==== 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 29-JUN-04 1VKZ . COMPND 2 MOLECULE: PHOSPHORIBOSYLAMINE--GLYCINE LIGASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOTOGA MARITIMA; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 782 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34289.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 527 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 156 19.9 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.8 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 . 68 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 59 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 188 24.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 2 0 0 6 0 2 0 2 4 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 4 0 0 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 . 6 4 2 10 2 0 2 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 2 4 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 4 A V 0 0 138 0, 0.0 24,-1.7 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 -21.6 41.0 34.5 32.1 2 5 A R E -a 25 0A 93 22,-0.2 2,-0.4 24,-0.0 55,-0.3 -0.841 360.0-160.9-119.7 137.1 40.2 37.6 34.4 3 6 A V E -a 26 0A 2 22,-2.8 24,-3.1 -2,-0.4 2,-0.5 -0.884 6.8-160.8-112.3 132.9 37.6 38.4 37.0 4 7 A H E -ab 27 58A 1 53,-2.1 55,-2.9 -2,-0.4 2,-0.6 -0.947 5.4-165.8-120.3 117.6 36.8 41.9 38.0 5 8 A I E -ab 28 59A 0 22,-3.8 24,-3.0 -2,-0.5 2,-0.6 -0.889 8.6-150.4-111.0 119.3 35.1 42.5 41.3 6 9 A L E +a 29 0A 0 53,-1.9 2,-0.2 -2,-0.6 58,-0.1 -0.755 58.2 40.6 -85.9 123.0 33.5 45.8 42.2 7 10 A G E -a 30 0A 10 22,-2.8 24,-2.3 -2,-0.6 22,-0.2 -0.714 66.3-116.1 134.4-177.7 33.5 46.7 45.9 8 11 A S + 0 0 62 -2,-0.2 -1,-0.1 22,-0.2 27,-0.1 0.291 69.7 98.3-140.2 8.5 35.4 46.6 49.2 9 12 A G S > S- 0 0 15 332,-0.1 4,-1.9 23,-0.0 330,-0.2 -0.208 86.0 -93.0 -96.7-175.2 33.6 44.3 51.6 10 13 A G H > S+ 0 0 0 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.769 122.5 60.0 -70.9 -28.1 34.0 40.6 52.7 11 14 A R H > S+ 0 0 31 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.942 108.6 44.6 -58.8 -48.1 31.5 39.5 50.1 12 15 A E H > S+ 0 0 7 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.915 115.6 46.1 -65.8 -45.5 33.7 40.9 47.4 13 16 A H H X S+ 0 0 1 -4,-1.9 4,-2.0 326,-0.3 -2,-0.2 0.914 112.8 50.9 -66.1 -42.2 36.8 39.4 49.0 14 17 A A H X S+ 0 0 0 -4,-3.2 4,-2.3 2,-0.2 -2,-0.2 0.955 111.6 47.4 -57.8 -49.5 35.1 36.1 49.4 15 18 A I H X S+ 0 0 2 -4,-3.1 4,-1.8 1,-0.2 -2,-0.2 0.951 116.0 44.7 -59.3 -45.9 34.0 36.1 45.8 16 19 A G H X S+ 0 0 0 -4,-2.9 4,-1.8 2,-0.2 -1,-0.2 0.780 108.3 58.6 -65.6 -28.7 37.5 37.0 44.7 17 20 A W H X S+ 0 0 38 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.968 106.4 47.3 -68.0 -48.3 39.0 34.5 47.1 18 21 A A H X S+ 0 0 0 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.884 113.1 47.8 -56.6 -46.7 37.1 31.6 45.4 19 22 A F H <>S+ 0 0 0 -4,-1.8 5,-2.4 2,-0.2 -1,-0.2 0.912 112.5 47.7 -63.0 -42.6 38.1 32.7 41.9 20 23 A A H ><5S+ 0 0 30 -4,-1.8 3,-1.2 1,-0.2 -1,-0.2 0.839 107.1 58.2 -68.1 -32.9 41.7 33.1 42.8 21 24 A K H 3<5S+ 0 0 132 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.829 105.9 49.7 -63.7 -34.3 41.5 29.7 44.5 22 25 A Q T 3<5S- 0 0 64 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.289 128.4 -99.3 -88.8 6.8 40.4 28.3 41.0 23 26 A G T < 5S+ 0 0 66 -3,-1.2 -3,-0.2 1,-0.3 2,-0.1 0.515 74.2 141.5 93.6 5.9 43.4 30.0 39.3 24 27 A Y < - 0 0 78 -5,-2.4 2,-0.6 -6,-0.1 -1,-0.3 -0.467 56.8-113.9 -81.0 153.5 41.7 33.1 37.9 25 28 A E E -a 2 0A 97 -24,-1.7 -22,-2.8 -2,-0.1 2,-0.5 -0.789 39.9-157.0 -88.2 120.8 43.4 36.5 37.8 26 29 A V E -a 3 0A 4 -2,-0.6 14,-1.9 12,-0.3 2,-0.5 -0.876 16.3-172.2-116.9 127.9 41.3 38.7 40.1 27 30 A H E -ac 4 40A 16 -24,-3.1 -22,-3.8 -2,-0.5 2,-0.4 -0.969 9.1-158.2-115.7 130.3 41.0 42.5 40.1 28 31 A F E -ac 5 41A 0 12,-1.9 14,-3.0 -2,-0.5 -22,-0.2 -0.863 14.7-131.1-109.7 144.0 39.2 44.3 42.9 29 32 A Y E S-a 6 0A 18 -24,-3.0 -22,-2.8 -2,-0.4 -21,-0.1 -0.857 91.8 -27.6-137.2 97.2 37.7 47.8 42.5 30 33 A P E S+a 7 0A 61 0, 0.0 -1,-0.2 0, 0.0 -22,-0.2 -0.984 92.1 170.2 -93.3 6.2 38.7 49.2 45.0 31 34 A G - 0 0 8 -24,-2.3 2,-0.3 -26,-0.2 9,-0.0 -0.237 32.5-107.7 56.8-154.3 39.0 46.2 47.3 32 35 A N >> - 0 0 16 -23,-0.1 3,-1.1 309,-0.1 4,-0.6 -0.905 39.5 -73.7-158.3-177.0 40.8 46.7 50.6 33 36 A A T 34 S+ 0 0 20 309,-1.1 3,-0.1 1,-0.3 310,-0.1 0.703 127.8 52.9 -66.7 -19.2 44.1 45.8 52.3 34 37 A G T >4 S+ 0 0 3 308,-0.2 3,-1.6 306,-0.2 -1,-0.3 0.746 96.3 66.1 -81.7 -26.7 43.0 42.2 52.7 35 38 A T G X> S+ 0 0 0 -3,-1.1 4,-1.2 1,-0.3 3,-1.1 0.646 80.5 79.4 -78.4 -12.8 42.1 41.7 49.1 36 39 A K G 3< S+ 0 0 114 -4,-0.6 -1,-0.3 1,-0.2 -2,-0.1 0.710 82.5 68.4 -58.2 -22.4 45.7 42.1 48.1 37 40 A R G <4 S+ 0 0 137 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.792 113.3 24.9 -66.3 -31.2 46.1 38.4 49.2 38 41 A D T <4 S- 0 0 45 -3,-1.1 -12,-0.3 -4,-0.2 2,-0.3 0.439 131.3 -15.4-121.9 -2.2 44.1 