==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 24-MAR-06 2CIM . COMPND 2 MOLECULE: SERYL-TRNA SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOSARCINA BARKERI; . AUTHOR S.BILOKAPIC,T.MAIER,D.AHEL,I.GRUIC-SOVULJ,D.SOLL,I.WEYGAND-D . 964 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42960.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 674 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 205 21.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 72 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 82 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 251 26.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 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 1 3 1 6 2 0 0 1 2 1 2 1 2 2 1 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 4 3 8 2 7 4 3 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 2 0 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 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 0 105 0, 0.0 2,-0.3 0, 0.0 107,-0.0 0.000 360.0 360.0 360.0 154.4 66.7 10.7 49.7 2 2 A K - 0 0 134 103,-0.1 2,-0.3 104,-0.0 125,-0.1 -0.868 360.0-109.3-116.0 143.8 68.2 7.4 50.7 3 3 A L + 0 0 18 -2,-0.3 2,-0.3 102,-0.1 63,-0.2 -0.555 48.4 166.6 -70.5 124.8 68.9 5.9 54.2 4 4 A Q E -A 104 0A 42 100,-1.6 100,-2.7 -2,-0.3 2,-0.3 -0.996 27.7-147.2-148.6 143.8 72.6 5.7 55.0 5 5 A F E -AB 103 64A 0 59,-2.7 59,-1.2 -2,-0.3 2,-0.4 -0.750 11.3-163.0-103.5 150.2 75.0 5.1 57.9 6 6 A N E -AB 102 63A 35 96,-1.6 96,-2.7 -2,-0.3 2,-0.4 -0.945 7.4-176.9-140.7 116.8 78.4 6.8 58.4 7 7 A L E -AB 101 62A 1 55,-2.6 55,-2.2 -2,-0.4 2,-0.4 -0.924 12.3-175.2-117.0 135.9 81.1 5.6 60.7 8 8 A K E +AB 100 61A 62 92,-2.1 91,-3.1 -2,-0.4 92,-1.1 -0.961 34.5 136.8-125.3 112.0 84.5 7.0 61.5 9 9 A A E -AB 98 60A 0 51,-1.9 51,-2.9 -2,-0.4 2,-0.3 -0.963 37.3-144.7-151.4 160.6 86.5 4.7 63.9 10 10 A Y E -AB 97 59A 19 87,-2.0 87,-1.9 -2,-0.3 2,-0.4 -0.984 19.3-124.8-132.6 147.0 89.8 3.1 64.7 11 11 A F E -A 96 0A 0 47,-0.7 47,-0.4 -2,-0.3 2,-0.3 -0.764 25.4-133.0 -86.3 130.2 91.0 -0.2 66.1 12 12 A K E -A 95 0A 69 83,-2.6 82,-2.4 -2,-0.4 83,-0.7 -0.617 26.1-163.6 -77.0 141.1 93.2 -0.1 69.1 13 13 A T E -A 93 0A 12 -2,-0.3 80,-0.2 43,-0.3 3,-0.1 -0.952 25.7-143.1-130.3 151.0 96.3 -2.3 69.0 14 14 A S S S+ 0 0 63 78,-1.7 