==== 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 07-JAN-08 3BVE . COMPND 2 MOLECULE: FERRITIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HELICOBACTER PYLORI; . AUTHOR K.H.KIM,K.J.CHO,J.H.LEE,H.J.SHIN,I.S.YANG . 1037 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46103.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 820 79.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 31 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 708 68.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.0 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 0 6 0 0 0 0 0 0 0 0 3 2 1 0 0 0 0 0 0 6 0 0 6 5 6 1 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1006 A H 0 0 218 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 154.0 68.0 80.0 -59.8 2 1005 A H - 0 0 89 907,-0.1 2,-0.4 1,-0.1 0, 0.0 -0.309 360.0-119.3 -80.2 155.3 65.6 80.9 -56.9 3 1004 A H - 0 0 140 -2,-0.1 2,-0.4 907,-0.0 -1,-0.1 -0.804 23.6-159.7 -95.7 131.2 64.2 84.3 -56.0 4 1003 A S - 0 0 21 -2,-0.4 904,-0.1 904,-0.1 905,-0.0 -0.874 30.4 -96.8-108.9 145.8 65.0 85.6 -52.5 5 1002 A Q - 0 0 134 -2,-0.4 3,-0.1 1,-0.1 905,-0.1 -0.272 43.0-105.6 -63.0 142.7 62.9 88.4 -50.8 6 1001 A D - 0 0 118 1,-0.2 -1,-0.1 2,-0.1 67,-0.1 -0.157 52.3 -72.3 -57.7 157.5 64.2 92.0 -51.0 7 0 A P - 0 0 59 0, 0.0 65,-0.2 0, 0.0 -1,-0.2 -0.284 39.1-143.9 -47.5 134.8 65.7 93.7 -48.0 8 1 A M S S+ 0 0 133 63,-3.0 2,-0.3 -3,-0.1 64,-0.1 0.496 77.1 70.9 -86.9 -5.7 62.9 94.5 -45.5 9 2 A L S S- 0 0 14 62,-0.4 2,-0.0 59,-0.1 111,-0.0 -0.766 88.6-100.4-111.3 158.3 64.6 97.8 -44.4 10 3 A S > - 0 0 54 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.292 32.8-109.5 -74.8 159.8 65.0 101.1 -46.2 11 4 A K H > S+ 0 0 183 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.892 117.0 49.6 -55.9 -45.5 68.2 102.2 -48.0 12 5 A D H > S+ 0 0 97 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.892 113.4 44.8 -61.9 -44.5 69.0 104.9 -45.4 13 6 A I H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.878 111.7 53.7 -70.3 -39.9 68.5 102.6 -42.4 14 7 A I H X S+ 0 0 25 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.943 110.8 47.2 -52.7 -50.4 70.5 99.9 -44.1 15 8 A K H X S+ 0 0 119 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.923 113.6 47.2 -61.1 -45.3 73.3 102.4 -44.6 16 9 A L H X S+ 0 0 27 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.900 113.9 46.6 -64.2 -42.8 73.1 103.6 -41.0 17 10 A L H X S+ 0 0 2 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.900 112.0 49.6 -69.6 -41.2 73.1 100.1 -39.5 18 11 A N H X S+ 0 0 4 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.905 109.9 51.9 -63.5 -41.3 75.9 98.8 -41.6 19 12 A E H X S+ 0 0 86 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.881 108.3 53.1 -58.3 -36.9 78.0 101.9 -40.7 20 13 A Q H X S+ 0 0 5 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.845 104.4 53.7 -70.4 -37.1 77.2 101.1 -37.0 21 14 A V H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.954 112.3 45.0 -59.3 -49.5 78.4 97.5 -37.3 22 15 A N H X S+ 0 0 15 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.864 111.0 54.5 -64.0 -37.0 81.7 98.8 -38.7 23 16 A K H X S+ 0 0 66 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.900 109.0 47.6 -59.3 -46.2 81.8 101.5 -35.9 24 17 A E H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.849 111.0 50.9 -66.9 -35.7 81.4 98.8 -33.2 25 18 A M H X S+ 0 0 8 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.924 112.1 47.5 -65.2 -42.4 84.2 96.6 -34.8 26 19 A N H X S+ 0 0 57 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.903 111.0 50.8 -62.7 -43.4 86.5 99.7 -34.9 27 20 A S H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.907 106.2 56.5 -59.8 -44.6 85.6 100.5 -31.3 28 21 A S H X S+ 0 0 1 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.922 109.4 44.8 -52.6 -50.1 86.4 96.9 -30.3 29 22 A N H X S+ 0 0 7 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.880 110.0 54.8 -66.2 -38.9 89.9 97.2 -31.8 30 23 A L H X S+ 0 0 22 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.953 110.1 47.2 -56.2 -49.1 90.5 100.6 -30.2 31 24 A Y H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.857 108.8 53.4 -64.8 -35.3 89.7 99.1 -26.8 32 25 A M H X S+ 0 0 1 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.893 110.6 48.6 -61.7 -39.8 92.0 96.1 -27.4 33 26 A S H X S+ 0 0 8 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.932 112.7 46.3 -66.1 -46.5 94.8 98.6 -28.1 34 27 A M H X S+ 0 0 1 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.905 112.1 52.7 -60.4 -42.1 94.0 100.6 -25.0 35 28 A S H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.934 108.2 49.7 -57.5 -50.3 93.9 97.4 -23.0 36 29 A S H X S+ 0 0 5 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.859 107.0 55.1 -60.0 -38.8 97.3 96.2 -24.3 37 30 A W H < S+ 0 0 39 -4,-2.0 4,-0.5 2,-0.2 -1,-0.2 0.948 110.8 45.6 -59.3 -47.0 98.8 99.6 -23.4 38 31 A C H ><>S+ 0 0 0 -4,-2.0 5,-2.6 1,-0.2 3,-1.4 0.944 111.0 52.1 -63.4 -46.4 97.6 99.1 -19.8 39 32 A Y H ><5S+ 0 0 43 -4,-2.7 3,-0.7 1,-0.3 -1,-0.2 0.826 111.3 47.5 -57.3 -34.2 98.8 95.5 -19.6 40 33 A T T 3<5S+ 0 0 20 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.449 110.0 53.2 -90.8 0.5 102.3 96.5 -20.8 41 34 A H T < 5S- 0 0 66 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 -0.036 122.5 -97.3-122.6 30.0 102.5 99.4 -18.3 42 35 A S T < 5S+ 0 0 64 -3,-0.7 2,-0.8 1,-0.1 3,-0.2 0.522 91.1 120.5 70.0 12.0 101.7 97.4 -15.1 43 36 A L >< + 0 0 8 -5,-2.6 4,-2.4 -6,-0.2 -1,-0.1 -0.559 21.4 153.6-104.1 66.2 98.0 98.5 -15.2 44 37 A D H > + 0 0 77 -2,-0.8 4,-2.4 2,-0.2 5,-0.2 0.717 69.1 62.6 -70.7 -18.4 96.4 95.0 -15.4 45 38 A G H > S+ 0 0 0 2,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.964 111.3 35.5 -65.7 -55.5 93.2 96.3 -13.7 46 39 A A H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.865 115.1 60.7 -64.4 -36.5 92.5 98.8 -16.5 47 40 A G H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.932 108.6 40.7 -55.6 -51.4 93.9 96.1 -18.9 48 41 A L H X S+ 0 0 28 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.944 114.7 51.5 -64.8 -49.4 91.2 93.6 -17.9 49 42 A F H X S+ 0 0 1 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.910 113.6 44.3 -52.2 -48.5 88.4 96.1 -17.8 50 43 A L H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.847 112.0 52.3 -71.2 -35.8 89.2 97.4 -21.3 51 44 A F H X S+ 0 0 15 -4,-2.1 4,-2.1 -5,-0.3 -2,-0.2 0.938 111.7 46.0 -59.6 -50.7 89.7 93.9 -22.8 52 45 A D H X S+ 0 0 33 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.874 113.1 50.5 -63.7 -36.8 86.3 92.9 -21.4 53 46 A H H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.901 107.1 53.7 -66.8 -41.0 84.7 96.1 -22.7 54 47 A A H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.915 108.2 50.7 -56.4 -44.2 86.3 95.5 -26.2 55 48 A A H X S+ 0 0 12 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.881 108.2 53.1 -61.1 -40.6 84.7 92.1 -26.2 56 49 A E H X S+ 0 0 71 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.879 104.8 53.0 -62.6 -43.0 81.3 93.6 -25.4 57 50 A E H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.910 108.5 51.2 -61.8 -40.8 81.4 96.2 -28.2 58 51 A Y H X S+ 0 0 8 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.878 105.5 55.9 -61.4 -38.5 82.1 93.2 -30.6 59 52 A E H X S+ 0 0 53 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.889 105.6 52.4 -58.5 -40.4 79.0 91.5 -29.1 60 53 A H H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.908 107.2 51.5 -60.2 -42.5 77.0 94.7 -30.0 61 54 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.910 108.9 51.7 -61.5 -42.1 78.3 94.4 -33.6 62 55 A K H X S+ 0 0 19 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.908 107.7 50.8 -60.9 -43.2 77.2 90.7 -33.7 63 56 A K H X S+ 0 0 82 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.857 110.8 49.2 -64.6 -35.9 73.6 91.6 -32.5 64 57 A L H X S+ 0 0 3 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.896 109.6 52.3 -67.5 -42.6 73.3 94.3 -35.2 65 58 A I H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.913 106.4 53.6 -57.6 -43.6 74.5 91.7 -37.8 66 59 A I H X S+ 0 0 78 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.915 109.4 48.7 -58.5 -44.2 71.8 89.3 -36.6 67 60 A F H X S+ 0 0 9 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.894 111.3 48.9 -64.1 -42.0 69.2 91.9 -37.2 68 61 A L H <>S+ 0 0 0 -4,-2.2 5,-2.7 1,-0.2 3,-0.4 0.930 111.8 50.3 -61.1 -46.0 70.5 92.8 -40.6 69 62 A N H ><5S+ 0 0 4 -4,-2.8 3,-1.6 1,-0.2 -2,-0.2 0.900 107.8 52.0 -58.6 -43.4 70.5 89.0 -41.5 70 63 A E H 3<5S+ 0 0 120 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.782 109.2 50.6 -70.2 -24.3 66.9 88.5 -40.3 71 64 A N T 3<5S- 0 0 12 -4,-1.3 -63,-3.0 -3,-0.4 -62,-0.4 0.198 116.5-112.9 -92.9 12.9 65.7 91.5 -42.5 72 65 A N T < 5 + 0 0 37 -3,-1.6 -3,-0.2 -65,-0.2 -2,-0.1 0.833 67.0 150.7 54.8 36.7 67.5 90.0 -45.6 73 66 A V < - 0 0 0 -5,-2.7 -1,-0.2 -6,-0.2 -2,-0.1 -0.870 50.1-119.1-101.9 121.2 69.9 93.0 -45.6 74 67 A P - 0 0 60 0, 0.0 2,-0.5 0, 0.0 -56,-0.1 -0.362 23.9-130.5 -56.9 128.8 73.4 92.4 -46.9 75 68 A V - 0 0 7 825,-0.2 2,-0.7 826,-0.1 829,-0.1 -0.757 20.5-159.3 -78.8 125.1 76.0 93.0 -44.2 76 69 A Q - 0 0 109 -2,-0.5 2,-0.5 -61,-0.0 -54,-0.2 -0.843 6.8-169.7-114.2 91.6 78.7 95.4 -45.8 77 70 A L - 0 0 14 -2,-0.7 2,-0.2 820,-0.1 3,-0.1 -0.712 7.3-164.9 -84.3 126.6 81.9 95.1 -43.8 78 71 A T - 0 0 73 -2,-0.5 2,-0.1 1,-0.2 870,-0.1 -0.456 39.9 -67.8 -99.5 174.6 84.4 97.8 -44.8 79 72 A S - 0 0 73 -2,-0.2 2,-0.7 871,-0.1 870,-0.2 -0.455 49.3-133.6 -60.3 134.4 88.1 97.9 -44.0 80 73 A I B -A 948 0A 4 868,-2.9 868,-2.5 -2,-0.1 -1,-0.1 -0.859 22.0-129.0 -95.7 111.5 88.7 98.4 -40.3 81 74 A S - 0 0 79 -2,-0.7 -52,-0.1 866,-0.2 865,-0.0 -0.263 29.5 -99.3 -57.9 141.3 91.3 101.1 -39.8 82 75 A A - 0 0 41 1,-0.1 865,-0.1 865,-0.0 864,-0.1 -0.399 46.8-116.8 -57.3 137.7 94.2 100.2 -37.4 83 76 A P - 0 0 18 0, 0.0 862,-0.1 0, 0.0 -1,-0.1 -0.371 30.9 -87.5 -77.4 158.7 93.5 101.6 -34.0 84 77 A E + 0 0 100 1,-0.1 -51,-0.1 -2,-0.1 -50,-0.0 -0.375 41.4 176.8 -53.7 139.8 95.6 104.3 -32.1 85 78 A H + 0 0 132 -3,-0.1 2,-0.6 -49,-0.0 -1,-0.1 0.484 50.6 93.2-123.6 -14.7 98.4 102.6 -30.2 86 79 A K + 0 0 173 2,-0.0 2,-0.3 -49,-0.0 -52,-0.0 -0.730 49.8 164.0 -87.6 119.6 100.2 105.7 -28.8 87 80 A F - 0 0 19 -2,-0.6 3,-0.1 1,-0.1 -2,-0.0 -0.984 34.4-153.2-138.0 148.4 99.0 106.7 -25.3 88 81 A E - 0 0 170 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.732 67.8 -49.0 -91.5 -27.7 100.4 109.0 -22.6 89 82 A G > - 0 0 18 1,-0.1 4,-2.3 0, 0.0 -1,-0.3 -0.988 64.0 -64.7 174.1-179.0 98.8 107.4 -19.5 90 83 A L H > S+ 0 0 6 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.921 125.5 48.4 -56.1 -50.8 95.8 106.0 -17.6 91 84 A T H > S+ 0 0 30 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.928 111.6 48.5 -60.0 -47.6 94.0 109.3 -17.5 92 85 A Q H > S+ 0 0 52 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.882 109.2 54.7 -62.0 -38.9 94.5 110.1 -21.2 93 86 A I H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.944 113.0 41.1 -58.0 -49.6 93.2 106.6 -22.1 94 87 A F H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.798 112.1 54.3 -74.3 -27.7 90.0 107.1 -20.1 95 88 A Q H X S+ 0 0 68 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.936 113.5 43.7 -65.5 -45.2 89.5 110.7 -21.3 96 89 A K H X S+ 0 0 60 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.869 114.1 51.2 -63.5 -39.5 89.8 109.5 -24.9 97 90 A A H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.905 109.1 49.0 -69.1 -42.2 87.5 106.5 -24.1 98 91 A Y H X S+ 0 0 5 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.907 112.3 48.6 -62.5 -43.3 84.8 108.7 -22.5 99 92 A E H X S+ 0 0 116 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.895 111.6 50.9 -62.7 -38.0 84.9 111.0 -25.5 100 93 A H H X S+ 0 0 30 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.924 108.4 50.7 -64.5 -45.4 84.7 107.9 -27.8 101 94 A E H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.843 107.4 54.5 -61.1 -36.0 81.7 106.6 -25.8 102 95 A Q H X S+ 0 0 80 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.884 108.1 49.6 -63.2 -40.5 80.0 110.0 -26.2 103 96 A H H X S+ 0 0 84 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.902 110.4 49.8 -63.4 -43.5 80.5 109.7 -30.0 104 97 A I H X S+ 0 0 2 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.915 109.6 51.8 -62.3 -42.6 79.0 106.2 -30.0 105 98 A S H X S+ 0 0 11 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.925 