37.1 46.4 39 42 A G S < S- 0 0 19 -4,-1.2 2,-0.5 -14,-0.1 -12,-0.2 -0.951 77.3 -68.5-175.4-168.3 44.3 39.7 43.6 40 43 A T E -c 27 0A 76 -14,-1.9 -12,-1.9 -2,-0.3 2,-0.3 -0.920 39.1-138.4-108.3 130.7 45.3 43.3 42.7 41 44 A N E +c 28 0A 32 -2,-0.5 -12,-0.2 -14,-0.2 -10,-0.1 -0.663 23.5 177.6 -85.0 135.9 43.3 46.3 43.9 42 45 A H - 0 0 62 -14,-3.0 2,-0.1 -2,-0.3 -15,-0.0 -0.970 35.5 -99.0-133.1 149.7 42.5 49.2 41.6 43 46 A P - 0 0 88 0, 0.0 2,-0.4 0, 0.0 -14,-0.0 -0.444 33.9-130.0 -64.2 138.7 40.5 52.4 42.1 44 47 A Y + 0 0 66 -2,-0.1 3,-0.1 1,-0.1 -15,-0.0 -0.786 30.5 171.0 -89.5 133.6 37.0 52.3 40.7 45 48 A E > - 0 0 116 1,-0.4 3,-1.3 -2,-0.4 4,-0.2 -0.193 41.9-115.5-139.6 43.8 36.2 55.3 38.6 46 49 A G T >> S- 0 0 23 1,-0.3 4,-1.6 2,-0.2 3,-0.9 -0.265 87.2 -0.5 64.7-141.1 32.8 54.5 37.0 47 50 A E H 3> S+ 0 0 148 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.706 129.6 62.6 -53.9 -26.7 32.5 54.0 33.3 48 51 A K H <> S+ 0 0 151 -3,-1.3 4,-0.8 2,-0.2 -1,-0.2 0.899 106.0 45.7 -67.6 -40.5 36.2 54.8 32.9 49 52 A T H <4 S+ 0 0 14 -3,-0.9 4,-0.4 -4,-0.2 -2,-0.2 0.915 120.0 39.6 -62.4 -45.2 37.0 51.7 34.9 50 53 A L H >< S+ 0 0 11 -4,-1.6 3,-0.5 1,-0.2 -2,-0.2 0.782 106.9 59.7 -83.6 -32.5 34.5 49.5 33.1 51 54 A K H 3< S+ 0 0 145 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.1 0.796 104.6 55.0 -63.0 -29.0 35.0 50.8 29.5 52 55 A A T 3< S+ 0 0 82 -4,-0.8 -1,-0.2 -5,-0.2 -2,-0.2 0.708 89.0 90.0 -80.0 -20.9 38.7 49.6 29.8 53 56 A I S < S- 0 0 8 -3,-0.5 20,-0.1 -4,-0.4 3,-0.1 -0.636 70.5-143.1 -83.3 127.8 37.8 46.1 30.8 54 57 A P - 0 0 63 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.043 44.6 -59.0 -75.3-178.6 37.5 43.6 27.9 55 58 A E S S+ 0 0 113 2,-0.0 2,-0.2 17,-0.0 18,-0.1 -0.588 97.3 97.2 -69.0 139.8 34.9 40.7 27.5 56 59 A E S S- 0 0 33 -2,-0.3 -53,-0.1 -3,-0.1 2,-0.1 -0.582 85.2 -49.5 129.1 150.1 35.7 38.6 30.5 57 60 A D - 0 0 6 -55,-0.3 -53,-2.1 -2,-0.2 2,-0.5 -0.268 39.4-174.3 -80.3 134.5 33.7 38.7 33.7 58 61 A I E -bd 4 74A 0 15,-2.6 17,-3.7 -55,-0.2 2,-0.7 -0.984 12.5-161.5-113.5 121.7 32.7 41.7 35.9 59 62 A V E -b 5 0A 1 -55,-2.9 -53,-1.9 -2,-0.5 17,-0.1 -0.878 7.4-167.3-105.4 109.7 31.0 40.8 39.2 60 63 A I + 0 0 1 -2,-0.7 2,-0.3 15,-0.3 -53,-0.1 -0.809 12.4 178.6 -93.4 130.9 29.1 43.6 40.8 61 64 A P + 0 0 8 0, 0.0 2,-0.3 0, 0.0 209,-0.1 -0.830 56.2 26.6-120.0 104.4 27.7 43.6 44.4 62 65 A G S S- 0 0 18 -2,-0.3 207,-0.2 207,-0.1 -2,-0.1 -0.951 108.8 -44.0 164.9-143.9 25.9 46.8 45.4 63 66 A S