.1 -1,-0.2 0.757 91.6 49.8 -56.7 -31.3 42.7 13.9 -2.7 103 123 A Y G > S+ 0 0 23 -3,-0.4 87,-1.8 1,-0.2 3,-0.8 0.361 82.3 86.7 -95.5 6.7 42.9 10.7 -0.6 104 124 A K G < S+ 0 0 94 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.716 92.6 53.4 -73.4 -18.7 45.2 8.7 -2.8 105 125 A G G < S+ 0 0 69 -3,-0.5 2,-0.3 -4,-0.3 -1,-0.3 -0.302 90.8 86.7-111.4 48.9 47.9 10.5 -0.9 106 126 A V < - 0 0 39 -3,-0.8 83,-2.9 80,-0.1 84,-0.3 -0.843 61.2-149.6-150.1 108.6 46.9 9.7 2.7 107 127 A E B -H 188 0D 90 -2,-0.3 81,-0.3 81,-0.3 79,-0.2 -0.396 17.2-132.7 -74.7 154.7 47.9 6.5 4.6 108 128 A I S >> S+ 0 0 0 79,-2.3 3,-2.0 76,-0.3 4,-1.7 0.469 75.7 109.7 -86.6 -1.0 45.6 5.1 7.2 109 129 A E T 34 S+ 0 0 85 76,-1.3 -1,-0.2 1,-0.3 3,-0.1 0.842 79.5 45.3 -43.9 -46.4 48.4 4.7 9.8 110 130 A P T 34 S+ 0 0 77 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.669 118.5 43.5 -75.3 -12.0 47.1 7.5 12.1 111 131 A Y T <4 S+ 0 0 56 -3,-2.0 -2,-0.2 74,-0.1 113,-0.1 0.682 80.0 102.4-109.1 -21.2 43.5 6.4 11.9 112 132 A Y S < S- 0 0 22 -4,-1.7 2,-0.3 -3,-0.1 105,-0.2 -0.331 75.5-104.6 -71.5 149.6 43.1 2.6 12.3 113 133 A Q B -I 216 0E 42 103,-2.5 103,-1.9 1,-0.1 93,-0.2 -0.554 21.7-165.4 -73.1 130.7 41.9 1.1 15.5 114 134 A R S S+ 0 0 100 -2,-0.3 2,-0.5 101,-0.2 -1,-0.1 0.591 77.5 70.6 -88.1 -14.1 44.6 -0.6 17.6 115 135 A Y + 0 0 190 101,-0.1 2,-0.4 2,-0.0 101,-0.1 -0.922 65.5 169.4-108.4 123.1 42.0 -2.3 19.7 116 136 A V - 0 0 40 -2,-0.5 2,-0.4 99,-0.1 24,-0.1 -0.996 32.6-132.3-140.7 135.0 40.0 -5.0 18.0 117 137 A S + 0 0 48 -2,-0.4 2,-0.2 22,-0.2 18,-0.0 -0.702 37.9 171.8 -81.9 129.3 37.5 -7.6 19.1 118 138 A I - 0 0 74 -2,-0.4 2,-0.3 22,-0.2 24,-0.2 -0.779 20.2-146.0-131.4 174.8 38.4 -11.0 17.6 119 139 A V E -l 142 0F 11 22,-1.8 24,-2.0 -2,-0.2 2,-0.2 -0.994 20.3-117.0-148.5 139.5 37.2 -14.6 18.0 120 140 A W E > -l 143 0F 131 -2,-0.3 3,-2.4 22,-0.2 52,-0.3 -0.540 29.7-123.4 -72.7 139.3 38.9 -18.0 17.8 121 141 A E T 3 S+ 0 0 50 22,-2.6 52,-1.8 1,-0.3 53,-0.2 0.717 109.9 60.0 -57.0 -21.9 37.6 -20.2 15.0 122 142 A G T 3 S+ 0 0 23 21,-0.3 -1,-0.3 50,-0.2 3,-0.1 0.473 77.8 120.1 -86.6 0.5 36.7 -22.9 17.5 123 143 A T S < S- 0 0 28 -3,-2.4 49,-2.6 48,-0.1 50,-0.2 -0.445 71.9-111.6 -70.3 