==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 06-AUG-13 4M49 . COMPND 2 MOLECULE: L-LACTATE DEHYDROGENASE A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.EIGENBROT,M.ULTSCH . 1324 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45770.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 959 72.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 101 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 128 9.7 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.6 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 . 92 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 146 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 439 33.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.1 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 4 0 0 1 1 0 0 11 1 0 8 0 0 8 0 0 0 3 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 11 5 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 . 8 12 4 4 0 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 ANTIPARALLEL BRIDGES PER LADDER . 4 4 0 0 0 0 0 0 0 4 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 A 0 0 107 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-166.3 59.4 -13.6 3.5 2 2 A T > - 0 0 62 1,-0.1 4,-2.2 4,-0.0 5,-0.2 -0.168 360.0-111.7 -63.9 160.9 58.3 -13.0 7.1 3 3 A L H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.950 121.1 55.7 -57.5 -47.1 55.4 -14.9 8.7 4 4 A K H > S+ 0 0 83 1,-0.2 4,-3.2 2,-0.2 -1,-0.2 0.918 108.9 45.3 -48.6 -50.5 53.6 -11.5 8.7 5 5 A D H 4 S+ 0 0 86 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.841 112.1 51.4 -68.2 -32.2 54.1 -11.1 4.9 6 6 A Q H < S+ 0 0 73 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.885 119.4 38.1 -68.2 -35.5 53.1 -14.6 4.2 7 7 A L H < S+ 0 0 0 -4,-2.5 1293,-3.2 -5,-0.2 2,-0.4 0.855 118.7 41.9 -80.7 -40.7 49.9 -14.1 6.3 8 8 A I E < -A 1299 0A 8 -4,-3.2 2,-0.5 1291,-0.2 1291,-0.2 -0.939 57.9-155.9-126.6 128.2 49.0 -10.5 5.4 9 9 A Y E -A 1298 0A 99 1289,-2.9 1289,-2.6 -2,-0.4 2,-0.4 -0.883 24.1-138.8 -95.3 131.7 48.8 -8.5 2.2 10 10 A N E -A 1297 0A 46 -2,-0.5 1287,-0.3 1287,-0.2 3,-0.1 -0.773 21.3-177.9 -96.1 130.5 49.1 -4.7 2.8 11 11 A L S S- 0 0 33 1285,-2.8 2,-0.3 -2,-0.4 1286,-0.2 0.802 72.7 -6.3 -89.8 -38.9 46.9 -2.2 0.8 12 12 A L - 0 0 43 1284,-1.3 -1,-0.4 1139,-0.0 2,-0.3 -0.985 57.8-129.1-158.6 153.7 48.3 1.0 2.3 13 13 A K - 0 0 152 1,-0.3 1283,-0.0 -2,-0.3 -3,-0.0 -0.284 48.4-168.4-107.3 48.6 50.7 2.1 