S > S+ 0 0 76 -2,-0.3 3,-2.0 1,-0.1 5,-0.1 0.220 101.7 99.3-106.0 0.5 24.0 49.8 44.0 64 67 A E G >> S+ 0 0 48 1,-0.2 4,-1.8 2,-0.1 3,-0.9 0.948 72.4 75.5 -38.1 -43.4 26.6 50.0 41.2 65 68 A E G 34 + 0 0 1 1,-0.3 -1,-0.2 2,-0.2 17,-0.2 0.440 67.9 77.5 -66.1 -3.0 23.7 48.2 39.5 66 69 A F G <4 S+ 0 0 55 -3,-2.0 -1,-0.3 16,-0.1 -2,-0.1 -0.056 124.3 4.3 -92.9 30.3 21.4 51.2 39.1 67 70 A L T <4 S+ 0 0 114 -3,-0.9 12,-0.3 0, 0.0 -2,-0.2 0.037 108.9 82.8-152.9 -40.7 23.8 51.9 36.2 68 71 A V < 0 0 18 -4,-1.8 -3,-0.1 -5,-0.1 10,-0.1 0.770 360.0 360.0 -41.8 -65.0 26.6 49.3 35.5 69 72 A E 0 0 41 8,-0.4 3,-0.2 -4,-0.1 10,-0.1 0.486 360.0 360.0 -71.5 360.0 25.1 46.5 33.3 70 ! 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 71 78 A R > 0 0 111 0, 0.0 3,-1.6 0, 0.0 -20,-0.0 0.000 360.0 360.0 360.0 123.9 28.0 46.6 29.2 72 79 A S T 3 + 0 0 79 1,-0.3 -3,-0.1 -3,-0.2 -17,-0.0 0.557 360.0 76.8 -60.6 -13.4 27.5 42.9 28.5 73 80 A N T 3 S+ 0 0 1 -20,-0.1 -15,-2.6 -16,-0.1 2,-0.5 0.661 74.3 89.4 -60.3 -31.1 30.6 42.3 30.7 74 81 A V B < S-d 58 0A 1 -3,-1.6 2,-1.7 -17,-0.2 -15,-0.2 -0.691 70.1-144.9 -91.1 124.7 28.8 42.8 33.9 75 82 A F S S+ 0 0 0 -17,-3.7 -15,-0.3 -2,-0.5 175,-0.2 -0.561 71.2 77.0 -90.8 75.1 27.2 39.8 35.5 76 83 A G S S- 0 0 0 -2,-1.7 173,-0.2 173,-0.2 -2,-0.1 -0.937 86.2 -77.0-174.2 159.7 24.2 41.5 37.0 77 84 A P - 0 0 0 0, 0.0 -8,-0.4 0, 0.0 170,-0.1 -0.225 45.9-102.2 -74.3 155.2 21.0 42.8 35.8 78 85 A V >> - 0 0 40 168,-0.3 4,-2.1 -9,-0.1 3,-1.1 -0.203 43.3 -95.7 -62.2 162.2 20.3 46.0 33.8 79 86 A K H 3> S+ 0 0 101 -12,-0.3 4,-0.8 1,-0.3 7,-0.2 0.832 123.0 56.9 -47.3 -45.4 18.9 49.1 35.6 80 87 A E H 34 S+ 0 0 81 1,-0.2 3,-0.3 2,-0.2 -1,-0.3 0.832 111.1 41.9 -60.7 -35.0 15.3 48.3 34.6 81 88 A V H X4 S+ 0 0 5 -3,-1.1 3,-1.9 1,-0.2 -1,-0.2 0.866 106.3 62.5 -82.0 -36.8 15.5 44.9 36.2 82 89 A A H >X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.3 3,-1.7 0.562 79.8 84.3 -67.6 -12.4 17.3 46.2 39.3 83 90 A R H 3X S+ 0 0 117 -4,-0.8 4,-2.2 -3,-0.3 8,-0.4 0.677 74.8 75.4 -53.7 -23.3 14.2 48.4 40.0 84 91 A L H <4 S+ 0 0 3 -3,-1.9 183,-0.6 1,-0.2 -1,-0.3 0.862 112.0 22.4 -57.5 -37.6 13.1 45.1 41.7 85 92 A E H <4 S+ 0 0 21 -3,-1.7 -2,-0.2 -4,-0.1 3,-0.2 0.782 125.1 55.0 -91.4 -38.2 15.5 46.1 44.4 86 93 A G H < S+ 0 0 19 -4,-2.9 2,-0.4 1,-0.2 46,-0.3 0.709 112.0 38.2 -73.4 -28.3 15.7 49.9 43.8 87 94 A S X - 0 0 11 -4,-2.2 4,-2.4 44,-0.1 -1,-0.2 -0.921 60.2-171.1-127.0 101.4 12.0 50.6 44.0 88 95 A K H > S+ 0 0 34 