129.1 34.3 -20.6 19.4 124 144 A P B >> -O 171 0G 56 0, 0.0 4,-1.9 0, 0.0 3,-0.7 -0.304 31.0-113.4 -57.9 142.9 30.7 -21.8 19.7 125 145 A L H 3> S+ 0 0 24 45,-2.7 4,-2.6 1,-0.2 5,-0.2 0.822 112.1 55.6 -48.0 -44.7 28.4 -19.5 17.7 126 146 A K H 3> S+ 0 0 142 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.898 110.4 45.0 -60.1 -41.4 26.5 -18.2 20.7 127 147 A A H <> S+ 0 0 54 -3,-0.7 4,-1.7 2,-0.2 -1,-0.2 0.853 112.6 52.2 -69.9 -34.5 29.7 -17.0 22.4 128 148 A A H X S+ 0 0 3 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.880 108.9 50.8 -67.7 -37.8 30.9 -15.5 19.1 129 149 A L H X S+ 0 0 64 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.866 105.5 55.3 -67.8 -36.1 27.6 -13.7 18.8 130 150 A K H X S+ 0 0 128 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.919 109.8 47.4 -62.0 -41.1 27.9 -12.3 22.3 131 151 A A H < S+ 0 0 30 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.889 109.8 52.2 -66.0 -40.2 31.3 -10.9 21.2 132 152 A L H >< S+ 0 0 30 -4,-2.1 3,-1.6 1,-0.2 -2,-0.2 0.914 107.0 53.4 -61.6 -42.3 29.9 -9.5 18.0 133 153 A L H 3< S+ 0 0 126 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.827 111.8 46.0 -61.1 -32.6 27.2 -7.7 20.1 134 154 A L T 3< S+ 0 0 127 -4,-1.3 2,-0.3 -5,-0.2 -1,-0.3 0.213 95.1 100.6 -97.0 14.9 30.0 -6.2 22.3 135 155 A S < - 0 0 19 -3,-1.6 5,-0.0 2,-0.2 -19,-0.0 -0.739 67.1-143.5-101.6 149.8 32.2 -5.1 19.4 136 156 A N S S+ 0 0 93 -2,-0.3 2,-0.3 3,-0.1 -1,-0.1 0.346 85.7 74.5 -89.1 7.8 32.4 -1.6 17.9 137 157 A S S S- 0 0 10 -5,-0.2 -2,-0.2 2,-0.1 66,-0.1 -0.850 82.4-130.5-118.4 155.1 32.8 -3.3 14.5 138 158 A M S S+ 0 0 69 -2,-0.3 17,-0.6 64,-0.1 2,-0.3 0.624 93.1 43.9 -76.6 -12.1 30.2 -5.0 12.3 139 159 A A E - M 0 154F 0 15,-0.2 15,-0.2 16,-0.1 -22,-0.2 -0.956 69.1-139.5-137.2 155.2 32.6 -7.9 12.0 140 160 A L E - M 0 153F 1 13,-2.8 13,-1.7 -2,-0.3 -22,-0.2 -0.945 22.0-134.9-111.9 118.3 34.9 -10.1 14.1 141 161 A P E - M 0 152F 0 0, 0.0 -22,-1.8 0, 0.0 2,-0.4 -0.506 27.0-137.6 -67.2 144.6 38.3 -11.1 12.6 142 162 A V E -lM 119 151F 0 9,-3.3 8,-2.9 -24,-0.2 9,-1.7 -0.889 20.6-169.1-109.6 137.7 38.7 -14.8 13.2 143 163 A V E -lM 120 149F 9 -24,-2.0 -22,-2.6 -2,-0.4 -21,-0.3 -0.824 18.3-120.1-122.9 160.5 42.0 -16.4 