2,-0.3 -2,-0.3 -1,-0.1 0.975 93.3 20.2 -71.3 -61.0 98.9 -3.7 71.5 15 15 A A S S- 0 0 45 77,-0.2 -1,-0.1 75,-0.1 75,-0.0 -0.720 107.1 -79.6-103.6 161.3 101.9 -3.5 69.2 16 16 A D - 0 0 74 -2,-0.3 40,-0.2 1,-0.1 39,-0.1 -0.409 26.5-148.6 -66.2 128.9 102.1 -1.3 66.1 17 17 A P > + 0 0 0 0, 0.0 3,-0.7 0, 0.0 -1,-0.1 0.162 68.5 112.7 -80.9 18.7 100.4 -2.7 62.9 18 18 A T G > + 0 0 50 1,-0.3 3,-1.1 2,-0.1 2,-0.9 0.854 62.9 62.3 -60.9 -42.1 103.1 -0.9 60.9 19 19 A P G 3 S+ 0 0 84 0, 0.0 -1,-0.3 0, 0.0 -3,-0.0 -0.049 102.6 55.0 -78.9 41.1 104.8 -4.1 59.5 20 20 A A G <> + 0 0 4 -2,-0.9 4,-2.2 -3,-0.7 5,-0.3 0.133 58.3 128.0-155.1 23.5 101.6 -5.1 57.8 21 21 A K H <> S+ 0 0 87 -3,-1.1 4,-0.8 1,-0.2 -3,-0.1 0.683 84.0 40.9 -63.1 -21.2 100.6 -2.1 55.5 22 22 A D H > S+ 0 0 139 2,-0.2 4,-1.3 3,-0.1 -1,-0.2 0.770 113.9 50.3 -95.5 -34.5 100.2 -4.4 52.5 23 23 A A H 4 S+ 0 0 48 2,-0.2 4,-0.3 1,-0.1 -2,-0.2 0.768 117.2 42.3 -73.2 -28.3 98.6 -7.4 54.2 24 24 A I H >X S+ 0 0 4 -4,-2.2 4,-1.7 2,-0.2 3,-0.6 0.884 111.9 51.6 -84.2 -44.8 96.0 -5.0 55.7 25 25 A A H 3X S+ 0 0 41 -4,-0.8 4,-1.2 -5,-0.3 -2,-0.2 0.814 108.9 52.1 -63.1 -32.8 95.3 -2.8 52.6 26 26 A A H 3X S+ 0 0 69 -4,-1.3 4,-0.6 1,-0.2 -1,-0.2 0.722 107.8 54.4 -73.3 -23.2 94.7 -5.9 50.5 27 27 A L H <> S+ 0 0 37 -3,-0.6 4,-1.4 -4,-0.3 3,-0.3 0.890 105.4 48.5 -79.4 -44.3 92.1 -7.2 53.1 28 28 A F H X S+ 0 0 10 -4,-1.7 4,-0.7 1,-0.2 20,-0.2 0.884 108.9 54.3 -62.8 -41.3 89.9 -4.1 53.2 29 29 A E H < S+ 0 0 137 -4,-1.2 -1,-0.2 1,-0.2 3,-0.2 0.750 106.7 53.1 -66.6 -26.0 89.7 -3.9 49.4 30 30 A E H >X S+ 0 0 99 -4,-0.6 3,-1.6 -3,-0.3 4,-1.3 0.863 99.1 62.6 -73.9 -39.1 88.5 -7.5 49.4 31 31 A A H 3<>S+ 0 0 2 -4,-1.4 5,-2.2 1,-0.3 -2,-0.2 0.698 87.0 72.7 -62.9 -23.1 85.6 -6.9 51.9 32 32 A N T 3<5S+ 0 0 54 -4,-0.7 -1,-0.3 1,-0.2 -2,-0.1 0.567 116.3 19.8 -72.0 -9.4 83.9 -4.5 49.5 33 33 A S T <45S+ 0 0 86 -3,-1.6 -2,-0.2 -4,-0.1 -1,-0.2 0.413 139.3 23.3-132.7 -9.3 82.8 -7.4 47.3 34 34 A T T >X5S+ 0 0 45 -4,-1.3 3,-1.4 3,-0.0 4,-0.6 0.616 118.4 34.3-119.3 -84.2 83.1 -10.3 49.7 35 35 A L T 345S+ 0 0 41 1,-0.3 3,-0.4 2,-0.2 -3,-0.1 0.794 120.6 46.2 -53.3 -39.7 83.0 -10.0 53.5 36 36 A L T 34 - 0 0 89 0, 0.0 3,-1.4 0, 0.0 26,-0.1 -0.332 58.7 -81.1 -57.9 144.8 71.0 -8.1 48.4 42 42 A E T 3 S+ 0 0 191 1,-0.2 2,-0.3 3,-0.0 