==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 27-MAR-13 4JX2 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: LEGIONELLA PNEUMOPHILA SUBSP. PNEUMOPH . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 801 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32072.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 558 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 34 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.0 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 . 46 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 110 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 302 37.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 2.9 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 0 0 2 7 0 1 2 0 6 2 0 0 0 0 0 2 0 0 2 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 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 0 0 PARALLEL BRIDGES PER LADDER . 4 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 50 A N 0 0 139 0, 0.0 537,-0.0 0, 0.0 539,-0.0 0.000 360.0 360.0 360.0 135.6 91.1 -15.5 35.1 2 51 A T + 0 0 139 2,-0.1 0, 0.0 478,-0.0 0, 0.0 0.332 360.0 139.4 -94.6 2.9 89.1 -18.7 35.5 3 52 A Y - 0 0 17 535,-0.2 2,-0.4 477,-0.0 532,-0.0 -0.153 32.3-168.7 -53.8 138.4 92.0 -20.4 37.5 4 53 A V - 0 0 115 476,-0.1 476,-0.1 531,-0.0 3,-0.1 -0.998 27.3-116.6-133.2 125.1 91.0 -22.5 40.5 5 54 A T - 0 0 10 -2,-0.4 5,-0.1 474,-0.4 475,-0.0 -0.458 45.2-103.7 -58.1 123.8 93.5 -23.8 43.1 6 55 A P >> - 0 0 22 0, 0.0 4,-1.2 0, 0.0 3,-0.9 -0.228 23.2-125.0 -52.4 138.8 93.4 -27.7 42.8 7 56 A Q H 3> S+ 0 0 123 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.837 108.6 64.7 -55.5 -38.1 91.4 -29.3 45.7 8 57 A A H 3> S+ 0 0 12 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.882 101.8 50.9 -54.1 -39.1 94.4 -31.5 46.7 9 58 A F H <> S+ 0 0 0 -3,-0.9 4,-2.7 2,-0.2 -1,-0.2 0.898 110.2 47.6 -67.6 -41.1 96.3 -28.2 47.6 10 59 A W H X S+ 0 0 83 -4,-1.2 4,-2.9 2,-0.2 -2,-0.2 0.938 110.5 52.6 -63.9 -44.3 93.5 -26.9 49.8 11 60 A N H X S+ 0 0 61 -4,-2.8 4,-0.7 1,-0.2 -2,-0.2 0.928 113.2 43.7 -55.6 -47.4 93.2 -30.3 51.5 12 61 A L H >X S+ 0 0 4 -4,-2.2 3,-0.7 508,-0.2 4,-0.5 0.892 113.5 52.2 -64.4 -42.9 97.0 -30.2 52.3 13 62 A Y H >X S+ 0 0 34 -4,-2.7 4,-1.9 1,-0.2 3,-1.3 0.943 109.6 47.6 -57.7 -51.2 96.7 -26.5 53.3 14 63 A F H 3< S+ 0 0 17 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.557 94.7 77.5 -71.6 -9.8 93.9 -27.2 55.8 15 64 A D H << S+ 0 0 1 -3,-0.7 16,-2.5 -4,-0.7 -1,-0.3 0.767 113.5 18.1 -69.6 -27.5 95.8 -30.2 57.3 16 65 A F H << S- 0 0 16 -3,-1.3 16,-1.4 -4,-0.5 -2,-0.2 0.789 130.0 -2.1-111.2 -47.9 98.0 -27.8 59.2 17 66 A T S < S+ 0 0 37 -4,-1.9 -1,-0.2 14,-0.1 14,-0.1 -0.562 77.1 86.7-134.5-168.0 96.4 -24.3 59.4 18 67 A G > + 0 0 4 -2,-0.2 3,-1.0 6,-0.1 6,-0.3 0.399 48.6 131.8 90.4 2.8 93.4 -22.2 58.4 19 68 A D T 3 S+ 0 0 44 1,-0.3 4,-0.1 -3,-0.1 -2,-0.0 0.658 78.8 42.3 -60.9 -20.7 91.1 -23.2 61.4 20 69 A E T 3 S+ 0 0 158 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.582 97.5 95.9 -98.1 -17.2 90.2 -19.5 62.0 21 70 A T S X S- 0 0 70 -3,-1.0 3,-1.7 1,-0.1 2,-0.2 -0.531 83.3-111.8 -77.3 137.7 89.8 -18.5 58.3 22 71 A P T 3 S+ 0 0 128 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.522 106.7 45.9 -69.3 134.4 86.3 -18.5 56.7 23 72 A G T 3 S+ 0 0 66 1,-0.4 3,-0.1 -2,-0.2 -4,-0.1 0.096 76.7 139.3 114.6 -14.8 86.3 -21.4 54.1 24 73 A Y < - 0 0 31 -3,-1.7 -1,-0.4 -6,-0.3 2,-0.2 -0.366 65.2 -99.0 -59.1 132.6 87.8 -23.8 56.6 25 74 A P > - 0 0 50 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.389 36.6-113.3 -63.8 131.4 86.1 -27.2 56.2 26 75 A K T 3 S+ 0 0 212 1,-0.2 0, 0.0 -2,-0.2 0, 0.0 -0.425 98.5 19.4 -62.3 129.6 83.4 -27.9 58.8 27 76 A G T 3 S+ 0 0 77 1,-0.3 -1,-0.2 -2,-0.1 2,-0.2 0.172 89.9 134.0 94.2 -11.0 84.3 -30.8 61.1 28 77 A K < - 0 0 52 -3,-1.5 2,-0.5 -9,-0.0 -1,-0.3 -0.479 39.6-162.7 -75.9 142.0 88.1 -30.8 60.5 29 78 A I - 0 0 101 -2,-0.2 2,-0.1 4,-0.0 -1,-0.0 -0.979 20.4-162.1-119.7 105.9 90.6 -31.0 63.3 30 79 A N > - 0 0 0 -2,-0.5 4,-2.0 -14,-0.1 -14,-0.2 -0.237 34.5 -96.2 -84.2 178.3 94.0 -29.8 61.8 31 80 A I H > S+ 0 0 0 -16,-2.5 4,-2.6 2,-0.2 5,-0.2 0.903 123.4 54.2 -65.3 -39.9 97.5 -30.4 63.2 32 81 A S H > S+ 0 0 23 -16,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.917 110.0 47.9 -58.7 -44.7 97.6 -26.9 65.0 33 82 A Q H > S+ 0 0 59 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.876 110.3 51.2 -63.9 -41.9 94.3 -27.8 66.8 34 83 A T H X S+ 0 0 5 -4,-2.0 4,-3.2 2,-0.2 5,-0.2 0.925 110.6 49.1 -62.0 -45.7 95.6 -31.2 67.9 35 84 A L H X S+ 0 0 9 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.935 113.1 47.5 -57.6 -46.9 98.8 -29.6 69.3 36 85 A F H X S+ 0 0 106 -4,-2.4 4,-1.0 2,-0.2 3,-0.3 0.953 115.1 45.2 -57.9 -52.3 96.5 -27.1 71.1 37 86 A Q H >X S+ 0 0 39 -4,-3.2 4,-0.9 1,-0.2 3,-0.7 0.891 114.3 48.2 -57.5 -49.1 94.3 -30.0 72.4 38 87 A S H 3X S+ 0 0 1 -4,-3.2 4,-1.0 1,-0.2 -1,-0.2 0.763 108.6 54.5 -63.1 -33.9 97.3 -32.2 73.5 39 88 A E H 3< S+ 0 0 33 -4,-1.9 -1,-0.2 -3,-0.3 -2,-0.2 0.708 102.7 57.9 -73.4 -25.9 99.0 -29.3 75.3 40 89 A X H << S+ 0 0 133 -4,-1.0 -1,-0.2 -3,-0.7 -2,-0.2 0.774 101.0 54.4 -75.5 -31.7 95.8 -28.7 77.4 41 90 A K H < 0 0 152 -4,-0.9 -2,-0.2 -3,-0.1 -1,-0.2 0.872 360.0 360.0 -67.0 -37.2 96.0 -32.3 78.7 42 91 A K < 0 0 133 -4,-1.0 463,-0.0 0, 0.0 -3,-0.0 -0.411 360.0 360.0 -67.6 360.0 99.6 -31.5 79.8 43 ! 