==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 05-JUN-12 4FGW . COMPND 2 MOLECULE: GLYCEROL-3-PHOSPHATE DEHYDROGENASE [NAD(+)] 1; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR D.APARICIO,N.MUNMUN,X.CARPENA,I.FITA,P.LOEWEN . 706 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28341.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 489 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 29 4.1 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 . 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 . 40 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 273 38.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.3 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 0 8 2 0 4 6 0 4 0 0 0 2 2 0 0 0 0 0 0 4 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 8 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 PARALLEL BRIDGES PER LADDER . 5 1 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 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 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 33 A K 0 0 170 0, 0.0 32,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 -61.2 -12.3 -22.9 -6.9 2 34 A P - 0 0 58 0, 0.0 2,-0.5 0, 0.0 30,-0.3 -0.375 360.0 -97.4 -74.3 158.3 -8.5 -23.4 -6.1 3 35 A F E -a 32 0A 6 28,-2.8 30,-2.1 84,-0.1 2,-0.4 -0.667 28.2-150.0 -83.5 119.1 -5.9 -22.8 -8.8 4 36 A K E - 0 0 105 -2,-0.5 84,-2.2 28,-0.2 83,-2.1 -0.744 18.0-154.8 -84.9 125.0 -4.6 -25.8 -10.8 5 37 A V E -ab 36 88A 1 30,-0.5 32,-1.6 -2,-0.4 2,-0.4 -0.914 13.7-176.4-111.4 133.1 -1.0 -25.2 -12.0 6 38 A T E -ab 37 89A 4 82,-2.5 84,-2.8 -2,-0.4 2,-0.5 -0.990 12.3-153.3-126.7 134.8 0.8 -26.8 -15.0 7 39 A V E -ab 38 90A 0 30,-2.8 32,-2.7 -2,-0.4 2,-0.9 -0.939 3.1-157.7-108.0 121.4 4.4 -26.3 -16.1 8 40 A I E S+ab 39 91A 0 82,-2.5 84,-3.3 -2,-0.5 32,-0.1 -0.887 70.2 61.4 -97.6 98.3 5.2 -26.7 -19.8 9 41 A G - 0 0 11 30,-1.1 32,-0.3 -2,-0.9 -1,-0.1 0.039 48.5-174.5-172.3 -76.0 8.9 -27.5 -19.7 10 42 A S + 0 0 10 1,-0.2 53,-0.2 30,-0.1 83,-0.1 0.192 57.9 100.6 69.1 -9.2 10.7 -30.4 -17.9 11 43 A G S > S- 0 0 21 81,-0.5 4,-2.3 51,-0.0 5,-0.3 0.234 95.7 -58.6 -79.1-154.7 14.3 -29.3 -18.6 12 44 A N H > S+ 0 0 84 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.975 138.2 26.1 -46.1 -72.3 16.7 -27.5 -16.3 13 45 A W H > S+ 0 0 38 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.833 119.9 59.8 -67.9 -37.4 14.6 -24.4 -15.5 14 46 A G H > S+ 0 0 1 78,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.893 108.9 41.2 -59.4 -49.4 11.3 -26.2 -16.2 15 47 A T H X S+ 0 0 0 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.875 116.2 51.4 -67.7 -41.2 11.8 -28.9 -13.5 16 48 A T H X S+ 0 0 0 -4,-1.5 4,-1.9 -5,-0.3 3,-0.4 0.938 111.7 44.8 -62.0 -51.3 13.2 -26.3 -11.0 17 49 A I H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.847 112.0 53.7 -63.7 -32.5 10.3 -23.9 -11.4 18 50 A A H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.785 107.8 50.5 -69.7 -31.6 7.9 -26.9 -11.2 19 51 A K H X S+ 0 0 9 -4,-1.5 4,-1.8 -3,-0.4 -2,-0.2 0.894 111.1 48.7 -70.8 -44.0 9.6 -27.9 -7.8 20 52 A V H X S+ 0 0 1 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.910 115.1 44.9 -59.5 -48.4 9.2 -24.2 -6.6 21 53 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.899 111.7 51.4 -66.0 -44.5 5.4 -24.2 -7.6 22 54 A A H X S+ 0 0 0 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.829 108.2 53.1 -63.0 -35.2 4.7 -27.7 -6.1 23 55 A E H X S+ 0 0 34 -4,-1.8 4,-1.1 1,-0.2 -1,-0.2 0.883 112.8 43.9 -65.2 -42.4 6.2 -26.6 -2.8 24 56 A N H X S+ 0 0 4 -4,-1.5 4,-1.4 165,-0.3 -2,-0.2 0.801 107.7 57.4 -74.7 -33.0 3.9 -23.5 -2.7 25 57 A C H < S+ 0 0 1 -4,-2.1 7,-0.3 2,-0.2 -2,-0.2 0.892 111.3 43.9 -64.1 -39.3 0.8 -25.5 -3.8 26 58 A K H < S+ 0 0 162 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.811 