109.9 49.0 -59.5 -45.5 76.0 107.4 -28.0 106 99 A E H X S+ 0 0 136 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.902 108.5 53.6 -58.8 -44.5 75.4 110.2 -30.5 107 100 A S H X S+ 0 0 14 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.832 110.2 47.2 -63.1 -34.9 75.6 107.8 -33.4 108 101 A I H X S+ 0 0 3 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.903 108.9 53.6 -72.7 -42.2 73.0 105.6 -31.9 109 102 A N H X S+ 0 0 35 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.877 107.0 54.5 -55.8 -40.0 70.7 108.6 -31.2 110 103 A N H X S+ 0 0 70 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.882 109.0 45.6 -61.4 -44.3 71.1 109.4 -34.9 111 104 A I H X S+ 0 0 2 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.910 113.5 49.4 -66.8 -41.9 69.9 106.0 -36.0 112 105 A V H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.902 110.3 50.9 -66.3 -40.0 67.0 106.0 -33.6 113 106 A D H X S+ 0 0 14 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.860 109.7 50.7 -62.9 -37.5 65.9 109.4 -34.8 114 107 A H H X S+ 0 0 42 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.872 106.5 54.0 -69.9 -36.7 66.0 108.3 -38.4 115 108 A A H X>S+ 0 0 0 -4,-2.2 5,-2.9 2,-0.2 4,-0.6 0.932 110.1 48.7 -58.4 -45.3 63.9 105.2 -37.5 116 109 A I H ><5S+ 0 0 41 -4,-2.1 3,-1.1 3,-0.2 -2,-0.2 0.947 112.8 46.0 -58.8 -52.6 61.3 107.7 -36.0 117 110 A K H 3<5S+ 0 0 146 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.865 116.5 45.5 -58.0 -39.4 61.4 110.0 -39.1 118 111 A S H 3<5S- 0 0 50 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.499 109.4-124.1 -81.2 -6.4 61.1 107.0 -41.5 119 112 A K T <<5 + 0 0 171 -3,-1.1 2,-1.2 -4,-0.6 -3,-0.2 0.824 59.2 150.9 58.9 35.2 58.3 105.4 -39.3 120 113 A D >< + 0 0 27 -5,-2.9 4,-2.2 -6,-0.2 -1,-0.2 -0.708 9.3 163.3 -96.1 84.4 60.5 102.3 -39.0 121 114 A H H > + 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V H X S+ 0 0 6 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.937 114.8 46.3 -60.2 -49.0 70.2 102.5 -26.3 132 125 A A H X S+ 0 0 35 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.920 114.8 45.2 -60.2 -49.3 69.9 101.2 -22.7 133 126 A E H X S+ 0 0 57 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.886 112.4 51.1 -68.2 -39.9 73.2 99.3 -22.8 134 127 A Q H X S+ 0 0 3 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.910 108.3 52.5 -61.5 -43.1 75.2 102.1 -24.4 135 128 A H H X S+ 0 0 21 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.936 109.0 50.1 -56.2 -47.5 73.8 104.6 -21.8 136 129 A E H X S+ 0 0 126 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.905 112.8 47.2 -53.9 -47.5 75.1 102.2 -19.1 137 130 A E H X S+ 0 0 4 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.908 111.0 50.0 -64.9 -44.8 78.5 102.1 -20.7 138 131 A E H X S+ 0 0 24 -4,-3.0 4,-2.0 2,-0.2 -2,-0.2 0.922 112.7 47.0 -60.3 -46.5 78.8 105.8 -21.2 139 132 A V H X S+ 0 0 14 -4,-2.5 4,-2.6 -5,-0.2 -1,-0.2 0.897 110.2 55.3 -58.0 -43.2 77.9 106.4 -17.5 140 133 A L H X S+ 0 0 24 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.926 108.8 45.4 -57.8 -49.5 80.4 103.7 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0.837 109.8 53.1 -66.3 -36.4 85.6 91.7 -11.7 171 164 A S H 3< S+ 0 0 99 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.708 106.8 54.2 -73.2 -20.1 82.2 92.8 -10.5 172 165 A R H << 0 0 96 -4,-1.5 -1,-0.2 -3,-0.5 -2,-0.2 0.625 360.0 360.0 -89.0 -16.1 80.9 93.1 -14.1 173 166 A K << 0 0 148 -4,-0.7 -3,-0.1 -3,-0.5 -4,-0.0 0.336 360.0 360.0-112.9 360.0 81.9 89.5 -15.0 174 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 175 1006 B H 0 0 204 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 142.4 78.6 70.9 60.7 176 1005 B H - 0 0 79 560,-0.1 2,-0.5 1,-0.1 0, 0.0 -0.340 360.0-125.1 -87.0 148.9 80.2 69.1 57.8 177 1004 B H - 0 0 137 -2,-0.1 2,-0.3 560,-0.0 -1,-0.1 -0.768 21.9-161.7 -89.3 126.2 83.8 68.5 56.8 178 1003 B S - 0 0 19 -2,-0.5 557,-0.1 557,-0.1 558,-0.0 -0.849 32.2 -96.3-103.6 145.3 84.9 69.6 53.3 179 1002 B Q - 0 0 134 -2,-0.3 3,-0.1 1,-0.1 558,-0.1 -0.284 43.1-106.6 -63.1 144.0 88.1 68.2 51.8 180 1001 B D - 0 0 115 1,-0.2 -1,-0.1 2,-0.1 67,-0.1 -0.166 52.5 -70.5 -61.4 159.3 91.3 70.3 52.0 181 0 B P - 0 0 63 0, 0.0 65,-0.2 0, 0.0 -1,-0.2 -0.241 39.2-144.0 -50.8 141.9 92.7 72.1 49.0 182 1 B M S S+ 0 0 133 63,-2.9 2,-0.3 -3,-0.1 64,-0.1 0.481 75.7 71.3 -92.9 -6.1 94.2 69.7 46.5 183 2 B L S S- 0 0 15 62,-0.4 2,-0.0 59,-0.1 111,-0.0 -0.776 88.1-101.2-110.4 155.9 97.1 71.9 45.4 184 3 B S > - 0 0 54 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.308 34.9-107.4 -71.1 158.8 100.2 72.9 47.3 185 4 B K H > S+ 0 0 184 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.853 117.7 48.9 -54.6 -43.0 100.5 76.4 49.0 186 5 B D H > S+ 0 0 87 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.903 111.6 47.8 -69.6 -42.5 103.0 77.7 46.5 187 6 B I H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.881 111.2 52.6 -63.2 -40.3 100.9 76.7 43.4 188 7 B I H X S+ 0 0 33 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.931 109.6 48.7 -59.1 -48.2 97.8 78.2 45.1 189 8 B K H X S+ 0 0 96 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.919 112.9 47.3 -59.0 -46.5 99.6 81.5 45.6 190 9 B L H X S+ 0 0 17 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.880 113.1 47.8 -63.8 -41.6 100.9 81.6 42.0 191 10 B L H X S+ 0 0 1 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.896 112.2 48.7 -68.8 -42.5 97.4 80.8 40.5 192 11 B N H X S+ 0 0 13 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.891 110.5 51.5 -62.8 -41.6 95.6 83.4 42.7 193 12 B E H X S+ 0 0 94 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.909 109.5 51.3 -58.0 -41.6 98.2 86.0 41.7 194 13 B Q H X S+ 0 0 4 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.864 106.1 53.7 -67.1 -38.7 97.5 85.0 38.1 195 14 B V H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.950 113.7 42.5 -57.9 -50.4 93.8 85.4 38.4 196 15 B N H X S+ 0 0 11 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.840 111.3 56.3 -68.0 -31.2 94.3 88.9 39.8 197 16 B K H X S+ 0 0 56 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.915 108.3 47.4 -63.9 -43.1 96.9 89.6 37.1 198 17 B E