3,-0.1 -0.081 117.8 31.2 -55.2 146.3 73.7 -7.5 45.8 43 43 A G T 3 S+ 0 0 77 1,-0.2 2,-0.3 -3,-0.1 -1,-0.2 -0.332 110.3 79.9 95.4 -47.9 74.7 -3.9 45.1 44 44 A Q < + 0 0 69 -3,-1.4 -1,-0.2 -2,-0.3 2,-0.2 -0.687 60.4 103.5 -87.9 145.6 73.8 -3.1 48.7 45 45 A G S S- 0 0 10 -2,-0.3 -8,-0.2 22,-0.2 23,-0.1 -0.570 71.7 -63.6 147.3 146.9 76.3 -3.8 51.4 46 46 A A - 0 0 1 -10,-0.2 2,-0.3 -2,-0.2 18,-0.2 -0.099 48.6-170.4 -57.0 145.7 78.8 -2.1 53.7 47 47 A K E -C 63 0A 98 16,-1.9 16,-2.4 -14,-0.0 2,-0.5 -0.997 21.2-133.8-141.2 141.3 81.8 -0.4 52.1 48 48 A V E +C 62 0A 22 -2,-0.3 14,-0.2 -20,-0.2 3,-0.1 -0.864 22.5 176.6 -96.4 125.2 85.1 1.2 53.4 49 49 A T E + 0 0 91 12,-3.0 2,-0.3 -2,-0.5 -1,-0.1 0.845 61.5 39.2 -97.2 -42.4 85.8 4.6 51.9 50 50 A E E -C 61 0A 74 11,-0.7 11,-1.1 2,-0.0 2,-0.4 -0.872 60.2-163.6-117.6 148.7 88.9 5.8 53.7 51 51 A W E +C 60 0A 115 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.996 19.6 151.4-131.7 131.5 92.1 4.0 54.8 52 52 A K - 0 0 109 7,-1.2 7,-0.4 -2,-0.4 2,-0.2 -0.956 15.9-168.6-161.0 142.3 94.7 5.2 57.3 53 53 A L + 0 0 30 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.488 8.2 167.2-119.1-172.8 97.2 3.7 59.8 54 54 A G - 0 0 26 3,-0.4 -36,-0.0 -2,-0.2 -2,-0.0 -0.869 59.3 -66.2-170.3-156.0 99.6 4.7 62.7 55 55 A E S S- 0 0 146 -2,-0.2 -37,-0.1 -39,-0.1 3,-0.1 0.394 130.8 -7.3 -92.7 -0.0 101.6 3.2 65.5 56 56 A D S S+ 0 0 63 1,-0.2 -43,-0.3 -40,-0.2 2,-0.2 0.297 117.1 89.7-159.9 -32.0 98.4 2.0 67.1 57 57 A R + 0 0 108 -45,-0.1 -3,-0.4 -47,-0.1 -1,-0.2 -0.573 39.3 179.6 -84.1 139.6 95.5 3.5 65.2 58 58 A I - 0 0 1 -47,-0.4 -47,-0.7 -2,-0.2 -5,-0.2 -0.604 22.7-172.5-131.8 71.3 93.8 1.9 62.2 59 59 A E E +B 10 0A 32 -7,-0.4 -7,-1.2 -49,-0.2 2,-0.3 -0.428 6.6 175.1 -77.5 139.8 91.2 4.4 61.3 60 60 A L E -BC 9 51A 3 -51,-2.9 -51,-1.9 -9,-0.2 2,-0.5 -0.966 26.7-137.9-140.0 152.2 88.5 3.8 58.6 61 61 A T E -BC 8 50A 35 -11,-1.1 -12,-3.0 -2,-0.3 -11,-0.7 -0.971 26.7-172.9-111.6 127.2 85.4 5.4 57.2 62 62 A L E -BC 7 48A 0 -55,-2.2 -55,-2.6 -2,-0.5 2,-0.4 -0.948 8.4-173.7-122.8 139.9 82.4 3.1 56.5 63 63 A Q E +BC 6 47A 66 -16,-2.4 -16,-1.9 -2,-0.4 2,-0.3 -0.995 15.1 152.1-132.8 143.8 79.1 3.6 54.8 64 64 A S E -B 5 0A 10 -59,-1.2 -59,-2.7 -2,-0.4 4,-0.1 -0.936 35.3-120.1-152.8 169.6 76.1 1.4 54.5 65 65 A G - 0 0 2 