==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 03-AUG-10 3ALH . COMPND 2 MOLECULE: 2-METHYL-3-HYDROXYPYRIDINE-5-CARBOXYLIC ACID OXYG . SOURCE 2 ORGANISM_SCIENTIFIC: MESORHIZOBIUM LOTI; . AUTHOR J.KOBAYASHI,H.YOSHIDA,Y.YOSHIKANE,S.KAMITORI,T.YAGI . 740 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29692.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 531 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 124 16.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.8 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 . 61 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 187 25.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.4 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 4 2 2 3 1 2 0 0 2 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 2 0 RESIDUES PER ALPHA HELIX . 0 0 4 2 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 PARALLEL BRIDGES PER LADDER . 2 6 5 2 6 2 0 2 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 . 2 4 1 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 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 10 A K 0 0 235 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 16.4 -15.0 -32.1 -58.1 2 11 A T - 0 0 73 1,-0.1 2,-0.1 24,-0.0 24,-0.1 -0.644 360.0-116.2 -66.2 131.0 -16.0 -28.5 -59.3 3 12 A R - 0 0 75 -2,-0.3 24,-2.9 22,-0.1 2,-0.4 -0.415 28.1-142.4 -72.6 149.4 -14.2 -26.1 -56.9 4 13 A R E -a 27 0A 118 22,-0.2 137,-2.2 -2,-0.1 138,-1.2 -0.941 15.4-171.4-123.1 133.1 -16.4 -23.9 -54.7 5 14 A A E -ab 28 142A 1 22,-2.7 24,-2.1 -2,-0.4 2,-0.5 -0.974 9.2-160.5-124.3 141.2 -15.8 -20.2 -53.8 6 15 A E E -ab 29 143A 14 136,-2.4 138,-3.4 -2,-0.4 2,-0.6 -0.978 12.0-163.1-115.9 127.7 -17.6 -18.1 -51.3 7 16 A V E -ab 30 144A 0 22,-2.9 24,-3.1 -2,-0.5 2,-0.7 -0.919 6.9-152.4-115.6 124.7 -17.2 -14.4 -51.7 8 17 A A E +ab 31 145A 2 136,-3.5 138,-2.3 -2,-0.6 24,-0.2 -0.850 65.6 33.1 -98.1 115.8 -18.1 -11.9 -48.9 9 18 A G - 0 0 11 22,-3.0 23,-0.2 -2,-0.7 22,-0.1 0.236 59.7-139.9 118.0 127.3 -19.1 -8.4 -50.3 10 19 A G + 0 0 2 4,-0.1 28,-0.1 20,-0.1 22,-0.1 -0.200 65.1 111.2-106.1 43.6 -21.0 -7.3 -53.4 11 20 A G S > S- 0 0 32 135,-0.5 4,-2.8 26,-0.1 5,-0.4 -0.214 93.1 -72.8 -94.2-166.3 -18.9 -4.2 -54.2 12 21 A F H > S+ 0 0 20 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.896 133.0 49.4 -60.6 -37.6 -16.5 -3.9 -57.2 13 22 A A H > S+ 0 0 10 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.940 115.1 42.3 -66.3 -50.3 -13.9 -6.2 -55.6 14 23 A G H > S+ 0 0 0 132,-0.5 4,-2.6 2,-0.2 -2,-0.2 0.915 116.0 48.2 -62.5 -45.2 -16.4 -9.0 -54.7 15 24 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 5,-0.2 0.915 112.8 49.3 -65.5 -41.7 -18.2 -8.8 -58.0 16 25 A T H X S+ 0 