==== 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 OXIDOREDUCTASE(CHOH(D)-NAD+(A)) 26-NOV-91 9LDT . COMPND 2 MOLECULE: LACTATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR C.R.DUNN,J.J.HOLBROOK,H.MUIRHEAD . 662 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26499.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 473 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 51 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 55 8.3 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 51 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 217 32.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.2 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 2 0 0 0 0 0 0 4 2 0 4 0 0 5 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 5 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 . 5 5 0 2 0 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 ANTIPARALLEL BRIDGES PER LADDER . 2 2 0 0 0 0 0 0 2 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 A 0 0 120 0, 0.0 2,-0.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 22.5 -37.3 6.1 19.0 2 2 A T >> - 0 0 54 1,-0.1 4,-1.4 2,-0.0 3,-0.7 -0.368 360.0-114.9 -70.9 152.7 -34.2 7.7 17.5 3 3 A L H >> S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 3,-1.7 0.987 117.0 55.0 -51.3 -58.6 -33.0 6.5 14.0 4 4 A K H 3> S+ 0 0 77 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.671 107.7 47.6 -37.2 -44.4 -29.8 5.2 15.7 5 5 A D H <4 S+ 0 0 115 -3,-0.7 -1,-0.3 2,-0.2 -2,-0.2 0.690 110.5 49.5 -81.1 -27.7 -31.6 3.1 18.3 6 6 A Q H << S+ 0 0 100 -3,-1.7 -2,-0.2 -4,-1.4 -3,-0.1 0.801 122.0 37.2 -79.8 -28.5 -33.9 1.5 15.8 7 7 A L H < S+ 0 0 38 -4,-2.0 2,-0.4 -5,-0.2 -2,-0.2 0.849 116.8 44.3 -86.4 -46.8 -30.9 0.7 13.7 8 8 A I < - 0 0 65 -4,-2.4 2,-0.6 -5,-0.2 -1,-0.2 -0.948 56.9-157.1-119.0 131.9 -28.1 -0.2 16.2 9 9 A H - 0 0 158 -2,-0.4 2,-0.2 -3,-0.1 -4,-0.1 -0.873 27.4-137.0-108.9 109.4 -28.2 -2.4 19.3 10 10 A N + 0 0 119 -2,-0.6 3,-0.1 1,-0.2 -5,-0.0 -0.529 34.9 162.1 -78.4 136.6 -25.3 -1.3 21.6 11 11 A L + 0 0 161 1,-0.5 2,-0.3 -2,-0.2 -1,-0.2 0.568 68.5 18.7-113.4 -48.8 -23.2 -3.9 23.3 12 12 A L S S- 0 0 121 3,-0.0 -1,-0.5 0, 0.0 2,-0.3 -0.808 72.0-124.8-127.5 170.1 -20.2 -1.8 24.3 13 13 A K - 0 0 131 -2,-0.3 2,-1.1 -3,-0.1 -3,-0.0 -0.824 42.2 -60.5-132.3 160.8 -19.2 1.8 24.7 14 14 A E + 0 0 141 -2,-0.3 -1,-0.0 2,-0.0 0, 0.0 0.146 48.4 174.7 -23.0 63.1 -16.8 4.5 23.8 15 15 A E - 0 0 123 -2,-1.1 2,-0.0 1,-0.2 -3,-0.0 -0.077 13.2-173.3 -64.1-165.4 -13.5 3.1 24.9 16 16 A H + 0 0 131 1,-0.1 -1,-0.2 2,-0.0 -2,-0.0 0.221 33.0 115.4-142.8 -74.2 -11.2 5.8 23.6 17 18 A V - 0 0 73 1,-0.1 -1,-0.1 -2,-0.0 2,-0.1 0.536 50.7-141.4 -27.8 121.8 -7.6 5.2 23.9 18 19 A P - 0 0 25 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.322 9.4-156.8 -81.3 156.6 -5.5 4.9 20.8 19 20 A H S S+ 0 0 136 1,-0.1 -2,-0.0 -2,-0.1 25,-0.0 0.593 91.3 31.0-111.1 -27.2 -2.7 2.5 20.2 20 22 A N S S+ 0 0 53 2,-0.0 25,-1.5 69,-0.0 26,-1.0 -0.589 78.7 165.7-130.6 60.1 -0.9 4.3 17.5 21 23 A K E -a 46 0A 13 66,-0.4 68,-2.5 23,-0.2 69,-1.2 -0.651 12.4-172.0 -91.1 141.6 -1.4 8.0 18.0 22 24 A I E -ab 47 90A 0 24,-2.3 26,-2.1 -2,-0.3 2,-0.4 -0.991 7.3-155.4-127.9 134.1 0.7 10.6 16.2 23 25 A T E -ab 48 91A 0 67,-2.6 69,-3.2 -2,-0.4 2,-0.5 -0.932 0.8-159.4-111.0 146.8 0.6 14.3 16.9 24 26 A V E -ab 49 92A 0 24,-3.2 26,-2.0 -2,-0.4 2,-0.7 -0.961 7.4-157.5-127.3 112.1 1.6 17.1 14.3 25 27 A V E S+ab 50 93A 2 67,-2.5 69,-3.4 -2,-0.5 70,-0.7 -0.794 70.3 27.8 -91.7 112.3 2.6 20.4 15.9 26 28 A G - 0 0 4 24,-3.1 25,-0.2 -2,-0.7 -1,-0.1 0.519 63.5-149.7 105.2 115.2 2.1 23.2 13.3 27 29 A V + 0 0 0 4,-0.2 24,-0.1 5,-0.1 -1,-0.1 -0.147 58.5 112.3-110.8 47.1 -0.4 22.9 10.4 28 30 A G S > S- 0 0 27 66,-0.0 4,-2.9 4,-0.0 5,-0.3 -0.100 90.4 -55.9 -95.9-156.6 1.5 25.0 7.8 29 31 A A H > S+ 0 0 33 1,-0.2 4,-1.2 2,-0.2 5,-0.1 0.903 139.8 33.5 -48.7 -57.7 3.1 23.8 4.5 30 32 A V H > S+ 0 0 37 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.783 115.2 56.0 -67.2 -44.2 5.4 21.3 6.2 31 33 A G H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.922 113.7 40.3 -63.4 -48.2 3.0 20.2 8.9 32 34 A M H X S+ 0 0 3 -4,-2.9 4,-2.0 2,-0.2 -1,-0.2 0.637 112.5 54.1 -75.1 -23.8 0.2 19.3 6.4 33 35 A A H X S+ 0 0 0 -4,-1.2 4,-1.6 -5,-0.3 -1,-0.2 0.822 112.1 46.9 -72.2 -33.9 2.7 17.7 4.0 34 36 A C H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.915 114.7 47.7 -65.0 -55.0 3.8 15.5 7.0 35 37 A A H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.799 112.6 45.6 -53.6 -49.6 0.1 14.8 7.9 36 38 A I