5.0 14 14 A E + 0 0 67 -2,-0.3 -1,-0.3 1,-0.1 0, 0.0 0.025 29.1 174.0 43.1-150.7 48.6 4.6 6.9 15 15 A E - 0 0 139 1,-0.1 2,-0.1 -3,-0.1 -1,-0.1 0.482 5.4-175.7-130.2 141.2 48.9 6.6 8.9 16 16 A Q - 0 0 60 1,-0.1 3,-0.1 0, 0.0 -1,-0.1 -0.395 36.7-106.8 -79.8 148.8 46.3 9.1 10.2 17 17 A T - 0 0 71 1,-0.1 -1,-0.1 -2,-0.1 70,-0.1 -0.382 62.9 -78.5 -55.1 148.3 46.8 11.9 12.7 18 18 A P - 0 0 21 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.332 47.0-167.7 -56.4 138.4 45.0 10.8 15.9 19 19 A Q S S+ 0 0 42 1,-0.1 -2,-0.0 -3,-0.1 68,-0.0 0.800 77.9 15.0-101.8 -37.4 41.2 11.2 15.6 20 20 A N S S+ 0 0 22 2,-0.1 25,-1.6 1240,-0.0 26,-0.9 -0.395 85.5 162.1-136.9 58.9 39.8 10.8 19.2 21 21 A K E -k 46 0B 7 66,-0.5 68,-2.4 23,-0.2 69,-1.5 -0.612 18.3-171.6 -93.6 138.3 42.9 11.1 21.4 22 22 A I E -kl 47 90B 0 24,-2.2 26,-2.5 -2,-0.3 2,-0.4 -0.967 6.9-157.4-122.3 140.6 43.0 11.9 25.1 23 23 A T E -kl 48 91B 0 67,-2.6 69,-3.5 -2,-0.4 2,-0.5 -0.969 1.8-160.0-116.5 135.0 46.0 12.6 27.2 24 24 A V E -kl 49 92B 0 24,-3.0 26,-2.1 -2,-0.4 2,-0.7 -0.964 9.0-156.4-110.5 122.8 46.3 12.1 31.0 25 25 A V E +kl 50 93B 2 67,-3.4 69,-2.6 -2,-0.5 70,-0.7 -0.879 67.8 27.5-102.9 116.7 49.2 14.1 32.6 26 26 A G - 0 0 3 24,-4.0 25,-0.2 -2,-0.7 -1,-0.1 0.512 62.1-148.7 99.9 113.8 50.3 12.6 35.9 27 27 A V + 0 0 0 4,-0.2 -1,-0.1 5,-0.1 24,-0.1 -0.073 54.2 124.0-105.7 33.9 49.9 8.9 36.6 28 28 A G S > S- 0 0 38 66,-0.1 4,-2.3 1,-0.0 5,-0.2 0.072 88.1 -68.7 -67.1-166.2 49.4 9.1 40.4 29 29 A A H > S+ 0 0 42 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.870 137.8 44.4 -56.5 -42.3 46.3 7.5 41.9 30 30 A V H > S+ 0 0 37 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.907 111.4 52.8 -72.5 -43.4 44.0 10.1 40.3 31 31 A G H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.943 111.8 44.9 -56.3 -48.5 45.6 10.0 36.9 32 32 A M H X S+ 0 0 5 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.785 110.1 54.2 -72.7 -25.4 45.3 6.2 36.6 33 33 A A H X S+ 0 0 1 -4,-1.2 4,-2.0 -5,-0.2 -1,-0.2 0.906 110.0 47.6 -74.2 -39.6 41.7 6.2 37.8 34 34 A C H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.942 112.9 51.1 -55.9 -48.5 40.8 8.7 35.1 35 35 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.930 111.3 44.1 -57.9 -50.6 42.7 6.5 32.7 36 36 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.885 114.4 50.4 -67.9 -35.5 41.0 3.2 33.5 37 37 A S H X S+ 0 0 0 -4,-2.0 4,-0.9 2,-0.2 -1,-0.2 0.908 112.2 47.2 -67.5 -40.4 37.6 