42,-3.1 4,-1.5 -2,-0.4 42,-0.1 0.794 91.6 54.8 -63.3 -27.2 10.1 48.7 46.6 89 96 A V H > S+ 0 0 7 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.935 107.2 47.8 -68.6 -49.3 6.9 50.0 45.1 90 97 A Y H > S+ 0 0 47 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.913 108.6 56.6 -54.3 -41.6 7.7 48.8 41.7 91 98 A A H X S+ 0 0 4 -4,-2.4 4,-2.4 -8,-0.4 -1,-0.2 0.908 107.0 48.6 -61.8 -40.1 8.6 45.4 43.2 92 99 A K H X S+ 0 0 3 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.851 111.8 47.1 -67.2 -38.5 5.1 45.1 44.8 93 100 A R H X S+ 0 0 125 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.871 110.9 53.8 -71.4 -35.8 3.3 46.0 41.6 94 101 A F H X S+ 0 0 6 -4,-2.5 4,-2.8 -5,-0.2 -2,-0.2 0.961 109.6 46.8 -57.2 -54.9 5.4 43.5 39.7 95 102 A X H <>S+ 0 0 4 -4,-2.4 5,-2.7 2,-0.2 4,-0.5 0.871 110.7 51.2 -60.9 -40.5 4.6 40.7 42.1 96 103 A K H ><5S+ 0 0 145 -4,-1.9 3,-1.0 3,-0.2 -1,-0.2 0.966 113.0 48.9 -59.0 -48.0 0.8 41.5 42.1 97 104 A K H 3<5S+ 0 0 130 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.931 117.0 38.2 -56.0 -52.3 1.0 41.4 38.3 98 105 A Y T 3<5S- 0 0 22 -4,-2.8 -1,-0.2 -5,-0.1 -2,-0.2 0.280 113.3-111.0 -93.7 16.1 2.9 38.1 38.0 99 106 A G T < 5 + 0 0 49 -3,-1.0 2,-0.5 -4,-0.5 -3,-0.2 0.871 57.0 163.0 63.5 40.8 1.1 36.3 40.9 100 107 A I < - 0 0 6 -5,-2.7 2,-0.2 -6,-0.1 -1,-0.2 -0.818 45.4-111.0 -97.8 125.4 4.1 36.3 43.2 101 108 A R + 0 0 71 -2,-0.5 163,-2.2 161,-0.2 2,-0.3 -0.340 58.8 141.2 -68.5 119.3 3.1 35.6 46.8 102 109 A T - 0 0 23 161,-0.2 163,-0.1 -2,-0.2 3,-0.1 -0.945 53.1 -76.6-150.3 165.7 3.6 38.7 48.9 103 110 A A - 0 0 2 161,-0.4 69,-0.1 -2,-0.3 70,-0.0 -0.339 53.2 -98.6 -66.0 148.4 2.0 40.6 51.7 104 111 A R + 0 0 115 66,-0.1 67,-3.2 68,-0.1 2,-0.3 -0.357 57.1 170.5 -61.4 148.6 -1.0 42.8 51.0 105 112 A F E -E 170 0B 25 65,-0.2 2,-0.3 -3,-0.1 65,-0.2 -0.988 29.3-151.9-159.2 156.6 0.1 46.4 50.7 106 113 A E E -E 169 0B 45 63,-1.6 63,-2.8 -2,-0.3 2,-0.5 -0.904 23.7-123.3-129.2 166.6 -0.9 49.9 49.8 107 114 A V E -E 168 0B 12 -2,-0.3 2,-0.6 61,-0.2 61,-0.2 -0.946 17.9-167.1-112.3 122.6 1.3 52.8 48.4 108 115 A A E +E 167 0B 0 59,-2.7 59,-2.6 -2,-0.5 -2,-0.0 -0.942 12.2 173.3-109.7 114.1 1.4 56.1 50.3 109 116 A E S S+ 0 0 107 -2,-0.6 -1,-0.1 57,-0.3 56,-0.1 0.627 72.6 28.6 -90.9 -21.2 3.0 58.9 48.2 110 117 A T S > S- 0 0 53 57,-0.1 4,-2.0 1,-0.0 3,-0.2 -0.930 84.7-110.9-132.7 159.8 2.2 61.6 50.8 111 118 A P H > S+ 0 0 30 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.796 118.8 