==== 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-APR-06 2GOK . COMPND 2 MOLECULE: IMIDAZOLONEPROPIONASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AGROBACTERIUM TUMEFACIENS STR.; . AUTHOR R.TYAGI,D.KUMARAN,S.SWAMINATHAN,S.K.BURLEY,NEW YORK SGX RESE . 808 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28735.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 583 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 90 11.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 72 8.9 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 . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 54 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 82 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 224 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 28 3.5 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 2 0 6 8 2 1 4 1 2 2 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 6 5 5 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 PARALLEL BRIDGES PER LADDER . 4 2 0 4 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 2 2 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 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 17 A A 0 0 93 0, 0.0 31,-2.2 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 160.9 41.5 -12.4 45.3 2 18 A T E +A 31 0A 44 29,-0.2 51,-0.5 30,-0.1 2,-0.3 -0.927 360.0 176.3-135.5 159.4 43.4 -12.0 42.0 3 19 A A E -Ab 30 53A 14 27,-1.8 27,-2.8 -2,-0.3 2,-0.4 -0.982 15.5-143.7-161.9 152.4 42.5 -11.6 38.3 4 20 A L E -Ab 29 54A 3 49,-2.3 51,-2.2 -2,-0.3 2,-0.5 -0.958 4.8-167.1-126.6 142.9 44.1 -11.0 35.0 5 21 A W E +Ab 28 55A 9 23,-1.8 23,-1.9 -2,-0.4 51,-0.2 -0.934 28.6 167.6-126.8 101.3 43.1 -8.9 31.9 6 22 A R E + b 0 56A 70 49,-2.6 51,-3.0 -2,-0.5 53,-0.3 -0.560 44.0 46.5-112.8 178.5 45.2 -9.8 28.9 7 23 A N E S+ 0 0 55 19,-0.3 52,-3.4 1,-0.2 53,-0.5 0.962 87.3 128.3 55.7 55.4 45.3 -9.3 25.2 8 24 A A E -A 26 0A 2 18,-1.6 18,-3.3 51,-0.2 2,-0.5 -0.942 60.1-127.2-140.3 160.8 44.6 -5.6 25.6 9 25 A Q E - c 0 61A 44 51,-2.4 53,-2.6 -2,-0.3 2,-0.4 -0.913 32.2-148.8-106.9 133.1 45.9 -2.2 24.6 10 26 A L E -Ac 23 62A 0 13,-2.9 13,-2.7 -2,-0.5 2,-0.6 -0.862 26.9-170.6-113.9 140.6 46.5 0.2 27.4 11 27 A A E +A 22 0A 3 51,-2.5 11,-0.2 -2,-0.4 10,-0.2 -0.846 22.4 172.9-115.0 83.2 46.3 4.0 27.8 12 28 A T - 0 0 0 9,-2.1 353,-2.4 -2,-0.6 9,-0.2 0.748 27.6-148.0 -69.1 -25.6 48.0 4.0 31.2 13 29 A L + 0 0 4 7,-2.6 8,-0.2 1,-0.2 -1,-0.1 0.764 31.1 172.8 59.5 26.2 48.2 7.7 31.4 14 30 A N > - 0 0 30 6,-0.2 3,-2.1 7,-0.2 -1,-0.2 -0.534 33.4-140.5 -66.8 121.6 51.4 7.2 33.4 15 31 A P T 3 S+ 0 0 77 0, 0.0 -1,-0.2 0, 0.0 4,-0.1 0.639 99.4 63.6 -60.8 -14.2 52.9 10.7 33.9 16 32 A A T 3 S+ 0 0 92 2,-0.1 2,-0.2 5,-0.0 -2,-0.1 0.608 95.8 71.9 -85.5 -13.1 56.4 9.2 33.3 17 33 A M S < S- 0 0 77 -3,-2.1 2,-0.1 2,-0.1 0, 0.0 -0.661 89.5-104.9-101.3 158.2 55.5 8.2 29.8 18 34 A D S > S- 0 0 158 -2,-0.2 3,-2.2 2,-0.1 4,-0.3 -0.381 84.3 -8.7 -76.2 160.5 55.0 10.4 26.7 19 35 A G T 3 S- 0 0 32 1,-0.3 -2,-0.1 2,-0.1 0, 0.0 -0.251 132.8 -25.6 54.6-132.7 51.6 11.2 25.4 20 36 A I T 3 S- 0 0 25 -7,-0.0 -7,-2.6 -8,-0.0 -1,-0.3 0.190 91.1-106.8 -98.1 15.8 48.9 9.0 27.1 21 37 A G < - 0 0 2 -3,-2.2 -9,-2.1 -9,-0.2 2,-0.2 0.957 47.1-164.9 59.8 55.4 51.3 6.3 27.9 22 38 A A E -A 11 0A 61 -4,-0.3 2,-0.4 -11,-0.2 -11,-0.2 -0.509 9.3-169.8 -76.4 136.2 50.1 3.7 25.4 23 39 A V E -A 10 0A 17 -13,-2.7 -13,-2.9 -2,-0.2 3,-0.3 -0.983 9.2-150.2-129.9 120.2 51.1 0.1 25.8 24 40 A E E S+ 0 0 115 -2,-0.4 17,-0.2 1,-0.2 -15,-0.1 -0.539 77.7 12.0 -85.4 153.7 50.5 -2.5 23.0 25 41 A N E S+ 0 0 94 -2,-0.2 16,-2.2 1,-0.1 17,-0.4 0.943 96.7 156.8 42.4 69.7 49.9 -6.2 23.8 26 42 A A E -AD 8 40A 0 -18,-3.3 -18,-1.6 -3,-0.3 -19,-0.3 -0.654 32.6-153.4-120.3 176.1 49.5 -5.5 27.5 27 43 A V E - D 0 39A 0 12,-2.4 12,-1.8 -2,-0.2 2,-0.4 -0.964 8.0-144.3-146.0 158.3 48.0 -7.1 30.6 28 44 A I E -AD 5 38A 0 -23,-1.9 -23,-1.8 -2,-0.3 2,-0.5 -0.984 10.9-162.0-130.6 120.1 