0 0 -4,-2.2 4,-2.7 -5,-0.4 5,-0.3 0.949 112.9 45.7 -58.0 -49.8 -14.9 -8.8 -60.0 17 26 A A H X S+ 0 0 1 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.917 112.7 51.7 -58.5 -43.4 -13.6 -11.8 -58.1 18 27 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.944 113.5 43.8 -62.4 -45.7 -17.0 -13.7 -58.5 19 28 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.936 114.3 48.2 -64.8 -48.9 -17.1 -13.1 -62.3 20 29 A A H X S+ 0 0 2 -4,-2.7 4,-1.0 -5,-0.2 -1,-0.2 0.912 114.9 45.8 -62.9 -43.6 -13.5 -14.0 -62.9 21 30 A L H ><>S+ 0 0 2 -4,-2.5 5,-2.4 -5,-0.3 3,-0.6 0.934 112.1 50.3 -61.3 -44.7 -13.8 -17.2 -60.8 22 31 A K H ><5S+ 0 0 52 -4,-2.6 3,-1.6 1,-0.3 -2,-0.2 0.890 106.5 56.5 -63.1 -38.0 -17.1 -18.2 -62.5 23 32 A Q H 3<5S+ 0 0 68 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.794 105.2 53.2 -60.2 -30.6 -15.5 -17.6 -65.9 24 33 A N T <<5S- 0 0 61 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.295 128.2 -96.4 -88.7 4.4 -12.8 -20.2 -64.8 25 34 A G T < 5S+ 0 0 48 -3,-1.6 -3,-0.2 1,-0.3 -22,-0.1 0.453 75.7 142.0 96.2 2.2 -15.4 -22.9 -64.0 26 35 A W < - 0 0 0 -5,-2.4 2,-0.6 -24,-0.1 -1,-0.3 -0.469 55.3-124.2 -66.5 148.5 -15.7 -22.3 -60.1 27 36 A D E -a 4 0A 79 -24,-2.9 -22,-2.7 -2,-0.1 2,-0.4 -0.860 42.4-167.7 -83.7 129.4 -19.1 -22.6 -58.5 28 37 A V E -a 5 0A 6 -2,-0.6 86,-2.5 84,-0.2 2,-0.4 -0.966 24.0-175.4-131.4 131.2 -19.4 -19.2 -56.8 29 38 A R E -ac 6 114A 56 -24,-2.1 -22,-2.9 -2,-0.4 2,-0.4 -0.972 13.0-160.7-117.4 136.2 -21.8 -17.7 -54.3 30 39 A L E -ac 7 115A 0 84,-3.3 86,-2.9 -2,-0.4 2,-0.5 -0.955 4.3-151.4-116.9 142.2 -21.5 -14.0 -53.4 31 40 A H E -ac 8 116A 2 -24,-3.1 -22,-3.0 -2,-0.4 2,-0.5 -0.921 9.9-173.7-117.2 124.6 -22.9 -12.6 -50.2 32 41 A E - 0 0 28 84,-2.9 87,-2.5 -2,-0.5 86,-0.3 -0.967 14.6-154.6-114.5 122.4 -24.1 -9.0 -49.9 33 42 A K S S+ 0 0 137 -2,-0.5 87,-0.2 85,-0.3 -1,-0.1 0.842 71.4 82.6 -68.6 -30.8 -25.1 -7.8 -46.4 34 43 A S S S- 0 0 52 85,-0.1 84,-2.5 1,-0.1 85,-0.4 -0.248 91.8-112.2 -68.9 169.2 -27.4 -5.0 -47.6 35 44 A S S S+ 0 0 79 82,-0.2 2,-0.3 83,-0.1 82,-0.1 0.673 98.9 19.1 -75.5 -16.0 -31.0 -5.7 -48.7 36 45 A E S S- 0 0 100 2,-0.1 2,-0.6 81,-0.0 -2,-0.1 -0.966 87.2 -98.7-148.7 166.3 -30.1 -4.9 -52.3 37 46 A L + 0 0 29 -2,-0.3 2,-0.3 -4,-0.1 -26,-0.1 -0.771 58.6 144.9 -87.9 119.2 -27.1 -4.6 -54.6 38 47 A R - 0 0 135 -2,-0.6 2,-0.5 -28,-0.1 -4,-0.1 -0.990 40.2-138.0-155.0 149.2 -26.1 -0.9 -54.9 39 48 A A - 0 0 15 -2,-0.3 3,-0.3 -28,-0.1 2,-0.2 -0.930 20.4-161.0-110.8 130.6 -22.8 1.1 -55.2 40 49 A F + 0 0 157 -2,-0.5 -2,-0.0 1,-0.1 3,-0.0 -0.700 57.6 76.8-103.1 165.1 -22.4 4.3 -53.2 41 50 A G S S- 0 0 10 -2,-0.2 2,-1.8 131,-0.2 -1,-0.1 0.421 85.0-118.7 118.6 6.3 -20.0 7.2 -53.8 42 51 A A S S+ 0 0 