==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN TRANSPORT 05-MAR-99 1T1N . COMPND 2 MOLECULE: PROTEIN (HEMOGLOBIN); . SOURCE 2 ORGANISM_SCIENTIFIC: TREMATOMUS NEWNESI; . AUTHOR L.MAZZARELLA,L.VITAGLIANO,C.SAVINO,A.ZAGARI . 288 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14817.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 76.7 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 . 0 0.0 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 . 7 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 165 57.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 1 1 1 0 0 0 0 1 1 2 0 1 3 2 0 0 0 0 0 0 0 0 0 0 0 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 . 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 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 1 A S 0 0 148 0, 0.0 2,-0.2 0, 0.0 128,-0.1 0.000 360.0 360.0 360.0 160.9 4.9 -18.8 -4.5 2 2 A L - 0 0 28 72,-0.2 2,-0.2 126,-0.1 123,-0.0 -0.501 360.0-143.4 -83.6 143.8 8.6 -19.8 -5.1 3 3 A S > - 0 0 48 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.513 34.8-102.8 -92.2 166.6 9.8 -21.9 -8.0 4 4 A D H > S+ 0 0 136 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.828 128.0 54.9 -63.4 -24.4 12.6 -24.5 -7.6 5 5 A K H > S+ 0 0 164 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.899 107.4 46.9 -71.2 -43.8 14.7 -21.8 -9.3 6 6 A D H > S+ 0 0 10 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.911 112.6 51.3 -60.9 -43.5 13.7 -19.2 -6.7 7 7 A K H X S+ 0 0 30 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.921 110.6 47.1 -62.5 -45.8 14.5 -21.7 -4.0 8 8 A A H X S+ 0 0 50 -4,-2.0 4,-2.6 -5,-0.2 -1,-0.2 0.875 111.2 51.1 -65.9 -39.5 17.9 -22.5 -5.3 9 9 A A H X S+ 0 0 36 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.918 111.2 48.5 -67.6 -40.6 18.9 -18.9 -5.8 10 10 A V H X S+ 0 0 3 -4,-2.4 4,-3.1 2,-0.2 5,-0.3 0.949 113.1 47.5 -62.9 -44.1 17.9 -18.1 -2.2 11 11 A R H X S+ 0 0 114 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.918 113.8 46.8 -65.2 -39.5 19.9 -21.0 -0.9 12 12 A A H X S+ 0 0 45 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.872 114.8 46.8 -67.0 -37.4 22.9 -20.1 -3.0 13 13 A L H >X S+ 0 0 8 -4,-2.3 4,-2.1 2,-0.2 3,-0.8 0.984 112.9 47.6 -68.0 -52.0 22.7 -16.4 -1.9 14 14 A W H 3X S+ 0 0 51 -4,-3.1 4,-2.5 1,-0.3 -2,-0.2 0.875 108.3 58.1 -56.5 -33.6 22.2 -17.3 1.7 15 15 A S H 3< S+ 0 0 97 -4,-1.9 -1,-0.3 -5,-0.3 4,-0.2 0.914 110.0 43.7 -60.5 -39.6 25.1 -19.6 1.3 16 16 A K H << S+ 0 0 110 -4,-1.5 -2,-0.2 -3,-0.8 3,-0.2 0.871 126.3 26.8 -78.0 -31.8 27.3 -16.7 0.2 17 17 A I H >< S+ 0 0 2 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.649 89.7 95.2-109.5 -17.2 26.3 -14.1 2.8 18 18 A G G >< S+ 0 0 22 -4,-2.5 3,-1.1 -5,-0.3 -1,-0.2 0.621 73.5 71.6 -55.1 -19.4 25.2 -16.1 5.8 19 19 A K G 3 S+ 0 0 172 1,-0.2 3,-0.4 -4,-0.2 -1,-0.3 0.901 103.5 41.9 -59.0 -41.0 28.7 -15.7 7.4 20 20 A S G <> S+ 0 0 41 -3,-1.8 4,-2.0 1,-0.2 -1,-0.2 -0.017 77.4 118.3 -94.1 25.8 27.9 -12.0 8.0 21 21 A S H <> + 0 0 21 -3,-1.1 4,-2.1 1,-0.2 -1,-0.2 0.731 69.7 59.7 -71.4 -19.8 24.3 -12.5 9.2 