==== 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 13-NOV-98 3PVA . COMPND 2 MOLECULE: PROTEIN (PENICILLIN V ACYLASE); . SOURCE 2 ORGANISM_SCIENTIFIC: LYSINIBACILLUS SPHAERICUS; . AUTHOR C.G.SURESH,A.V.PUNDLE,K.N.RAO,H.SIVARAMAN,J.A.BRANNIGAN,C.E. . 2672 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 92275.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1629 61.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 72 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 649 24.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 32 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 24 0.9 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 . 2 0.1 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 . 196 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 254 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 346 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.0 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 3 5 16 0 0 6 0 2 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 8 8 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 . 12 28 24 8 35 15 0 8 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 . 24 0 0 0 0 8 2 6 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 C 0 0 7 0, 0.0 2,-0.3 0, 0.0 18,-0.2 0.000 360.0 360.0 360.0 158.6 33.4 48.1 65.7 2 2 A S E +A 18 0A 0 16,-0.5 16,-2.5 172,-0.1 2,-0.3 -0.948 360.0 175.2-128.8 157.9 37.1 48.3 66.7 3 3 A S E +AB 17 173A 0 170,-1.1 170,-3.1 -2,-0.3 2,-0.3 -0.979 8.3 162.0-166.0 148.7 40.1 46.3 65.6 4 4 A L E -AB 16 172A 0 12,-2.2 12,-3.0 -2,-0.3 2,-0.3 -0.951 21.4-139.9-159.0 167.5 43.9 45.9 65.9 5 5 A S E -A 15 0A 7 166,-1.7 2,-0.3 -2,-0.3 10,-0.3 -0.941 15.5-166.9-135.9 151.3 46.6 43.4 65.2 6 6 A I E -A 14 0A 25 8,-2.3 8,-2.2 -2,-0.3 2,-0.4 -0.890 16.9-133.2-132.2 169.7 49.7 42.5 67.3 7 7 A R E -A 13 0A 90 -2,-0.3 235,-0.4 6,-0.2 6,-0.2 -0.985 23.0-143.3-121.4 131.9 52.9 40.6 66.8 8 8 A T > - 0 0 3 4,-3.0 3,-0.7 -2,-0.4 235,-0.2 -0.329 25.3-114.3 -87.2-179.7 54.0 38.2 69.5 9 9 A T T 3 S+ 0 0 74 233,-1.9 234,-0.2 1,-0.2 235,-0.1 0.685 116.0 67.7 -84.5 -14.1 57.6 37.5 70.6 10 10 A D T 3 S- 0 0 69 232,-0.3 -1,-0.2 233,-0.2 3,-0.1 0.304 122.8-104.0 -74.5 -6.4 57.0 34.0 69.2 11 11 A D S < S+ 0 0 112 -3,-0.7 2,-0.4 1,-0.3 -2,-0.1 0.844 77.5 140.8 70.6 37.5 56.8 35.5 65.6 12 12 A K - 0 0 29 272,-0.1 -4,-3.0 273,-0.0 2,-0.4 -0.832 42.2-149.3-108.4 143.0 53.1 35.1 65.6 13 13 A S E -A 7 0A 1 -2,-0.4 271,-2.5 -6,-0.2 272,-0.5 -0.932 17.6-177.9-112.6 134.4 50.7 37.6 64.1 14 14 A L E -AC 6 283A 0 -8,-2.2 -8,-2.3 -2,-0.4 2,-0.4 -0.987 9.9-163.0-132.8 146.2 47.2 38.0 65.6 15 15 A F E -AC 5 282A 1 267,-2.1 267,-2.6 -2,-0.3 2,-0.3 -0.973 11.0-176.4-129.1 142.7 44.3 40.2 64.6 16 16 A A E +AC 4 281A 0 -12,-3.0 -12,-2.2 -2,-0.4 2,-0.3 -0.989 4.7 176.7-142.7 152.9 41.3 41.1 66.7 17 17 A R E -AC 3 280A 2 263,-1.9 263,-2.6 -2,-0.3 2,-0.3 -0.998 22.2-137.5-151.8 153.8 38.0 42.9 66.5 18 18 A T E -AC 2 279A 0 -16,-2.5 2,-0.6 -2,-0.3 -16,-0.5 -0.766 19.9-140.8-104.0 150.6 34.8 43.9 68.3 19 19 A M E - C 0 278A 35 