60.0 -54.1 -34.9 1.8 61.7 54.6 112 119 A E H > S+ 0 0 124 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.930 106.1 45.7 -57.4 -48.3 -1.9 62.4 54.0 113 120 A E H > S+ 0 0 47 1,-0.2 4,-3.6 -3,-0.2 5,-0.3 0.875 107.9 58.3 -64.7 -37.7 -2.2 59.1 52.1 114 121 A L H X S+ 0 0 0 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.883 106.7 48.4 -57.7 -41.3 -0.3 57.4 54.9 115 122 A R H X S+ 0 0 141 -4,-1.8 4,-0.5 2,-0.2 -2,-0.2 0.912 118.8 38.7 -64.4 -46.7 -3.0 58.6 57.4 116 123 A E H >< S+ 0 0 93 -4,-2.0 3,-1.2 1,-0.2 4,-0.2 0.978 120.5 43.2 -66.0 -57.7 -5.8 57.3 55.2 117 124 A K H >< S+ 0 0 45 -4,-3.6 3,-1.0 1,-0.3 -3,-0.2 0.675 100.9 68.7 -71.2 -18.6 -4.2 54.1 54.0 118 125 A I H >< S+ 0 0 0 -4,-1.5 3,-2.0 -5,-0.3 -1,-0.3 0.827 86.0 70.9 -69.1 -26.5 -2.8 53.1 57.4 119 126 A K T << S+ 0 0 160 -3,-1.2 -1,-0.2 -4,-0.5 -2,-0.2 0.692 84.7 68.8 -64.3 -19.9 -6.3 52.4 58.6 120 127 A K T < S+ 0 0 117 -3,-1.0 -1,-0.3 -4,-0.2 2,-0.3 0.463 97.7 66.0 -72.2 -2.3 -6.5 49.3 56.4 121 128 A F S < S- 0 0 16 -3,-2.0 4,-0.1 -4,-0.1 50,-0.1 -0.785 77.0-119.3-126.7 165.7 -3.9 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-87.5 176.5 14.1 53.7 47.4 132 139 A L + 0 0 72 -46,-0.3 -1,-0.2 1,-0.1 -2,-0.1 -0.432 42.2 173.0 -64.5 136.9 17.4 52.4 48.7 133 140 A A - 0 0 13 -2,-0.1 -1,-0.1 -4,-0.1 30,-0.1 0.096 65.6 -93.9-129.9 19.9 18.0 53.4 52.4 134 141 A R S S- 0 0 91 1,-0.2 -2,-0.1 2,-0.1 0, 0.0 0.956 82.8 -60.8 53.7 52.6 21.1 51.4 52.8 135 142 A G S S+ 0 0 84 1,-0.1 -1,-0.2 2,-0.1 -3,-0.1 0.835 123.8 106.8 41.2 43.2 18.7 48.8 54.2 136 143 A K + 0 0 117 1,-0.0 -1,-0.1 24,-0.0 -2,-0.1 0.129 56.1 80.0-124.2 17.1 17.6 51.2 56.9 137 144 A G + 0 0 4 -8,-0.1 -8,-3.1 -6,-0.1 2,-0.7 0.182 59.0 94.4-120.4 15.2 14.1 52.1 55.5 138 145 A V E -F 128 0B 57 -10,-0.3 2,-0.3 -5,-0.1 -10,-0.3 -0.947 60.0-164.0-100.2 111.9 11.8 49.2 56.4 139 146 A L E -F 127 0B 28 -12,-3.8 -12,-2.1 -2,-0.7 2,-0.4 -0.773 12.8-168.2 -95.4 140.8 10.1 50.3 59.6 140 147 A I E +F 126 0B 78 -2,-0.3 2,-0.4 -14,-0.2 -14,-0.2 -0.904 19.0 176.1-126.7 104.2 8.2 47.9 61.9 141 148 A L E -F 125 0B 18 -16,-2.3 -16,-3.1 -2,-0.4 6,-0.1 -0.900 32.1-154.1-120.8 135.9 6.2 49.8 64.5 142 149 A D S S+ 0 0 45 -2,-0.4 2,-0.3 -18,-0.2 -1,-0.1 0.909 80.7 55.9 -66.5 -44.8 3.7 48.6 67.1 143 150 A S S > S- 0 0 40 1,-0.1 4,-1.4 -19,-0.1 5,-0.1 -0.676 70.0-140.4-102.1 147.0 1.7 51.8 67.3 144 151 A K H > S+ 0 0 52 -2,-0.3 4,-3.1 2,-0.2 5,-0.2 0.902 102.3 56.2 -64.4 -45.2 -0.1 53.8 64.6 145 152 