23 -3,-0.3 55,-2.4 130,-0.1 56,-0.5 -0.468 80.9 13.4 68.2 -78.4 -21.8 9.0 -56.8 43 52 A G E -F 96 0B 0 -2,-1.8 2,-0.3 53,-0.3 53,-0.2 -0.748 61.4-162.4-129.7 172.8 -19.1 8.7 -59.5 44 53 A I E -F 95 0B 10 51,-2.4 51,-2.0 -2,-0.2 2,-0.4 -0.983 12.8-138.7-156.0 144.6 -15.9 7.0 -60.2 45 54 A Y E -F 94 0B 14 -2,-0.3 2,-0.3 49,-0.2 49,-0.2 -0.901 18.7-172.8-100.4 137.0 -12.8 7.2 -62.5 46 55 A L E -F 93 0B 1 47,-2.8 47,-2.7 -2,-0.4 2,-0.2 -0.865 3.5-163.0-117.6 161.6 -11.3 4.1 -64.1 47 56 A W E >> -F 92 0B 2 -2,-0.3 4,-2.5 45,-0.3 3,-0.6 -0.748 47.6 -71.4-124.0-175.8 -8.0 3.9 -66.2 48 57 A H H 3> S+ 0 0 9 43,-1.9 4,-2.4 1,-0.2 5,-0.2 0.848 128.2 56.6 -48.1 -41.4 -6.5 1.4 -68.6 49 58 A N H 3> S+ 0 0 2 308,-1.1 4,-1.5 1,-0.2 -1,-0.2 0.939 113.7 38.2 -61.8 -51.0 -5.8 -1.2 -65.8 50 59 A G H <> S+ 0 0 0 -3,-0.6 4,-2.4 2,-0.2 -1,-0.2 0.820 114.2 55.3 -66.5 -41.4 -9.5 -1.3 -64.6 51 60 A L H X S+ 0 0 17 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.850 107.7 51.0 -58.0 -34.7 -10.8 -1.1 -68.2 52 61 A R H X S+ 0 0 51 -4,-2.4 4,-2.9 -5,-0.3 -2,-0.2 0.882 106.7 51.8 -72.4 -36.6 -8.7 -4.1 -69.0 53 62 A V H X S+ 0 0 0 -4,-1.5 4,-1.8 -5,-0.2 -2,-0.2 0.952 110.1 50.5 -60.6 -49.3 -10.1 -6.0 -66.0 54 63 A L H <>S+ 0 0 0 -4,-2.4 5,-2.8 1,-0.2 6,-0.8 0.925 109.5 51.1 -54.8 -45.9 -13.6 -5.1 -67.4 55 64 A E H ><5S+ 0 0 90 -4,-2.5 3,-1.6 4,-0.2 -1,-0.2 0.946 111.0 46.8 -50.1 -49.4 -12.4 -6.5 -70.8 56 65 A G H 3<5S+ 0 0 20 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.713 113.1 51.2 -72.0 -19.9 -11.2 -9.8 -69.2 57 66 A L T 3<5S- 0 0 0 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.459 110.8-122.0 -86.6 -2.9 -14.6 -9.9 -67.3 58 67 A G T < 5S+ 0 0 45 -3,-1.6 -3,-0.2 -4,-0.4 4,-0.1 0.837 88.0 106.9 51.9 38.5 -16.6 -9.4 -70.5 59 68 A A >< + 0 0 2 -5,-2.8 4,-0.9 -6,-0.2 -4,-0.2 0.282 41.7 98.0-123.4 12.7 -18.2 -6.3 -68.9 60 69 A L H >> S+ 0 0 35 -6,-0.8 4,-2.7 1,-0.2 3,-0.5 0.895 77.1 55.9 -71.8 -40.1 -16.4 -3.6 -70.9 61 70 A D H 3> S+ 0 0 127 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.920 105.8 49.6 -67.3 -41.5 -19.1 -2.9 -73.5 62 71 A D H 34 S+ 0 0 93 2,-0.2 -1,-0.3 1,-0.2 -2,-0.2 0.767 114.4 47.4 -63.2 -29.2 -21.8 -2.1 -70.9 63 72 A V H << S+ 0 0 0 -4,-0.9 -2,-0.2 -3,-0.5 -1,-0.2 0.945 111.4 46.9 -78.3 -52.9 -19.4 0.3 -69.2 64 73 A L H >< S+ 0 0 59 -4,-2.7 3,-1.8 2,-0.1 2,-0.5 0.894 97.4 80.3 -55.2 -45.5 -18.1 2.2 -72.2 65 74 A Q T 3< S+ 0 0 155 -4,-2.3 3,-0.1 -5,-0.3 0, 0.0 -0.541 110.6 9.3 -59.6 114.9 -21.7 2.6 -73.5 66 75 A G T 3 S+ 0 0 33 -2,-0.5 -1,-0.3 1,-0.3 2,-0.2 0.675 109.6 98.3 88.2 11.9 -23.0 5.6 -71.4 67 76 A S < - 0 0 12 -3,-1.8 2,-0.4 28,-0.1 -1,-0.3 -0.733 62.8-125.8-121.7-173.8 -19.7 6.7 -69.8 68 77 A H B -G 94 0B 28 