114.4 52.3 -70.1 -33.7 1.3 -27.8 -0.8 27 59 A G H < S+ 0 0 49 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.665 116.2 38.0 -76.1 -23.4 2.0 -24.5 1.3 28 60 A Y >X + 0 0 94 -4,-1.4 4,-2.8 -3,-0.2 3,-1.0 -0.646 62.0 160.5-129.6 74.3 -1.3 -22.8 0.2 29 61 A P T 34 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.698 78.0 55.3 -70.3 -17.7 -4.1 -25.4 -0.0 30 62 A E T 34 S+ 0 0 123 1,-0.1 3,-0.1 3,-0.1 -2,-0.0 0.557 119.3 32.9 -85.7 -13.6 -6.9 -22.7 0.2 31 63 A V T <4 S+ 0 0 36 -3,-1.0 -28,-2.8 1,-0.3 2,-0.3 0.778 120.8 36.2-108.6 -49.7 -5.3 -20.9 -2.9 32 64 A F E < S-a 3 0A 1 -4,-2.8 -1,-0.3 -30,-0.3 -28,-0.2 -0.867 82.1-106.4-116.5 150.5 -3.9 -23.7 -5.2 33 65 A A E - 0 0 10 -30,-2.1 -28,-0.2 -2,-0.3 -5,-0.1 -0.264 36.7-117.5 -63.4 149.0 -4.9 -27.2 -6.1 34 66 A P E S+ 0 0 86 0, 0.0 2,-0.3 0, 0.0 38,-0.1 0.897 91.9 63.0 -61.3 -42.0 -2.6 -29.9 -4.4 35 67 A I E - 0 0 89 -10,-0.1 -30,-0.5 38,-0.1 2,-0.5 -0.669 63.6-159.9 -91.4 136.2 -1.1 -31.5 -7.6 36 68 A V E -ac 5 73A 0 36,-2.9 38,-2.5 -2,-0.3 2,-0.3 -0.972 12.8-145.7-115.6 128.4 1.1 -29.7 -10.1 37 69 A Q E -ac 6 74A 44 -32,-1.6 -30,-2.8 -2,-0.5 2,-0.4 -0.709 9.7-164.2 -93.5 139.6 1.4 -31.1 -13.6 38 70 A M E -ac 7 75A 0 36,-2.3 38,-3.0 -2,-0.3 2,-0.6 -0.976 17.8-134.1-128.2 117.6 4.6 -30.9 -15.6 39 71 A W E -ac 8 76A 20 -32,-2.7 -30,-1.1 -2,-0.4 2,-0.5 -0.603 26.0-173.5 -73.3 117.5 4.6 -31.6 -19.4 40 72 A V - 0 0 0 36,-2.6 2,-0.6 -2,-0.6 -30,-0.1 -0.968 26.7-129.3-114.3 121.9 7.6 -33.9 -20.2 41 73 A F - 0 0 101 -2,-0.5 37,-0.1 -32,-0.3 9,-0.1 -0.641 45.9-106.3 -70.0 111.8 8.4 -34.7 -23.8 42 74 A E + 0 0 69 -2,-0.6 2,-0.3 35,-0.4 -1,-0.1 -0.220 53.4 160.0 -52.3 125.8 8.6 -38.5 -23.6 43 75 A E - 0 0 61 5,-0.0 7,-2.2 -3,-0.0 2,-0.4 -0.953 32.1-127.8-144.1 151.1 12.1 -40.0 -23.7 44 76 A E B +I 49 0B 132 -2,-0.3 5,-0.2 5,-0.2 3,-0.0 -0.879 23.1 176.0-110.5 137.8 13.4 -43.4 -22.6 45 77 A I S S+ 0 0 64 3,-2.4 2,-2.3 -2,-0.4 -1,-0.2 0.742 84.1 12.5-102.9 -95.4 16.3 -43.9 -20.3 46 78 A N S S- 0 0 108 1,-0.2 3,-0.1 3,-0.0 -1,-0.1 -0.209 132.2 -71.8 -70.4 45.3 17.2 -47.4 -19.3 47 79 A G S S+ 0 0 49 -2,-2.3 -1,-0.2 1,-0.3 2,-0.1 0.533 115.8 131.7 65.8 5.7 14.7 -48.0 -22.0 48 80 A E - 0 0 90 1,-0.1 -3,-2.4 2,-0.0 2,-0.5 -0.432 68.6-103.8 -85.8 156.2 12.6 -46.7 -19.2 49 81 A K B >> -I 44 0B 98 -5,-0.2 4,-1.3 1,-0.1 3,-0.5 -0.759 18.3-149.9 -84.8 126.2 10.0 -43.9 -19.3 50 82 A L H 3> S+ 0 0 0 -7,-2.2 4,-1.8 -2,-0.5 5,-0.2 0.857 97.1 59.6 -60.0 -38.8 11.3 -40.5 -17.9 51 83 A T H 3> S+ 0 0 3 -8,-0.2 4,-1.4 1,-0.2 24,-0.4 0.823 109.0 43.5 -58.7 -37.3 7.7 -39.6 -16.8 52 84 A E H <4 S+ 0 0 97 -3,-0.5 -1,-0.2 2,-0.2 -2,-0.2 0.723 106.9 59.2 -82.9 -25.8 7.5 -42.7 -14.6 53 85 A I H <>S+ 0 0 26 -4,-1.3 5,-0.7 1,-0.2 3,-0.5 0.889 111.1 43.6 -66.6 -40.9 11.1 -42.2 -13.2 54 86 A I H <5S+ 0 0 0 -4,-1.8 2,-1.4 1,-0.2 4,-0.5 0.881 101.0 67.8 -71.4 -41.0 9.9 -38.8 -11.9 55 87 A N T <5S+ 0 0 48 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.1 -0.054 119.2 10.4 -76.3 42.3 6.5 -40.2 -10.6 56 88 A T T 5S+ 0 0 97 -2,-1.4 -1,-0.2 -3,-0.5 15,-0.0 0.330 128.5 35.9 106.1 117.4 8.6 -42.1 -8.0 57 89 A R T 5S- 0 0 230 -3,-0.2 -3,-0.2 12,-0.1 12,-0.1 -0.880 98.0-134.6 -82.7 23.7 11.6 -42.0 -7.0 58 90 A H < + 0 0 29 -5,-0.7 11,-2.5 -4,-0.5 2,-0.3 0.941 58.6 120.2 58.8 59.3 11.0 -38.2 -7.7 59 91 A Q - 0 0 61 -6,-0.5 2,-1.7 9,-0.2 -1,-0.2 -0.958 62.4-138.4-151.7 128.7 14.1 -37.2 -9.7 60 92 A N B > -J 64 0C 0 4,-0.6 4,-2.9 7,-0.4 7,-0.1 -0.657 30.4-172.7 -86.7 77.6 14.6 -35.8 -13.2 61 93 A V T 4 S+ 0 0 69 -2,-1.7 -1,-0.2 1,-0.2 -11,-0.0 0.676 75.8 36.7 -45.4 -31.5 17.6 -38.1 -13.7 62 94 A K T 4 S+ 0 0 103 2,-0.1 -1,-0.2 -3,-0.1 -2,-0.1 0.889 128.2 26.3 -92.3 -49.9 18.6 -36.6 -17.1 63 95 A Y T 4 S+ 0 0 81 1,-0.2 -2,-0.2 -53,-0.2 -48,-0.0 0.682 135.9 19.1 -94.0 -21.7 17.9 -32.8 -16.8 64 96 A L B >< S-J 60 0C 7 -4,-2.9 3,-1.1 3,-0.1 -4,-0.6 -0.515 79.6-169.7-146.5 68.2 18.1 -32.1 -13.0 65 97 A P T 3 + 0 0 90 0, 0.0 -4,-0.1 0, 0.0 3,-0.1 -0.367 67.3 17.0 -69.9 145.0 20.1 -35.0 -11.3 66 98 A G T 3 S+ 0 0 56 1,-0.2 2,-0.7 -2,-0.1 -5,-0.1 0.374 91.2 122.6 80.9 -0.2 20.4 -35.4 -7.5 67 99 A I < - 0 0 27 -3,-1.1 -7,-0.4 -7,-0.1 2,-0.4 -0.858 56.0-142.5-101.1 113.4 17.3 -33.1 -6.8 68 100 A T - 0 0 102 -2,-0.7 -9,-0.2 -9,-0.1 -10,-0.1 -0.581 15.9-145.4 -74.4 123.7 14.5 -34.6 -4.9 69 101 A L - 0 0 1 -11,-2.5 -12,-0.1 -2,-0.4 -50,-0.1 -0.688 21.6-108.9 -91.9 143.6 11.1 -33.4 -6.2 70 102 A P - 0 0 39 0, 0.0 -1,-0.1 0, 0.0 -51,-0.1 0.864 37.4-106.0 -36.0 -90.3 8.2 -32.9 -3.7 71 103 A D S S+ 0 0 123 -15,-0.0 -13,-0.1 0, 0.0 -2,-0.0 -0.048 111.8 61.1-179.5 -35.6 5.4 -35.6 -4.1 72 104 A N S S+ 0 0 20 -38,-0.1 -36,-2.9 -50,-0.1 2,-0.9 0.276 75.2 101.9 -93.4 4.0 2.7 -33.5 -5.8 73 105 A L E -c 36 0A 0 -38,-0.2 2,-0.5 -19,-0.1 -36,-0.2 -0.836 57.1-172.0 -92.2 100.3 4.9 -32.8 -8.8 74 106 A V E -c 37 0A 44 -38,-2.5 -36,-2.3 -2,-0.9 2,-0.3 -0.869 16.0-138.5-102.5 126.2 3.5 -35.2 -11.4 75 107 A A E -c 38 0A 3 -2,-0.5 -36,-0.2 -24,-0.4 -20,-0.1 -0.612 19.4-167.7 -80.9 137.5 5.1 -35.7 -14.8 76 108 A N E -c 39 0A 11 -38,-3.0 -36,-2.6 -2,-0.3 6,-0.1 -0.989 20.0-165.1-131.9 125.0 2.8 -35.9 -17.9 77 109 A P S S+ 0 0 62 0, 0.0 2,-0.6 0, 0.0 -35,-0.4 0.688 74.8 77.7 -81.1 -16.9 3.8 -37.0 -21.4 78 110 A D > - 0 0 84 1,-0.2 4,-1.7 -37,-0.1 5,-0.1 -0.854 65.4-157.4 -98.0 117.1 0.6 -35.6 -23.0 79 111 A L H > S+ 0 0 14 -2,-0.6 4,-1.2 1,-0.2 3,-0.3 0.947 94.0 45.9 -52.3 -56.0 0.5 -31.9 -23.6 80 112 A I H > S+ 0 0 58 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.835 109.7 53.5 -64.2 -34.3 -3.3 -31.7 -23.7 81 113 A D H >4 S+ 0 0 87 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.868 106.2 53.1 -68.9 -33.8 -3.8 -33.9 -20.6 82 114 A S H 3< S+ 0 0 3 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.815 109.0 50.1 -69.2 -30.0 -1.5 -31.7 -18.6 83 115 A V H >< S+ 0 0 2 -4,-1.2 3,-0.6 -5,-0.1 -1,-0.2 0.522 75.9 145.4 -87.2 -4.2 -3.6 -28.6 -19.6 84 116 A K T << S- 0 0 149 -3,-0.7 -3,-0.1 -4,-0.6 25,-0.1 -0.029 89.1 -37.4 -41.4 102.8 -6.8 -30.5 -18.6 85 117 A D T 3 S+ 0 0 92 24,-0.2 2,-0.3 1,-0.1 -1,-0.2 0.870 91.9 172.1 18.0 102.3 -8.7 -27.5 -17.3 86 118 A V < - 0 0 1 -3,-0.6 -81,-0.2 23,-0.3 -1,-0.1 -0.886 30.3-157.1-130.8 151.7 -5.8 -25.7 -15.7 87 119 A D S S+ 0 0 43 -83,-2.1 27,-2.0 -2,-0.3 2,-0.4 0.829 79.1 34.6-103.1 -45.6 -5.9 -22.2 -14.3 88 120 A I E -bd 5 114A 1 -84,-2.2 -82,-2.5 25,-0.2 2,-0.5 -0.969 63.4-165.0-120.8 123.7 -2.2 -21.2 -14.4 89 121 A I E -bd 6 115A 0 25,-1.9 27,-2.4 -2,-0.4 2,-0.6 -0.927 3.5-162.5-106.8 126.2 0.3 -22.2 -17.2 90 122 A V E -bd 7 116A 0 -84,-2.8 -82,-2.5 -2,-0.5 2,-0.5 -0.944 12.2-152.6-107.5 106.9 4.0 -21.7 -16.5 91 123 A F E +bd 8 117A 0 25,-3.2 27,-3.0 -2,-0.6 28,-0.2 -0.769 28.3 157.7 -85.2 123.0 5.9 -21.8 -19.8 92 124 A N + 0 0 13 -84,-3.3 -81,-0.5 -2,-0.5 -78,-0.3 -0.419 26.7 113.0-146.3 69.3 9.5 -23.0 -19.3 93 125 A I S S- 0 0 9 -83,-0.1 5,-0.1 -80,-0.1 -83,-0.1 -0.881 72.9 -78.0-133.1 162.0 10.9 -24.4 -22.6 94 126 A P > - 0 0 55 0, 0.0 3,-2.3 0, 0.0 4,-0.4 -0.314 45.0-111.8 -65.8 147.3 13.7 -23.3 -24.9 95 127 A H G > S+ 0 0 94 1,-0.3 3,-1.0 2,-0.2 24,-0.0 0.748 114.4 61.9 -45.1 -39.3 12.8 -20.4 -27.3 96 128 A Q G 3 S+ 0 0 137 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.652 103.2 51.4 -67.2 -19.4 13.0 -22.7 -30.4 97 129 A F G <> S+ 0 0 94 -3,-2.3 4,-2.2 1,-0.1 -1,-0.2 0.445 83.9 88.0 -96.9 -6.7 10.1 -24.9 -29.1 98 130 A L H <> S+ 0 0 6 -3,-1.0 4,-2.4 -4,-0.4 5,-0.2 0.938 86.7 50.8 -59.4 -47.1 7.7 -22.1 -28.4 99 131 A P H > S+ 0 0 65 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.843 113.1 48.0 -60.6 -32.4 6.1 -22.1 -32.0 100 132 A R