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 44 96 A A 0 0 60 0, 0.0 2,-0.4 0, 0.0 -8,-0.0 0.000 360.0 360.0 360.0-165.4 99.6 -22.7 76.9 45 97 A Q - 0 0 32 250,-0.0 2,-0.1 2,-0.0 254,-0.0 -0.947 360.0-159.3-115.0 135.2 97.6 -19.8 78.5 46 98 A Q - 0 0 64 -2,-0.4 253,-0.0 2,-0.2 0, 0.0 -0.325 29.9-107.7-102.8-177.9 94.9 -20.2 81.4 47 99 A N S S+ 0 0 67 -2,-0.1 -1,-0.0 248,-0.0 247,-0.0 0.703 86.6 94.1 -84.3 -27.1 91.9 -18.2 82.8 48 100 A E + 0 0 109 180,-0.0 -2,-0.2 2,-0.0 2,-0.1 -0.222 57.8 61.2 -69.4 158.3 93.6 -17.1 86.1 49 101 A G S S- 0 0 7 2,-0.0 2,-0.2 179,-0.0 179,-0.2 0.033 81.5 -80.6 101.6 151.2 95.5 -13.7 86.5 50 102 A Q - 0 0 29 174,-0.3 179,-2.5 13,-0.1 2,-0.6 -0.554 32.0-127.9 -88.6 147.4 94.4 -10.1 86.2 51 103 A L E -Ab 62 229A 0 11,-2.9 11,-1.9 -2,-0.2 2,-0.7 -0.869 19.7-166.9 -94.7 114.9 94.0 -8.1 83.0 52 104 A I E -Ab 61 230A 1 177,-3.1 179,-2.7 -2,-0.6 2,-0.5 -0.944 13.4-174.2-107.7 105.8 95.9 -4.8 83.1 53 105 A L E -Ab 60 231A 0 7,-3.4 7,-2.8 -2,-0.7 2,-1.0 -0.918 21.1-173.4-115.1 110.3 94.7 -2.7 80.2 54 106 A F E +Ab 59 232A 0 177,-2.8 179,-3.4 -2,-0.5 2,-0.5 -0.847 24.9 170.6 -96.1 92.0 96.2 0.6 79.1 55 107 A I E > -Ab 58 233A 1 3,-2.3 3,-1.6 -2,-1.0 2,-0.8 -0.968 58.3 -42.8-118.2 118.0 93.6 1.6 76.5 56 108 A N E 3 S- b 0 234A 62 177,-2.8 179,-2.0 -2,-0.5 181,-0.1 -0.606 125.1 -25.7 67.1 -98.0 93.7 5.1 75.0 57 109 A S T 3 S+ 0 0 26 -2,-0.8 17,-3.4 177,-0.2 18,-0.6 0.491 121.9 83.4-117.2 -10.6 94.2 7.3 78.1 58 110 A T E < -AC 55 73A 19 -3,-1.6 -3,-2.3 15,-0.3 2,-0.5 -0.736 63.7-141.6-104.3 145.8 92.7 5.0 80.8 59 111 A L E -AC 54 72A 0 13,-3.7 13,-2.6 -2,-0.3 2,-0.4 -0.907 22.2-171.8 -96.8 126.3 94.1 2.1 82.8 60 112 A Y E -AC 53 71A 31 -7,-2.8 -7,-3.4 -2,-0.5 2,-0.5 -0.983 7.7-166.5-119.9 132.2 91.5 -0.7 83.4 61 113 A I E +AC 52 70A 0 9,-2.6 8,-3.3 -2,-0.4 9,-1.4 -0.988 10.4 179.4-118.4 125.2 92.1 -3.7 85.7 62 114 A Y E -AC 51 68A 0 -11,-1.9 -11,-2.9 -2,-0.5 6,-0.2 -0.971 16.7-140.6-123.0 137.7 89.7 -6.7 85.5 63 115 A N > - 0 0 33 4,-2.2 3,-1.8 -2,-0.4 -13,-0.1 -0.282 38.4 -89.5 -88.3 179.7 89.9 -9.9 87.5 64 116 A S T 3 S+ 0 0 53 1,-0.3 -1,-0.1 2,-0.1 -14,-0.0 0.766 127.1 61.8 -58.5 -30.4 89.2 -13.6 86.3 65 117 A D T 3 S- 0 0 117 2,-0.1 -1,-0.3 1,-0.1 -2,-0.0 0.221 118.6-113.0 -84.3 13.8 85.5 -13.1 87.2 66 118 A R S < S+ 0 0 47 -3,-1.8 219,-2.6 1,-0.2 2,-0.3 0.581 70.7 143.8 64.7 16.7 85.4 -10.2 84.5 67 119 A Q B -E 284 0B 62 217,-0.2 -4,-2.2 1,-0.1 2,-0.3 -0.698 55.8-114.8 -91.5 137.1 84.8 -7.6 87.4 68 120 A L E +C 62 0A 23 215,-3.0 -6,-0.2 -2,-0.3 3,-0.1 -0.534 36.4 169.4 -70.0 122.6 86.3 -4.1 87.2 69 121 A K E + 0 0 109 -8,-3.3 2,-0.3 1,-0.4 -7,-0.2 0.725 67.5 9.5-104.4 -31.2 88.9 -3.6 90.0 70 122 A L E -C 61 0A 8 -9,-1.4 -9,-2.6 2,-0.0 -1,-0.4 -0.986 50.0-179.3-154.2 141.7 90.4 -0.3 88.9 71 123 A K E +C 60 0A 108 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.932 24.0 159.7-142.2 109.7 89.6 2.5 86.2 72 124 A Q E -C 59 0A 26 -13,-2.6 -13,-3.7 -2,-0.3 2,-0.4 -0.992 39.0-126.1-140.0 136.0 92.1 5.4 86.2 73 125 A L E -C 58 0A 53 -2,-0.3 -15,-0.3 -15,-0.3 4,-0.2 -0.633 13.9-166.9 -79.0 124.4 93.1 8.1 83.6 74 126 A X S S+ 0 0 4 -17,-3.4 2,-0.3 -2,-0.4 -16,-0.1 0.529 79.8 12.5 -87.8 -9.9 96.9 8.1 83.0 75 127 A R S S+ 0 0 49 -18,-0.6 -1,-0.2 135,-0.1 162,-0.0 -0.928 123.1 29.5-161.4 149.7 96.6 11.5 81.2 76 128 A T + 0 0 52 -2,-0.3 -2,-0.1 1,-0.2 -19,-0.0 0.755 69.2 170.1 63.8 32.4 93.8 14.1 80.9 77 129 A A > - 0 0 18 -4,-0.2 3,-0.8 1,-0.1 5,-0.4 -0.594 43.1-107.0 -69.8 122.2 92.3 13.2 84.3 78 130 A P T 3 S- 0 0 85 0, 0.0 -1,-0.1 0, 0.0 -5,-0.1 -0.315 91.6 -5.4 -57.7 138.3 89.7 16.0 85.0 79 131 A N T 3 S+ 0 0 54 1,-0.1 60,-0.5 59,-0.0 328,-0.1 0.836 96.9 120.6 47.0 53.9 90.7 18.6 87.7 80 132 A S S < S- 0 0 19 -3,-0.8 -1,-0.1 58,-0.1 -3,-0.0 0.363 91.4 -95.6-122.5 -1.9 94.0 16.7 88.6 81 133 A G S > S+ 0 0 1 -4,-0.1 4,-2.5 128,-0.0 5,-0.2 0.247 101.1 107.4 96.6 -7.1 96.6 19.4 87.8 82 134 A F H > S+ 0 0 23 -5,-0.4 4,-3.2 2,-0.2 5,-0.2 0.957 81.9 38.8 -65.1 -58.0 97.2 17.8 84.3 83 135 A T H > S+ 0 0 5 -6,-0.3 4,-2.7 2,-0.2 5,-0.2 0.936 118.7 51.0 -58.2 -49.0 95.5 20.6 82.2 84 136 A E H > S+ 0 0 1 1,-0.2 4,-1.1 2,-0.2 -2,-0.2 0.917 118.0 36.3 -53.6 -55.2 97.0 23.3 84.6 85 137 A X H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.859 117.2 51.2 -70.0 -41.7 100.6 21.9 84.3 86 138 A T H X S+ 0 0 11 -4,-3.2 4,-2.2 -5,-0.2 -2,-0.2 0.880 104.4 59.0 -65.6 -39.5 100.4 20.9 80.6 87 139 A A H < S+ 0 0 2 -4,-2.7 -1,-0.2 -5,-0.2 4,-0.2 0.865 110.0 42.7 -55.9 -42.3 99.1 24.4 79.6 88 140 A I H >< S+ 0 0 0 -4,-1.1 3,-1.3 -5,-0.2 4,-0.4 0.911 113.2 52.4 -71.4 -43.2 102.3 25.9 81.1 89 141 A S H >< S+ 0 0 0 -4,-1.9 3,-0.7 1,-0.3 -2,-0.2 0.808 104.7 57.8 -57.8 -39.1 104.6 23.2 79.5 90 142 A H T 3X S+ 0 0 27 -4,-2.2 4,-2.6 1,-0.2 -1,-0.3 0.458 80.3 85.7 -77.1 -5.1 103.0 23.8 76.0 91 143 A I H <> S+ 0 0 1 -3,-1.3 4,-2.4 -4,-0.2 -1,-0.2 0.913 90.5 51.7 -63.9 -41.9 104.0 27.5 76.0 92 144 A G H <> S+ 0 0 0 -3,-0.7 4,-2.2 -4,-0.4 3,-0.2 0.975 113.1 41.0 -57.9 -61.8 107.4 26.5 74.5 93 145 A P H > S+ 0 0 4 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.867 113.2 56.5 -57.1 -38.1 106.1 24.3 71.7 94 146 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.928 109.7 44.4 -56.2 -48.4 103.3 26.9 71.0 95 147 A L H X S+ 0 0 0 -4,-2.4 4,-1.9 -3,-0.2 -1,-0.2 0.868 111.8 53.2 -65.9 -37.6 106.0 29.7 70.5 96 148 A X H X S+ 0 0 1 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.918 110.1 48.2 -60.4 -45.3 108.1 27.3 68.3 97 149 A Y H X S+ 0 0 5 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.874 108.6 53.9 -62.5 -41.0 105.0 26.6 66.1 98 150 A L H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.870 105.3 53.7 -64.1 -37.1 104.4 30.4 65.9 99 151 A A H X S+ 0 0 2 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.871 111.2 46.0 -63.4 -39.7 108.0 30.9 64.6 100 152 A K H X S+ 0 0 8 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.913 109.8 53.3 -69.4 -43.6 107.3 28.3 61.8 101 153 A I H <>S+ 0 0 0 -4,-2.4 5,-2.3 1,-0.2 -2,-0.2 0.901 111.3 48.1 -56.2 -42.3 103.9 30.0 61.0 102 154 A K H ><5S+ 0 0 82 -4,-2.2 3,-2.1 3,-0.2 -2,-0.2 0.941 109.2 51.7 -63.2 -49.4 105.8 33.3 60.6 103 155 A E H 3<5S+ 0 0 114 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.870 105.8 55.7 -54.9 -40.9 108.6 31.6 58.4 104 156 A N T 3<5S- 0 0 20 -4,-2.4 -1,-0.3 2,-0.1 -2,-0.2 0.385 120.7-112.5 -73.5 2.4 105.8 30.2 56.1 105 157 A G T < 5 + 0 0 68 -3,-2.1 2,-0.7 1,-0.2 -3,-0.2 0.777 66.9 147.2 69.2 31.5 104.5 33.8 55.7 106 158 A D > < - 0 0 34 -5,-2.3 3,-1.2 -6,-0.1 -1,-0.2 -0.901 36.8-160.2-102.9 113.7 101.2 33.4 57.5 107 159 A A T >> S+ 0 0 73 -2,-0.7 3,-1.6 1,-0.3 4,-0.6 0.558 77.0 89.2 -66.7 -13.2 100.3 36.6 59.4 108 160 A S H 3> + 0 0 47 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.573 69.0 78.8 -64.4 -9.4 97.9 34.6 61.7 109 161 A W H <> S+ 0 0 24 -3,-1.2 4,-2.2 1,-0.2 -1,-0.3 0.833 90.6 52.7 -66.3 -32.8 101.0 34.1 64.0 110 162 A K H <> S+ 0 0 115 -3,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.888 112.2 42.2 -69.5 -44.9 100.4 37.8 65.3 111 163 A S H X S+ 0 0 74 -4,-0.6 4,-1.7 2,-0.2 -2,-0.2 0.869 115.8 49.8 -73.1 -35.7 96.7 37.2 66.2 112 164 A Q H X S+ 0 0 20 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.891 113.0 47.1 -67.6 -40.4 97.5 33.8 67.7 113 165 A X H X S+ 0 0 0 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.900 108.7 54.3 -68.1 -41.4 100.3 35.3 69.8 114 166 A E H X S+ 0 0 103 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.910 113.9 42.2 -56.3 -45.0 98.2 38.2 70.9 115 167 A N H X S+ 0 0 29 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.896 112.7 52.7 -69.2 -42.9 95.5 35.7 72.2 116 168 A L H X S+ 0 0 2 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.925 111.6 46.9 -57.5 -46.6 98.2 33.4 73.7 117 169 A L H X S+ 0 0 13 -4,-3.1 4,-1.9 2,-0.2 -2,-0.2 0.909 111.7 51.3 -62.2 -45.2 99.7 36.4 75.6 118 170 A K H X S+ 0 0 106 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.931 111.7 46.7 -55.9 -48.4 96.1 37.5 76.8 119 171 A D H X S+ 0 0 16 -4,-2.7 4,-1.9 1,-0.2 297,-0.2 0.813 109.4 53.9 -70.1 -29.0 95.4 33.9 78.1 120 172 A I H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.841 107.4 52.1 -71.1 -34.1 98.9 33.7 79.9 121 173 A Q H X S+ 0 0 81 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.919 108.5 50.1 -68.4 -42.0 98.0 37.0 81.7 122 174 A A H X S+ 0 0 43 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.912 111.9 48.5 -61.2 -43.0 94.6 35.5 82.8 123 175 A V H X S+ 0 0 0 -4,-1.9 4,-2.8 289,-0.2 5,-0.2 0.903 107.5 54.9 -64.4 -44.9 96.5 32.4 84.1 124 176 A K H X S+ 0 0 20 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.900 111.3 45.8 -53.2 -45.2 99.1 34.6 86.0 125 177 A V H >< S+ 0 0 92 -4,-1.9 3,-0.7 2,-0.2 4,-0.5 0.944 113.9 45.9 -65.9 -50.8 96.3 36.3 87.8 126 178 A I H >< S+ 0 0 42 -4,-2.3 3,-1.0 1,-0.2 8,-0.4 0.859 111.4 53.9 -62.4 -36.4 94.3 33.1 88.7 127 179 A N H 3< S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.753 107.0 53.0 -66.6 -27.5 97.6 31.5 89.9 128 180 A A T << S+ 0 0 52 -4,-1.1 -1,-0.2 -3,-0.7 -2,-0.2 0.539 83.1 125.7 -86.3 -6.0 98.2 34.5 92.2 129 181 A Q < - 0 0 101 -3,-1.0 5,-0.1 -4,-0.5 -3,-0.0 -0.227 48.6-144.3 -62.5 135.0 94.7 34.2 93.8 130 182 A T + 0 0 121 2,-0.1 2,-0.1 3,-0.1 -2,-0.0 -0.970 65.0 27.9-148.7 134.6 94.6 34.0 97.6 131 183 A P S S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.674 126.4 24.3 -84.9-173.4 92.9 32.4 99.6 132 184 A N S S- 0 0 119 1,-0.2 -2,-0.1 -2,-0.1 -3,-0.1 0.850 82.3-171.2 64.5 40.6 91.6 29.2 98.0 133 185 A N >> - 0 0 12 1,-0.1 3,-1.2 -5,-0.1 4,-0.7 -0.333 32.8-119.3 -59.5 143.6 94.5 29.0 95.5 134 186 A W H >> S+ 0 0 8 -8,-0.4 4,-2.3 1,-0.2 3,-1.0 0.856 114.5 57.9 -53.4 -38.6 93.9 26.3 92.8 135 187 A L H 34 S+ 0 0 8 1,-0.3 -1,-0.2 2,-0.2 5,-0.2 0.742 104.9 50.3 -64.3 -29.5 97.2 24.6 94.0 136 188 A E H <4 S+ 0 0 134 -3,-1.2 -1,-0.3 1,-0.1 -2,-0.2 0.576 116.0 43.4 -82.7 -15.9 95.8 24.3 97.6 137 189 A Q H << S+ 0 0 76 -3,-1.0 270,-0.3 -4,-0.7 -2,-0.2 0.745 88.8 93.9-101.4 -36.7 92.6 22.7 96.3 138 190 A V S < S- 0 0 11 -4,-2.3 2,-1.5 1,-0.1 -58,-0.1 -0.369 83.3-117.8 -59.0 138.0 93.8 20.2 93.7 139 191 A N + 0 0 92 -60,-0.5 -1,-0.1 1,-0.1 -3,-0.1 -0.697 67.8 131.6 -80.3 87.3 94.2 16.6 95.0 140 192 A A >> + 0 0 9 -2,-1.5 3,-1.9 -5,-0.2 4,-0.7 -0.534 20.7 166.7-136.2 66.3 98.0 16.4 94.4 141 193 A P G >4 S+ 0 0 42 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.824 74.6 64.1 -57.6 -30.4 99.6 15.1 97.6 142 194 A A G 34 S+ 0 0 0 1,-0.2 4,-0.1 2,-0.1 67,-0.1 0.669 103.1 49.7 -61.8 -23.5 102.9 14.4 95.8 143 195 A W G X4 S+ 0 0 0 -3,-1.9 3,-2.7 1,-0.1 4,-0.5 0.664 82.6 95.5 -88.2 -23.1 103.3 18.2 95.2 144 196 A K G X< S+ 0 0 163 -3,-0.9 3,-1.2 -4,-0.7 4,-0.2 0.820 78.8 56.6 -40.9 -47.7 102.6 19.2 98.8 145 197 A P G 3 S+ 0 0 61 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.712 118.9 32.7 -60.7 -19.0 106.4 19.4 99.7 146 198 A H G <> S+ 0 0 24 -3,-2.7 4,-2.7 1,-0.1 5,-0.2 0.209 76.1 122.4-123.3 15.4 107.0 21.9 96.9 147 199 A L H <> S+ 0 0 49 -3,-1.2 4,-2.2 -4,-0.5 5,-0.1 0.816 79.0 48.9 -48.0 -44.7 103.7 24.0 96.7 148 200 A T H > S+ 0 0 110 -4,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.943 114.2 45.9 -62.6 -50.1 105.5 27.4 97.3 149 201 A T H > S+ 0 0 31 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.891 111.9 51.7 -57.6 -48.0 108.1 26.6 94.6 150 202 A I H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.904 110.8 49.3 -56.5 -45.7 105.4 25.4 92.1 151 203 A H H X S+ 0 0 51 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.922 112.6 45.6 -58.8 -51.9 103.4 28.6 92.7 152 204 A N H X S+ 0 0 23 -4,-2.2 4,-2.9 1,-0.2 -1,-0.2 0.825 111.2 54.8 -61.4 -35.8 106.5 30.9 92.1 153 205 A X H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.900 108.6 45.3 -67.0 -45.0 107.5 28.9 89.0 154 206 A I H X S+ 0 0 1 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.911 115.4 49.3 -67.0 -38.4 104.0 29.3 87.3 155 207 A D H X S+ 0 0 15 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.956 114.2 44.9 -60.8 -50.6 104.2 33.1 88.2 156 208 A Y H X S+ 0 0 2 -4,-2.9 4,-2.9 239,-0.3 -2,-0.2 0.869 113.6 51.1 -56.6 -46.6 107.8 33.3 86.8 157 209 A A H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 5,-0.3 0.925 112.2 45.0 -61.3 -48.4 106.8 31.3 83.7 158 210 A C H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.3 0.922 115.5 47.8 -62.3 -45.7 103.7 33.6 83.0 159 211 A S H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.2 5,-0.2 0.913 116.0 44.0 -61.7 -46.4 105.8 36.7 83.6 160 212 A X H X S+ 0 0 0 -4,-2.9 4,-1.9 2,-0.2 -2,-0.2 0.973 120.4 38.5 -63.5 -58.9 108.7 35.5 81.4 161 213 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.853 