A E H > S+ 0 0 136 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.907 110.8 43.2 -56.1 -49.1 0.9 57.2 66.0 146 153 A E H > S+ 0 0 79 1,-0.2 4,-2.2 2,-0.2 5,-0.4 0.794 114.4 53.0 -68.4 -32.2 4.7 56.4 65.8 147 154 A T H X S+ 0 0 0 -4,-1.4 4,-2.1 2,-0.2 5,-0.2 0.898 112.7 42.2 -67.0 -45.3 4.0 54.8 62.3 148 155 A I H X S+ 0 0 40 -4,-3.1 4,-2.1 3,-0.2 5,-0.2 0.934 116.7 49.2 -69.2 -43.9 2.3 58.0 61.0 149 156 A E H X S+ 0 0 41 -4,-2.9 4,-1.3 -5,-0.2 -2,-0.2 0.938 122.2 30.9 -61.5 -51.2 5.0 60.2 62.7 150 157 A K H X S+ 0 0 71 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.873 119.9 52.7 -76.6 -40.4 8.0 58.4 61.4 151 158 A G H X S+ 0 0 0 -4,-2.1 4,-1.6 -5,-0.4 -2,-0.2 0.832 108.5 51.0 -65.6 -34.3 6.5 57.2 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164 171 A K + 0 0 168 -2,-0.4 -8,-0.2 -8,-0.1 -9,-0.2 -0.960 27.8 63.8-171.1 140.6 12.2 60.6 50.2 165 172 A G S S- 0 0 21 -10,-2.8 -8,-0.2 -2,-0.3 -35,-0.2 -0.715 81.2 -9.0 122.4-174.8 9.3 59.5 48.1 166 173 A P - 0 0 30 0, 0.0 -36,-2.2 0, 0.0 2,-0.3 0.058 55.7-148.6 -57.0 160.7 6.5 56.9 48.4 167 174 A V E -EG 108 129B 0 -59,-2.6 -59,-2.7 -38,-0.2 2,-0.4 -0.963 9.9-130.4-127.5 148.0 6.3 54.2 50.9 168 175 A V E -EG 107 128B 0 -40,-2.7 -40,-2.3 -2,-0.3 2,-0.6 -0.794 13.1-152.2 -86.1 137.0 4.8 50.7 50.9 169 176 A I E -EG 106 127B 0 -63,-2.8 -63,-1.6 -2,-0.4 2,-0.4 -0.975 22.5-164.2-106.6 118.8 2.5 49.8 53.7 170 177 A D E -EG 105 126B 5 -44,-2.6 -44,-0.8 -2,-0.6 2,-0.4 -0.871 24.4-116.3-111.4 138.0 2.9 46.1 54.1 171 178 A E E - G 0 125B 66 -67,-3.2 2,-0.1 -2,-0.4 -46,-0.1 -0.605 41.8-118.0 -64.3 122.7 0.6 43.7 55.9 172 179 A F - 0 0 69 -48,-0.5 2,-0.5 -2,-0.4 -50,-0.1 -0.483 27.3-149.1 -68.8 136.8 2.8 42.3 58.7 173 180 A L - 0 0 7 -2,-0.1 84,-0.1 -70,-0.0 2,-0.1 -0.954 6.8-137.6-113.7 113.3 3.3 38.6 58.4 174 181 A A + 0 0 61 -2,-0.5 2,-0.3 82,-0.1 85,-0.1 -0.440 59.8 84.7 -54.4 140.1 3.8 36.4 61.4 175 182 A G S S- 0 0 44 83,-0.1 2,-0.5 -2,-0.1 83,-0.2 -0.901 78.9 -59.2 158.6-174.1 6.5 33.8 60.7 176 183 A N E -H 257 0C 124 81,-1.3 81,-2.7 -2,-0.3 2,-0.1 -0.903 50.9-131.3-100.7 125.4 10.2 32.8 60.4 177 184 A E E +H 256 0C 105 -2,-0.5 2,-0.3 79,-0.2 79,-0.3 -0.428 31.5 171.7 -78.3 152.8 12.2 35.0 58.1 178 185 A L E -H 255 0C 11 77,-2.2 77,-4.3 -2,-0.1 2,-0.3 -0.979 22.3-140.3-163.7 143.3 14.5 33.4 55.5 179 186 A S E -H 254 0C 4 16,-0.4 2,-0.4 -2,-0.3 75,-0.2 -0.834 10.9-166.6-111.3 148.2 16.6 34.4 52.6 180 187 A A E -H 253 0C 1 73,-2.8 73,-3.7 -2,-0.3 