26,-2.3 26,-3.1 -2,-0.2 141,-0.1 -0.958 14.7-161.3-141.5 135.7 -17.3 9.5 -70.7 69 78 A T - 0 0 55 -2,-0.4 24,-0.1 24,-0.2 139,-0.1 -0.933 32.6-136.8-109.5 114.3 -13.7 10.1 -71.5 70 79 A P - 0 0 3 0, 0.0 119,-0.2 0, 0.0 3,-0.1 -0.195 17.4-118.5 -61.7 154.2 -13.1 13.9 -71.1 71 80 A P S S- 0 0 86 0, 0.0 2,-0.3 0, 0.0 118,-0.1 0.810 93.7 -1.4 -63.5 -29.0 -10.9 15.5 -73.9 72 81 A T - 0 0 13 116,-0.1 118,-1.9 2,-0.0 2,-0.7 -0.988 64.7-121.4-155.3 159.5 -8.4 16.4 -71.1 73 82 A Y E -Hi 85 190C 10 12,-2.7 12,-2.9 -2,-0.3 2,-0.3 -0.945 43.8-173.0-101.9 109.5 -7.8 16.2 -67.4 74 83 A E E -Hi 84 191C 12 116,-2.8 118,-2.3 -2,-0.7 2,-0.4 -0.804 12.8-159.8-110.9 144.5 -7.4 19.9 -66.4 75 84 A T E -Hi 83 192C 3 8,-2.2 7,-2.9 -2,-0.3 8,-1.3 -0.978 5.6-167.1-124.7 142.7 -6.4 21.4 -63.1 76 85 A W E -Hi 81 193C 36 116,-2.8 118,-2.7 -2,-0.4 2,-0.5 -0.953 9.0-162.0-124.8 145.1 -7.1 24.9 -61.8 77 86 A M E > S-Hi 80 194C 34 3,-2.6 3,-2.1 -2,-0.4 118,-0.2 -0.998 86.1 -15.4-124.8 121.7 -5.6 26.8 -58.8 78 87 A H T 3 S- 0 0 78 116,-2.4 117,-0.1 -2,-0.5 -1,-0.1 0.864 129.7 -55.2 51.6 44.2 -7.7 29.8 -57.8 79 88 A N T 3 S+ 0 0 81 115,-0.5 2,-0.5 1,-0.2 -1,-0.3 0.475 112.5 118.0 71.9 5.4 -9.5 29.6 -61.2 80 89 A K E < S-H 77 0C 143 -3,-2.1 -3,-2.6 2,-0.0 2,-0.3 -0.908 70.9-121.7-104.6 130.2 -6.4 29.8 -63.3 81 90 A S E +H 76 0C 41 -2,-0.5 -5,-0.3 -5,-0.2 3,-0.1 -0.501 33.7 175.3 -66.1 122.6 -5.8 26.7 -65.4 82 91 A V E - 0 0 55 -7,-2.9 2,-0.3 1,-0.3 -6,-0.2 0.570 60.0 -1.5-109.1 -11.9 -2.4 25.3 -64.4 83 92 A S E -H 75 0C 9 -8,-1.3 -8,-2.2 263,-0.1 2,-0.4 -0.949 44.3-157.2-165.6 158.0 -2.3 22.1 -66.5 84 93 A K E -H 74 0C 102 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.984 24.4-172.3-137.8 123.0 -4.1 19.9 -69.0 85 94 A E E +H 73 0C 18 -12,-2.9 -12,-2.7 -2,-0.4 -2,-0.0 -0.965 23.0 172.4-121.8 138.0 -3.0 16.3 -69.1 86 95 A T > - 0 0 78 -2,-0.4 3,-1.1 -14,-0.2 4,-0.2 0.274 44.2-127.7-129.0 5.4 -4.0 13.4 -71.6 87 96 A F G > - 0 0 9 1,-0.3 3,-2.1 2,-0.2 -2,-0.0 0.774 54.5 -73.5 62.5 28.2 -1.6 10.8 -70.4 88 97 A N G 3 S- 0 0 110 1,-0.3 -1,-0.3 282,-0.1 -3,-0.0 0.910 98.6 -47.6 55.0 39.2 -0.0 10.0 -73.8 89 98 A G G < S+ 0 0 47 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.406 89.5 158.0 89.5 -8.6 -3.1 8.1 -75.0 90 99 A L < - 0 0 2 -3,-2.1 -1,-0.2 -4,-0.2 268,-0.1 -0.358 47.1-115.3 -54.9 122.7 -3.6 6.0 -71.8 91 100 A P + 0 0 47 0, 0.0 -43,-1.9 0, 0.0 2,-0.3 -0.281 46.5 161.7 -60.9 141.5 -7.3 5.0 -71.8 92 101 A W E -F 47 0B 12 -45,-0.3 2,-0.3 -44,-0.1 -45,-0.3 -0.960 14.4-168.8-157.0 166.5 -9.4 6.4 -68.9 93 102 A R E -F 46 0B 53 -47,-2.7 -47,-2.8 -2,-0.3 2,-0.4 -0.981 13.9-149.3-162.4 143.2 -13.1 6.8 -68.2 94 103 A I E +FG 45 68B 0 -26,-3.1 -26,-2.3 -2,-0.3 2,-0.3 -0.955 