H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.924 115.2 47.5 -65.0 -44.4 -1.0 13.8 4.5 37 39 A S H X S+ 0 0 1 -4,-1.6 4,-0.9 2,-0.2 -2,-0.2 0.866 114.1 46.8 -59.9 -52.5 2.1 11.6 3.9 38 40 A I H <>S+ 0 0 1 -4,-2.5 5,-1.2 1,-0.2 3,-0.4 0.853 113.0 50.2 -64.0 -36.1 1.7 9.9 7.3 39 41 A L H ><5S+ 0 0 2 -4,-1.9 3,-1.0 1,-0.2 33,-0.4 0.892 109.1 50.8 -71.0 -40.5 -2.1 9.4 6.7 40 42 A M H 3<5S+ 0 0 33 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.672 107.8 53.5 -65.8 -25.3 -1.5 7.8 3.2 41 43 A K T 3<5S- 0 0 77 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.241 107.7-130.8 -90.6 -1.7 1.0 5.4 4.7 42 44 A E T < 5 + 0 0 119 -3,-1.0 -3,-0.2 -4,-0.2 -2,-0.1 0.835 58.9 140.6 48.3 51.1 -1.6 4.3 7.2 43 45 A L < + 0 0 13 -5,-1.2 2,-0.2 30,-0.0 -4,-0.1 0.761 55.6 50.2 -89.9 -26.3 0.7 4.6 10.3 44 46 A A - 0 0 8 -6,-0.4 -23,-0.2 1,-0.1 3,-0.1 -0.669 48.2-164.9-121.2 156.3 -1.8 6.1 12.9 45 47 A D S S+ 0 0 51 -25,-1.5 30,-0.8 1,-0.4 2,-0.4 0.387 92.4 32.8-111.4 -10.6 -5.2 5.3 14.1 46 48 A E E -ac 21 75A 14 -26,-1.0 -24,-2.3 28,-0.1 2,-0.4 -0.965 66.2-169.5-155.8 127.5 -5.3 8.8 15.6 47 49 A I E -ac 22 76A 1 28,-1.8 30,-2.6 -2,-0.4 2,-0.4 -0.983 5.6-161.8-120.3 134.6 -3.9 12.0 14.5 48 50 A A E -ac 23 77A 0 -26,-2.1 -24,-3.2 -2,-0.4 2,-0.4 -0.956 4.5-161.0-117.4 129.3 -3.8 15.2 16.6 49 51 A L E -ac 24 78A 0 28,-2.4 30,-1.8 -2,-0.4 2,-0.4 -0.951 10.0-178.4-114.0 133.8 -3.2 18.6 15.0 50 52 A V E +ac 25 79A 3 -26,-2.0 -24,-3.1 -2,-0.4 2,-0.3 -0.999 13.8 144.1-136.9 131.0 -2.1 21.6 17.0 51 53 A D - 0 0 32 28,-0.6 28,-0.1 -2,-0.4 -2,-0.0 -0.949 48.3-129.7-156.6 163.5 -1.5 25.2 15.9 52 54 A V S S+ 0 0 88 -2,-0.3 2,-1.5 1,-0.1 28,-0.1 0.593 91.7 88.5 -93.8 -14.9 -2.0 28.7 17.4 53 55 A M > - 0 0 112 1,-0.2 4,-1.8 2,-0.1 5,-0.2 -0.636 63.6-172.3 -75.4 100.7 -3.7 29.8 14.3 54 56 A E H > S+ 0 0 116 -2,-1.5 4,-2.6 1,-0.2 5,-0.2 0.845 77.9 44.5 -60.1 -45.4 -7.3 28.7 15.2 55 57 A D H > S+ 0 0 83 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.962 115.8 45.5 -63.1 -63.9 -9.1 29.3 11.9 56 58 A K H > S+ 0 0 55 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.879 114.1 52.7 -41.1 -47.3 -6.4 27.7 9.7 57 59 A L H X S+ 0 0 6 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.955 111.9 42.3 -60.6 -58.2 -6.2 24.7 12.2 58 60 A K H X S+ 0 0 95 