2,-0.8 5,-0.2 -2,-0.3 -61,-0.1 -0.077 63.0 -70.8 -92.2-156.0 72.3 1.1 54.1 66 66 A R S S+ 0 0 95 -63,-0.2 3,-0.5 3,-0.1 2,-0.4 0.693 119.4 79.4 -73.7 -19.1 70.0 -0.6 56.6 67 67 A Y S S+ 0 0 113 1,-0.3 -2,-0.8 -26,-0.1 -22,-0.2 -0.799 109.8 0.6 -92.5 130.6 71.5 -3.9 55.4 68 68 A V S S- 0 0 10 -2,-0.4 -1,-0.3 -29,-0.2 -22,-0.2 0.967 93.7-146.5 53.0 60.8 74.9 -4.7 57.0 69 69 A R >> - 0 0 31 -3,-0.5 4,-2.7 1,-0.1 3,-1.6 -0.134 20.9-104.6 -59.0 150.5 74.9 -1.5 59.0 70 70 A V H 3> S+ 0 0 0 1,-0.3 4,-1.5 -5,-0.2 -1,-0.1 0.742 121.2 52.6 -49.7 -31.5 78.3 0.2 59.7 71 71 A H H 3> S+ 0 0 0 2,-0.2 4,-0.5 1,-0.2 -1,-0.3 0.774 112.3 43.9 -80.7 -26.3 78.4 -1.1 63.3 72 72 A D H <> S+ 0 0 59 -3,-1.6 4,-0.9 2,-0.2 3,-0.3 0.816 110.7 57.9 -76.5 -35.4 77.8 -4.7 62.2 73 73 A A H X S+ 0 0 0 -4,-2.7 4,-1.3 1,-0.2 3,-0.3 0.839 102.9 52.2 -61.1 -37.2 80.4 -4.0 59.4 74 74 A I H < S+ 0 0 0 -4,-1.5 -1,-0.2 -5,-0.2 4,-0.2 0.751 106.4 53.6 -73.2 -24.8 83.0 -3.1 62.0 75 75 A F H X S+ 0 0 46 -4,-0.5 4,-0.8 -3,-0.3 -1,-0.2 0.630 105.8 53.7 -83.4 -16.5 82.4 -6.3 63.9 76 76 A R H X S+ 0 0 60 -4,-0.9 4,-0.7 -3,-0.3 -2,-0.2 0.818 112.3 43.9 -77.8 -36.0 83.0 -8.3 60.6 77 77 A L H X S+ 0 0 0 -4,-1.3 4,-0.8 1,-0.2 -2,-0.2 0.458 104.8 67.6 -86.6 -4.5 86.3 -6.5 60.2 78 78 A R H > S+ 0 0 83 -4,-0.2 4,-1.0 2,-0.2 15,-0.2 0.926 107.6 32.6 -81.8 -49.5 87.2 -7.0 63.9 79 79 A K H X S+ 0 0 156 -4,-0.8 4,-0.7 2,-0.2 -2,-0.2 0.678 114.1 61.7 -82.4 -19.8 87.6 -10.8 63.9 80 80 A Q H X S+ 0 0 76 -4,-0.7 4,-1.2 2,-0.2 3,-0.3 0.878 110.4 40.6 -68.8 -40.3 88.9 -10.9 60.3 81 81 A L H X S+ 0 0 2 -4,-0.8 4,-1.9 1,-0.2 -2,-0.2 0.767 106.8 65.3 -74.0 -29.1 91.9 -8.7 61.5 82 82 A A H < S+ 0 0 34 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.691 112.5 32.8 -69.2 -20.0 92.1 -10.8 64.7 83 83 A E H < S+ 0 0 163 -4,-0.7 4,-0.4 -3,-0.3 5,-0.3 0.652 115.2 55.7-107.3 -24.5 93.1 -13.9 62.7 84 84 A A H < S+ 0 0 40 -4,-1.2 -2,-0.2 1,-0.2 -3,-0.2 0.799 125.4 25.7 -74.3 -30.7 95.0 -12.2 59.9 85 85 A L S < S+ 0 0 6 -4,-1.9 6,-1.2 6,-0.1 4,-0.5 0.283 102.6 101.3-110.3 4.9 97.3 -10.5 62.5 86 86 A G S > S- 0 0 26 3,-0.2 4,-0.5 4,-0.2 -3,-0.1 0.976 104.6 -14.3 -58.1 -82.4 96.8 -13.2 65.2 87 87 A K T 4 S+ 0 0 189 -4,-0.4 -1,-0.1 2,-0.2 -3,-0.1 0.530 132.1 67.4-101.3 -11.6 99.8 -15.5 65.3 88 88 A K T 4 S+ 0 