2,-0.4 -0.999 7.3-171.5-133.8 139.1 17.0 32.6 49.3 181 188 A X E -H 252 0C 6 -2,-0.4 11,-3.2 11,-0.3 2,-0.4 -0.969 3.4-177.7-132.0 141.5 19.7 33.3 46.7 182 189 A A E -HI 251 191C 0 69,-2.4 69,-2.9 -2,-0.4 2,-0.5 -0.989 29.9-129.7-141.9 149.0 20.3 32.2 43.2 183 190 A V E -HI 250 190C 0 7,-2.0 7,-2.6 -2,-0.4 2,-0.3 -0.857 44.4-165.3 -87.7 133.6 22.7 32.4 40.3 184 191 A V E +HI 249 189C 0 65,-3.0 65,-2.5 -2,-0.5 2,-0.3 -0.949 32.1 176.7-135.7 138.4 20.6 33.3 37.4 185 192 A N E > S-HI 248 188C 27 3,-2.9 3,-2.3 -2,-0.3 2,-0.4 -0.848 72.6 -61.5-140.5 102.6 20.7 33.4 33.5 186 193 A G T 3 S- 0 0 10 61,-3.2 61,-0.2 -2,-0.3 54,-0.1 -0.449 122.3 -12.9 60.9-113.2 17.4 34.4 32.0 187 194 A R T 3 S+ 0 0 95 -2,-0.4 2,-0.3 -3,-0.1 -1,-0.3 0.542 120.6 90.1 -97.4 -10.4 15.0 31.7 33.1 188 195 A N E < +I 185 0C 98 -3,-2.3 -3,-2.9 49,-0.1 2,-0.3 -0.678 52.7 161.9 -83.7 139.8 17.6 29.3 34.4 189 196 A F E -I 184 0C 38 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.989 29.6-149.7-151.3 154.3 18.8 29.5 38.0 190 197 A V E -I 183 0C 13 -7,-2.6 -7,-2.0 -2,-0.3 2,-0.4 -0.996 23.5-133.1-122.1 134.1 20.5 27.5 40.7 191 198 A I E -I 182 0C 34 -2,-0.4 112,-0.5 -9,-0.2 -9,-0.3 -0.712 22.3-136.8 -84.0 132.6 19.6 28.1 44.3 192 199 A L - 0 0 4 -11,-3.2 -11,-0.3 -2,-0.4 112,-0.1 -0.402 37.8 -71.2 -84.0 162.9 22.6 28.5 46.7 193 200 A P - 0 0 12 0, 0.0 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3,-0.4 1,-0.3 -1,-0.1 -0.158 112.5 31.0 -65.5 148.2 23.4 38.6 71.6 204 211 A G T 4 S- 0 0 55 1,-0.2 -1,-0.3 -4,-0.1 -2,-0.0 0.826 132.9 -76.9 68.6 31.3 19.9 37.4 72.0 205 212 A D T 4 S+ 0 0 85 -3,-0.4 -2,-0.2 1,-0.2 2,-0.2 0.848 93.3 141.3 39.3 53.7 19.1 39.6 69.0 206 213 A R E < +P 202 0E 77 -4,-1.3 -4,-2.5 -3,-0.4 -5,-0.2 -0.606 33.3 39.9-106.9 173.2 19.2 42.9 70.9 207 214 A G E S- 0 0 5 -2,-0.2 329,-0.0 -6,-0.2 328,-0.0 -0.211 99.4 -26.7 81.2-172.7 20.5 46.3 69.9 208 215 A P E - 0 0 44 0, 0.0 -7,-2.0 0, 0.0 -6,-0.2 -0.249 68.5 -99.4 -70.7 158.6 20.2 48.0 66.5 209 216 A N E -P 200 0E 75 -9,-0.2 2,-0.2 -8,-0.1 -9,-0.2 -0.482 44.1-173.6 -69.8 148.6 19.9 46.2 63.2 210 217 A T - 0 0 12 -11,-2.5 3,-0.1 -2,-0.1 -1,-0.0 -0.739 44.3 -96.6-131.6 180.0 23.1 45.9 61.2 211 218 A G S S- 0 0 42 -2,-0.2 62,-0.4 1,-0.2 -12,-0.1 0.408 98.8 -47.7 -82.6 -2.0 24.0 44.7 57.7 212 219 A G - 0 0 1 -13,-0.4 -13,-0.2 -14,-0.1 -1,-0.2 0.166 39.9-156.2 137.4 124.9 24.8 41.4 59.5 213 220 A X S S- 0 0 0 -15,-4.2 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