22 22 A D H > S+ 0 0 76 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.964 111.0 40.8 -71.7 -44.9 25.1 -11.0 12.6 23 23 A A H > S+ 0 0 46 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.835 113.3 55.7 -66.7 -35.2 26.2 -7.7 11.1 24 24 A I H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.921 109.8 45.4 -62.9 -44.9 23.3 -7.9 8.6 25 25 A G H X S+ 0 0 3 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.891 114.1 47.1 -69.2 -41.0 20.7 -8.2 11.3 26 26 A N H X S+ 0 0 27 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.962 117.1 44.4 -61.7 -51.8 22.2 -5.4 13.5 27 27 A D H X S+ 0 0 32 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.876 113.3 48.7 -61.9 -41.3 22.5 -3.1 10.5 28 28 A A H X S+ 0 0 2 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.866 114.7 45.7 -72.0 -34.8 19.1 -3.8 9.1 29 29 A L H X S+ 0 0 4 -4,-1.7 4,-1.6 -5,-0.2 -2,-0.2 0.889 109.8 54.3 -76.2 -37.7 17.4 -3.3 12.4 30 30 A S H X S+ 0 0 4 -4,-2.6 4,-2.4 1,-0.2 3,-0.3 0.959 110.9 47.1 -57.1 -52.2 19.4 -0.1 13.1 31 31 A R H X S+ 0 0 8 -4,-2.2 4,-2.4 1,-0.2 5,-0.4 0.840 107.0 55.4 -60.3 -36.8 18.2 1.4 9.8 32 32 A M H X S+ 0 0 10 -4,-1.5 4,-1.3 2,-0.2 7,-0.3 0.904 111.7 45.3 -63.2 -35.5 14.6 0.4 10.4 33 33 A I H < S+ 0 0 3 -4,-1.6 7,-0.2 -3,-0.3 -2,-0.2 0.902 120.1 38.6 -78.3 -40.9 14.6 2.3 13.7 34 34 A V H < S+ 0 0 51 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.961 124.1 36.9 -70.1 -54.1 16.3 5.4 12.3 35 35 A V H < S+ 0 0 16 -4,-2.4 -3,-0.2 1,-0.3 -2,-0.2 0.698 126.7 36.6 -77.8 -18.6 14.7 5.6 8.9 36 36 A Y >< + 0 0 34 -4,-1.3 3,-2.6 -5,-0.4 -1,-0.3 -0.466 68.1 176.1-136.8 62.8 11.2 4.5 10.0 37 37 A P G > + 0 0 78 0, 0.0 3,-1.3 0, 0.0 4,-0.3 0.575 69.7 76.9 -45.1 -22.1 10.7 6.0 13.4 38 38 A Q G 3 S+ 0 0 124 1,-0.2 3,-0.5 2,-0.1 -5,-0.1 0.678 90.0 60.7 -65.0 -13.4 7.2 4.8 13.7 39 39 A T G X S+ 0 0 2 -3,-2.6 3,-1.3 -7,-0.3 4,-0.3 0.520 80.3 83.3 -91.6 -9.3 8.7 1.3 14.4 40 40 A K G X S+ 0 0 104 -3,-1.3 3,-1.6 1,-0.3 -1,-0.2 0.785 74.5 73.2 -69.5 -26.5 10.6 2.4 17.6 41 41 A I G > S+ 0 0 118 -3,-0.5 3,-0.8 -4,-0.3 -1,-0.3 0.691 87.6 61.9 -62.5 -22.6 7.5 2.0 19.7 42 42 A Y G < S+ 0 0 67 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.667 112.5 36.7 -76.3 -14.5 7.8 -1.8 19.6 43 43 A F G X S+ 0 0 29 -3,-1.6 3,-1.5 -4,-0.3 -1,-0.2 -0.037 77.7 118.1-122.6 28.9 11.2 -1.6 21.3 44 44 A S T < + 0 0 90 -3,-0.8 -1,-0.1 1,-0.3 -2,-0.1 0.764 65.6 70.1 -70.6 -20.8 10.5 1.2 23.7 45 45 A H T 3 S+ 0 0 137 -4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.554 80.6 90.8 -74.8 -8.0 11.2 -1.1 26.7 46 46 A W S < S- 0 0 38 -3,-1.5 3,-0.1 1,-0.1 -3,-0.0 -0.693 76.8-136.3 -87.6 147.3 14.9 -1.3 25.9 47 47 A P S S+ 0 0 123 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 0.832 93.2 35.4 -68.7 -34.2 17.1 1.3 27.5 48 48 A D + 0 0 63 1,-0.0 7,-0.3 2,-0.0 8,-0.2 -0.971 57.6 167.3-129.0 117.6 19.1 2.1 24.4 49 49 A V + 0 0 29 -2,-0.5 -6,-0.1 -3,-0.1 -1,-0.0 -0.476 43.6 107.6-129.9 56.9 17.4 2.1 21.0 50 50 A T S > S- 0 0 75 1,-0.0 3,-1.1 -16,-0.0 6,-0.3 -0.944 84.9 -94.3-128.7 150.2 20.0 3.7 18.8 51 51 A P T 3 S+ 0 