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.848 115.0 53.5 -62.5 -36.9 -9.9 24.0 12.2 59 61 A G H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.886 111.0 42.9 -64.1 -41.9 -10.0 24.5 8.3 60 62 A E H X S+ 0 0 2 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.880 112.1 55.3 -77.7 -39.3 -7.3 22.0 7.6 61 63 A M H X S+ 0 0 25 -4,-2.2 4,-2.6 -5,-0.3 -2,-0.2 0.939 110.9 46.0 -49.7 -57.5 -8.8 19.5 10.2 62 64 A M H X S+ 0 0 18 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.759 110.4 51.1 -55.3 -50.3 -12.1 19.7 8.2 63 65 A D H X S+ 0 0 0 -4,-1.8 4,-0.5 2,-0.2 3,-0.4 0.921 114.3 45.8 -58.0 -51.8 -10.4 19.3 4.7 64 66 A L H >< S+ 0 0 0 -4,-2.2 3,-2.0 1,-0.2 -2,-0.2 0.960 114.4 48.1 -57.6 -54.9 -8.6 16.1 6.1 65 67 A Q H >< S+ 0 0 27 -4,-2.6 3,-1.5 1,-0.3 -1,-0.2 0.747 102.3 60.3 -55.3 -36.1 -12.0 14.8 7.7 66 68 A H H 3< S+ 0 0 7 -4,-1.5 3,-0.4 -3,-0.4 -1,-0.3 0.748 103.6 56.0 -62.0 -30.5 -14.0 15.4 4.4 67 69 A G T XX S+ 0 0 0 -3,-2.0 3,-1.5 -4,-0.5 4,-0.5 0.249 74.5 112.0 -90.0 7.1 -11.4 12.9 3.0 68 70 A S G X4 + 0 0 8 -3,-1.5 3,-1.8 1,-0.3 5,-0.2 0.855 66.1 62.5 -52.2 -48.1 -12.4 10.2 5.7 69 71 A L G 34 S+ 0 0 17 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.749 108.5 42.3 -43.5 -39.2 -13.9 7.8 3.2 70 72 A F G <4 S+ 0 0 28 -3,-1.5 -1,-0.3 512,-0.1 -2,-0.2 0.486 107.2 75.9 -93.7 -5.4 -10.6 7.4 1.4 71 73 A L << - 0 0 6 -3,-1.8 -31,-0.1 -4,-0.5 -32,-0.0 -0.460 64.5-147.5-102.5 170.4 -8.4 7.1 4.5 72 74 A R S S+ 0 0 133 -33,-0.4 -3,-0.1 -2,-0.2 -4,-0.1 -0.195 76.1 92.2-126.5 36.3 -7.8 4.4 7.2 73 75 A T - 0 0 2 -5,-0.2 -28,-0.1 1,-0.1 -27,-0.1 -0.916 54.4-173.7-128.1 93.4 -7.3 6.8 10.2 74 76 A P + 0 0 90 0, 0.0 2,-0.5 0, 0.0 -28,-0.1 0.504 63.4 60.8 -76.2 -15.1 -10.7 7.1 11.8 75 77 A K E +c 46 0A 88 -30,-0.8 -28,-1.8 2,-0.0 2,-0.4 -0.997 54.4 169.7-121.2 119.5 -10.0 9.8 14.4 76 78 A I E +c 47 0A 11 -2,-0.5 2,-0.3 -30,-0.2 -28,-0.2 -0.983 14.2 167.3-122.1 115.6 -8.7 13.2 13.3 77 79 A V E -c 48 0A 33 -30,-2.6 -28,-2.4 -2,-0.4 2,-0.3 -0.910 10.7-178.6-127.8 168.1 -8.6 15.8 16.0 78 80 A S E +c 49 0A 27 -2,-0.3 2,-0.3 -30,-0.2 -28,-0.2 -0.968 9.5 145.3-157.8 162.9 -7.2 19.3 16.6 79 81 A G E -c 50 0A 16 -30,-1.8 -28,-0.6 -2,-0.3 -2,-0.0 -0.912 49.3-117.1 174.5 167.6 -6.8 22.1 19.1 80 83 A K S S+ 0 0 110 -2,-0.3 