H > S+ 0 0 128 -4,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.944 113.1 45.7 -67.5 -54.1 5.6 -26.0 -31.6 101 133 A I H X S+ 0 0 3 -4,-2.2 4,-1.1 1,-0.2 -3,-0.2 0.880 115.5 47.5 -56.9 -44.4 4.0 -25.8 -28.1 102 134 A C H X S+ 0 0 0 -4,-2.4 4,-1.4 2,-0.2 3,-0.2 0.892 110.5 50.4 -66.1 -45.5 1.7 -22.9 -29.2 103 135 A S H < S+ 0 0 87 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.811 114.5 46.4 -63.8 -31.0 0.6 -24.6 -32.4 104 136 A Q H < S+ 0 0 84 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.650 112.1 48.7 -85.4 -22.7 -0.2 -27.7 -30.5 105 137 A L H >X S+ 0 0 0 -4,-1.1 3,-2.3 -3,-0.2 4,-0.6 0.651 80.5 120.5 -88.9 -17.5 -2.1 -25.9 -27.7 106 138 A K T 3< S+ 0 0 109 -4,-1.4 34,-0.1 1,-0.3 35,-0.0 -0.268 88.3 7.2 -52.2 120.0 -4.2 -23.8 -30.1 107 139 A G T 34 S+ 0 0 82 33,-0.2 -1,-0.3 1,-0.0 33,-0.1 0.643 119.7 78.2 78.0 19.6 -7.9 -24.6 -29.4 108 140 A H T <4 S+ 0 0 102 -3,-2.3 -2,-0.2 32,-0.1 -3,-0.0 0.387 78.8 64.8-132.9 -4.8 -7.0 -26.7 -26.3 109 141 A V S < S- 0 0 11 -4,-0.6 -23,-0.3 31,-0.1 -24,-0.2 0.953 84.2-122.5 -88.2 -79.8 -6.3 -24.1 -23.6 110 142 A D > - 0 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S+ 0 0 0 -4,-1.0 4,-2.3 -3,-0.3 -1,-0.2 0.936 105.8 50.3 -66.5 -45.5 30.7 -8.6 -24.1 219 251 A G H X S+ 0 0 0 -4,-1.3 4,-1.7 1,-0.2 -2,-0.2 0.814 110.8 50.4 -60.0 -34.8 31.8 -5.0 -23.6 220 252 A C H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.883 109.6 49.8 -69.1 -44.9 32.9 -5.9 -20.0 221 253 A G H X S+ 0 0 0 -4,-2.0 4,-3.1 2,-0.2 5,-0.2 0.903 109.6 51.1 -60.5 -44.9 34.9 -8.9 -21.1 222 254 A F H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.941 113.9 44.8 -56.1 -50.4 36.7 -6.8 -23.8 223 255 A V H <>S+ 0 0 0 -4,-1.7 5,-2.1 2,-0.2 6,-0.3 0.834 115.8 46.1 -65.5 -37.4 37.6 -4.3 -21.1 224 256 A E H ><5S+ 0 0 44 -4,-2.4 3,-2.1 3,-0.2 5,-0.4 0.945 111.3 51.7 -69.7 -50.9 38.7 -7.0 -18.5 225 257 A G H 3<5S+ 0 0 19 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.724 103.5 58.8 -57.9 -29.5 40.8 -8.9 -21.1 226 258 A L T 3<5S- 0 0 52 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.533 120.4-113.0 -75.8 -11.2 42.6 -5.7 -22.1 227 259 A G T < 5S+ 0 0 48 -3,-2.1 -3,-0.2 -4,-0.1 -2,-0.2 0.689 77.6 132.2 84.0 24.9 43.6 -5.5 -18.4 228 260 A W >< - 0 0 45 -5,-2.1 4,-0.5 1,-0.2 3,-0.3 0.621 53.8-150.6 -83.2 -11.8 41.6 -2.4 -17.5 229 261 A G H > - 0 0 26 -5,-0.4 4,-1.5 -6,-0.3 -1,-0.2 -0.206 35.6 -39.2 81.4-168.1 40.2 -3.9 -14.3 230 262 A N H > S+ 0 0 70 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.781 128.3 57.5 -65.1 -38.5 37.0 -3.7 -12.3 231 263 A N H > S+ 0 0 3 -3,-0.3 4,-1.3 2,-0.2 286,-0.2 0.841 109.6 44.6 -65.3 -37.8 36.6 0.2 -12.6 232 264 A A H X S+ 0 0 0 -4,-0.5 4,-1.5 2,-0.2 -2,-0.2 0.869 114.8 49.4 -73.6 -38.1 36.5 -0.1 -16.4 233 265 A S H X S+ 0 0 4 -4,-1.5 4,-2.0 2,-0.2 3,-0.2 0.932 109.6 50.7 -65.0 -48.2 34.1 -3.0 -16.2 234 266 A A H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.830 107.4 55.9 -58.3 -36.4 31.8 -1.2 -13.8 235 267 A A H X S+ 0 0 1 -4,-1.3 4,-2.4 2,-0.2 -1,-0.2 0.894 107.6 47.4 -63.7 -43.2 31.8 1.8 -16.2 236 268 A I H X S+ 0 0 0 -4,-1.5 4,-3.2 -3,-0.2 -2,-0.2 0.864 110.8 52.4 -66.5 -37.4 30.5 -0.4 -19.1 237 269 A Q H X S+ 0 0 9 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.896 111.2 47.1 -63.9 -40.0 27.8 -1.9 -16.8 238 270 A R H X S+ 0 0 39 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.923 116.3 42.9 -66.2 -47.4 26.7 1.7 -16.0 239 271 A V H X S+ 0 0 22 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.921 115.7 50.9 -64.0 -44.5 26.7 2.7 -19.7 240 272 A G H X S+ 0 0 0 -4,-3.2 4,-2.1 2,-0.2 -2,-0.2 0.907 107.1 51.6 -59.1 -48.7 25.0 -0.6 -20.5 241 273 A L H X S+ 0 0 3 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.906 109.7 51.4 -55.2 -44.3 22.3 -0.2 -17.9 242 274 A G H X S+ 0 0 27 