==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 29-SEP-10 3P0W . COMPND 2 MOLECULE: MANDELATE RACEMASE/MUCONATE LACTONIZING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RALSTONIA PICKETTII; . AUTHOR A.A.FEDOROV,E.V.FEDOROV,J.A.GERLT,S.K.BURLEY,S.C.ALMO,NEW YO . 1698 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 61748.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1116 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 106 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 170 10.0 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 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 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 . 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 . 68 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 176 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 528 31.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 0.9 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 14 5 0 0 4 6 2 1 11 2 10 4 0 0 0 1 3 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 17 11 4 1 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 PARALLEL BRIDGES PER LADDER . 23 8 4 0 0 0 4 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 15 0 0 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 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 6 A H 0 0 204 0, 0.0 3,-0.1 0, 0.0 538,-0.1 0.000 360.0 360.0 360.0 -38.8 31.0 83.3 100.1 2 7 A T - 0 0 9 1,-0.1 39,-0.1 536,-0.1 537,-0.0 -0.480 360.0-102.8 -70.1 135.5 32.6 81.9 96.9 3 8 A P - 0 0 6 0, 0.0 69,-2.3 0, 0.0 70,-0.4 -0.140 33.3-153.6 -57.7 150.2 35.2 79.2 97.6 4 9 A R B -A 71 0A 121 67,-0.3 37,-2.1 68,-0.1 2,-0.3 -0.926 26.2-101.2-121.5 152.8 38.9 80.0 97.3 5 10 A V E +B 40 0B 3 65,-2.6 64,-2.8 62,-0.4 35,-0.3 -0.579 35.5 177.8 -71.0 131.2 41.7 77.7 96.6 6 11 A T E + 0 0 60 33,-3.1 2,-0.3 1,-0.3 34,-0.2 0.616 63.9 17.1-106.7 -21.3 43.6 76.8 99.8 7 12 A E E -B 39 0B 107 32,-1.6 32,-2.0 60,-0.1 2,-0.4 -0.991 53.4-164.5-154.3 143.4 46.2 74.3 98.4 8 13 A M E -B 38 0B 16 -2,-0.3 2,-0.4 30,-0.2 30,-0.2 -0.995 10.1-170.0-129.6 129.7 47.8 73.3 95.1 9 14 A Q E -B 37 0B 85 28,-2.7 28,-2.3 -2,-0.4 2,-0.6 -0.946 9.6-158.5-117.3 138.3 49.8 70.1 94.7 10 15 A V E +B 36 0B 13 -2,-0.4 26,-0.2 26,-0.2 -2,-0.0 -0.959 19.5 177.9-115.5 114.1 51.9 69.2 91.6 11 16 A I E -B 35 0B 7 24,-2.7 24,-2.3 -2,-0.6 2,-0.2 -0.909 22.0-148.7-128.3 106.6 52.4 65.4 91.4 12 17 A P E -B 34 0B 7 0, 0.0 2,-0.3 0, 0.0 22,-0.2 -0.532 25.5-169.7 -66.4 131.0 54.3 63.5 88.6 13 18 A V E -B 33 0B 0 20,-3.2 20,-2.3 -2,-0.2 2,-0.3 -0.953 