==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 23-MAR-10 3M9Y . COMPND 2 MOLECULE: TRIOSEPHOSPHATE ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR S.MUKHERJEE,D.DUTTA,B.SAHA,A.K.DAS . 506 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20172.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 353 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 71 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.8 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 . 34 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 169 33.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 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 2 4 5 1 0 2 2 1 2 3 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 1 9 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 0 A S 0 0 119 0, 0.0 206,-0.1 0, 0.0 205,-0.0 0.000 360.0 360.0 360.0 148.7 71.7 5.5 -18.9 2 1 A M + 0 0 185 204,-0.2 2,-0.4 2,-0.1 205,-0.1 0.470 360.0 120.4 -84.9 -0.1 70.9 3.3 -15.9 3 2 A R - 0 0 26 203,-0.2 205,-0.1 1,-0.1 204,-0.0 -0.512 60.5-137.5 -76.3 125.4 68.0 5.5 -14.7 4 3 A T - 0 0 50 -2,-0.4 32,-0.1 1,-0.1 31,-0.1 -0.651 25.5-109.9 -84.3 127.9 64.8 3.4 -14.7 5 4 A P - 0 0 31 0, 0.0 32,-2.9 0, 0.0 2,-0.4 -0.160 33.8-163.4 -56.2 145.8 61.7 5.4 -16.1 6 5 A I E -ab 37 232A 0 225,-1.6 227,-1.5 30,-0.2 2,-0.6 -0.957 10.3-170.9-140.9 118.2 59.1 6.3 -13.6 7 6 A I E -ab 38 233A 0 30,-2.9 32,-1.8 -2,-0.4 2,-0.6 -0.943 7.3-171.9-112.5 118.8 55.6 7.4 -14.4 8 7 A A E -ab 39 234A 0 225,-2.8 227,-2.4 -2,-0.6 2,-0.7 -0.955 13.5-148.1-114.9 114.8 53.7 8.7 -11.3 9 8 A G E -ab 40 235A 0 30,-3.4 32,-3.3 -2,-0.6 2,-1.0 -0.726 8.3-158.1 -81.8 115.7 49.9 9.4 -11.9 10 9 A N E -a 41 0A 2 225,-3.2 229,-0.2 -2,-0.7 32,-0.2 -0.817 10.6-176.5 -95.7 100.5 48.9 12.4 -9.6 11 10 A W - 0 0 1 30,-1.9 318,-0.2 -2,-1.0 -1,-0.2 0.598 20.8-164.1 -68.5 -13.2 45.1 12.0 -9.2 12 11 A K - 0 0 39 29,-0.4 2,-1.5 1,-0.2 -1,-0.2 -0.252 60.7 -18.9 53.9-149.3 45.0 15.2 -7.2 13 12 A M B S+I 329 0B 2 316,-1.9 316,-2.1 -3,-0.1 2,-0.3 -0.615 106.5 116.2 -91.6 79.6 41.8 15.6 -5.3 14 13 A N + 0 0 36 -2,-1.5 314,-0.1 314,-0.2 -3,-0.1 -0.993 41.6 33.1-146.0 150.6 39.6 13.2 -7.2 15 14 A K - 0 0 50 -2,-0.3 321,-0.2 27,-0.1 2,-0.2 0.448 63.2-108.4 87.8 141.8 37.7 9.9 -6.7 16 15 A T > - 0 0 16 1,-0.1 4,-2.1 322,-0.1 5,-0.2 -0.486 42.5-100.2 -80.1 167.9 35.8 8.3 -3.9 17 16 A V H > S+ 0 0 5 322,-0.2 4,-2.2 1,-0.2 5,-0.2 0.937 126.6 53.3 -51.7 -47.3 37.4 5.3 -2.1 18 17 A Q H > S+ 0 0 93 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.931 107.7 49.5 -55.6 -45.6 35.0 3.1 -4.2 19 18 A E H > S+ 0 0 97 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.858 107.7 54.6 -66.8 -30.3 36.2 4.7 -7.5 20 19 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.915 109.2 47.6 -66.3 -42.3 39.9 4.2 -6.5 21 20 A K H X S+ 0 0 70 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.904 109.6 53.6 -60.9 -43.4 39.2 0.5 -6.0 22 21 A D H X S+ 0 0 78 -4,-2.2 4,-1.1 -5,-0.2 -2,-0.2 0.889 107.5 52.1 -60.3 -40.0 37.3 0.3 -9.4 23 22 A F H >X S+ 0 0 10 -4,-2.0 3,-0.8 2,-0.2 4,-0.6 0.968 113.4 41.3 -63.8 -49.2 40.4 1.8 -11.1 24 23 A V H >< S+ 0 0 1 -4,-2.1 3,-0.7 1,-0.3 35,-0.3 0.864 111.7 56.6 -71.0 -33.3 42.9 -0.7 -9.6 25 24 A N H 3< S+ 0 0 77 -4,-2.7 -1,-0.3 1,-0.2 -2,-0.2 0.712 108.9 48.2 -64.8 -22.7 40.5 -3.6 -10.2 26 25 A A H << S+ 0 0 61 -4,-1.1 -1,-0.2 -3,-0.8 -2,-0.2 0.473 79.8 117.6 -98.0 -6.5 40.3 -2.7 -13.9 27 26 A L << - 0 0 20 -3,-0.7 32,-0.3 -4,-0.6 3,-0.1 -0.470 53.5-147.7 -61.2 129.3 44.0 -2.4 -14.7 28 27 A P - 0 0 72 0, 0.0 -1,-0.0 0, 0.0 -2,-0.0 -0.162 53.6 -44.7 -80.7-175.1 45.2 -4.9 -17.3 29 28 A T - 0 0 134 1,-0.1 32,-0.1 30,-0.1 0, 0.0 -0.332 65.1-149.2 -56.9 133.7 48.8 -6.3 -17.1 30 29 A L - 0 0 18 30,-0.5 3,-0.1 1,-0.2 -1,-0.1 -0.522 27.4 -83.6 -97.8 164.1 51.3 -3.4 -16.5 31 30 A P - 0 0 13 0, 0.0 7,-0.2 0, 0.0 -1,-0.2 -0.283 59.5 -82.0 -57.1 157.5 55.0 -3.3 -17.7 32 31 A D >> - 0 0 93 1,-0.1 4,-2.4 5,-0.1 3,-1.7 -0.393 37.6-123.6 -59.1 138.6 57.6 -5.0 -15.7 33 32 A S T 34 S+ 0 0 40 1,-0.3 -1,-0.1 2,-0.2 28,-0.0 0.723 110.8 58.2 -56.7 -29.0 58.7 -2.8 -12.7 34 33 A K T 34 S+ 0 0 175 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.627 112.0 40.2 -77.1 -17.6 62.4 -3.0 -14.0 35 34 A E T <4 S+ 0 0 91 -3,-1.7 2,-0.4 1,-0.3 -2,-0.2 0.843 134.7 4.4 -95.2 -51.4 61.4 -1.5 -17.3 36 35 A V < - 0 0 0 -4,-2.4 2,-0.6 -32,-0.1 -1,-0.3 -0.981 67.3-140.9-134.3 128.1 58.9 1.2 -16.2 37 36 A E E -a 6 0A 13 -32,-2.9 -30,-2.9 -2,-0.4 2,-0.4 -0.792 21.4-158.7 -88.0 124.1 58.1 2.0 -12.6 38 37 A S E +a 7 0A 2 -2,-0.6 25,-2.3 23,-0.4 2,-0.4 -0.893 14.8 174.1-107.3 132.6 54.3 2.7 -12.3 39 38 A V E -ac 8 63A 0 -32,-1.8 -30,-3.4 -2,-0.4 2,-0.5 -0.995 21.5-158.8-141.5 135.4 52.9 4.8 -9.4 40 39 A I E -ac 9 64A 0 23,-1.8 25,-3.2 -2,-0.4 2,-0.7 -0.987 11.6-158.5-112.7 119.6 49.5 6.1 -8.5 41 40 A C E +ac 10 65A 0 -32,-3.3 -30,-1.9 -2,-0.5 -29,-0.4 -0.896 26.2 174.9-101.9 111.9 49.7 9.0 -6.1 42 41 A A E - c 0 66A 0 23,-2.1 25,-0.6 -2,-0.7 -29,-0.1 -0.714 36.6 -78.0-120.9 161.0 46.2 9.2 -4.5 43 42 A P >> - 0 0 6 0, 0.0 3,-2.0 0, 0.0 4,-0.5 -0.215 46.0-114.1 -56.4 148.1 44.4 11.1 -1.7 44 43 A A H >> S+ 0 0 17 1,-0.3 3,-1.5 2,-0.2 4,-0.5 0.860 113.5 63.8 -54.3 -38.8 45.2 9.9 1.8 45 44 A I H 34 S+ 0 0 1 1,-0.2 4,-0.3 2,-0.1 -1,-0.3 0.700 106.8 43.8 -61.6 -16.2 41.7 8.7 2.4 46 45 A Q H <> S+ 0 0 0 -3,-2.0 4,-2.1 1,-0.1 -1,-0.2 0.483 87.1 90.6-106.7 -5.1 42.1 6.0 -0.5 47 46 A L H S+ 0 0 9 -4,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.891 116.6 47.3 -57.2 -40.1 42.1 0.5 -0.0 50 49 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.949 114.5 44.2 -73.2 -44.7 44.8 0.9 -2.8 51 50 A T H X S+ 0 0 7 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.897 113.7 52.1 -69.8 -36.2 47.7 -0.6 -0.9 52 51 A T H X S+ 0 0 51 -4,-2.4 4,-2.0 -5,-0.3 -1,-0.2 0.933 109.2 49.9 -62.0 -47.3 45.4 -3.5 0.3 53 52 A A H <>S+ 0 0 8 -4,-2.2 5,-2.5 2,-0.2 4,-0.3 0.915 111.8 48.0 -55.3 -45.4 44.3 -4.2 -3.4 54 53 A V H ><5S+ 0 0 36 -4,-2.6 3,-1.8 1,-0.2 -2,-0.2 0.944 111.7 50.6 -65.8 -44.1 47.9 -4.3 -4.5 55 54 A K H 3<5S+ 0 0 144 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.788 104.7 56.8 -61.9 -29.1 48.7 -6.6 -1.6 56 55 A E T 3<5S- 0 0 158 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.442 129.6 -96.2 -83.5 4.8 45.9 -8.9 -2.5 57 56 A G T < 5S+ 0 0 57 -3,-1.8 3,-0.5 1,-0.3 -3,-0.2 0.529 78.2 137.2 96.7 8.8 47.5 -9.3 -6.0 58 57 A K S S- 0 0 11 -32,-0.3 3,-2.8 -35,-0.3 -1,-0.2 0.896 90.2-144.3 50.4 51.2 47.7 -4.4 -10.6 60 59 A