14.4 144 164 A D > - 0 0 31 4,-2.2 3,-1.9 -2,-0.3 -1,-0.1 -0.207 51.2 -79.4 -85.4-174.6 43.4 -19.9 14.8 145 165 A S T 3 S+ 0 0 99 1,-0.3 -1,-0.1 2,-0.1 -25,-0.0 0.661 132.1 49.7 -61.8 -15.8 44.6 -21.4 18.0 146 166 A E T 3 S- 0 0 164 2,-0.1 -1,-0.3 0, 0.0 0, 0.0 0.350 121.4-101.7-104.7 3.4 47.9 -19.5 17.7 147 167 A G S < S+ 0 0 43 -3,-1.9 66,-0.4 1,-0.3 2,-0.2 0.475 72.7 143.4 92.4 1.7 46.4 -16.1 17.0 148 168 A N - 0 0 73 64,-0.1 -4,-2.2 1,-0.1 2,-0.4 -0.525 58.7-106.8 -76.4 143.0 46.9 -16.0 13.2 149 169 A L E +M 143 0F 23 62,-2.3 -6,-0.3 -6,-0.2 -1,-0.1 -0.542 51.6 154.3 -71.0 122.5 44.2 -14.4 11.1 150 170 A V E - 0 0 38 -8,-2.9 2,-0.3 -2,-0.4 -7,-0.2 0.463 59.3 -20.0-127.7 -7.2 42.2 -17.1 9.3 151 171 A G E -M 142 0F 0 -9,-1.7 -9,-3.3 28,-0.1 2,-0.3 -0.969 50.6-126.3-175.9-170.6 38.8 -15.6 8.6 152 172 A I E -MN 141 177F 0 25,-1.5 25,-3.0 -11,-0.3 2,-0.3 -0.975 18.0-165.5-157.4 150.3 36.2 -13.0 9.4 153 173 A V E +M 140 0F 8 -13,-1.7 -13,-2.8 -2,-0.3 2,-0.2 -1.000 8.2 172.3-146.7 143.9 32.5 -13.1 10.3 154 174 A D E > -M 139 0F 4 -2,-0.3 3,-1.4 -15,-0.2 4,-0.4 -0.813 51.2 -81.8-138.2 180.0 29.5 -10.8 10.6 155 175 A E G > S+ 0 0 103 -17,-0.6 3,-1.7 1,-0.3 4,-0.3 0.860 121.8 59.1 -53.5 -41.6 25.8 -10.9 11.2 156 176 A T G > S+ 0 0 44 1,-0.3 3,-1.3 2,-0.2 -1,-0.3 0.755 92.5 69.0 -62.7 -23.6 24.9 -11.8 7.5 157 177 A D G X S+ 0 0 1 -3,-1.4 3,-2.0 1,-0.3 -1,-0.3 0.684 79.9 77.2 -69.9 -16.1 27.1 -14.9 7.8 158 178 A L G X S+ 0 0 46 -3,-1.7 3,-1.7 -4,-0.4 -1,-0.3 0.814 83.1 66.3 -61.8 -28.7 24.5 -16.4 10.2 159 179 A L G < S+ 0 0 125 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.515 84.2 73.6 -71.6 -3.6 22.3 -17.1 7.1 160 180 A R G < S+ 0 0 120 -3,-2.0 2,-0.8 15,-0.1 -1,-0.3 0.542 73.5 98.6 -84.5 -7.2 25.0 -19.6 6.0 161 181 A D X - 0 0 33 -3,-1.7 3,-1.6 -4,-0.2 4,-0.1 -0.733 66.0-154.6 -85.8 109.5 23.7 -21.9 8.7 162 182 A S G > S+ 0 0 87 -2,-0.8 3,-1.9 1,-0.3 -1,-0.2 0.733 86.4 78.1 -53.4 -25.0 21.4 -24.4 7.0 163 183 A E G 3 S+ 0 0 148 1,-0.3 -1,-0.3 -3,-0.0 -2,-0.0 0.366 73.9 78.5 -69.8 7.7 19.7 -24.9 10.4 164 184 A I G < + 0 0 91 -3,-1.6 2,-2.3 -5,-0.1 -1,-0.3 0.547 61.4 105.7 -90.4 -8.6 17.8 -21.6 9.8 165 185 A V < 0 0 127 -3,-1.9 -1,-0.1 -4,-0.1 -3,-0.0 -0.504 360.0 360.0 -72.7 80.9 15.4 -23.4 7.5 166 186 A R 0 0 270 -2,-2.3 -3,-0.0 0, 0.0 0, 0.0 -0.928 360.0 360.0 175.9 360.0 12.6 -23.4 10.0 167 ! 