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.869 110.3 48.4 -60.5 -39.4 21.6 3.3 -19.4 243 275 A E H X S+ 0 0 3 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.826 109.3 52.1 -72.5 -31.9 21.3 1.8 -22.9 244 276 A I H X S+ 0 0 2 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.913 112.4 46.3 -68.0 -44.5 18.9 -1.0 -21.7 245 277 A I H X S+ 0 0 12 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.940 113.9 48.3 -60.6 -50.1 16.7 1.7 -20.1 246 278 A R H X S+ 0 0 109 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.867 112.9 48.2 -58.9 -43.1 16.8 3.9 -23.3 247 279 A F H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 5,-0.3 0.903 112.1 49.2 -64.5 -48.0 16.0 0.8 -25.5 248 280 A G H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 7,-0.2 0.935 115.0 42.2 -57.3 -51.4 13.1 -0.2 -23.3 249 281 A Q H < S+ 0 0 68 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.708 114.8 51.5 -72.3 -23.6 11.5 3.2 -23.2 250 282 A M H < S+ 0 0 69 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.883 125.4 24.1 -77.8 -43.7 12.1 3.9 -26.9 251 283 A F H < S+ 0 0 39 -4,-2.2 -2,-0.2 1,-0.1 -3,-0.2 0.621 137.9 28.0-102.9 -13.7 10.5 0.6 -28.1 252 284 A F S >< S+ 0 0 32 -4,-2.7 3,-1.6 -5,-0.3 2,-0.4 -0.210 70.5 177.0-138.3 44.7 8.2 -0.2 -25.3 253 285 A P T 3 S+ 0 0 90 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.465 72.6 72.7 -30.4 -15.5 7.4 3.2 -23.9 254 286 A E T 3 S+ 0 0 174 -2,-0.4 2,-0.3 -6,-0.2 -49,-0.1 0.315 77.9 112.0 -84.0 12.0 5.0 1.7 -21.3 255 287 A S < - 0 0 5 -3,-1.6 2,-0.4 -7,-0.2 -3,-0.1 -0.658 67.2-131.4 -88.7 138.5 8.1 0.5 -19.6 256 288 A R >> - 0 0 132 -2,-0.3 3,-0.7 1,-0.1 4,-0.6 -0.728 4.6-142.9 -93.4 136.3 9.0 2.0 -16.2 257 289 A E H >> S+ 0 0 51 -2,-0.4 4,-0.9 1,-0.2 3,-0.9 0.858 101.0 67.8 -56.3 -38.2 12.7 3.2 -15.6 258 290 A E H 3> S+ 0 0 50 1,-0.2 4,-2.8 2,-0.2 3,-0.4 0.809 89.2 62.2 -49.5 -44.4 12.2 1.8 -12.1 259 291 A T H <> S+ 0 0 4 -3,-0.7 4,-1.5 1,-0.2 7,-0.5 0.855 101.2 52.8 -52.4 -45.6 12.1 -1.9 -13.3 260 292 A Y H << S+ 0 0 0 -3,-0.9 7,-2.3 -4,-0.6 -1,-0.2 0.831 122.8 25.0 -65.6 -39.0 15.6 -1.6 -14.7 261 293 A Y H < S+ 0 0 5 -4,-0.9 -2,-0.2 -3,-0.4 -1,-0.2 0.629 125.8 46.0-103.2 -16.7 17.4 -0.4 -11.5 262 294 A Q H < S+ 0 0 76 -4,-2.8 2,-0.2 -5,-0.2 -3,-0.2 0.674 101.4 72.9 -95.6 -25.2 14.9 -1.7 -8.8 263 295 A E S ><>S- 0 0 13 -4,-1.5 5,-0.9 -5,-0.4 3,-0.8 -0.669 75.4-128.0-104.8 155.2 14.4 -5.3 -10.0 264 296 A S T 3 >S+ 0 0 3 1,-0.2 5,-1.9 -2,-0.2 -115,-0.2 0.867 112.1 58.9 -56.3 -41.7 16.3 -8.6 -10.1 265 297 A A T 3 5S+ 0 0 0 -117,-0.5 -1,-0.2 3,-0.2 -116,-0.2 0.784 115.1 37.1 -59.1 -32.3 15.5 -8.9 -13.9 266 298 A G T <>5S+ 0 0 2 -3,-0.8 4,-1.9 -7,-0.5 3,-0.3 0.750 129.2 4.3 -85.1-113.0 17.3 -5.5 -14.4 267 299 A V H >5S+ 0 0 2 -7,-2.3 4,-2.7 1,-0.2 -3,-0.2 0.804 129.5 51.8 -46.3 -48.3 20.4 -4.4 -12.5 268 300 A A H > S- 0 0 41 -2,-0.3 4,-2.3 -3,-0.1 5,-0.2 -0.879 76.9 -61.8 153.5 178.4 29.4 -16.3 -17.7 278 310 A R H > S+ 0 0 121 -2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.878 124.9 47.7 -55.9 -50.3 29.6 -17.4 -21.4 279 311 A N H > S+ 0 0 10 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.910 115.7 42.0 -62.2 -50.0 29.4 -13.9 -22.9 280 312 A V H > S+ 0 0 0 -7,-0.4 4,-2.0 1,-0.2 -2,-0.2 0.902 115.3 52.0 -65.4 -41.2 32.0 -12.2 -20.6 281 313 A K H X S+ 0 0 108 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.872 111.1 45.6 -62.6 -45.6 34.4 -15.3 -20.8 282 314 A V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.940 114.6 48.4 -63.4 -48.7 34.4 -15.3 -24.7 283 315 A A H X S+ 0 0 0 -4,-1.9 4,-1.3 1,-0.2 -2,-0.2 0.817 109.1 53.7 -59.8 -38.4 34.9 -11.5 -24.9 284 316 A R H X S+ 0 0 76 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.886 110.2 46.7 -64.8 -42.7 37.8 -11.7 -22.3 285 317 A L H X>S+ 0 0 26 -4,-1.7 4,-3.5 2,-0.2 5,-0.6 0.885 