117.5 51.9 -61.0 -42.1 106.6 34.2 78.4 162 214 A G H X S+ 0 0 0 -4,-2.7 4,-2.3 -5,-0.3 -2,-0.2 0.959 113.8 40.5 -60.8 -54.7 104.1 37.1 78.7 163 215 A N H X S+ 0 0 20 -4,-2.2 4,-1.9 -5,-0.3 -2,-0.2 0.791 113.5 56.0 -69.5 -24.8 106.8 39.9 78.6 164 216 A Y H X S+ 0 0 4 -4,-1.9 4,-1.6 -5,-0.2 -2,-0.2 0.963 110.4 44.0 -68.5 -50.0 108.7 38.0 75.9 165 217 A X H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.888 111.7 54.6 -60.3 -39.7 105.5 37.9 73.6 166 218 A S H X S+ 0 0 4 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.908 107.7 49.6 -57.9 -45.7 104.9 41.5 74.5 167 219 A D H <>S+ 0 0 49 -4,-1.9 5,-2.7 2,-0.2 6,-1.4 0.796 111.3 49.2 -64.5 -34.8 108.5 42.4 73.3 168 220 A V H ><5S+ 0 0 7 -4,-1.6 3,-1.2 3,-0.2 -2,-0.2 0.934 114.4 43.6 -71.0 -48.7 108.0 40.5 70.0 169 221 A L H 3<5S+ 0 0 57 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.731 114.5 50.4 -70.3 -24.7 104.6 42.2 69.2 170 222 A N T 3<5S- 0 0 85 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.327 113.8-123.4 -92.7 4.2 106.1 45.6 70.3 171 223 A E T < 5S+ 0 0 175 -3,-1.2 -3,-0.2 2,-0.1 -2,-0.1 0.701 77.1 126.3 59.1 28.3 109.0 44.9 67.9 172 224 A K S S- 0 0 66 -2,-0.5 4,-3.1 1,-0.1 5,-0.2 -0.921 79.2 -82.3-167.1 170.9 112.3 33.5 64.4 177 229 A X H > S+ 0 0 17 -2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.899 129.2 42.6 -47.7 -51.2 113.5 29.9 65.4 178 230 A A H > S+ 0 0 62 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.884 115.3 47.4 -64.4 -48.6 117.0 31.2 66.4 179 231 A S H > S+ 0 0 23 2,-0.2 4,-3.6 1,-0.2 5,-0.4 0.904 109.6 54.6 -63.2 -43.4 115.7 34.4 68.2 180 232 A L H X>S+ 0 0 0 -4,-3.1 5,-2.0 1,-0.2 4,-1.7 0.899 110.4 46.5 -58.2 -44.5 113.2 32.3 70.2 181 233 A Q H <>S+ 0 0 7 -4,-1.7 5,-2.5 -5,-0.2 6,-0.2 0.947 120.9 36.2 -62.4 -52.6 115.9 29.9 71.4 182 234 A N H <5S+ 0 0 103 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.900 123.7 40.0 -70.6 -44.2 118.4 32.7 72.4 183 235 A D H <5S+ 0 0 32 -4,-3.6 -3,-0.2 -5,-0.2 -1,-0.2 0.704 135.7 3.1 -81.3 -24.7 115.9 35.3 73.8 184 236 A F T ><5S+ 0 0 0 -4,-1.7 11,-1.2 -5,-0.4 3,-0.9 0.684 123.1 50.1-128.5 -62.5 113.4 33.0 75.6 185 237 A L T 3 > - 0 0 20 0, 0.0 3,-0.9 0, 0.0 4,-0.9 -0.242 6.8-127.9 -55.3 150.4 115.7 29.3 81.0 195 247 A Y H 3> S+ 0 0 0 -11,-1.2 4,-2.4 1,-0.2 -10,-0.2 0.789 110.4 73.2 -66.8 -24.3 112.1 28.5 80.0 196 248 A N H 3> S+ 0 0 3 -11,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.869 94.9 50.3 -51.1 -42.1 113.7 25.1 79.1 197 249 A N H <> S+ 0 0 6 -3,-0.9 4,-2.9 -12,-0.3 -1,-0.2 0.858 107.4 52.7 -67.6 -37.0 113.9 24.5 82.9 198 250 A V H X S+ 0 0 0 -4,-0.9 4,-2.6 2,-0.2 5,-0.2 0.911 107.9 52.6 -64.7 -41.3 110.1 25.4 83.3 199 251 A X H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.915 113.4 42.2 -61.9 -42.6 109.4 22.8 80.6 200 252 A I H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.946 115.1 50.5 -68.9 -47.8 111.3 20.0 82.4 201 253 A G H X S+ 0 0 0 -4,-2.9 4,-1.7 181,-0.2 -2,-0.2 0.905 113.5 44.4 -54.9 -48.8 109.9 21.1 85.9 202 254 A T H X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.889 113.6 49.8 -65.5 -43.6 106.2 21.1 84.6 203 255 A F H X S+ 0 0 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0 0 42 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.905 113.4 44.5 -61.2 -41.4 97.5 8.9 91.7 214 266 A L H X S+ 0 0 0 -4,-1.6 4,-3.4 2,-0.2 5,-0.3 0.910 111.2 52.1 -68.0 -46.0 97.8 5.4 90.2 215 267 A H H X S+ 0 0 44 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.934 108.5 52.1 -57.9 -44.1 100.1 4.0 92.8 216 268 A S H X S+ 0 0 58 -4,-2.5 4,-0.6 1,-0.2 -1,-0.2 0.898 117.4 38.9 -56.8 -42.8 97.7 5.2 95.6 217 269 A K H >< S+ 0 0 88 -4,-1.6 3,-0.6 2,-0.2 -2,-0.2 0.928 118.4 45.2 -73.0 -51.0 94.8 3.4 93.8 218 270 A I H >< S+ 0 0 11 -4,-3.4 3,-1.5 1,-0.2 -2,-0.2 0.746 103.2 66.0 -67.0 -30.3 96.6 0.2 92.7 219 271 A S H 3< S+ 0 0 68 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.839 94.8 58.2 -60.0 -35.6 98.3 -0.2 96.1 220 272 A Q T << S+ 0 0 167 -3,-0.6 2,-0.3 -4,-0.6 -1,-0.3 0.512 96.8 85.2 -73.5 -6.6 94.8 -0.9 97.7 221 273 A L S < S- 0 0 38 -3,-1.5 2,-1.0 -4,-0.1 -151,-0.0 -0.714 79.7-127.1 -99.0 150.9 94.4 -3.9 95.2 222 274 A K + 0 0 94 -2,-0.3 2,-0.5 2,-0.1 -3,-0.1 -0.795 38.2 177.9 -94.6 92.2 95.6 -7.5 95.6 223 275 A I - 0 0 24 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-5.3 48.6 475 126 B X + 0 0 34 -17,-3.6 -16,-0.1 -2,-0.4 -1,-0.1 0.695 66.6 110.4 -71.5 -19.3 97.1 -6.7 50.4 476 127 B R S S- 0 0 163 -18,-0.5 -2,-0.1 1,-0.1 2,-0.1 -0.258 83.6 -99.5 -55.2 136.3 95.1 -10.0 50.8 477 128 B T - 0 0 72 1,-0.1 -1,-0.1 2,-0.0 -2,-0.1 -0.385 37.3-116.6 -67.6 139.0 96.5 -12.8 48.6 478 129 B A > - 0 0 43 1,-0.1 3,-0.8 -2,-0.1 5,-0.4 -0.282 13.3-124.3 -69.4 157.3 94.8 -13.5 45.3 479 130 B P T 3 S+ 0 0 107 0, 0.0 -474,-0.4 0, 0.0 -1,-0.1 0.553 114.2 44.1 -81.0 -5.9 93.0 -16.9 44.6 480 131 B N T 3 S+ 0 0 32 1,-0.1 60,-3.0 -476,-0.1 -476,-0.1 0.094 88.6 93.9-120.4 18.0 95.2 -17.2 41.3 481 132 B S S < S- 0 0 2 -3,-0.8 -1,-0.1 58,-0.2 58,-0.1 0.672 92.4-120.8 -83.9 -25.1 98.5 -16.1 43.0 482 133 B G S > S+ 0 0 0 -4,-0.2 4,-2.2 -3,-0.1 5,-0.2 0.542 75.9 125.5 88.5 10.8 99.9 -19.6 43.9 483 134 B F H > S+ 0 0 56 -5,-0.4 4,-3.0 2,-0.2 5,-0.2 0.946 72.6 42.8 -64.6 -57.0 99.9 -18.6 47.7 484 135 B T H > S+ 0 0 17 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.933 116.9 49.2 -55.2 -49.4 97.8 -21.6 49.0 485 136 B E H > S+ 0 0 1 1,-0.2 4,-1.2 2,-0.2 -2,-0.2 0.910 116.9 40.1 -55.6 -52.1 99.7 -24.1 46.8 486 137 B X H X S+ 0 0 1 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.882 117.2 48.6 -66.9 -45.3 103.2 -22.8 47.8 487 138 B T H X S+ 0 0 5 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.857 105.3 58.7 -66.2 -40.4 102.2 -22.4 51.5 488 139 B A H < S+ 0 0 2 -4,-2.9 4,-0.2 -5,-0.2 -1,-0.2 0.874 110.4 42.9 -57.5 -41.4 100.7 -25.9 51.7 489 140 B I H >< S+ 0 0 0 -4,-1.2 3,-1.3 -5,-0.2 4,-0.3 0.908 113.8 51.5 -70.7 -45.9 104.0 -27.4 50.7 490 141 B S H >< S+ 0 0 1 -4,-1.9 3,-1.3 1,-0.2 -2,-0.2 0.905 102.2 60.8 -54.7 -46.2 106.0 -25.1 53.0 491 142 B H T 3X S+ 0 0 30 -4,-2.7 4,-2.7 1,-0.3 -1,-0.2 0.519 79.8 85.6 -66.3 -6.4 103.9 -26.0 56.0 492 143 B I H <> S+ 0 0 0 -3,-1.3 4,-2.4 -4,-0.2 -1,-0.3 0.889 89.4 51.7 -62.8 -40.1 104.8 -29.7 55.8 493 144 B G H <> S+ 0 0 0 -3,-1.3 4,-2.1 -4,-0.3 3,-0.3 0.990 114.0 40.0 -59.9 -63.3 108.0 -28.9 57.9 494 145 B P H > S+ 0 0 8 0, 0.0 4,-2.5 0, 0.0 -2,-0.2 0.868 113.8 56.7 -55.4 -38.4 106.1 -27.1 60.8 495 146 B A H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.923 109.1 44.9 -56.9 -48.0 103.3 -29.8 60.5 496 147 B L H X S+ 0 0 0 -4,-2.4 4,-2.0 -3,-0.3 -1,-0.2 0.861 111.9 53.3 -66.0 -34.6 105.8 -32.6 61.1 497 148 B X H X S+ 0 0 4 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.919 109.9 48.0 -62.9 -45.6 107.4 -30.5 64.0 498 149 B Y H X S+ 0 0 22 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.877 109.4 53.4 -61.0 -42.4 103.9 -30.1 65.6 499 150 B L H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.879 106.7 51.5 -63.5 -40.3 103.4 -33.9 65.2 500 151 B A H X S+ 0 0 5 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.873 112.2 47.3 -62.5 -38.1 106.7 -34.7 67.0 501 152 B K H X S+ 0 0 14 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.930 109.7 51.8 -68.8 -46.5 105.4 -32.4 69.8 502 153 B I H <>S+ 0 0 0 -4,-2.7 5,-2.3 1,-0.2 -2,-0.2 0.872 111.0 49.6 -55.3 -42.2 101.9 -34.1 69.9 503 154 B K H ><5S+ 0 0 81 -4,-2.3 3,-2.1 3,-0.2 -1,-0.2 0.942 108.5 51.9 -61.9 -49.4 103.8 -37.5 70.2 504 155 B E H 3<5S+ 0 0 116 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.860 105.2 55.7 -55.1 -40.8 106.0 -36.1 73.1 505 156 B N T 3<5S- 0 0 27 -4,-2.2 -1,-0.3 2,-0.1 -2,-0.2 0.394 120.5-113.3 -72.4 1.0 102.7 -35.0 75.0 506 157 B G T < 5 + 0 0 68 -3,-2.1 2,-0.7 1,-0.2 -3,-0.2 0.720 67.2 146.6 71.1 25.7 101.6 -38.6 74.7 507 158 B D > < - 0 0 10 -5,-2.3 3,-1.2 1,-0.1 -1,-0.2 -0.864 37.5-159.8 -98.1 113.3 98.7 -37.9 72.3 508 159 B A T >> S+ 0 0 73 -2,-0.7 3,-1.7 1,-0.3 4,-0.6 0.577 76.7 90.4 -66.1 -14.5 98.2 -40.8 69.9 509 160 B S H 3> + 0 0 48 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.604 68.0 79.5 -60.4 -12.0 96.3 -38.5 67.4 510 161 B W H <> S+ 0 0 23 -3,-1.2 4,-2.2 1,-0.2 -1,-0.3 0.831 90.2 52.4 -64.4 -33.3 99.8 -37.8 65.8 511 162 B K H <> S+ 0 0 116 -3,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.890 112.3 42.5 -69.1 -45.1 99.5 -41.2 63.9 512 163 B S H X S+ 0 0 75 -4,-0.6 4,-1.8 2,-0.2 -2,-0.2 0.869 115.7 49.8 -72.9 -35.7 96.1 -40.5 62.4 513 164 B Q H X S+ 0 0 20 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.919 113.0 46.5 -67.3 -43.1 97.0 -36.9 61.6 514 165 B X H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.801 109.0 55.5 -69.1 -32.5 100.3 -38.0 59.9 515 166 B E H X S+ 0 0 81 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.925 112.9 41.8 -62.6 -46.9 98.4 -40.8 57.9 516 167 B N H X S+ 0 0 29 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.894 112.4 53.8 -67.6 -42.7 96.0 -38.2 56.5 517 168 B L H X S+ 0 0 2 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.930 110.9 47.0 -57.0 -47.1 98.9 -35.7 55.9 518 169 B L H X S+ 0 0 5 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.909 111.8 50.9 -61.2 -45.2 100.7 -38.5 53.9 519 170 B K H X S+ 0 0 92 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.906 111.8 46.8 -57.4 -45.7 97.5 -39.3 51.9 520 171 B D H X S+ 0 0 16 -4,-2.6 4,-1.8 1,-0.2 -508,-0.2 0.829 109.4 53.9 -71.2 -30.3 97.0 -35.6 51.0 521 172 B I H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.846 106.5 53.2 -70.7 -35.5 100.7 -35.2 49.9 522 173 B Q H X S+ 0 0 62 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.905 108.4 49.4 -66.8 -40.2 100.2 -38.2 47.6 523 174 B A H X S+ 0 0 42 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.896 111.6 49.7 -64.5 -38.7 97.2 -36.5 46.0 524 175 B V H X S+ 0 0 0 -4,-1.8 4,-2.7 -516,-0.2 5,-0.2 0.911 106.5 55.0 -67.4 -42.4 99.3 -33.3 45.6 525 176 B K H X S+ 0 0 21 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.914 111.1 46.0 -55.8 -43.7 102.2 -35.2 43.9 526 177 B V H >< S+ 0 0 94 -4,-1.8 3,-0.7 2,-0.2 4,-0.5 0.940 113.5 46.5 -65.5 -51.2 99.7 -36.6 41.3 527 178 B I H >< S+ 0 0 39 -4,-2.2 3,-1.1 1,-0.3 8,-0.4 0.862 110.7 54.1 -61.9 -37.3 98.0 -33.2 40.6 528 179 B N H 3< S+ 0 0 0 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.752 105.5 54.0 -66.9 -27.3 101.4 -31.5 40.3 529 180 B A T << S+ 0 0 51 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.549 82.2 122.9 -86.4 -5.0 102.5 -34.1 37.7 530 181 B Q < - 0 0 105 -3,-1.1 5,-0.1 -4,-0.5 -3,-0.0 -0.292 51.9-141.7 -63.2 131.8 99.4 -33.3 35.5 531 182 B T + 0 0 116 2,-0.1 2,-0.1 3,-0.1 -2,-0.0 -0.985 62.6 24.2-147.4 137.9 100.2 -32.3 31.9 532 183 B P S S+ 0 0 101 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 0.651 125.3 27.2 -84.5-168.8 99.1 -30.3 29.9 533 184 B N S S- 0 0 121 1,-0.2 -2,-0.1 -2,-0.1 -3,-0.1 0.868 83.8-173.0 59.9 41.0 97.2 -27.4 31.7 534 185 B N >> - 0 0 10 1,-0.1 3,-1.3 -5,-0.1 4,-0.5 -0.409 33.9-118.5 -61.5 139.8 99.4 -27.9 34.8 535 186 B W H >> S+ 0 0 9 -8,-0.4 3,-1.1 1,-0.3 4,-0.6 0.812 113.3 59.6 -50.7 -37.6 98.2 -25.7 37.6 536 187 B L H 34 S+ 0 0 7 1,-0.3 3,-0.4 2,-0.2 -1,-0.3 0.775 100.5 53.8 -65.8 -32.1 101.6 -23.9 37.7 537 188 B E H <4 S+ 0 0 127 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.613 109.2 51.1 -75.0 -15.4 101.2 -22.7 34.0 538 189 B Q H << S+ 0 0 80 -3,-1.1 -2,-0.2 -4,-0.5 -1,-0.2 0.501 86.3 104.8-101.8 -9.0 97.8 -21.2 35.0 539 190 B V S < S- 0 0 18 -4,-0.6 2,-1.3 -3,-0.4 -58,-0.2 -0.492 75.1-123.6 -77.0 142.9 99.0 -19.2 38.1 540 191 B N + 0 0 63 -60,-3.0 -1,-0.1 -2,-0.2 -60,-0.1 -0.727 68.6 119.4 -88.8 88.1 99.4 -15.3 37.7 541 192 B A >> + 0 0 11 -2,-1.3 3,-1.6 1,-0.1 4,-0.7 -0.568 30.8 175.0-152.2 78.3 103.1 -15.0 38.7 542 193 B P G >4 S+ 0 0 52 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.866 80.7 62.7 -56.3 -36.5 105.2 -13.4 35.9 543 194 B A G 34 S+ 0 0 0 1,-0.3 4,-0.1 2,-0.1 67,-0.1 0.636 101.2 52.8 -61.0 -23.9 108.3 -13.3 38.2 544 195 B W G X4 S+ 0 0 2 -3,-1.6 3,-2.7 