259,-2.1 258,-1.9 -2,-0.3 259,-0.8 -0.969 19.8-173.9-113.8 106.3 31.4 43.7 66.5 20 20 A D E + C 0 276A 7 -2,-0.6 2,-0.3 256,-0.2 256,-0.2 -0.887 22.3 140.2-109.3 107.3 29.2 46.7 67.5 21 21 A F E - C 0 275A 27 254,-1.6 254,-1.7 -2,-0.7 -2,-0.1 -0.895 56.3-125.6-138.8 168.9 25.7 46.6 66.2 22 22 A T S S+ 0 0 40 -2,-0.3 2,-0.3 252,-0.2 251,-0.2 0.502 95.4 31.5 -90.6 -7.6 22.1 47.2 67.1 23 23 A M S S- 0 0 84 252,-0.1 254,-0.1 249,-0.1 -1,-0.1 -0.986 72.1-129.9-149.5 153.9 20.9 43.8 66.1 24 24 A E - 0 0 52 -2,-0.3 3,-0.1 -3,-0.1 2,-0.0 -0.840 21.8-164.9-110.7 93.9 22.3 40.2 66.1 25 25 A P - 0 0 28 0, 0.0 2,-0.2 0, 0.0 110,-0.0 -0.424 51.0 -77.7 -66.7 151.1 21.7 38.6 62.7 26 26 A D + 0 0 104 -2,-0.0 34,-0.3 33,-0.0 2,-0.3 -0.436 69.7 167.1 -61.7 121.2 22.2 34.9 63.0 27 27 A S + 0 0 11 -2,-0.2 292,-0.4 32,-0.1 2,-0.3 -0.913 8.8 161.9-130.8 153.1 26.0 34.6 63.0 28 28 A K E -G 58 0B 20 30,-1.6 30,-2.0 -2,-0.3 2,-0.5 -0.916 51.5 -79.0-160.0 169.6 28.1 31.5 63.9 29 29 A V E -GH 57 317B 0 288,-3.1 288,-2.9 -2,-0.3 2,-0.4 -0.714 53.1-162.8 -85.8 130.8 31.7 30.6 63.3 30 30 A I E -GH 56 316B 0 26,-2.6 26,-1.6 -2,-0.5 2,-0.6 -0.958 16.1-155.7-114.8 133.8 31.9 29.3 59.7 31 31 A I E -GH 55 315B 0 284,-2.6 284,-1.5 -2,-0.4 24,-0.2 -0.924 10.8-160.4-102.5 124.1 34.6 27.2 58.1 32 32 A V E -G 54 0B 0 22,-3.3 22,-2.4 -2,-0.6 2,-0.1 -0.944 14.2-147.0-105.6 117.8 34.6 27.6 54.3 33 33 A P > - 0 0 0 0, 0.0 3,-1.0 0, 0.0 4,-0.2 -0.492 31.9 -78.9 -81.2 157.3 36.4 24.7 52.6 34 34 A R T 3 S+ 0 0 77 275,-2.5 17,-0.2 1,-0.2 18,-0.1 -0.130 113.5 14.7 -55.1 148.3 38.5 25.0 49.5 35 35 A N T 3 S+ 0 0 87 15,-3.6 -1,-0.2 76,-0.2 16,-0.1 0.806 83.0 128.5 56.1 35.4 36.7 25.1 46.2 36 36 A Y < - 0 0 82 -3,-1.0 -2,-0.1 14,-0.3 -1,-0.1 0.862 63.7-134.2 -81.4 -39.8 33.3 25.8 47.9 37 37 A G - 0 0 5 -4,-0.2 2,-0.4 13,-0.1 12,-0.2 0.399 15.1-138.8 89.2 135.4 32.7 28.8 45.6 38 38 A I E -N 48 0C 0 10,-2.8 10,-2.6 26,-0.1 -1,-0.1 -0.988 14.8-121.1-129.4 132.8 31.5 32.3 46.5 39 39 A R E -N 47 0C 44 -2,-0.4 8,-0.2 8,-0.2 3,-0.1 -0.162 10.6-159.6 -63.6 157.0 29.1 34.6 44.7 40 40 A L S S+ 0 0 5 6,-1.1 61,-2.7 1,-0.5 2,-0.3 0.748 82.2 20.0-104.3 -42.0 30.4 38.0 43.6 41 41 A L - 0 0 13 5,-0.4 -1,-0.5 3,-0.3 3,-0.4 -0.936 67.3-140.8-125.9 148.9 26.9 39.6 43.4 42 42 A E S S+ 0 0 43 -2,-0.3 -1,-0.1 1,-0.2 21,-0.1 0.691 105.9 47.7 -83.5 -18.8 23.7 38.4 45.1 43 43 A K S S+ 0 0 180 -3,-0.0 2,-0.3 2,-0.0 -1,-0.2 0.207 108.7 62.4-104.6 12.7 21.6 39.3 42.0 44 44 A E S S- 0 0 98 -3,-0.4 -3,-0.3 2,-0.1 -4,-0.2 -0.977 74.3-141.1-134.0 145.5 24.0 37.5 39.6 45 45 A N + 0 0 137 -2,-0.3 2,-0.1 -6,-0.1 -3,-0.0 0.436 55.3 128.6 -95.8 8.1 24.8 33.8 39.6 46 46 A V - 0 0 67 1,-0.1 -6,-1.1 -7,-0.0 2,-0.5 -0.356 41.2-163.3 -61.4 127.5 28.5 34.0 38.8 47 47 A V E -N 39 0C 78 -8,-0.2 2,-0.5 -2,-0.1 -8,-0.2 -0.967 8.7-150.9-117.3 120.7 30.4 32.0 41.4 48 48 A I E -N 38 0C 44 -10,-2.6 -10,-2.8 -2,-0.5 2,-0.4 -0.784 22.2-127.2 -88.7 130.7 34.1 32.4 41.9 49 49 A N - 0 0 82 -2,-0.5 2,-0.6 -12,-0.2 -15,-0.1 -0.662 22.9-131.1 -77.7 131.7 35.8 29.2 43.1 50 50 A N - 0 0 0 -2,-0.4 -15,-3.6 -17,-0.2 -14,-0.3 -0.721 12.5-160.5 -89.0 124.7 37.8 29.8 46.2 51 51 A S S S+ 0 0 60 -2,-0.6 2,-0.3 60,-0.4 61,-0.2 0.843 72.0 55.0 -63.9 -41.2 41.4 28.5 46.3 52 52 A Y S S- 0 0 55 59,-3.3 2,-0.2 -18,-0.1 -17,-0.1 -0.813 72.6-131.4-109.4 149.7 41.7 28.6 50.1 53 53 A A + 0 0 0 -2,-0.3 20,-1.5 -19,-0.1 2,-0.3 -0.557 35.2 178.2 -81.3 151.4 39.9 27.3 53.1 54 54 A F E -GI 32 72B 0 -22,-2.4 -22,-3.3 18,-0.2 2,-0.4 -0.995 19.8-147.5-158.4 155.0 39.2 29.9 55.8 55 55 A V E +GI 31 71B 0 16,-2.9 16,-2.4 -2,-0.3 2,-0.3 -0.966 35.5 109.6-128.1 142.6 37.5 30.3 59.2 56 56 A G E -GI 30 70B 0 -26,-1.6 -26,-2.6 -2,-0.4 2,-0.5 -0.965 63.0 -58.5-179.0-165.7 35.7 33.2 60.9 57 57 A M E +GI 29 69B 0 12,-0.5 11,-3.8 -2,-0.3 12,-0.9 -0.883 68.6 123.2-102.5 131.7 32.5 34.8 62.1 58 58 A G E -GI 28 67B 0 -30,-2.0 -30,-1.6 -2,-0.5 2,-0.4 -0.917 52.7 -88.8-161.7-170.1 29.8 35.3 59.5 59 59 A S E - I 0 66B 6 7,-2.4 7,-3.3 -2,-0.3 3,-0.2 -0.898 8.8-166.2-117.5 148.7 26.3 34.7 58.2 60 60 A T + 0 0 49 -2,-0.4 -33,-0.1 -34,-0.3 -1,-0.1 0.059 63.8 107.0-112.3 20.4 24.9 31.8 56.2 61 61 A D S S+ 0 0 59 -35,-0.3 2,-0.2 5,-0.1 -1,-0.1 0.587 74.0 46.1 -80.8 -13.8 21.6 33.8 55.5 62 62 A I S S- 0 0 19 2,-0.4 4,-0.1 -3,-0.2 71,-0.0 -0.480 106.6 -76.0-115.6-172.6 22.3 34.6 51.8 63 63 A T S S+ 0 0 74 -2,-0.2 -21,-0.0 -21,-0.1 3,-0.0 0.949 113.9 27.0 -50.5 -62.7 23.6 32.6 48.8 64 64 A S S S- 0 0 7 1,-0.1 -2,-0.4 -26,-0.0 -26,-0.1 -0.700 104.0 -84.0-100.4 158.1 27.3 32.4 49.7 65 65 A P - 0 0 2 0, 0.0 2,-0.6 0, 0.0 -5,-0.2 -0.339 39.3-143.6 -57.4 134.4 28.7 32.6 53.2 66 66 A V E -I 59 0B 10 -7,-3.3 -7,-2.4 -4,-0.1 2,-0.4 -0.913 15.2-159.2-102.1 114.0 29.2 36.1 54.4 67 67 A L E -I 58 0B 0 -2,-0.6 39,-0.3 -9,-0.2 -9,-0.3 -0.759 18.3-173.4-102.4 138.3 32.3 36.6 56.6 68 68 A Y E S- 0 0 25 -11,-3.8 12,-3.1 -2,-0.4 2,-0.3 0.775 77.3 -21.0 -87.8 -35.0 32.7 39.4 59.0 69 69 A D E S+IJ 57 79B 0 -12,-0.9 -12,-0.5 10,-0.3 -1,-0.4 -0.881 77.8 142.5-159.9 175.6 36.3 38.6 59.9 70 70 A G E -IJ 56 78B 0 8,-1.2 8,-1.6 -2,-0.3 2,-0.3 -0.897 37.1-101.9 158.3 170.1 38.5 35.5 59.6 71 71 A V E -IJ 55 77B 0 -16,-2.4 -16,-2.9 -2,-0.3 6,-0.2 -0.936 26.5-137.1-121.5 152.5 41.8 33.7 58.9 72 72 A N E > -I 54 0B 0 4,-1.4 3,-0.7 -2,-0.3 -18,-0.2 -0.471 28.0-114.4 -89.8 174.6 43.0 31.7 56.0 73 73 A E T 3 S+ 0 0 10 -20,-1.5 -19,-0.1 1,-0.2 -1,-0.1 0.667 123.0 53.3 -84.8 -14.3 44.9 28.4 55.6 74 74 A K T 3 S- 0 0 84 -21,-0.3 75,-0.3 36,-0.2 -1,-0.2 0.425 122.8-105.5 -92.8 -10.5 47.6 30.8 54.2 75 75 A G < + 0 0 1 -3,-0.7 2,-0.3 1,-0.3 -2,-0.1 0.450 69.0 143.1 96.4 2.8 47.6 33.1 57.2 76 76 A L - 0 0 0 37,-0.3 -4,-1.4 72,-0.2 2,-0.3 -0.579 29.0-167.5 -81.8 135.6 45.8 36.1 55.8 77 77 A M E +JK 71 147B 0 70,-2.7 70,-3.0 -2,-0.3 2,-0.3 -0.929 15.7 148.6-120.5 149.3 43.6 37.8 58.3 78 78 A G E -JK 70 146B 0 -8,-1.6 -8,-1.2 -2,-0.3 2,-0.3 -0.986 20.8-160.6-168.7 170.4 40.9 40.5 57.7 79 79 A A E -JK 69 145B 0 66,-1.9 66,-1.7 -2,-0.3 2,-0.5 -0.989 21.4-124.1-159.9 153.0 37.6 42.0 58.7 80 80 A M E - K 0 144B 18 -12,-3.1 2,-0.3 -2,-0.3 64,-0.2 -0.855 33.2-178.3 -94.5 129.0 34.7 44.2 