==== 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 HYDROLASE 06-DEC-06 2O5U . COMPND 2 MOLECULE: THIOESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR M.CHRUSZCZ,S.WANG,E.EVDOKIMOVA,K.D.KOCLEGA,M.KUDRITSKA,A.SAV . 427 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20227.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 307 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 141 33.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 . 20 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 19.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 2 1 0 0 0 0 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 9 0 0 0 4 0 0 3 3 0 3 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 0 0 0 1 0 0 0 0 0 1 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 0 A A 0 0 96 0, 0.0 74,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0-168.1 21.1 20.8 34.8 2 1 A M + 0 0 29 72,-0.7 72,-0.2 1,-0.4 205,-0.1 0.325 360.0 29.1-135.2-122.8 19.6 21.8 31.5 3 2 A A - 0 0 16 70,-2.8 -1,-0.4 204,-0.2 205,-0.1 -0.284 51.6-158.7 -60.8 142.2 18.1 19.9 28.5 4 3 A T + 0 0 100 -3,-0.1 -1,-0.1 359,-0.1 360,-0.1 0.428 51.2 120.1-105.9 -3.9 16.3 16.7 29.6 5 4 A A S S- 0 0 16 1,-0.1 2,-0.1 358,-0.1 357,-0.1 -0.156 83.4 -78.7 -51.0 154.8 16.5 15.0 26.1 6 5 A P - 0 0 54 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.429 52.2-120.3 -60.7 125.4 18.3 11.6 25.9 7 6 A R - 0 0 86 -2,-0.1 2,-0.1 -3,-0.1 105,-0.0 -0.627 25.0-133.4 -74.5 122.3 22.1 12.5 25.8 8 7 A P - 0 0 14 0, 0.0 103,-1.7 0, 0.0 2,-0.3 -0.356 17.5-133.5 -71.2 154.9 23.7 11.1 22.6 9 8 A L B > -A 110 0A 67 101,-0.2 3,-1.9 1,-0.1 4,-0.2 -0.777 20.8-108.9-110.0 156.1 27.0 9.3 22.8 10 9 A R G > S+ 0 0 62 99,-1.4 3,-1.8 -2,-0.3 100,-0.1 0.787 113.4 62.7 -48.9 -41.1 30.3 9.6 20.8 11 10 A E G 3 S+ 0 0 146 1,-0.3 -1,-0.3 98,-0.1 98,-0.0 0.677 89.2 69.6 -70.0 -14.6 29.8 6.3 18.9 12 11 A Q G < S+ 0 0 84 -3,-1.9 2,-0.3 76,-0.0 -1,-0.3 0.534 93.5 70.9 -74.3 -6.3 26.6 7.6 17.4 13 12 A Y < - 0 0 12 -3,-1.8 75,-0.2 -4,-0.2 3,-0.1 -0.844 64.1-158.4-116.2 150.7 28.7 10.1 15.2 14 13 A L S S+ 0 0 96 73,-1.9 2,-0.4 -2,-0.3 74,-0.2 0.689 71.8 36.2-106.0 -23.5 31.0 9.2 12.3 15 14 A H E -B 87 0B 54 72,-1.7 72,-2.4 128,-0.1 2,-0.4 -0.999 64.5-159.2-137.3 140.3 33.5 