Q T 3 S+ 0 0 178 -3,-0.5 -30,-0.5 1,-0.3 -1,-0.2 -0.241 80.9 21.1 -57.9 132.0 50.9 -6.5 -10.0 61 60 A G T 3 S+ 0 0 29 1,-0.3 -23,-0.4 -3,-0.2 -1,-0.3 0.091 91.7 130.0 98.5 -20.8 53.9 -4.3 -10.1 62 61 A L < - 0 0 3 -3,-2.8 -1,-0.3 -4,-0.2 2,-0.3 -0.412 42.7-155.1 -69.1 138.7 52.0 -1.1 -9.3 63 62 A E E -c 39 0A 51 -25,-2.3 -23,-1.8 -3,-0.1 2,-0.4 -0.866 9.0-134.1-109.4 153.1 53.3 1.1 -6.5 64 63 A I E -c 40 0A 5 26,-0.4 28,-2.6 -2,-0.3 29,-1.1 -0.865 22.0-173.3-107.7 139.0 51.2 3.5 -4.4 65 64 A G E -cd 41 93A 0 -25,-3.2 -23,-2.1 -2,-0.4 29,-0.2 -0.872 16.4-131.3-121.4 165.6 52.2 7.1 -3.6 66 65 A A E -cd 42 94A 2 27,-2.7 29,-3.0 -2,-0.3 3,-0.1 -0.664 10.9-137.9-110.0 166.2 50.9 9.9 -1.5 67 66 A Q S S- 0 0 6 -25,-0.6 2,-0.3 1,-0.3 31,-0.2 0.434 81.0 -7.2-100.8 -5.3 50.3 13.6 -2.5 68 67 A N - 0 0 17 28,-0.1 2,-0.3 265,-0.1 -1,-0.3 -0.944 56.9-168.8-176.9 163.9 51.7 15.1 0.8 69 68 A T - 0 0 0 -2,-0.3 13,-0.2 -3,-0.1 2,-0.2 -0.946 25.3-116.1-155.0 158.1 52.9 14.3 4.3 70 69 A Y - 0 0 15 11,-2.9 -2,-0.0 -2,-0.3 7,-0.0 -0.467 26.1-125.8 -85.0 174.7 53.7 16.2 7.5 71 70 A F S S+ 0 0 32 -2,-0.2 2,-0.3 11,-0.1 11,-0.1 0.478 82.9 71.1-111.6 0.8 57.3 16.1 8.8 72 71 A E S S- 0 0 90 1,-0.1 12,-0.2 5,-0.0 -2,-0.2 -0.800 79.1-126.8-104.8 163.5 56.9 14.9 12.3 73 72 A D S S- 0 0 41 -2,-0.3 11,-0.4 1,-0.2 12,-0.3 0.872 82.2 -18.4 -70.1 -44.3 56.0 11.3 13.2 74 73 A N S S+ 0 0 98 194,-0.1 2,-0.3 10,-0.1 194,-0.2 -0.954 84.3 92.3-156.5 158.8 53.0 12.0 15.5 75 74 A G B S-J 267 0C 19 192,-1.7 2,-2.2 -2,-0.3 192,-2.0 -0.898 74.9 -20.7 145.5-161.9 51.6 15.0 17.5 76 75 A A S S+ 0 0 47 -2,-0.3 2,-0.2 190,-0.2 190,-0.1 -0.468 79.2 121.8 -89.2 69.3 49.3 18.0 17.7 77 76 A F > - 0 0 38 -2,-2.2 3,-2.1 3,-0.1 -1,-0.1 -0.577 51.0-155.6-129.5 65.4 48.9 18.6 14.0 78 77 A T T 3 S+ 0 0 0 1,-0.2 -2,-0.1 -2,-0.2 218,-0.0 -0.155 77.1 14.4 -43.5 123.6 45.2 18.4 13.5 79 78 A G T 3 S+ 0 0 24 1,-0.3 -1,-0.2 243,-0.1 2,-0.2 0.261 97.9 123.7 95.4 -6.5 44.3 17.4 9.8 80 79 A E < - 0 0 8 -3,-2.1 2,-0.4 241,-0.1 -1,-0.3 -0.516 59.0-125.4 -91.0 154.8 47.8 16.3 8.8 81 80 A T - 0 0 22 -2,-0.2 -11,-2.9 216,-0.1 186,-0.1 -0.839 24.2-133.4 -97.9 127.4 49.0 12.9 7.4 82 81 A S > - 0 0 10 -2,-0.4 4,-2.3 187,-0.2 5,-0.2 -0.611 5.2-143.4 -80.4 137.1 51.8 11.1 9.3 83 82 A P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.796 105.2 60.3 -65.3 -23.7 54.8 9.6 7.4 84 83 A V H > S+ 0 0 48 -11,-0.4 4,-2.3 -12,-0.2 5,-0.1 0.941 106.1 43.6 -68.0 -50.0 54.6 6.8 9.9 85 84 A A H > S+ 0 0 2 -12,-0.3 4,-0.9 2,-0.2 186,-0.3 0.903 114.1 52.0 -62.4 -36.4 51.0 5.9 8.9 86 85 A L H ><>S+ 0 0 0 -4,-2.3 5,-1.7 1,-0.2 3,-0.9 0.947 111.6 45.4 -61.3 -48.9 52.0 6.2 5.2 87 86 A A H ><5S+ 0 0 30 -4,-2.4 3,-1.7 1,-0.3 -1,-0.2 0.876 104.7 61.9 -67.2 -33.7 54.9 3.9 5.5 88 87 A D H 3<5S+ 0 0 94 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.761 102.5 52.0 -64.9 -24.9 53.0 1.3 7.6 89 88 A L T <<5S- 0 0 11 -4,-0.9 -1,-0.3 -3,-0.9 -2,-0.2 0.588 121.9-105.8 -82.6 -6.2 50.6 0.8 4.6 90 89 A G T < 5 + 0 0 43 -3,-1.7 -26,-0.4 -4,-0.4 -3,-0.2 0.604 59.0 166.0 82.4 17.5 53.5 0.1 2.2 91 90 A V < - 0 0 6 -5,-1.7 -1,-0.2 1,-0.1 -26,-0.2 -0.448 14.4-172.4 -58.2 134.2 53.2 3.6 0.4 92 91 A K + 0 0 75 -28,-2.6 33,-2.4 1,-0.2 2,-0.4 0.777 58.9 39.3-105.3 -39.1 56.5 3.9 -1.6 93 92 A Y E -de 65 125A 3 -29,-1.1 -27,-2.7 31,-0.2 2,-0.4 -0.907 56.8-166.0-117.5 147.4 56.5 7.5 -2.9 94 93 A V E -de 66 126A 0 31,-2.2 33,-2.8 -2,-0.4 2,-0.3 -0.941 14.9-144.0-132.5 116.6 55.4 10.8 -1.4 95 94 A V E + e 0 127A 0 -29,-3.0 2,-0.3 -2,-0.4 33,-0.2 -0.571 27.8 172.9 -71.2 130.0 54.9 13.9 -3.6 96 95 A I E + e 0 128A 1 31,-2.5 33,-3.0 -2,-0.3 -28,-0.1 -0.978 54.4 27.3-137.2 156.2 56.0 17.1 -1.8 97 96 A G S S+ 0 0 0 -2,-0.3 5,-0.1 31,-0.2 -1,-0.1 0.640 70.8 171.4 73.3 13.4 56.3 20.7 -2.9 98 97 A H >> - 0 0 10 -31,-0.2 4,-1.9 1,-0.1 3,-1.2 -0.319 44.9-116.6 -56.3 143.5 53.6 20.4 -5.7 99 98 A S H 3> S+ 0 0 12 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.793 114.9 59.7 -53.4 -32.7 52.9 24.0 -7.1 100 99 A E H 3>>S+ 0 0 20 1,-0.2 4,-2.4 2,-0.2 5,-0.5 0.892 108.5 43.3 -67.4 -33.9 49.3 23.7 -5.9 101 100 A R H <>5S+ 0 0 6 -3,-1.2 6,-1.8 3,-0.2 4,-0.9 0.848 114.7 49.8 -77.1 -35.7 50.5 23.3 -2.2 102 101 A R H <5S+ 0 0 40 -4,-1.9 4,-0.4 4,-0.2 -2,-0.2 0.909 121.5 34.3 -64.8 -44.3 53.1 26.0 -2.6 103 102 A E H <5S+ 0 0 149 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.931 130.0 27.0 -80.1 -49.7 50.5 28.4 -4.1 104 103 A L H <5S+ 0 0 51 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.1 0.798 130.6 34.9 -86.5 -25.1 47.2 27.6 -2.3 105 104 A F S < - 0 0 51 1,-0.1 4,-2.4 -2,-0.0 5,-0.2 -0.692 24.1-114.2-110.0 162.1 57.8 26.7 2.1 109 108 A D H > S+ 0 0 31 -2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.900 118.0 55.9 -56.3 -41.7 61.2 25.4 0.9 110 109 A E H > S+ 0 0 107 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.903 108.6 45.3 -59.1 -45.1 62.1 24.8 4.6 111 110 A E H > S+ 0 0 49 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.890 110.8 54.4 -62.9 -42.9 59.0 22.6 5.2 112 111 A I H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.914 107.8 49.1 -59.7 -42.8 59.6 20.7 2.0 113 112 A N H X S+ 0 0 34 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.929 110.0 51.3 -59.5 -46.3 63.2 19.9 3.2 114 113 A K H X S+ 0 0 105 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.931 111.5 48.4 -60.9 -43.9 61.9 18.7 6.5 115 114 A K H X S+ 0 0 3 -4,-2.8 4,-3.3 2,-0.2 -2,-0.2 0.916 106.5 55.3 -60.8 -42.7 59.4 16.4 4.7 116 115 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 5,-0.3 0.957 111.7 45.9 -53.8 -50.2 62.1 15.0 2.3 117 116 A H H X S+ 0 0 67 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.912 112.9 48.0 -55.8 -46.6 64.0 14.0 5.5 118 117 A A H X S+ 0 0 9 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.900 109.0 55.3 -66.4 -41.0 61.0 12.5 7.3 119 118 A I H <>S+ 0 0 0 -4,-3.3 5,-2.7 1,-0.2 3,-0.4 0.941 111.7 42.2 -55.3 -50.9 60.1 10.6 4.1 120 119 A F H ><5S+ 0 0 29 -4,-2.2 3,-2.1 1,-0.2 -1,-0.2 0.874 106.6 63.5 -65.8 -37.1 63.5 8.9 3.9 121 120 A K H 3<5S+ 0 0 141 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.878 105.9 45.1 -51.9 -40.4 63.5 8.3 7.6 122 121 A H T 3<5S- 0 0 43 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.113 124.7-101.0 -94.2 17.4 60.4 6.0 7.2 123 122 A G T < 5S+ 0 0 69 -3,-2.1 -3,-0.2 1,-0.3 2,-0.2 0.631 83.7 118.2 79.1 21.5 61.9 4.2 4.2 124 123 A M < - 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0 0 16 -3,-2.2 -1,-0.3 1,-0.1 -3,-0.0 -0.496 55.5-121.9 -68.4 137.4 70.4 14.8 