0 47 0, 0.0 -21,-0.1 0, 0.0 -20,-0.1 0.737 121.7 51.2 -37.6 -42.2 22.2 2.0 16.2 52 52 A G T 3 S+ 0 0 54 -22,-0.1 5,-0.2 4,-0.1 -22,-0.0 0.946 85.8 132.3 -62.1 -43.8 25.3 1.3 18.5 53 53 A S <> - 0 0 1 -3,-1.1 4,-1.6 1,-0.1 3,-0.1 0.505 59.6-140.7 -13.7 131.1 23.0 -0.3 21.1 54 54 A P H > S+ 0 0 95 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.777 104.6 55.1 -69.2 -27.6 23.8 -3.6 22.7 55 55 A N H > S+ 0 0 48 -7,-0.3 4,-1.9 2,-0.2 5,-0.2 0.824 105.7 49.7 -74.6 -34.3 20.2 -4.6 22.5 56 56 A I H > S+ 0 0 0 -6,-0.3 4,-2.3 1,-0.2 5,-0.2 0.887 110.5 51.9 -73.6 -38.0 19.9 -4.0 18.7 57 57 A K H X S+ 0 0 109 -4,-1.6 4,-1.2 2,-0.2 -2,-0.2 0.895 112.4 44.1 -63.2 -40.5 23.0 -6.1 18.2 58 58 A A H X S+ 0 0 58 -4,-1.5 4,-1.1 1,-0.2 -1,-0.2 0.871 116.3 46.2 -77.2 -36.0 21.6 -9.0 20.2 59 59 A H H X S+ 0 0 51 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.802 105.8 58.5 -76.9 -30.4 18.2 -8.8 18.7 60 60 A G H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.847 102.2 56.2 -68.5 -31.7 19.5 -8.5 15.1 61 61 A K H X S+ 0 0 121 -4,-1.2 4,-1.1 1,-0.2 -1,-0.2 0.934 108.2 48.8 -58.1 -43.8 21.3 -11.8 15.7 62 62 A K H X S+ 0 0 145 -4,-1.1 4,-1.3 1,-0.2 -2,-0.2 0.829 109.1 51.0 -65.9 -35.7 17.9 -13.3 16.5 63 63 A V H X S+ 0 0 37 -4,-1.6 4,-1.6 2,-0.2 -1,-0.2 0.882 109.6 49.1 -73.6 -38.6 16.1 -11.9 13.5 64 64 A M H X S+ 0 0 3 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.742 107.3 57.8 -71.2 -22.3 18.7 -13.2 11.1 65 65 A G H X S+ 0 0 39 -4,-1.1 4,-1.8 2,-0.2 -1,-0.2 0.856 104.7 50.0 -72.0 -37.6 18.2 -16.5 12.9 66 66 A G H X S+ 0 0 18 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.813 110.9 49.6 -68.7 -32.6 14.5 -16.4 12.0 67 67 A I H X S+ 0 0 18 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.956 108.0 52.8 -70.4 -45.7 15.5 -15.7 8.4 68 68 A A H X S+ 0 0 35 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.913 109.2 51.5 -55.8 -38.4 18.0 -18.7 8.5 69 69 A L H X S+ 0 0 63 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.925 107.3 51.3 -63.5 -43.3 15.0 -20.7 9.7 70 70 A A H < S+ 0 0 0 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.865 108.2 53.0 -63.3 -35.1 12.8 -19.6 6.8 71 71 A V H >< S+ 0 0 14 -4,-2.3 3,-1.6 2,-0.2 -2,-0.2 0.959 111.3 44.7 -62.6 -50.0 15.6 -20.6 4.4 72 72 A S H 3< S+ 0 0 86 -4,-2.1 3,-0.3 1,-0.3 -2,-0.2 0.862 119.1 43.5 -67.7 -30.2 15.8 -24.1 5.8 73 73 A K T >< S+ 0 0 107 -4,-2.3 3,-1.9 -5,-0.2 -1,-0.3 0.107 75.9 133.2 -95.0 25.9 11.9 -24.3 5.9 74 74 A I T < + 0 0 7 -3,-1.6 3,-0.4 1,-0.3 -1,-0.2 0.694 63.2 60.5 -53.2 -19.1 11.6 -22.8 2.4 75 75 A D T 3 S+ 0 0 109 -3,-0.3 -1,-0.3 1,-0.3 2,-0.2 0.727 118.9 22.0 -88.0 -19.5 9.1 -25.4 1.2 76 76 A D <> + 0 0 77 -3,-1.9 4,-2.1 -6,-0.1 -1,-0.3 -0.645 65.5 165.2-142.8 87.1 6.5 -24.7 3.8 77 77 A L H > S+ 0 0 23 -3,-0.4 4,-2.0 -2,-0.2 5,-0.1 0.895 74.6 62.3 -65.2 -41.6 6.9 -21.2 5.1 78 78 A K H 4 S+ 0 0 89 1,-0.2 -1,-0.2 2,-0.2 7,-0.1 0.930 114.2 32.4 -53.6 -45.7 3.4 -21.1 6.7 79 79 A T H >4 S+ 0 0 83 1,-0.2 3,-1.1 2,-0.2 4,-0.3 0.902 114.7 58.6 -80.5 -39.7 4.2 -24.1 9.0 80 80 A G H 3< S+ 0 0 21 -4,-2.1 3,-0.2 -7,-0.3 -2,-0.2 0.768 115.4 35.2 -59.4 -30.0 7.9 -23.3 9.5 81 81 A L T 3X S+ 0 0 4 -4,-2.0 4,-2.1 1,-0.1 -1,-0.2 0.212 81.0 111.8-113.6 15.4 7.2 -19.8 10.9 82 82 A M H <> S+ 0 0 55 -3,-1.1 4,-1.7 1,-0.2 -1,-0.1 0.802 77.4 52.8 -58.2 -35.1 3.9 -20.5 12.8 83 83 A E H > S+ 0 0 165 -4,-0.3 4,-1.7 -3,-0.2 -1,-0.2 0.906 112.8 45.2 -70.1 -41.7 5.5 -19.9 16.3 84 84 A L H > S+ 0 0 51 2,-0.2 4,-2.0 1,-0.2 5,-0.3 0.774 109.9 53.9 -68.6 -33.2 6.9 -16.6 15.1 85 85 A S H X>S+ 0 0 0 -4,-2.1 4,-1.3 2,-0.2 5,-0.7 0.871 108.8 50.9 -67.8 -37.7 3.6 -15.6 13.5 86 86 A E H X>S+ 0 0 70 -4,-1.7 5,-1.6 -5,-0.2 4,-1.0 0.945 111.4 47.8 -59.0 -50.1 1.9 -16.3 16.9 87 87 A Q H <>S+ 0 0 75 -4,-1.7 5,-2.3 3,-0.2 6,-0.2 0.905 123.5 28.8 -59.0 -51.0 4.4 -14.2 18.7 88 88 A H H <5S+ 0 0 52 -4,-2.0 6,-1.7 3,-0.2 5,-0.2 0.962 129.1 34.1 -79.8 -61.0 4.2 -11.1 16.4 89 89 A A H <5S+ 0 0 0 -4,-1.3 -3,-0.2 48,-0.4 -2,-0.2 0.701 131.2 30.9 -75.8 -21.4 0.7 -11.1 15.0 90 90 A Y T < - 0 0 75 1,-0.1 3,-2.5 -3,-0.1 4,-0.2 -0.630 20.4-134.0 -74.6 124.3 1.2 -4.1 12.5 96 96 A P T >> S+ 0 0 53 0, 0.0 3,-1.6 0, 0.0 4,-0.8 0.649 97.4 75.9 -61.8 -20.7 2.0 -6.0 9.3 97 97 A S H 3> S+ 0 0 58 1,-0.3 4,-0.9 2,-0.2 3,-0.3 0.827 90.1 64.0 -60.0 -22.0 2.8 -2.9 7.3 98 98 A N H <> S+ 0 0 8 -3,-2.5 4,-2.2 1,-0.2 -1,-0.3 0.708 87.1 66.0 -76.4 -20.3 6.0 -3.1 9.3 99 99 A F H <> S+ 0 0 21 -3,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.905 99.9 51.9 -68.3 -40.6 7.2 -6.5 7.9 100 100 A K H X S+ 0 0 150 -4,-0.8 4,-2.1 -3,-0.3 -1,-0.2 0.859 108.5 53.5 -60.7 -32.9 7.6 -4.9 4.4 101 101 A I H X S+ 0 0 21 -4,-0.9 4,-2.0 2,-0.2 -2,-0.2 0.963 109.7 44.7 -67.6 -50.4 9.7 -2.1 6.1 102 102 A L H X S+ 0 0 32 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.883 112.8 53.2 -62.0 -34.9 12.1 -4.6 7.7 103 103 A N H X S+ 0 0 23 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.913 106.9 51.0 -66.1 -40.3 12.4 -6.6 4.5 104 104 A H H X S+ 0 0 15 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.918 109.4 50.8 -56.6 -47.2 13.3 -3.5 2.5 105 105 A C H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.779 106.6 54.3 -67.6 -29.7 16.0 -2.6 5.0 106 106 A I H X S+ 0 0 8 -4,-1.7 4,-3.2 2,-0.2 5,-0.3 0.915 109.1 48.9 -67.6 -43.5 17.5 -6.2 4.8 107 107 A L H X S+ 0 0 5 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.880 111.4 49.5 -61.2 -37.6 17.7 -5.7 1.0 108 108 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.929 112.4 47.6 -67.3 -43.7 19.4 -2.4 1.5 109 109 A V H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.964 112.7 47.2 -64.7 -49.1 21.8 -3.9 3.9 110 110 A I H X S+ 0 0 4 -4,-3.2 4,-3.7 1,-0.2 -1,-0.2 0.927 112.0 51.6 -56.4 -45.4 22.6 -6.9 1.6 111 111 A S H < S+ 0 0 3 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.940 109.3 50.9 -54.7 -44.2 23.1 -4.5 -1.3 112 112 A T H < S+ 0 0 8 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.895 120.9 33.6 -59.5 -39.2 25.5 -2.4 0.8 113 113 A M H < S+ 0 0 47 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.834 130.1 26.4 -92.7 -31.5 27.5 -5.5 1.7 114 114 A F X + 0 0 22 -4,-3.7 4,-2.2 -5,-0.2 -1,-0.2 -0.514 