==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 09-MAY-08 3D31 . COMPND 2 MOLECULE: SULFATE/MOLYBDATE ABC TRANSPORTER, ATP-BINDING . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOSARCINA ACETIVORANS; . AUTHOR S.GERBER,M.COMELLAS-BIGLER,K.P.LOCHER . 1192 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53557.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 988 82.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 158 13.3 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.0 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 . 4 0.3 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 . 95 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 167 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 471 39.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 1.5 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 2 3 6 0 6 2 4 6 0 0 0 0 2 2 0 0 2 0 0 0 0 2 0 0 0 4 RESIDUES PER ALPHA HELIX . 0 0 2 2 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 PARALLEL BRIDGES PER LADDER . 1 2 2 4 4 10 2 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 2 3 3 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 55 0, 0.0 59,-1.8 0, 0.0 60,-1.0 0.000 360.0 360.0 360.0 -47.2 42.1 106.0 222.8 2 2 A I E +AB 23 59A 6 21,-1.2 21,-3.2 57,-0.2 2,-0.5 -0.824 360.0 170.9 -99.3 118.7 42.5 109.6 221.7 3 3 A E E -AB 22 58A 55 55,-1.1 55,-2.8 -2,-0.6 2,-0.6 -0.973 16.7-163.8-130.4 120.8 39.4 111.6 221.1 4 4 A I E -AB 21 57A 6 17,-1.8 17,-2.3 -2,-0.5 2,-0.6 -0.912 14.5-160.8-100.3 126.6 39.3 115.3 220.4 5 5 A E E - B 0 56A 85 51,-2.3 51,-2.4 -2,-0.6 15,-0.2 -0.914 63.1 -39.3-116.0 104.7 35.8 116.7 220.9 6 6 A S E S- 0 0 59 -2,-0.6 12,-0.2 49,-0.2 14,-0.2 0.890 84.6-170.2 48.5 53.8 34.9 120.1 219.4 7 7 A L E +A 19 0A 0 12,-2.5 12,-1.3 48,-0.2 2,-0.3 -0.397 16.6 164.1 -82.1 150.8 38.3 121.5 220.3 8 8 A S E + B 0 54A 24 46,-1.3 45,-3.0 9,-0.2 46,-1.7 -0.865 3.7 162.3-166.5 127.4 39.2 125.2 220.0 9 9 A R E -A 16 0A 62 7,-1.0 7,-2.4 -2,-0.3 2,-0.5 -0.987 22.0-145.7-147.5 145.9 42.1 127.3 221.4 10 10 A K E +A 15 0A 154 -2,-0.3 5,-0.2 5,-0.2 2,-0.1 -0.943 21.8 165.0-126.8 118.3 43.4 130.7 220.4 11 11 A W - 0 0 51 3,-2.2 -2,-0.0 -2,-0.5 5,-0.0 -0.340 54.1 -85.2-109.5-168.3 47.0 131.8 220.5 12 12 A K S S+ 0 0 217 -2,-0.1 3,-0.1 1,-0.1 -2,-0.0 0.619 121.1 7.3 -79.6 -12.2 48.8 134.8 218.9 13 13 A N S S+ 0 0 111 1,-0.2 2,-0.4 24,-0.0 -1,-0.1 0.470 119.6 65.7-142.4 -13.3 49.5 133.1 215.6 14 14 A F - 0 0 14 23,-0.1 -3,-2.2 24,-0.1 2,-0.5 -0.960 56.2-166.7-121.6 134.0 47.6 129.7 215.6 15 15 A S E -A 10 0A 57 -2,-0.4 2,-0.6 -5,-0.2 -5,-0.2 -0.975 2.2-167.6-122.9 124.8 43.9 129.3 215.6 16 16 A L E -A 9 0A 4 -7,-2.4 -7,-1.0 -2,-0.5 2,-0.4 -0.949 12.7-179.7-111.8 117.5 42.1 125.9 216.3 17 17 A D E - 0 0 64 187,-1.2 189,-0.5 -2,-0.6 -9,-0.2 -0.963 57.1 -23.7-123.0 135.3 38.4 125.8 215.5 18 18 A N E S+ 0 0 111 -2,-0.4 2,-0.6 -12,-0.2 188,-0.3 0.857 72.0 179.7 33.1 80.4 36.0 122.9 215.9 19 19 A L E +A 7 0A 0 -12,-1.3 -12,-2.5 -3,-0.1 2,-0.4 -0.937 6.0 174.2-112.2 121.3 38.3 120.0 215.8 20 20 A S E + 0 0 60 -2,-0.6 2,-0.3 -14,-0.2 -15,-0.2 -0.991 8.9 153.7-127.9 129.0 36.9 116.5 216.2 21 21 A L E -A 4 0A 15 -17,-2.3 -17,-1.8 -2,-0.4 2,-0.4 -0.996 27.5-156.1-152.4 154.6 38.9 113.3 215.8 22 22 A K E -A 3 0A 118 -2,-0.3 2,-0.7 -19,-0.2 -19,-0.2 -0.949 6.4-173.4-135.0 109.8 38.9 109.7 216.9 23 23 A V E -A 2 0A 5 -21,-3.2 -21,-1.2 -2,-0.4 2,-0.2 -0.936 23.5-143.9-101.7 116.9 42.1 107.7 216.9 24 24 A E > - 0 0 106 -2,-0.7 3,-2.1 -23,-0.2 5,-0.1 -0.532 35.6 -73.2 -82.2 151.1 41.1 104.1 217.8 25 25 A S T 3 S+ 0 0 79 1,-0.3 -1,-0.2 -2,-0.2 155,-0.1 -0.012 116.4 8.2 -43.3 135.4 43.4 101.9 219.9 26 26 A G T 3 S+ 0 0 24 1,-0.2 -1,-0.3 152,-0.2 2,-0.2 0.320 95.5 131.7 74.7 -8.9 46.6 100.6 218.3 27 27 A E < - 0 0 31 -3,-2.1 2,-1.1 151,-0.1 154,-0.8 -0.531 57.8-137.0 -76.8 138.7 46.0 102.8 215.2 28 28 A Y E -d 181 0B 3 -2,-0.2 168,-2.0 152,-0.2 169,-0.9 -0.740 30.8-169.7 -97.8 85.5 49.0 105.0 214.0 29 29 A F E -de 182 197B 0 152,-1.9 154,-3.4 -2,-1.1 2,-0.5 -0.576 4.9-159.6 -81.4 136.8 47.1 108.2 213.4 30 30 A V E -de 183 198B 1 167,-2.7 169,-2.5 -2,-0.3 2,-0.4 -0.950 9.2-155.6-124.7 122.4 48.9 111.1 211.5 31 31 A I E -de 184 199B 2 152,-2.0 154,-2.1 -2,-0.5 2,-0.4 -0.785 22.4-166.7 -91.2 132.6 48.0 114.8 211.5 32 32 A L E +de 185 200B 2 167,-2.4 169,-2.9 -2,-0.4 154,-0.2 -0.957 47.0 34.0-126.6 139.8 49.3 116.5 208.4 33 33 A G + 0 0 10 152,-1.2 169,-0.2 -2,-0.4 167,-0.1 -0.564 