2.3 158 157 A S > - 0 0 53 -2,-0.2 4,-2.4 -3,-0.1 5,-0.2 -0.275 26.2-102.0 -72.3 166.6 73.2 12.2 2.0 159 158 A E H > S+ 0 0 105 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.912 124.9 52.2 -54.4 -44.1 74.7 11.1 -1.3 160 159 A D H > S+ 0 0 123 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.908 110.1 48.2 -60.5 -39.9 72.8 7.9 -1.2 161 160 A Q H > S+ 0 0 50 1,-0.2 4,-2.2 2,-0.2 3,-0.3 0.906 108.8 54.5 -67.9 -37.7 69.5 9.9 -0.6 162 161 A L H < S+ 0 0 7 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.870 106.0 52.0 -64.3 -37.1 70.4 12.2 -3.5 163 162 A K H < S+ 0 0 104 -4,-2.1 46,-0.2 1,-0.2 -1,-0.2 0.837 116.3 40.8 -63.0 -33.1 70.7 9.2 -5.8 164 163 A S H < S+ 0 0 60 -4,-1.2 -2,-0.2 -3,-0.3 -1,-0.2 0.667 90.4 101.8 -91.8 -24.0 67.2 7.9 -4.7 165 164 A V < - 0 0 0 -4,-2.2 44,-1.2 -5,-0.1 2,-0.4 -0.278 61.1-146.3 -65.7 147.2 65.3 11.1 -4.6 166 165 A V E -fg 127 209A 0 -40,-2.0 -38,-3.2 42,-0.2 2,-0.4 -0.964 10.8-164.2-109.3 136.7 63.0 12.0 -7.6 167 166 A I E -fg 128 210A 2 42,-2.1 44,-2.7 -2,-0.4 2,-0.5 -0.983 3.5-157.8-120.7 128.6 62.6 15.7 -8.6 168 167 A A E -fg 129 211A 0 -40,-2.4 -38,-2.6 -2,-0.4 2,-0.6 -0.962 8.8-145.5-106.6 128.8 59.7 16.7 -10.8 169 168 A Y E -fg 130 212A 0 42,-2.7 44,-3.6 -2,-0.5 45,-0.3 -0.793 13.7-166.6 -95.6 120.2 60.0 19.9 -12.8 170 169 A E - 0 0 6 -40,-3.1 2,-2.0 -2,-0.6 3,-0.2 -0.934 17.3-147.8-107.4 118.7 56.7 21.8 -13.2 171 170 A P > + 0 0 4 0, 0.0 3,-2.3 0, 0.0 4,-0.4 -0.613 24.6 174.5 -84.5 81.4 56.6 24.7 -15.8 172 171 A I G > S+ 0 0 43 -2,-2.0 3,-1.7 -40,-0.4 -39,-0.2 0.853 73.9 68.7 -59.1 -37.2 54.1 26.6 -13.7 173 172 A W G 3 S+ 0 0 15 -41,-1.6 -1,-0.3 1,-0.3 -40,-0.1 0.665 100.8 49.5 -50.7 -19.6 54.5 29.5 -16.2 174 173 A A G < S+ 0 0 18 -3,-2.3 -1,-0.3 4,-0.0 -2,-0.2 0.604 82.0 128.0 -93.4 -19.1 52.7 27.1 -18.6 175 174 A I < 0 0 118 -3,-1.7 4,-0.0 -4,-0.4 -3,-0.0 -0.149 360.0 360.0 -50.9 126.1 49.7 26.2 -16.3 176 175 A G 0 0 108 2,-0.0 0, 0.0 0, 0.0 0, 0.0 0.631 360.0 360.0 106.3 360.0 46.2 26.6 -17.8 177 ! 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 0.0 178 178 A K 0 0 145 0, 0.0 2,-0.3 0, 0.0 -4,-0.0 0.000 360.0 360.0 360.0 167.4 50.6 29.0 -23.0 179 179 A S - 0 0 104 -4,-0.0 2,-0.4 -6,-0.0 -4,-0.1 -0.970 360.0-155.3-145.1 138.4 53.1 26.0 -23.8 180 180 A S - 0 0 14 -2,-0.3 2,-0.1 -6,-0.1 35,-0.0 -0.904 21.1-149.2-106.3 134.8 56.3 24.1 -23.0 181 181 A T > - 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0 0 17 -3,-2.2 -1,-0.2 1,-0.1 2,-0.1 -0.487 54.2-118.0 -78.5 150.4 24.1 29.3 7.2 412 157 B S > - 0 0 55 -2,-0.1 4,-2.6 -3,-0.1 5,-0.2 -0.300 24.9-103.1 -78.3 168.0 20.3 28.7 7.6 413 158 B E H > S+ 0 0 113 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.874 124.0 48.8 -56.1 -44.5 18.4 28.6 10.9 414 159 B D H > S+ 0 0 116 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.874 110.7 52.0 -67.2 -35.5 18.3 24.8 10.9 415 160 B Q H > S+ 0 0 50 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.910 106.5 53.9 -64.6 -42.7 22.0 24.7 10.1 416 161 B L H < S+ 0 0 9 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.841 108.1 49.4 -61.8 -34.2 22.7 27.0 13.1 417 162 B K H < S+ 0 0 91 -4,-1.6 47,-0.3 -5,-0.2 -1,-0.2 0.849 117.4 41.5 -67.3 -34.8 20.8 24.7 15.4 418 163 B S H < S+ 0 0 61 