9.1-149.1-128.0 148.6 52.8 60.0 88.2 14 19 A A E -B 32 0B 1 377,-1.5 2,-0.3 -2,-0.3 18,-0.2 -0.863 12.6-179.9-119.0 151.4 53.9 56.9 86.2 15 20 A G E -B 31 0B 0 16,-2.2 16,-2.0 -2,-0.3 2,-0.3 -0.880 29.8-103.9-139.1 171.2 52.0 54.1 84.5 16 21 A R E -B 30 0B 84 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.774 35.0-171.1-103.3 143.9 52.9 51.0 82.5 17 22 A D - 0 0 8 12,-2.1 129,-0.2 -2,-0.3 336,-0.1 -0.939 21.5-113.7-132.7 155.1 52.6 50.8 78.7 18 23 A S - 0 0 3 -2,-0.3 2,-2.2 127,-0.1 142,-0.1 -0.281 48.6 -88.7 -75.4 169.8 52.9 48.1 75.9 19 24 A M - 0 0 3 117,-0.3 117,-2.6 7,-0.1 2,-0.1 -0.345 59.8-178.6 -82.3 57.9 55.6 48.1 73.3 20 25 A L B -D 135 0C 0 -2,-2.2 7,-3.0 115,-0.2 2,-0.3 -0.369 15.4-141.3 -61.0 129.9 53.6 50.4 70.9 21 26 A L E +F 26 0D 0 113,-2.5 113,-0.4 5,-0.2 2,-0.3 -0.728 32.1 145.6 -98.7 142.4 55.3 51.2 67.6 22 27 A N E > -F 25 0D 7 3,-2.4 3,-1.5 -2,-0.3 168,-0.1 -0.901 63.3 -74.0-156.8-174.2 55.2 54.5 65.8 23 28 A L T 3 S+ 0 0 4 166,-0.4 396,-0.4 1,-0.3 399,-0.1 0.815 128.2 52.6 -57.6 -33.1 57.3 56.9 63.6 24 29 A C T 3 S- 0 0 53 1,-0.1 2,-0.4 394,-0.1 -1,-0.3 0.574 119.7-102.3 -84.7 -13.1 59.4 57.8 66.6 25 30 A G E < -F 22 0D 0 -3,-1.5 -3,-2.4 383,-0.1 2,-0.4 -0.974 63.5 -21.9 136.5-124.2 60.2 54.2 67.6 26 31 A A E -F 21 0D 0 379,-3.0 382,-0.6 -2,-0.4 383,-0.3 -0.996 61.3-110.3-133.6 133.9 58.8 52.0 70.3 27 32 A H - 0 0 10 -7,-3.0 378,-0.1 -2,-0.4 4,-0.1 -0.419 36.5-122.7 -62.8 132.0 57.0 53.1 73.5 28 33 A A - 0 0 26 2,-0.2 -8,-0.2 -2,-0.1 -11,-0.1 -0.230 29.3-100.5 -65.8 165.0 59.0 52.5 76.6 29 34 A P S S+ 0 0 7 0, 0.0 -12,-2.1 0, 0.0 2,-0.4 0.628 106.0 47.1 -64.7 -17.1 57.6 50.3 79.4 30 35 A F E -B 16 0B 53 -14,-0.2 2,-0.3 115,-0.0 -2,-0.2 -0.973 62.3-170.9-128.4 145.3 56.7 53.4 81.4 31 36 A F E -B 15 0B 23 -16,-2.0 -16,-2.2 -2,-0.4 2,-0.3 -0.896 13.9-143.0-122.5 161.5 54.9 56.7 80.6 32 37 A T E +B 14 0B 47 -2,-0.3 20,-1.3 -18,-0.2 2,-0.3 -0.929 15.9 177.2-124.7 150.2 54.6 59.8 82.8 33 38 A R E -BC 13 51B 5 -20,-2.3 -20,-3.2 -2,-0.3 2,-0.5 -0.955 24.2-131.0-139.3 158.0 51.9 62.4 83.4 34 39 A N E -BC 12 50B 2 16,-2.4 16,-1.9 -2,-0.3 2,-0.3 -0.938 23.8-163.1-107.6 127.9 51.8 65.4 85.7 35 40 A L E -BC 11 49B 2 -24,-2.3 -24,-2.7 -2,-0.5 2,-0.4 -0.831 8.3-151.3-112.5 156.0 48.7 65.9 87.8 36 41 A V E -BC 10 48B 0 12,-2.5 12,-2.2 -2,-0.3 2,-0.5 -0.984 8.7-167.9-120.1 132.0 47.5 68.9 89.7 37 42 A I E -BC 9 47B 6 -28,-2.3 -28,-2.7 -2,-0.4 2,-0.4 -0.981 7.4-173.0-121.9 123.3 45.4 68.5 92.9 38 43 A L E -BC 8 46B 0 8,-3.2 8,-2.3 -2,-0.5 2,-0.3 -0.894 6.4-165.5-114.6 145.4 43.6 71.6 94.3 39 44 A K E -BC 7 45B 74 -32,-2.0 -33,-3.1 -2,-0.4 -32,-1.6 -0.962 11.6-161.0-122.4 149.6 41.7 72.0 97.5 40 45 A D E > -B 5 0B 5 4,-1.6 3,-1.9 -2,-0.3 -35,-0.2 -0.664 38.4 -80.9-120.4 177.1 39.3 74.8 98.5 41 46 A N T 3 S+ 0 0 97 -37,-2.1 -36,-0.1 1,-0.3 -39,-0.0 0.579 123.3 50.6 -41.0 -27.8 37.6 76.6 101.4 42 47 A A T 3 S- 0 0 12 -38,-0.2 -1,-0.3 2,-0.1 961,-0.1 0.049 118.8-101.4-112.7 23.5 34.9 74.0 101.6 43 48 A G S < S+ 0 0 54 -3,-1.9 2,-0.2 1,-0.2 -2,-0.1 0.550 75.7 139.5 72.5 9.2 37.0 70.8 101.7 44 49 A R - 0 0 41 -4,-0.0 -4,-1.6 60,-0.0 2,-0.4 -0.491 41.3-142.7 -85.2 156.5 36.5 69.9 98.0 45 50 A T E -C 39 0B 32 -6,-0.2 2,-0.4 -2,-0.2 -6,-0.2 -0.952 12.2-171.5-119.2 139.4 39.2 68.6 95.7 46 51 A G E -C 38 0B 0 -8,-2.3 -8,-3.2 -2,-0.4 2,-0.3 -0.967 12.4-160.8-124.6 146.0 39.6 69.4 92.0 47 52 A V E -C 37 0B 5 -2,-0.4 2,-0.3 52,-0.2 -10,-0.2 -0.921 11.5-172.4-133.2 154.3 42.1 67.6 89.8 48 53 A G E -C 36 0B 0 -12,-2.2 -12,-2.5 -2,-0.3 2,-0.4 -0.993 4.7-163.4-141.8 146.1 43.9 68.0 86.5 49 54 A E E +C 35 0B 1 -2,-0.3 -14,-0.2 -14,-0.2 50,-0.1 -0.999 19.5 151.2-135.5 138.3 46.1 65.8 84.3 50 55 A V E -C 34 0B 0 -16,-1.9 -16,-2.4 -2,-0.4 278,-0.1 -0.877 50.6 -46.5-152.1 173.1 48.5 66.7 81.5 51 56 A P E -C 33 0B 18 0, 0.0 -18,-0.2 0, 0.0 -17,-0.1 -0.075 56.6-120.3 -50.7 147.1 51.7 65.5 79.8 52 57 A G + 0 0 18 -20,-1.3 4,-0.2 -19,-0.2 2,-0.1 -0.151 54.2 115.6 -77.0-179.9 54.6 64.4 82.0 53 58 A G > - 0 0 33 -20,-0.1 4,-2.1 2,-0.1 5,-0.1 -0.239 68.8-108.4 125.8 140.5 58.0 66.1 81.8 54 59 A E H > S+ 0 0 79 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.907 115.1 62.3 -64.7 -41.0 60.2 68.1 84.1 55 60 A G H > S+ 0 0 56 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.935 110.1 37.6 -45.7 -58.9 59.5 71.2 82.1 56 61 A I H > S+ 0 0 24 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.914 114.3 56.0 -62.8 -45.0 55.8 71.1 82.8 57 62 A R H X S+ 0 0 56 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.947 111.1 43.1 -55.8 -50.8 56.2 70.0 86.4 58 63 A Q H X S+ 0 0 84 -4,-3.0 4,-2.5 1,-0.2 -1,-0.2 0.872 111.4 54.7 -64.8 -37.5 58.5 72.9 87.2 59 64 A A H X S+ 0 0 11 -4,-2.0 4,-1.1 -5,-0.3 -1,-0.2 0.936 109.8 47.4 -61.6 -45.3 56.3 75.4 85.4 60 65 A L H >< S+ 0 0 0 -4,-2.7 3,-0.9 1,-0.2 4,-0.5 0.944 112.0 49.4 -57.7 -52.0 53.3 74.2 87.5 61 66 A E H >< S+ 0 0 86 -4,-2.4 3,-1.3 1,-0.2 -1,-0.2 0.911 106.7 57.8 -52.6 -44.7 55.2 74.4 90.7 62 67 A R H 3< S+ 0 0 161 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.768 108.2 44.8 -61.3 -29.1 56.4 77.9 89.8 63 68 A V T X< S+ 0 0 3 -4,-1.1 3,-1.8 -3,-0.9 4,-0.4 0.335 75.9 107.2-103.4 7.6 52.8 79.3 89.5 64 69 A I G