30.1 151.1-117.6 145.2 -15.5 8.5 -65.8 95 104 A M E -F 44 0B 0 -51,-2.0 -51,-2.4 -2,-0.4 2,-0.1 -0.965 49.0 -86.5-159.9 164.5 -19.0 7.0 -65.0 96 105 A T E > -F 43 0B 8 -2,-0.3 4,-1.5 -53,-0.2 -53,-0.3 -0.467 39.7-119.0 -72.5 152.7 -21.5 7.0 -62.2 97 106 A R H > S+ 0 0 53 -55,-2.4 4,-2.8 1,-0.2 5,-0.2 0.885 116.1 54.6 -54.5 -44.6 -20.9 4.2 -59.6 98 107 A S H > S+ 0 0 53 -56,-0.5 4,-3.1 1,-0.2 5,-0.2 0.896 102.5 56.8 -58.5 -40.1 -24.3 2.7 -60.5 99 108 A H H > S+ 0 0 43 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.921 113.7 38.5 -56.6 -46.8 -23.3 2.6 -64.1 100 109 A L H X S+ 0 0 0 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.933 116.1 51.9 -69.5 -45.2 -20.2 0.4 -63.2 101 110 A H H X S+ 0 0 2 -4,-2.8 4,-3.2 1,-0.2 5,-0.2 0.909 108.3 51.5 -55.2 -47.7 -22.0 -1.6 -60.6 102 111 A D H X S+ 0 0 85 -4,-3.1 4,-3.0 1,-0.2 5,-0.2 0.856 108.0 51.6 -60.6 -42.2 -24.9 -2.4 -63.0 103 112 A A H X S+ 0 0 4 -4,-1.5 4,-1.5 -5,-0.2 -1,-0.2 0.874 114.1 43.7 -63.5 -44.4 -22.5 -3.7 -65.7 104 113 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.901 115.0 48.5 -65.8 -45.0 -20.8 -6.0 -63.1 105 114 A V H X S+ 0 0 13 -4,-3.2 4,-2.3 2,-0.2 5,-0.3 0.937 112.1 49.5 -61.0 -47.1 -24.1 -7.2 -61.6 106 115 A N H X S+ 0 0 90 -4,-3.0 4,-2.8 1,-0.2 -1,-0.2 0.922 113.0 47.2 -57.9 -39.1 -25.6 -7.9 -65.1 107 116 A R H X S+ 0 0 69 -4,-1.5 4,-1.9 -5,-0.2 -1,-0.2 0.902 109.6 51.8 -70.1 -43.3 -22.5 -9.8 -66.0 108 117 A A H <>S+ 0 0 0 -4,-2.3 5,-2.5 2,-0.2 4,-0.2 0.932 114.0 45.1 -55.8 -44.4 -22.4 -11.9 -62.7 109 118 A R H ><5S+ 0 0 148 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.906 107.8 56.5 -73.1 -42.2 -26.1 -12.9 -63.2 110 119 A A H 3<5S+ 0 0 81 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.870 109.2 48.2 -55.5 -36.8 -25.6 -13.7 -66.9 111 120 A L T 3<5S- 0 0 46 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.459 118.1-112.6 -76.6 -9.7 -22.8 -16.2 -65.8 112 121 A G T < 5 + 0 0 47 -3,-1.8 2,-0.3 1,-0.2 -84,-0.2 0.761 52.8 167.8 77.0 28.5 -25.0 -17.8 -63.1 113 122 A V < - 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0 0 2 -4,-1.8 -19,-2.9 -5,-0.2 2,-0.3 -0.156 24.9-179.0 -48.2 137.9 -5.8 -1.1 -25.9 655 293 B M - 0 0 14 -21,-0.2 -22,-0.1 1,-0.0 47,-0.1 -0.802 33.6 -72.5-141.9 173.8 -3.5 -4.1 -25.2 656 294 B C - 0 0 8 46,-0.4 3,-0.5 -2,-0.3 5,-0.3 -0.470 43.2-124.7 -69.8 147.6 -3.6 -7.9 -24.8 657 295 B P S > S+ 0 0 70 0, 0.0 3,-2.2 0, 0.0 5,-0.1 0.568 80.7 103.8 -70.5 -11.2 -5.1 -9.0 -21.4 658 296 B A T 3 S+ 0 0 17 1,-0.3 48,-0.0 47,-0.3 47,-0.0 0.751 85.4 36.2 -50.1 -43.3 -2.2 -11.1 -20.2 659 297 B L T 3 S- 0 0 4 -3,-0.5 -1,-0.3 42,-0.1 43,-0.0 0.474 102.6-127.5 -88.2 -0.4 -0.6 -8.8 -17.6 660 298 B A S < S+ 0 0 32 -3,-2.2 -2,-0.1 -4,-0.1 4,-0.1 0.930 75.4 119.5 52.4 51.5 -4.1 -7.5 -16.5 661 299 B Q > + 0 0 3 -5,-0.3 4,-3.0 3,-0.1 5,-0.3 0.289 28.0 102.7-126.6 8.2 -2.8 -3.9 -17.0 662 300 B G H > S+ 0 0 22 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.971 98.0 29.1 -63.9 -48.1 -5.2 -2.5 -19.6 663 301 B A H > S+ 0 0 19 2,-0.2 4,-3.2 -247,-0.2 -1,-0.2 0.859 117.7 58.6 -78.5 -32.0 -7.2 -0.5 -17.1 664 302 B G H > S+ 0 0 3 1,-0.2 4,-2.5 -248,-0.2 5,-0.2 0.954 111.4 42.2 -63.1 -47.2 -4.3 -0.1 -14.6 665 303 B C H X S+ 0 0 3 -4,-3.0 4,-3.2 2,-0.2 -1,-0.2 0.933 112.8 53.6 -63.9 -41.3 -2.3 1.7 -17.3 666 304 B A H X S+ 0 0 4 -4,-1.9 4,-2.6 -5,-0.3 -2,-0.2 0.904 112.3 45.4 -57.6 -46.8 -5.4 3.7 -18.4 667 305 B M H X S+ 0 0 0 -4,-3.2 4,-2.6 2,-0.2 5,-0.2 0.898 112.8 48.7 -63.5 -48.2 -5.9 4.9 -14.8 668 306 B V H X S+ 0 0 7 -4,-2.5 4,-2.8 -5,-0.2 -2,-0.2 0.913 114.3 47.9 -55.9 -49.2 -2.2 5.7 -14.3 669 307 B N H X S+ 0 0 2 -4,-3.2 4,-1.8 -5,-0.2 -2,-0.2 0.934 113.2 45.2 -60.9 -49.1 -2.3 7.6 -17.6 670 308 B A H X S+ 0 0 1 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.922 116.8 47.1 -59.1 -42.7 -5.5 9.6 -16.9 671 309 B F H X S+ 0 0 22 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.934 110.8 50.9 -64.1 -43.3 -4.3 10.4 -13.4 672 310 B S H X S+ 0 0 0 -4,-2.8 4,-2.6 -5,-0.2 -1,-0.2 0.831 102.8 61.3 -63.7 -32.8 -0.8 11.4 -14.7 673 311 B L H X S+ 0 0 1 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.940 103.4 49.8 -58.6 -48.1 -2.5 13.8 -17.3 674 312 B S H < S+ 0 0 3 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.896 108.7 53.5 -60.9 -38.1 -4.0 15.8 -14.5 675 313 B Q H >< S+ 0 0 23 -4,-1.6 3,-2.0 1,-0.2 -2,-0.2 0.955 108.4 49.0 -59.1 -50.7 -0.6 16.0 -12.7 676 314 B D H >< S+ 0 0 11 -4,-2.6 3,-1.1 1,-0.3 5,-0.3 0.796 101.3 63.2 -61.2 -28.0 1.1 17.4 -15.8 677 315 B L T 3< S+ 0 0 12 -4,-1.6 -1,-0.3 1,-0.2 3,-0.2 0.406 93.9 66.1 -78.1 4.3 -1.7 20.0 -16.3 678 316 B E T < S+ 0 0 88 -3,-2.0 -1,-0.2 1,-0.1 -2,-0.1 0.133 74.8 90.7-102.9 13.1 -0.6 21.5 -12.9 679 317 B E S < S- 0 0 115 -3,-1.1 -1,-0.1 3,-0.1 -2,-0.1 0.452 100.5-108.5 -92.9 -0.8 2.9 22.7 -14.0 680 318 B G S S+ 0 0 79 1,-0.3 3,-0.1 -3,-0.2 -3,-0.1 0.325 79.0 123.6 90.7 -7.6 2.0 26.2 -15.2 681 319 B S S S- 0 0 66 -5,-0.3 -1,-0.3 1,-0.1 -2,-0.1 -0.278 73.5 -87.4 -78.0 166.7 2.4 25.4 -19.0 682 320 B S > - 0 0 55 1,-0.1 4,-2.3 -3,-0.1 5,-0.2 -0.352 43.5-110.8 -58.3 154.9 -0.2 25.8 -21.7 683 321 B V H > S+ 0 0 21 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.900 118.5 57.4 -55.4 -44.8 -2.5 22.8 -22.0 684 322 B E H > S+ 0 0 66 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.917 110.6 41.5 -58.4 -44.0 -0.9 21.9 -25.4 685 323 B D H > S+ 0 0 105 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.873 