69.1 108.6 130.2 -74.4 49.8 120.1 207.4 34 34 A P - 0 0 10 0, 0.0 2,-0.5 0, 0.0 -1,-0.3 0.182 57.6-131.3 -39.9 156.4 50.7 122.6 210.2 35 35 A T > - 0 0 115 151,-0.0 3,-1.5 4,-0.0 2,-0.5 -0.972 47.5 -71.7-123.0 119.1 54.2 124.1 210.4 36 36 A G T 3> S+ 0 0 35 -2,-0.5 4,-1.5 1,-0.3 5,-0.4 -0.075 127.9 53.5 41.0 -88.6 56.1 124.1 213.7 37 37 A A H 3> S+ 0 0 49 -2,-0.5 4,-1.1 1,-0.2 -1,-0.3 0.881 119.0 38.2 -38.0 -53.1 54.2 126.7 215.7 38 38 A G H X> S+ 0 0 2 -3,-1.5 4,-2.6 2,-0.2 3,-1.2 0.999 114.1 49.0 -64.5 -71.4 51.0 124.8 215.1 39 39 A K H 3> S+ 0 0 2 1,-0.3 4,-2.4 2,-0.2 5,-0.3 0.865 112.3 48.1 -31.3 -71.6 52.1 121.1 215.2 40 40 A T H 3X S+ 0 0 17 -4,-1.5 4,-1.6 1,-0.2 -1,-0.3 0.778 115.8 44.4 -46.4 -37.7 54.0 121.4 218.5 41 41 A L H S+ 0 0 18 -4,-1.6 5,-1.6 -5,-0.3 4,-0.7 0.909 106.8 52.5 -63.3 -41.2 51.0 120.1 223.7 45 45 A L H <5S+ 0 0 3 -4,-3.3 3,-0.5 3,-0.2 -1,-0.2 0.882 109.8 49.3 -61.1 -38.5 47.3 120.9 224.2 46 46 A I H <5S+ 0 0 0 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.973 110.5 50.3 -61.5 -53.5 46.6 117.1 223.8 47 47 A A H <5S- 0 0 0 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.555 124.2-107.7 -62.5 -10.0 49.4 116.4 226.3 48 48 A G T <5S+ 0 0 15 -4,-0.7 -3,-0.2 -3,-0.5 3,-0.1 0.923 84.6 119.6 84.8 47.1 47.8 118.9 228.7 49 49 A F S S-BC 2 62A 5 3,-1.5 3,-2.4 -2,-0.5 -57,-0.2 -0.756 80.6 -8.1 -93.0 129.1 42.5 109.8 226.4 60 60 A D T 3 S- 0 0 83 -59,-1.8 -1,-0.2 -2,-0.4 -58,-0.1 0.673 133.6 -59.8 61.2 14.4 41.8 106.1 227.0 61 61 A G T 3 S+ 0 0 60 -60,-1.0 2,-0.5 -3,-0.5 -1,-0.3 0.609 109.6 127.8 88.0 14.2 38.2 107.5 227.3 62 62 A K E < -C 59 0A 134 -3,-2.4 -3,-1.5 -61,-0.2 2,-1.0 -0.898 64.2-125.1-106.5 127.7 39.1 109.8 230.3 63 63 A D E +C 58 0A 72 -2,-0.5 -5,-0.2 -5,-0.2 3,-0.2 -0.594 45.8 157.1 -71.1 106.2 38.1 113.5 230.1 64 64 A V > + 0 0 4 -7,-2.7 3,-3.7 -2,-1.0 -1,-0.2 0.481 32.8 111.8-110.6 -5.9 41.6 115.1 230.7 65 65 A T T 3 S+ 0 0 10 -8,-1.1 -1,-0.1 1,-0.3 -7,-0.1 0.690 92.4 34.0 -41.4 -26.1 41.1 118.5 229.1 66 66 A D T 3 S+ 0 0 93 -3,-0.2 -1,-0.3 -9,-0.2 2,-0.1 0.031 105.5 87.4-121.2 22.7 41.3 120.0 232.6 67 67 A L S < S- 0 0 78 -3,-3.7 -3,-0.1 1,-0.0 3,-0.0 -0.279 78.2 -91.8-105.2-164.5 43.8 117.6 234.3 68 68 A S >> - 0 0 40 -2,-0.1 4,-1.8 1,-0.1 3,-1.3 -0.853 27.2-111.6-117.6 154.5 47.6 117.7 234.4 69 69 A P H 3>>S+ 0 0 4 0, 0.0 4,-0.7 0, 0.0 5,-0.5 0.813 117.9 54.3 -43.3 -47.3 50.3 116.1 232.2 70 70 A E H 345S+ 0 0 41 1,-0.2 3,-0.3 2,-0.2 792,-0.1 0.842 113.1 45.2 -61.0 -34.2 51.4 113.7 234.9 71 71 A K H <45S+ 0 0 150 -3,-1.3 -1,-0.2 1,-0.2 791,-0.0 0.771 96.5 69.6 -81.0 -29.6 47.8 112.5 235.1 72 72 A H H <5S- 0 0 12 -4,-1.8 -1,-0.2 -25,-0.2 -2,-0.2 0.739 92.3-150.1 -59.4 -21.2 47.2 112.3 231.3 73 73 A D T <5 + 0 0 75 -4,-0.7 74,-0.4 -3,-0.3 75,-0.4 0.939 41.6 140.2 47.3 64.7 49.6 109.3 231.6 74 74 A I < - 0 0 4 -5,-0.5 2,-0.4 788,-0.5 75,-0.2 -0.475 56.2-114.8-120.1-170.5 51.1 109.6 228.2 75 75 A A E -f 149 0B 0 73,-1.0 75,-2.7 -2,-0.2 2,-0.4 -0.997 33.8-175.1-129.8 126.4 54.4 109.3 226.3 76 76 A F E +f 150 0B 15 -2,-0.4 2,-0.5 73,-0.2 75,-0.2 -0.971 11.3 179.6-134.0 121.8 55.6 112.6 224.7 77 77 A V E -f 151 0B 8 73,-1.8 75,-1.4 -2,-0.4 4,-0.1 -0.843 16.5-151.8-127.0 98.5 58.6 113.0 222.5 78 78 A Y > - 0 0 5 -2,-0.5 3,-0.6 2,-0.2 59,-0.0 -0.041 33.0-105.8 -54.2 165.9 59.4 116.5 221.3 79 79 A Q T 3 S+ 0 0 49 1,-0.3 2,-1.2 2,-0.1 -1,-0.1 0.922 121.9 49.3 -62.5 -43.4 61.2 116.9 218.0 80 80 A N T 3 S- 0 0 99 53,-0.0 -1,-0.3 2,-0.0 -2,-0.2 -0.582 108.7-124.0 -95.8 66.5 64.3 117.9 219.8 81 81 A Y < - 0 0 34 -2,-1.2 2,-2.6 -3,-0.6 -2,-0.1 0.289 19.0-137.8 -14.2 100.2 64.2 115.0 222.3 82 82 A S + 0 0 15 773,-0.1 -1,-0.2 52,-0.0 2,-0.1 -0.341 33.5 175.4 -74.3 66.0 64.3 116.9 225.6 83 83 A L - 0 0 12 -2,-2.6 773,-0.1 -3,-0.1 54,-0.0 -0.416 38.3-110.8 -72.5 145.5 66.7 114.7 227.4 84 84 A F > - 0 0 0 1,-0.1 3,-0.8 5,-0.1 -1,-0.1 -0.708 25.6-156.2 -80.6 110.8 67.8 115.8 230.9 85 85 A P T 3 S+ 0 0 56 0, 0.0 41,-0.2 0, 0.0 -1,-0.1 0.542 84.9 62.5 -63.4 -13.9 71.6 116.8 230.5 86 86 A H T 3 S+ 0 0 65 1,-0.1 2,-0.3 39,-0.1 -2,-0.0 -0.107 97.1 66.2-106.3 36.1 72.5 116.3 234.2 87 87 A M S < S- 0 0 16 -3,-0.8 5,-0.2 36,-0.0 -1,-0.1 -0.896 83.1-119.1-156.4 122.4 71.7 112.5 234.2 88 88 A N >> - 0 0 22 -2,-0.3 4,-1.5 36,-0.2 3,-0.8 -0.278 48.6 -92.7 -58.8 149.7 73.4 109.7 232.3 89 89 A V H >> S+ 0 0 0 34,-2.3 4,-2.0 31,-0.3 3,-1.1 0.802 127.3 52.6 -27.1 -64.6 71.0 107.9 230.0 90 90 A K H 3> S+ 0 0 96 31,-2.6 4,-2.7 1,-0.3 -1,-0.3 0.910 