46.6 -5.9 33.9 29 45 A A E -AD 4 37A 4 8,-2.5 7,-3.1 -2,-0.4 8,-1.5 -0.887 11.0-165.5-102.6 130.1 47.0 -8.0 37.1 30 46 A V E -AD 3 35A 7 -27,-2.8 -27,-1.8 -2,-0.5 2,-0.4 -0.935 10.8-179.4-119.9 140.7 44.7 -7.1 40.0 31 47 A R E > S-AD 2 34A 140 3,-2.7 3,-1.1 -2,-0.4 -29,-0.2 -0.961 73.6 -15.4-141.2 119.4 45.0 -8.2 43.6 32 48 A N T 3 S- 0 0 103 -31,-2.2 -30,-0.1 -2,-0.4 3,-0.1 0.871 128.8 -51.2 55.8 42.7 42.5 -7.2 46.3 33 49 A G T 3 S+ 0 0 17 1,-0.3 338,-2.3 -32,-0.2 2,-0.3 0.635 119.1 110.3 72.7 14.9 41.0 -4.5 44.1 34 50 A R E < S-DE 31 370A 81 -3,-1.1 -3,-2.7 336,-0.3 2,-0.7 -0.887 76.7-108.2-121.9 151.9 44.4 -3.0 43.4 35 51 A I E +D 30 0A 2 334,-3.0 333,-2.7 -2,-0.3 334,-0.3 -0.701 32.6 176.4 -80.9 114.3 46.6 -2.9 40.3 36 52 A A E S- 0 0 32 -7,-3.1 2,-0.3 -2,-0.7 -6,-0.2 0.806 71.1 -3.9 -85.1 -33.5 49.5 -5.3 40.8 37 53 A F E -D 29 0A 41 -8,-1.5 -8,-2.5 329,-0.1 -1,-0.3 -0.974 54.7-178.7-160.4 146.5 50.9 -4.7 37.3 38 54 A A E +D 28 0A 22 -2,-0.3 -10,-0.2 -10,-0.2 329,-0.2 -0.858 48.5 63.1-151.2 107.8 50.0 -2.9 34.1 39 55 A G E S+D 27 0A 3 -12,-1.8 -12,-2.4 -2,-0.3 5,-0.1 -0.984 81.8 1.1 169.8-162.7 52.2 -3.1 31.1 40 56 A P E > -D 26 0A 41 0, 0.0 3,-1.0 0, 0.0 4,-0.3 -0.167 55.5-132.1 -50.9 136.4 53.6 -5.4 28.3 41 57 A E T 3 S+ 0 0 56 -16,-2.2 3,-0.5 1,-0.3 -15,-0.1 0.744 109.2 59.4 -62.9 -21.0 52.5 -9.0 28.6 42 58 A S T 3 S+ 0 0 109 -17,-0.4 -1,-0.3 1,-0.2 -16,-0.1 0.764 101.3 51.3 -78.1 -28.1 56.2 -9.9 28.2 43 59 A D S < S+ 0 0 101 -3,-1.0 -1,-0.2 2,-0.1 -2,-0.2 0.385 80.6 130.6 -89.7 3.4 57.2 -7.9 31.3 44 60 A L - 0 0 20 -3,-0.5 5,-0.1 -4,-0.3 2,-0.1 -0.385 63.7-117.6 -61.5 124.2 54.6 -9.7 33.4 45 61 A P > - 0 0 38 0, 0.0 3,-1.2 0, 0.0 4,-0.2 -0.366 12.3-129.3 -63.9 140.2 56.1 -11.0 36.6 46 62 A D G > S+ 0 0 137 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.793 111.4 62.5 -59.9 -26.5 56.0 -14.8 37.0 47 63 A D G 3 S+ 0 0 135 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.831 111.1 36.7 -66.7 -32.5 54.5 -14.1 40.4 48 64 A L G < S+ 0 0 44 -3,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.196 90.3 95.4-105.0 14.0 51.6 -12.5 38.7 49 65 A S S < S+ 0 0 55 -3,-0.9 2,-0.4 -4,-0.2 -1,-0.2 0.734 83.2 56.9 -74.9 -22.9 51.5 -14.9 35.7 50 66 A T + 0 0 110 -4,-0.4 2,-0.3 -3,-0.3 -47,-0.1 -0.870 65.9 166.0-112.8 144.3 48.8 -16.9 37.5 51 67 A A - 0 0 25 -2,-0.4 -48,-0.1 -49,-0.1 3,-0.1 -0.970 47.6-112.6-151.0 164.2 45.4 -15.6 38.8 52 68 A D S S+ 0 0 116 -2,-0.3 2,-0.3 1,-0.2 -49,-0.2 0.852 105.5 17.1 -66.7 -35.2 42.1 -16.9 40.1 53 69 A E E -b 3 0A 135 -51,-0.5 -49,-2.3 -3,-0.0 2,-0.4 -0.985 67.7-162.0-139.4 148.9 40.4 -15.5 37.0 54 70 A T E -b 4 0A 80 -2,-0.3 2,-0.4 -51,-0.2 -49,-0.2 -0.984 2.6-163.4-132.9 143.3 41.6 -14.4 33.5 55 71 A T E -b 5 0A 44 -51,-2.2 -49,-2.6 -2,-0.4 2,-0.7 -0.992 12.2-146.6-131.2 128.4 39.9 -12.2 30.9 56 72 A D E -b 6 0A 99 -2,-0.4 -49,-0.2 -51,-0.2 -48,-0.1 -0.840 8.6-164.2 -93.1 119.4 40.8 -11.9 27.2 57 73 A C > - 0 0 3 -51,-3.0 3,-2.1 -2,-0.7 -50,-0.1 0.348 31.4-125.7 -87.0 6.6 40.1 -8.3 26.1 58 74 A G T 3 - 0 0 46 1,-0.3 -50,-0.2 -52,-0.2 -51,-0.1 0.780 66.8 -61.5 55.7 30.3 40.2 -9.1 22.4 59 75 A G T 3 S+ 0 0 23 -52,-3.4 -1,-0.3 -53,-0.3 -51,-0.2 0.614 95.3 155.0 73.9 10.1 42.8 -6.4 21.8 60 76 A R < - 0 0 74 -3,-2.1 -51,-2.4 -53,-0.5 2,-0.2 -0.307 47.7-101.1 -70.8 155.4 40.4 -3.7 23.0 61 77 A W E -cF 9 376A 23 315,-0.7 315,-2.9 317,-0.4 2,-0.4 -0.543 33.4-163.4 -78.8 140.2 41.6 -0.4 24.5 62 78 A I E +cF 10 375A 0 -53,-2.6 -51,-2.5 -2,-0.2 313,-0.2 -0.989 10.8 174.2-126.9 132.6 41.7 0.1 28.2 63 79 A T E - F 0 374A 8 311,-2.4 311,-2.5 -2,-0.4 -51,-0.1 -0.815 44.9 -83.5-128.0 168.6 41.9 3.4 30.0 64 80 A P E - F 0 373A 1 0, 0.0 309,-0.3 0, 0.0 -1,-0.1 -0.380 66.0 -87.4 -65.4 158.1 41.7 4.4 33.6 65 81 A A - 0 0 0 307,-2.0 68,-0.2 332,-0.1 298,-0.1 -0.388 54.6-100.6 -64.4 148.8 38.1 4.8 34.6 66 82 A L E -i 133 0B 3 66,-2.0 68,-2.6 65,-0.1 69,-1.2 -0.342 33.2-149.3 -72.8 155.7 36.8 8.3 33.8 67 83 A I E -i 135 0B 0 