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.680 91.2 98.9 -86.9 -27.2 22.8 21.6 14.0 419 164 B V < - 0 0 0 -4,-2.4 45,-0.9 -5,-0.1 2,-0.4 -0.238 63.7-143.4 -61.0 150.6 26.3 23.1 13.9 420 165 B V E -pq 381 464D 0 -40,-2.0 -38,-3.2 43,-0.1 2,-0.5 -0.975 12.0-163.1-112.3 137.0 28.8 22.3 16.8 421 166 B I E -pq 382 465D 2 43,-2.0 45,-2.6 -2,-0.4 2,-0.5 -0.983 2.2-158.7-116.4 129.6 31.2 25.1 17.8 422 167 B A E -pq 383 466D 0 -40,-2.8 -38,-2.2 -2,-0.5 2,-0.5 -0.947 8.5-146.0-109.3 131.2 34.3 24.3 20.0 423 168 B Y E -pq 384 467D 0 43,-2.6 45,-3.6 -2,-0.5 46,-0.3 -0.774 12.8-166.3 -94.5 122.6 35.9 27.0 22.0 424 169 B E - 0 0 5 -40,-2.7 2,-1.8 -2,-0.5 -38,-0.3 -0.941 16.5-148.9-109.7 116.8 39.7 26.7 22.4 425 170 B P > + 0 0 3 0, 0.0 3,-2.0 0, 0.0 45,-0.1 -0.659 23.5 176.1 -82.0 86.5 41.4 28.9 25.0 426 171 B I G > S+ 0 0 39 -2,-1.8 3,-2.9 -40,-0.7 -39,-0.2 0.849 71.2 71.6 -66.4 -31.4 44.6 29.1 22.9 427 172 B W G 3 S+ 0 0 14 -41,-1.5 6,-0.3 1,-0.3 -1,-0.3 0.684 94.8 53.0 -51.5 -22.6 46.0 31.5 25.6 428 173 B A G < S+ 0 0 25 -3,-2.0 2,-0.5 4,-0.1 -1,-0.3 0.289 89.4 99.1 -93.9 9.8 46.3 28.5 27.8 429 174 B I S < S- 0 0 98 -3,-2.9 -41,-0.2 3,-0.1 3,-0.1 -0.880 102.1 -13.7-111.7 127.4 48.3 26.5 25.2 430 175 B G S S+ 0 0 55 -2,-0.5 3,-0.2 1,-0.3 2,-0.1 0.126 116.3 88.4 42.6 167.6 52.0 26.5 25.7 431 176 B T S S- 0 0 71 1,-0.1 -1,-0.3 -3,-0.1 0, 0.0 0.209 93.4-114.3 73.4 138.5 52.1 29.4 28.2 432 177 B G S S+ 0 0 84 -3,-0.1 2,-0.2 -2,-0.1 -1,-0.1 -0.080 77.9 123.4 -97.4 31.1 51.7 27.9 31.6 433 178 B K - 0 0 80 -6,-0.3 2,-0.4 -3,-0.2 -3,-0.1 -0.645 49.6-147.8 -86.1 156.5 48.3 29.6 32.0 434 179 B S - 0 0 96 -2,-0.2 2,-0.6 -5,-0.1 -5,-0.1 -0.981 7.7-141.5-128.5 138.8 45.2 27.4 32.8 435 180 B S - 0 0 9 -2,-0.4 2,-0.1 -7,-0.1 35,-0.1 -0.873 23.9-150.9 -94.2 125.9 41.6 27.9 31.8 436 181 B T > - 0 0 64 -2,-0.6 4,-2.5 1,-0.1 5,-0.2 -0.292 30.6-101.8 -87.8 175.2 39.3 26.9 34.7 437 182 B S H > S+ 0 0 13 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.813 124.8 54.4 -67.6 -25.4 35.7 25.5 34.2 438 183 B E H > S+ 0 0 139 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.928 109.6 45.4 -70.6 -44.2 34.4 28.9 35.2 439 184 B D H > S+ 0 0 38 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.898 113.5 51.4 -59.8 -43.5 36.5 30.6 32.4 440 185 B A H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.900 109.1 49.0 -65.0 -40.5 35.4 27.9 30.0 441 186 B N H X S+ 0 0 29 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.895 108.8 54.3 -67.9 -36.9 31.7 28.4 30.8 442 187 B E H X S+ 0 0 114 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.944 111.7 42.5 -63.1 -46.8 31.9 32.1 30.4 443 188 B M H X S+ 0 0 3 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.855 113.4 51.8 -67.5 -37.3 33.4 31.9 26.9 444 189 B C H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.904 110.2 50.3 -64.1 -38.7 31.0 29.1 25.8 445 190 B A H X S+ 0 0 32 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.858 109.7 51.1 -63.0 -36.5 28.1 31.3 27.0 446 191 B F H X S+ 0 0 54 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.878 108.1 50.8 -71.5 -39.6 29.6 34.2 25.0 447 192 B V H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.934 111.6 49.8 -58.6 -47.4 29.8 31.9 21.8 448 193 B R H X S+ 0 0 7 