1,-0.2 4,-0.5 0.654 80.5 95.7 -86.2 -22.2 108.2 -17.2 38.5 545 196 B K G X< S+ 0 0 165 -3,-1.1 3,-1.2 -4,-0.7 4,-0.3 0.826 80.2 53.7 -42.1 -46.1 108.2 -17.7 34.7 546 197 B P G 3 S+ 0 0 58 0, 0.0 -1,-0.3 0, 0.0 4,-0.1 0.708 118.2 36.9 -63.7 -18.9 112.1 -18.2 34.4 547 198 B H G <> S+ 0 0 23 -3,-2.7 4,-2.7 1,-0.1 5,-0.2 0.219 75.4 116.9-119.1 14.6 111.9 -21.0 37.1 548 199 B L H <> S+ 0 0 49 -3,-1.2 4,-2.2 -4,-0.5 5,-0.1 0.843 80.9 50.0 -52.7 -40.3 108.6 -22.8 36.4 549 200 B T H > S+ 0 0 107 -4,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.942 113.0 46.4 -64.4 -47.9 110.5 -26.1 35.6 550 201 B T H > S+ 0 0 27 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.890 111.1 52.1 -58.5 -47.5 112.5 -25.9 38.9 551 202 B I H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.905 110.7 49.1 -57.9 -45.1 109.3 -25.1 40.9 552 203 B H H X S+ 0 0 51 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.921 113.0 45.6 -58.5 -50.8 107.6 -28.2 39.4 553 204 B N H X S+ 0 0 22 -4,-2.2 4,-3.0 1,-0.2 -1,-0.2 0.827 111.1 54.8 -63.2 -34.5 110.5 -30.5 40.2 554 205 B X H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.897 108.5 45.3 -68.0 -45.3 110.7 -29.0 43.7 555 206 B I H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.904 116.0 48.7 -65.8 -38.8 107.0 -29.8 44.6 556 207 B D H X S+ 0 0 14 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.954 113.8 45.5 -62.4 -50.5 107.5 -33.3 43.1 557 208 B Y H X S+ 0 0 2 -4,-3.0 4,-2.8 239,-0.3 -2,-0.2 0.866 113.3 51.7 -56.3 -45.5 110.8 -33.8 45.1 558 209 B A H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.926 111.2 45.2 -61.9 -48.5 109.0 -32.4 48.2 559 210 B C H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.916 115.4 48.0 -62.9 -44.5 106.0 -34.7 48.0 560 211 B S H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.909 116.5 43.2 -61.5 -46.3 108.3 -37.7 47.3 561 212 B X H X S+ 0 0 0 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.971 120.2 39.3 -64.8 -58.7 110.7 -36.8 50.2 562 213 B A H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.859 117.1 51.6 -62.0 -41.2 108.0 -36.0 52.8 563 214 B G H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.3 -2,-0.2 0.958 113.3 41.5 -61.8 -55.1 105.7 -38.9 51.7 564 215 B N H X S+ 0 0 20 -4,-2.1 4,-2.0 -5,-0.3 -2,-0.2 0.807 113.9 55.1 -67.8 -25.9 108.4 -41.6 51.9 565 216 B Y H X S+ 0 0 4 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.969 110.9 43.5 -68.5 -50.7 109.6 -40.1 55.2 566 217 B X H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.886 111.9 55.1 -59.3 -40.5 106.1 -40.3 56.8 567 218 B S H X S+ 0 0 3 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.916 107.6 48.9 -58.1 -47.2 105.7 -43.8 55.3 568 219 B D H <>S+ 0 0 49 -4,-2.0 5,-2.6 2,-0.2 6,-1.4 0.791 112.1 49.0 -62.9 -34.1 108.9 -45.0 57.0 569 220 B V H ><5S+ 0 0 8 -4,-1.6 3,-1.3 3,-0.2 -2,-0.2 0.937 114.5 43.8 -72.0 -48.5 107.8 -43.5 60.4 570 221 B L H 3<5S+ 0 0 56 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.757 114.6 49.9 -70.1 -25.8 104.3 -45.1 60.2 571 222 B N T 3<5S- 0 0 86 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.322 114.4-122.4 -91.3 4.2 105.9 -48.4 59.0 572 223 B E T < 5S+ 0 0 173 -3,-1.3 -3,-0.2 2,-0.1 -4,-0.1 0.665 77.7 126.0 60.2 27.6 108.4 -48.1 62.0 573 224 B K S S- 0 0 67 -2,-0.5 4,-2.9 1,-0.1 5,-0.2 -0.911 79.6 -83.7-169.9 169.8 110.9 -37.3 67.8 578 229 B X H > S+ 0 0 25 -2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.892 128.8 44.6 -50.3 -47.8 112.2 -33.7 67.4 579 230 B A H > S+ 0 0 55 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.895 115.1 46.2 -64.2 -49.0 115.8 -35.0 67.0 580 231 B S H > S+ 0 0 23 1,-0.2 4,-3.7 2,-0.2 5,-0.4 0.928 110.8 53.3 -60.4 -48.6 115.0 -37.8 64.5 581 232 B L H X>S+ 0 0 0 -4,-2.9 5,-2.1 1,-0.2 4,-1.6 0.860 111.2 47.3 -53.5 -44.3 112.7 -35.5 62.4 582 233 B Q H <>S+ 0 0 20 -4,-1.6 5,-2.8 -5,-0.2 6,-0.3 0.945 120.7 34.9 -64.3 -53.8 115.6 -32.9 62.1 583 234 B N H <5S+ 0 0 100 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.900 123.7 41.9 -71.8 -43.3 118.3 -35.5 61.2 584 235 B D H <5S- 0 0 46 -4,-3.7 -3,-0.2 -5,-0.2 -1,-0.2 0.724 136.6 -0.6 -78.9 -24.8 116.2 -37.9 59.1 585 236 B F T ><5S+ 0 0 0 -4,-1.6 11,-1.1 -5,-0.4 3,-0.8 0.680 122.9 52.3-130.6 -61.3 114.1 -35.3 57.1 586 237 B L T 3 > - 0 0 18 0, 0.0 3,-0.8 0, 0.0 4,-0.8 -0.220 6.2-128.5 -56.0 152.1 117.1 -30.7 53.0 596 247 B Y H 3> S+ 0 0 0 -11,-1.1 4,-2.4 -10,-0.3 3,-0.4 0.804 108.4 74.0 -70.4 -23.7 113.4 -30.1 53.4 597 248 B N H 3> S+ 0 0 2 -11,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.859 94.1 52.2 -49.8 -41.4 114.6 -26.8 55.1 598 249 B N H <> S+ 0 0 5 -3,-0.8 4,-2.9 -12,-0.3 -1,-0.2 0.847 106.8 51.7 -66.3 -38.9 115.4 -25.6 51.5 599 250 B V H X S+ 0 0 0 -4,-0.8 4,-2.5 -3,-0.4 5,-0.2 0.932 109.2 50.9 -65.3 -43.9 111.9 -26.5 50.3 600 251 B X H X S+ 0 0 1 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.910 116.3 40.1 -58.0 -47.4 110.3 -24.5 53.2 601 252 B I H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.933 114.0 54.0 -70.2 -45.0 112.5 -21.4 52.4 602 253 B G H X S+ 0 0 0 -4,-2.9 4,-1.9 181,-0.2 -2,-0.2 0.894 110.1 46.4 -53.2 -49.7 112.1 -21.8 48.6 603 254 B T H X S+ 0 0 0 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.911 113.6 48.5 -62.6 -46.2 108.3 -21.8 48.8 604 255 B F H X S+ 0 0 31 -4,-1.7 4,-2.1 -5,-0.2 -2,-0.2 0.908 110.1 52.6 -59.1 -47.0 108.1 -18.8 51.2 605 256 B X H X S+ 0 0 0 -4,-2.7 4,-2.8 177,-0.2 -1,-0.2 0.854 107.3 51.1 -57.3 -42.7 110.5 -16.9 48.9 606 257 B L H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.844 109.1 51.6 -66.8 -34.3 108.3 -17.5 45.8 607 258 B T H X S+ 0 0 25 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.916 112.5 45.4 -67.2 -44.7 105.2 -16.3 47.8 608 259 B A H X S+ 0 0 12 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.923 113.1 50.6 -64.9 -44.7 107.2 -13.0 48.7 609 260 B L H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.876 111.3 48.1 -60.4 -41.7 108.4 -12.6 45.2 610 261 B Q H X S+ 0 0 14 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.945 