105.0 54.7 -42.8 -56.3 70.0 105.3 232.6 91 91 A K H <> S+ 0 0 95 -3,-0.8 4,-2.1 30,-0.3 -1,-0.3 0.849 107.7 52.4 -49.6 -37.1 69.1 108.0 235.1 92 92 A N H X S+ 0 0 0 -4,-2.0 4,-0.7 1,-0.2 3,-0.5 0.897 111.0 53.8 -43.5 -51.0 65.0 106.2 231.9 94 94 A E H >X S+ 0 0 45 -4,-2.7 4,-1.6 1,-0.2 3,-1.5 0.886 90.3 77.5 -50.6 -51.2 64.7 105.8 235.7 95 95 A F H 3X S+ 0 0 2 -4,-2.1 4,-2.5 -3,-0.4 -1,-0.2 0.801 91.0 50.9 -28.7 -63.4 63.1 109.2 236.1 96 96 A G H + 0 0 78 1,-0.2 4,-0.9 3,-0.1 -7,-0.0 0.056 29.5 179.5 -41.3 107.8 60.9 96.7 238.2 105 105 A P H > S+ 0 0 89 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.609 83.7 69.7 -81.2 -11.2 64.5 97.0 236.9 106 106 A K H > S+ 0 0 145 2,-0.2 4,-4.0 1,-0.2 5,-0.4 0.992 94.6 52.1 -64.6 -57.9 63.4 94.4 234.3 107 107 A R H > S+ 0 0 75 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.852 113.7 46.1 -42.9 -43.6 61.2 97.0 232.6 108 108 A V H X S+ 0 0 10 -4,-0.9 4,-2.8 2,-0.2 -1,-0.2 0.960 116.0 40.6 -69.7 -52.1 64.2 99.4 232.5 109 109 A L H X S+ 0 0 84 -4,-2.7 4,-1.2 1,-0.2 -2,-0.2 0.883 120.8 47.0 -65.8 -33.7 66.8 96.9 231.2 110 110 A D H X S+ 0 0 61 -4,-4.0 4,-2.9 -5,-0.2 -2,-0.2 0.886 112.1 48.0 -71.9 -41.5 64.2 95.4 228.8 111 111 A T H X S+ 0 0 7 -4,-2.5 4,-1.3 -5,-0.4 -2,-0.2 0.937 110.4 53.9 -63.1 -43.5 63.1 98.9 227.6 112 112 A A H <>S+ 0 0 1 -4,-2.8 5,-3.1 1,-0.2 6,-0.7 0.811 111.4 45.7 -58.6 -34.0 66.8 99.7 227.1 113 113 A R H ><5S+ 0 0 137 -4,-1.2 3,-3.8 3,-0.2 -2,-0.2 0.954 103.2 61.4 -73.4 -55.1 67.1 96.6 225.0 114 114 A D H 3<5S+ 0 0 89 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.771 113.3 38.7 -42.2 -33.2 64.0 97.2 222.9 115 115 A L T 3<5S- 0 0 4 -4,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.232 111.2-120.0-106.1 14.1 65.6 100.4 221.7 116 116 A K T < 5S+ 0 0 153 -3,-3.8 -3,-0.2 -5,-0.1 3,-0.1 0.866 75.2 125.4 51.6 44.4 69.1 99.0 221.4 117 117 A I >>< + 0 0 2 -5,-3.1 3,-3.1 -6,-0.1 4,-1.5 0.465 26.8 108.9-109.4 -2.8 70.6 101.5 224.0 118 118 A E T 34 S+ 0 0 111 -6,-0.7 3,-0.5 1,-0.3 4,-0.2 0.848 80.0 54.3 -38.6 -47.1 72.2 99.1 226.4 119 119 A H T 34 S+ 0 0 138 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.628 113.6 40.8 -66.5 -15.5 75.7 100.2 225.2 120 120 A L T X4 S+ 0 0 3 -3,-3.1 3,-1.7 1,-0.1 -31,-0.3 0.540 79.0 109.7-106.5 -14.9 74.9 103.9 225.9 121 121 A L T 3< S+ 0 0 34 -4,-1.5 -31,-2.6 -3,-0.5 -30,-0.3 0.658 86.9 40.8 -33.3 -27.8 73.1 103.4 229.2 122 122 A D T 3 S+ 0 0 132 -4,-0.2 -1,-0.3 -33,-0.2 -2,-0.1 0.722 93.4 97.0-100.2 -27.5 76.1 105.0 230.9 123 123 A R S < S- 0 0 96 -3,-1.7 -34,-2.3 -35,-0.1 -33,-0.2 -0.070 77.9-103.8 -63.6 165.1 77.0 107.9 228.6 124 124 A N > - 0 0 99 -36,-0.2 3,-3.2 1,-0.1 4,-0.4 -0.845 30.8-114.4 -99.1 122.0 75.9 111.5 229.1 125 125 A P G > S+ 0 0 3 0, 0.0 3,-0.7 0, 0.0 -1,-0.1 0.530 109.7 60.9 -20.1 -36.1 73.0 112.9 226.9 126 126 A L G 3 S+ 0 0 152 1,-0.2 7,-0.0 -41,-0.2 -3,-0.0 0.659 97.3 56.0 -78.9 -15.6 75.2 115.5 225.1 127 127 A T G < S+ 0 0 89 -3,-3.2 -1,-0.2 2,-0.1 2,-0.2 0.497 91.2 98.1 -91.9 -2.4 77.7 112.9 223.6 128 128 A L S < S- 0 0 9 -3,-0.7 2,-0.1 -4,-0.4 3,-0.0 -0.535 70.7-127.1 -86.5 149.4 74.8 111.1 221.9 129 129 A S > - 0 0 66 -2,-0.2 4,-3.7 4,-0.0 5,-0.3 -0.351 40.2 -83.7 -87.3 172.4 73.8 111.5 218.2 130 130 A G H > S+ 0 0 30 1,-0.2 4,-3.7 2,-0.2 5,-0.2 0.906 129.9 35.0 -37.8 -73.8 70.3 112.3 217.0 131 131 A G H > S+ 0 0 10 1,-0.2 4,-3.8 2,-0.2 5,-0.3 0.919 115.4 56.5 -50.0 -52.5 69.0 108.8 216.9 132 132 A E H > S+ 0 0 46 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.925 115.1 39.6 -46.9 -49.4 71.0 107.8 220.0 133 133 A Q H X S+ 0 0 44 -4,-3.7 4,-3.0 1,-0.2 -2,-0.2 0.976 114.6 52.4 -64.4 -53.8 69.2 110.7 221.8 134 134 A Q H X S+ 0 0 5 -4,-3.7 4,-2.8 -5,-0.3 -2,-0.2 0.836 111.1 48.0 -48.8 -40.8 65.9 110.0 220.1 135 135 A R H X S+ 0 0 59 -4,-3.8 4,-3.7 2,-0.2 -1,-0.2 0.977 110.7 49.0 -64.0 -58.2 66.0 106.4 221.3 136 136 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.3 5,-0.3 0.878 112.3 53.4 -47.6 -40.2 67.0 107.3 224.8 137 137 A A H X S+ 0 0 3 -4,-3.0 4,-2.8 2,-0.2 5,-0.3 0.989 111.1 40.9 -57.5 -66.4 64.0 109.7 224.5 138 138 A L H X S+ 0 0 2 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.835 111.8 63.7 -50.9 -36.0 61.5 107.0 223.4 139 139 A A H >< S+ 0 0 0 -4,-3.7 3,-0.9 2,-0.2 -2,-0.2 0.984 111.4 30.0 -54.7 -68.2 63.1 104.8 226.0 140 140 A R H >X S+ 0 0 12 -4,-2.3 3,-1.0 1,-0.3 4,-0.5 0.796 116.7 60.0 -65.3 -29.8 62.3 106.9 229.1 141 141 A A H 3< S+ 0 0 2 -4,-2.8 -1,-0.3 -5,-0.3 -2,-0.2 0.810 113.5 38.3 -67.0 -27.7 59.1 108.1 227.5 142 142 A L T << S+ 0 0 10 -4,-1.8 -1,-0.2 -3,-0.9 -2,-0.2 0.110 89.4 89.7-109.8 19.8 57.9 104.5 227.2 143 143 A V T <4 S+ 0 0 2 -3,-1.0 -1,-0.1 1,-0.2 -2,-0.1 0.847 84.3 56.9 -83.4 -34.0 59.2 103.0 230.5 144 144 A T S < S- 0 0 22 -4,-0.5 -1,-0.2 -3,-0.1 -2,-0.1 0.486 110.8-134.2 -70.1 -2.4 56.0 103.9 232.4 145 145 A N + 0 0 74 -3,-0.2 -3,-0.1 1,-0.1 -2,-0.1 0.939 36.0 177.4 44.9 69.3 54.5 101.8 229.5 146 146 A P - 0 0 4 0, 0.0 -72,-0.1 0, 0.0 3,-0.1 -0.279 32.3-135.3 -86.2-176.1 51.6 103.9 228.5 147 147 A K S S+ 0 0 124 -74,-0.4 33,-2.5 1,-0.1 2,-0.6 0.728 85.8 70.4-106.1 -33.1 49.4 103.0 225.6 148 148 A I E - g 0 180B 9 -75,-0.4 -73,-1.0 31,-0.2 2,-0.6 -0.787 61.3-171.6 -93.1 117.7 49.2 106.5 223.9 149 149 A L E -fg 75 181B 2 31,-1.8 33,-1.7 -2,-0.6 2,-0.6 -0.909 4.1-165.0-113.2 104.2 52.5 107.7 222.3 150 150 A L E +fg 76 182B 0 -75,-2.7 -73,-1.8 -2,-0.6 2,-0.4 -0.790 15.1 176.9 -89.2 119.9 52.4 111.3 221.1 151 151 A L E -fg 77 183B 3 31,-2.2 33,-1.5 -2,-0.6 2,-0.4 -0.939 14.6-161.2-124.9 147.5 55.2 112.2 218.7 152 152 A D E - g 0 184B 3 -75,-1.4 33,-0.2 -2,-0.4 31,-0.1 -0.996 69.6 -26.0-132.5 132.9 56.0 115.3 216.8 153 153 A E S S+ 0 0 11 31,-2.5 4,-0.3 -2,-0.4 -1,-0.1 0.802 74.5 159.5 33.3 56.3 58.3 115.6 213.8 154 154 A P S S+ 0 0 7 0, 0.0 -1,-0.2 0, 0.0 31,-0.1 0.704 70.5 27.7 -75.5 -18.4 60.3 112.5 214.8 155 155 A L S > S+ 0 0 0 2,-0.1 3,-1.3 1,-0.1 8,-0.1 0.880 97.5 69.5-109.0 -63.5 61.5 112.0 211.3 156 156 A S T 3 S+ 0 0 34 1,-0.3 -1,-0.1 31,-0.1 -3,-0.0 0.613 98.3 60.3 -36.9 -22.5 61.9 115.0 208.9 157 157 A A T 3 S+ 0 0 61 -4,-0.3 -1,-0.3 2,-0.1 2,-0.3 -0.016 88.8 88.8-102.0 31.9 64.9 116.3 211.0 158 158 A L S < S- 0 0 22 -3,-1.3 -3,-0.0 -28,-0.0 3,-0.0 -0.791 88.2 -87.3-123.9 165.1 67.3 113.4 210.7 159 159 A D >> - 0 0 111 -2,-0.3 3,-3.2 1,-0.2 4,-1.7 -0.516 40.8-121.9 -67.7 135.8 70.0 112.3 208.2 160 160 A P H 3> S+ 0 0 100 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.891 112.1 72.6 -46.5 -33.8 68.3 110.4 205.5 161 161 A R H 34 S+ 0 0 228 1,-0.2 4,-0.4 2,-0.2 -2,-0.0 0.720 105.4 34.0 -51.6 -27.5 70.7 107.7 206.6 162 162 A T H <> S+ 0 0 41 -3,-3.2 4,-4.0 2,-0.1 5,-0.3 0.733 99.1 80.4-100.4 -30.2 68.7 107.2 209.8 163 163 A Q H X S+ 0 0 30 -4,-1.7 4,-3.2 1,-0.2 5,-0.2 0.894 91.6 51.5 -44.6 -51.4 65.2 107.8 208.5 164 164 A E H X S+ 0 0 50 -4,-1.2 4,-1.7 2,-0.2 -1,-0.2 0.971 119.1 35.3 -51.7 -61.0 64.9 104.4 207.0 165 165 A N H > S+ 0 0 77 -4,-0.4 4,-2.4 1,-0.2 3,-0.5 0.952 114.9 58.8 -55.3 -52.7 65.8 102.6 210.3 166 166 A A H X S+ 0 0 4 -4,-4.0 4,-2.0 1,-0.3 -1,-0.2 0.888 103.4 51.5 -41.2 -55.1 64.1 105.3 212.3 167 167 A R H X S+ 0 0 10 -4,-3.2 4,-2.9 -5,-0.3 -1,-0.3 0.901 111.6 48.0 -52.6 -45.6 60.8 104.5 210.6 168 168 A E H X S+ 0 0 121 -4,-1.7 4,-3.3 -3,-0.5 5,-0.3 0.994 105.1 56.8 -58.3 -65.3 61.2 100.9 211.4 169 169 A M H X S+ 0 0 13 -4,-2.4 4,-2.2 1,-0.3 -1,-0.2 0.797 114.6 41.5 -30.3 -49.0 62.1 101.5 215.1 170 170 A L H X S+ 0 0 5 -4,-2.0 4,-2.9 -5,-0.2 -1,-0.3 0.950 111.5 50.9 -69.0 -56.6 58.8 103.3 215.3 171 171 A S H X S+ 0 0 63 -4,-2.9 4,-1.4 1,-0.2 -2,-0.2 0.932 112.3 52.1 -48.6 -46.6 56.7 100.9 213.3 172 172 A V H >X S+ 0 0 54 -4,-3.3 4,-1.8 1,-0.2 3,-0.8 0.956 109.7 45.7 -54.8 -57.6 58.1 98.2 215.5 173 173 A L H 3X S+ 0 0 7 -4,-2.2 4,-1.0 -5,-0.3 6,-0.6 0.851 103.3 67.1 -56.0 -34.4 57.2 100.0 218.8 174 174 A H H 3<>S+ 0 0 9 -4,-2.9 5,-2.1 4,-0.1 -1,-0.3 0.919 116.7 23.5 -51.1 -47.9 53.8 100.6 217.3 175 175 A K H X<5S+ 0 0 130 -4,-1.4 3,-3.1 -3,-0.8 -2,-0.2 0.962 117.2 55.7 -82.9 -69.1 53.1 96.9 217.4 176 176 A K H 3<5S+ 0 0 162 -4,-1.8 -3,-0.2 1,-0.3 -2,-0.1 0.537 122.9 33.3 -47.0 -5.9 55.3 95.3 220.1 177 177 A N T 3<5S- 0 0 27 -4,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.369 105.7-128.0-126.6 -7.1 53.8 97.8 222.6 178 178 A K T < 5 - 0 0 166 -3,-3.1 -152,-0.2 -5,-0.2 -3,-0.2 0.942 46.6-177.2 56.9 47.9 50.4 97.9 221.0 179 179 A L < - 0 0 0 -5,-2.1 2,-0.7 -6,-0.6 -31,-0.2 -0.391 34.0-142.6 -79.7 154.5 50.7 101.6 220.9 180 180 A T E - g 0 148B 2 -33,-2.5 -31,-1.8 -154,-0.1 2,-0.4 -0.957 32.5-163.7-115.0 100.7 48.2 104.1 219.7 181 181 A V E -dg 28 149B 2 -154,-0.8 -152,-1.9 -2,-0.7 2,-0.7 -0.783 19.9-161.9 -99.7 134.7 50.4 106.7 218.1 182 182 A L E -dg 29 150B 4 -33,-1.7 -31,-2.2 -2,-0.4 2,-0.6 -0.941 19.2-171.2-111.3 105.0 49.5 110.3 217.2 183 183 A H E -dg 30 151B 2 -154,-3.4 -152,-2.0 -2,-0.7 2,-0.5 -0.887 7.8-167.9-106.5 117.4 52.1 111.5 214.6 184 184 A I E +dg 31 152B 0 -33,-1.5 -31,-2.5 -2,-0.6 2,-0.3 -0.915 22.8 147.5-108.3 120.9 52.2 115.1 213.5 185 185 A T E -d 32 0B 0 -154,-2.1 -152,-1.2 -2,-0.5 -2,-0.0 -0.906 47.4-146.3-143.6 166.8 54.4 116.0 210.5 186 186 A H S S+ 0 0 84 -2,-0.3 2,-0.8 -154,-0.2 3,-0.1 0.354 80.3 95.3-112.3 -2.0 54.5 118.4 207.5 187 187 A D > - 0 0 43 1,-0.2 4,-2.6 2,-0.0 -31,-0.1 -0.831 55.3-170.7 -94.9 107.5 56.1 115.7 205.4 188 188 A Q H > S+ 0 0 47 -2,-0.8 4,-3.1 1,-0.2 -1,-0.2 0.804 87.0 58.0 -66.7 -32.4 53.4 114.1 203.4 189 189 A T H > S+ 0 0 37 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.882 109.3 44.7 -65.7 -37.8 55.8 111.4 202.2 190 190 A E H > S+ 0 0 9 2,-0.2 4,-1.7 1,-0.2 5,-0.2 0.959 111.1 55.6 -68.0 -49.7 56.5 110.5 205.9 191 191 A A H >X S+ 0 0 1 -4,-2.6 4,-1.9 2,-0.2 3,-0.6 0.923 110.3 44.1 -46.8 -57.0 52.8 110.7 206.5 192 192 A R H >< S+ 0 0 28 -4,-3.1 3,-1.3 1,-0.2 -2,-0.2 0.981 109.3 54.4 -51.2 -72.9 52.0 108.1 203.8 193 193 A I H 3< S+ 0 0 18 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.671 124.3 23.5 -35.6 -30.9 54.7 105.7 204.6 194 194 A M H << S+ 0 0 20 -4,-1.7 -1,-0.2 -3,-0.6 -2,-0.2 0.524 93.7 108.5-123.7 -0.9 53.6 105.4 208.3 195 195 A A << - 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0 0 39 0, 0.0 4,-2.5 0, 0.0 3,-0.2 -0.242 38.9 -95.9 -63.7 158.0 54.5 117.2 239.6 867 181 C L H > S+ 0 0 18 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.869 124.2 45.3 -47.7 -49.0 55.7 120.8 239.1 868 182 C W H > S+ 0 0 134 2,-0.2 4,-4.0 1,-0.2 5,-0.3 0.914 110.9 52.1 -65.6 -40.0 57.9 120.9 242.2 869 183 C K H > S+ 0 0 35 -3,-0.2 4,-3.2 2,-0.2 5,-0.4 0.905 113.5 47.9 -59.7 -36.3 59.4 117.5 241.5 870 184 C A H X>S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-1.0 0.968 114.6 43.4 -63.5 -56.4 60.1 119.0 238.0 871 185 C F H <>S+ 0 0 21 -4,-3.3 5,-3.4 3,-0.2 -2,-0.2 0.887 119.5 45.2 -57.3 -42.6 61.6 122.2 239.5 872 186 C F H <5S+ 0 0 113 -4,-4.0 -2,-0.2 -5,-0.2 -3,-0.2 0.963 121.2 32.9 -71.0 -52.9 63.5 120.3 242.1 873 187 C F H <5S+ 0 0 73 -4,-3.2 -2,-0.2 -5,-0.3 -3,-0.2 0.754 138.1 9.5 -78.6 -23.0 65.0 117.4 240.0 874 188 C V T X5S+ 0 0 0 -4,-2.6 4,-2.0 -5,-0.4 5,-0.3 0.679 123.3 43.8-117.0 -78.9 65.4 119.4 236.8 875 189 C T H >> S+ 0 0 217 -4,-0.3 4,-1.4 1,-0.3 -1,-0.3 0.793 111.0 45.2 -40.2 -34.8 75.5 127.7 238.3 882 196 C Y H <> S+ 0 0 94 -3,-1.6 4,-2.7 2,-0.2 -1,-0.3 0.929 112.5 48.2 -77.7 -44.9 73.4 130.9 238.1 883 197 C L H X S+ 0 0 18 -4,-1.8 4,-2.4 -3,-0.3 -2,-0.2 0.896 110.3 53.7 -60.3 -41.9 72.0 130.7 241.6 884 198 C L H X S+ 0 0 111 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.949 111.5 43.5 -59.4 -51.5 75.5 130.1 243.0 885 199 C I H X S+ 0 0 90 -4,-1.4 4,-3.0 -5,-0.3 5,-0.3 0.971 114.4 50.4 -58.8 -53.6 77.0 133.1 241.4 886 200 C G H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.838 108.3 52.1 -54.0 -38.3 74.0 135.3 242.3 887 201 C S H X S+ 0 0 19 -4,-2.4 4,-3.1 2,-0.2 -1,-0.2 0.975 113.7 43.5 -63.0 -53.1 74.1 134.3 245.9 888 202 C V H X S+ 0 0 25 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.855 111.1 53.4 -60.9 -38.3 77.7 135.1 246.2 889 203 C M H X S+ 0 0 59 -4,-3.0 4,-1.2 -5,-0.2 -1,-0.2 0.930 112.7 47.8 -61.6 -42.1 77.3 138.4 244.2 890 204 C T H >X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.3 3,-2.0 0.987 106.1 54.8 -58.4 -62.0 74.6 139.1 246.8 891 205 C W H 3X S+ 0 0 53 -4,-3.1 4,-2.5 1,-0.3 -1,-0.2 0.803 111.5 47.5 -41.9 -36.2 76.7 138.2 249.8 892 206 C A H 3X S+ 0 0 13 -4,-1.7 4,-1.0 2,-0.2 -1,-0.3 0.728 106.6 53.0 -83.7 -22.7 79.2 140.7 248.5 893 207 C R H << S+ 0 0 7 -3,-2.0 -2,-0.2 -4,-1.2 -1,-0.2 0.736 114.8 46.9 -80.0 -21.0 76.8 143.6 247.9 894 208 C A H >< S+ 0 0 0 -4,-2.1 3,-3.5 -5,-0.2 -2,-0.2 0.966 106.1 53.3 -78.2 -62.8 75.8 143.0 251.4 895 209 C I H 3< S+ 0 0 3 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.1 0.816 112.2 49.4 -40.9 -38.8 79.2 142.8 253.1 896 210 C S T 3< S+ 0 0 2 -4,-1.0 148,-1.6 -5,-0.1 2,-0.5 0.290 81.7 118.9 -90.9 10.8 80.0 146.1 251.5 897 211 C E < + 0 0 1 -3,-3.5 16,-0.2 146,-0.2 -64,-0.1 -0.682 24.6 150.9 -85.3 128.2 76.9 148.1 252.5 898 212 C F >> + 0 0 0 -2,-0.5 4,-2.2 14,-0.1 3,-1.4 0.650 61.8 42.2-113.3 -91.4 77.4 151.2 254.6 899 213 C G H 3> S+ 0 0 1 1,-0.3 4,-1.4 2,-0.2 -2,-0.1 0.803 114.1 53.9 -28.5 -57.4 75.0 154.1 254.5 900 214 C A H 3> S+ 0 0 0 1,-0.2 4,-0.9 2,-0.2 -1,-0.3 0.904 116.5 37.3 -50.5 -47.9 72.0 151.9 254.4 901 215 C V H <> S+ 0 0 1 -3,-1.4 4,-2.9 2,-0.2 3,-0.4 0.932 105.0 66.0 -73.8 -48.0 73.0 150.0 257.5 902 216 C V H X S+ 0 0 4 -4,-2.2 4,-1.6 1,-0.2 