X> S+ 0 0 32 -3,-1.3 4,-2.7 -4,-0.5 3,-1.7 0.878 76.8 58.6 -48.4 -43.5 51.2 77.8 92.6 65 70 A P G 34 S+ 0 0 100 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.697 98.8 59.2 -63.1 -18.8 51.2 81.3 94.3 66 71 A L G <4 S+ 0 0 65 -3,-1.8 -2,-0.2 1,-0.1 15,-0.1 0.572 115.9 34.1 -83.7 -7.8 49.0 82.6 91.4 67 72 A V T X4 S+ 0 0 0 -3,-1.7 3,-2.2 -4,-0.4 -62,-0.4 0.783 96.2 85.4-112.4 -50.7 46.3 80.0 92.2 68 73 A V T 3< S+ 0 0 50 -4,-2.7 -62,-0.2 1,-0.3 3,-0.1 -0.350 100.0 22.1 -58.1 127.7 46.4 79.5 96.0 69 74 A G T 3 S+ 0 0 38 -64,-2.8 -1,-0.3 1,-0.3 2,-0.2 0.262 96.4 126.1 98.5 -12.1 44.2 82.2 97.6 70 75 A Q < - 0 0 73 -3,-2.2 -65,-2.6 1,-0.1 -1,-0.3 -0.513 64.2-115.7 -85.9 146.4 42.1 82.8 94.5 71 76 A S B > -A 4 0A 8 -67,-0.3 3,-1.6 -2,-0.2 -67,-0.3 -0.592 18.9-134.7 -73.8 137.2 38.4 82.7 94.3 72 77 A I G > S+ 0 0 1 -69,-2.3 3,-1.1 1,-0.3 -1,-0.1 0.678 104.7 68.4 -68.3 -15.8 37.2 79.9 91.9 73 78 A G G 3 S+ 0 0 6 -70,-0.4 3,-0.3 1,-0.3 -1,-0.3 0.695 94.1 59.0 -72.8 -15.8 34.8 82.4 90.4 74 79 A R G <> + 0 0 85 -3,-1.6 4,-2.4 1,-0.2 3,-0.4 0.025 66.4 130.3 -99.2 26.7 37.9 84.1 89.0 75 80 A T H <> S+ 0 0 7 -3,-1.1 4,-2.8 1,-0.2 5,-0.2 0.878 71.0 51.1 -48.7 -46.6 39.1 81.0 87.1 76 81 A N H > S+ 0 0 22 -3,-0.3 4,-2.3 469,-0.3 -1,-0.2 0.918 110.9 47.9 -60.0 -42.5 39.6 83.0 83.8 77 82 A G H > S+ 0 0 21 -3,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.887 111.5 49.8 -66.9 -42.6 41.7 85.6 85.6 78 83 A V H X S+ 0 0 4 -4,-2.4 4,-2.2 2,-0.2 3,-0.4 0.952 111.6 48.7 -59.8 -51.5 43.8 83.1 87.3 79 84 A L H X S+ 0 0 14 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.879 110.1 52.5 -56.8 -38.0 44.4 81.2 84.0 80 85 A S H X S+ 0 0 20 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.821 107.6 50.9 -69.0 -32.4 45.3 84.5 82.3 81 86 A S H X S+ 0 0 22 -4,-1.7 4,-2.2 -3,-0.4 -1,-0.2 0.903 110.0 49.9 -72.0 -40.3 47.9 85.4 84.9 82 87 A I H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.944 109.3 52.1 -57.8 -48.8 49.5 81.9 84.5 83 88 A R H X S+ 0 0 98 -4,-2.4 4,-1.1 1,-0.2 3,-0.3 0.920 111.2 46.4 -52.7 -48.0 49.5 82.5 80.8 84 89 A R H < S+ 0 0 168 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.839 108.8 57.7 -63.4 -33.5 51.3 85.9 81.3 85 90 A A H < S+ 0 0 53 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.847 107.9 45.6 -66.4 -33.2 53.6 84.1 83.8 86 91 A L H < 0 0 44 -4,-1.8 -1,-0.2 -3,-0.3 -2,-0.2 0.658 360.0 360.0 -87.9 -16.7 54.8 81.6 81.1 87 92 A A < 0 0 112 -4,-1.1 -3,-0.0 -3,-0.2 -4,-0.0 -0.482 360.0 360.0 -65.1 360.0 55.3 84.1 78.2 88 ! 