113.7 46.5 -65.0 -49.5 104.8 -13.0 43.7 611 262 B S H X S+ 0 0 34 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.891 116.7 43.7 -58.9 -46.4 103.3 -10.5 46.2 612 263 B X H X S+ 0 0 2 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.880 112.0 52.6 -73.5 -36.7 106.0 -7.9 45.6 613 264 B D H X S+ 0 0 2 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.903 108.8 50.5 -65.2 -41.3 106.0 -8.3 41.8 614 265 B Q H X S+ 0 0 35 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.890 113.5 45.9 -62.3 -40.4 102.2 -7.7 41.7 615 266 B L H X S+ 0 0 11 -4,-1.6 4,-3.0 2,-0.2 5,-0.3 0.916 111.8 49.6 -71.6 -43.8 102.6 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109,-0.3 -401,-0.1 0.356 66.1 52.7-102.8 0.9 104.4 -1.1 64.3 646 297 B S S > S- 0 0 35 108,-0.3 3,-2.1 1,-0.1 4,-0.1 -0.981 88.6-118.2-138.4 143.0 108.2 -0.1 64.0 647 298 B K G > S+ 0 0 101 -2,-0.3 3,-1.1 1,-0.3 6,-0.2 0.783 112.8 56.2 -52.7 -36.7 110.2 0.2 60.7 648 299 B G G 3 S+ 0 0 17 1,-0.2 -1,-0.3 5,-0.1 3,-0.1 0.624 111.9 44.5 -69.3 -15.7 112.7 -2.6 61.6 649 300 B S G < S+ 0 0 8 -3,-2.1 -5,-0.5 1,-0.1 2,-0.4 0.146 103.1 71.2-115.0 14.1 109.7 -5.0 62.0 650 301 B N X - 0 0 0 -3,-1.1 3,-1.7 -6,-0.1 -1,-0.1 -0.912 57.4-164.9-135.9 106.9 107.7 -4.0 58.9 651 302 B W T 3> S+ 0 0 25 -2,-0.4 4,-2.1 1,-0.3 5,-0.1 0.572 83.0 80.7 -69.6 -7.9 109.2 -5.0 55.5 652 303 B L H 3> S+ 0 0 3 2,-0.2 4,-2.6 3,-0.2 -1,-0.3 0.810 87.0 60.5 -63.7 -28.7 106.7 -2.5 53.8 653 304 B V H <> S+ 0 0 10 -3,-1.7 4,-1.8 -6,-0.2 -2,-0.2 0.989 111.3 33.9 -65.9 -60.8 109.3 0.2 54.8 654 305 B P H > S+ 0 0 30 0, 0.0 4,-2.4 0, 0.0 -2,-0.2 0.855 117.7 57.9 -63.7 -30.5 112.3 -1.3 52.7 655 306 B F H X S+ 0 0 0 -4,-2.1 4,-2.4 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-37,-2.1 -38,-0.0 2,-0.5 0.394 87.1 84.6 -93.9 1.5 108.9 10.7 54.7 669 320 B I E < -k 631 0E 18 -3,-1.7 2,-0.4 -39,-0.2 -37,-0.2 -0.927 61.5-177.1-106.4 112.3 107.6 7.2 55.8 670 321 B Y E -k 632 0E 3 -39,-2.7 -37,-2.6 -2,-0.5 2,-0.7 -0.954 22.5-148.7-119.1 131.6 105.6 7.3 59.1 671 322 B I E +k 633 0E 21 -2,-0.4 -37,-0.2 -39,-0.2 -24,-0.1 -0.900 23.7 174.8 -93.9 109.3 104.1 4.3 60.9 672 323 B T > + 0 0 0 -39,-2.0 3,-2.0 -2,-0.7 -431,-0.2 -0.708 7.6 172.7-118.9 76.7 100.9 5.8 62.5 673 324 B P T 3 S+ 0 0 2 0, 0.0 -432,-0.2 0, 0.0 -1,-0.1 0.725 79.6 49.1 -63.5 -18.7 99.1 2.8 64.2 674 325 B Y T 3 S+ 0 0 23 -434,-2.2 -433,-0.1 2,-0.1 -40,-0.1 0.330 78.7 125.4-104.6 9.1 96.5 5.1 65.9 675 326 B A < - 0 0 2 -3,-2.0 2,-0.1 -435,-0.4 19,-0.0 -0.411 67.2-107.1 -66.6 141.1 95.6 7.2 62.8 676 327 B A - 0 0 37 1,-0.1 2,-0.9 -2,-0.1 -1,-0.1 -0.386 15.9-124.4 -69.7 150.3 91.8 7.1 62.2 677 328 B V - 0 0 71 -2,-0.1 -1,-0.1 4,-0.0 -221,-0.0 -0.870 39.3-144.2 -92.7 98.3 90.2 5.2 59.3 678 329 B K > - 0 0 68 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1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.927 120.0 51.8 -57.9 -39.8 88.8 17.8 51.8 689 340 B A H > S+ 0 0 69 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.900 113.3 42.5 -61.4 -46.2 88.4 17.0 55.5 690 341 B D H > S+ 0 0 14 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.875 116.5 48.8 -69.9 -37.0 89.6 13.4 55.2 691 342 B Y H X S+ 0 0 11 -4,-3.0 4,-3.0 2,-0.2 5,-0.3 0.953 111.6 48.6 -65.5 -50.4 92.5 14.5 52.8 692 343 B N H X>S+ 0 0 44 -4,-3.4 4,-2.1 -5,-0.2 5,-2.0 0.826 109.1 57.0 -58.5 -31.9 93.6 17.3 55.2 693 344 B Y H <>S+ 0 0 22 -4,-1.6 5,-2.4 -5,-0.2 -1,-0.2 0.957 116.1 31.1 -63.9 -55.3 93.5 14.7 58.0 694 345 B Y H <>S+ 0 0 0 -4,-1.9 5,-2.6 3,-0.2 6,-0.2 0.917 126.6 42.9 -72.3 -42.7 95.9 12.3 56.4 695 346 B N H <>S+ 0 0 2 -4,-3.0 5,-1.1 -5,-0.2 -3,-0.2 0.897 134.7 9.4 -70.1 -48.8 98.0 14.9 54.6 696 347 B N T <>S+ 0 0 11 -4,-2.1 5,-1.1 -5,-0.3 -3,-0.2 0.840 130.2 44.5-102.8 -50.6 98.3 17.6 57.3 697 348 B T T < + 0 0 1 -4,-2.0 3,-1.8 -5,-0.4 -1,-0.2 -0.106 63.7 133.9 -90.4 42.6 116.8 23.4 69.6 714 365 B T T 3 + 0 0 87 -2,-0.4 -1,-0.2 -3,-0.3 4,-0.1 0.691 68.5 58.9 -62.9 -18.7 120.2 23.9 67.9 715 366 B N T 3 S+ 0 0 106 -3,-0.3 2,-0.5 2,-0.1 -1,-0.3 0.485 91.9 81.0 -89.8 -7.3 122.0 24.6 71.2 716 367 B I S < S- 0 0 15 -3,-1.8 -3,-0.0 -374,-0.1 -377,-0.0 -0.903 91.9-110.6-103.4 127.6 120.9 21.2 72.6 717 368 B T - 0 0 87 -2,-0.5 2,-0.4 1,-0.1 -371,-0.1 -0.267 35.3-119.1 -57.0 134.7 123.1 18.1 71.6 718 369 B S - 0 0 42 -4,-0.1 2,-0.3 -372,-0.1 -1,-0.1 -0.698 20.1-145.2 -84.0 136.5 121.2 15.8 69.3 719 370 B I - 0 0 22 -2,-0.4 2,-0.4 -376,-0.3 -393,-0.0 -0.776 11.3-167.7 -96.1 140.4 120.6 12.2 70.4 720 371 B F - 0 0 172 -2,-0.3 -373,-0.0 0, 0.0 -2,-0.0 -0.999 5.1-158.6-128.7 123.6 120.6 9.4 67.8 721 372 B L - 0 0 44 -2,-0.4 -398,-0.0 1,-0.0 -395,-0.0 -0.844 26.6-110.2 -95.8 145.0 119.3 5.9 68.8 722 373 B P - 0 0 92 0, 0.0 2,-0.1 0, 0.0 -1,-0.0 -0.302 24.1-119.1 -73.3 160.8 120.5 2.9 66.7 723 374 B D - 0 0 116 1,-0.2 3,-0.1 -76,-0.0 0, 0.0 -0.236 53.7 -70.2 -78.5 176.8 118.2 0.9 64.3 724 375 B R - 0 0 64 1,-0.1 -1,-0.2 -2,-0.1 3,-0.1 -0.393 64.9 -96.0 -70.6 152.6 117.7 -2.8 65.1 725 376 B P - 0 0 60 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.248 41.8 -93.7 -64.4 159.5 120.9 -4.9 64.5 726 377 B A + 0 0 59 -3,-0.1 3,-0.0 6,-0.1 0, 0.0 -0.582 56.4 178.5 -69.1 126.9 121.4 -6.8 61.2 727 378 B I > - 0 0 9 -2,-0.3 3,-1.9 -3,-0.1 6,-0.3 -0.913 38.7 -67.5-129.5 161.2 120.1 -10.3 61.9 728 379 B P T 3 S+ 0 0 9 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.145 120.0 35.9 -48.4 140.3 119.8 -13.5 59.7 729 380 B G T 3 S+ 0 0 2 1,-0.4 35,-0.6 9,-0.1 2,-0.1 0.108 87.8 119.7 99.7 -20.8 117.2 -13.1 56.9 730 381 B D S <> S- 0 0 14 -3,-1.9 4,-0.7 33,-0.1 -1,-0.4 -0.496 74.2-119.9 -72.5 147.1 118.1 -9.4 56.3 731 382 B Y T 4 S+ 0 0 34 32,-0.2 3,-0.2 1,-0.2 -1,-0.1 0.866 110.0 37.3 -58.0 -41.5 119.4 -8.6 52.8 732 383 B T T 4 S+ 0 0 122 1,-0.2 -1,-0.2 -5,-0.1 3,-0.1 0.610 94.8 85.5 -87.2 -16.0 122.8 -7.3 54.0 733 384 B Y T 4 S+ 0 0 114 -3,-0.4 2,-0.3 -6,-0.3 -1,-0.2 0.904 103.4 7.3 -53.8 -51.9 123.4 -9.8 56.9 734 385 B S < - 0 0 28 -4,-0.7 -1,-0.2 -3,-0.2 -5,-0.1 -0.998 