==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PHOSPHOTRANSFERASE (CARBOXYL ACCEPTOR) 28-AUG-76 2PGK . COMPND 2 MOLECULE: PHOSPHOGLYCERATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS; . AUTHOR R.D.BANKS,C.C.F.BLAKE,P.R.EVANS,R.M.MASER . 407 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20752.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 277 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 25 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 4 1.0 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 . 36 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 120 29.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.7 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 1 1 2 1 0 2 1 2 1 1 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 3 3 1 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 . 3 0 1 1 0 0 1 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 . 2 0 2 0 1 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 1 A X > 0 0 97 0, 0.0 3,-3.7 0, 0.0 2,-1.0 0.000 360.0 360.0 360.0 -75.3 50.2 17.6 18.2 2 2 A X T 3 + 0 0 92 1,-0.3 3,-0.1 191,-0.2 188,-0.0 -0.080 360.0 39.4 -40.0 79.8 53.0 15.3 19.3 3 3 A X T 3 S+ 0 0 54 -2,-1.0 404,-1.1 1,-0.6 2,-0.4 0.220 89.0 105.4 150.0 -6.5 55.6 17.5 17.6 4 4 A X B < S-A 406 0A 45 -3,-3.7 -1,-0.6 402,-0.2 402,-0.2 -0.847 74.4-111.9 -96.9 135.7 54.2 20.9 18.5 5 5 A X + 0 0 39 400,-0.8 2,-0.2 -2,-0.4 -1,-0.1 0.069 34.5 176.6 -59.1 177.4 56.1 22.7 21.2 6 6 A X - 0 0 26 179,-0.2 4,-0.4 183,-0.0 181,-0.2 -0.420 53.2 -72.5-148.3-136.1 55.1 23.5 24.7 7 7 A X S S+ 0 0 62 179,-0.2 180,-0.1 -2,-0.2 178,-0.1 0.341 115.5 77.7-118.7 3.6 56.9 25.1 27.6 8 8 A X S S+ 0 0 91 1,-0.1 -1,-0.1 179,-0.0 179,-0.0 0.392 101.6 45.1 -87.3 2.4 59.2 22.2 28.4 9 9 A X S S+ 0 0 70 -3,-0.0 -2,-0.1 398,-0.0 -1,-0.1 0.760 91.8 99.9-105.6 -46.8 61.2 23.4 25.4 10 10 A X - 0 0 55 -4,-0.4 -3,-0.0 1,-0.1 148,-0.0 0.029 68.2-136.9 -51.5 147.9 61.3 27.1 26.0 11 11 A X - 0 0 79 40,-0.0 -1,-0.1 39,-0.0 -4,-0.0 0.924 34.6-162.3 -67.7 -48.0 64.3 28.9 27.4 12 12 A X + 0 0 51 3,-0.1 3,-0.1 39,-0.1 4,-0.1 0.938 52.7 89.2 60.1 96.5 62.0 31.0 29.6 13 13 A X + 0 0 26 1,-0.8 40,-1.2 2,-0.4 41,-0.4 -0.125 56.7 