62.6 154.4-135.0 67.3 27.4 -7.8 -1.3 115 115 A P T 4 S+ 0 0 64 0, 0.0 -1,-0.1 0, 0.0 144,-0.1 0.874 77.1 52.0 -61.9 -36.0 26.8 -5.6 -4.4 116 116 A K T 4 S+ 0 0 172 1,-0.2 3,-0.1 -3,-0.1 -2,-0.1 0.904 116.1 38.2 -69.8 -43.8 28.4 -8.1 -6.7 117 117 A E T 4 S+ 0 0 64 1,-0.2 2,-1.9 -6,-0.1 -1,-0.2 0.710 98.4 81.3 -81.2 -21.0 26.3 -11.0 -5.5 118 118 A F < + 0 0 2 -4,-2.2 -1,-0.2 -8,-0.2 141,-0.0 -0.458 66.8 162.1 -87.4 69.4 23.1 -9.0 -5.2 119 119 A T > - 0 0 46 -2,-1.9 4,-1.8 1,-0.1 5,-0.1 -0.315 55.5-103.5 -81.0 170.2 22.2 -9.1 -8.9 120 120 A P H > S+ 0 0 16 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.797 123.4 53.7 -65.5 -30.1 18.8 -8.4 -10.2 121 121 A E H > S+ 0 0 85 2,-0.2 4,-1.2 1,-0.2 5,-0.2 0.935 110.8 45.7 -68.1 -47.4 18.1 -12.1 -10.7 122 122 A A H > S+ 0 0 16 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.769 111.0 56.7 -62.2 -30.1 19.1 -12.7 -7.0 123 123 A H H X S+ 0 0 1 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.887 101.5 52.6 -75.7 -39.8 16.9 -9.8 -6.1 124 124 A V H X S+ 0 0 34 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.885 115.5 40.8 -60.2 -40.5 13.6 -11.0 -7.7 125 125 A S H X S+ 0 0 7 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.909 114.5 50.8 -77.8 -44.6 13.8 -14.4 -5.9 126 126 A L H X S+ 0 0 15 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.852 111.8 50.3 -59.0 -33.5 15.0 -12.9 -2.6 127 127 A D H X S+ 0 0 29 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.853 110.2 47.7 -74.2 -37.0 12.1 -10.4 -2.8 128 128 A K H X S+ 0 0 80 -4,-1.7 4,-1.3 -5,-0.2 -2,-0.2 0.919 114.2 48.9 -67.2 -39.1 9.5 -13.2 -3.5 129 129 A F H >X S+ 0 0 2 -4,-2.4 4,-2.0 2,-0.2 3,-0.7 0.969 110.0 49.7 -64.5 -56.1 11.0 -15.1 -0.6 130 130 A L H 3X S+ 0 0 3 -4,-2.9 4,-2.0 1,-0.3 -1,-0.2 0.840 110.7 49.9 -54.0 -36.5 10.9 -12.2 1.8 131 131 A S H 3X S+ 0 0 61 -4,-1.7 4,-2.0 2,-0.2 -1,-0.3 0.810 107.0 55.6 -69.0 -26.9 7.2 -11.5 0.9 132 132 A G H < S+ 0 0 5 -4,-1.8 3,-1.2 1,-0.2 4,-0.3 0.920 110.6 51.2 -72.8 -39.2 3.8 -16.5 6.7 137 137 A L H 3< S+ 0 0 20 -4,-3.2 3,-0.5 1,-0.2 -48,-0.4 0.793 105.7 55.8 -62.7 -28.1 4.2 -14.1 9.7 138 138 A A T >< S+ 0 0 33 -4,-1.6 3,-1.0 1,-0.2 4,-0.5 0.455 80.0 100.0 -84.1 -1.3 0.8 -12.6 9.1 139 139 A E T < S+ 0 0 81 -3,-1.2 3,-0.4 1,-0.2 -1,-0.2 0.869 79.5 46.0 -55.4 -40.5 -0.9 -16.0 9.3 140 140 A R T 3 S+ 0 0 84 -3,-0.5 -1,-0.2 -4,-0.3 -2,-0.1 0.584 86.0 88.4 -90.9 -3.3 -2.2 -15.7 12.9 141 141 A Y < 0 0 45 -3,-1.0 -1,-0.2 -4,-0.1 -2,-0.1 0.905 360.0 360.0 -56.4 -47.3 -3.7 -12.2 12.8 142 142 A R 0 0 294 -4,-0.5 -1,-0.1 -3,-0.4 -53,-0.0 -0.917 360.0 360.0-152.5 360.0 -7.2 -13.3 11.6 143 !