57.5 81 81 A L E - K 0 143B 0 62,-2.5 62,-2.8 -2,-0.5 93,-0.1 -0.922 31.6 -96.1-128.3 156.2 34.0 47.3 59.6 82 82 A Y E - K 0 142B 60 -2,-0.3 60,-0.3 60,-0.3 92,-0.0 -0.312 30.7-179.6 -64.9 151.1 31.4 50.1 59.3 83 83 A Y >> - 0 0 1 58,-2.0 4,-2.3 92,-0.2 3,-1.7 -0.364 16.5-170.6-150.8 54.4 32.3 53.3 57.5 84 84 A A T 34 + 0 0 25 57,-0.3 92,-0.0 1,-0.3 58,-0.0 -0.052 67.8 10.3 -52.2 143.9 29.1 55.4 57.7 85 85 A T T 34 S+ 0 0 92 1,-0.2 -1,-0.3 2,-0.1 1131,-0.1 0.417 127.7 57.6 72.7 -9.0 28.9 58.6 55.8 86 86 A F T <4 S+ 0 0 50 -3,-1.7 74,-0.3 73,-0.1 -2,-0.2 0.718 72.9 96.7-122.9 -44.1 32.1 57.8 53.9 87 87 A A < - 0 0 21 -4,-2.3 2,-0.4 72,-0.1 72,-0.2 -0.346 52.4-172.8 -57.2 125.1 31.7 54.5 52.1 88 88 A T - 0 0 63 70,-3.2 2,-0.4 -2,-0.1 40,-0.1 -0.984 4.8-169.5-127.2 125.8 30.7 55.1 48.4 89 89 A Y - 0 0 26 -2,-0.4 40,-0.2 50,-0.1 41,-0.1 -0.963 17.8-126.1-117.0 142.1 29.7 52.4 46.0 90 90 A A B -o 129 0D 23 38,-1.6 40,-2.4 -2,-0.4 37,-0.0 -0.243 11.0-132.1 -77.3 167.7 29.1 52.6 42.2 91 91 A D S S+ 0 0 136 1,-0.2 -1,-0.1 38,-0.2 38,-0.1 0.865 91.0 19.4 -86.4 -40.5 26.0 51.6 40.3 92 92 A E S S- 0 0 149 36,-0.1 -1,-0.2 37,-0.0 3,-0.1 -0.934 96.9 -91.4-127.6 151.9 27.7 49.6 37.5 93 93 A P - 0 0 42 0, 0.0 3,-0.1 0, 0.0 6,-0.1 -0.268 47.7-102.6 -59.0 149.6 31.2 48.2 37.5 94 94 A K > - 0 0 125 1,-0.2 3,-1.1 4,-0.2 33,-0.0 -0.398 63.4 -65.5 -69.6 154.7 34.0 50.4 36.1 95 95 A K T 3 S+ 0 0 198 1,-0.3 -1,-0.2 -3,-0.1 3,-0.1 -0.169 121.6 4.9 -47.9 119.9 35.0 49.4 32.6 96 96 A G T 3 S+ 0 0 87 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 -0.180 107.6 98.9 101.5 -50.1 36.6 45.9 32.6 97 97 A T S < S- 0 0 27 -3,-1.1 2,-0.3 29,-0.1 -1,-0.3 -0.302 70.2-124.0 -66.0 163.9 36.1 45.0 36.2 98 98 A T E -p 126 0E 70 27,-2.5 29,-2.0 -3,-0.1 2,-0.2 -0.803 30.4-109.5-107.3 151.4 33.3 42.8 37.6 99 99 A G E -p 127 0E 2 -2,-0.3 2,-0.4 27,-0.2 29,-0.2 -0.484 32.0-166.9 -80.1 150.1 31.0 44.2 40.3 100 100 A I E -p 128 0E 1 27,-2.4 29,-2.5 -2,-0.2 -59,-0.2 -0.994 24.5-119.0-136.3 138.4 31.2 42.8 43.8 101 101 A N >> - 0 0 0 -61,-2.7 3,-3.0 -2,-0.4 4,-0.5 -0.694 25.5-129.4 -73.9 130.5 28.7 43.2 46.7 102 102 A P G >4 S+ 0 0 0 0, 0.0 3,-0.8 0, 0.0 4,-0.3 0.809 107.0 62.0 -51.7 -30.2 30.5 45.0 49.6 103 103 A V G 34 S+ 0 0 9 1,-0.2 4,-0.3 2,-0.1 -36,-0.2 0.572 101.2 52.3 -72.9 -14.2 29.3 42.2 51.9 104 104 A Y G <> S+ 0 0 0 -3,-3.0 4,-2.5 -64,-0.2 5,-0.3 0.489 79.2 96.0-106.8 0.4 31.2 39.6 50.0 105 105 A V H S+ 0 0 0 -39,-0.3 4,-3.2 -4,-0.3 5,-0.3 0.945 112.7 47.8 -64.3 -46.5 36.0 39.3 53.0 107 107 A S H > S+ 0 0 0 -4,-0.3 4,-2.2 -40,-0.3 -1,-0.2 0.931 116.5 44.2 -60.3 -45.3 34.9 35.9 51.8 108 108 A Q H X S+ 0 0 9 -4,-2.5 4,-0.6 2,-0.2 -1,-0.2 0.906 116.8 45.0 -62.4 -46.1 36.3 36.5 48.4 109 109 A V H >X S+ 0 0 5 -4,-2.8 4,-2.2 -5,-0.3 3,-1.0 0.956 115.9 45.9 -67.8 -45.3 39.6 38.0 49.7 110 110 A L H 3< S+ 0 0 0 -4,-3.2 -37,-0.2 1,-0.3 -36,-0.2 0.891 111.4 52.7 -65.3 -36.1 40.1 35.3 52.4 111 111 A G H 3< S+ 0 0 0 -4,-2.2 -59,-3.3 -5,-0.3 -60,-0.4 0.624 124.8 23.0 -73.4 -17.0 39.3 32.5 49.9 112 112 A N H << S+ 0 0 23 -3,-1.0 2,-0.3 -4,-0.6 -2,-0.2 0.573 101.8 72.6-133.0 -5.0 41.8 33.7 47.4 113 113 A C < - 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0 0 26 -16,-1.4 -16,-0.2 -3,-0.3 -1,-0.1 -0.133 47.7 -84.9 -86.8-170.3 1.7 116.2 19.4 1845 170 F I - 0 0 18 2,-0.2 -165,-0.2 -302,-0.1 3,-0.1 0.518 61.4-113.2 -81.1 -5.0 1.6 116.1 15.6 1846 171 F G S S+ 0 0 6 1,-0.3 -166,-1.9 -167,-0.1 2,-0.3 0.829 79.2 112.3 80.8 33.9 3.3 112.7 15.4 1847 172 F V E +Z 1679 0n 2 -168,-0.2 2,-0.3 -19,-0.0 -1,-0.3 -0.991 34.1 165.9-136.9 140.6 6.5 113.8 13.8 1848 173 F M E +Z 1678 0n 3 -170,-2.7 -170,-0.9 -2,-0.3 2,-0.1 -0.916 9.3 148.9-164.8 128.0 10.0 113.8 15.3 1849 174 F T - 0 0 1 1,-0.4 -172,-0.1 -2,-0.3 2,-0.1 0.215 55.2 -54.7-124.9-117.0 13.5 114.1 14.0 1850 175 F N S S+ 0 0 13 1,-0.3 -1,-0.4 50,-0.1 -92,-0.2 -0.200 75.9 12.3-119.7-155.8 16.4 115.6 15.9 1851 176 F S S S+ 0 0 0 369,-0.3 -1,-0.3 -2,-0.1 50,-0.2 -0.299 81.8 54.1 -66.8 158.9 17.2 118.9 17.7 1852 177 F P S S- 0 0 1 0, 0.0 -91,-0.1 0, 0.0 -93,-0.0 0.267 95.8 -74.6 -75.8-151.1 16.1 121.3 18.7 1853 178 F G >> - 0 0 14 -2,-0.2 4,-1.8 1,-0.1 3,-0.5 -0.216 39.8-108.1 -68.2 157.6 13.1 120.7 21.0 1854 179 F Y H 3> S+ 0 0 5 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.929 118.7 52.8 -54.0 -48.5 9.7 119.6 20.0 1855 180 F E H 3> S+ 0 0 117 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.878 106.0 54.6 -55.9 -36.7 8.1 123.0 20.7 1856 181 F W H <> S+ 0 0 19 -3,-0.5 4,-2.6 2,-0.2 3,-0.2 0.976 112.3 42.8 -59.4 -52.3 10.7 124.7 18.5 1857 182 F H H X S+ 0 0 4 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.902 111.2 53.5 -59.7 -44.1 9.8 122.5 15.6 1858 183 F Q H X S+ 0 0 39 -4,-2.6 4,-0.6 -5,-0.2 -1,-0.2 0.878 111.1 47.3 -60.1 -38.6 6.1 122.7 16.0 1859 184 F T H >< S+ 0 0 20 -4,-2.1 3,-1.2 -3,-0.2 4,-0.3 0.941 105.0 60.7 -69.4 -43.7 6.3 126.5 16.0 1860 185 F N H >< S+ 0 0 7 -4,-2.6 3,-2.6 1,-0.3 4,-0.5 0.856 89.8 71.2 -50.3 -42.8 8.5 126.4 12.9 1861 186 F L H >< S+ 0 0 0 -4,-1.9 3,-2.5 1,-0.3 4,-0.3 0.859 87.8 65.1 -39.7 -51.3 5.7 124.6 11.0 1862 187 F R T << S+ 0 0 31 -3,-1.2 3,-0.4 -4,-0.6 -1,-0.3 0.630 93.0 58.1 -50.8 -23.4 3.7 128.0 10.9 1863 188 F A T < S+ 0 0 19 -3,-2.6 -1,-0.3 -4,-0.3 3,-0.2 0.544 110.8 46.5 -78.7 -14.4 6.3 129.8 8.7 1864 189 F Y X + 0 0 26 -3,-2.5 3,-2.7 -4,-0.5 -2,-0.2 0.372 68.7 114.2-113.9 10.0 5.7 127.1 6.1 1865 190 F I T 3 S+ 0 0 2 -3,-0.4 -1,-0.1 -4,-0.3 -327,-0.1 0.685 72.0 67.8 -55.4 -17.2 1.9 126.8 6.0 1866 191 F G T 3 S+ 0 0 29 -3,-0.2 2,-0.8 -329,-0.1 -1,-0.3 0.458 72.0 100.6 -83.0 -4.5 2.1 128.1 2.3 1867 192 F V < + 0 0 0 -3,-2.7 24,-0.3 24,-0.1 23,-0.1 -0.734 56.6 151.0 -77.7 105.6 3.9 124.9 1.2 1868 193 F T - 0 0 34 22,-2.2 24,-0.1 -2,-0.8 -2,-0.1 -0.922 60.5-108.2-134.5 173.1 0.9 123.1 -0.4 1869 194 F P S S+ 0 0 8 0, 0.0 408,-2.0 0, 0.0 21,-0.3 0.782 88.8 92.2 -69.2 -25.2 0.2 120.6 -3.2 1870 195 F N S S- 0 0 83 20,-0.2 -2,-0.2 406,-0.2 408,-0.1 -0.503 75.9-113.6 -87.9 138.0 -1.4 123.3 -5.5 1871 196 F P - 0 0 34 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.219 31.0-107.6 -68.4 144.8 0.1 125.4 -8.2 1872 197 F P - 0 0 24 0, 