111.7 53.9 -70.9 -38.4 2.6 21.8 -23.9 686 324 B A H X S+ 0 0 3 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.867 107.0 54.7 -58.5 -42.7 1.5 19.9 -20.7 687 325 B L H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.923 109.9 45.1 -56.7 -50.0 -0.1 17.2 -23.0 688 326 B V H X S+ 0 0 84 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.936 114.0 48.7 -62.6 -45.6 3.2 16.7 -24.9 689 327 B A H X S+ 0 0 46 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.858 109.1 56.0 -60.8 -36.5 5.2 16.6 -21.6 690 328 B W H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.5 0.972 109.2 44.1 -59.9 -49.4 2.5 14.1 -20.2 691 329 B E H X S+ 0 0 25 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.940 113.1 51.9 -64.5 -45.0 3.0 11.6 -23.1 692 330 B T H < S+ 0 0 108 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.901 115.5 41.6 -53.5 -42.6 6.8 12.0 -22.9 693 331 B R H < S+ 0 0 73 -4,-2.4 -2,-0.2 -5,-0.1 4,-0.2 0.913 128.7 21.6 -70.5 -48.0 6.8 11.2 -19.1 694 332 B I H >X S+ 0 0 1 -4,-2.7 4,-0.9 -5,-0.2 3,-0.7 0.662 99.8 80.8-108.0 -21.6 4.3 8.4 -18.8 695 333 B R H 3X S+ 0 0 19 -4,-2.4 4,-2.9 -5,-0.5 3,-0.4 0.857 81.0 65.3 -67.1 -36.4 3.9 6.7 -22.2 696 334 B P H 3> S+ 0 0 53 0, 0.0 4,-2.6 0, 0.0 5,-0.3 0.876 97.3 57.3 -56.5 -36.1 7.0 4.4 -22.1 697 335 B I H <> S+ 0 0 16 -3,-0.7 4,-1.9 1,-0.2 -2,-0.2 0.924 111.7 42.9 -56.3 -44.5 5.6 2.4 -19.1 698 336 B T H X S+ 0 0 1 -4,-0.9 4,-3.7 -3,-0.4 5,-0.3 0.909 111.7 52.8 -65.6 -44.6 2.5 1.6 -21.2 699 337 B D H X S+ 0 0 36 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.942 112.8 43.7 -61.2 -45.7 4.4 0.8 -24.4 700 338 B R H X S+ 0 0 116 -4,-2.6 4,-2.5 -5,-0.2 5,-0.3 0.893 115.5 48.5 -65.2 -41.7 6.7 -1.6 -22.6 701 339 B C H X S+ 0 0 8 -4,-1.9 4,-2.5 -5,-0.3 5,-0.2 0.940 112.9 48.4 -62.5 -48.1 3.7 -3.2 -20.7 702 340 B Q H X S+ 0 0 20 -4,-3.7 4,-2.2 2,-0.2 -46,-0.4 0.908 112.5 49.0 -55.3 -43.6 1.7 -3.4 -23.9 703 341 B A H X S+ 0 0 52 -4,-2.5 4,-2.2 -5,-0.3 -2,-0.2 0.935 113.9 44.9 -64.1 -44.3 4.7 -5.0 -25.8 704 342 B L H X S+ 0 0 42 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.922 111.9 50.7 -72.3 -37.9 5.3 -7.6 -23.1 705 343 B S H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.3 -47,-0.3 0.920 109.3 52.5 -62.5 -42.0 1.7 -8.5 -22.7 706 344 B G H X S+ 0 0 23 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.914 111.0 48.1 -57.9 -44.4 1.5 -9.0 -26.5 707 345 B D H X S+ 0 0 91 -4,-2.2 4,-2.4 2,-0.2 6,-0.2 0.920 111.8 48.3 -62.7 -48.2 4.5 -11.4 -26.3 708 346 B Y H X>S+ 0 0 15 -4,-3.0 5,-1.9 2,-0.2 4,-0.6 0.919 113.2 47.9 -55.0 -46.8 3.0 -13.3 -23.4 709 347 B A H ><5S+ 0 0 45 -4,-2.7 3,-0.6 -5,-0.2 -2,-0.2 0.909 113.8 45.8 -65.7 -40.9 -0.3 -13.7 -25.2 710 348 B A H 3<5S+ 0 0 