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 89 124 A R >> 0 0 127 0, 0.0 3,-1.3 0, 0.0 4,-0.6 0.000 360.0 360.0 360.0 102.8 54.2 74.3 75.4 90 125 A M H >> + 0 0 60 1,-0.3 4,-2.4 2,-0.2 3,-0.7 0.744 360.0 67.2 -74.3 -27.6 52.3 76.5 77.8 91 126 A D H 3> S+ 0 0 26 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.770 93.2 63.7 -63.5 -25.9 48.9 75.2 77.2 92 127 A N H <> S+ 0 0 11 -3,-1.3 4,-1.0 2,-0.2 -1,-0.3 0.885 108.3 40.7 -62.8 -39.0 50.1 72.0 78.8 93 128 A V H S+ 0 0 0 -4,-3.1 5,-2.2 2,-0.2 4,-1.4 0.904 111.7 49.8 -57.9 -46.5 31.3 72.6 88.7 107 142 A Q H <5S+ 0 0 51 -4,-2.3 3,-0.3 270,-0.3 -2,-0.2 0.944 113.2 47.2 -57.1 -47.3 31.2 71.1 92.2 108 143 A F H <5S+ 0 0 23 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.943 118.8 38.8 -60.5 -46.5 30.4 74.5 93.6 109 144 A L H <5S- 0 0 4 -4,-3.3 -1,-0.2 2,-0.2 -2,-0.2 0.584 108.4-124.9 -81.8 -7.5 27.7 75.2 91.0 110 145 A E T <5S+ 0 0 94 -4,-1.4 -3,-0.2 -3,-0.3 -4,-0.1 0.880 71.1 117.9 62.1 42.7 26.4 71.6 91.1 111 146 A V S -g 378 0E 4 0, 0.0 3,-2.2 0, 0.0 4,-0.5 -0.449 38.5-110.9 -65.8 148.3 29.0 68.9 85.3 113 148 A V G >> S+ 0 0 0 265,-1.9 3,-1.6 1,-0.3 4,-0.9 0.792 115.1 72.8 -48.8 -31.1 32.1 70.6 83.7 114 149 A A G 34 S+ 0 0 0 264,-0.3 3,-0.5 1,-0.3 -1,-0.3 0.845 92.9 55.6 -54.5 -32.7 30.4 70.1 80.3 115 150 A E G <4 S+ 0 0 8 -3,-2.2 387,-0.3 5,-0.2 -1,-0.3 0.697 104.4 52.6 -73.3 -21.1 28.0 72.9 81.3 116 151 A L T <4 S+ 0 0 31 -3,-1.6 2,-0.3 -4,-0.5 -1,-0.2 0.641 96.2 84.4 -89.3 -14.9 30.8 75.3 82.1 117 152 A L S >< S- 0 0 0 -4,-0.9 3,-2.8 -3,-0.5 184,-0.1 -0.680 102.2 -40.6 -94.9 140.2 32.4 74.9 78.7 118 153 A G T 3 S- 0 0 19 -2,-0.3 3,-0.1 1,-0.3 430,-0.1 -0.209 124.8 -18.9 57.3-124.1 31.6 76.7 75.5 119 154 A A T 3 S- 0 0 33 1,-0.4 -1,-0.3 219,-0.4 387,-0.1 -0.090 109.8 -95.7-107.7 32.3 27.8 76.9 75.2 120 155 A G S < S- 0 0 0 -3,-2.8 -1,-0.4 -6,-0.2 -5,-0.2 -0.273 72.1 -14.4 88.5-173.3 27.1 74.2 77.7 121 156 A Q + 0 0 43 1,-0.1 217,-0.2 -3,-0.1 3,-0.1 -0.454 49.4 173.1 -74.3 135.3 26.5 70.5 77.3 122 157 A Q + 0 0 69 215,-3.5 2,-0.3 1,-0.3 216,-0.2 0.609 62.1 25.4-113.7 -25.4 25.6 69.3 73.8 123 158 A R - 0 0 42 214,-1.3 -1,-0.3 1,-0.1 3,-0.1 -0.983 59.2-134.7-147.6 153.2 25.5 65.5 74.2 124 159 A D S S+ 0 0 133 -2,-0.3 249,-2.5 1,-0.1 2,-0.3 0.628 91.9 28.9 -81.0 -18.0 24.9 62.7 76.8 125 160 A S E -H 372 0F 41 247,-0.3 247,-0.2 211,-0.1 -1,-0.1 -0.997 69.3-130.9-147.1 149.7 27.9 60.7 75.6 126 161 A A E -H 371 0F 0 245,-2.4 245,-2.2 -2,-0.3 2,-0.2 -0.900 26.8-134.0-102.1 123.3 31.3 61.1 74.0 127 162 A P E -H 370 0F 20 0, 0.0 219,-2.2 0, 0.0 2,-0.3 -0.569 27.3-170.9 -73.0 136.1 32.1 58.8 71.0 128 163 A M B -j 346 0G 1 241,-2.7 55,-0.4 