H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.848 110.8 51.0 -68.1 -36.3 94.4 88.8 34.4 199 18 B M H X S+ 0 0 7 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.912 112.2 47.0 -67.4 -43.1 91.7 91.0 35.9 200 19 B N H X S+ 0 0 42 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.930 113.6 48.9 -58.1 -48.3 94.2 93.9 36.1 201 20 B S H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.924 108.0 54.6 -57.4 -48.1 95.2 93.2 32.5 202 21 B S H X S+ 0 0 1 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.915 109.7 45.8 -55.3 -49.0 91.6 93.1 31.4 203 22 B N H X S+ 0 0 8 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.833 109.1 56.3 -66.1 -33.0 90.8 96.5 32.8 204 23 B L H X S+ 0 0 34 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.919 108.2 48.2 -60.5 -44.4 94.0 97.9 31.3 205 24 B Y H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.869 107.9 54.6 -65.4 -36.7 92.8 96.8 27.9 206 25 B M H X S+ 0 0 2 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.901 109.8 48.2 -58.6 -41.6 89.4 98.3 28.5 207 26 B S H X S+ 0 0 5 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.913 112.6 46.9 -67.3 -44.1 91.2 101.6 29.2 208 27 B M H X S+ 0 0 2 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.918 111.7 52.3 -60.3 -44.9 93.3 101.3 26.1 209 28 B S H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.917 108.7 49.5 -57.2 -47.6 90.2 100.4 24.1 210 29 B S H X S+ 0 0 4 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.869 107.5 54.7 -61.8 -38.2 88.3 103.5 25.3 211 30 B W H < S+ 0 0 36 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0.917 111.5 48.3 -61.7 -43.9 90.4 75.2 38.2 242 61 B L H <>S+ 0 0 0 -4,-2.4 5,-2.7 1,-0.2 3,-0.4 0.947 112.1 50.4 -60.2 -47.0 90.8 76.6 41.7 243 62 B N H ><5S+ 0 0 6 -4,-3.1 3,-1.8 1,-0.2 -2,-0.2 0.914 108.3 50.2 -55.4 -49.8 87.2 75.8 42.5 244 63 B E H 3<5S+ 0 0 122 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.749 109.9 52.6 -65.8 -25.0 87.4 72.1 41.3 245 64 B N T 3<5S- 0 0 15 -4,-1.3 -63,-2.9 -3,-0.4 -62,-0.4 0.249 116.4-113.9 -90.4 10.7 90.6 71.7 43.5 246 65 B N T < 5 + 0 0 37 -3,-1.8 -3,-0.2 -65,-0.2 -2,-0.1 0.839 67.7 147.8 56.1 36.9 88.8 73.0 46.6 247 66 B V < - 0 0 0 -5,-2.7 -1,-0.2 -6,-0.2 -2,-0.1 -0.903 49.8-125.1-104.4 120.2 91.1 76.0 46.6 248 67 B P - 0 0 67 0, 0.0 2,-0.4 0, 0.0 -56,-0.1 -0.420 24.0-128.8 -61.0 130.9 89.7 79.3 48.0 249 68 B V - 0 0 14 478,-0.2 2,-0.8 479,-0.1 482,-0.1 -0.725 14.3-148.8 -80.5 130.5 90.1 82.1 45.4 250 69 B Q - 0 0 141 -2,-0.4 2,-0.7 -61,-0.1 -54,-0.2 -0.870 14.5-166.4-103.0 99.0 91.7 85.2 46.9 251 70 B L - 0 0 17 -2,-0.8 2,-0.1 527,-0.1 3,-0.1 -0.788 7.5-170.6 -93.0 115.3 90.2 88.2 45.1 252 71 B T - 0 0 61 -2,-0.7 2,-0.2 1,-0.1 523,-0.0 -0.332 37.9 -74.1 -93.6 175.1 92.2 91.4 45.7 253 72 B S - 0 0 66 524,-0.1 2,-0.4 -2,-0.1 523,-0.2 -0.545 50.7-126.0 -67.3 136.9 91.3 95.0 44.7 254 73 B I B -B 775 0B 3 521,-2.4 521,-1.9 -2,-0.2 -57,-0.1 -0.768 28.2-110.9 -90.9 130.0 91.9 95.5 41.0 255 74 B S - 0 0 72 -2,-0.4 -1,-0.1 519,-0.2 -52,-0.1 -0.220 24.8-111.2 -58.9 142.3 94.2 98.4 40.1 256 75 B A - 0 0 59 518,-0.1 518,-0.2 1,-0.1 517,-0.2 -0.664 46.1-129.5 -65.1 122.4 92.8 101.5 38.4 257 76 B P - 0 0 16 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.372 27.4 -82.4 -75.6 160.6 94.4 101.2 35.0 258 77 B E - 0 0 88 1,-0.1 514,-0.1 -2,-0.1 3,-0.0 -0.391 41.6-173.0 -52.0 133.7 96.4 103.9 33.2 259 78 B H + 0 0 108 -3,-0.1 2,-0.4 -2,-0.1 -1,-0.1 0.651 58.9 72.3-106.7 -24.8 93.9 106.3 31.5 260 79 B K + 0 0 159 -49,-0.0 2,-0.3 2,-0.0 -1,-0.1 -0.816 55.0 170.9-104.5 134.4 96.2 108.5 29.5 261 80 B F - 0 0 24 -2,-0.4 3,-0.1 1,-0.1 -2,-0.0 -0.933 32.4-138.0-137.6 158.1 98.1 107.4 26.4 262 81 B E - 0 0 161 1,-0.3 2,-0.3 -2,-0.3 -1,-0.1 0.808 69.2 -53.1 -87.6 -34.5 100.2 109.1 23.7 263 82 B G > - 0 0 11 1,-0.1 4,-2.3 0, 0.0 -1,-0.3 -0.970 64.0 -65.5 172.8 179.0 98.9 107.4 20.5 264 83 B L H > S+ 0 0 3 -2,-0.3 4,-2.2 2,-0.2 5,-0.2 0.897 126.1 48.7 -56.5 -50.4 98.3 104.1 18.7 265 84 B T H > S+ 0 0 11 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.931 111.8 49.4 -58.0 -48.7 102.0 103.1 18.4 266 85 B Q H > S+ 0 0 64 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.891 109.1 52.5 -59.9 -42.6 102.6 103.8 22.1 267 86 B I H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.954 113.9 42.0 -58.7 -49.1 99.5 101.8 23.2 268 87 B F H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.765 112.2 54.4 -74.2 -24.9 100.6 98.7 21.2 269 88 B Q H X S+ 0 0 67 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.919 114.0 42.0 -67.8 -45.3 104.2 99.1 22.3 270 89 B K H X S+ 0 0 117 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.894 114.8 51.6 -65.9 -41.1 103.0 99.1 25.9 271 90 B A H X S+ 0 0 0 -4,-2.8 4,-2.5 -5,-0.2 -2,-0.2 0.903 108.5 50.7 -64.3 -42.6 100.6 96.2 25.1 272 91 B Y H X S+ 0 0 54 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.932 111.4 47.3 -61.8 -45.8 103.3 94.1 23.5 273 92 B E H X S+ 0 0 126 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.888 111.2 53.0 -60.1 -39.9 105.6 94.6 26.6 274 93 B H H X S+ 0 0 33 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.926 107.8 49.9 -61.5 -45.9 102.6 93.7 28.8 275 94 B E H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.864 107.6 54.2 -62.6 -37.5 102.0 90.5 26.9 276 95 B Q H X S+ 0 0 82 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.910 109.2 48.5 -60.8 -43.8 105.7 89.5 27.2 277 96 B H H X S+ 0 0 89 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.899 111.0 50.5 -60.5 -44.0 105.3 90.0 31.0 278 97 B I H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.929 109.2 50.7 -61.0 -45.4 102.2 87.9 31.0 279 98 B S H X S+ 0 0 11 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.887 109.9 50.8 -60.4 -41.6 103.9 85.1 29.0 280 99 B E H X S+ 0 0 142 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.895 107.4 52.9 -59.4 -44.6 106.8 85.1 31.5 281 100 B S H X S+ 0 0 15 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.873 110.1 48.3 -63.7 -37.5 104.4 84.9 34.5 282 101 B I H X S+ 0 0 2 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.948 109.1 52.5 -65.5 -49.6 102.8 81.8 32.9 283 102 B N H X S+ 0 0 98 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.876 107.0 