0.0 -341,-0.1 0, 0.0 17,-0.1 -0.365 41.4-101.6 -67.4 148.9 0.5 129.2 -8.0 1873 198 F Q - 0 0 177 1,-0.1 2,-0.1 -343,-0.1 0, 0.0 -0.339 43.7-100.7 -66.7 152.6 -1.8 131.2 -10.2 1874 199 F D - 0 0 101 -3,-0.1 2,-0.2 9,-0.0 9,-0.2 -0.477 44.7-167.9 -72.5 148.8 -0.2 132.6 -13.4 1875 200 F I E -P 1882 0s 23 7,-1.7 7,-2.3 -2,-0.1 2,-0.3 -0.671 12.2-128.7-126.7-178.5 0.9 136.2 -13.3 1876 201 F M E -P 1881 0s 88 -2,-0.2 2,-0.4 5,-0.2 5,-0.2 -0.955 5.4-160.3-133.9 154.0 2.0 138.9 -15.7 1877 202 F M E > S-P 1880 0s 17 3,-1.9 3,-2.5 -2,-0.3 2,-0.4 -0.899 76.3 -54.7-132.9 94.6 5.0 141.3 -15.7 1878 203 F G T 3 S- 0 0 66 -2,-0.4 -368,-0.1 1,-0.3 -369,-0.0 -0.551 124.5 -19.9 69.9-120.6 4.0 144.0 -18.1 1879 204 F D T 3 S+ 0 0 154 -2,-0.4 2,-0.4 -3,-0.1 -1,-0.3 0.337 113.5 111.2 -96.5 1.0 3.1 142.0 -21.2 1880 205 F L E < -P 1877 0s 43 -3,-2.5 -3,-1.9 -371,-0.0 2,-0.5 -0.712 60.7-143.0 -82.8 127.0 5.1 139.0 -20.1 1881 206 F D E -P 1876 0s 121 -2,-0.4 2,-0.6 -5,-0.2 -5,-0.2 -0.788 16.2-160.7 -87.1 124.9 3.1 135.9 -19.3 1882 207 F L E +P 1875 0s 3 -7,-2.3 -7,-1.7 -2,-0.5 -358,-0.0 -0.949 18.5 163.1-113.7 120.3 4.7 134.0 -16.4 1883 208 F T - 0 0 40 -2,-0.6 -10,-0.1 -9,-0.2 -9,-0.0 -0.919 41.2 -87.2-133.3 153.5 3.8 130.4 -15.8 1884 209 F P - 0 0 17 0, 0.0 -356,-0.1 0, 0.0 -1,-0.1 -0.133 32.9-119.5 -57.7 153.0 5.3 127.5 -13.8 1885 210 F F S S- 0 0 6 -358,-0.1 301,-0.4 2,-0.1 2,-0.2 0.826 80.6 -59.6 -61.3 -33.4 8.0 125.2 -15.4 1886 211 F G S S- 0 0 26 1,-0.2 2,-0.2 299,-0.1 3,-0.1 -0.532 93.0 -21.5-170.4-112.0 5.6 122.3 -14.9 1887 212 F Q S S+ 0 0 53 346,-0.2 -1,-0.2 -2,-0.2 -2,-0.1 -0.494 101.0 56.3-109.9 178.3 4.0 120.8 -11.8 1888 213 F G > + 0 0 8 -19,-0.3 3,-1.8 389,-0.3 345,-0.6 0.188 55.6 124.6 92.4 -17.1 5.2 121.2 -8.2 1889 214 F A G > + 0 0 17 1,-0.3 3,-1.5 344,-0.2 -19,-0.1 0.584 57.3 78.9 -62.9 -8.8 5.4 124.9 -7.5 1890 215 F G G 3 S+ 0 0 8 -21,-0.3 -22,-2.2 1,-0.3 -1,-0.3 0.695 87.1 64.2 -68.7 -21.3 3.1 124.9 -4.5 1891 216 F G G X + 0 0 3 -3,-1.8 3,-2.4 -24,-0.3 -1,-0.3 0.431 65.7 136.7 -83.7 -3.0 6.1 123.7 -2.5 1892 217 F L T < + 0 0 28 -3,-1.5 -24,-0.1 1,-0.2 -335,-0.0 -0.273 69.5 35.9 -46.0 117.9 8.2 126.8 -3.0 1893 218 F G T 3 S+ 0 0 20 1,-0.4 -1,-0.2 -335,-0.1 -335,-0.1 -0.087 80.5 117.3 123.8 -38.5 9.7 127.3 0.4 1894 219 F L < - 0 0 3 -3,-2.4 337,-3.4 -30,-0.1 338,-0.6 -0.496 64.6-127.4 -65.0 130.5 10.3 123.8 1.7 1895 220 F P B -Q 2230 0t 22 0, 0.0 11,-0.1 0, 0.0 332,-0.1 -0.462 12.8-157.1 -76.5 145.5 14.0 123.3 2.2 1896 221 F G + 0 0 3 333,-3.2 331,-0.1 330,-0.2 -2,-0.0 0.502 56.8 105.7-103.8 -2.5 15.7 120.3 0.6 1897 222 F D S S- 0 0 9 332,-0.6 327,-0.1 329,-0.1 330,-0.0 -0.273 75.5-117.6 -72.9 170.5 18.7 119.9 2.8 1898 223 F F + 0 0 6 325,-0.6 324,-0.2 4,-0.1 326,-0.2 0.179 64.5 129.8-101.7 20.3 19.2 117.2 5.5 1899 224 F T S > S- 0 0 12 324,-0.4 4,-3.2 1,-0.1 5,-0.2 -0.337 71.2-111.0 -67.0 156.8 19.3 119.3 8.6 1900 225 F P H > S+ 0 0 2 0, 0.0 4,-2.7 0, 0.0 -1,-0.1 0.865 117.3 49.2 -56.0 -44.8 17.0 118.1 11.4 1901 226 F S H > S+ 0 0 10 2,-0.2 4,-2.0 -50,-0.2 5,-0.2 0.937 112.5 47.3 -64.3 -47.7 14.7 