83.3-174.7 -68.7 63.9 34.1 30.8 14 14 A X S S- 0 0 67 38,-0.2 -1,-0.8 39,-0.1 144,-0.1 -0.232 107.7 -76.6 -46.7 144.6 63.6 37.1 28.4 15 15 A X - 0 0 38 37,-0.1 -2,-0.4 -3,-0.1 40,-0.3 0.120 66.1-156.8 -31.6-177.3 60.3 38.7 29.3 16 16 A X E -b 55 0B 25 38,-2.3 40,-1.6 139,-0.2 2,-0.5 -0.979 15.6-119.1-169.9 152.3 57.5 36.6 27.8 17 17 A X E -bc 56 159B 22 141,-2.8 143,-1.8 -2,-0.3 2,-0.5 -0.887 21.5-168.5-106.7 129.1 53.9 36.7 26.6 18 18 A X E -bc 57 160B 39 38,-2.9 40,-2.9 -2,-0.5 2,-0.5 -0.936 0.7-169.8-117.3 127.1 51.2 34.5 28.2 19 19 A X E +bc 58 161B 36 141,-3.0 143,-1.7 -2,-0.5 40,-0.2 -0.954 18.8 171.6-120.0 116.9 47.8 34.2 26.5 20 20 A X + 0 0 44 38,-1.9 2,-0.3 -2,-0.5 40,-0.2 -0.480 18.4 155.1-118.1-175.2 45.1 32.5 28.5 21 21 A X + 0 0 29 -2,-0.2 19,-0.2 38,-0.2 40,-0.1 -0.892 56.2 88.1 175.4-161.3 41.4 31.7 28.8 22 22 A X S S+ 0 0 67 -2,-0.3 2,-0.5 1,-0.1 3,-0.1 0.504 84.2 106.4 58.7 -7.8 39.4 29.0 30.5 23 23 A X + 0 0 44 37,-0.2 -1,-0.1 140,-0.2 37,-0.1 -0.480 39.8 111.8 -99.3 58.5 40.0 32.1 32.6 24 24 A X - 0 0 62 -2,-0.5 2,-0.3 1,-0.2 -1,-0.1 0.921 48.2-168.0 -95.9 -70.9 36.5 33.6 32.4 25 25 A X - 0 0 54 8,-0.2 -1,-0.2 -3,-0.1 6,-0.1 -0.894 31.4 -74.7 111.3-151.2 34.6 33.5 35.8 26 26 A X - 0 0 59 4,-0.6 2,-0.3 -2,-0.3 5,-0.2 0.701 67.2 -60.2-117.8 -80.5 30.9 34.1 36.5 27 27 A X B > -G 30 0C 43 3,-1.5 3,-4.4 45,-0.1 -1,-0.1 -0.976 58.2 -65.1-178.0 158.6 29.3 37.5 36.6 28 28 A X T 3 S+ 0 0 81 1,-0.3 3,-0.1 -2,-0.3 -1,-0.0 0.594 119.9 72.6 -21.2 -26.9 29.0 41.1 37.9 29 29 A X T 3 S- 0 0 88 1,-0.2 -1,-0.3 2,-0.1 2,-0.3 0.844 114.3-101.0 -64.2 -38.1 28.0 39.3 41.1 30 30 A X B < -G 27 0C 51 -3,-4.4 -3,-1.5 1,-0.2 -4,-0.6 -0.980 63.6 -28.5 151.8-135.7 31.6 38.2 41.7 31 31 A X + 0 0 42 -2,-0.3 -1,-0.2 -5,-0.2 -2,-0.1 0.968 54.8 163.2 -84.5 -62.9 33.4 34.8 41.2 32 32 A X S S+ 0 0 79 1,-0.1 -2,-0.1 -6,-0.1 -3,-0.1 0.895 88.9 10.8 35.8 80.3 30.9 32.0 41.5 33 33 A X S S+ 0 0 64 -7,-0.1 3,-0.2 2,-0.0 -8,-0.2 0.882 77.2 156.2 87.1 53.9 33.0 29.3 39.8 34 34 A X > + 0 0 42 1,-0.2 3,-1.8 2,-0.1 4,-0.2 0.684 36.0 119.2 -81.5 -20.4 36.3 31.3 39.8 35 35 A X T > + 0 0 62 1,-0.3 3,-3.3 2,-0.2 -1,-0.2 0.540 57.2 60.4 -1.0 -86.6 37.9 27.9 39.6 36 36 A X T >> S+ 0 0 50 1,-0.3 