0 176 -5,-0.3 -2,-0.1 1,-0.1 -1,-0.1 0.572 123.8 11.6 -83.1 -11.5 101.2 -14.4 61.9 89 89 A Y T 4 S- 0 0 76 -4,-0.5 -3,-0.2 2,-0.1 -2,-0.2 0.457 90.7-129.0-139.3 -15.2 102.0 -10.9 63.4 90 90 A K < + 0 0 168 -4,-0.5 2,-0.6 -5,-0.2 -4,-0.2 0.453 68.6 126.1 71.7 3.1 101.6 -11.2 67.2 91 91 A I + 0 0 9 -6,-1.2 2,-0.3 -77,-0.1 -1,-0.2 -0.838 35.1 179.1 -98.8 121.1 99.4 -8.1 67.1 92 92 A G - 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0 0 3 -3,-0.9 -5,-2.4 -5,-0.3 2,-0.3 -0.958 35.4-166.4-134.7 145.8 38.3 13.1 95.0 204 204 A W E -M 197 0C 9 -2,-0.3 2,-0.5 -7,-0.3 -7,-0.2 -0.922 16.8-147.8-136.4 148.9 35.3 12.2 97.1 205 205 A I E -M 196 0C 0 -9,-3.1 -9,-2.1 -2,-0.3 2,-0.7 -0.988 25.4-143.1-113.6 128.2 34.4 11.2 100.6 206 206 A H E -MN 195 717C 2 511,-1.7 511,-1.8 -2,-0.5 -11,-0.2 -0.838 6.4-149.4-102.7 115.1 31.4 8.9 100.8 207 207 A G > - 0 0 0 -13,-1.7 4,-2.2 -2,-0.7 3,-0.5 -0.142 45.8 -82.9 -64.2 172.3 28.9 9.3 103.7 208 208 A P H > S+ 0 0 3 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.826 127.4 56.3 -53.1 -37.2 27.0 6.2 104.8 209 209 A Q H > S+ 0 0 34 -16,-0.3 4,-0.9 1,-0.2 -15,-0.1 0.912 112.7 39.5 -62.9 -47.4 24.3 6.5 102.1 210 210 A S H > S+ 0 0 1 -16,-0.8 4,-1.9 -3,-0.5 3,-0.3 0.851 112.6 56.2 -69.6 -38.4 26.8 6.5 99.2 211 211 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 -17,-0.2 -2,-0.2 0.877 102.9 57.2 -62.6 -37.1 29.0 3.9 100.7 212 212 A R H X S+ 0 0 81 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.2 0.843 106.0 49.2 -59.1 -38.1 26.0 1.6 100.9 213 213 A I H X S+ 0 0 0 -4,-0.9 4,-2.0 -3,-0.3 -1,-0.2 0.902 111.0 49.1 -71.4 -43.1 25.5 1.9 97.2 214 214 A F H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.927 113.2 46.9 -60.5 -47.1 29.2 1.1 96.5 215 215 A R H X S+ 0 0 31 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.755 108.6 55.7 -69.5 -25.3 29.0 -1.9 98.8 216 216 A T H X S+ 0 0 5 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.894 108.8 47.2 -72.0 -38.9 25.8 -3.1 97.2 217 217 A F H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.913 112.1 50.3 -64.7 -42.9 27.4 -3.1 93.7 218 218 A E H X S+ 0 0 20 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.924 109.5 51.0 -61.3 -47.1 30.4 -4.9 95.1 219 219 A K H X S+ 0 0 85 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.900 109.4 