5,-0.2 0.896 101.3 50.2 -38.7 -59.1 74.5 152.9 259.5 903 217 C I H < S+ 0 0 4 -4,-1.4 -1,-0.2 2,-0.2 3,-0.2 0.881 119.7 34.6 -52.6 -46.8 71.1 154.7 259.9 904 218 C L H < S+ 0 0 1 -4,-0.9 -80,-1.0 -3,-0.4 -2,-0.2 0.972 142.9 0.4 -76.9 -51.9 69.2 151.6 261.1 905 219 C A H < + 0 0 0 -4,-2.9 -2,-0.2 -82,-0.2 -3,-0.2 -0.395 65.8 159.5-139.0 64.7 71.9 149.8 263.1 906 220 C Y >< + 0 0 36 -4,-1.6 3,-0.9 1,-0.2 4,-0.4 0.843 65.2 67.1 -51.6 -35.5 75.2 151.7 263.1 907 221 C Y T 3 S+ 0 0 134 1,-0.3 -1,-0.2 -5,-0.2 -82,-0.1 0.726 71.0 68.0 -79.1 -27.6 76.3 150.0 266.2 908 222 C P T 3 S- 0 0 51 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.530 105.8-128.3 -69.6 23.6 77.1 146.5 266.1 909 223 C M < - 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0 0 1 0, 0.0 4,-2.1 0, 0.0 5,-0.3 -0.051 26.4-115.9 -37.8 131.2 82.6 148.3 250.3 1044 109 D H H > S+ 0 0 5 -148,-1.6 4,-1.4 1,-0.2 -147,-0.1 0.841 113.8 47.8 -37.1 -57.3 81.6 152.0 250.1 1045 110 D T H >> S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 3,-1.4 0.957 108.9 53.6 -49.5 -62.2 83.9 153.0 253.0 1046 111 D V H 3> S+ 0 0 0 1,-0.3 4,-3.3 2,-0.2 5,-0.2 0.854 105.7 54.0 -40.5 -50.2 86.9 151.1 251.6 1047 112 D A H 3X S+ 0 0 1 -4,-2.1 4,-2.8 -5,-0.2 -1,-0.3 0.839 108.4 50.5 -58.2 -36.0 86.5 153.0 248.3 1048 113 D G H X S+ 0 0 0 -4,-2.8 4,-2.7 -5,-0.2 3,-1.9 0.900 107.7 54.7 -54.0 -44.4 90.4 157.0 247.0 1052 117 D L H 3X S+ 0 0 3 -4,-3.0 4,-2.7 -3,-0.4 -1,-0.2 0.909 96.8 66.0 -54.8 -45.0 91.8 159.3 249.7 1053 118 D T H 3< S+ 0 0 2 -4,-2.2 7,-1.3 -5,-0.2 -1,-0.3 0.624 115.4 28.9 -53.0 -15.6 95.1 157.5 249.4 1054 119 D V H <4 S+ 0 0 4 -3,-1.9 8,-2.8 -4,-0.4 7,-1.2 0.747 131.1 29.8-116.5 -42.4 95.3 158.9 245.9 1055 120 D F H < S+ 0 0 14 -4,-2.7 17,-0.5 6,-0.2 16,-0.3 0.408 94.4 111.1-101.5 2.3 93.5 162.2 245.8 1056 121 D G S >< S- 0 0 3 -4,-2.7 3,-3.5 -5,-0.4 6,-0.3 -0.437 89.4-102.8 -74.4 150.5 94.1 163.0 249.4 1057 122 D S T 3 S+ 0 0 69 1,-0.3 -1,-0.1 5,-0.1 9,-0.1 0.685 126.3 40.7 -45.3 -20.7 96.5 165.9 250.1 1058 123 D R T 3 S+ 0 0 90 -6,-0.2 -1,-0.3 5,-0.0 2,-0.2 0.086 101.1 102.0-117.9 22.5 99.1 163.2 251.0 1059 124 D G S <> S- 0 0 2 -3,-3.5 4,-2.8 -7,-0.1 -5,-0.3 -0.531 85.7 -87.1-107.5 172.5 98.3 160.8 248.2 1060 125 D L T 4 S+ 0 0 95 -7,-1.3 -6,-0.1 1,-0.2 -5,-0.1 0.863 123.4 14.0 -35.8 -64.9 99.8 159.7 244.8 1061 126 D I T 4 S+ 0 0 71 -7,-1.2 -6,-0.2 2,-0.1 -1,-0.2 0.733 125.7 58.0 -91.1 -25.9 98.0 162.2 242.7 1062 127 D G T >4 S+ 0 0 6 -8,-2.8 3,-0.6 -6,-0.3 -2,-0.2 0.861 102.2 53.8 -73.7 -36.9 96.8 164.6 245.3 1063 128 D E G >< S+ 0 0 109 -4,-2.8 3,-1.1 -9,-0.3 -2,-0.1 0.983 109.7 44.5 -62.4 -60.1 100.2 165.4 246.8 1064 129 D P G 3 S+ 0 0 88 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.467 112.3 56.4 -66.9 1.3 101.9 166.5 243.5 1065 130 D L G <> + 0 0 62 -3,-0.6 4,-1.2 -4,-0.2 -2,-0.1 -0.065 63.0 118.6-125.5 37.1 98.9 168.6 242.5 1066 131 D E T <4 S+ 0 0 143 -3,-1.1 -1,-0.1 1,-0.2 -3,-0.1 0.827 77.9 50.1 -68.6 -34.6 98.4 170.9 245.5 1067 132 D S T 4 S+ 0 0 101 -3,-0.1 -1,-0.2 1,-0.1 3,-0.1 0.877 116.5 36.5 -73.9 -41.7 99.0 174.0 243.4 1068 133 D Y T 4 S- 0 0 182 1,-0.3 2,-0.3 0, 0.0 -2,-0.1 0.989 127.3 -1.3 -77.4 -63.0 96.5 173.3 240.5 1069 134 D I < - 0 0 95 -4,-1.2 2,-0.3 -7,-0.1 -1,-0.3 -0.984 55.2-146.5-136.2 143.9 93.6 171.6 242.2 1070 135 D Q - 0 0 152 -2,-0.3 7,-0.2 1,-0.1 -14,-0.1 -0.823 14.2-178.7-103.8 144.8 92.6 170.5 245.8 1071 136 D F > + 0 0 33 -2,-0.3 3,-1.8 -16,-0.3 6,-0.6 0.835 49.2 87.6-108.5 -55.7 90.5 167.3 246.2 1072 137 D R T 3 S- 0 0 94 -17,-0.5 82,-0.2 1,-0.3 3,-0.1 -0.259 109.0 -2.3 -54.5 131.5 89.7 166.6 249.9 1073 138 D D T 3 S+ 0 0 82 80,-1.1 -1,-0.3 1,-0.2 2,-0.2 0.643 117.2 104.1 58.7 18.7 86.5 168.3 251.2 1074 139 D A S X> S- 0 0 16 -3,-1.8 4,-1.4 79,-0.1 3,-0.5 -0.711 86.9-100.7-121.4 174.1 86.1 170.0 247.8 1075 140 D L H >> S+ 0 0 56 1,-0.2 4,-2.6 -2,-0.2 3,-0.9 0.963 119.0 52.0 -58.3 -57.9 83.9 169.5 244.8 1076 141 D P H 3> S+ 0 0 35 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.719 105.2 61.0 -53.5 -20.4 86.5 167.6 242.6 1077 142 D G H <> S+ 0 0 0 -6,-0.6 4,-1.6 -3,-0.5 -2,-0.2 0.929 108.4 39.6 -72.5 -45.1 86.8 165.3 245.6 1078 143 D I H X S+ 0 0 2 -4,-2.9 4,-2.4 1,-0.2 3,-1.8 0.935 109.9 54.6 -48.6 -57.3 81.2 159.3 242.4 1083 148 D L H 3X S+ 0 0 6 -4,-2.6 4,-2.9 1,-0.3 3,-0.3 0.911 103.4 55.4 -43.7 -55.3 82.9 158.4 239.2 1084 149 D F H 3< S+ 0 0 0 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.758 117.4 36.9 -53.2 -25.4 84.7 155.5 240.9 