55.5 -50.4 -42.5 106.2 80.2 32.2 284 103 B N H X S+ 0 0 82 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.909 109.1 44.3 -58.4 -47.6 107.0 80.8 35.9 285 104 B I H X S+ 0 0 2 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.932 114.1 49.6 -64.0 -44.7 103.9 78.8 37.1 286 105 B V H X S+ 0 0 17 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.900 110.9 50.8 -63.8 -39.6 104.4 76.0 34.6 287 106 B D H X S+ 0 0 66 -4,-2.6 4,-2.4 -5,-0.3 -1,-0.2 0.912 109.7 49.8 -60.3 -44.3 108.0 75.8 35.8 288 107 B H H X S+ 0 0 44 -4,-2.1 4,-2.0 1,-0.2 6,-0.2 0.856 107.0 55.0 -67.5 -34.4 106.9 75.6 39.4 289 108 B A H <>S+ 0 0 0 -4,-2.3 5,-2.3 2,-0.2 4,-0.3 0.908 109.5 47.1 -62.6 -43.4 104.4 72.9 38.6 290 109 B I H ><5S+ 0 0 83 -4,-1.9 3,-1.5 3,-0.2 -2,-0.2 0.952 110.8 52.5 -61.5 -49.5 107.3 70.8 37.1 291 110 B K H 3<5S+ 0 0 150 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.833 115.0 39.9 -57.2 -38.4 109.5 71.4 40.1 292 111 B S T 3<5S- 0 0 54 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.318 112.4-116.6 -96.1 9.7 106.9 70.3 42.6 293 112 B K T < 5 + 0 0 174 -3,-1.5 2,-1.5 -4,-0.3 -3,-0.2 0.737 62.4 150.8 62.6 26.1 105.8 67.3 40.5 294 113 B D >< + 0 0 28 -5,-2.3 4,-2.1 -6,-0.2 -1,-0.2 -0.632 7.9 161.9 -87.4 82.6 102.3 68.9 40.1 295 114 B H H > + 0 0 102 -2,-1.5 4,-2.9 2,-0.2 5,-0.2 0.714 66.4 65.1 -81.6 -18.9 101.4 67.4 36.7 296 115 B A H > S+ 0 0 64 2,-0.2 4,-2.2 -3,-0.2 -1,-0.2 0.909 110.4 40.1 -60.2 -43.6 97.7 67.9 37.1 297 116 B T H > S+ 0 0 0 2,-0.2 4,-2.3 -3,-0.2 -2,-0.2 0.905 114.2 52.6 -74.2 -43.4 98.5 71.7 37.1 298 117 B F H < S+ 0 0 59 -4,-2.1 4,-0.5 1,-0.2 -2,-0.2 0.953 113.8 44.0 -52.6 -53.5 101.1 71.3 34.4 299 118 B N H >< S+ 0 0 121 -4,-2.9 3,-1.3 1,-0.2 4,-0.3 0.921 112.4 52.5 -57.7 -47.6 98.6 69.5 32.2 300 119 B F H >< S+ 0 0 36 -4,-2.2 3,-0.7 1,-0.2 4,-0.3 0.869 103.8 56.9 -57.6 -40.3 95.8 72.0 32.9 301 120 B L T 3X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 3,-0.5 0.552 80.8 90.8 -73.7 -9.0 97.9 75.0 32.0 302 121 B Q H <> S+ 0 0 73 -3,-1.3 4,-2.4 -4,-0.5 -1,-0.2 0.846 83.6 51.2 -61.1 -40.9 98.7 73.8 28.5 303 122 B W H <> S+ 0 0 62 -3,-0.7 4,-2.6 -4,-0.3 -1,-0.3 0.868 112.8 49.6 -58.3 -35.6 95.7 75.5 26.8 304 123 B Y H > S+ 0 0 0 -3,-0.5 4,-2.6 -4,-0.3 5,-0.2 0.899 109.1 50.0 -74.7 -43.7 96.8 78.7 28.6 305 124 B V H X S+ 0 0 43 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.940 115.0 44.7 -55.0 -51.3 100.4 78.4 27.4 306 125 B A H X S+ 0 0 62 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.932 115.2 46.3 -62.6 -49.1 99.2 77.9 23.8 307 126 B E H X S+ 0 0 60 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.887 113.1 49.2 -62.7 -42.6 96.6 80.7 23.8 308 127 B Q H X S+ 0 0 3 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.900 107.8 54.4 -64.1 -42.7 99.0 83.2 25.4 309 128 B H H X S+ 0 0 116 -4,-2.2 4,-2.5 -5,-0.2 5,-0.2 0.941 109.4 48.1 -54.6 -47.7 101.7 82.4 22.9 310 129 B E H X S+ 0 0 113 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.874 112.5 49.5 -59.5 -39.6 99.2 83.1 20.1 311 130 B E H X S+ 0 0 8 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.918 110.5 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0.3 78.3 115.9 -9.0 563 34 D H T < 5S- 0 0 54 -3,-1.2 -1,-0.2 -4,-0.4 -2,-0.2 -0.068 121.6 -98.8-124.8 31.4 81.7 116.1 -7.3 564 35 D S T < 5S+ 0 0 4 -3,-0.7 2,-0.6 1,-0.1 -3,-0.2 0.608 90.4 119.6 66.1 17.2 82.9 112.5 -7.9 565 36 D L >< + 0 0 1 -5,-2.9 4,-2.1 -6,-0.2 -1,-0.1 -0.619 22.2 153.4-111.0 68.5 82.0 111.4 -4.4 566 37 D D H > + 0 0 37 -2,-0.6 4,-2.6 2,-0.2 5,-0.2 0.715 67.5 63.6 -74.0 -20.4 79.5 108.7 -5.3 567 38 D G H > S+ 0 0 0 2,-0.2 4,-2.3 -3,-0.2 -1,-0.2 0.959 112.0 34.9 -62.7 -54.7 80.2 106.8 -2.0 568 39 D A H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.820 114.5 61.4 -66.8 -34.6 78.8 109.7 0.1 569 40 D G H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.956 109.5 39.9 -53.1 -54.0 76.3 110.3 -2.7 570 41 D L H X S+ 0 0 52 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.930 114.5 52.9 -63.6 -48.8 74.8 106.9 -2.2 571 42 D F H X S+ 0 0 6 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.910 113.2 43.1 -52.2 -47.6 75.0 107.0 1.6 572 43 D L H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.820 111.7 53.8 -75.3 -32.6 73.2 110.4 1.8 573 44 D F H X S+ 0 0 16 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.937 112.0 44.8 -61.1 -50.2 70.5 109.4 -0.7 574 45 D D H X S+ 0 0 60 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.896 113.0 51.3 -64.0 -38.3 69.7 106.3 1.3 575 46 D H H X S+ 0 0 11 -4,-2.2 4,-1.9 -5,-0.3 -1,-0.2 0.916 107.9 52.6 -62.7 -41.4 69.8 108.3 4.5 576 47 D A H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.907 108.9 49.9 -60.0 -43.7 67.3 110.8 2.9 577 48 D A H X S+ 0 0 13 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.889 108.8 52.4 -62.9 -41.3 64.9 108.0 2.0 578 49 D E H X S+ 0 0 76 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.849 105.0 55.3 -63.4 -36.4 65.1 106.6 5.5 579 50 D E H X S+ 0 0 0 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.885 107.2 49.9 -65.8 -37.6 64.2 110.1 7.0 580 51 D Y H X S+ 0 0 7 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.871 104.4 58.7 -66.3 -37.2 61.1 110.1 4.8 581 52 D E H X S+ 0 0 57 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.894 104.8 51.0 -55.0 -41.7 60.3 106.6 6.1 582 53 D H H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.906 107.5 52.2 -61.5 -45.0 60.2 108.1 9.6 583 54 D A H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.912 109.8 49.5 -56.7 -44.8 57.9 110.9 8.4 584 55 D K H X S+ 0 0 19 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.885 108.6 52.1 -63.5 -40.5 55.5 108.2 7.0 585 56 D K H X S+ 0 0 85 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.865 110.9 48.3 -64.7 -35.0 55.6 106.2 10.3 586 57 D L H X S+ 0 0 2 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.898 110.0 51.7 -69.4 -41.5 54.7 109.4 12.2 587 58 D I H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.919 106.0 55.2 -58.5 -46.8 51.8 110.1 9.7 588 59 D I H X S+ 0 0 78 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.894 108.2 49.3 -53.5 -43.0 50.5 106.6 10.2 589 60 D F H X S+ 0 0 7 -4,-1.4 4,-1.4 2,-0.2 -1,-0.2 