2,-0.3 -30,-0.2 -1,-0.1 0.765 95.3 77.4 -88.0 -30.2 -4.9 24.9 20.7 81 84 A D S > S- 0 0 79 1,-0.1 3,-1.1 -3,-0.1 4,-0.1 -0.654 82.5-133.7 -88.1 140.7 -4.8 23.2 24.1 82 85 A Y G > S+ 0 0 12 -2,-0.3 3,-2.0 1,-0.2 -1,-0.1 0.487 88.4 91.5 -71.5 -0.4 -2.2 20.3 24.4 83 86 A N G > S+ 0 0 95 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.771 78.8 62.7 -65.5 -25.7 -4.7 18.0 26.0 84 87 A V G < S+ 0 0 31 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.1 0.648 95.6 62.1 -64.0 -32.4 -5.6 16.7 22.6 85 88 A T G X S+ 0 0 0 -3,-2.0 3,-0.7 -4,-0.1 -1,-0.3 0.288 75.5 142.2 -73.2 -13.5 -2.0 15.5 22.3 86 89 A A T < - 0 0 29 -3,-1.3 41,-0.2 1,-0.2 40,-0.1 -0.189 68.8 -0.4 -49.4 124.7 -2.3 13.1 25.2 87 90 A N T 3 S+ 0 0 107 39,-2.0 -66,-0.4 1,-0.2 2,-0.4 0.911 79.4 171.4 64.8 47.6 -0.5 9.8 24.9 88 91 A S < - 0 0 6 -3,-0.7 -1,-0.2 1,-0.2 -66,-0.2 -0.657 31.4-153.8 -84.2 139.4 1.1 10.2 21.5 89 92 A R S S+ 0 0 58 -68,-2.5 42,-1.6 -2,-0.4 2,-0.3 0.925 88.1 19.7 -78.0 -45.1 3.6 7.5 20.5 90 93 A L E -bd 22 131A 0 -69,-1.2 -67,-2.6 40,-0.2 2,-0.4 -0.953 63.8-162.7-134.2 138.3 5.2 10.2 18.2 91 94 A V E -bd 23 132A 0 40,-2.3 42,-2.5 -2,-0.3 2,-0.7 -0.999 10.9-157.3-123.0 112.7 5.1 14.1 18.1 92 95 A V E -bd 24 133A 0 -69,-3.2 -67,-2.5 -2,-0.4 2,-0.7 -0.944 8.3-153.3 -91.8 117.6 6.2 15.7 14.9 93 96 A I E +bd 25 134A 0 40,-3.6 42,-3.2 -2,-0.7 43,-1.7 -0.813 34.7 145.5 -99.9 114.0 7.3 19.3 15.4 94 97 A T + 0 0 19 -69,-3.4 -64,-0.2 -2,-0.7 -68,-0.2 0.354 33.2 118.7-121.3 1.8 7.0 21.6 12.4 95 98 A A + 0 0 19 -70,-0.7 2,-0.2 41,-0.1 41,-0.1 -0.366 40.6 63.6 -70.4 147.6 6.1 24.9 13.9 96 99 A G S S- 0 0 41 -2,-0.1 2,-0.2 40,-0.1 16,-0.1 -0.718 82.1 -39.0 134.2 178.3 8.1 28.1 13.6 97 100 A A - 0 0 30 -2,-0.2 40,-0.3 11,-0.2 2,-0.2 -0.541 54.0-150.0 -76.0 144.2 9.4 30.7 11.3 98 101 A R - 0 0 129 -2,-0.2 -1,-0.1 1,-0.1 38,-0.0 -0.744 28.1 -75.1-115.0 165.2 10.7 29.6 7.8 99 102 A Q - 0 0 17 -2,-0.2 2,-0.2 4,-0.1 -1,-0.1 -0.189 34.5-149.6 -67.4 136.2 13.3 30.9 5.5 100 103 A Q > - 0 0 128 1,-0.2 3,-1.6 4,-0.1 2,-0.1 -0.423 54.0 -61.4 -87.7 170.6 12.8 34.0 3.4 101 105 A E T 3 S+ 0 0 139 1,-0.2 -1,-0.2 -2,-0.2 3,-0.1 -0.311 126.8 4.9 -61.8 131.7 14.6 34.1 0.0 102 106 A G T 3 S+ 0 0 68 1,-0.2 2,-0.4 136,-0.2 -1,-0.2 0.432 98.7 140.6 70.4 4.8 18.4 