4.9 33.6 38 38 A I H ><>S+ 0 0 0 -4,-2.6 5,-1.5 -5,-0.2 3,-0.6 0.927 112.7 49.1 -65.9 -43.8 38.2 6.4 30.2 39 39 A L H ><5S+ 0 0 0 -4,-2.8 3,-1.1 1,-0.2 33,-0.5 0.905 110.3 51.8 -60.4 -40.2 39.4 3.1 28.8 40 40 A M H 3<5S+ 0 0 21 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.673 108.9 50.4 -70.9 -21.4 36.3 1.3 30.2 41 41 A K T <<5S- 0 0 68 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.376 104.9-126.6-101.4 4.7 33.9 3.8 28.6 42 42 A D T < 5 + 0 0 43 -3,-1.1 -3,-0.2 -4,-0.4 -2,-0.1 0.888 59.6 143.7 55.1 46.1 35.5 3.6 25.1 43 43 A L < + 0 0 12 -5,-1.5 2,-0.3 1,-0.0 -4,-0.1 0.604 55.6 45.1 -89.5 -13.6 35.9 7.4 24.9 44 44 A A - 0 0 9 -6,-0.3 -23,-0.2 1,-0.1 3,-0.1 -0.947 51.0-157.1-136.2 149.1 39.2 7.4 22.9 45 45 A D S S+ 0 0 13 -25,-1.6 30,-0.6 -2,-0.3 2,-0.3 0.542 96.2 26.7 -96.0 -8.9 40.9 5.7 20.0 46 46 A E E -km 21 75B 15 -26,-0.9 -24,-2.2 28,-0.1 2,-0.5 -0.960 67.9-163.7-152.3 132.0 44.3 6.6 21.5 47 47 A L E -km 22 76B 0 28,-2.6 30,-2.6 -2,-0.3 2,-0.4 -0.973 7.1-166.9-118.2 127.7 45.3 7.2 25.1 48 48 A A E -km 23 77B 0 -26,-2.5 -24,-3.0 -2,-0.5 2,-0.4 -0.912 1.9-161.8-113.5 140.0 48.5 9.0 26.1 49 49 A L E -km 24 78B 0 28,-2.2 30,-1.9 -2,-0.4 2,-0.4 -0.968 7.1-175.4-119.8 136.0 50.1 9.1 29.5 50 50 A V E +k 25 0B 2 -26,-2.1 -24,-4.0 -2,-0.4 2,-0.3 -0.990 14.9 144.2-128.0 138.1 52.7 11.5 30.8 51 51 A D - 0 0 27 28,-0.4 -2,-0.0 -2,-0.4 3,-0.0 -0.941 48.2-125.3-152.2 176.2 54.6 11.7 34.0 52 52 A V S S+ 0 0 108 -2,-0.3 2,-1.0 1,-0.1 28,-0.1 0.586 92.1 82.4-100.8 -14.1 58.1 12.7 35.3 53 53 A I > - 0 0 92 1,-0.2 4,-2.3 2,-0.1 5,-0.2 -0.793 66.0-168.3 -92.7 102.7 58.7 9.4 37.1 54 54 A E H > S+ 0 0 109 -2,-1.0 4,-2.4 2,-0.2 5,-0.2 0.853 77.4 45.2 -68.9 -44.2 59.9 7.2 34.2 55 55 A D H > S+ 0 0 84 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.961 116.2 48.1 -63.4 -49.6 59.8 3.6 35.6 56 56 A K H > S+ 0 0 51 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.897 112.3 49.9 -53.0 -46.5 56.4 4.2 37.2 57 57 A L H X S+ 0 0 5 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.927 111.1 47.5 -62.0 -47.8 55.1 5.7 33.9 58 58 A K H X S+ 0 0 112 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.921 111.4 51.7 -61.8 -43.5 56.3 2.8 31.8 59 59 A G H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.867 109.1 48.9 -62.4 -41.9 54.9 0.2 34.2 60 60 A E H X S+ 0 0 2 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.935 111.7 50.2 -62.2 -47.3 51.4 1.7 34.3 61 61 A M H X