281,-2.5 2,-0.8 66,-0.2 69,-0.2 -0.993 9.4-158.4-129.8 129.1 36.5 10.9 36.6 68 84 A D E +i 136 0B 0 67,-2.4 69,-2.7 -2,-0.4 3,-0.1 -0.862 15.5 179.4-106.7 95.4 34.0 13.8 36.7 69 85 A C E + 0 0 1 -2,-0.8 2,-0.2 243,-0.4 -1,-0.1 0.369 65.0 44.7 -81.4 4.1 35.7 16.2 39.1 70 86 A H E + 0 0 0 242,-0.1 245,-2.1 67,-0.1 246,-0.4 -0.729 69.9 130.9-153.6 98.8 33.1 18.9 39.1 71 87 A T E -i 138 0B 0 66,-0.6 68,-1.5 244,-0.2 246,-0.1 -0.969 45.2-152.9-144.4 161.1 29.3 18.3 39.4 72 88 A H + 0 0 4 244,-2.8 66,-0.1 -2,-0.3 68,-0.0 -0.423 40.0 156.0-124.5 48.2 26.2 19.4 41.2 73 89 A L + 0 0 0 64,-0.3 2,-0.5 244,-0.1 51,-0.1 0.726 50.7 75.6 -50.1 -30.3 24.6 16.0 40.7 74 90 A V + 0 0 0 65,-0.4 2,-0.3 -3,-0.1 44,-0.1 -0.788 62.0 111.5 -95.3 124.8 22.3 16.4 43.7 75 91 A F - 0 0 8 -2,-0.5 2,-0.3 42,-0.3 31,-0.1 -0.928 57.5-105.5-178.1 158.1 19.3 18.7 43.4 76 92 A G S S- 0 0 0 29,-0.6 33,-0.3 -2,-0.3 32,-0.2 -0.701 76.2 -15.4 -95.5 150.6 15.5 18.8 43.4 77 93 A G S S- 0 0 21 -2,-0.3 2,-0.3 31,-0.2 28,-0.1 -0.037 76.0-101.3 59.3-159.8 13.5 19.4 40.2 78 94 A N - 0 0 32 26,-0.0 3,-0.2 239,-0.0 241,-0.1 -0.925 12.0-121.6-152.4 174.5 14.9 20.8 37.0 79 95 A R > + 0 0 20 239,-0.4 4,-1.3 -2,-0.3 5,-0.1 -0.077 67.4 120.4-116.6 32.9 14.9 24.1 35.1 80 96 A A H > + 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.791 68.9 65.1 -66.3 -27.6 13.2 23.1 31.8 81 97 A M H > S+ 0 0 56 -3,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.969 106.0 39.0 -60.1 -56.0 10.5 25.6 32.4 82 98 A E H > S+ 0 0 3 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.779 110.5 61.1 -66.8 -27.0 12.7 28.7 32.2 83 99 A F H X S+ 0 0 38 -4,-1.3 4,-1.7 2,-0.2 -1,-0.2 0.966 109.5 42.7 -60.5 -51.1 14.6 27.1 29.4 84 100 A E H X S+ 0 0 64 -4,-2.3 4,-1.1 1,-0.2 662,-0.2 0.894 113.7 52.0 -61.0 -43.8 11.4 27.1 27.4 85 101 A M H ><>S+ 0 0 43 -4,-2.3 5,-2.3 1,-0.2 3,-0.8 0.939 107.1 51.4 -60.5 -48.7 10.4 30.6 28.5 86 102 A R H ><5S+ 0 0 109 -4,-2.9 3,-1.6 1,-0.3 -1,-0.2 0.888 108.3 51.7 -56.1 -43.0 13.7 32.1 27.5 87 103 A L H 3<5S+ 0 0 20 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.754 105.5 56.5 -66.9 -24.2 13.4 30.6 24.0 88 104 A N T <<5S- 0 0 97 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.339 127.3 -99.7 -87.9 6.2 9.9 32.1 23.7 89 105 A G T < 5 + 0 0 61 -3,-1.6 -3,-0.2 1,-0.2 -2,-0.1 0.625 65.1 162.8 88.0 14.4 11.4 35.6 24.4 90 106 A A < - 0 0 24 -5,-2.3 -1,-0.2 -6,-0.2 2,-0.1 -0.395 34.8-126.1 -68.1 142.0 10.5 35.8 28.1 91 107 A T > - 0 0 72 1,-0.1 4,-2.2 -2,-0.1 5,-0.2 -0.433 22.9-110.4 -83.2 162.8 12.3 38.5 30.1 92 108 A Y H > S+ 0 0 167 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.880 122.1 56.2 -59.7 -36.9 14.2 37.6 33.2 93 109 A E H > S+ 0 0 113 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.897 108.3 46.6 -61.4 -41.4 11.5 39.6 35.1 94 110 A E H > S+ 0 0 95 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.848 113.1 48.9 -70.0 -35.5 8.9 37.3 33.6 95 111 A I H <>S+ 0 0 2 -4,-2.2 5,-2.9 2,-0.2 -2,-0.2 0.898 108.6 53.4 -71.5 -39.8 10.8 34.2 34.4 96 112 A A H ><5S+ 0 0 42 -4,-2.9 3,-1.8 1,-0.2 -2,-0.2 0.932 108.2 50.3 -60.0 -45.2 11.4 35.3 37.9 97 113 A K H 3<5S+ 0 0 167 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.787 104.8 57.6 -64.1 -27.7 7.6 35.8 38.4 98 114 A A T 3<5S- 0 0 47 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.428 128.3-100.2 -82.0 1.8 7.0 32.3 37.0 99 115 A G T < 5S+ 0 0 20 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.2 0.625 77.4 141.4 89.9 15.8 9.3 31.0 39.8 100 116 A G < + 0 0 3 -5,-2.9 3,-0.3 -6,-0.1 -1,-0.2 -0.255 22.7 66.0 -86.0 174.7 12.4 30.6 37.7 101 117 A G S >> S- 0 0 6 1,-0.2 3,-1.9 2,-0.1 4,-0.6 -0.451 105.7 -49.5 104.3 177.8 16.0 31.3 38.5 102 118 A I H >> S+ 0 0 62 1,-0.3 4,-2.2 2,-0.2 3,-0.6 0.784 128.2 73.3 -59.7 -25.5 18.3 29.5 41.0 103 119 A V H 3> S+ 0 0 51 -3,-0.3 4,-3.0 1,-0.2 -1,-0.3 0.816 88.9 62.0 -58.4 -28.3 15.6 30.0 43.7 104 120 A S H <> S+ 0 0 24 -3,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.917 