121.1 11.1 1902 227 F A H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.971 112.6 49.6 -58.6 -54.1 14.4 120.8 7.4 1903 228 F R H X S+ 0 0 9 -4,-3.2 4,-2.7 1,-0.2 5,-0.3 0.872 107.6 56.0 -52.6 -40.4 13.7 117.0 7.8 1904 229 F F H X S+ 0 0 2 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.969 109.9 44.3 -52.3 -59.1 11.0 117.9 10.4 1905 230 F L H X S+ 0 0 3 -4,-2.0 4,-3.0 1,-0.2 5,-0.3 0.890 112.8 52.4 -49.8 -49.4 9.2 120.2 7.9 1906 231 F R H X S+ 0 0 8 -4,-2.5 4,-1.7 1,-0.2 5,-0.3 0.912 112.4 43.1 -62.3 -42.3 9.5 117.7 5.1 1907 232 F V H X S+ 0 0 0 -4,-2.7 4,-2.3 -5,-0.2 -2,-0.2 0.939 117.9 47.2 -70.0 -41.3 8.1 114.8 7.1 1908 233 F A H X S+ 0 0 0 -4,-2.7 4,-2.5 -5,-0.3 -2,-0.2 0.972 114.5 42.8 -64.4 -55.7 5.3 117.0 8.5 1909 234 F Y H X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 -3,-0.2 0.956 118.7 44.3 -59.3 -49.0 4.2 118.7 5.3 1910 235 F W H X S+ 0 0 5 -4,-1.7 4,-3.0 -5,-0.3 -1,-0.2 0.868 110.5 56.7 -65.2 -29.9 4.3 115.4 3.3 1911 236 F K H < S+ 0 0 56 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.923 109.3 47.2 -64.2 -42.3 2.5 113.6 6.2 1912 237 F K H < S+ 0 0 75 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.909 121.4 34.5 -60.7 -45.9 -0.2 116.2 5.9 1913 238 F Y H < S+ 0 0 42 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.682 90.3 93.0 -95.2 -17.7 -0.6 115.9 2.1 1914 239 F T S < S- 0 0 15 -4,-3.0 360,-0.2 -5,-0.1 3,-0.1 -0.447 89.9 -85.5 -73.9 152.1 0.1 112.3 1.1 1915 240 F E - 0 0 85 358,-1.9 -1,-0.1 1,-0.1 2,-0.1 -0.134 46.3 -96.6 -56.6 146.7 -3.1 110.1 0.9 1916 241 F K - 0 0 140 1,-0.1 2,-0.4 -3,-0.1 -1,-0.1 -0.360 41.7-111.0 -61.3 135.9 -4.6 108.4 3.9 1917 242 F A - 0 0 2 -235,-0.4 -233,-2.4 1,-0.2 -232,-0.4 -0.547 21.7-158.4 -71.5 126.6 -3.5 104.8 4.2 1918 243 F K S S- 0 0 109 -2,-0.4 2,-0.2 -235,-0.2 -1,-0.2 0.755 73.2 -6.2 -79.7 -20.0 -6.6 102.6 3.6 1919 244 F N S > S- 0 0 45 -235,-0.1 4,-1.8 -234,-0.1 -235,-0.1 -0.837 89.1 -78.6-154.0-172.3 -5.1 99.6 5.4 1920 245 F E H > S+ 0 0 0 424,-0.8 4,-2.7 -2,-0.2 5,-0.1 0.856 123.8 50.8 -69.4 -36.9 -1.8 98.5 7.2 1921 246 F T H > S+ 0 0 38 423,-1.1 4,-2.4 2,-0.2 5,-0.2 0.931 111.9 47.2 -69.8 -39.3 0.1 97.6 4.0 1922 247 F E H > S+ 0 0 60 1,-0.2 4,-4.2 2,-0.2 5,-0.3 0.949 111.1 55.7 -60.5 -43.6 -0.7 101.0 2.4 1923 248 F G H X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.921 107.1 46.5 -49.4 -55.7 0.3 102.4 5.7 1924 249 F V H X S+ 0 0 1 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.908 117.5 43.0 -61.0 -40.3 3.8 100.8 5.6 1925 250 F T H X S+ 0 0 9 -4,-2.4 4,-1.1 1,-0.2 -2,-0.2 0.892 114.1 49.5 -80.0 -29.3 4.3 101.9 2.0 1926 251 F N H X S+ 0 0 16 -4,-4.2 4,-2.4 -5,-0.2 3,-0.5 0.937 110.2 53.0 -65.7 -42.5 3.0 105.4 2.5 1927 252 F L H X S+ 0 0 0 -4,-2.5 4,-1.9 -5,-0.3 -2,-0.2 0.858 109.9 46.8 -61.2 -38.6 5.2 105.7 5.6 1928 253 F F H < S+ 0 0 7 -4,-1.6 4,-0.3 2,-0.2 -1,-0.3 0.661 109.9 55.5 -76.7 -19.9 8.3 104.7 3.6 1929 254 F H H >X S+ 0 0 22 -4,-1.1 3,-0.6 -3,-0.5 4,-0.6 0.888 108.4 46.1 -79.6 -42.6 7.3 107.2 0.9 1930 255 F I H >< S+ 0 0 2 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.980 