3,-2.2 -3,-0.2 4,-0.6 0.741 85.7 75.8 -23.5 -60.7 39.8 28.1 36.3 37 37 A X H <> S+ 0 0 53 -3,-1.8 4,-1.0 1,-0.3 -1,-0.3 0.721 82.0 75.7 -28.8 -36.0 41.9 31.1 37.4 38 38 A X H X> S+ 0 0 59 -3,-3.3 4,-0.9 -4,-0.2 3,-0.6 0.886 96.3 41.8 -43.9 -58.1 43.8 28.5 39.4 39 39 A X H <> S+ 0 0 50 -3,-2.2 4,-1.7 1,-0.2 3,-0.4 0.950 96.3 68.6 -61.4 -61.3 45.7 27.0 36.5 40 40 A X H 3X S+ 0 0 68 -4,-0.6 4,-2.4 1,-0.3 -1,-0.2 0.813 104.4 58.4 -29.1 -31.3 46.7 30.1 34.4 41 41 A X H X S+ 0 0 46 -4,-2.8 3,-0.9 -5,-0.5 4,-0.5 0.934 105.7 48.4 -41.9 -66.6 57.2 29.5 33.6 48 48 A X H >< S+ 0 0 35 -4,-3.4 3,-1.9 1,-0.2 -1,-0.2 0.918 95.2 74.0 -41.4 -61.9 58.6 32.4 35.6 49 49 A X H 3< S+ 0 0 70 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.732 88.7 62.1 -16.0 -65.8 60.7 30.1 37.8 50 50 A X H << S- 0 0 68 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.809 125.3 -87.0 -32.7 -60.7 63.1 29.6 34.9 51 51 A X << + 0 0 45 -3,-1.9 -38,-0.3 -4,-0.5 -39,-0.1 -0.416 66.5 148.7-176.3 -97.7 64.1 33.3 34.7 52 52 A X - 0 0 30 -37,-0.1 -38,-0.2 -2,-0.1 3,-0.1 0.832 33.0-152.1 40.1 116.0 62.0 35.8 32.7 53 53 A X S S+ 0 0 43 -40,-1.2 59,-0.9 1,-0.3 2,-0.4 0.847 76.7 15.7 -79.6 -39.6 62.0 39.3 34.1 54 54 A X E - d 0 112B 18 -41,-0.4 -38,-2.3 57,-0.3 2,-0.4 -0.996 57.0-175.2-146.1 138.6 58.6 40.2 32.7 55 55 A X E -bd 16 113B 35 57,-1.5 59,-1.4 -2,-0.4 2,-0.5 -0.999 17.0-145.4-132.0 130.6 55.5 38.5 31.2 56 56 A X E -bd 17 114B 25 -40,-1.6 -38,-2.9 99,-0.5 2,-0.7 -0.845 15.9-152.9 -97.1 123.1 52.5 40.2 29.7 57 57 A X E -bd 18 115B 33 57,-2.6 59,-2.3 -2,-0.5 2,-0.7 -0.893 9.3-170.1-102.2 116.3 49.3 38.2 30.3 58 58 A X E +bd 19 116B 45 -40,-2.9 -38,-1.9 -2,-0.7 2,-0.3 -0.913 19.1 159.0-105.6 111.9 46.4 38.6 27.8 59 59 A X - 0 0 34 57,-2.0 60,-0.3 -2,-0.7 2,-0.3 -0.842 12.3-178.6-121.9 163.5 43.2 37.0 29.0 60 60 A X + 0 0 45 -2,-0.3 2,-0.3 -40,-0.2 -37,-0.2 -0.861 7.8 163.6-168.7 128.9 39.7 37.8 27.9 61 61 A X + 0 0 45 -2,-0.3 2,-0.3 13,-0.3 57,-0.1 -0.992 33.4 66.5-151.1 141.9 36.2 36.6 28.8 62 62 A X S S- 0 0 84 -2,-0.3 12,-0.0 1,-0.1 -37,-0.0 -0.978 76.1 -91.6 157.1-141.6 32.7 37.8 28.2 63 63 A X + 0 0 74 -2,-0.3 -1,-0.1 10,-0.1 10,-0.0 -0.056 57.1 148.7-166.1 25.8 30.2 38.4 25.4 64 64 A X - 0 0 61 2,-0.1 3,-0.3 1,-0.1 57,-0.0 0.836 38.0-161.6 -37.5 -39.7 31.2 42.0 24.7 65 65 A X - 0 0 56 1,-0.3 2,-0.5 64,-0.0 64,-0.1 0.978 63.1 -7.4 49.8 67.7 30.2 41.1 21.2 66 66 A X S S- 0 0 13 63,-0.2 57,-0.4 54,-0.2 2,-0.3 -0.982 118.2 -5.2 128.7-114.9 32.0 43.9 19.4 67 67 A X S S- 0 0 46 63,-0.6 55,-0.3 -2,-0.5 54,-0.2 -0.868 96.1 -31.0-129.1 148.0 33.7 46.8 21.2 68 68 A X + 0 0 57 53,-7.1 -1,-0.3 -2,-0.3 2,-0.1 0.641 47.0 163.6 6.8 127.9 34.0 48.1 24.7 69 69 A X + 0 0 65 4,-0.2 -1,-0.1 -3,-0.1 4,-0.1 -0.585 22.6 170.2-155.8 76.6 31.2 47.5 27.2 70 70 A X + 0 0 74 1,-0.1 3,-0.2 -2,-0.1 4,-0.1 0.049 40.6 81.0 -79.2-166.1 32.7 48.0 30.7 71 71 A X S S+ 0 0 95 1,-0.3 2,-0.2 -43,-0.0 -1,-0.1 0.865 110.3 16.0 71.1 40.6 31.3 48.3 34.2 72 72 A X S S+ 0 0 46 -45,-0.0 2,-1.0 -3,-0.0 -1,-0.3 -0.787 111.4 50.8 169.7-125.2 31.0 44.6 34.6 73 73 A X S S+ 0 0 67 -2,-0.2 -4,-0.2 -3,-0.2 -10,-0.1 -0.206 84.6 113.1 -42.8 84.1 32.7 41.8 32.6 74 74 A X S S- 0 0 47 -2,-1.0 44,-0.3 -4,-0.1 -13,-0.3 0.276 77.0-108.7-126.1 -93.3 36.1 43.5 33.1 75 75 A X S > S+ 0 0 45 -3,-0.3 4,-2.6 42,-0.1 -2,-0.1 0.401 76.2 115.7 166.6 14.2 38.6 41.8 35.2 76 76 A X H > S+ 0 0 62 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.933 89.0 51.3 -60.1 -45.0 39.2 43.5 38.5 77 77 A X H > S+ 0 0 64 2,-0.2 4,-2.7 1,-0.2 5,-0.4 0.938 105.1 57.8 -52.1 -45.0 37.8 40.3 40.1 78 78 A X H > S+ 0 0 54 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.963 108.4 45.9 -46.1 -62.6 40.4 38.6 37.9 79 79 A X H X S+ 0 0 47 -4,-2.6 4,-3.7 1,-0.2 -2,-0.2 0.930 112.9 47.2 -42.5 -72.7 43.1 40.6 39.6 80 80 A X H X S+ 0 0 53 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.896 115.8 44.5 -36.2 -66.0 41.9 40.2 43.2 81 81 A X H X S+ 0 0 51 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.950 115.1 47.6 -46.2 -58.5 41.5 36.4 42.8 82 82 A X H X S+ 0 0 48 -4,-3.1 4,-3.9 -5,-0.4 5,-0.4 0.916 111.7 52.7 -51.3 -48.9 44.8 35.9 41.0 83 83 A X H X S+ 0 0 22 -4,-3.7 4,-4.1 -5,-0.3 -1,-0.2 0.959 113.2 41.8 -46.3 -68.0 46.4 38.1 43.7 84 84 A X H < S+ 0 0 62 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.936 118.7 45.1 -45.2 -64.1 45.1 36.0 46.6 85 85 A X H < S+ 0 0 75 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.893 