217,-0.3 56,-0.3 -0.967 12.3-143.3-131.0 148.9 35.5 57.2 71.1 129 164 A L - 0 0 3 217,-1.7 2,-0.8 -2,-0.3 219,-0.4 -0.690 26.9-107.9-103.7 162.1 37.6 55.1 68.7 130 165 A A E -k 185 0H 0 54,-2.6 56,-2.1 -2,-0.2 2,-1.1 -0.800 29.8-145.7 -87.4 113.4 39.9 52.2 69.3 131 166 A Y E -k 186 0H 13 -2,-0.8 2,-0.2 217,-0.6 56,-0.2 -0.695 21.4-164.7 -82.5 101.3 43.4 53.4 68.8 132 167 A L E -k 187 0H 0 54,-3.2 56,-2.7 -2,-1.1 2,-0.3 -0.577 8.9-177.6 -89.0 151.2 45.2 50.4 67.3 133 168 A F - 0 0 3 -2,-0.2 2,-0.3 54,-0.2 -111,-0.1 -0.965 34.6-108.9-136.1 152.8 49.0 50.1 67.1 134 169 A Y - 0 0 1 54,-0.5 -113,-2.5 -113,-0.4 2,-0.5 -0.662 43.4-144.8 -69.1 141.9 51.5 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298 B T H < S- 0 0 19 -4,-1.9 -31,-0.5 -5,-0.2 -2,-0.2 0.653 82.5-138.6-114.2 -25.4 40.7 100.5 46.8 694 299 B G < + 0 0 62 -4,-2.8 -4,-0.1 -5,-0.4 -3,-0.1 0.703 57.1 138.2 63.5 21.3 42.9 98.9 49.5 695 300 B I - 0 0 10 -6,-0.3 -1,-0.3 -5,-0.1 -2,-0.2 -0.845 58.6-115.9 -93.4 129.9 40.6 100.5 52.2 696 301 B P - 0 0 52 0, 0.0 -26,-2.9 0, 0.0 2,-0.3 -0.302 33.3-142.7 -64.1 153.6 39.8 98.2 55.1 697 302 B T E -h 670 0T 0 -28,-0.2 23,-1.9 -26,-0.1 22,-1.2 -0.849 16.4-169.9-120.8 153.9 36.1 97.3 55.4 698 303 B A E -hi 671 720T 0 -28,-2.0 -26,-2.7 -2,-0.3 2,-0.3 -0.934 12.1-171.5-134.4 162.8 33.7 96.8 58.3 699 304 B T E + i 0 721T 0 21,-1.5 23,-2.3 -2,-0.3 51,-0.1 -0.996 38.6 173.5-156.3 147.1 30.2 95.4 58.4 700 305 B N S S+ 0 0 9 -2,-0.3 -184,-0.1 21,-0.1 -1,-0.1 -0.028 95.5 49.5-125.5 24.7 27.0 94.7 60.2 701 306 B M S S+ 0 0 88 2,-0.0 3,-0.2 -19,-0.0 -19,-0.1 0.579 110.3 38.1-131.8 -28.7 25.2 93.5 57.1 702 307 B I S S+ 0 0 9 1,-0.2 -19,-0.1 -20,-0.1 10,-0.1 0.496 122.5 36.0-112.1 -7.4 27.4 90.9 55.3 703 308 B A S S+ 0 0 1 19,-0.1 -1,-0.2 8,-0.1 19,-0.2 -0.585 70.0 137.4-140.1 74.9 28.9 89.0 58.2 704 309 B T + 0 0 8 -3,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.459 67.7 21.8-107.2 -3.5 26.1 88.9 60.8 705 310 B D S > S- 0 0 56 -3,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.934 91.7 -89.4-151.6 175.0 26.4 85.3 62.0 706 311 B W H > S+ 0 0 25 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.896 121.7 52.8 -58.9 -40.8 28.9 82.5 62.1 707 312 B R H > S+ 0 0 186 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.934 111.3 44.3 -62.2 -50.7 28.0 81.1 58.7 708 313 B Q H > S+ 0 0 48 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.922 110.7 57.3 -57.1 -42.8 28.3 84.5 56.9 709 314 B M H X S+ 0 0 8 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.868 100.7 56.7 -56.8 -41.2 31.6 85.1 58.8 710 315 B G H X S+ 0 0 12 