113.8 49.2 -61.2 -51.4 7.2 110.1 3.2 1931 256 F L G >< S+ 0 0 1 -4,-1.9 3,-1.1 1,-0.3 -1,-0.2 0.533 94.6 74.0 -65.6 -8.3 10.5 109.1 4.8 1932 257 F S G X4 S+ 0 0 13 -3,-0.6 3,-1.1 1,-0.3 -1,-0.3 0.752 86.5 64.3 -79.8 -20.1 12.1 108.8 1.4 1933 258 F S G << S+ 0 0 11 -3,-1.7 -1,-0.3 -4,-0.6 -2,-0.2 0.540 109.7 39.1 -72.7 -12.3 12.1 112.6 1.2 1934 259 F V G < S+ 0 0 0 -3,-1.1 2,-0.8 -4,-0.1 -1,-0.2 -0.068 85.4 127.2-126.3 27.1 14.5 112.5 4.2 1935 260 F N < - 0 0 16 -3,-1.1 -3,-0.1 332,-0.1 332,-0.1 -0.727 50.7-144.9 -91.0 113.2 16.6 109.5 3.1 1936 261 F I - 0 0 2 -2,-0.8 15,-1.6 -38,-0.1 2,-0.1 -0.618 4.4-146.1 -84.7 112.5 20.3 110.2 3.1 1937 262 F P > - 0 0 1 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.428 39.3 -91.0 -67.7 139.2 22.5 108.6 0.4 1938 263 F K T 3 S+ 0 0 48 1,-0.2 312,-1.7 2,-0.1 12,-0.1 -0.266 112.0 24.2 -53.0 130.6 26.0 107.8 1.6 1939 264 F G T 3 S+ 0 0 8 2,-0.4 -1,-0.2 310,-0.3 310,-0.1 0.127 95.0 91.9 100.9 -22.4 28.4 110.7 0.9 1940 265 F V S < S+ 0 0 3 -3,-1.9 2,-0.4 1,-0.2 -2,-0.1 0.779 90.2 43.1 -80.5 -23.9 25.9 113.6 0.8 1941 266 F V + 0 0 5 -4,-0.4 8,-2.0 8,-0.4 -2,-0.4 -0.992 69.0 178.6-122.9 128.0 26.3 114.3 4.5 1942 267 F L B -R 1948 0u 40 262,-2.3 281,-0.3 -2,-0.4 6,-0.2 -0.975 20.2-135.4-126.7 142.0 29.7 114.4 6.3 1943 268 F T > - 0 0 14 4,-2.5 3,-0.9 -2,-0.4 279,-0.0 -0.118 38.7 -94.8 -77.4-173.6 30.5 115.2 9.9 1944 269 F N T 3 S+ 0 0 144 1,-0.3 -1,-0.1 2,-0.1 261,-0.0 0.880 132.4 57.2 -69.2 -36.0 33.3 117.4 11.1 1945 270 F E T 3 S- 0 0 155 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.578 121.0-116.1 -61.5 -20.2 35.2 114.2 11.4 1946 271 F G < + 0 0 44 -3,-0.9 2,-0.2 1,-0.3 -2,-0.1 0.579 67.6 143.9 88.5 9.4 34.5 113.6 7.7 1947 272 F K - 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0 0 1 -2,-0.3 362,-3.0 360,-0.1 2,-0.4 -0.627 22.2-158.4 -77.7 130.9 10.7 95.2 3.0 1975 300 F S E -Cd19662336n 11 -9,-2.6 -9,-1.9 -2,-0.3 2,-0.4 -0.913 5.0-154.8-113.7 142.6 11.0 92.4 5.5 1976 301 F A E -Cd19652337n 0 360,-2.7 362,-2.5 -2,-0.4 363,-0.8 -0.935 13.0-174.7-124.6 142.2 8.4 91.6 8.2 1977 302 F V E -C 1964 0n 0 -13,-2.8 -13,-3.2 -2,-0.4 2,-0.6 -0.985 17.2-146.0-124.3 137.4 8.5 89.9 11.6 1978 303 F S E -C 1963 0n 9 -2,-0.4 3,-0.5 -15,-0.2 4,-0.3 -0.936 3.5-161.9-105.3 121.4 5.3 89.2 13.5 1979 304 F L S > S+ 0 0 0 -17,-2.0 3,-2.1 -2,-0.6 -1,-0.2 0.971 90.0 53.4 -63.7 -51.9 5.7 89.5 17.3 1980 305 F M T 3 S+ 0 0 88 -19,-0.4 -1,-0.2 -18,-0.3 4,-0.1 0.629 94.4 71.5 -59.2 -17.3 2.6 87.5 18.1 1981 306 F A T 3 S+ 0 0 50 -3,-0.5 -1,-0.3 2,-0.1 -2,-0.2 0.659 92.7 69.2 -75.0 -16.1 3.7 84.5 16.0 1982 307 F E S < S- 0 0 57 -3,-2.1 2,-0.9 -4,-0.3 357,-0.0 -0.495 99.3 -92.4 -99.1 170.4 6.4 83.7 18.5 1983 308 F N > - 0 0 100 -2,-0.2 3,-1.8 1,-0.1 -2,-0.1 -0.736 32.1-161.5 -84.8 111.3 6.2 82.2 22.0 1984 309 F L T 3 S+ 0 0 11 -2,-0.9 -275,-2.0 1,-0.3 -1,-0.1 0.484 88.7 55.8 -73.8 -2.4 6.2 85.3 24.2 1985 310 F N T 3 S+ 0 0 90 -277,-0.2 -1,-0.3 -275,-0.0 -2,-0.1 0.254 76.2 133.2-110.1 10.9 7.2 83.2 27.2 1986 311 F S < - 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