118.7 41.2 -48.4 -54.6 45.7 32.7 44.9 86 86 A X H < S- 0 0 71 -4,-3.9 -1,-0.2 -5,-0.3 -2,-0.2 0.937 96.6-142.7 -63.0 -47.0 49.2 33.6 43.7 87 87 A X S < S+ 0 0 71 -4,-4.1 2,-0.3 1,-0.4 -3,-0.1 0.016 70.8 94.4 104.6 -20.7 50.0 35.3 47.0 88 88 A X S S- 0 0 48 -6,-0.2 -1,-0.4 -5,-0.2 -2,-0.2 -0.693 83.7-100.4-103.5 152.2 51.9 37.9 45.1 89 89 A X - 0 0 85 -2,-0.3 2,-0.4 -3,-0.1 24,-0.2 -0.353 34.7-161.9 -70.6 151.4 50.7 41.3 43.9 90 90 A X - 0 0 67 22,-0.1 2,-0.3 -2,-0.1 24,-0.2 -1.000 13.5-127.7-139.1 137.2 49.8 41.8 40.2 91 91 A X E -e 114 0B 47 22,-2.5 24,-2.2 -2,-0.4 2,-0.6 -0.628 12.4-155.8 -88.7 143.7 49.4 44.9 38.2 92 92 A X E -e 115 0B 76 -2,-0.3 2,-0.5 22,-0.2 24,-0.1 -0.948 9.8-171.6-123.1 106.6 46.3 45.7 36.2 93 93 A X + 0 0 55 22,-1.2 24,-0.3 -2,-0.6 2,-0.2 -0.870 25.0 138.0-101.1 127.8 46.8 48.1 33.3 94 94 A X + 0 0 68 -2,-0.5 2,-0.6 22,-0.1 4,-0.1 -0.648 26.1 109.4-149.7-160.6 43.7 49.3 31.5 95 95 A X S S- 0 0 99 -2,-0.2 2,-0.2 2,-0.1 -1,-0.0 -0.713 125.4 -2.6 110.3 -63.4 41.6 52.1 29.9 96 96 A X S S- 0 0 58 -2,-0.6 2,-1.8 -28,-0.0 6,-0.3 -0.746 84.1-149.7-155.2 86.3 42.3 50.3 26.6 97 97 A X S S+ 0 0 50 20,-0.3 25,-0.1 -2,-0.2 2,-0.1 -0.522 77.3 55.9 -68.8 86.8 44.5 47.4 27.5 98 98 A X S S+ 0 0 63 -2,-1.8 2,-0.3 -4,-0.1 3,-0.1 -0.144 84.4 59.8 145.0 108.6 46.4 47.3 24.2 99 99 A X S > S- 0 0 48 1,-0.2 4,-3.6 -2,-0.1 5,-0.2 -0.919 94.7 -25.2 147.6-172.6 48.2 50.3 22.8 100 100 A X H > S+ 0 0 71 -2,-0.3 4,-3.5 1,-0.2 -1,-0.2 0.845 130.9 35.7 -31.5 -75.1 51.0 52.8 23.4 101 101 A X H > S+ 0 0 60 2,-0.2 4,-4.2 1,-0.2 5,-0.3 0.941 117.3 50.1 -54.9 -58.7 51.1 52.7 27.2 102 102 A X H > S+ 0 0 47 -6,-0.3 4,-5.7 2,-0.2 5,-0.4 0.951 115.1 47.6 -45.5 -54.5 50.3 49.1 27.7 103 103 A X H X S+ 0 0 31 -4,-3.6 4,-3.4 2,-0.2 5,-0.4 0.964 113.1 45.2 -48.0 -69.3 53.1 48.4 25.2 104 104 A X H X S+ 0 0 54 -4,-3.5 4,-3.6 1,-0.2 5,-0.2 0.915 121.5 43.0 -35.8 -60.2 55.5 50.8 26.9 105 105 A X H X S+ 0 0 46 -4,-4.2 4,-3.8 1,-0.2 -2,-0.2 0.925 113.4 46.7 -52.7 -62.0 54.4 49.2 30.1 106 106 A X H < S+ 0 0 39 -4,-5.7 -1,-0.2 -5,-0.3 -2,-0.2 0.844 118.7 44.1 -56.5 -34.6 54.4 45.5 29.1 107 107 A X H < S+ 0 0 59 -4,-3.4 3,-0.4 -5,-0.4 -2,-0.2 0.971 114.8 47.0 -71.6 -55.0 57.8 