12.0 11.9 16 15 A F E -B 86 0B 57 -2,-0.4 70,-0.2 70,-0.2 68,-0.0 -0.924 7.3-176.7-124.8 143.2 35.2 14.2 14.5 17 16 A Q E -B 85 0B 34 68,-2.3 68,-2.6 -2,-0.4 2,-0.1 -0.962 20.9-135.7-141.6 126.6 36.8 17.6 14.5 18 17 A P E -B 84 0B 85 0, 0.0 2,-0.4 0, 0.0 66,-0.3 -0.433 19.9-169.9 -71.9 145.7 38.6 19.5 17.1 19 18 A I E -B 83 0B 23 64,-1.5 64,-1.0 -2,-0.1 2,-0.2 -0.976 19.4-131.2-135.1 122.3 37.7 23.2 17.4 20 19 A S - 0 0 95 -2,-0.4 2,-0.2 62,-0.1 62,-0.1 -0.524 23.3-123.4 -72.7 141.5 39.7 25.5 19.6 21 20 A T - 0 0 16 60,-0.5 2,-0.3 -2,-0.2 -1,-0.1 -0.491 22.5-143.2 -81.2 154.1 37.8 27.7 22.0 22 21 A R >> - 0 0 186 -2,-0.2 3,-2.0 1,-0.1 4,-0.5 -0.812 23.9-107.4-120.4 158.6 38.3 31.5 21.9 23 22 A W G >4 S+ 0 0 193 -2,-0.3 3,-1.4 1,-0.3 56,-0.2 0.909 118.0 46.6 -50.3 -51.1 38.3 34.1 24.8 24 23 A H G 34 S+ 0 0 161 1,-0.3 -1,-0.3 8,-0.0 9,-0.2 0.332 84.6 90.7 -84.9 4.7 34.9 35.6 23.9 25 24 A D G <4 S+ 0 0 19 -3,-2.0 8,-2.7 7,-0.1 -1,-0.3 0.887 79.2 76.1 -57.2 -37.2 33.2 32.2 23.5 26 25 A N B << S-N 32 0C 33 -3,-1.4 6,-0.2 -4,-0.5 2,-0.1 -0.478 75.2-156.7 -73.4 141.5 32.4 32.7 27.2 27 26 A D > - 0 0 55 4,-2.2 3,-2.1 -2,-0.2 -1,-0.1 -0.327 43.4 -70.6-104.4-164.8 29.6 35.1 28.0 28 27 A I T 3 S+ 0 0 81 1,-0.3 -2,-0.1 2,-0.1 -1,-0.0 0.769 130.5 55.8 -64.7 -24.0 29.0 37.0 31.2 29 28 A Y T 3 S- 0 0 49 2,-0.2 -1,-0.3 1,-0.0 3,-0.1 0.447 117.5-111.2 -89.5 -0.5 27.9 33.9 33.2 30 29 A G S < S+ 0 0 36 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.374 81.1 92.4 100.3 -3.4 31.3 32.3 32.4 31 30 A H S S- 0 0 79 47,-0.1 -4,-2.2 -6,-0.1 -1,-0.3 -0.792 88.8 -70.9-118.2 168.2 30.5 29.4 30.0 32 31 A V B -N 26 0C 10 45,-2.6 -6,-0.3 -2,-0.3 45,-0.2 -0.316 60.7-110.4 -59.6 126.7 30.4 29.1 26.2 33 32 A N >> - 0 0 28 -8,-2.7 3,-0.9 -9,-0.2 4,-0.8 -0.253 17.2-120.6 -61.9 138.7 27.4 31.0 24.9 34 33 A N H >> S+ 0 0 16 1,-0.2 3,-0.7 2,-0.2 4,-0.6 0.853 112.2 58.1 -46.0 -38.5 24.5 29.0 23.4 35 34 A V H >> S+ 0 0 14 1,-0.2 3,-1.2 2,-0.2 4,-1.0 0.880 95.0 65.8 -59.8 -39.7 24.8 30.9 20.0 36 35 A T H <> S+ 0 0 23 -3,-0.9 4,-2.0 1,-0.3 3,-0.3 0.794 88.5 66.6 -58.2 -30.1 28.5 29.7 19.7 37 36 A Y H S+ 0 0 19 -4,-1.6 4,-3.5 -5,-0.2 5,-1.0 0.929 111.5 51.3 -57.0 -51.9 34.3 18.6 6.0 49 48 A L H X5S+ 0 0 0 -4,-2.3 6,-2.2 3,-0.2 4,-0.7 0.873 116.7 41.3 -59.7 -40.8 32.5 19.7 2.7 50 49 A I H X5S+ 0 0 67 -4,-2.5 4,-0.9 4,-0.2 -1,-0.2 0.964 122.4 37.0 -69.3 -57.5 35.5 21.7 1.6 51 50 A E H <5S+ 0 0 152 -4,-2.8 -2,-0.2 -5,-0.3 -3,-0.2 0.871 135.7 19.7 -67.2 -38.8 38.3 19.3 2.6 52 51 A R H <5S+ 0 0 72 -4,-3.5 -3,-0.2 -5,-0.3 -1,-0.2 0.749 130.6 39.9-103.4 -30.5 36.5 16.1 1.7 53 52 A G H < + 0 0 84 6,-0.2 4,-1.6 1,-0.1 6,-0.2 -0.860 19.9 174.8-105.7 96.1 34.6 25.8 -3.5 57 56 A I T 4 S+ 0 0 46 -2,-0.8 -1,-0.1 2,-0.2 -2,-0.0 0.770 77.0 51.4 -74.5 -24.0 33.3 28.6 -1.2 58 57 A Q T 4 S+ 0 0 140 1,-0.1 -1,-0.2 0, 0.0 -2,-0.1 0.928 133.8 1.7 -79.4 -45.1 35.2 31.4 -3.0 59 58 A G T 4 S+ 0 0 59 3,-0.0 -2,-0.2 0, 0.0 -1,-0.1 0.277 90.8 132.4-129.7 7.4 34.2 30.7 -6.7 60 59 A G < - 0 0 13 -4,-1.6 -5,-0.0 1,-0.1 64,-0.0 -0.384 50.8-143.2 -72.3 142.1 31.7 27.8 -6.6 61 60 A E S S+ 0 0 72 -2,-0.1 63,-2.6 63,-0.1 2,-0.4 0.541 84.3 60.2 -75.5 -9.7 28.5 28.0 -8.6 62 61 A V E -C 123 0B 32 61,-0.2 2,-0.3 -6,-0.2 61,-0.2 -0.962 65.0-174.8-127.6 135.2 26.5 26.1 -5.9 63 62 A I E -C 122 0B 8 59,-2.6 59,-2.7 -2,-0.4 2,-0.4 -0.960 24.7-120.2-131.0 153.0 26.0 27.1 -2.2 64 63 A G E -C 121 0B 12 -2,-0.3 2,-0.5 57,-0.2 57,-0.2 -0.770 22.7-160.5 -90.3 126.9 24.4 25.6 0.9 65 64 A L E -C 120 0B 62 55,-3.4 55,-2.3 -2,-0.4 2,-0.6 -0.953 16.7-134.2-104.4 131.8 21.5 27.6 2.5 66 65 A V E +C 119 0B 19 -2,-0.5 53,-0.2 53,-0.2 3,-0.1 -0.739 29.5 173.0 -82.3 121.0 20.8 26.7 6.1 67 66 A V E + 0 0 45 51,-2.6 146,-2.4 -2,-0.6 2,-0.3 0.605 62.2 1.7-109.3 -17.2 17.0 26.4 6.3 68 67 A S E +CD 118 212B 28 50,-0.8 50,-2.2 144,-0.2 -1,-0.4 -0.950 61.3 171.6-159.4 155.5 16.5 25.1 9.8 69 68 A S E -CD 117 211B 5 142,-1.9 142,-2.2 -2,-0.3 2,-0.3 -0.978 3.1-179.8-156.0 162.7 18.6 24.3 12.8 70 69 A S E -CD 116 210B 15 46,-2.3 46,-2.3 -2,-0.3 2,-0.3 -0.980 5.0-165.7-160.2 162.0 18.2 23.3 16.5 71 70 A C E -CD 115 209B 1 138,-2.4 138,-2.0 -2,-0.3 2,-0.4 -0.995 10.9-154.9-150.7 144.8 20.3 22.5 19.6 72 71 A D E -CD 114 208B 53 42,-3.2 42,-2.3 -2,-0.3 2,-0.6 -0.975 17.2-148.9-114.7 136.9 19.8 20.9 23.0 73 72 A Y E +C 113 0B 5 134,-2.6 -70,-2.8 -2,-0.4 40,-0.3 -0.932 21.7 170.3-111.9 117.4 22.3 21.9 25.7 74 73 A F - 0 0 11 38,-2.8 -72,-0.7 -2,-0.6 39,-0.2 0.819 67.5 -5.0 -98.5 -35.7 23.0 19.2 28.3 75 74 A A S S- 0 0 29 37,-2.1 -1,-0.3 -74,-0.1 132,-0.0 -0.965 76.0-103.1-159.6 146.5 26.0 20.6 30.2 76 75 A P - 0 0 65 0, 0.0 2,-0.3 0, 0.0 -43,-0.1 -0.169 24.1-170.8 -72.5 155.7 28.3 23.7 29.9 77 76 A V - 0 0 3 -45,-0.2 -45,-2.6 4,-0.0 2,-0.3 -0.867 11.6-153.7-127.3 170.7 31.8 23.9 28.6 78 77 A A > - 0 0 20 -2,-0.3 3,-3.0 -47,-0.3 -47,-0.1 -0.993 25.8 -73.6-146.3 138.5 34.1 27.0 28.9 79 78 A F T 3 S+ 0 0 58 -2,-0.3 3,-0.1 1,-0.3 -57,-0.0 -0.415 112.9 36.3 -50.4 137.1 37.0 28.5 27.1 80 79 A P T 3 S+ 0 0 97 0, 0.0 -1,-0.3 0, 0.0 -59,-0.2 -0.833 89.7 112.6-101.5 30.2 39.8 27.4 27.2 81 80 A Q S < S- 0 0 76 -3,-3.0 2,-0.5 1,-0.1 -60,-0.5 -0.248 70.0-119.5 -54.2 143.4 38.5 23.8 27.2 82 81 A R - 0 0 112 24,-0.2 24,-2.6 -62,-0.1 2,-0.2 -0.778 38.6-175.5 -88.5 130.0 39.4 21.8 24.1 83 82 A I E -BE 19 105B 2 -64,-1.0 -64,-1.5 -2,-0.5 2,-0.3 -0.697 14.0-158.1-120.0 167.5 36.2 20.6 22.4 84 83 A E E -BE 18 104B 28 20,-2.0 20,-2.8 -66,-0.3 2,-0.5 -0.979 12.2-136.2-149.3 146.3 35.4 18.4 19.4 85 84 A M E -BE 17 103B 1 -68,-2.6 -68,-2.3 -2,-0.3 2,-0.4 -0.889 10.2-150.8-105.7 127.3 32.4 18.1 17.2 86 85 A G E -BE 16 102B 0 16,-2.8 16,-1.6 -2,-0.5 2,-0.4 -0.793 18.8-167.1 -88.9 139.7 30.9 14.8 16.1 87 86 A L E +BE 15 101B 3 -72,-2.4 -73,-1.9 -2,-0.4 -72,-1.7 -0.989 17.2 159.8-131.4 133.2 29.1 14.8 12.8 88 87 A R E - E 0 100B 55 12,-2.1 12,-3.2 -2,-0.4 2,-0.6 -0.961 36.2-123.1-139.4 161.7 26.8 12.4 11.0 89 88 A V E - E 0 99B 2 54,-1.9 10,-0.2 -2,-0.3 3,-0.1 -0.897 19.9-173.9-100.5 123.8 24.4 12.8 8.1 90 89 A A E S+ 0 0 41 8,-2.6 2,-0.3 -2,-0.6 9,-0.2 0.810 72.9 8.0 -87.0 -37.9 20.9 11.7 9.1 91 90 A R E - E 0 98B 62 7,-1.4 7,-2.5 53,-0.0 2,-0.5 -0.990 58.1-164.8-147.0 148.2 19.4 12.1 5.6 92 91 A L E + E 0 97B 37 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.983 19.8 169.5-134.3 114.6 20.7 12.8 2.2 93 92 A G - 0 0 20 3,-3.1 39,-0.2 -2,-0.5 -2,-0.0 -0.396 50.2 -84.1-113.3-167.6 18.3 13.9 -0.5 94 93 A N S S+ 0 0 116 -2,-0.2 38,-3.1 1,-0.1 43,-0.1 0.943 121.3 1.8 -68.0 -51.9 18.6 15.3 -4.0 95 94 A S S S+ 0 0 33 36,-0.3 26,-2.7 34,-0.0 2,-0.3 0.503 126.9 56.9-114.8 -7.3 19.0 18.9 -3.0 96 95 A S E - F 0 120B 22 24,-0.2 -3,-3.1 36,-0.1 2,-0.3 -0.892 52.9-169.8-132.6 159.4 19.0 18.8 0.8 97 96 A V E -EF 92 119B 0 22,-2.3 22,-2.2 -2,-0.3 2,-0.6 -0.999 13.0-147.5-149.3 