0.889 110.2 49.7 -67.1 -40.2 50.3 107.2 14.0 590 61 D L H <>S+ 0 0 1 -4,-2.0 5,-2.9 1,-0.2 3,-0.4 0.957 111.8 49.7 -60.7 -49.9 48.5 110.5 13.5 591 62 D N H ><5S+ 0 0 5 -4,-3.0 3,-1.7 1,-0.2 -2,-0.2 0.892 108.5 51.4 -52.1 -47.5 46.0 108.8 11.2 592 63 D E H 3<5S+ 0 0 121 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.797 110.6 49.8 -66.9 -28.0 45.3 105.9 13.7 593 64 D N T 3<5S- 0 0 12 -4,-1.4 -63,-3.1 -3,-0.4 -62,-0.4 0.244 116.5-114.1 -89.5 9.8 44.6 108.5 16.4 594 65 D N T < 5 + 0 0 37 -3,-1.7 -3,-0.2 -65,-0.2 -2,-0.1 0.831 66.1 150.7 56.8 35.2 42.2 110.5 14.1 595 66 D V < - 0 0 0 -5,-2.9 -1,-0.2 -6,-0.2 -2,-0.1 -0.871 50.1-119.5-100.7 121.7 44.6 113.4 14.1 596 67 D P - 0 0 51 0, 0.0 2,-0.4 0, 0.0 -56,-0.1 -0.375 25.6-127.5 -56.9 130.4 44.6 115.7 11.0 597 68 D V - 0 0 7 -217,-0.2 2,-0.7 -216,-0.1 -213,-0.1 -0.723 20.8-158.7 -80.4 129.4 48.0 115.7 9.3 598 69 D Q - 0 0 86 -2,-0.4 2,-0.6 -61,-0.1 -54,-0.2 -0.801 7.8-171.3-118.6 86.1 49.1 119.3 8.8 599 70 D L - 0 0 13 -2,-0.7 2,-0.1 -222,-0.1 -58,-0.1 -0.711 8.5-167.3 -84.9 121.0 51.7 119.5 6.1 600 71 D T - 0 0 76 -2,-0.6 2,-0.6 -170,-0.1 -172,-0.0 -0.259 38.7 -64.3 -94.5-177.4 53.3 122.9 5.9 601 72 D S - 0 0 76 -171,-0.1 2,-0.8 -2,-0.1 -172,-0.2 -0.630 44.7-140.8 -77.7 118.5 55.5 124.4 3.2 602 73 D I B -C 428 0C 11 -174,-1.7 -174,-3.2 -2,-0.6 -1,-0.1 -0.702 21.3-136.8 -78.5 108.0 58.9 122.6 2.8 603 74 D S - 0 0 81 -2,-0.8 -176,-0.0 -176,-0.2 -177,-0.0 -0.318 30.6 -91.3 -63.0 148.4 61.5 125.4 2.2 604 75 D A - 0 0 56 1,-0.1 -177,-0.1 -177,-0.0 -178,-0.1 -0.377 46.5-121.9 -61.8 135.0 64.1 124.7 -0.5 605 76 D P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 -180,-0.1 -0.379 34.0 -85.2 -74.7 159.0 67.2 123.0 1.0 606 77 D E - 0 0 87 1,-0.1 -51,-0.1 -2,-0.1 3,-0.0 -0.393 42.0-177.1 -55.0 138.3 70.7 124.5 0.8 607 78 D H + 0 0 109 -3,-0.1 2,-0.5 1,-0.1 -1,-0.1 0.496 56.7 78.6-118.4 -13.8 72.2 123.4 -2.6 608 79 D K + 0 0 140 -49,-0.0 2,-0.3 2,-0.0 -1,-0.1 -0.870 55.7 171.8-105.4 129.5 75.7 124.9 -2.3 609 80 D F - 0 0 21 -2,-0.5 3,-0.1 1,-0.1 -2,-0.0 -0.939 35.4-138.1-136.8 157.5 78.4 123.2 -0.2 610 81 D E S S- 0 0 162 -2,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.782 70.5 -63.4 -83.4 -31.8 82.1 123.7 0.4 611 82 D G > - 0 0 16 1,-0.1 4,-2.4 0, 0.0 -1,-0.3 -0.964 63.7 -55.9 163.2-179.0 83.1 120.0 0.4 612 83 D L H > S+ 0 0 5 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.895 126.3 47.2 -56.1 -50.9 82.8 116.6 2.0 613 84 D T H > S+ 0 0 40 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.928 112.2 50.8 -58.7 -45.9 83.9 117.6 5.5 614 85 D Q H > S+ 0 0 37 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.901 109.5 51.5 -61.3 -42.7 81.6 120.6 5.6 615 86 D I H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.946 113.4 43.3 -56.1 -51.1 78.6 118.5 4.5 616 87 D F H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.820 112.0 53.4 -73.1 -27.2 79.2 115.9 7.2 617 88 D Q H X S+ 0 0 50 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.939 113.3 44.2 -63.2 -48.3 79.8 118.6 9.8 618 89 D K H X S+ 0 0 80 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.894 114.0 50.4 -61.8 -43.2 76.5 120.2 8.8 619 90 D A H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.904 109.6 49.5 -64.9 -44.8 74.8 116.8 8.8 620 91 D Y H X S+ 0 0 3 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.943 111.8 48.5 -60.4 -47.3 76.0 115.8 12.2 621 92 D E H X S+ 0 0 105 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.891 111.8 51.1 -57.3 -41.4 74.9 119.2 13.7 622 93 D H H X S+ 0 0 31 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.895 108.2 50.6 -62.3 -43.8 71.5 118.6 12.0 623 94 D E H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.855 106.9 55.2 -65.3 -35.1 71.2 115.1 13.5 624 95 D Q H X S+ 0 0 75 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.923 108.8 48.3 -59.9 -44.8 71.9 116.6 16.9 625 96 D H H X S+ 0 0 84 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.886 110.8 49.8 -61.0 -44.2 69.0 119.0 16.4 626 97 D I H X S+ 0 0 1 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.921 110.1 51.7 -63.4 -42.8 66.7 116.2 15.3 627 98 D S H X S+ 0 0 11 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.927 109.6 49.6 -57.5 -45.5 67.7 114.2 18.4 628 99 D E H X S+ 0 0 140 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.894 108.6 53.1 -60.0 -42.3 66.9 117.2 20.5 629 100 D S H X S+ 0 0 14 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.869 110.1 47.2 -63.4 -38.7 63.5 117.6 18.9 630 101 D I H X S+ 0 0 3 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.917 109.4 53.0 -69.4 -44.3 62.6 114.0 19.6 631 102 D N H X S+ 0 0 36 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.879 107.1 55.3 -53.8 -40.3 63.7 114.2 23.2 632 103 D N H X S+ 0 0 68 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.872 108.8 44.9 -61.0 -43.3 61.4 117.2 23.5 633 104 D I H X S+ 0 0 1 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.900 113.4 50.3 -69.7 -42.1 58.3 115.3 22.3 634 105 D V H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.911 109.9 51.7 -62.2 -41.6 59.1 112.3 24.5 635 106 D D H X S+ 0 0 14 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.898 110.1 48.4 -60.5 -42.3 59.5 114.7 27.5 636 107 D H H X S+ 0 0 47 -4,-1.8 4,-2.5 2,-0.2 6,-0.3 0.852 107.2 55.8 -68.5 -35.2 56.1 116.3 26.8 637 108 D A H <>S+ 0 0 0 -4,-2.2 5,-2.7 2,-0.2 4,-0.2 0.906 110.8 45.3 -60.8 -43.5 54.5 112.8 26.5 638 109 D I H ><5S+ 0 0 39 -4,-1.9 3,-1.1 3,-0.2 -2,-0.2 0.937 113.2 50.3 -62.1 -48.7 55.8 112.0 30.0 639 110 D K H 3<5S+ 0 0 138 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.879 116.1 39.7 -61.2 -41.9 54.7 115.4 31.4 640 111 D S T 3<5S- 0 0 51 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.333 112.9-117.0 -92.2 7.2 51.1 115.2 30.0 641 112 D K T < 5 + 0 0 162 -3,-1.1 2,-1.4 -4,-0.2 -3,-0.2 0.758 61.3 151.8 64.4 29.7 50.9 111.5 30.9 642 113 D D >< + 0 0 26 -5,-2.7 4,-2.2 -6,-0.3 -1,-0.2 -0.667 6.4 161.2 -89.7 82.6 50.5 110.4 27.2 643 114 D H H > + 0 0 103 -2,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.704 67.4 64.6 -84.4 -16.8 52.1 107.0 27.6 644 115 D A H > S+ 0 0 66 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.953 111.5 38.8 -58.6 -49.2 50.5 105.7 24.3 645 116 D T H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.894 114.1 53.5 -69.6 -44.7 52.7 108.3 22.5 646 117 D F H < S+ 0 0 25 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.946 113.5 44.4 -51.0 -52.7 55.7 107.8 24.8 647 118 D N H >< S+ 0 0 121 -4,-2.4 3,-1.2 1,-0.2 4,-0.3 0.891 111.3 52.7 -60.7 -44.4 55.6 104.0 24.0 648 119 D F H >< S+ 0 0 42 -4,-2.3 3,-0.7 1,-0.2 4,-0.3 0.876 104.6 56.8 -59.6 -40.3 55.0 104.6 20.3 649 120 D L T 3X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 3,-0.4 0.499 79.4 91.5 -73.4 -5.5 58.1 106.8 20.0 650 121 D Q H <> S+ 0 0 30 -3,-1.2 4,-2.4 -4,-0.3 -1,-0.2 0.878 84.3 51.5 -63.3 -37.9 60.6 104.3 21.4 651 122 D W H <> S+ 0 0 61 -3,-0.7 4,-2.7 -4,-0.3 -1,-0.2 0.864 112.1 50.1 -59.3 -34.4 61.5 102.8 17.9 652 123 D Y H > S+ 0 0 0 -3,-0.4 4,-2.6 -4,-0.3 -2,-0.2 0.897 109.0 48.6 -77.7 -43.9 62.1 106.4 16.8 653 124 D V H X S+ 0 0 6 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.936 115.4 46.3 -55.1 -50.1 64.3 107.3 19.8 654 125 D A H X S+ 0 0 35 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.938 115.1 44.6 -61.7 -49.9 66.4 104.1 19.2 655 126 D E H X S+ 0 0 51 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.905 113.9 50.0 -64.6 -40.7 66.7 104.6 15.4 656 127 D Q H X S+ 0 0 3 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.901 108.3 52.7 -65.6 -41.3 67.6 108.3 15.7 657 128 D H H X S+ 0 0 21 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.915 109.7 50.2 -57.3 -41.9 70.3 107.6 18.4 658 129 D E H X S+ 0 0 109 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.892 112.0 46.9 -63.1 -40.6 71.7 105.0 15.9 659 130 D E H X S+ 0 0 5 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.897 110.9 51.0 -69.4 -42.1 71.7 107.6 13.1 660 131 D E H X S+ 0 0 26 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.906 111.7 47.7 -61.1 -44.5 73.3 110.3 15.2 661 132 D V H X S+ 0 0 15 -4,-2.3 4,-2.6 -5,-0.2 -1,-0.2 0.893 109.4 55.4 -60.0 -41.9 76.1 107.9 16.3 662 133 D L H X S+ 0 0 17 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.918 108.5 46.0 -59.1 -46.7 76.5 107.0 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0.920 113.6 43.6 -52.0 -47.1 74.8 79.2 40.3 745 43 E L H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.812 111.8 52.5 -74.7 -34.4 76.9 82.1 41.8 746 44 E F H X S+ 0 0 19 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.2 0.938 111.6 46.5 -61.8 -49.5 79.8 81.7 39.3 747 45 E D H X S+ 0 0 46 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.890 112.8 50.0 -64.0 -37.6 77.4 81.9 36.3 748 46 E H H X S+ 0 0 8 -4,-2.0 4,-2.0 -5,-0.3 -1,-0.2 0.893 108.3 52.8 -66.5 -40.5 75.7 84.9 37.9 749 47 E A H X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.921 108.1 51.0 -56.4 -48.1 79.1 86.6 38.4 750 48 E A H X S+ 0 0 15 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.875 109.1 52.0 -55.7 -40.4 79.8 86.0 34.7 751 49 E E H X S+ 0 0 65 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.856 104.8 54.5 -67.4 -38.7 76.5 87.6 33.8 752 50 E E H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.890 107.5 51.3 -62.1 -37.9 77.2 90.7 36.0 753 51 E Y H X S+ 0 0 6 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.879 103.8 57.7 -67.5 -37.3 80.4 91.2 34.0 754 52 E E H X S+ 0 0 58 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.882 104.7 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L H X S+ 0 0 19 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.927 109.4 45.8 -56.5 -49.5 65.5 85.4 41.2 836 134 E F H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.840 110.6 53.3 -66.9 -33.7 67.5 86.1 44.3 837 135 E K H X S+ 0 0 71 -4,-1.9 4,-2.6 -5,-0.2 -1,-0.2 0.929 110.7 48.9 -59.9 -46.6 64.3 86.8 46.3 838 136 E D H X S+ 0 0 68 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.861 112.0 46.4 -63.9 -40.2 63.0 83.3 45.1 839 137 E I H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.919 113.3 48.8 -70.1 -43.3 66.2 81.4 46.1 840 138 E L H X S+ 0 0 7 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.925 110.2 52.1 -60.6 -47.0 66.4 83.1 49.5 841 139 E D H X S+ 0 0 93 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.882 112.8 45.5 -52.4 -42.8 62.7 82.3 50.1 842 140 E K H X S+ 0 0 75 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.905 111.0 51.2 -72.8 -41.1 63.5 78.6 49.2 843 141 E I H X S+ 0 0 5 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.915 113.3 46.0 -59.9 -43.5 66.6 78.4 51.4 844 142 E E H < S+ 0 0 111 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.804 111.4 52.7 -71.6 -28.3 64.7 79.8 54.3 845 143 E L 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-1,-0.2 0.866 109.6 48.3 -66.2 -37.9 99.9 79.3 -40.4 976 101 F I H X S+ 0 0 2 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.935 108.9 53.8 -64.9 -47.1 99.5 77.7 -37.0 977 102 F N H X S+ 0 0 100 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.882 106.8 53.0 -51.9 -43.3 101.9 74.9 -38.0 978 103 F N H X S+ 0 0 86 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.886 110.0 47.0 -60.5 -42.8 104.5 77.6 -38.8 979 104 F I H X S+ 0 0 2 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.937 113.6 47.5 -66.8 -45.6 104.2 79.2 -35.4 980 105 F V H X S+ 0 0 18 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.904 112.2 50.7 -61.5 -42.9 104.4 75.9 -33.6 981 106 F D H X S+ 0 0 67 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.919 110.5 49.0 -59.8 -44.0 107.5 75.0 -35.7 982 107 F H H X S+ 0 0 47 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.887 108.1 53.7 -64.1 -40.8 109.1 78.3 -34.9 983 108 F A H <>S+ 0 0 0 -4,-2.5 5,-2.7 2,-0.2 4,-0.5 0.910 110.2 48.1 -55.9 -47.0 108.4 77.8 -31.1 984 109 F I H ><5S+ 0 0 85 -4,-2.1 3,-1.0 3,-0.2 -2,-0.2 0.940 112.0 49.0 -58.9 -49.2 110.2 74.4 -31.4 985 110 F K H 3<5S+ 0 0 151 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.819 116.0 41.9 -63.6 -33.9 113.2 75.9 -33.2 986 111 F S T 3<5S- 0 0 50 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.384 111.9-118.6 -95.3 2.9 113.6 78.8 -30.8 987 112 F K T < 5 + 0 0 174 -3,-1.0 2,-1.2 -4,-0.5 -3,-0.2 0.793 61.3 150.3 66.3 31.0 113.0 76.5 -27.7 988 113 F D >< + 0 0 27 -5,-2.7 4,-2.0 -6,-0.2 -1,-0.2 -0.703 7.9 161.6 -94.6 84.2 109.9 78.5 -26.6 989 114 F H H > + 0 0 107 -2,-1.2 4,-2.5 2,-0.2 5,-0.2 0.673 66.9 66.3 -86.6 -13.7 108.0 75.7 -25.0 990 115 F A H > S+ 0 0 64 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.925 110.4 38.7 -62.1 -45.8 105.7 78.0 -23.0 991 116 F T H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.893 114.7 53.5 -72.0 -43.4 104.3 79.1 -26.4 992 117 F F H < S+ 0 0 60 -4,-2.0 4,-0.4 2,-0.2 -2,-0.2 0.956 113.5 43.2 -51.1 -55.1 104.4 75.5 -27.8 993 118 F N H >< S+ 0 0 120 -4,-2.5 3,-1.3 1,-0.2 4,-0.3 0.907 112.5 53.1 -60.4 -45.6 102.4 74.2 -24.9 994 119 F F H >< S+ 0 0 40 -4,-2.1 3,-0.8 1,-0.2 4,-0.4 0.878 103.7 57.2 -55.6 -41.1 100.0 77.2 -24.9 995 120 F L T 3X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 3,-0.4 0.539 79.8 91.4 -74.4 -5.6 99.2 76.7 -28.6 996 121 F Q H <> S+ 0 0 75 -3,-1.3 4,-2.3 -4,-0.4 -1,-0.2 0.858 83.6 51.5 -63.3 -37.8 98.0 73.1 -28.2 997 122 F W H <> S+ 0 0 60 -3,-0.8 4,-2.7 -4,-0.3 -1,-0.3 0.888 112.7 49.3 -60.5 -35.9 94.3 73.9 -27.6 998 123 F Y H > S+ 0 0 0 -3,-0.4 4,-2.3 -4,-0.4 -2,-0.2 0.864 108.8 49.9 -75.9 -41.2 94.6 76.0 -30.8 999 124 F V H X S+ 0 0 43 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.937 114.9 45.5 -57.7 -49.3 96.2 73.2 -32.9 1000 125 F A H X S+ 0 0 60 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.951 114.9 45.3 -62.9 -52.8 93.4 70.8 -31.7 1001 126 F E H X S+ 0 0 61 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.897 113.1 50.9 -60.8 -39.9 90.5 73.1 -32.3 1002 127 F Q H X S+ 0 0 3 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.904 107.7 52.8 -66.5 -38.9 91.8 74.2 -35.7 1003 128 F H H X S+ 0 0 118 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.923 110.0 48.8 -59.6 -42.7 92.2 70.6 -36.8 1004 129 F E H X S+ 0 0 112 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.891 112.4 48.5 -61.7 -42.7 88.6 70.0 -35.8 1005 130 F E H X S+ 0 0 5 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.904 111.2 49.1 -64.6 -44.8 87.5 73.1 -37.7 1006 131 F E H X S+ 0 0 42 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.928 112.4 48.0 -60.2 -47.7 89.4 72.1 -40.9 1007 132 F V H X S+ 0 0 46 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.916 109.1 55.5 -57.1 -45.3 88.0 68.5 -40.8 1008 133 F L H X S+ 0 0 19 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.906 108.9 45.2 -54.8 -48.0 84.5 70.1 -40.3 1009 134 F F H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.848 110.9 54.3 -68.0 -33.9 84.8 72.2 -43.5 1010 135 F K H X S+ 0 0 72 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.944 110.8 46.8 -58.9 -48.4 86.2 69.2 -45.4 1011 136 F D H X S+ 0 0 66 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.879 113.0 47.1 -63.7 -43.6 83.1 67.2 -44.3 1012 137 F I H X S+ 0 0 1 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.923 112.8 49.1 -65.0 -45.0 80.6 69.9 -45.2 1013 138 F L H X S+ 0 0 5 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.938 111.0 50.9 -57.9 -48.0 82.3 70.5 -48.6 1014 139 F D H X S+ 0 0 81 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.884 112.2 47.6 -53.7 -43.2 82.2 66.7 -49.2 1015 140 F K H X S+ 0 0 67 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.913 111.4 48.5 -69.4 -43.7 78.5 66.7 -48.4 1016 141 F I H X S+ 0 0 5 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.906 112.9 49.2 -61.0 -43.9 77.6 69.6 -50.6 1017 142 F E H < S+ 0 0 100 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.893 112.4 48.6 -59.9 -42.9 79.6 68.0 -53.5 1018 143 F L H < S+ 0 0 131 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.872 114.8 44.1 -66.9 -40.9 77.7 64.7 -52.9 1019 144 F I H < S- 0 0 54 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.949 95.0-166.2 -70.2 -50.6 74.2 66.3 -52.8 1020 145 F G < - 0 0 29 -4,-2.6 9,-0.2 -5,-0.2 -1,-0.1 -0.237 31.7 -85.8 86.3-179.9 74.7 68.6 -55.8 1021 146 F N S >S+ 0 0 115 4,-0.2 5,-0.7 -4,-0.1 4,-0.3 0.679 87.3 103.8-101.1 -25.3 72.7 71.6 -57.0 1022 147 F E T > 5S- 0 0 156 3,-0.2 3,-1.4 1,-0.2 0, 0.0 -0.195 86.4 -9.1 -66.1 156.3 70.0 70.0 -59.1 1023 148 F N T 3 5S- 0 0 137 1,-0.2 -1,-0.2 2,-0.1 0, 0.0 0.744 138.2 -19.5 8.4 105.8 66.4 69.5 -57.8 1024 149 F H T 3>5S+ 0 0 144 -3,-0.2 4,-3.1 1,-0.1 -1,-0.2 0.452 99.7 127.4 62.6 1.5 66.2 70.5 -54.1 1025 150 F G H <>5S+ 0 0 2 -3,-1.4 4,-2.8 -4,-0.3 5,-0.2 0.913 72.5 47.1 -50.1 -52.7 69.9 70.0 -53.9 1026 151 F L H > S+ 0 0 144 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.944 112.9 47.0 -58.2 -50.3 67.6 72.9 -49.9 1028 153 F L H X S+ 0 0 96 -4,-3.1 4,-2.0 1,-0.2 -2,-0.2 0.918 114.2 46.7 -58.3 -48.1 69.0 69.5 -48.9 1029 154 F A H X S+ 0 0 3 -4,-2.8 4,-2.0 -9,-0.2 -1,-0.2 0.898 112.9 49.4 -61.9 -43.0 72.5 70.9 -48.4 1030 155 F D H X S+ 0 0 4 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.883 110.4 49.8 -67.1 -37.1 71.4 73.9 -46.5 1031 156 F Q H X S+ 0 0 71 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.858 109.5 52.4 -67.9 -36.0 69.2 71.8 -44.1 1032 157 F Y H X S+ 0 0 100 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.897 111.6 45.6 -62.5 -44.0 72.2 69.5 -43.5 1033 158 F V H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.848 109.0 56.5 -68.8 -36.3 74.4 72.5 -42.6 1034 159 F K H X S+ 0 0 36 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.892 104.7 53.3 -59.8 -41.8 71.5 73.8 -40.4 1035 160 F G H X S+ 0 0 43 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.918 110.4 46.3 -59.6 -45.0 71.6 70.5 -38.5 1036 161 F I H X S+ 0 0 26 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.941 109.3 54.6 -62.2 -50.0 75.3 70.9 -37.9 1037 162 F A H X S+ 0 0 3 -4,-2.7 4,-0.8 1,-0.2 -1,-0.2 0.890 112.9 42.8 -51.4 -45.4 75.0 74.5 -36.8 1038 163 F K H X S+ 0 0 120 -4,-2.1 4,-1.8 1,-0.2 3,-0.3 0.848 110.9 54.5 -74.0 -34.4 72.4 73.6 -34.2 1039 164 F S H < S+ 0 0 75 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.757 105.6 54.5 -68.9 -26.0 74.3 70.5 -32.9 1040 165 F R H < S+ 0 0 115 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.687 105.3 52.0 -85.2 -21.4 77.4 72.6 -32.3 1041 166 F K H < 0 0 124 -4,-0.8 -2,-0.2 -3,-0.3 -3,-0.1 0.965 360.0 360.0 -67.7 -63.4 75.6 75.1 -30.1 1042 167 F S < 0 0 145 -4,-1.8 -4,-0.0 0, 0.0 -3,-0.0 0.013 360.0 360.0-156.4 360.0 74.2 72.2 -28.0