34.0 0.5 103 107 A E < - 0 0 29 -3,-1.6 -1,-0.2 135,-0.1 2,-0.1 -0.561 50.9-129.5 -80.8 129.0 17.9 33.5 4.3 104 108 A S > - 0 0 44 -2,-0.4 3,-1.0 1,-0.1 4,-0.2 -0.429 16.8-128.0 -66.7 140.9 20.2 31.1 6.3 105 109 A R G > S+ 0 0 9 1,-0.2 3,-1.3 2,-0.1 4,-0.1 0.772 108.1 69.4 -61.5 -23.3 18.3 28.6 8.5 106 110 A L G > S+ 0 0 35 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.775 85.8 65.4 -69.8 -25.5 20.7 29.9 11.3 107 111 A N G < S+ 0 0 105 -3,-1.0 4,-0.3 1,-0.2 3,-0.3 0.517 91.5 65.7 -65.5 -18.6 18.9 33.3 11.3 108 112 A L G <> S+ 0 0 0 -3,-1.3 4,-2.0 1,-0.2 5,-0.3 0.476 71.9 95.7 -83.6 -14.7 15.7 31.6 12.6 109 113 A V H <> S+ 0 0 18 -3,-1.1 4,-1.9 2,-0.2 5,-0.2 0.846 80.5 50.2 -52.9 -48.7 17.1 30.6 16.0 110 114 A Q H > S+ 0 0 110 -3,-0.3 4,-1.3 1,-0.2 -1,-0.2 0.964 116.8 40.2 -56.9 -62.7 15.8 33.6 18.1 111 115 A R H > S+ 0 0 100 -4,-0.3 4,-0.6 1,-0.2 -1,-0.2 0.706 120.7 42.3 -56.3 -37.8 12.2 33.4 16.9 112 116 A N H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.660 105.9 60.6 -84.3 -28.5 12.0 29.5 17.0 113 117 A V H X S+ 0 0 9 -4,-1.9 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57.1 -80.8 -34.4 -8.6 29.2 -20.3 448 120 B F H 3X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.3 -2,-0.2 0.834 96.2 66.5 -61.0 -31.0 -10.3 25.9 -21.5 449 121 B K H 3< S+ 0 0 80 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.774 112.9 32.2 -61.2 -35.8 -10.5 27.5 -25.0 450 122 B F H <> S+ 0 0 138 -3,-1.4 4,-0.9 -4,-0.3 -2,-0.2 0.814 120.1 48.4 -90.6 -43.5 -6.7 27.3 -25.1 451 123 B I H X S+ 0 0 9 -4,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.901 101.9 59.8 -68.7 -42.2 -5.9 24.2 -22.9 452 124 B I H >X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 3,-0.7 0.883 105.0 45.6 -56.7 -53.7 -8.3 21.6 -24.5 453 125 B P H 3> S+ 0 0 61 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.844 112.5 53.7 -59.3 -28.4 -7.0 21.6 -28.1 454 126 B N H 3X S+ 0 0 45 -4,-0.9 4,-0.6 2,-0.2 -2,-0.2 0.846 115.5 40.5 -74.6 -25.7 -3.4 21.4 -26.7 455 127 B I H XX S+ 0 0 0 -4,-1.4 3,-1.2 -3,-0.7 4,-1.2 0.971 112.4 52.3 -79.7 -53.8 -4.5 18.4 -24.7 456 128 B V H 3< S+ 0 0 34 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.1 0.707 107.5 55.0 -53.4 -33.6 -6.6 16.6 -27.3 457 129 B K H 3< S+ 0 0 144 -4,-1.3 -1,-0.3 -5,-0.3 