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.941 109.7 49.8 -60.2 -46.3 26.1 31.1 22.5 449 194 B Q H X S+ 0 0 106 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.899 107.5 54.4 -59.3 -40.2 25.1 34.7 22.9 450 195 B T H X S+ 0 0 8 -4,-2.4 4,-1.3 2,-0.2 -1,-0.2 0.928 109.6 47.3 -60.1 -40.8 26.9 35.6 19.6 451 196 B I H X S+ 0 0 0 -4,-2.0 4,-0.7 1,-0.2 3,-0.4 0.937 110.2 53.2 -63.0 -45.6 24.8 32.9 17.8 452 197 B A H >< S+ 0 0 14 -4,-2.6 3,-0.8 1,-0.2 -1,-0.2 0.867 106.9 51.9 -56.4 -43.4 21.6 34.2 19.5 453 198 B D H 3< S+ 0 0 120 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.746 112.0 45.7 -68.7 -28.5 22.4 37.8 18.2 454 199 B L H 3< S- 0 0 68 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.482 138.3 -1.4 -93.0 -1.2 22.8 36.6 14.6 455 200 B S S << S- 0 0 39 -3,-0.8 2,-0.3 -4,-0.7 -3,-0.2 0.023 107.7 -58.5-145.1 -99.9 19.7 34.4 14.7 456 201 B S > - 0 0 29 -5,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.985 36.5-107.1-154.9 166.5 17.4 34.0 17.7 457 202 B K H > S+ 0 0 125 -2,-0.3 4,-1.7 1,-0.2 -1,-0.1 0.925 117.8 54.5 -59.0 -45.4 17.5 32.9 21.3 458 203 B E H 4 S+ 0 0 138 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.872 108.2 48.8 -58.8 -42.5 15.7 29.7 20.5 459 204 B V H >> S+ 0 0 3 1,-0.2 3,-1.9 2,-0.2 4,-1.4 0.962 109.6 51.7 -59.9 -48.0 18.2 28.7 17.8 460 205 B S H 3< S+ 0 0 4 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.765 101.6 62.4 -68.2 -22.3 21.2 29.4 20.1 461 206 B E T 3< S+ 0 0 57 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.655 107.1 44.4 -76.1 -13.8 19.6 27.1 22.8 462 207 B A T <4 S+ 0 0 32 -3,-1.9 -2,-0.2 -4,-0.5 -1,-0.2 0.771 89.1 100.3 -91.3 -38.1 19.9 24.1 20.4 463 208 B T S < S- 0 0 0 -4,-1.4 2,-0.5 1,-0.1 -43,-0.1 -0.299 71.7-134.2 -57.7 127.5 23.4 24.8 19.2 464 209 B R E -q 420 0D 31 -45,-0.9 -43,-2.0 -47,-0.3 2,-0.5 -0.753 19.3-165.1 -86.7 130.3 25.9 22.5 20.9 465 210 B I E -q 421 0D 0 -2,-0.5 21,-3.3 -45,-0.2 22,-0.5 -0.968 5.3-163.0-119.8 123.1 29.0 24.3 22.2 466 211 B Q E -q 422 0D 0 -45,-2.6 -43,-2.6 -2,-0.5 2,-0.5 -0.709 19.8-124.3-100.5 154.3 32.0 22.2 23.2 467 212 B Y E -qr 423 488D 3 20,-2.5 22,-2.0 -2,-0.3 -43,-0.2 -0.862 21.8-174.9 -92.4 133.6 35.0 23.1 25.3 468 213 B G + 0 0 17 -45,-3.6 -44,-0.1 -2,-0.5 3,-0.1 0.169 50.7 100.8-115.2 16.2 38.3 22.5 23.4 469 214 B G S S- 0 0 14 -46,-0.3 2,-0.2 1,-0.2 22,-0.2 -0.252 92.3 -47.6 -85.1-170.6 40.7 23.4 26.2 470 215 B S + 0 0 80 -45,-0.1 2,-0.4 -2,-0.1 -1,-0.2 -0.366 64.9 169.1 -70.1 122.1 42.5 20.6 28.3 471 216 B V + 0 0 3 -2,-0.2 22,-0.4 -3,-0.1 20,-0.1 -1.000 5.5 176.0-133.4 140.7 40.1 18.0 29.7 472 217 B K >> - 0 0 87 -2,-0.4 4,-1.6 20,-0.1 3,-1.6 -0.820 48.5 -95.4-131.8 167.4 41.0 14.6 31.3 473 218 B P T 34 S+ 0 0 43 0, 0.0 4,-0.5 0, 0.0 3,-0.4 0.904 122.6 57.6 -54.3 -37.3 39.1 11.8 33.0 474 219 B N T 34 S+ 0 0 146 1,-0.2 4,-0.1 2,-0.1 -3,-0.0 0.656 120.4 24.9 -72.1 -15.5 39.6 13.4 36.3 475 220 B N T <> S+ 0 0 32 -3,-1.6 4,-1.7 2,-0.1 3,-0.3 0.398 88.0 98.8-123.9 4.5 38.0 16.7 35.4 476 221 B I H X S+ 0 0 3 -4,-1.6 4,-2.7 -3,-0.4 5,-0.3 0.903 85.5 54.9 -54.7 -40.9 35.5 16.0 32.5 477 222 B K H > S+ 0 0 136 -4,-0.5 4,-1.4 1,-0.2 -1,-0.2 0.875 104.7 52.8 -65.2 -35.7 32.6 15.9 35.0 478 223 B E H 4 S+ 0 0 101 -3,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.905 