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 0.0 168 219 A P 0 0 146 0, 0.0 2,-0.1 0, 0.0 -42,-0.1 0.000 360.0 360.0 360.0 34.0 22.8 -25.4 17.2 169 220 A N + 0 0 67 -44,-0.1 -42,-0.1 -45,-0.1 3,-0.1 -0.162 360.0 155.0-139.7 67.0 25.7 -24.1 18.8 170 221 A K - 0 0 113 -46,-0.2 -45,-2.7 1,-0.2 -44,-0.1 -0.197 52.0 -71.6 -76.3 167.1 28.6 -25.1 16.4 171 222 A P B > -O 124 0G 49 0, 0.0 3,-2.0 0, 0.0 4,-0.2 -0.269 37.0-125.3 -59.7 140.8 32.0 -23.4 15.9 172 223 A V G >> S+ 0 0 1 -49,-2.6 3,-2.0 -52,-0.3 4,-1.1 0.723 104.4 79.6 -60.8 -19.6 32.0 -20.1 14.2 173 224 A A G 34 S+ 0 0 20 -52,-1.8 3,-0.3 1,-0.3 -1,-0.3 0.822 81.7 67.1 -57.4 -29.9 34.5 -21.6 11.7 174 225 A E G <4 S+ 0 0 124 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.619 113.4 26.0 -68.8 -14.2 31.5 -23.3 10.1 175 226 A I T <4 S+ 0 0 10 -3,-2.0 -1,-0.2 -4,-0.2 -2,-0.2 0.385 95.0 116.9-128.6 2.6 30.1 -19.9 8.8 176 227 A M < - 0 0 12 -4,-1.1 2,-0.6 -3,-0.3 -23,-0.2 -0.290 67.1-116.1 -76.5 157.0 33.1 -17.7 8.5 177 228 A T B -N 152 0F 25 -25,-3.0 -25,-1.5 1,-0.1 -35,-0.2 -0.820 25.6-166.5 -89.3 121.9 34.5 -16.1 5.4 178 229 A R S S+ 0 0 158 -2,-0.6 2,-1.2 -27,-0.2 -1,-0.1 0.806 70.0 71.4 -83.2 -30.8 38.0 -17.5 4.8 179 230 A D S S- 0 0 132 -27,-0.1 2,-0.4 2,-0.0 -1,-0.2 -0.738 74.7-163.3 -90.9 97.3 39.4 -15.1 2.2 180 231 A V - 0 0 23 -2,-1.2 2,-0.7 -31,-0.1 24,-0.1 -0.669 15.0-139.9 -88.3 129.8 39.9 -12.0 4.3 181 232 A I - 0 0 23 -2,-0.4 2,-0.2 22,-0.2 22,-0.0 -0.798 35.6-170.4 -86.2 117.2 40.4 -8.6 2.5 182 233 A V - 0 0 42 -2,-0.7 2,-0.3 22,-0.2 24,-0.2 -0.656 21.3-157.9-114.8 167.1 43.1 -6.8 4.5 183 234 A A B -j 206 0E 0 22,-2.6 24,-2.7 -2,-0.2 34,-0.0 -0.789 9.9-147.0-129.5 170.3 44.8 -3.5 4.9 184 235 A T > - 0 0 52 -2,-0.3 3,-1.4 22,-0.2 -76,-0.3 -0.879 35.8 -99.9-133.5 166.6 48.2 -2.4 6.3 185 236 A P T 3 S+ 0 0 21 0, 0.0 -76,-1.3 0, 0.0 -77,-0.2 0.811 122.2 50.3 -59.4 -29.3 49.2 0.8 8.1 186 237 A H T 3 S+ 0 0 125 -78,-0.2 2,-0.1 -79,-0.2 -80,-0.1 0.519 82.9 113.6 -87.8 -6.0 50.7 2.2 4.9 187 238 A M S < S- 0 0 27 -3,-1.4 -79,-2.3 -80,-0.1 -78,-0.2 -0.394 70.3-113.8 -66.7 142.7 47.6 1.6 2.7 188 239 A T B > -H 107 0D 33 -81,-0.3 4,-2.5 1,-0.1 -81,-0.3 -0.385 11.9-120.3 -80.6 156.7 45.9 4.7 1.6 189 240 A V H > S+ 0 0 0 -83,-2.9 4,-2.4 -86,-0.4 5,-0.2 0.867 115.8 57.0 -58.5 -36.7 42.5 6.0 2.5 190 241 A H H > S+ 0 0 33 -87,-1.8 4,-2.5 -84,-0.3 -1,-0.2 0.963 108.2 42.9 -60.5 -53.9 41.7 5.8 -1.2 191 242 A E H > S+ 0 0 81 -88,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.886 113.3 52.0 -63.4 -39.0 42.6 2.1 -1.6 192 243 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.941 112.2 46.3 -62.5 -44.9 40.8 1.1 1.6 193 244 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.893 109.2 55.4 -64.1 -38.8 37.6 2.9 0.5 194 245 A L H X S+ 0 0 59 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.913 111.1 44.6 -59.2 -42.7 38.0 1.3 -2.9 195 246 A K H X S+ 0 0 43 -4,-2.2 4,-2.6 2,-0.2 6,-0.3 0.896 111.3 52.5 -69.1 -41.3 38.0 -2.2 -1.3 196 247 A M H X>S+ 0 0 5 -4,-2.5 5,-1.6 1,-0.2 4,-0.8 0.913 115.6 41.8 -60.5 -42.0 35.2 -1.3 1.1 197 248 A A H <5S+ 0 0 35 -4,-2.6 3,-0.2 3,-0.2 -2,-0.2 0.928 114.6 50.5 -70.2 -46.5 33.1 -0.3 -1.9 198 249 A K H <5S+ 0 0 146 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.893 123.7 28.8 -58.8 -44.8 34.1 -3.1 -4.2 199 250 A Y H <5S- 0 0 102 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.435 103.2-125.2 -98.3 -1.5 33.4 -5.9 -1.6 200 251 A S T <5 + 0 0 78 -4,-0.8 2,-0.4 -5,-0.2 -3,-0.2 0.932 61.9 142.0 55.5 49.6 30.6 -4.0 0.2 201 252 A I < - 0 0 7 -5,-1.6 -1,-0.2 -6,-0.3 -2,-0.1 -0.929 49.9-149.7-122.6 147.3 32.4 -4.4 3.5 202 253 A E S S+ 0 0 25 -2,-0.4 17,-2.5 1,-0.1 18,-0.3 0.421 77.1 30.3 -95.3 0.2 32.6 -1.9 6.4 203 254 A Q E - K 0 218E 1 15,-0.3 15,-0.2 16,-0.1 -22,-0.2 -0.983 53.7-158.3-161.1 147.1 36.0 -3.0 7.8 204 255 A L E - K 0 217E 0 13,-2.4 13,-2.7 -2,-0.3 -22,-0.2 -0.992 29.5-121.6-127.3 125.9 39.4 -4.4 6.9 205 256 A P E - K 0 216E 0 0, 0.0 -22,-2.6 0, 0.0 2,-0.5 -0.398 27.8-132.6 -62.0 144.0 41.7 -6.1 9.4 206 257 A V E +jK 183 215E 0 9,-2.8 8,-2.7 -24,-0.2 9,-1.3 -0.892 37.0 171.0-101.0 127.8 45.0 -4.3 9.5 207 258 A I E - K 0 213E 11 -24,-2.7 2,-0.3 -2,-0.5 6,-0.2 -0.806 31.7-149.8-133.2 174.3 48.0 -6.7 9.3 208 259 A R E > S+ K 0 