* 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 0.0 144 1 B V 0 0 113 0, 0.0 2,-0.7 0, 0.0 80,-0.1 0.000 360.0 360.0 360.0 137.6 8.3 19.4 4.3 145 2 B E - 0 0 179 0, 0.0 2,-0.3 0, 0.0 77,-0.0 -0.906 360.0-163.0 -97.7 114.4 10.4 21.0 7.0 146 3 B W - 0 0 24 -2,-0.7 2,-0.2 4,-0.0 76,-0.0 -0.780 9.9-136.9-102.2 145.9 14.1 20.2 6.1 147 4 B T > - 0 0 69 -2,-0.3 4,-1.7 1,-0.1 5,-0.1 -0.534 23.6-118.5 -92.0 166.3 17.1 20.4 8.4 148 5 B D H > S+ 0 0 137 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.814 117.9 55.5 -73.4 -30.2 20.4 21.9 7.3 149 6 B K H > S+ 0 0 131 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.915 107.8 49.2 -65.9 -39.6 22.0 18.5 8.0 150 7 B E H > S+ 0 0 40 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.871 108.2 53.7 -65.6 -36.6 19.4 17.0 5.6 151 8 B R H X S+ 0 0 81 -4,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.888 110.7 46.3 -65.4 -40.6 20.1 19.6 2.9 152 9 B S H X S+ 0 0 79 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.875 112.6 48.6 -71.4 -41.3 23.8 18.9 3.0 153 10 B I H X S+ 0 0 23 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.966 113.3 47.3 -59.8 -53.1 23.4 15.1 2.9 154 11 B I H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.838 114.1 48.1 -62.4 -30.8 21.0 15.3 -0.0 155 12 B S H X S+ 0 0 64 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.900 110.4 50.0 -78.1 -42.9 23.3 17.7 -1.8 156 13 B D H X S+ 0 0 93 -4,-2.7 4,-1.4 2,-0.2 -2,-0.2 0.955 110.4 52.5 -56.6 -50.2 26.4 15.6 -1.3 157 14 B I H >X S+ 0 0 9 -4,-2.6 3,-1.0 1,-0.2 4,-0.8 0.948 113.0 41.2 -49.0 -61.5 24.6 12.5 -2.6 158 15 B F H >< S+ 0 0 7 -4,-1.8 3,-0.8 1,-0.3 -1,-0.2 0.872 110.1 59.6 -59.3 -35.3 23.4 14.0 -5.8 159 16 B S H 3< S+ 0 0 79 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.765 111.2 39.9 -71.3 -20.6 26.7 15.7 -6.3 160 17 B H H << S+ 0 0 150 -4,-1.4 -1,-0.3 -3,-1.0 2,-0.2 0.461 91.8 109.6-107.0 -0.2 28.6 12.4 -6.4 161 18 B M << - 0 0 19 -3,-0.8 2,-0.8 -4,-0.8 3,-0.1 -0.513 60.6-142.4 -76.4 136.1 26.1 10.4 -8.4 162 19 B D >> - 0 0 76 -2,-0.2 4,-2.7 1,-0.2 3,-1.3 -0.876 11.1-164.0 -96.4 110.2 26.8 9.2 -11.9 163 20 B Y H 3> S+ 0 0 32 -2,-0.8 4,-1.6 1,-0.3 -1,-0.2 0.806 86.5 59.7 -66.4 -30.0 23.4 9.5 -13.6 164 21 B D H 34 S+ 0 0 116 2,-0.2 -1,-0.3 1,-0.2 44,-0.1 0.566 114.6 36.8 -71.7 -15.8 24.6 7.3 -16.5 165 22 B D H <> S+ 0 0 48 -3,-1.3 4,-1.2 3,-0.1 -2,-0.2 0.790 120.5 40.5-102.5 -48.9 25.2 4.5 -14.1 166 23 B I H X S+ 0 0 1 -4,-2.7 4,-2.6 2,-0.2 5,-0.3 0.882 110.3 53.3 -73.4 -39.2 22.5 4.8 -11.5 167 24 B G H X S+ 0 0 2 -4,-1.6 4,-1.9 -5,-0.3 5,-0.2 0.905 110.0 44.9 -71.6 -43.3 19.5 5.5 -13.6 168 25 B P H > S+ 0 0 20 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.878 116.2 47.5 -66.2 -41.0 19.7 2.7 -16.1 169 26 B K H X S+ 0 0 110 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.867 111.8 49.7 -68.9 -39.4 20.4 0.2 -13.3 170 27 B A H X S+ 0 0 2 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.897 116.7 40.4 -64.4 -43.5 17.5 1.4 -11.1 171 28 B L H X S+ 0 0 5 -4,-1.9 4,-2.3 -5,-0.3 5,-0.2 0.960 114.3 52.4 -72.6 -48.2 15.0 1.3 -13.9 172 29 B S H X S+ 0 0 9 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.937 111.6 47.3 -45.0 -55.5 16.3 -2.0 -15.3 173 30 B R H X S+ 0 0 30 -4,-2.1 4,-3.3 1,-0.2 5,-0.3 0.839 110.0 52.5 -60.7 -37.2 16.0 -3.6 -11.9 174 31 B C H X S+ 0 0 5 -4,-1.6 4,-1.9 1,-0.2 7,-0.3 0.866 107.8 51.1 -70.5 -34.0 12.5 -2.3 -11.4 175 32 B L H < S+ 0 0 0 -4,-2.3 7,-0.3 2,-0.2 -2,-0.2 0.845 117.2 40.9 -72.9 -30.6 11.4 -3.7 -14.7 176 33 B V H < S+ 0 0 20 -4,-1.7 -2,-0.2 -5,-0.2 -3,-0.2 0.922 117.9 43.0 -78.1 -51.7 12.8 -7.1 -13.7 177 34 B V H < S+ 0 0 9 -4,-3.3 -3,-0.2 1,-0.3 -2,-0.2 0.879 130.6 26.4 -69.9 -31.9 11.8 -7.3 -10.0 178 35 B Y S >< S+ 0 0 29 -4,-1.9 3,-2.1 -5,-0.3 -1,-0.3 -0.711 75.2 177.0-131.6 79.5 8.3 -5.9 -10.7 179 36 B P G > + 0 0 62 0, 0.0 3,-1.2 0, 0.0 4,-0.3 0.596 69.2 73.3 -71.0 -15.8 7.6 -6.9 -14.3 180 37 B W G > S+ 0 0 149 1,-0.2 3,-1.2 2,-0.2 4,-0.2 0.747 85.5 70.8 -66.6 -21.0 4.1 -5.6 -14.5 181 38 B T G X S+ 0 0 8 -3,-2.1 3,-1.4 -7,-0.3 4,-0.3 0.751 81.6 72.5 -67.5 -21.4 5.7 -2.1 -14.6 182 39 B Q G X S+ 0 0 49 -3,-1.2 3,-1.3 -7,-0.3 -1,-0.2 0.761 83.3 72.7 -58.5 -25.4 7.0 -3.0 -18.1 183 40 B R G < S+ 0 0 196 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.767 87.5 58.3 -60.9 -28.2 3.3 -2.5 -19.2 184 41 B Y G < S+ 0 0 67 -3,-1.4 2,-1.0 -4,-0.2 -1,-0.3 0.672 88.4 84.7 -83.2 -12.9 3.4 1.3 -18.9 185 42 B F < - 0 0 54 -3,-1.3 2,-0.5 -4,-0.3 -1,-0.2 -0.703 62.6-171.1-101.9 85.7 6.3 1.6 -21.3 186 43 B S + 0 0 116 -2,-1.0 -3,-0.1 2,-0.1 -2,-0.0 -0.588 68.7 16.0 -75.4 115.4 4.8 1.6 -24.8 187 44 B G S S+ 0 0 71 -2,-0.5 -1,-0.1 2,-0.1 0, 0.0 0.724 75.9 126.7 76.2 101.4 7.5 1.4 -27.5 188 45 B F - 0 0 29 1,-0.0 2,-0.3 15,-0.0 14,-0.3 0.138 57.1-139.1-156.8 -25.3 10.7 0.2 -25.8 189 46 B G + 0 0 59 13,-0.1 2,-1.2 2,-0.0 -2,-0.1 -0.745 62.8 16.8 104.1-144.6 11.5 -2.8 -28.0 190 47 B N + 0 0 136 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 -0.592 58.1 161.4 -80.8 94.7 12.8 -6.3 -27.2 191 48 B L + 0 0 27 -2,-1.2 -1,-0.2 1,-0.1 6,-0.1 0.005 25.6 136.5-105.9 19.6 12.1 -6.6 -23.5 192 49 B Y - 0 0 205 3,-0.1 -1,-0.1 4,-0.1 2,-0.0 0.876 61.9 -8.5 -21.4-102.6 12.3 -10.4 -23.6 193 50 B N S > S- 0 0 86 -3,-0.1 4,-1.1 0, 0.0 5,-0.1 0.061 87.4 -77.7 -94.0-159.6 14.3 -11.8 -20.7 194 51 B A H > S+ 0 0 30 1,-0.2 4,-1.4 2,-0.2 -18,-0.1 0.772 127.5 49.4 -84.1 -31.6 16.4 -10.2 -17.9 195 52 B E H > S+ 0 0 114 2,-0.2 4,-0.5 3,-0.1 -1,-0.2 0.502 105.6 59.8 -89.6 -1.7 19.5 -9.5 -20.1 196 53 B G H >> S+ 0 0 18 2,-0.1 3,-1.9 -5,-0.1 4,-0.7 0.938 110.6 40.0 -72.1 -72.6 17.4 -7.9 -22.8 197 54 B I H >< S+ 0 0 4 -4,-1.1 3,-0.7 1,-0.3 -2,-0.2 0.761 110.7 60.8 -36.6 -43.9 16.1 -5.3 -20.3 198 55 B M H 3< S+ 0 0 57 -4,-1.4 -1,-0.3 1,-0.3 -2,-0.1 0.777 117.3 27.1 -68.1 -28.3 19.6 -4.9 -18.7 199 56 B S H << S+ 0 0 83 -3,-1.9 2,-0.6 -4,-0.5 -1,-0.3 0.202 85.6 127.4-120.1 13.1 21.3 -3.8 -21.9 200 57 B N XX - 0 0 22 -3,-0.7 4,-1.9 -4,-0.7 3,-0.6 -0.625 50.6-152.2 -70.7 114.9 18.3 -2.2 -23.7 201 58 B A H 3> S+ 0 0 76 -2,-0.6 4,-2.5 1,-0.2 -1,-0.2 0.736 92.2 58.6 -64.5 -23.0 19.5 1.3 -24.6 202 59 B N H 3> S+ 0 0 90 -14,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.825 106.2 46.7 -74.9 -35.9 15.9 2.7 -24.5 203 60 B V H <> S+ 0 0 0 -3,-0.6 4,-1.4 2,-0.2 -2,-0.2 0.868 114.0 50.1 -69.9 -41.6 15.5 1.6 -20.9 204 61 B A H >X S+ 0 0 30 -4,-1.9 4,-1.9 2,-0.2 3,-1.1 0.976 108.2 50.9 -60.2 -58.0 18.9 3.2 -20.1 205 62 B A H 3X S+ 0 0 51 -4,-2.5 4,-1.4 1,-0.3 3,-0.3 0.913 114.0 46.5 -42.1 -51.9 18.0 6.4 -21.9 206 63 B H H 3X S+ 0 0 50 -4,-1.8 4,-1.3 1,-0.2 -1,-0.3 0.743 