46.0 27.5 108 108 A X H < S+ 0 0 57 -4,-3.6 -2,-0.2 -5,-0.4 -3,-0.2 0.871 75.4 138.1 -52.0 -44.2 59.3 48.0 30.4 109 109 A X < - 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0 0 43 -13,-4.0 5,-0.1 -2,-0.4 -16,-0.1 -0.701 32.3-106.6 -91.3 128.8 37.4 45.5 11.4 141 141 A X > - 0 0 47 -2,-0.4 4,-4.4 3,-0.1 5,-0.1 0.092 15.4-119.7 -54.3 161.0 39.8 47.2 9.1 142 142 A X H > S+ 0 0 68 2,-0.2 4,-3.0 1,-0.2 5,-0.1 0.967 116.9 39.7 -57.6 -67.9 42.8 45.9 7.2 143 143 A X H > S+ 0 0 68 2,-0.2 4,-3.9 1,-0.2 5,-0.2 0.906 117.9 52.7 -50.5 -48.0 45.4 48.1 8.9 144 144 A X H > S+ 0 0 49 2,-0.2 4,-2.6 1,-0.2 5,-0.4 0.970 108.5 47.5 -52.7 -60.7 43.5 47.6 12.1 145 145 A X H X S+ 0 0 43 -4,-4.4 4,-2.2 1,-0.2 -2,-0.2 0.948 117.2 46.9 -41.0 -64.0 43.6 43.8 11.8 146 146 A X H X S+ 0 0 50 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.810 113.6 42.9 -43.6 -58.6 47.2 44.2 11.0 147 147 A X H X>S+ 0 0 43 -4,-3.9 4,-5.3 3,-0.2 5,-0.5 0.953 110.7 55.0 -65.2 -46.4 48.3 46.6 13.7 148 148 A X H X5S+ 0 0 51 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.932 115.2 39.7 -47.5 -54.1 46.4 44.8 16.5 149 149 A X H X5S+ 0 0 18 -4,-2.2 4,-1.7 -5,-0.4 -2,-0.2 0.990 124.5 40.1 -57.4 -61.4 48.1 41.5 15.8 150 150 A X H X5S+ 0 0 43 -4,-2.4 4,-0.8 1,-0.2 -2,-0.2 0.902 115.8 47.1 -51.1 -64.4 51.4 43.2 15.1 151 151 A X H ><5S+ 0 0 56 -4,-5.3 3,-0.9 -5,-0.2 -1,-0.2 0.950 106.4 59.8 -50.8 -51.8 51.4 45.8 17.9 152 152 A X H 3< + 0 0 37 -144,-0.1 4,-1.1 -142,-0.1 -1,-0.2 -0.118 27.4 113.2-123.3 30.7 43.0 28.9 25.3 165 165 A X H > + 0 0 34 2,-0.2 4,-3.3 1,-0.2 3,-0.5 0.952 59.2 68.1 -69.9 -56.5 41.6 26.7 22.7 166 166 A X H > S+ 0 0 49 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.816 107.0 48.2 -32.9 -39.0 38.0 27.7 22.7 167 167 A X H > S+ 0 0 49 1,-0.2 4,-2.5 2,-0.2 3,-0.3 0.939 111.1 46.2 -69.0 -49.7 39.5 30.9 21.2 168 168 A X H < S+ 0 0 14 -4,-1.1 232,-0.5 -3,-0.5 231,-0.4 0.744 104.0 68.2 -63.8 -25.2 41.6 29.0 18.6 169 169 A X H < S+ 0 0 56 -4,-3.3 -1,-0.2 1,-0.2 230,-0.2 0.951 111.4 28.9 -59.0 -55.9 38.5 27.1 17.8 170 170 A X H < S- 0 0 81 -4,-1.3 -2,-0.2 -3,-0.3 -1,-0.2 0.804 122.2-119.5 -74.4 -31.5 36.7 30.1 16.3 171 171 A X < - 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