131.8 20.9 17.2 3.6 98 97 A Q E -EF 91 118B 6 -7,-2.5 -8,-2.6 -2,-0.3 -7,-1.4 -0.947 18.2-160.1-105.7 121.2 20.2 17.0 7.4 99 98 A Y E -EF 89 117B 2 18,-2.9 18,-1.5 -2,-0.6 2,-0.4 -0.723 7.9-153.8 -94.1 141.5 23.2 16.9 9.7 100 99 A E E +EF 88 116B 38 -12,-3.2 -12,-2.1 -2,-0.3 2,-0.3 -0.993 23.1 176.1-105.2 132.9 23.4 15.6 13.3 101 100 A L E -EF 87 115B 0 14,-2.5 14,-2.2 -2,-0.4 2,-0.3 -0.928 12.7-175.8-133.3 152.7 26.1 17.2 15.4 102 101 A A E -EF 86 114B 0 -16,-1.6 -16,-2.8 -2,-0.3 2,-0.4 -0.986 20.3-133.8-144.5 146.9 27.2 17.0 19.0 103 102 A L E +EF 85 113B 0 10,-1.9 9,-2.3 -2,-0.3 10,-1.2 -0.886 27.2 179.4 -99.1 138.0 29.9 18.8 21.0 104 103 A F E -E 84 0B 0 -20,-2.8 -20,-2.0 -2,-0.4 2,-0.1 -0.964 35.2-108.6-128.5 149.9 32.2 16.7 23.3 105 104 A L E -E 83 0B 29 5,-0.5 3,-0.3 -2,-0.3 2,-0.3 -0.550 50.6-101.8 -68.6 143.6 35.1 17.6 25.6 106 105 A E S S+ 0 0 105 -24,-2.6 -24,-0.2 1,-0.3 3,-0.1 -0.575 115.1 32.4 -68.9 131.2 38.2 16.3 23.9 107 106 A G S S+ 0 0 71 -2,-0.3 2,-0.3 1,-0.3 -1,-0.3 0.918 106.5 99.5 81.5 53.1 38.8 13.1 25.9 108 107 A Q - 0 0 89 -3,-0.3 -1,-0.3 1,-0.1 -98,-0.0 -0.949 55.5-153.8-171.8 155.2 35.2 12.3 26.6 109 108 A R + 0 0 50 -2,-0.3 -99,-1.4 -3,-0.1 2,-0.3 0.777 69.9 76.4 -99.7 -36.7 32.1 10.3 25.8 110 109 A E B S-A 9 0A 98 -101,-0.2 -5,-0.5 -100,-0.1 2,-0.3 -0.616 80.9-114.2 -88.5 139.2 28.9 12.1 26.8 111 110 A A - 0 0 0 -103,-1.7 -7,-0.2 -2,-0.3 3,-0.1 -0.553 15.0-162.2 -69.5 131.8 27.7 15.0 24.7 112 111 A C S S- 0 0 5 -9,-2.3 -38,-2.8 1,-0.3 -37,-2.1 0.775 82.9 -3.8 -73.1 -32.0 27.7 18.5 26.3 113 112 A A E -CF 73 103B 0 -10,-1.2 -10,-1.9 -40,-0.3 -1,-0.3 -0.981 64.6-168.4-155.2 159.4 25.2 19.5 23.5 114 113 A A E +CF 72 102B 8 -42,-2.3 -42,-3.2 -2,-0.3 2,-0.3 -0.980 18.8 140.7-154.3 144.8 23.6 18.1 20.4 115 114 A G E -CF 71 101B 6 -14,-2.2 -14,-2.5 -2,-0.3 2,-0.3 -0.844 28.7-127.1-163.3-168.3 21.6 19.5 17.5 116 115 A R E -CF 70 100B 46 -46,-2.3 -46,-2.3 -2,-0.3 2,-0.3 -0.959 11.6-169.8-148.6 160.7 20.9 19.4 13.8 117 116 A F E -CF 69 99B 2 -18,-1.5 -18,-2.9 -2,-0.3 2,-0.5 -0.966 15.3-134.3-156.2 159.3 20.6 21.5 10.8 118 117 A V E -CF 68 98B 16 -50,-2.2 -51,-2.6 -2,-0.3 -50,-0.8 -0.946 10.9-161.9-114.2 125.1 19.5 21.3 7.2 119 118 A H E -CF 66 97B 5 -22,-2.2 -22,-2.3 -2,-0.5 2,-0.4 -0.857 