105.9 59.2 -68.5 -39.0 39.5 -14.4 -24.5 286 318 A M H <5S+ 0 0 11 -4,-2.2 4,-0.4 1,-0.2 -1,-0.2 0.858 112.7 40.3 -54.9 -40.1 39.0 -12.2 -27.7 287 319 A A H <5S+ 0 0 24 -4,-1.3 -2,-0.2 -5,-0.1 -1,-0.2 0.867 117.7 48.3 -75.9 -40.5 41.0 -9.5 -25.9 288 320 A T H <5S+ 0 0 99 -4,-2.1 -2,-0.2 -5,-0.1 -3,-0.2 0.930 129.9 17.2 -64.7 -53.7 43.6 -12.0 -24.4 289 321 A S T <5S- 0 0 53 -4,-3.5 -3,-0.2 2,-0.1 -2,-0.1 0.947 90.2-128.6 -86.5 -63.0 44.3 -13.9 -27.7 290 322 A G < + 0 0 58 -5,-0.6 -4,-0.2 -4,-0.4 -3,-0.1 0.484 60.7 134.0 117.9 8.5 43.1 -11.8 -30.6 291 323 A K - 0 0 70 -6,-0.3 -1,-0.3 1,-0.2 -2,-0.1 -0.383 62.3 -93.6 -82.0 169.9 41.0 -14.5 -32.2 292 324 A D > - 0 0 80 -2,-0.1 4,-1.7 1,-0.1 -1,-0.2 -0.311 40.7 -97.7 -80.1 171.3 37.6 -13.8 -33.4 293 325 A A H >> S+ 0 0 0 45,-0.4 4,-2.3 1,-0.2 3,-1.0 0.952 119.7 46.3 -47.0 -64.7 34.5 -14.5 -31.3 294 326 A W H 3> S+ 0 0 104 1,-0.3 4,-1.9 2,-0.3 -1,-0.2 0.761 108.2 55.4 -61.9 -29.1 33.6 -17.9 -32.7 295 327 A E H 3> S+ 0 0 113 2,-0.2 4,-1.3 1,-0.2 -1,-0.3 0.895 114.5 42.2 -64.7 -40.1 37.1 -19.2 -32.5 296 328 A C H < S- 0 0 12 -4,-1.3 3,-0.8 -5,-0.3 2,-0.4 0.501 74.2-176.0 -82.9 -5.1 32.0 -23.2 -24.5 302 334 A N T 3< S+ 0 0 138 -4,-0.7 -1,-0.2 -5,-0.3 -2,-0.1 -0.283 78.1 11.0 45.9 -96.9 32.4 -26.4 -26.6 303 335 A G T 3 S+ 0 0 74 -2,-0.4 2,-0.3 2,-0.0 -1,-0.3 -0.026 121.2 82.2 -96.6 28.2 28.8 -27.4 -27.5 304 336 A Q < - 0 0 100 -3,-0.8 2,-0.3 -7,-0.3 -3,-0.2 -0.907 66.0-136.1-131.9 157.7 27.3 -24.0 -26.2 305 337 A S - 0 0 72 -2,-0.3 2,-1.0 -4,-0.0 -26,-0.1 -0.885 15.5-129.6-119.0 148.4 26.9 -20.5 -27.6 306 338 A A > - 0 0 0 -2,-0.3 3,-1.9 1,-0.2 4,-0.4 -0.830 25.3-159.5 -91.0 99.5 27.4 -16.9 -26.2 307 339 A Q T >> S+ 0 0 83 -2,-1.0 3,-2.0 1,-0.3 4,-1.9 0.856 81.9 71.9 -51.6 -42.4 24.0 -15.5 -27.1 308 340 A G H 3> S+ 0 0 0 1,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.710 86.9 66.8 -48.7 -26.5 25.2 -11.9 -27.0 309 341 A L H <> S+ 0 0 0 -3,-1.9 4,-0.5 2,-0.2 -1,-0.3 0.878 109.5 35.7 -61.5 -41.7 27.2 -12.5 -30.2 310 342 A I H X> S+ 0 0 63 -3,-2.0 4,-2.3 -4,-0.4 3,-0.7 0.909 115.1 56.6 -77.9 -46.5 23.8 -12.9 -32.1 311 343 A T H 3X S+ 0 0 2 -4,-1.9 4,-3.0 1,-0.2 5,-0.3 0.868 101.1 55.5 -55.2 -45.1 22.0 -10.2 -30.1 312 344 A C H 3X S+ 0 0 1 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.816 112.8 44.0 -60.9 -29.5 24.5 -7.4 -30.8 313 345 A K H S+ 0 0 5 -4,-2.6 5,-2.5 2,-0.2 4,-1.7 0.796 107.3 54.8 -68.1 -32.0 18.4 0.1 -35.0 320 352 A E H <5S+ 0 0 118 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.892 109.3 47.0 -67.1 -40.9 19.4 0.4 -38.7 321 353 A T H <5S+ 0 0 89 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.691 118.5 42.8 -73.4 -19.4 15.7 -0.0 -39.8 322 354 A C H <5S- 0 0 53 -4,-0.9 -2,-0.2 -5,-0.1 -1,-0.2 0.673 105.7-127.6 -92.5 -28.7 14.7 2.6 -37.1 323 355 A G T <5S+ 0 0 67 -4,-1.7 -3,-0.2 -5,-0.1 -4,-0.1 0.837 76.6 118.3 75.8 37.3 17.6 5.0 -37.8 324 356 A S < + 0 0 20 -5,-2.5 3,-0.4 1,-0.1 4,-0.3 -0.027 24.6 114.1-122.8 27.0 18.5 4.9 -34.1 325 357 A V S > S+ 0 0 24 -6,-0.5 3,-1.4 1,-0.2 7,-0.3 0.893 74.8 57.7 -66.0 -42.2 22.1 3.4 -34.2 326 358 A E T 3 S+ 0 0 183 1,-0.3 -1,-0.2 -7,-0.1 -2,-0.1 0.756 96.7 64.3 -58.8 -31.1 23.6 6.7 -32.9 327 359 A D T 3 S+ 0 0 72 -3,-0.4 -1,-0.3 1,-0.2 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110.7 52.3 -66.3 -37.8 22.6 -7.8 -2.2 591 269 B Q H X S+ 0 0 8 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.895 111.3 47.0 -63.3 -39.6 23.9 -5.2 -4.7 592 270 B R H X S+ 0 0 43 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.926 116.4 42.8 -66.8 -47.7 20.3 -4.7 -5.9 593 271 B V H X S+ 0 0 22 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.920 115.7 51.1 -63.7 -44.5 18.9 -4.5 -2.3 594 272 B G H X S+ 0 0 0 -4,-3.2 4,-2.1 2,-0.2 -2,-0.2 0.907 107.2 51.6 -59.0 -49.0 21.9 -2.2 -1.3 595 273 B L H X S+ 0 0 2 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.907 109.8 51.2 -55.1 -44.6 21.3 0.2 -4.3 596 274 B G H X S+ 0 0 27 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.873 110.5 48.5 -60.0 -40.1 17.6 0.5 -3.2 597 275 B E H X S+ 0 0 4 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.830 109.5 51.9 -72.0 -32.1 18.7 1.3 0.4 598 276 B I H X S+ 0 0 2 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.912 112.3 46.3 -68.0 -44.8 21.3 3.9 -0.8 599 277 B I H X S+ 0 0 13 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.945 114.0 48.4 -60.5 -50.6 18.5 5.6 -2.9 600 278 B R H X S+ 0 0 107 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.856 112.0 49.3 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17.7 12.8 -7.5 611 289 B E H >> S+ 0 0 47 -2,-0.4 3,-0.9 1,-0.2 4,-0.9 0.856 101.3 68.0 -56.2 -38.3 17.0 9.0 -7.9 612 290 B E H 3> S+ 0 0 51 1,-0.2 4,-2.8 2,-0.2 5,-0.4 0.803 89.1 62.3 -49.1 -44.1 18.7 9.3 -11.3 613 291 B T H <> S+ 0 0 4 -3,-0.8 4,-1.5 1,-0.2 7,-0.5 0.855 101.1 52.9 -52.7 -45.3 22.1 10.1 -9.7 614 292 B Y H << S+ 0 0 0 -3,-0.9 7,-2.5 -4,-0.6 -1,-0.2 0.837 122.9 24.8 -66.0 -38.9 22.2 6.6 -8.0 615 293 B Y H < S+ 0 0 6 -4,-0.9 -2,-0.2 -3,-0.3 -1,-0.2 0.624 126.0 45.8-103.3 -16.4 21.6 4.5 -11.1 616 294 B Q H < S+ 0 0 76 -4,-2.8 2,-0.2 -5,-0.2 -3,-0.2 0.668 101.3 73.4 -96.2 -25.0 22.9 6.8 -14.0 617 295 B E S ><>S- 0 0 15 -4,-1.5 3,-0.9 -5,-0.4 5,-0.9 -0.669 75.6-127.8-104.9 155.4 26.2 8.0 -12.5 618 296 B S T 3 >S+ 0 0 2 1,-0.3 5,-2.0 -2,-0.2 -115,-0.2 0.863 112.1 58.5 -57.3 -40.9 29.7 6.5 -11.8 619 297 B A T 3 5S+ 0 0 0 -117,-0.5 -1,-0.3 -116,-0.2 -116,-0.2 0.724 115.2 37.6 -62.4 -26.8 29.4 7.7 -8.1 620 298 B G T <>5S+ 0 0 2 -3,-0.9 4,-1.9 -7,-0.5 3,-0.3 0.666 129.3 3.2 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40.8 -10.0 13.2 650 328 B C H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 5,-0.3 0.873 110.8 56.1 -67.0 -41.3 40.3 -10.3 9.4 651 329 B E H X S+ 0 0 28 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.856 110.6 45.2 -56.7 -43.5 41.1 -6.6 8.9 652 330 B K H X S+ 0 0 169 -4,-2.0 4,-0.7 1,-0.2 -2,-0.2 0.911 113.5 49.6 -67.4 -48.5 44.5 -7.1 10.7 653 331 B E H < S+ 0 0 105 -4,-2.0 -2,-0.2 1,-0.1 -1,-0.2 0.815 124.7 24.6 -60.1 -42.0 45.2 -10.4 8.7 654 332 B L H < S+ 0 0 53 -4,-2.2 -2,-0.2 2,-0.1 -3,-0.2 0.817 130.5 28.9-100.3 -37.9 44.5 -8.9 5.2 655 333 B L H >< S- 0 0 7 -4,-1.9 3,-1.9 -5,-0.3 -3,-0.2 0.274 73.4-177.5-111.4 11.1 44.9 -5.1 5.1 656 334 B N T 3< S+ 0 0 127 -4,-0.7 -1,-0.2 1,-0.3 -2,-0.1 0.077 77.1 21.0 21.5 -98.6 47.5 -4.7 7.8 657 335 B G T 3 S+ 0 0 67 2,-0.0 -1,-0.3 -5,-0.0 -2,-0.1 0.929 118.0 67.7 -50.7 -54.0 47.9 -1.0 7.9 658 336 B Q S < S- 0 0 102 -3,-1.9 2,-0.3 1,-0.1 -3,-0.2 -0.146 70.5-127.5 -86.2 168.2 44.6 0.0 6.4 659 337 B S - 0 0 51 -7,-0.0 2,-0.9 3,-0.0 -26,-0.1 -0.804 15.4-126.0-115.0 148.1 41.0 -0.2 7.4 660 338 B A > - 0 0 0 -2,-0.3 3,-1.5 -28,-0.2 4,-0.4 -0.857 27.2-158.3 -90.0 101.7 37.7 -1.5 5.8 661 339 B Q T >> S+ 0 0 97 -2,-0.9 4,-2.2 1,-0.2 3,-0.5 0.679 82.4 73.2 -60.2 -22.1 35.7 1.7 6.2 662 340 B G H 3> S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.729 87.5 63.9 -63.4 -27.0 32.4 -0.2 6.0 663 341 B L H <> S+ 0 0 1 -3,-1.5 4,-0.7 2,-0.2 -1,-0.2 0.864 109.9 37.7 -64.5 -41.3 33.0 -1.5 9.6 664 342 B I H <> S+ 0 0 63 -3,-0.5 4,-2.1 -4,-0.4 3,-0.4 0.906 115.8 54.7 -74.9 -47.4 32.8 2.0 10.9 665 343 B T H X S+ 0 0 7 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.855 102.0 54.9 -59.3 -43.9 30.0 3.1 8.5 666 344 B C H X S+ 0 0 1 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.863 112.2 45.0 -62.8 -31.3 27.5 0.3 9.4 667 345 B K H X S+ 0 0 78 -4,-0.7 4,-2.2 -3,-0.4 -2,-0.2 0.921 115.0 47.4 -73.5 -46.9 27.7 1.3 13.1 668 346 B E H X S+ 0 0 62 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.884 