69 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.882 120.9 40.3 -68.2 -40.5 1.3 -14.8 -28.6 711 349 B N H 3<5S- 0 0 107 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.354 101.5-129.2 -88.0 2.4 3.6 -17.2 -26.7 712 350 B R T X<5 + 0 0 142 -4,-0.6 3,-1.6 -3,-0.6 4,-0.2 0.854 50.4 161.1 51.5 36.1 1.0 -18.5 -24.2 713 351 B S G > < + 0 0 12 -5,-1.9 3,-1.7 1,-0.3 4,-0.4 0.774 59.8 64.8 -61.2 -31.0 3.7 -17.7 -21.6 714 352 B L G > S+ 0 0 12 -6,-0.3 3,-1.4 1,-0.3 -1,-0.3 0.775 87.4 74.2 -68.1 -19.8 1.3 -17.6 -18.6 715 353 B S G < S+ 0 0 15 -3,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.681 90.9 57.2 -65.4 -17.5 0.7 -21.3 -19.2 716 354 B K G < S- 0 0 134 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.699 101.7-139.6 -90.7 -17.3 4.1 -22.0 -17.8 717 355 B G S < S+ 0 0 5 -3,-1.4 -1,-0.1 -4,-0.4 -263,-0.1 0.009 77.0 67.5 80.1 167.6 3.5 -20.4 -14.5 718 356 B N + 0 0 105 1,-0.1 -1,-0.1 -4,-0.1 -4,-0.1 0.764 64.7 128.2 54.8 28.0 6.1 -18.2 -12.6 719 357 B M + 0 0 32 -5,-0.2 2,-1.6 1,-0.1 5,-0.1 0.412 33.4 96.3-101.3 5.7 5.8 -15.6 -15.3 720 358 B F + 0 0 13 4,-0.1 -1,-0.1 -6,-0.1 -262,-0.1 -0.570 61.7 166.4 -86.2 75.8 5.1 -12.5 -13.2 721 359 B T > - 0 0 51 -2,-1.6 4,-2.3 1,-0.1 5,-0.2 -0.243 55.7 -91.5 -83.0 173.6 8.8 -11.6 -13.3 722 360 B P T 4 S+ 0 0 75 0, 0.0 4,-0.2 0, 0.0 7,-0.2 0.938 130.5 48.2 -53.4 -44.2 10.3 -8.2 -12.3 723 361 B A T >4 S+ 0 0 59 1,-0.2 3,-1.5 2,-0.2 4,-0.3 0.931 109.5 51.0 -67.5 -37.8 9.9 -7.0 -15.9 724 362 B A T 34 S+ 0 0 5 1,-0.3 3,-0.4 2,-0.1 4,-0.3 0.849 112.2 48.9 -63.4 -33.2 6.3 -8.3 -16.2 725 363 B L T 3X S+ 0 0 4 -4,-2.3 4,-2.3 1,-0.2 -1,-0.3 0.326 79.3 106.0 -88.4 6.9 5.4 -6.5 -13.0 726 364 B E H <> S+ 0 0 48 -3,-1.5 4,-0.7 -4,-0.2 -1,-0.2 0.914 81.7 44.9 -53.5 -47.5 7.0 -3.2 -14.1 727 365 B A H >4 S+ 0 0 2 -3,-0.4 3,-1.2 -4,-0.3 -1,-0.2 0.947 114.2 50.7 -63.0 -42.2 3.7 -1.4 -14.7 728 366 B A H 34 S+ 0 0 2 -4,-0.3 -308,-1.0 1,-0.3 -1,-0.2 0.828 106.0 55.5 -65.0 -32.1 2.3 -2.7 -11.5 729 367 B R H 3< S+ 0 0 51 -4,-2.3 9,-3.0 -7,-0.2 2,-0.3 0.642 84.0 106.1 -73.0 -16.4 5.3 -1.5 -9.5 730 368 B Y E << -I 737 0K 12 -3,-1.2 7,-0.2 -4,-0.7 -307,-0.2 -0.504 57.0-158.0 -73.6 126.9 4.9 2.0 -10.7 731 369 B D E >> -I 736 0K 2 5,-3.2 4,-2.0 -2,-0.3 5,-1.2 -0.875 5.4-170.5-103.1 105.4 3.5 4.4 -8.0 732 370 B P T 45S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.646 80.3 62.4 -69.5 -17.8 1.9 7.3 -9.8 733 371 B L T 45S+ 0 0 45 1,-0.1 -2,-0.0 3,-0.1 -309,-0.0 0.947 121.4 21.2 -74.3 -47.4 1.5 9.4 -6.6 734 372 B R T 45S- 0 0 162 2,-0.2 -1,-0.1 -3,-0.1 3,-0.1 0.537 103.1-128.8 -97.0 -7.0 5.2 9.6 -5.8 735 373 B R T <5S+ 0 0 99 -4,-2.0 2,-0.3 1,-0.2 -5,-0.1 0.887 71.0 105.5 65.0 39.4 6.3 8.9 -9.4 736 374 B V E