51.1 -55.4 -45.9 28.1 -7.5 96.7 220 220 A I H X S+ 0 0 1 -4,-2.2 4,-2.8 2,-0.2 5,-0.4 0.911 109.3 49.6 -59.8 -44.8 26.3 -8.0 93.4 221 221 A V H X>S+ 0 0 0 -4,-2.2 5,-2.8 1,-0.2 4,-1.1 0.909 114.3 46.2 -62.9 -42.7 29.6 -8.6 91.5 222 222 A L H <>S+ 0 0 29 -4,-2.4 5,-2.7 3,-0.2 -2,-0.2 0.952 121.0 35.6 -59.9 -51.3 30.6 -11.1 94.1 223 223 A E H <5S+ 0 0 85 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.809 126.3 33.3 -80.5 -33.1 27.4 -13.0 94.2 224 224 A E H <5S+ 0 0 45 -4,-2.8 -1,-0.2 -5,-0.2 -3,-0.2 0.563 135.3 14.1-103.0 -13.1 26.2 -12.9 90.6 225 225 A L T X5S+ 0 0 0 -4,-1.1 4,-1.2 -5,-0.4 -3,-0.2 0.671 121.9 42.3-126.7 -61.5 29.5 -13.0 88.8 226 226 A L T 4XS+ 0 0 2 -5,-2.8 5,-2.9 2,-0.2 4,-0.5 0.937 116.1 42.3 -67.7 -51.5 32.6 -14.0 90.8 227 227 A E T >4 -Q 299 0E 15 -2,-0.5 4,-1.5 58,-0.2 3,-0.5 -0.475 28.5-107.5 -94.2 162.1 57.2 0.3 90.8 242 242 A W H > S+ 0 0 20 56,-1.9 4,-2.8 1,-0.2 5,-0.2 0.865 115.8 62.1 -52.6 -42.5 58.9 1.0 87.5 243 243 A E H > S+ 0 0 79 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.906 104.0 48.9 -56.4 -41.3 59.9 -2.7 87.1 244 244 A V H > S+ 0 0 3 -3,-0.5 4,-1.5 1,-0.2 -1,-0.2 0.922 114.3 44.2 -61.7 -46.1 56.2 -3.7 87.0 245 245 A W H X>S+ 0 0 1 -4,-1.5 6,-1.9 1,-0.2 4,-1.3 0.781 107.8 59.0 -74.7 -28.5 55.3 -1.1 84.4 246 246 A M H <5S+ 0 0 63 -4,-2.8 -1,-0.2 4,-0.2 -2,-0.2 0.910 110.2 43.5 -59.3 -42.5 58.3 -1.9 82.3 247 247 A K H <5S+ 0 0 86 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.781 115.1 48.2 -77.0 -27.2 57.0 -5.5 82.0 248 248 A S H <5S- 0 0 2 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.674 112.0-114.6 -84.3 -18.1 53.4 -4.4 81.3 249 249 A G T ><5S+ 0 0 18 -4,-1.3 3,-1.1 -5,-0.1 4,-0.2 0.383 86.4 114.2 95.4 -1.3 54.2 -1.9 78.7 250 250 A H G >>< + 0 0 34 -5,-0.9 4,-2.3 1,-0.2 3,-2.1 0.827 62.5 72.2 -69.4 -30.3 53.0 1.2 80.7 251 251 A A G 34 S+ 0 0 0 -6,-1.9 -1,-0.2 1,-0.3 510,-0.1 0.547 87.3 69.9 -61.6 -4.0 56.6 2.6 80.9 252 252 A K G <4 S- 0 0 121 -3,-1.1 -1,-0.3 -7,-0.3 -2,-0.2 0.730 127.0 -22.2 -84.6 -23.3 56.1 3.3 77.2 253 253 A G T <4 S+ 0 0 49 -3,-2.1 -2,-0.2 -4,-0.2 -3,-0.1 0.463 95.8 103.9-173.7 16.0 53.5 6.1 77.7 254 254 A V >< + 0 0 14 -4,-2.3 3,-2.7 1,-0.2 4,-0.5 0.636 54.8 106.4 -80.7 -12.5 51.4 6.4 80.9 255 255 A Y G > S+ 0 0 1 -5,-0.3 3,-1.0 1,-0.3 -1,-0.2 