114.3 42.0 -65.0 -43.4 33.5 19.4 36.4 479 224 B Y H >< S+ 0 0 18 -4,-1.7 3,-1.2 1,-0.2 6,-0.2 0.899 112.9 51.5 -69.8 -41.9 33.5 21.0 32.8 480 225 B M H 3< S+ 0 0 25 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.738 100.5 65.2 -70.2 -23.8 30.3 19.1 31.5 481 226 B A T 3< S+ 0 0 78 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.644 79.2 105.7 -71.0 -16.3 28.4 20.3 34.6 482 227 B Q S X S- 0 0 52 -3,-1.2 3,-0.9 -4,-0.3 -44,-0.0 -0.418 79.6-123.2 -68.3 146.6 28.7 23.9 33.4 483 228 B T T 3 S+ 0 0 101 1,-0.3 -1,-0.1 -2,-0.1 -3,-0.0 0.817 105.5 35.7 -63.2 -35.8 25.4 25.4 32.0 484 229 B D T 3 S+ 0 0 30 -20,-0.0 2,-0.6 2,-0.0 -1,-0.3 0.370 94.1 92.8-109.7 9.0 26.8 26.3 28.6 485 230 B I < + 0 0 4 -3,-0.9 -19,-0.2 -6,-0.2 3,-0.1 -0.891 42.1 172.3-103.0 116.1 29.3 23.5 28.0 486 231 B D - 0 0 13 -21,-3.3 -226,-2.0 -2,-0.6 2,-0.3 0.281 62.2 -30.9-107.3 5.5 27.6 20.7 26.0 487 232 B G E -l 260 0D 0 -22,-0.5 -20,-2.5 -228,-0.2 2,-0.4 -0.987 62.8 -99.9 169.7-170.2 30.6 18.5 25.3 488 233 B A E -lr 261 467D 2 -228,-1.4 -226,-2.7 -2,-0.3 2,-0.7 -0.999 5.0-145.2-148.7 146.5 34.3 18.5 24.7 489 234 B L E -l 262 0D 7 -22,-2.0 2,-0.5 -2,-0.4 -226,-0.2 -0.919 41.2-165.5-106.2 105.1 36.8 18.3 21.8 490 235 B V E -l 263 0D 3 -228,-2.6 -226,-2.8 -2,-0.7 4,-0.1 -0.851 20.8-177.7-114.7 132.7 39.4 16.3 23.5 491 236 B G S > S+ 0 0 20 -2,-0.5 3,-2.4 -228,-0.2 4,-0.4 0.867 73.9 13.0 -86.4 -98.1 43.1 15.7 22.5 492 237 B G G > S+ 0 0 43 1,-0.3 3,-1.4 2,-0.2 4,-0.3 0.804 120.4 61.3 -60.3 -36.9 45.4 13.5 24.5 493 238 B A G 3 S+ 0 0 2 -22,-0.4 -1,-0.3 1,-0.2 10,-0.2 0.461 99.2 58.5 -69.3 -1.7 42.7 11.9 26.7 494 239 B S G < S+ 0 0 0 -3,-2.4 -1,-0.2 -230,-0.2 -2,-0.2 0.429 85.2 81.4 -98.2 -8.1 41.0 10.4 23.6 495 240 B L S < S+ 0 0 45 -3,-1.4 2,-0.4 -4,-0.4 -2,-0.1 0.822 86.5 53.9 -73.9 -29.4 44.0 8.4 22.5 496 241 B K S >> S- 0 0 115 -4,-0.3 4,-2.9 1,-0.1 3,-0.6 -0.882 77.5-133.8-111.3 138.6 43.7 5.4 24.8 497 242 B V H 3> S+ 0 0 23 -2,-0.4 4,-2.5 1,-0.2 5,-0.2 0.881 107.1 57.6 -53.4 -43.6 40.5 3.3 25.1 498 243 B E H 3> S+ 0 0 129 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.877 113.1 38.6 -57.0 -37.9 40.7 3.4 28.9 499 244 B D H <> S+ 0 0 52 -3,-0.6 4,-1.9 2,-0.2 -2,-0.2 0.911 113.1 54.8 -78.7 -43.2 40.7 7.3 29.0 500 245 B F H X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.2 3,-0.2 0.907 105.6 53.1 -59.9 -43.6 38.2 7.7 26.2 501 246 B V H X S+ 0 0 18 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.858 107.9 51.6 -57.8 -40.2 35.6 5.4 28.0 502 247 B Q H X S+ 0 0 97 -4,-0.9 4,-2.5 -5,-0.2 -1,-0.2 0.850 105.4 54.4 -68.8 -33.1 35.9 7.6 31.1 503 248 B L H < S+ 0 0 0 -4,-1.9 4,-0.4 -10,-0.2 -2,-0.2 0.915 109.9 48.4 -65.6 -40.9 35.3 10.8 29.1 504 249 B L H >< S+ 0 0 2 -4,-1.8 3,-1.1 2,-0.2 4,-0.4 0.932 112.1 47.9 -63.3 -49.2 32.0 9.2 27.8 505 250 B E H >< S+ 0 0 84 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.928 111.0 52.2 -52.3 -49.1 30.9 8.1 31.4 506 251 B G T 3< S+ 0 0 8 -4,-2.5 -1,-0.2 1,-0.3 -26,-0.2 0.493 99.5 64.5 -71.5 -6.3 31.7 11.6 32.8 507 252 B A T < 0 0 4 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.538 360.0 360.0 -93.5 -11.0 29.6 13.3 30.1 508 253 B K < 0 0 127 -3,-1.5 -2,-0.2 -4,-0.4 -1,-0.1 0.899 360.0 360.0 -65.5 360.0 26.3 11.8 31.3