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.944 112.8 40.6 -54.7 -51.2 33.0 81.8 57.4 711 316 B H H X S+ 0 0 99 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.895 113.3 53.9 -64.4 -41.8 32.4 83.0 53.8 712 317 B A H X>S+ 0 0 1 -4,-2.8 5,-2.4 1,-0.2 4,-0.6 0.915 111.5 46.3 -62.5 -38.2 33.5 86.5 54.6 713 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338 B S H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.908 110.9 50.0 -60.1 -43.7 30.4 88.4 70.3 734 339 B V H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.888 106.6 55.5 -63.1 -37.9 33.4 87.7 72.5 735 340 B R H X S+ 0 0 40 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.909 108.9 48.6 -60.7 -40.8 34.1 84.4 70.6 736 341 B V H X S+ 0 0 3 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.932 109.9 51.0 -61.7 -45.4 34.2 86.6 67.5 737 342 B A H X S+ 0 0 1 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.896 108.9 51.8 -60.6 -38.5 36.6 89.0 69.2 738 343 B Q H X S+ 0 0 13 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.941 110.3 47.6 -64.7 -45.5 38.8 86.0 70.2 739 344 B L H X S+ 0 0 18 -4,-2.4 4,-2.5 1,-0.2 6,-0.3 0.925 109.4 54.5 -57.1 -46.6 38.9 84.8 66.6 740 345 B C H X>S+ 0 0 5 -4,-2.7 5,-1.6 1,-0.2 4,-1.0 0.904 109.2 47.7 -55.1 -42.8 39.8 88.4 65.4 741 346 B D H <5S+ 0 0 73 -4,-1.9 3,-0.5 1,-0.2 -1,-0.2 0.916 112.9 47.5 -69.3 -42.7 42.7 88.6 67.7 742 347 B E H <5S+ 0 0 74 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.852 119.7 39.9 -63.2 -36.7 44.1 85.2 66.8 743 348 B W H <5S- 0 0 49 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.396 112.4-105.3-105.2 5.6 43.7 85.9 63.1 744 349 B G T <5S+ 0 0 69 -4,-1.0 -3,-0.2 -3,-0.5 -4,-0.1 0.587 78.6 124.3 85.5 6.9 44.8 89.5 62.6 745 350 B L < - 0 0 40 -5,-1.6 2,-0.5 -6,-0.3 -1,-0.3 -0.337 60.1-118.5 -84.4-179.5 41.3 90.9 62.1 746 351 B T - 0 0 42 -27,-2.0 2,-0.2 -2,-0.1 27,-0.2 -0.949 18.4-140.7-131.5 112.9 39.8 93.8 64.3 747 352 B W + 0 0 3 -2,-0.5 27,-2.3 25,-0.4 2,-0.3 -0.448 29.4 160.7 -75.2 140.2 36.8 93.3 66.4 748 353 B G B -m 722 0W 0 -27,-1.9 -25,-1.6 25,-0.2 2,-0.3 -0.821 27.7-124.2-139.9-178.4 34.2 96.1 66.7 749 354 B S - 0 0 1 -27,-0.3 28,-2.2 26,-0.3 2,-0.3 -0.989 8.3-149.2-136.7 148.3 30.6 96.5 67.8 750 355 B H - 0 0 9 -2,-0.3 2,-0.3 26,-0.1 26,-0.0 -0.796 20.6-170.9-109.5 152.5 27.4 97.8 66.2 751 356 B S - 0 0 1 -2,-0.3 2,-0.3 -27,-0.1 27,-0.1 -0.888 17.8-151.8-138.2 168.3 24.5 99.4 68.1 752 357 B N - 0 0 22 -2,-0.3 27,-0.4 25,-0.1 -2,-0.0 -0.899 58.9 -61.5-126.1 163.0 20.9 100.7 67.8 753 358 B N S S+ 0 0 10 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