1085 150 D V H << S+ 0 0 4 -3,-1.8 -1,-0.2 -4,-1.0 -2,-0.2 0.731 125.6 33.2-101.8 -24.7 81.4 154.1 241.9 1086 151 D S H >X S+ 0 0 0 -4,-2.4 3,-0.9 -3,-0.3 4,-0.9 0.647 92.7 87.0-105.8 -19.2 79.1 154.9 239.0 1087 152 D M H 3X S+ 0 0 0 -4,-2.9 4,-1.6 -5,-0.4 3,-0.3 0.884 79.3 65.0 -49.3 -48.4 81.5 154.6 236.0 1088 153 D P H 3> S+ 0 0 4 0, 0.0 4,-2.0 0, 0.0 5,-0.4 0.886 97.2 58.0 -45.7 -43.2 80.9 150.8 235.6 1089 154 D Y H <> S+ 0 0 41 -3,-0.9 4,-2.2 1,-0.3 5,-0.2 0.943 106.7 43.9 -55.1 -53.7 77.3 151.4 234.7 1090 155 D L H X S+ 0 0 0 -4,-0.9 4,-1.2 -3,-0.3 -1,-0.3 0.756 116.2 52.7 -66.2 -19.4 77.9 153.7 231.8 1091 156 D A H >X S+ 0 0 3 -4,-1.6 4,-1.9 -3,-0.4 3,-1.4 0.970 111.3 39.3 -75.4 -74.6 80.6 151.3 230.7 1092 157 D N H 3X S+ 0 0 61 -4,-2.0 4,-2.1 1,-0.3 5,-0.2 0.832 119.2 51.7 -42.3 -37.6 78.8 147.9 230.7 1093 158 D S H 3X S+ 0 0 28 -4,-2.2 4,-0.9 -5,-0.4 -1,-0.3 0.862 110.2 46.3 -72.1 -33.6 75.8 149.8 229.2 1094 159 D A H > - 0 0 69 -2,-0.6 3,-1.1 1,-0.1 4,-0.5 -0.428 12.9-114.0 -76.9 151.4 76.9 144.7 214.4 1103 168 D P H >> S+ 0 0 64 0, 0.0 3,-2.7 0, 0.0 4,-1.7 0.879 103.4 72.2 -44.2 -60.3 80.4 145.1 212.7 1104 169 D R H 3> S+ 0 0 61 1,-0.3 4,-3.9 2,-0.2 5,-0.2 0.757 92.6 57.7 -31.9 -44.5 79.2 144.9 209.0 1105 170 D L H <> S+ 0 0 18 -3,-1.1 4,-2.2 2,-0.2 -1,-0.3 0.906 108.9 45.4 -59.3 -39.8 77.6 148.3 209.2 1106 171 D E H <>S+ 0 0 0 -4,-2.2 5,-1.6 -5,-0.2 3,-0.8 0.924 110.3 57.0 -64.4 -43.9 80.6 152.5 205.7 1110 175 D R H ><5S+ 0 0 47 -4,-2.7 3,-2.3 1,-0.3 4,-0.4 0.943 106.9 46.5 -50.7 -57.2 84.4 151.9 205.6 1111 176 D S H 3<5S+ 0 0 3 -4,-2.4 -688,-0.4 1,-0.3 -1,-0.3 0.659 104.1 62.9 -63.2 -16.9 84.3 150.5 202.0 1112 177 D L T <<5S- 0 0 8 -3,-0.8 -1,-0.3 -4,-0.8 -2,-0.2 0.478 133.7 -88.8 -85.5 -2.1 82.0 153.4 201.0 1113 178 D G T < 5S+ 0 0 9 -3,-2.3 -3,-0.2 -4,-0.3 -2,-0.2 0.636 81.9 137.2 106.8 20.9 84.9 155.6 201.9 1114 179 D A < - 0 0 0 -5,-1.6 -1,-0.2 -4,-0.4 -695,-0.1 -0.874 47.6-131.7-107.9 126.4 84.5 156.4 205.6 1115 180 D P > - 0 0 39 0, 0.0 4,-2.5 0, 0.0 3,-0.2 -0.240 38.8 -96.0 -63.7 158.1 87.4 156.5 208.0 1116 181 D L H > S+ 0 0 16 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.873 124.2 45.4 -47.3 -49.6 86.9 154.6 211.3 1117 182 D W H > S+ 0 0 134 2,-0.2 4,-4.0 1,-0.2 5,-0.3 0.913 110.9 52.0 -65.3 -39.8 85.8 157.6 213.3 1118 183 D K H > S+ 0 0 40 -3,-0.2 4,-3.2 2,-0.2 5,-0.4 0.903 113.5 48.0 -60.1 -36.1 83.5 158.9 210.6 1119 184 D A H X>S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-1.0 0.967 114.5 43.3 -63.6 -56.5 82.1 155.4 210.7 1120 185 D F H <>S+ 0 0 24 -4,-3.3 5,-3.5 3,-0.2 -2,-0.2 0.885 119.5 45.3 -57.3 -42.5 81.8 155.4 214.5 1121 186 D F H <5S+ 0 0 117 -4,-4.0 -2,-0.2 -5,-0.2 -3,-0.2 0.961 121.1 32.9 -71.0 -53.1 80.4 158.9 214.4 1122 187 D F H <5S+ 0 0 90 -4,-3.2 -2,-0.2 -5,-0.3 -3,-0.2 0.760 138.1 9.6 -78.5 -23.3 77.9 158.7 211.7 1123 188 D V T X5S+ 0 0 1 -4,-2.6 4,-2.0 -5,-0.4 5,-0.3 0.689 123.3 43.7-116.8 -78.6 76.8 155.2 212.2 1124 189 D T H >> S+ 0 0 217 -4,-0.3 4,-1.4 1,-0.3 -1,-0.3 0.796 111.0 45.2 -40.2 -34.8 69.5 154.5 223.1 1131 196 D Y H <> S+ 0 0 97 -3,-1.6 4,-2.7 2,-0.2 -1,-0.3 0.931 112.4 48.2 -77.7 -44.7 72.0 152.5 225.1 1132 197 D L H X S+ 0 0 20 -4,-1.9 4,-2.4 -3,-0.3 -2,-0.2 0.898 110.2 53.9 -60.5 -41.9 74.4 155.3 225.9 1133 198 D L H X S+ 0 0 108 -4,-3.0 4,-2.1 -5,-0.2 -1,-0.2 0.944 111.4 43.3 -58.9 -51.3 71.5 157.5 227.1 1134 199 D I H X S+ 0 0 90 -4,-1.4 4,-3.0 -5,-0.3 5,-0.3 0.968 114.4 50.6 -59.3 -53.0 70.2 155.0 229.5 1135 200 D G H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.841 108.3 51.9 -54.5 -38.6 73.7 154.1 230.8 1136 201 D S H X S+ 0 0 19 -4,-2.4 4,-3.1 2,-0.2 -1,-0.2 0.976 113.8 43.5 -62.8 -53.4 74.6 157.8 231.4 1137 202 D V H X S+ 0 0 27 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.852 111.2 53.3 -60.6 -37.8 71.4 158.3 233.4 1138 203 D M H X S+ 0 0 59 -4,-3.0 4,-1.2 2,-0.2 -1,-0.2 0.929 112.6 47.7 -62.2 -42.0 71.8 155.0 235.3 1139 204 D T H >X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.3 3,-1.9 0.987 106.3 54.7 -58.7 -61.5 75.3 156.4 236.1 1140 205 D W H 3X S+ 0 0 53 -4,-3.1 4,-2.5 1,-0.3 -1,-0.2 0.810 111.4 47.7 -42.1 -37.0 74.1 159.8 237.2 1141 206 D A H 3X S+ 0 0 12 -4,-1.7 4,-1.0 2,-0.2 -1,-0.3 0.728 106.8 52.8 -82.6 -23.0 71.8 158.0 239.6 1142 207 D R H << S+ 0 0 6 -3,-1.9 -2,-0.2 -4,-1.2 -1,-0.2 0.733 114.7 47.0 -80.2 -21.0 74.4 155.7 241.0 1143 208 D A H >< S+ 0 0 0 -4,-2.1 3,-3.5 -5,-0.2 -2,-0.2 0.965 106.1 53.3 -78.2 -62.4 76.4 158.8 241.7 1144 209 