106.8 42.6 -63.9 -43.2 13.7 27.2 41.8 105 121 A S H - 0 0 49 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.174 30.0-105.9 -65.6 163.3 13.4 14.4 51.5 114 130 A D H > S+ 0 0 87 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.898 122.5 54.4 -56.8 -41.1 16.9 12.9 51.5 115 131 A E H > S+ 0 0 148 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.892 108.8 46.4 -60.8 -43.5 15.3 9.7 50.0 116 132 A V H > S+ 0 0 57 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.894 109.8 53.0 -69.4 -39.1 13.7 11.6 47.1 117 133 A L H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -42,-0.3 0.883 107.5 53.5 -63.0 -36.1 16.9 13.5 46.3 118 134 A V H X S+ 0 0 16 -4,-2.0 4,-1.9 -5,-0.2 3,-0.2 0.951 110.9 46.0 -62.1 -47.0 18.7 10.2 46.2 119 135 A A H < S+ 0 0 56 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.841 110.7 51.8 -66.0 -35.3 16.2 8.9 43.7 120 136 A Q H < S+ 0 0 63 -4,-2.4 4,-0.4 1,-0.2 -1,-0.2 0.806 112.7 47.0 -72.0 -25.4 16.2 12.0 41.5 121 137 A A H >X S+ 0 0 0 -4,-1.6 4,-2.5 -3,-0.2 3,-0.7 0.796 93.4 77.5 -84.4 -31.2 20.0 11.8 41.4 122 138 A L H 3X S+ 0 0 31 -4,-1.9 4,-3.3 1,-0.2 5,-0.2 0.859 90.7 52.6 -49.4 -45.1 20.3 8.1 40.5 123 139 A P H 3> S+ 0 0 57 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.874 112.6 45.8 -62.0 -35.2 19.4 8.5 36.8 124 140 A R H <> S+ 0 0 28 -3,-0.7 4,-1.8 -4,-0.4 -2,-0.2 0.920 113.9 48.5 -70.9 -45.1 22.1 11.2 36.4 125 141 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.950 111.8 50.0 -59.1 -49.2 24.6 9.1 38.3 126 142 A D H X S+ 0 0 55 -4,-3.3 4,-2.2 1,-0.2 -1,-0.2 0.845 105.6 55.8 -61.0 -34.4 23.7 6.0 36.2 127 143 A T H < S+ 0 0 31 -4,-1.6 4,-0.4 -5,-0.2 -1,-0.2 0.926 111.1 44.9 -65.6 -39.4 24.1 7.9 32.9 128 144 A L H ><>S+ 0 0 0 -4,-1.8 3,-1.6 1,-0.2 5,-1.5 0.931 112.1 51.2 -67.5 -45.0 27.7 8.9 33.9 129 145 A L H ><5S+ 0 0 9 -4,-2.6 3,-2.1 1,-0.3 -1,-0.2 0.863 100.9 62.8 -59.9 -36.7 28.5 5.3 35.1 130 146 A S T 3<5S+ 0 0 48 -4,-2.2 -1,-0.3 1,-0.3 263,-0.2 0.669 101.0 55.4 -62.9 -15.8 27.2 4.0 31.8 131 147 A E T < 5S- 0 0 14 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.213 128.6 -93.6-101.1 11.8 30.0 6.0 30.2 132 148 A G T < 5S+ 0 0 0 -3,-2.1 -66,-2.0 1,-0.3 2,-0.3 0.610 74.0 149.2 89.5 9.9 32.8 4.4 32.2 133 149 A V E < +i 66 0B 0 -5,-1.5 -1,-0.3 -68,-0.2 -66,-0.2 -0.617 12.4 165.2 -78.1 136.8 32.9 7.0 35.0 134 150 A S E + 0 0 0 -68,-2.6 32,-3.3 -2,-0.3 2,-0.4 0.528 61.5 49.8-126.1 -17.1 34.0 5.6 38.4 135 151 A T E +ij 67 166B 0 -69,-1.2 -67,-2.4 30,-0.2 2,-0.4 -0.996 63.3 177.5-128.3 130.6 34.8 8.6 40.5 136 152 A I E -ij 68 167B 0 30,-2.7 32,-2.1 -2,-0.4 2,-0.5 -0.996 20.9-145.5-138.0 133.9 32.5 11.6 40.8 137 153 A E E - j 0 168B 1 -69,-2.7 -66,-0.6 -2,-0.4 2,-0.4 -0.846 19.1-168.0 -97.3 131.0 32.7 14.8 42.8 138 154 A I E -ij 71 169B 2 30,-2.6 32,-2.0 -2,-0.5 2,-0.2 -0.981 2.2-159.2-123.2 131.4 29.3 16.2 44.1 139 155 A K E - j 0 170B 2 -68,-1.5 -65,-0.4 -2,-0.4 32,-0.2 -0.669 9.5-145.9-105.8 159.1 28.8 19.6 45.6 140 156 A S + 0 0 0 30,-1.6 -1,-0.2 -2,-0.2 9,-0.1 0.138 49.9 121.7 -94.5-140.5 26.1 20.9 47.9 141 157 A G + 0 0 0 -2,-0.1 -1,-0.1 -35,-0.0 8,-0.1 0.552 53.3 84.2 100.0 0.9 25.2 24.6 47.3 142 158 A Y S S+ 0 0 7 6,-0.1 -32,-0.2 -37,-0.1 -33,-0.2 0.122 84.5 60.9-119.4 15.8 21.4 24.4 46.5 143 159 A G - 0 0 0 -34,-0.1 5,-0.1 -33,-0.1 3,-0.1 0.812 68.0-172.7-103.5 -53.7 20.4 24.4 50.2 144 160 A L + 0 0 5 1,-0.2 2,-0.3 28,-0.1 49,-0.1 0.717 63.2 75.2 62.4 22.7 21.7 27.7 51.4 145 161 A D S > S- 0 0 41 1,-0.1 4,-2.4 47,-0.1 5,-0.2 -0.941 93.6-107.4-152.1 154.0 20.8 26.8 55.0 146 162 A I H > S+ 0 0 41 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.919 113.0 49.2 -54.5 -51.2 22.6 24.4 57.3 147 163 A E H > S+ 0 0 121 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.903 115.6 42.2 -58.8 -44.1 20.1 21.6 57.3 148 164 A T H > S+ 0 0 9 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.878 111.5 54.3 -73.8 -35.5 19.7 21.4 53.5 149 165 A E H X S+ 0 0 1 