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148 B V H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.927 112.3 50.8 -55.0 -51.6 -17.4 23.0 -22.3 478 149 B A H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 6,-0.3 0.877 112.6 46.4 -54.4 -43.8 -14.5 20.5 -22.3 479 150 B W H X>S+ 0 0 45 -4,-2.2 4,-1.9 2,-0.2 5,-0.5 0.964 113.0 48.9 -58.0 -65.5 -16.7 18.0 -24.2 480 151 B K H <5S+ 0 0 97 -4,-2.9 3,-0.2 1,-0.2 -2,-0.2 0.903 116.7 40.0 -48.2 -52.1 -17.8 20.5 -26.7 481 152 B I H <5S+ 0 0 49 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.850 113.7 54.5 -66.4 -44.4 -14.3 21.9 -27.5 482 153 B S H <5S- 0 0 12 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.803 89.5-139.2 -59.5 -43.6 -12.6 18.5 -27.5 483 154 B G T <5 + 0 0 71 -4,-1.9 -3,-0.1 1,-0.3 -4,-0.1 0.469 54.5 144.9 85.7 -0.3 -14.7 16.7 -30.0 484 155 B F < - 0 0 16 -5,-0.5 -1,-0.3 -6,-0.3 -2,-0.1 -0.523 58.5-102.0 -71.0 152.2 -14.4 13.6 -27.6 485 156 B P > - 0 0 58 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.223 36.9-111.6 -69.2 154.7 -17.2 11.1 -27.1 486 157 B K G > S+ 0 0 105 1,-0.3 3,-1.4 2,-0.2 145,-0.2 0.721 112.2 70.3 -62.5 -29.3 -19.0 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3,-1.9 -2,-0.3 -21,-0.1 -0.980 93.5 -14.2-131.3 111.0 -26.3 1.1 6.5 538 209AB A T 3 S- 0 0 93 -23,-0.5 3,-0.1 -2,-0.4 -22,-0.1 0.805 129.3 -51.7 63.9 31.0 -26.0 -2.7 5.6 539 209BB G T 3 S+ 0 0 60 1,-0.3 2,-0.5 -22,-0.0 -1,-0.3 0.225 107.7 125.5 90.9 -17.8 -28.9 -2.7 3.2 540 209CB V E < -W 537 0E 60 -3,-1.9 -3,-1.3 -533,-0.1 2,-0.4 -0.543 59.0-132.8 -92.6 125.4 -31.4 -1.0 5.6 541 209DB S E >> -W 536 0E 32 -2,-0.5 4,-1.0 -5,-0.2 3,-0.9 -0.674 6.8-156.4 -64.4 111.4 -33.0 2.1 4.3 542 210AB L H >> S+ 0 0 0 -7,-2.4 4,-2.0 -2,-0.4 3,-0.5 0.883 96.5 59.1 -64.9 -35.0 -32.9 4.8 6.9 543 210BB K H 34 S+ 0 0 48 -11,-0.5 -1,-0.2 -8,-0.5 6,-0.1 0.596 103.0 54.5 -66.3 -17.7 -36.0 6.4 5.2 544 211 B N H <4 S+ 0 0 139 -3,-0.9 -1,-0.3 1,-0.1 -2,-0.2 0.813 112.9 40.1 -86.3 -31.1 -37.9 3.1 5.9 545 212 B L H << S+ 0 0 49 -4,-1.0 -2,-0.2 -3,-0.5 -3,-0.1 0.727 131.3 26.9 -82.9 -34.8 -37.1 3.2 9.6 546 213 B H >< - 0 0 11 -4,-2.0 3,-2.7 -5,-0.1 -1,-0.3 -0.757 69.0-174.9-124.4 77.0 -37.7 7.0 10.0 547 214 B P T 3 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