67.2-141.3-140.8 140.2 124.9 -12.6 54.8 735 386 B K S S+ 0 0 151 1,-0.4 -3,-0.0 -2,-0.3 -4,-0.0 -0.914 100.7 25.1-142.8 107.2 126.0 -12.9 51.1 736 387 B P S S- 0 0 105 0, 0.0 -1,-0.4 0, 0.0 2,-0.1 0.553 105.0-133.9 -74.2 151.8 125.3 -15.6 49.9 737 388 B P - 0 0 20 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.453 13.3-133.2 -74.7 148.7 122.5 -16.2 52.4 738 389 B K >> - 0 0 111 1,-0.1 3,-0.9 -2,-0.1 4,-0.8 -0.751 14.7-125.6 -95.0 149.9 122.3 -19.6 54.1 739 390 B I H >> S+ 0 0 10 -2,-0.3 4,-1.6 1,-0.2 3,-0.8 0.912 112.7 61.3 -60.3 -39.7 119.0 -21.5 54.4 740 391 B E H 3> S+ 0 0 78 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.744 94.3 64.9 -58.4 -27.4 119.6 -21.7 58.2 741 392 B D H <> S+ 0 0 8 -3,-0.9 4,-1.7 1,-0.2 -1,-0.2 0.928 105.2 41.8 -62.1 -44.8 119.5 -17.8 58.2 742 393 B F H < - 0 0 57 -4,-2.6 3,-1.7 -5,-0.2 -1,-0.0 -0.618 65.4-151.9 -81.8 123.1 108.3 -12.0 68.8 753 404 B P T 3 S+ 0 0 17 0, 0.0 -111,-0.2 0, 0.0 -1,-0.1 0.783 98.0 58.7 -60.6 -27.8 105.0 -10.0 69.3 754 405 B T T 3 S+ 0 0 50 -111,-0.1 -110,-2.1 -110,-0.1 -109,-0.3 0.654 98.1 83.3 -72.9 -20.6 106.6 -7.1 67.2 755 406 B E < - 0 0 4 -3,-1.7 2,-0.3 -112,-0.2 -113,-0.1 -0.589 62.3-148.6 -98.3 155.3 107.1 -9.4 64.2 756 407 B X > - 0 0 9 -107,-0.3 3,-1.6 -2,-0.2 4,-0.3 -0.835 28.8-123.0-104.9 143.9 105.0 -10.7 61.2 757 408 B L T > S+ 0 0 74 -2,-0.3 3,-1.8 1,-0.3 4,-0.2 0.845 111.3 65.7 -62.3 -31.7 105.8 -14.2 59.8 758 409 B S T >> S+ 0 0 52 1,-0.3 4,-2.7 2,-0.2 3,-1.1 0.659 82.4 77.1 -65.1 -13.9 106.4 -12.5 56.3 759 410 B N H <> S+ 0 0 0 -3,-1.6 4,-0.7 1,-0.2 -1,-0.3 0.727 75.1 80.2 -66.0 -22.8 109.5 -10.8 57.9 760 411 B T H <4 S- 0 0 1 -3,-1.8 -1,-0.2 -4,-0.3 -15,-0.2 0.832 122.0 -1.8 -47.9 -42.5 111.2 -14.2 57.5 761 412 B V H <> S+ 0 0 7 -3,-1.1 4,-3.0 -4,-0.2 5,-0.3 0.466 114.0 89.6-129.0 -20.2 111.9 -13.4 53.7 762 413 B G H X S+ 0 0 1 -4,-2.7 4,-2.0 1,-0.2 -3,-0.2 0.876 91.6 44.8 -51.4 -50.8 110.2 -9.9 53.3 763 414 B F H X S+ 0 0 20 -4,-0.7 4,-1.5 2,-0.2 -32,-0.2 0.891 117.1 46.6 -64.4 -40.9 113.4 -7.9 54.2 764 415 B W H > S+ 0 0 5 -35,-0.6 4,-2.2 -5,-0.3 -2,-0.2 0.954 114.1 44.3 -66.4 -57.4 115.6 -10.2 52.0 765 416 B X H X S+ 0 0 0 -4,-3.0 4,-2.7 2,-0.2 5,-0.2 0.837 111.0 55.2 -58.8 -37.2 113.4 -10.3 48.8 766 417 B A H X S+ 0 0 1 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.931 111.8 44.6 -62.3 -42.2 112.7 -6.5 49.0 767 418 B G H X S+ 0 0 18 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.870 113.5 49.5 -66.1 -43.1 116.5 -5.9 49.0 768 419 B E H X S+ 0 0 3 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.927 111.6 47.8 -64.7 -45.9 117.2 -8.4 46.2 769 420 B L H <>S+ 0 0 0 -4,-2.7 5,-2.8 2,-0.2 4,-0.4 0.929 114.3 47.7 -61.4 -44.6 114.5 -6.9 43.9 770 421 B A H ><5S+ 0 0 25 -4,-2.1 3,-1.4 -5,-0.2 -2,-0.2 0.953 113.3 47.9 -57.8 -54.2 115.9 -3.4 44.6 771 422 B E H 3<5S+ 0 0 115 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.853 117.3 41.5 -54.6 -44.0 119.5 -4.5 43.9 772 423 B K T ><5S- 0 0 41 -4,-2.5 3,-1.3 -5,-0.1 -1,-0.3 0.336 110.8-120.8 -93.3 9.4 118.5 -6.3 40.7 773 424 B N T < 5 - 0 0 100 -3,-1.4 -3,-0.2 -4,-0.4 -4,-0.1 0.833 65.7 -63.5 53.2 42.0 116.1 -3.5 39.6 774 425 B W T 3 - 0 0 62 -3,-1.3 3,-1.7 -6,-0.3 4,-0.9 -0.774 33.2-161.8 -89.9 106.3 114.7 -8.0 36.7 776 427 B Y T 34 S+ 0 0 60 -2,-0.9 -1,-0.2 1,-0.3 -2,-0.1 0.699 86.9 59.6 -56.8 -29.8 113.3 -11.6 37.1 777 428 B N T 34 S+ 0 0 129 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.666 110.0 41.6 -77.0 -17.0 116.0 -13.1 35.0 778 429 B K T <4 S+ 0 0 117 -3,-1.7 -2,-0.2 -6,-0.2 -1,-0.2 0.563 90.7 99.7-105.4 -17.7 118.8 -11.7 37.3 779 430 B I < - 0 0 8 -4,-0.9 2,-0.4 -7,-0.1 -10,-0.1 -0.441 61.6-141.1 -75.9 148.4 117.4 -12.3 40.8 780 431 B S - 0 0 36 -2,-0.1 -2,-0.1 4,-0.0 -12,-0.0 -0.853 8.9-154.1-106.4 141.8 118.5 -15.3 42.9 781 432 B I >>> - 0 0 0 -2,-0.4 4,-2.7 -13,-0.0 3,-2.6 -0.924 16.2-132.2-119.9 102.0 115.9 -17.1 45.0 782 433 B P B 345S+n 786 0H 2 0, 0.0 -177,-0.2 0, 0.0 5,-0.2 -0.297 97.0 22.3 -55.0 130.7 117.2 -19.0 48.1 783 434 B G T 345S+ 0 0 0 3,-2.6 -181,-0.2 -182,-0.1 4,-0.1 0.271 130.6 47.4 91.9 -9.5 115.7 -22.4 48.1 784 435 B I T <45S+ 0 0 1 -3,-2.6 11,-0.2 2,-0.2 -1,-0.1 0.643 129.3 8.8-124.4 -56.3 115.0 -22.3 44.3 785 436 B T T <5S+ 0 0 49 -4,-2.7 2,-0.3 1,-0.1 3,-0.1 0.612 130.0 32.0-103.5 -20.2 118.1 -21.1 42.5 786 437 B T B - 0 0 41 0, 0.0 3,-2.8 0, 0.0 -1,-0.1 -0.256 58.6 -77.8 -58.6 148.0 124.1 -28.9 49.0 790 441 B E T 3 S+ 0 0 204 1,-0.3 3,-0.1 -3,-0.1 0, 0.0 -0.244 124.3 26.0 -47.7 123.3 127.7 -29.1 47.5 791 442 B G T 3 S+ 0 0 85 1,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.117 103.9 95.2 103.8 -17.6 127.5 -31.2 44.3 792 443 B I < + 0 0 54 -3,-2.8 -1,-0.3 1,-0.1 -4,-0.1 -0.877 42.0 177.1-108.4 138.6 123.8 -30.4 43.6 793 444 B S - 0 0 105 -2,-0.4 2,-0.3 1,-0.3 -5,-0.1 0.655 67.0 -9.1-110.6 -29.4 122.7 -27.6 41.3 794 445 B T S S- 0 0 59 -241,-0.0 -1,-0.3 -240,-0.0 -9,-0.1 -0.927 86.9 -66.0-156.7 177.5 118.8 -27.9 41.3 795 446 B Y - 0 0 2 -2,-0.3 -241,-0.1 -11,-0.2 -242,-0.1 -0.540 60.5-103.7 -72.9 138.0 115.9 -30.2 42.4 796 447 B P - 0 0 52 0, 0.0 -239,-0.3 0, 0.0 3,-0.1 -0.229 20.6-147.8 -63.8 153.7 115.8 -33.7 40.7 797 448 B N S S+ 0 0 106 1,-0.2 2,-0.8 -241,-0.1 -2,-0.0 0.908 84.3 51.9 -87.9 -54.2 113.2 -34.3 37.9 798 449 B N S S- 0 0 146 -242,-0.0 -1,-0.2 -241,-0.0 -245,-0.0 -0.809 75.1-179.5 -92.1 106.8 112.4 -38.1 38.3 799 450 B N - 0 0 22 -2,-0.8 -242,-0.0 -3,-0.1 -240,-0.0 -0.880 32.8 -96.7-112.4 141.5 111.5 -38.6 42.0 800 451 B P - 0 0 64 0, 0.0 -236,-0.1 0, 0.0 -1,-0.1 -0.164 42.5-108.8 -53.8 144.7 110.5 -41.9 43.6 801 452 B V - 0 0 102 1,-0.1 2,-0.7 -238,-0.1 -279,-0.0 -0.304 39.0 -96.3 -68.5 158.0 106.8 -42.6 44.0 802 453 B I - 0 0 9 -280,-0.1 2,-0.7 -284,-0.0 -1,-0.1 -0.712 38.2-152.8 -80.3 115.2 105.3 -42.5 47.6 803 454 B Q 0 0 139 -2,-0.7 -1,-0.0 1,-0.1 -236,-0.0 -0.833 360.0 360.0 -92.8 106.7 105.3 -46.2 48.8 804 455 B R 0 0 119 -2,-0.7 -1,-0.1 -236,-0.0 -233,-0.0 0.588 360.0 360.0 -90.2 360.0 102.5 -46.6 51.4