212E 152 4,-1.6 4,-2.0 -2,-0.3 3,-0.3 -0.875 76.3 3.7-133.2 160.2 51.7 -7.1 8.9 209 260 A G T 4 S- 0 0 75 -2,-0.3 -2,-0.1 1,-0.2 0, 0.0 -0.320 122.3 -43.6 61.2-139.5 53.4 -10.1 7.3 210 261 A E T 4 S- 0 0 196 1,-0.0 -1,-0.2 -3,-0.0 -3,-0.0 0.766 130.9 -10.0 -97.6 -30.5 50.8 -12.6 5.9 211 262 A G T 4 S+ 0 0 17 -3,-0.3 -62,-2.3 2,-0.0 2,-1.0 0.091 83.5 137.5-160.3 33.7 48.3 -12.7 8.7 212 263 A D E < - K 0 208E 78 -4,-2.0 -4,-1.6 -64,-0.2 2,-0.3 -0.771 46.0-144.3 -91.5 100.3 49.6 -10.9 11.8 213 264 A L E + K 0 207E 29 -2,-1.0 -6,-0.2 -66,-0.4 3,-0.1 -0.493 36.2 155.2 -70.5 124.0 46.7 -8.9 13.0 214 265 A I E - 0 0 38 -8,-2.7 2,-0.3 -2,-0.3 -7,-0.2 0.365 63.2 -30.0-128.5 -0.4 47.6 -5.5 14.5 215 266 A G E - K 0 206E 0 -9,-1.3 -9,-2.8 -100,-0.0 2,-0.3 -0.990 54.6-105.4 173.1-168.8 44.4 -3.5 14.1 216 267 A L E -IK 113 205E 2 -103,-1.9 -103,-2.5 -11,-0.3 2,-0.7 -0.982 12.3-152.0-150.6 132.6 41.2 -2.8 12.2 217 268 A I E - K 0 204E 0 -13,-2.7 -13,-2.4 -2,-0.3 2,-0.2 -0.936 21.8-172.8-110.3 111.1 40.2 -0.0 9.8 218 269 A R E >> - K 0 203E 28 -2,-0.7 4,-1.0 -15,-0.2 3,-0.7 -0.616 38.0-114.7 -96.4 159.8 36.5 0.5 9.9 219 270 A D H >> S+ 0 0 10 -17,-2.5 3,-0.8 1,-0.3 4,-0.6 0.902 119.8 58.6 -59.7 -37.0 34.6 2.9 7.6 220 271 A F H >4 S+ 0 0 12 -18,-0.3 3,-0.6 1,-0.3 4,-0.4 0.804 99.3 57.6 -61.6 -30.9 33.8 4.9 10.7 221 272 A D H X4 S+ 0 0 2 -3,-0.7 3,-1.1 1,-0.2 4,-0.3 0.795 95.9 63.3 -71.7 -28.2 37.5 5.3 11.3 222 273 A L H XX S+ 0 0 0 -4,-1.0 3,-1.6 -3,-0.8 4,-0.5 0.750 86.9 72.8 -68.4 -21.7 38.0 6.9 7.9 223 274 A L G X< S+ 0 0 0 -4,-0.6 3,-1.2 -3,-0.6 4,-0.5 0.817 84.4 68.1 -61.6 -29.0 35.7 9.8 9.1 224 275 A K G X4 S+ 0 0 62 -3,-1.1 3,-0.8 -4,-0.4 -1,-0.3 0.740 86.7 67.7 -63.4 -22.3 38.6 11.0 11.3 225 276 A V G <4 S+ 0 0 22 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.855 94.4 57.1 -65.3 -34.3 40.5 11.8 8.1 226 277 A L G << 0 0 18 -3,-1.2 -1,-0.2 -4,-0.5 -2,-0.2 0.657 360.0 360.0 -71.5 -16.9 38.0 14.6 7.4 227 278 A V < 0 0 88 -3,-0.8 -2,-0.2 -4,-0.5 -1,-0.2 0.968 360.0 360.0 -81.5 360.0 38.7 16.2 10.8 228 ! 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 0.0 229 6075 A X 0 0 147 0, 0.0 -75,-0.0 0, 0.0 -28,-0.0 0.000 360.0 360.0 360.0 360.0 26.3 -5.4 5.2