1.5-167.5 -90.3 138.0 21.3 22.5 4.1 120 119 A V E -CF 65 96B 28 -55,-2.3 -55,-3.4 -2,-0.4 2,-0.4 -0.994 21.4-134.8-116.9 136.2 19.5 23.1 0.8 121 120 A F E +C 64 0B 0 -26,-2.7 9,-2.0 -2,-0.4 2,-0.3 -0.741 30.5 174.9 -95.9 130.8 21.8 23.6 -2.1 122 121 A V E -CG 63 129B 2 -59,-2.7 -59,-2.6 -2,-0.4 2,-0.2 -0.937 40.9 -88.4-135.3 157.2 21.0 26.4 -4.5 123 122 A E E > -C 62 0B 63 5,-3.3 4,-2.7 -2,-0.3 -61,-0.2 -0.462 44.5-126.5 -61.9 128.2 22.4 28.1 -7.6 124 123 A R T 4 S+ 0 0 73 -63,-2.6 -1,-0.1 -2,-0.2 -62,-0.1 0.869 99.8 29.9 -46.5 -52.4 24.7 30.9 -6.2 125 124 A R T 4 S+ 0 0 115 -64,-0.2 -1,-0.2 1,-0.1 -63,-0.0 0.893 131.0 31.1 -80.3 -45.8 23.1 33.9 -8.1 126 125 A S T 4 S- 0 0 65 2,-0.1 -2,-0.2 1,-0.0 -1,-0.1 0.688 89.8-136.6 -89.8 -23.0 19.5 32.9 -8.5 127 126 A S < + 0 0 59 -4,-2.7 -3,-0.1 1,-0.3 -2,-0.0 0.633 49.8 150.8 64.9 20.5 19.0 30.8 -5.3 128 127 A R - 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0 0 92 -2,-0.4 2,-0.2 62,-0.1 62,-0.1 -0.554 25.3-123.0 -77.8 141.1 20.7 47.3 14.4 161 20 B T - 0 0 20 60,-0.3 2,-0.3 -2,-0.2 -1,-0.1 -0.604 22.8-144.9 -84.4 153.0 22.7 45.1 11.8 162 21 B R >> - 0 0 183 -2,-0.2 3,-1.9 1,-0.1 4,-0.5 -0.787 23.2-109.8-116.8 155.8 26.5 45.0 11.8 163 22 B W G >4 S+ 0 0 199 1,-0.3 3,-1.3 -2,-0.3 56,-0.2 0.910 116.4 46.5 -47.3 -55.3 29.0 44.7 9.0 164 23 B H G 34 S+ 0 0 164 1,-0.3 -1,-0.3 8,-0.0 9,-0.2 0.321 85.3 90.4 -81.3 9.6 30.1 41.1 9.8 165 24 B D G <4 S+ 0 0 19 -3,-1.9 8,-2.6 7,-0.1 -1,-0.3 0.897 78.0 76.6 -63.4 -37.4 26.6 39.9 10.3 166 25 B N B << S-P 172 0E 32 -3,-1.3 6,-0.2 -4,-0.5 2,-0.1 -0.510 76.1-154.9 -70.8 138.4 26.8 39.1 6.5 167 26 B D > - 0 0 55 4,-2.0 3,-2.3 -2,-0.2 -1,-0.1 -0.323 41.8 -70.3 -98.7-162.4 28.8 36.0 5.7 168 27 B I T 3 S+ 0 0 78 1,-0.3 -2,-0.1 2,-0.1 -1,-0.0 0.737 132.6 53.7 -64.9 -28.0 30.7 35.0 2.6 169 28 B Y T 3 S- 0 0 56 2,-0.2 -1,-0.3 1,-0.0 3,-0.1 0.414 118.2-112.4 -89.3 1.5 27.5 34.5 0.6 170 29 B G S < S+ 0 0 33 -3,-2.3 2,-0.3 1,-0.2 -2,-0.1 0.364 79.6 97.9 96.1 -3.6 26.4 38.0 1.5 171 30 B H S S- 0 0 81 47,-0.1 -4,-2.0 -6,-0.1 47,-0.3 -0.781 87.9 -74.9-114.0 161.0 23.3 37.5 3.8 172 31 B V B -P 166 0E 9 45,-3.2 -6,-0.3 -2,-0.3 45,-0.2 -0.322 60.4-112.5 -56.3 127.7 23.0 37.5 7.6 173 32 B N >> - 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