S+ 0 0 27 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.941 112.0 47.5 -55.5 -50.9 51.4 1.9 30.5 62 62 A M H X S+ 0 0 27 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.874 108.8 53.9 -59.3 -40.5 52.5 -1.8 30.2 63 63 A D H < S+ 0 0 0 -4,-2.1 4,-0.5 1,-0.2 -1,-0.2 0.943 112.0 44.7 -62.9 -46.7 49.9 -3.0 32.8 64 64 A L H >< S+ 0 0 0 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.906 110.2 54.8 -60.0 -47.5 47.1 -1.3 30.8 65 65 A Q H >< S+ 0 0 27 -4,-2.6 3,-2.0 1,-0.3 -1,-0.2 0.856 99.5 61.6 -57.4 -35.3 48.5 -2.6 27.5 66 66 A H T 3< S+ 0 0 10 -4,-2.0 3,-0.3 1,-0.3 -1,-0.3 0.716 101.7 53.7 -66.8 -18.0 48.3 -6.2 28.9 67 67 A G T X S+ 0 0 0 -3,-1.6 3,-2.2 -4,-0.5 -1,-0.3 0.321 74.5 111.5 -94.5 7.6 44.6 -5.7 29.2 68 68 A S G X + 0 0 12 -3,-2.0 3,-1.8 1,-0.3 5,-0.2 0.785 66.7 65.1 -53.1 -38.8 44.1 -4.7 25.5 69 69 A L G 3 S+ 0 0 21 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.800 105.8 45.6 -52.2 -29.7 42.2 -7.8 24.7 70 70 A F G < S+ 0 0 16 -3,-2.2 -1,-0.3 512,-0.0 2,-0.2 0.374 109.4 67.5 -99.4 6.1 39.5 -6.6 27.0 71 71 A L < - 0 0 1 -3,-1.8 -31,-0.1 -4,-0.2 -32,-0.0 -0.703 65.0-144.2-123.3 168.8 39.4 -3.0 25.7 72 72 A R S S+ 0 0 55 -33,-0.5 -3,-0.1 -2,-0.2 -4,-0.1 -0.211 73.5 100.0-126.0 39.8 38.4 -1.1 22.5 73 73 A T - 0 0 2 -5,-0.2 -28,-0.1 1,-0.1 -27,-0.1 -0.921 55.2-168.1-125.7 99.6 41.2 1.5 22.7 74 74 A P + 0 0 39 0, 0.0 2,-0.4 0, 0.0 -28,-0.1 0.600 64.3 48.4 -79.1 -10.9 43.7 0.2 20.3 75 75 A K E +m 46 0B 80 -30,-0.6 -28,-2.6 2,-0.0 2,-0.5 -0.961 53.4 171.5-137.5 118.6 46.7 2.5 21.1 76 76 A I E +m 47 0B 10 -2,-0.4 2,-0.3 -30,-0.2 -28,-0.2 -0.991 14.7 168.9-125.6 123.8 48.1 3.3 24.5 77 77 A V E -m 48 0B 35 -30,-2.6 -28,-2.2 -2,-0.5 2,-0.3 -0.910 10.4-173.6-134.8 160.0 51.3 5.3 24.7 78 78 A S E +m 49 0B 25 -2,-0.3 2,-0.3 -30,-0.2 -28,-0.2 -0.975 11.2 148.4-149.4 162.0 53.4 7.1 27.3 79 79 A G - 0 0 16 -30,-1.9 -28,-0.4 -2,-0.3 -2,-0.0 -0.892 49.5-122.3 175.0 156.6 56.4 9.3 27.7 80 80 A K S S+ 0 0 103 -2,-0.3 2,-0.3 -30,-0.2 -1,-0.1 0.829 98.2 78.6 -74.1 -34.4 58.2 12.0 29.7 81 81 A D S > S- 0 0 90 1,-0.1 3,-1.3 -3,-0.1 4,-0.1 -0.571 82.8-136.4 -78.8 135.9 58.4 13.9 26.4 82 82 A Y G > S+ 0 0 10 -2,-0.3 3,-1.6 1,-0.3 4,-0.2 0.471 87.5 91.2 -75.4 -1.0 55.2 15.6 25.3 83 83 A N G > S+ 0 0 88 1,-0.3 3,-1.3 2,-0.2 -1,-0.3 0.808 78.9 63.6 -64.3 -23.2 55.5 14.5 21.7 84 84 A V G < S+ 0 0 31 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.705 97.8 58.2 -70.8 -16.9 53.4 11.4 22.7 85 85 A T G X S+ 0 0 0 -3,-1.6 3,-1.0 -4,-0.1 -1,-0.2 0.431 76.8 138.6 -91.0 -1.0 50.6 13.8 23.4 86 86 A A T < + 0 0 23 -3,-1.3 41,-0.2 1,-0.2 40,-0.1 -0.107 69.4 9.3 -52.6 138.9 50.4 15.4 19.9 87 87 A N T 3 S+ 0 0 80 39,-2.2 -66,-0.5 1,-0.2 2,-0.3 0.790 82.3 164.8 64.0 32.0 46.9 16.0 18.4 88 88 A S < - 0 0 6 -3,-1.0 -1,-0.2 1,-0.2 -66,-0.2 -0.620 31.2-158.2 -76.3 137.3 45.0 15.3 21.6 89 89 A K S S+ 0 0 55 -68,-2.4 42,-2.4 -2,-0.3 2,-0.4 0.827 84.9 25.5 -76.0 -36.5 41.4 16.5 21.6 90 90 A L E -ln 22 131B 0 -69,-1.5 -67,-2.6 40,-0.2 2,-0.5 -0.991 66.2-167.9-135.8 124.0 41.3 16.5 25.4 91 91 A V E -ln 23 132B 0 40,-2.8 42,-2.6 -2,-0.4 2,-0.6 -0.960 10.1-158.3-115.4 119.0 44.2 16.9 27.8 92 92 A I E -ln 24 133B 0 -69,-3.5 -67,-3.4 -2,-0.5 2,-0.7 -0.853 3.3-155.3-102.4 120.6 43.6 16.1 31.5 93 93 A I E +ln 25 134B 0 40,-2.7 42,-2.9 -2,-0.6 43,-1.3 -0.840 34.2 146.3 -99.6 114.2 45.9 17.5 34.1 94 94 A T + 0 0 22 -69,-2.6 -68,-0.2 -2,-0.7 -63,-0.2 0.287 40.6 116.5-119.8 2.6 46.2 15.7 37.4 95 95 A A + 0 0 20 -70,-0.7 2,-0.3 41,-0.1 41,-0.2 -0.368 35.3 115.3 -72.1 151.6 49.9 16.5 38.0 96 96 A G - 0 0 44 40,-0.1 2,-0.5 -2,-0.1 16,-0.1 -0.935 60.7 -84.5 169.1 175.5 50.9 18.6 41.0 97 97 A A - 0 0 25 -2,-0.3 15,-0.1 11,-0.2 2,-0.1 -0.911 42.2-121.9-106.8 128.9 52.8 18.8 44.3 98 98 A R - 0 0 224 -2,-0.5 2,-0.1 1,-0.1 -2,-0.0 -0.410 39.1 -95.5 -70.0 142.8 51.0 17.6 47.4 99 99 A Q - 0 0 102 -2,-0.1 2,-0.1 1,-0.1 -1,-0.1 -0.318 38.5-131.2 -65.0 134.9 50.7 20.3 50.2 100 100 A Q > - 0 0 104 1,-0.1 3,-0.9 4,-0.1 2,-0.1 -0.438 32.5 -86.7 -82.0 157.3 53.4 20.2 52.8 101 101 A E T 3 S+ 0 0 195 1,-0.3 -1,-0.1 -2,-0.1 0, 0.0 -0.416 112.1 7.8 -61.9 134.7 52.8 20.3 56.6 102 102 A G T 3 S+ 0 0 94 1,-0.2 2,-0.4 -2,-0.1 -1,-0.3 0.907 94.5 144.3 58.3 46.0 52.5 23.9 57.9 103 103 A E < - 0 0 41 -3,-0.9 -1,-0.2 3,-0.0 -4,-0.0 -0.958 48.2-119.3-117.4 136.6 52.5 25.4 54.4 104 104 A S > - 0 0 56 -2,-0.4 4,-2.0 1,-0.1 5,-0.2 -0.305 23.1-115.2 -70.4 152.6 50.5 28.5 53.4 105 105 A R H > S+ 0 0 97 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.936 115.8 52.2 -46.5 -52.9 47.9 28.5 50.7 106 106 A L H > S+ 0 0 61 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.883 108.7 47.8 -57.4 -45.7 50.0 30.9 48.6 107 107 A N H > S+ 0 0 90 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.833 111.7 50.0 -68.1 -34.8 53.2 28.9 48.8 108 108 A L H >X S+ 0 0 11 -4,-2.0 4,-1.8 -3,-0.2 3,-0.5 0.969 113.2 46.0 -65.0 -55.2 51.5 25.6 47.9 109 109 A V H 3X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.3 3,-0.3 0.922 109.5 54.9 -50.9 -49.4 49.8 27.2 44.9 110 110 A Q H 3X S+ 0 0 35 -4,-2.7 4,-1.5 1,-0.3 -1,-0.3 0.832 105.4 54.2 -59.0 -31.5 53.0 28.8 43.8 111 111 A R H X S+ 0 0 54 -4,-0.9 4,-2.3 2,-0.2 3,-1.1 0.905 111.1 50.0 -74.7 -43.2 55.0 22.9 37.7 116 116 A F H 3X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.3 -2,-0.2 0.831 97.1 68.3 -66.6 -32.8 52.3 24.3 35.3 117 117 A K H 3< 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359 27 B V + 0 0 0 4,-0.2 24,-0.1 26,-0.1 -1,-0.1 -0.104 56.1 120.0-107.6 33.4 40.8 -4.5 48.8 360 28 B G S > S- 0 0 24 66,-0.1 4,-2.6 4,-0.0 5,-0.3 0.076 88.8 -65.5 -75.7-162.8 44.4 -4.2 47.8 361 29 B A H > S+ 0 0 29 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.901 138.1 40.0 -57.1 -42.9 45.7 -3.2 44.3 362 30 B V H > S+ 0 0 37 64,-0.2 4,-2.7 2,-0.2 5,-0.2 0.950 113.4 53.0 -74.0 -48.4 44.2 -6.3 42.7 363 31 B G H > S+ 0 0 0 63,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.910 112.9 44.0 -52.4 -47.0 41.0 -6.4 44.6 364 32 B M H X S+ 0 0 4 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.839 110.7 53.8 -71.8 -33.1 40.1 -2.8 43.8 365 33 B A H X S+ 0 0 0 -4,-1.4 4,-1.9 -5,-0.3 -2,-0.2 0.921 111.7 47.0 -63.2 -41.7 41.1 -3.2 40.1 366 34 B C H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.933 112.2 51.5 -61.5 -46.5 38.7 -6.1 40.0 367 35 B A H X S+ 0 0 0 -4,-2.4 4,-2.8 -5,-0.2 -2,-0.2 0.937 111.2 43.8 -57.3 -52.8 36.1 -4.0 41.8 368 36 B I H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.887 114.0 51.7 -65.2 -36.2 36.2 -1.0 39.4 369 37 B S H X S+ 0 0 1 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0.232 74.2 111.7 -96.2 15.9 31.0 7.5 42.4 400 68 B S G X + 0 0 15 -3,-1.9 3,-2.0 1,-0.3 5,-0.2 0.797 65.2 65.3 -62.1 -37.7 27.5 5.9 42.4 401 69 B L G 3 S+ 0 0 17 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.793 107.0 46.1 -52.3 -27.9 25.9 8.6 40.2 402 70 B F G < S+ 0 0 36 -3,-1.5 -1,-0.3 -152,-0.0 2,-0.2 0.320 109.0 66.6-102.6 6.1 28.2 7.2 37.5 403 71 B L < - 0 0 5 -3,-2.0 -31,-0.1 -4,-0.1 -32,-0.0 -0.699 67.9-139.7-120.8 174.1 27.6 3.5 38.1 404 72 B R S S+ 0 0 51 -33,-0.5 -3,-0.1 -2,-0.2 -4,-0.1 -0.117 74.2 99.0-123.5 32.7 24.7 1.1 37.8 405 73 B T - 0 0 3 -5,-0.2 -28,-0.1 1,-0.1 -26,-0.1 -0.916 55.5-164.9-122.2 101.3 25.3 -0.9 41.0 406 74 B P + 0 0 42 0, 0.0 2,-0.4 0, 0.0 -28,-0.1 0.617 66.8 44.5 -71.7 -16.0 