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.924 112.6 44.3 -63.0 -41.7 23.4 21.8 52.8 150 166 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.869 108.7 57.6 -69.6 -36.9 24.1 18.8 55.1 151 167 A K H X S+ 0 0 33 -4,-1.9 4,-2.5 -5,-0.2 -1,-0.2 0.913 104.1 53.0 -59.2 -42.5 21.2 16.8 53.6 152 168 A M H X S+ 0 0 1 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.906 109.5 47.9 -60.1 -42.1 22.8 17.2 50.1 153 169 A L H X S+ 0 0 1 -4,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.893 111.0 50.6 -66.7 -39.1 26.2 15.8 51.4 154 170 A R H X S+ 0 0 89 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.909 109.2 52.0 -64.4 -40.8 24.4 12.9 53.1 155 171 A V H X S+ 0 0 2 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.931 109.3 50.1 -59.6 -45.6 22.6 12.2 49.8 156 172 A A H X S+ 0 0 0 -4,-2.2 4,-1.0 1,-0.2 -2,-0.2 0.918 112.0 46.9 -60.1 -44.9 25.9 12.2 48.0 157 173 A R H >< S+ 0 0 56 -4,-2.4 3,-0.6 1,-0.2 4,-0.4 0.908 110.4 53.6 -62.8 -42.5 27.5 9.8 50.6 158 174 A R H >< S+ 0 0 131 -4,-2.8 3,-1.6 1,-0.2 4,-0.4 0.849 98.9 62.7 -62.0 -36.1 24.4 7.5 50.4 159 175 A L H >X S+ 0 0 0 -4,-2.1 3,-1.5 1,-0.3 4,-0.9 0.861 95.2 61.3 -57.9 -35.7 24.7 7.3 46.6 160 176 A E T << S+ 0 0 73 -4,-1.0 5,-0.4 -3,-0.6 -1,-0.3 0.721 100.9 54.2 -64.6 -20.9 28.1 5.6 47.0 161 177 A T T <4 S+ 0 0 87 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.517 107.5 50.4 -91.0 -5.6 26.3 2.8 48.9 162 178 A L T <4 S+ 0 0 55 -3,-1.5 -2,-0.2 -4,-0.4 -1,-0.2 0.575 115.7 28.6-106.6 -12.5 23.8 2.2 46.1 163 179 A R S < S- 0 0 84 -4,-0.9 2,-1.9 2,-0.1 -1,-0.2 -0.973 87.0 -97.1-146.6 158.5 26.3 1.9 43.1 164 180 A P S S+ 0 0 48 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 -0.553 80.3 118.4 -77.2 82.6 29.9 0.8 42.4 165 181 A V - 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0 0 14 -3,-0.7 -1,-0.5 41,-0.1 41,-0.1 -0.954 65.1 -96.1-168.0 167.6 25.0 32.2 46.7 177 193 A T - 0 0 11 -2,-0.3 5,-0.1 -3,-0.1 8,-0.1 -0.789 38.7-126.0 -97.6 142.1 22.9 33.9 49.3 178 194 A P > - 0 0 9 0, 0.0 3,-2.3 0, 0.0 4,-0.4 -0.315 39.5 -85.1 -78.1 171.8 19.3 32.8 49.8 179 195 A A G > S+ 0 0 92 1,-0.3 3,-1.0 2,-0.2 -2,-0.0 0.837 127.2 51.6 -44.8 -46.6 16.4 35.3 49.7 180 196 A D G 3 S+ 0 0 104 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.534 112.4 46.2 -75.1 -3.7 16.6 36.3 53.4 181 197 A Y G X S+ 0 0 36 -3,-2.3 3,-2.5 2,-0.0 -1,-0.2 0.276 73.7 134.9-119.2 9.8 20.4 37.0 53.2 182 198 A K T < S+ 0 0 123 -3,-1.0 -3,-0.0 -4,-0.4 -6,-0.0 -0.382 80.8 16.9 -61.4 134.5 20.6 39.1 50.0 183 199 A G T 3 S+ 0 0 80 -2,-0.1 -1,-0.3 1,-0.0 3,-0.2 0.388 113.2 86.1 82.8 -4.6 22.7 42.1 50.6 184 200 A R <> + 0 0 100 -3,-2.5 4,-2.1 1,-0.1 5,-0.2 -0.384 39.5 147.6-125.3 55.9 24.1 40.4 53.7 185 201 A N H > S+ 0 0 33 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.871 75.3 54.0 -56.4 -40.1 27.0 38.2 52.4 186 202 A A H > S+ 0 0 53 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.939 109.8 44.3 -62.3 -48.9 28.9 38.6 55.7 187 203 A D H > S+ 0 0 69 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.834 110.9 56.1 -65.6 -33.9 26.0 37.4 58.0 188 204 A Y H X>S+ 0 0 0 -4,-2.1 4,-2.9 -7,-0.2 5,-1.7 0.938 110.1 44.3 -63.4 -45.6 25.3 34.5 55.6 189 205 A I H <>S+ 0 0 1 -4,-2.2 5,-2.9 3,-0.2 -2,-0.2 0.937 117.4 47.0 -63.3 -43.5 28.9 33.4 56.0 190 206 A T H <5S+ 0 0 58 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.890 123.3 31.2 -63.8 -43.2 28.7 33.9 59.8 191 207 A D H <5S+ 0 0 70 -4,-3.2 -2,-0.2 -5,-0.1 -3,-0.2 0.805 136.1 11.1 -89.6 -34.8 25.3 32.2 60.2 192 208 A V T X5S+ 0 0 12 -4,-2.9 4,-2.2 -5,-0.3 5,-0.2 0.807 122.0 47.3-111.7 -56.0 25.2 29.5 57.6 193 209 A V H > S+ 0 0 52 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.880 115.0 51.9 -65.1 -34.2 28.5 26.9 61.3 196 212 A G H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.884 107.7 51.4 -67.1 -38.2 27.5 24.5 58.5 197 213 A L H X S+ 0 0 0 -4,-2.1 4,-2.8 -5,-0.2 5,-0.2 0.906 109.0 51.3 -64.6 -42.2 31.1 23.7 57.7 198 214 A E H X S+ 0 0 103 