D I H 3< S+ 0 0 4 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.1 0.818 112.2 49.4 -41.0 -38.9 73.7 161.0 243.2 1145 210 D S T 3< S+ 0 0 2 -4,-1.0 -350,-1.5 -5,-0.1 2,-0.4 0.310 81.7 119.0 -90.5 10.0 73.1 158.2 245.7 1146 211 D E < + 0 0 1 -3,-3.5 16,-0.2 -352,-0.2 -64,-0.1 -0.664 24.6 151.0 -84.9 128.8 76.7 157.5 246.8 1147 212 D F >> + 0 0 1 -2,-0.4 4,-2.2 14,-0.1 3,-1.4 0.653 61.6 42.3-113.4 -91.1 77.5 158.1 250.4 1148 213 D G H 3> S+ 0 0 1 1,-0.3 4,-1.5 2,-0.2 -2,-0.1 0.804 114.0 53.9 -28.8 -57.7 80.2 156.1 252.2 1149 214 D A H 3> S+ 0 0 0 1,-0.2 4,-0.9 2,-0.2 -1,-0.3 0.904 116.5 37.5 -50.1 -47.8 82.6 156.4 249.3 1150 215 D V H <> S+ 0 0 2 -3,-1.4 4,-2.8 2,-0.2 3,-0.4 0.932 104.9 66.0 -73.6 -48.3 82.3 160.2 249.2 1151 216 D V H X S+ 0 0 3 -4,-2.2 4,-1.6 1,-0.2 5,-0.2 0.893 101.2 50.3 -38.5 -59.3 82.1 160.9 252.9 1152 217 D I H < S+ 0 0 4 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.880 119.7 34.7 -52.2 -46.5 85.6 159.7 253.6 1153 218 D L H < S+ 0 0 0 -4,-0.9 -80,-1.1 -3,-0.4 -2,-0.2 0.973 142.8 0.2 -76.9 -52.6 87.2 161.8 250.8 1154 219 D A H < + 0 0 0 -4,-2.8 -2,-0.2 -82,-0.2 -3,-0.2 -0.406 65.8 159.6-139.0 65.0 85.0 164.9 251.0 1155 220 D Y >< + 0 0 37 -4,-1.6 3,-0.9 1,-0.2 4,-0.4 0.843 65.2 67.2 -51.9 -35.5 82.3 164.7 253.6 1156 221 D Y T 3 S+ 0 0 134 1,-0.3 -1,-0.2 -5,-0.2 -82,-0.1 0.725 71.0 68.0 -78.7 -28.2 81.9 168.4 253.7 1157 222 D P T 3 S- 0 0 51 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.530 105.9-128.2 -69.3 23.6 80.5 170.1 250.9 1158 223 D M < - 0 0 36 -3,-0.9 2,-0.4 1,-0.1 -160,-0.1 0.919 22.0-147.8 40.9 93.9 77.6 168.0 252.3 1159 224 D V >> - 0 0 3 -4,-0.4 3,-2.6 -161,-0.1 4,-1.6 -0.707 31.1 -99.0 -87.9 137.7 76.1 165.9 249.5 1160 225 D G H 3> S+ 0 0 0 -165,-2.7 4,-1.9 -2,-0.4 -164,-0.1 0.698 122.4 45.5 -16.3 -71.4 72.4 165.2 249.7 1161 226 D P H 3> S+ 0 0 0 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.796 113.8 49.5 -52.5 -35.0 72.8 161.7 251.1 1162 227 D T H X> S+ 0 0 0 -3,-2.6 4,-2.4 2,-0.2 3,-1.5 0.965 106.1 56.7 -69.2 -51.4 75.4 162.8 253.7 1163 228 D L H 3X S+ 0 0 2 -4,-1.6 4,-2.6 1,-0.3 5,-0.3 0.899 102.3 55.0 -42.7 -54.6 73.3 165.7 254.9 1164 229 D I H 3X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -1,-0.3 0.831 110.6 46.7 -51.2 -35.3 70.5 163.3 255.7 1165 230 D Y H X S+ 0 0 22 -4,-2.4 4,-2.0 1,-0.2 3,-0.8 0.984 113.5 43.1 -53.7 -62.2 74.3 164.5 259.6 1167 232 D R H 3X S+ 0 0 41 -4,-2.6 4,-0.6 1,-0.2 5,-0.2 0.910 107.5 62.8 -50.3 -48.2 70.8 165.6 260.5 1168 233 D F H 3< S+ 0 0 21 -4,-2.0 -1,-0.2 -5,-0.3 4,-0.2 0.831 110.4 35.6 -49.4 -42.3 69.8 162.1 261.6 1169 234 D I H << S+ 0 0 100 -4,-1.8 3,-0.5 -3,-0.8 -1,-0.2 0.961 126.5 37.1 -77.1 -54.0 72.4 161.9 264.4 1170 235 D S H < S+ 0 0 76 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.1 0.984 133.0 20.3 -58.2 -82.9 72.2 165.5 265.5 1171 236 D Y S X S- 0 0 163 -4,-0.6 4,-1.0 1,-0.2 3,-0.4 0.032 106.1-130.2 -81.4 27.0 68.6 166.5 265.2 1172 237 D G T 4 - 0 0 28 -3,-0.5 3,-0.5 -5,-0.2 4,-0.4 0.187 48.3 -41.0 53.4-174.3 67.2 162.9 265.2 1173 238 D L T > S+ 0 0 33 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.620 122.7 71.5 -60.4 -19.6 64.8 161.3 262.7 1174 239 D S T 4 S+ 0 0 88 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.953 107.1 30.9 -67.0 -53.9 62.4 164.3 262.5 1175 240 D A T < S+ 0 0 34 -4,-1.0 -1,-0.2 -3,-0.5 -2,-0.2 0.406 119.6 64.5 -84.7 4.0 64.6 166.7 260.4 1176 241 D S T >> S+ 0 0 0 -4,-0.4 3,-1.4 -5,-0.2 4,-1.4 0.932 95.9 47.4 -88.4 -59.9 66.0 163.6 258.9 1177 242 D R H 3X S+ 0 0 6 -4,-2.3 4,-2.7 1,-0.3 5,-0.3 0.885 102.1 63.6 -50.2 -51.3 63.1 162.0 257.0 1178 243 D P H 3> S+ 0 0 7 0, 0.0 4,-1.0 0, 0.0 -1,-0.3 0.726 106.8 45.2 -49.3 -26.0 61.9 165.2 255.3 1179 244 D I H <> S+ 0 0 4 -3,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.833 111.5 50.6 -87.1 -37.4 65.3 165.4 253.4 1180 245 D A H X S+ 0 0 0 -4,-1.4 4,-2.0 -3,-0.3 -3,-0.1 0.844 113.7 46.5 -68.3 -33.7 65.3 161.7 252.5 1181 246 D V H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.882 111.9 49.8 -74.6 -40.0 61.7 162.0 251.1 1182 247 D L H X S+ 0 0 42 -4,-1.0 4,-0.6 -5,-0.3 -2,-0.2 0.861 110.4 52.3 -67.5 -32.3 62.6 165.2 249.3 1183 248 D L H >X S+ 0 0 1 -4,-2.1 4,-1.6 2,-0.2 3,-1.1 0.956 107.9 49.3 -68.7 -49.8 65.6 163.4 247.8 1184 249 D I H >X S+ 0 0 5 -4,-2.0 4,-3.1 1,-0.3 3,-0.7 0.949 102.5 59.4 -54.8 -54.6 63.7 160.4 246.5 1185 250 D L H 3X S+ 0 0 78 -4,-1.9 4,-1.1 1,-0.3 -1,-0.3 0.799 107.8 49.7 -45.5 -27.0 61.1 162.4 244.8 1186 251 D V H