22.9 0.5 43.6 407 75 B K E +j 378 0F 104 -30,-0.8 -28,-2.4 2,-0.0 2,-0.4 -0.962 53.2 173.4-138.5 124.8 24.5 -1.0 46.8 408 76 B I E +j 379 0F 9 -2,-0.4 2,-0.3 -30,-0.2 -28,-0.2 -0.990 14.3 171.3-126.4 124.0 28.1 -1.3 47.9 409 77 B V E -j 380 0F 38 -30,-2.4 -28,-2.2 -2,-0.4 2,-0.3 -0.832 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163.8 77.4 20.8 24.1 -14.6 49.4 420 88 B S < - 0 0 6 -3,-1.1 -1,-0.2 1,-0.1 -66,-0.2 -0.501 32.7-159.8 -74.7 136.8 26.9 -13.9 46.8 421 89 B K S S+ 0 0 57 -68,-2.4 42,-2.2 1,-0.3 2,-0.4 0.827 85.9 23.0 -76.8 -34.7 26.6 -15.5 43.4 422 90 B L E -ik 354 463F 0 -69,-1.4 -67,-2.5 40,-0.2 2,-0.5 -0.998 65.5-166.3-138.8 131.8 30.4 -15.0 42.9 423 91 B V E -ik 355 464F 1 40,-2.5 42,-2.7 -2,-0.4 2,-0.5 -0.979 9.3-161.4-122.7 119.2 33.1 -14.6 45.4 424 92 B I E -ik 356 465F 0 -69,-3.2 -67,-3.1 -2,-0.5 2,-0.6 -0.895 4.8-154.8-106.6 123.8 36.5 -13.3 44.2 425 93 B I E +ik 357 466F 0 40,-2.4 42,-2.5 -2,-0.5 43,-1.4 -0.877 33.2 147.2-105.1 115.0 39.5 -13.9 46.4 426 94 B T + 0 0 18 -69,-3.0 -63,-0.2 -2,-0.6 -64,-0.2 0.252 34.0 125.1-126.8 8.1 42.4 -11.5 46.0 427 95 B A + 0 0 20 -70,-0.5 2,-0.1 41,-0.1 -69,-0.1 -0.303 41.9 48.0 -71.3 149.7 43.8 -11.4 49.5 428 96 B G S S- 0 0 41 40,-0.1 16,-0.1 19,-0.1 41,-0.1 -0.446 84.8 -26.8 120.8 177.2 47.3 -12.2 50.5 429 97 B A - 0 0 30 11,-0.2 40,-0.3 -2,-0.1 2,-0.3 -0.342 50.4-152.0 -68.1 142.9 51.0 -11.6 49.9 430 98 B R - 0 0 119 38,-0.1 2,-0.1 -2,-0.0 -1,-0.0 -0.793 27.4 -95.7-110.4 158.0 52.2 -10.7 46.4 431 99 B Q - 0 0 11 -2,-0.3 2,-0.2 4,-0.1 3,-0.1 -0.438 35.9-139.7 -78.0 145.7 55.6 -11.5 45.0 432 100 B Q > - 0 0 99 1,-0.2 3,-3.3 -2,-0.1 142,-0.1 -0.475 49.6 -49.3 -96.2 173.1 58.4 -8.8 45.1 433 101 B E T 3 S- 0 0 124 1,-0.3 -1,-0.2 140,-0.2 3,-0.1 -0.141 129.6 -2.0 -46.4 117.8 60.9 -8.0 42.5 434 102 B G T 3 S+ 0 0 65 1,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.495 100.9 130.9 78.3 4.1 62.5 -11.2 41.3 435 103 B E < - 0 0 36 -3,-3.3 -1,-0.3 135,-0.1 2,-0.2 -0.734 57.7-121.9 -94.7 138.1 60.5 -13.4 43.7 436 104 B S > - 0 0 40 -2,-0.4 3,-2.1 1,-0.1 4,-0.1 -0.529 11.6-130.6 -75.6 141.1 58.7 -16.5 42.5 437 105 B R G > S+ 0 0 4 1,-0.3 3,-1.7 -2,-0.2 -1,-0.1 0.828 109.9 67.6 -54.8 -30.7 55.0 -16.7 43.0 438 106 B L G > S+ 0 0 49 1,-0.3 3,-1.0 2,-0.2 -1,-0.3 0.720 85.8 69.0 -64.3 -19.2 55.8 -20.2 44.3 439 107 B N G < S+ 0 0 107 -3,-2.1 -1,-0.3 1,-0.2 4,-0.2 0.444 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