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.932 114.3 42.7 -59.5 -47.5 31.8 23.0 61.4 199 215 A K H X S+ 0 0 89 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.861 113.5 51.9 -69.2 -37.1 28.8 20.6 61.5 200 216 A A H <>S+ 0 0 0 -4,-2.7 5,-2.7 2,-0.2 6,-0.5 0.930 112.3 46.7 -64.4 -45.4 29.7 19.0 58.1 201 217 A H H ><5S+ 0 0 73 -4,-2.8 3,-1.4 1,-0.2 -2,-0.2 0.913 108.2 54.9 -62.3 -45.5 33.2 18.4 59.3 202 218 A A H 3<5S+ 0 0 85 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.822 112.9 44.0 -58.9 -31.2 32.1 16.9 62.6 203 219 A E T 3<5S- 0 0 81 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.440 110.9-121.9 -93.3 -1.1 30.0 14.4 60.7 204 220 A G T < 5S+ 0 0 44 -3,-1.4 -3,-0.2 -4,-0.4 -2,-0.1 0.831 71.6 131.8 64.2 34.1 32.7 13.7 58.2 205 221 A L < + 0 0 14 -5,-2.7 2,-0.5 -6,-0.2 -4,-0.2 0.620 51.5 65.5 -92.4 -16.0 30.4 14.8 55.3 206 222 A A + 0 0 7 -6,-0.5 -36,-0.2 1,-0.1 3,-0.1 -0.934 44.1 179.2-117.2 127.7 32.8 17.1 53.4 207 223 A D S S+ 0 0 61 -38,-1.1 2,-0.3 -2,-0.5 -37,-0.2 0.641 80.2 2.1 -92.4 -17.2 36.0 16.1 51.6 208 224 A A E -k 170 0B 5 -39,-0.7 -37,-2.9 27,-0.2 2,-0.4 -0.963 68.7-118.9-159.2 168.3 36.6 19.6 50.5 209 225 A V E -kl 171 237B 1 27,-2.1 29,-1.9 -2,-0.3 2,-0.2 -0.981 30.9-175.8-121.0 130.4 35.3 23.2 50.8 210 226 A D + 0 0 1 -39,-2.8 -36,-0.4 -2,-0.4 2,-0.3 -0.556 3.2 179.9-115.6 178.2 34.2 25.1 47.6 211 227 A G - 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0 0 9 468,-0.3 4,-1.5 1,-0.1 -197,-0.1 -0.956 42.7-177.3-131.5 116.5 27.9 13.0 29.5 326 342 A L H > S+ 0 0 0 -2,-0.4 4,-1.7 2,-0.2 -1,-0.1 0.773 90.5 58.3 -77.8 -27.6 31.6 13.2 30.2 327 343 A L H > S+ 0 0 8 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.918 108.2 45.8 -66.2 -42.2 32.3 11.7 26.7 328 344 A L H > S+ 0 0 6 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.887 106.5 60.5 -66.9 -37.8 30.5 14.7 25.2 329 345 A T H X S+ 0 0 0 -4,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.896 104.5 48.8 -56.2 -41.8 32.3 17.0 27.6 330 346 A M H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.919 109.7 51.1 -66.0 -42.0 35.6 15.8 26.0 331 347 A N H X S+ 0 0 1 -4,-1.7 4,-2.9 53,-0.2 -2,-0.2 0.877 112.0 48.0 -62.8 -35.1 34.3 16.4 22.5 332 348 A M H X>S+ 0 0 4 -4,-2.5 4,-2.9 2,-0.2 5,-1.0 0.842 106.9 56.0 -73.0 -34.2 33.2 19.9 23.6 333 349 A G H X5S+ 0 0 0 -4,-2.1 6,-1.8 -5,-0.2 4,-0.6 0.903 115.4 39.0 -63.1 -39.0 36.6 20.6 25.1 334 350 A A H X5S+ 0 0 0 -4,-2.0 4,-0.9 4,-0.2 -2,-0.2 0.944 123.4 39.7 -73.8 -49.4 38.2 19.8 21.8 335 351 A T H <5S+ 0 0 4 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.914 129.0 26.7 -69.5 -47.1 35.6 21.5 19.6 336 352 A L H <5S+ 0 0 10 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.1 0.881 134.0 30.3 -87.1 -40.5 34.9 24.6 21.7 337 353 A F H < - 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0 0 24 -5,-2.2 -1,-0.2 -6,-0.2 2,-0.1 -0.334 34.5-127.1 -67.9 147.3 48.3 20.2 11.2 496 107 B T > - 0 0 66 1,-0.1 4,-2.3 -2,-0.0 5,-0.2 -0.446 28.1-103.6 -87.9 167.2 47.6 22.1 8.0 497 108 B Y H > S+ 0 0 190 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.868 123.4 53.4 -58.3 -35.4 45.1 20.9 5.3 498 109 B E H > S+ 0 0 95 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.938 107.2 47.7 -65.7 -49.6 48.1 19.8 3.3 499 110 B E H > S+ 0 0 100 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.889 114.7 48.5 -59.6 -39.9 49.7 17.7 6.0 500 111 B I H <>S+ 0 0 17 -4,-2.3 5,-2.6 2,-0.2 3,-0.5 0.953 110.9 49.2 -64.8 -50.2 46.3 16.1 6.7 501 112 B A H ><5S+ 0 0 57 -4,-2.8 3,-1.8 1,-0.3 -2,-0.2 0.917 109.8 51.8 -55.5 -46.2 45.7 15.4 3.0 502 113 B K H 3<5S+ 0 0 163 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.813 105.8 55.8 -61.6 -29.4 49.2 13.8 2.7 503 114 B A T 3<5S- 0 0 51 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.520 129.3 -97.7 -80.6 -4.8 48.3 11.6 5.7 504 115 B G T < 5S+ 0 0 17 -3,-1.8 -3,-0.2 -4,-0.4 -2,-0.2 0.561 76.7 143.3 100.2 11.2 45.2 10.4 3.8 505 116 B G < + 0 0 5 -5,-2.6 -1,-0.2 -6,-0.2 3,-0.2 -0.291 25.1 66.8 -81.2 167.9 42.6 12.7 5.4 506 117 B G S >> S- 0 0 23 1,-0.2 3,-2.4 2,-0.1 4,-0.6 -0.452 104.5 -53.3 110.5 172.7 39.7 14.3 3.7 507 118 B I H >> S+ 0 0 62 1,-0.3 4,-2.2 2,-0.2 3,-0.5 0.783 128.2 73.2 -55.9 -26.3 36.5 12.9 2.2 508 119 B V H 3> S+ 0 0 56 1,-0.2 4,-2.8 -3,-0.2 -1,-0.3 0.816 89.3 60.3 -58.4 -29.0 38.7 10.7 0.2 509 120 B S H <> S+ 0 0 22 -3,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.909 106.9 43.9 -65.1 -42.1 39.4 8.7 3.4 510 121 B S H < S+ 0 0 0 -4,-1.8 3,-0.9 33,-0.3 -2,-0.2 0.888 110.9 51.5 -79.8 -41.1 33.6 2.5 2.1 515 126 B R H 3< S+ 0 0 94 -4,-2.7 -2,-0.2 32,-0.3 -1,-0.2 0.837 107.8 56.1 -62.7 -32.2 34.8 1.2 -1.3 516 127 B A T 3< S+ 0 0 81 -4,-1.8 2,-0.3 -5,-0.2 -1,-0.2 0.633 95.2 80.6 -77.2 -15.8 37.0 -1.3 0.5 517 128 B L S < S- 0 0 43 -3,-0.9 2,-0.1 -4,-0.4 -36,-0.0 -0.651 72.2-125.3-101.5 153.7 34.3 -3.0 2.6 518 129 B S > - 0 0 47 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.382 32.6-107.0 -83.0 165.9 31.7 -5.6 1.9 519 130 B D H > S+ 0 0 41 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.917 121.5 55.8 -58.7 -42.9 27.9 -5.2 2.5 520 131 B E H > S+ 0 0 133 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.918 110.6 42.2 -55.0 -50.8 28.3 -7.5 5.5 521 132 B V H > S+ 0 0 54 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.905 111.9 54.7 -66.4 -42.0 31.0 -5.4 7.1 522 133 B L H X S+ 0 0 0 -4,-2.7 4,-1.4 1,-0.2 -42,-0.3 0.877 108.2 49.5 -60.2 -37.2 29.2 -2.1 6.3 523 134 B V H X S+ 0 0 14 -4,-2.4 4,-2.2 -5,-0.2 3,-0.4 0.937 109.2 53.2 -65.6 -44.8 26.1 -3.4 8.0 524 135 B A H < S+ 0 0 59 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.883 111.6 44.8 -56.5 -42.0 28.2 -4.4 11.0 525 136 B Q H < S+ 0 0 64 -4,-2.3 4,-0.4 1,-0.2 -1,-0.2 0.720 114.5 48.8 -77.3 -21.1 29.7 -0.9 11.3 526 137 B A H X S+ 0 0 0 -4,-1.4 4,-2.8 -3,-0.4 3,-0.4 0.774 93.7 73.6 -88.8 -29.2 26.4 0.9 10.8 527 138 B L H X S+ 0 0 32 -4,-2.2 4,-3.5 1,-0.2 5,-0.3 0.881 93.1 53.6 -54.8 -43.4 24.3 -1.1 13.4 528 139 B P H > S+ 0 0 60 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.899 113.0 44.9 -60.6 -37.1 25.9 0.6 16.4 529 140 B R H > S+ 0 0 25 -4,-0.4 4,-1.7 -3,-0.4 -2,-0.2 0.931 114.9 48.1 -69.8 -45.5 25.1 4.0 15.0 530 141 B L H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 3,-0.3 0.951 110.6 50.9 -58.9 -51.2 21.6 2.9 14.1 531 142 B D H X S+ 0 0 59 -4,-3.5 4,-2.2 1,-0.2 -1,-0.2 0.792 104.9 57.4 -59.9 -29.7 21.0 1.3 17.5 532 143 B T H < S+ 0 0 30 -4,-1.3 4,-0.4 -5,-0.3 -1,-0.2 0.929 110.7 43.3 -67.5 -42.6 22.1 4.5 19.2 533 144 B L H ><>S+ 0 0 0 -4,-1.7 3,-1.6 -3,-0.3 5,-1.5 0.932 112.8 51.8 -67.0 -44.9 19.4 6.5 17.3 534 145 B L H ><5S+ 0 0 9 -4,-2.7 3,-2.2 1,-0.3 -1,-0.2 0.889 101.1 62.1 -59.0 -38.2 16.8 3.8 17.9 535 146 B S T 3<5S+ 0 0 60 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.663 100.9 55.6 -63.1 -14.6 17.5 3.9 21.7 536 147 B E T < 5S- 0 0 16 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.213 129.3 -91.1-102.2 13.3 16.4 7.5 21.6 537 148 B G T < 5S+ 0 0 0 -3,-2.2 -66,-2.1 1,-0.3 2,-0.3 0.589 74.2 150.2 92.4 8.6 13.0 6.8 20.2 538 149 B V E < +c 471 0H 0 -5,-1.5 -1,-0.3 -68,-0.2 -66,-0.2 -0.606 12.4 166.3 -77.1 132.3 13.8 7.2 16.5 539 150 B S E + 0 0 0 -68,-2.7 32,-3.4 -2,-0.3 2,-0.4 0.571 63.3 45.2-119.9 -19.8 11.6 5.0 14.2 540 151 B T E +cd 472 571H 0 -69,-1.2 -67,-2.4 30,-0.2 2,-0.4 -0.995 63.1 177.8-130.2 134.3 12.3 6.5 10.8 541 152 B I E -cd 473 572H 0 30,-2.6 32,-1.9 -2,-0.4 2,-0.5 -0.998 20.8-143.4-139.6 135.7 15.8 7.3 9.4 542 153 B E E - 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0 0 71 -3,-1.2 -3,-0.2 -4,-0.4 -4,-0.1 0.858 44.5-178.2 58.4 34.5 33.1 25.9 14.0 699 310 B E < - 0 0 32 -5,-2.0 -1,-0.2 -6,-0.3 -50,-0.0 -0.320 22.0-169.4 -65.2 148.3 30.8 27.7 11.6 700 311 B K + 0 0 160 -3,-0.1 2,-0.8 1,-0.1 -1,-0.1 0.653 61.4 87.6-111.1 -27.2 29.9 31.4 12.4 701 312 B Q - 0 0 85 -7,-0.0 -1,-0.1 1,-0.0 -2,-0.1 -0.683 69.4-149.2 -80.8 111.9 27.1 32.1 9.9 702 313 