112.4 48.7 -62.3 -43.7 27.4 5.1 12.4 669 347 B V H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.946 111.9 50.8 -61.4 -47.2 24.4 4.6 10.0 670 348 B H H X S+ 0 0 13 -4,-1.7 4,-1.9 -5,-0.2 -2,-0.2 0.866 109.7 49.5 -56.2 -45.9 22.8 2.4 12.7 671 349 B E H X S+ 0 0 52 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.909 112.2 47.7 -62.3 -44.8 23.3 5.1 15.4 672 350 B W H X S+ 0 0 36 -4,-2.2 4,-0.9 1,-0.2 -2,-0.2 0.891 112.7 49.2 -61.3 -44.2 21.8 7.8 13.1 673 351 B L H X>S+ 0 0 4 -4,-2.6 5,-2.5 2,-0.2 4,-1.7 0.800 107.3 54.8 -68.0 -32.3 18.8 5.5 12.3 674 352 B E H <5S+ 0 0 118 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.894 109.5 46.9 -66.4 -41.2 18.3 4.8 16.1 675 353 B T H <5S+ 0 0 88 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.692 118.4 43.1 -73.7 -19.6 18.0 8.6 16.8 676 354 B C H <5S- 0 0 51 -4,-0.9 -2,-0.2 -5,-0.1 -1,-0.2 0.671 105.6-127.7 -91.7 -29.3 15.6 8.9 13.8 677 355 B G T <5S+ 0 0 66 -4,-1.7 -3,-0.2 -5,-0.1 -4,-0.1 0.846 76.7 118.3 75.8 37.6 13.6 5.8 14.6 678 356 B S < + 0 0 21 -5,-2.5 3,-0.4 1,-0.1 4,-0.3 -0.025 24.8 113.8-123.2 27.1 14.2 4.6 11.0 679 357 B V S > S+ 0 0 26 -6,-0.5 3,-1.4 1,-0.2 7,-0.3 0.892 74.9 57.7 -66.3 -42.1 16.1 1.3 11.6 680 358 B E T 3 S+ 0 0 179 1,-0.3 -1,-0.2 -7,-0.1 -2,-0.1 0.749 96.8 64.2 -59.2 -30.8 13.2 -0.9 10.2 681 359 B D T 3 S+ 0 0 69 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.638 104.3 46.5 -69.5 -20.5 13.4 1.0 6.8 682 360 B F <> + 0 0 0 -3,-1.4 4,-2.5 -4,-0.3 -1,-0.2 -0.551 61.5 162.2-124.2 67.4 17.0 -0.3 6.1 683 361 B P H > S+ 0 0 35 0, 0.0 4,-2.6 0, 0.0 -1,-0.1 0.823 78.2 50.2 -56.8 -34.7 17.1 -4.1 6.8 684 362 B L H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.934 112.0 46.3 -68.1 -47.0 20.3 -4.7 4.8 685 363 B F H > S+ 0 0 5 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.903 117.1 46.2 -59.3 -41.8 22.2 -1.8 6.6 686 364 B E H X S+ 0 0 67 -4,-2.5 4,-2.4 -7,-0.3 -2,-0.2 0.906 110.7 52.2 -66.1 -44.7 20.8 -3.2 9.9 687 365 B A H X S+ 0 0 3 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.899 109.4 48.8 -58.2 -47.5 21.7 -6.8 9.0 688 366 B V H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.933 113.2 48.3 -58.8 -47.9 25.4 -5.9 8.2 689 367 B Y H X>S+ 0 0 32 -4,-1.9 4,-2.6 1,-0.2 5,-0.6 0.882 111.5 49.4 -58.2 -47.4 25.7 -4.0 11.5 690 368 B Q H X5S+ 0 0 22 -4,-2.4 6,-1.5 2,-0.2 4,-0.5 0.811 113.6 45.8 -63.1 -37.1 24.1 -6.9 13.5 691 369 B I H <5S+ 0 0 9 -4,-1.9 -2,-0.2 4,-0.2 -1,-0.2 0.925 117.9 42.7 -70.6 -49.4 26.5 -9.5 11.9 692 370 B V H <5S+ 0 0 7 -4,-2.4 -45,-0.4 -5,-0.2 -2,-0.2 0.923 128.6 23.5 -63.7 -55.1 29.7 -7.3 12.4 693 371 B Y H <5S+ 0 0 68 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.1 0.908 128.2 33.3 -85.5 -48.8 29.1 -5.9 16.0 694 372 B N S < S+ 0 0 23 1,-0.2 3,-1.1 -11,-0.1 -118,-0.1 -0.153 90.3 74.2 73.8 -41.0 25.2 -14.4 8.8 699 377 B K T 3 S+ 0 0 144 -2,-1.7 4,-0.2 1,-0.2 -1,-0.2 0.664 85.5 66.2 -71.3 -20.7 23.2 -17.3 7.1 700 378 B N T 3> + 0 0 66 1,-0.2 4,-1.9 2,-0.1 3,-0.5 0.415 68.5 107.3 -81.0 -2.6 20.0 -15.5 8.2 701 379 B L H <> S+ 0 0 0 -3,-1.1 4,-1.8 1,-0.2 3,-0.3 0.871 76.5 50.0 -45.8 -50.7 20.8 -12.6 5.8 702 380 B P H > S+ 0 0 9 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.877 112.4 47.8 -57.2 -41.6 18.0 -13.6 3.3 703 381 B D H 4 S+ 0 0 90 -3,-0.5 -2,-0.2 -4,-0.2 -3,-0.1 0.803 110.5 52.8 -65.8 -34.9 15.4 -13.7 6.2 704 382 B M H < S+ 0 0 52 -4,-1.9 -1,-0.2 -3,-0.3 -3,-0.1 0.838 117.9 35.2 -70.7 -37.0 16.6 -10.3 7.5 705 383 B I H < S+ 0 0 16 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.564 87.9 129.7 -94.4 -12.5 16.1 -8.5 4.2 706 384 B E < 0 0 76 -4,-1.3 -3,-0.1 -5,-0.2 -510,-0.0 -0.166 360.0 360.0 -49.9 127.6 13.0 -10.5 3.0 707 385 B E 0 0 164 -510,-0.1 -510,-0.2 0, 0.0 -1,-0.1 -0.774 360.0 360.0-100.8 360.0 10.1 -8.3 1.9