0.741 71.2 55.7 -37.6 -47.6 53.6 9.3 82.3 256 256 A P G 3 S+ 0 0 21 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.758 112.8 42.7 -61.7 -20.3 51.0 12.1 81.7 257 257 A E G < S+ 0 0 36 -3,-2.7 80,-2.6 79,-0.1 2,-0.3 0.420 92.3 97.2-110.8 3.2 48.3 10.3 83.7 258 258 A I < - 0 0 1 -3,-1.0 2,-0.7 -4,-0.5 78,-0.2 -0.657 64.6-131.9-104.6 151.4 50.0 9.0 86.8 259 259 A Y - 0 0 3 76,-0.3 42,-2.3 -2,-0.3 2,-0.1 -0.885 36.4-135.7 -92.3 113.8 50.4 10.2 90.3 260 260 A Y E -RS 300 744E 0 484,-2.8 484,-2.5 -2,-0.7 2,-0.5 -0.375 10.4-147.2 -78.7 146.7 54.1 9.7 91.1 261 261 A V E -RS 299 743E 0 38,-2.6 37,-1.8 482,-0.2 38,-0.8 -0.958 15.3-178.4-118.8 127.9 55.4 8.3 94.4 262 262 A C E - S 0 742E 0 480,-2.6 480,-2.7 -2,-0.5 34,-0.1 -0.988 15.5-146.4-125.5 130.5 58.6 9.4 96.0 263 263 A P - 0 0 11 0, 0.0 32,-3.3 0, 0.0 2,-0.1 -0.476 38.2 -92.5 -79.4 162.9 60.2 8.0 99.2 264 264 A P B -V 294 0F 2 0, 0.0 30,-0.2 0, 0.0 3,-0.1 -0.499 30.1-122.3 -64.9 146.6 62.2 10.4 101.5 265 265 A Q S S+ 0 0 111 28,-1.5 2,-0.3 1,-0.2 29,-0.1 0.853 94.6 5.9 -58.6 -31.1 65.9 10.4 100.7 266 266 A T - 0 0 50 27,-0.2 -1,-0.2 2,-0.1 29,-0.0 -0.996 54.8-138.7-151.3 154.8 66.3 9.3 104.3 267 267 A R + 0 0 73 -2,-0.3 5,-0.1 -3,-0.1 -1,-0.0 0.477 67.7 124.6 -76.6 -10.7 64.3 8.2 107.4 268 268 A D >> - 0 0 73 1,-0.2 3,-1.9 2,-0.1 4,-0.7 -0.436 55.9-151.4 -68.4 111.7 66.7 10.4 109.5 269 269 A P H >> S+ 0 0 89 0, 0.0 4,-0.7 0, 0.0 3,-0.5 0.731 93.3 64.1 -51.6 -30.8 64.8 12.9 111.6 270 270 A D H 34 S+ 0 0 97 1,-0.2 4,-0.4 2,-0.2 3,-0.2 0.798 98.8 54.5 -66.2 -28.4 67.7 15.4 111.5 271 271 A Y H <4 S+ 0 0 66 -3,-1.9 -1,-0.2 1,-0.2 4,-0.2 0.748 113.7 41.8 -72.2 -26.5 67.2 15.7 107.7 272 272 A W H S+ 0 0 62 -4,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.891 109.0 47.1 -63.3 -42.5 64.1 22.0 108.9 275 275 A V H > S+ 0 0 0 -4,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.956 115.2 45.9 -60.8 -52.1 60.8 21.1 107.2 276 276 A A H X S+ 0 0 10 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.888 113.5 48.4 -60.4 -43.1 59.1 20.5 110.5 277 277 A D H X S+ 0 0 7 -4,-2.9 4,-1.2 2,-0.2 -1,-0.2 0.898 110.1 52.4 -66.0 -40.4 60.4 23.7 112.1 278 278 A Y H X S+ 0 0 71 -4,-2.1 4,-2.4 -5,-0.2 3,-0.4 0.926 111.7 46.2 -60.7 -47.0 59.4 25.8 109.1 279 279 A Y H X S+ 0 0 16 