B L - 0 0 80 -2,-0.8 40,-0.1 1,-0.1 -2,-0.1 -0.516 22.6-105.3 -80.1 146.1 23.8 31.1 11.5 703 314 B P - 0 0 7 0, 0.0 2,-2.2 0, 0.0 3,-0.2 -0.376 41.9-100.2 -66.4 152.3 21.0 29.9 9.3 704 315 B P > + 0 0 29 0, 0.0 4,-2.3 0, 0.0 5,-0.2 -0.371 55.3 162.1 -75.6 66.9 18.2 32.5 8.9 705 316 B V H > S+ 0 0 13 -2,-2.2 4,-2.5 1,-0.2 5,-0.2 0.912 73.9 47.1 -52.1 -50.9 15.7 31.1 11.4 706 317 B Q H > S+ 0 0 100 1,-0.2 4,-3.0 -3,-0.2 -1,-0.2 0.892 111.6 50.9 -62.6 -38.2 13.7 34.3 11.7 707 318 B A H > S+ 0 0 26 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.865 111.1 49.2 -65.9 -35.3 13.5 34.8 7.9 708 319 B L H X>S+ 0 0 0 -4,-2.3 5,-2.6 2,-0.2 4,-1.1 0.905 112.2 49.1 -68.6 -40.2 12.3 31.2 7.7 709 320 B R H <5S+ 0 0 76 -4,-2.5 3,-0.4 -5,-0.2 -2,-0.2 0.926 111.9 47.7 -63.2 -46.4 9.7 31.9 10.4 710 321 B D H <5S+ 0 0 116 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.853 110.9 50.6 -65.1 -35.8 8.5 35.1 8.6 711 322 B A H <5S- 0 0 32 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.708 113.5-119.3 -74.0 -21.5 8.2 33.4 5.2 712 323 B G T <5 + 0 0 54 -4,-1.1 -3,-0.2 -3,-0.4 2,-0.1 0.731 57.0 159.2 87.5 24.5 6.2 30.6 6.9 713 324 B A < - 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0 0 3 -2,-1.5 -317,-0.5 1,-0.1 -2,-0.1 -0.932 63.0-145.2-137.8 161.0 9.4 13.4 31.6 784 395 B E S S+ 0 0 148 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.683 90.8 26.3 -98.6 -22.8 7.0 15.8 33.3 785 396 B R S > S- 0 0 73 1,-0.1 3,-2.4 -319,-0.1 4,-0.3 -0.997 73.0-128.8-143.6 134.5 7.2 18.4 30.5 786 397 B P T > S+ 0 0 13 0, 0.0 3,-2.0 0, 0.0 4,-0.4 0.830 105.7 71.0 -49.3 -34.9 8.0 18.1 26.7 787 398 B A T >> S+ 0 0 0 1,-0.3 4,-2.7 2,-0.2 3,-1.7 0.774 80.6 74.3 -53.7 -29.3 10.6 20.8 27.1 788 399 B E H <> S+ 0 0 5 -3,-2.4 4,-1.8 1,-0.3 -1,-0.3 0.811 87.7 61.3 -55.8 -30.2 12.8 18.3 29.0 789 400 B L H <4 S+ 0 0 5 -3,-2.0 -1,-0.3 -4,-0.3 -53,-0.2 0.718 114.8 32.7 -69.2 -21.9 13.6 16.6 25.7 790 401 B V H <4 S+ 0 0 0 -3,-1.7 -2,-0.2 -4,-0.4 -1,-0.2 0.728 115.6 58.1-103.0 -32.0 15.2 19.8 24.4 791 402 B Y H < S+ 0 0 11 -4,-2.7 -3,-0.2 -52,-0.1 -2,-0.2 0.892 89.6 77.8 -67.6 -46.8 16.5 21.2 27.7 792 403 B R < - 0 0 55 -4,-1.8 2,-0.6 -5,-0.2 3,-0.2 -0.344 66.7-146.0 -71.8 148.9 18.8 18.3 28.8 793 404 B I B S-s 323 0E 1 -471,-2.9 -469,-2.2 1,-0.2 -468,-0.3 -0.946 78.3 -6.4-117.3 111.3 22.2 17.7 27.3 794 405 B G S S+ 0 0 24 -2,-0.6 2,-0.3 1,-0.3 -1,-0.2 0.926 99.4 118.6 75.5 45.0 23.3 14.1 26.9 795 406 B F - 0 0 35 -3,-0.2 -1,-0.3 -6,-0.1 -671,-0.1 -0.976 48.8-150.9-139.1 150.7 20.5 12.3 28.7 796 407 B N + 0 0 57 -2,-0.3 -7,-0.0 1,-0.1 -260,-0.0 -0.885 16.9 172.0-129.5 102.4 17.9 9.8 27.5 797 408 B P + 0 0 12 0, 0.0 -15,-3.2 0, 0.0 2,-0.2 0.114 29.9 141.7 -93.4 21.0 14.5 9.8 29.2 798 409 B L E +A 781 0G 32 -17,-0.2 -17,-0.2 -263,-0.2 3,-0.1 -0.439 25.8 179.4 -67.2 134.1 12.9 7.3 26.8 799 410 B H E - 0 0 100 -19,-3.2 2,-0.3 1,-0.4 -18,-0.2 0.792 65.0 -10.6-100.3 -42.4 10.5 4.9 28.5 800 411 B A E -A 780 0G 4 -20,-1.8 -20,-2.9 9,-0.1 2,-0.4 -0.987 52.3-144.1-159.8 149.9 9.3 2.9 25.6 801 412 B R E -A 779 0G 9 -2,-0.3 7,-2.5 -22,-0.2 8,-1.1 -0.974 13.3-165.0-119.0 130.0 9.4 2.8 21.8 802 413 B I E -AB 778 807G 0 -24,-2.9 -24,-1.8 -2,-0.4 2,-0.5 -0.971 5.2-173.4-117.4 120.1 6.4 1.6 19.8 803 414 B F E > S- B 0 806G 20 3,-2.5 3,-1.6 -2,-0.5 -26,-0.2 -0.961 73.0 -17.8-117.9 118.1 6.9 0.8 16.1 804 415 B K T 3 S- 0 0 86 -2,-0.5 -27,-0.2 1,-0.3 -1,-0.2 0.916 129.4 -50.6 55.1 45.7 3.9 -0.1 14.0 805 416 B G T 3 S+ 0 0 10 -29,-2.6 2,-0.5 -367,-0.2 -1,-0.3 0.416 117.1 112.0 76.1 -1.2 1.8 -0.8 17.1 806 417 B Q E < -B 803 0G 135 -3,-1.6 -3,-2.5 -30,-0.2 2,-0.5 -0.919 68.5-130.6-112.4 122.3 4.5 -3.1 18.6 807 418 B K E +B 802 0G 149 -2,-0.5 -5,-0.2 -5,-0.2 -7,-0.0 -0.546 34.5 169.2 -66.3 117.6 6.4 -2.3 21.7 808 419 B V 0 0 41 -7,-2.5 -1,-0.2 -2,-0.5 -6,-0.1 0.824 360.0 360.0-100.2 -42.0 10.0 -2.9 20.6 809 420 B S 0 0 107 -8,-1.1 -272,-0.1 -275,-0.1 -7,-0.1 0.005 360.0 360.0 172.9 360.0 12.1 -1.4 23.4