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.934 109.6 53.6 -59.8 -48.4 55.9 24.5 109.2 280 280 A K H < S+ 0 0 29 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.687 116.8 37.8 -64.5 -21.3 55.5 25.0 113.0 281 281 A V H < S+ 0 0 0 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.826 130.5 25.6 -95.9 -40.7 56.5 28.6 112.8 282 282 A T H < S- 0 0 28 -4,-2.4 -3,-0.2 2,-0.2 -2,-0.2 0.730 88.7-134.2 -95.1 -24.9 54.9 29.7 109.5 283 283 A H S < S+ 0 0 89 -4,-3.0 2,-0.4 -5,-0.4 -4,-0.2 0.742 72.7 114.3 60.7 30.2 52.0 27.2 109.3 284 284 A E - 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0 0 3 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.1 -0.207 31.5 -76.7 87.7 179.0 50.0 -22.6 112.1 947 479 B L S S+ 0 0 11 -4,-0.1 -1,-0.2 -2,-0.1 -5,-0.1 0.297 98.7 100.4 -97.8 5.4 48.8 -22.8 108.5 948 480 B D > - 0 0 85 -3,-0.3 3,-2.2 1,-0.1 4,-0.3 -0.869 62.6-152.3-104.8 112.6 46.8 -26.0 109.0 949 481 B P G > S+ 0 0 44 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.692 91.4 69.5 -54.5 -26.0 43.0 -25.5 109.4 950 482 B A G 3 S+ 0 0 65 1,-0.2 4,-0.1 7,-0.0 7,-0.0 0.708 101.6 45.6 -67.3 -21.4 42.8 -28.7 111.5 951 483 B N G < S+ 0 0 109 -3,-2.2 -1,-0.2 -6,-0.1 3,-0.1 0.366 90.8 104.0-104.8 1.9 44.6 -27.0 114.3 952 484 B W S < S- 0 0 5 -3,-1.0 -85,-0.1 -4,-0.3 -86,-0.1 -0.525 86.7 -88.0 -79.0 151.5 42.7 -23.7 114.2 953 485 B P >> - 0 0 20 0, 0.0 4,-2.2 0, 0.0 3,-0.8 -0.304 35.6-120.3 -56.2 143.3 40.1 -23.0 116.9 954 486 B E H 3> S+ 0 0 114 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.900 112.7 57.6 -49.7 -48.5 36.6 -24.3 115.9 955 487 B E H 34 S+ 0 0 90 1,-0.2 4,-0.4 -91,-0.2 -1,-0.2 0.810 110.1 43.9 -57.0 -34.0 35.1 -20.8 116.1 956 488 B F H X> S+ 0 0 0 -3,-0.8 4,-1.2 -91,-0.5 3,-1.0 0.888 109.3 55.8 -76.8 -41.8 37.6 -19.6 113.5 957 489 B R H 3X S+ 0 0 85 -4,-2.2 4,-1.7 1,-0.2 3,-0.4 0.878 102.1 57.1 -58.7 -40.6 37.2 -22.6 111.2 958 490 B N H 3< S+ 0 0 110 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.709 110.0 45.5 -62.6 -23.1 33.4 -22.1 110.9 959 491 B R H <4 S+ 0 0 51 -3,-1.0 -1,-0.2 -4,-0.4 -2,-0.2 0.650 108.8 53.7 -95.4 -21.9 34.0 -18.6 109.6 960 492 B V H < S- 0 0 7 -4,-1.2 2,-0.2 -3,-0.4 -2,-0.2 0.897 87.3-164.1 -77.2 -42.9 36.7 -19.4 107.0 961 493 B G < - 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