103.1 61.2 -69.6 -23.8 14.9 6.5 -19.8 207 64 B G H X S+ 0 0 11 -4,-0.7 4,-1.6 -3,-0.5 3,-0.6 0.743 100.2 67.3 -86.8 -31.3 14.8 14.0 -9.3 215 72 B D H 3X S+ 0 0 26 -4,-1.3 4,-1.4 1,-0.3 -2,-0.2 0.867 96.3 55.6 -56.7 -40.0 17.5 16.5 -9.8 216 73 B R H 3< S+ 0 0 78 -4,-0.9 4,-0.4 1,-0.2 -1,-0.3 0.818 106.2 48.5 -66.5 -31.7 14.9 19.2 -10.1 217 74 B G H <4 S+ 0 0 0 -3,-0.6 3,-0.4 -4,-0.4 -1,-0.2 0.815 108.2 55.9 -80.3 -25.8 13.3 18.5 -6.8 218 75 B M H >< S+ 0 0 39 -4,-1.6 3,-0.6 1,-0.2 -2,-0.2 0.847 106.5 50.5 -68.0 -35.1 16.7 18.5 -5.1 219 76 B K T 3< S+ 0 0 146 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.585 120.2 35.5 -79.4 -11.8 17.3 22.0 -6.5 220 77 B N T > + 0 0 75 -3,-0.4 3,-1.4 -4,-0.4 -1,-0.2 -0.390 67.4 155.0-140.5 58.5 14.0 23.2 -5.1 221 78 B M G X S+ 0 0 14 -3,-0.6 3,-0.6 1,-0.3 4,-0.1 0.667 71.8 56.0 -68.6 -18.1 13.3 21.5 -1.8 222 79 B D G 3 S+ 0 0 118 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.562 118.5 35.4 -87.9 -9.9 11.0 24.0 -0.2 223 80 B N G <> S+ 0 0 70 -3,-1.4 4,-1.4 -6,-0.2 -1,-0.2 -0.207 71.2 134.3-137.3 41.3 8.7 23.8 -3.2 224 81 B I H X> S+ 0 0 10 -3,-0.6 4,-0.9 1,-0.2 3,-0.8 0.977 70.4 59.6 -59.0 -52.7 8.9 20.1 -4.2 225 82 B A H 34 S+ 0 0 36 1,-0.3 3,-0.5 2,-0.2 -1,-0.2 0.825 110.0 39.2 -44.4 -46.0 5.1 19.8 -4.6 226 83 B D H >4 S+ 0 0 105 1,-0.2 3,-1.0 -3,-0.2 -1,-0.3 0.692 105.3 63.3 -89.3 -18.3 4.8 22.5 -7.3 227 84 B A H << S+ 0 0 19 -4,-1.4 4,-0.3 -3,-0.8 -1,-0.2 0.626 104.0 54.3 -74.9 -9.0 7.9 21.7 -9.3 228 85 B Y T 3X S+ 0 0 2 -4,-0.9 4,-2.6 -3,-0.5 -1,-0.2 0.124 72.3 101.7-112.4 23.2 6.3 18.4 -10.0 229 86 B T H <> S+ 0 0 57 -3,-1.0 4,-1.4 2,-0.2 5,-0.2 0.900 83.5 50.7 -73.5 -42.3 2.9 19.4 -11.5 230 87 B D H >> S+ 0 0 84 -4,-0.3 4,-2.0 2,-0.2 3,-0.6 0.988 119.3 36.6 -53.7 -61.1 4.0 18.7 -15.0 231 88 B L H 3> S+ 0 0 38 -4,-0.3 4,-3.0 1,-0.2 5,-0.3 0.901 114.1 55.6 -61.3 -46.5 5.2 15.2 -14.1 232 89 B S H 3X S+ 0 0 1 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.818 110.3 48.2 -55.1 -27.6 2.5 14.5 -11.6 233 90 B T H << S+ 0 0 55 -4,-1.4 5,-0.3 -3,-0.6 6,-0.2 0.900 113.1 44.5 -86.8 -41.6 -0.1 15.3 -14.4 234 91 B L H >X>S+ 0 0 69 -4,-2.0 4,-1.5 3,-0.2 5,-1.3 0.933 119.2 43.4 -61.5 -48.1 1.5 13.1 -17.1 235 92 B H H 3<5S+ 0 0 49 -4,-3.0 6,-1.7 1,-0.2 -2,-0.2 0.880 122.8 33.7 -74.0 -35.9 2.0 10.2 -14.6 236 93 B S T 3<5S+ 0 0 17 -4,-1.7 -1,-0.2 -5,-0.3 52,-0.2 -0.065 134.6 19.9-115.5 35.6 -1.3 10.3 -12.8 237 94 B E T <45S+ 0 0 94 -3,-0.8 -3,-0.2 -4,-0.1 -2,-0.2 0.297 128.8 35.8-172.0 -9.3 -3.6 11.4 -15.7 238 95 B K T <5S+ 0 0 150 -4,-1.5 -3,-0.2 -5,-0.3 -4,-0.1 0.577 132.0 26.6-121.4 -15.8 -2.0 10.8 -19.0 239 96 B L S - 0 0 73 -2,-0.3 3,-2.7 1,-0.2 4,-0.4 -0.388 19.8-126.3 -62.5 129.2 -0.8 3.5 -10.1 243 100 B P T >> S+ 0 0 69 0, 0.0 3,-1.3 0, 0.0 4,-1.0 0.766 104.9 70.6 -42.6 -34.2 0.7 5.5 -7.3 244 101 B D H 3> S+ 0 0 119 1,-0.3 4,-1.1 2,-0.2 3,-0.1 0.805 91.0 62.2 -61.4 -26.1 2.1 2.3 -5.6 245 102 B N H <> S+ 0 0 17 -3,-2.7 4,-2.1 2,-0.2 -1,-0.3 0.762 91.2 60.6 -74.2 -25.5 4.6 2.0 -8.5 246 103 B F H <> S+ 0 0 19 -3,-1.3 4,-2.3 -4,-0.4 -1,-0.2 0.886 105.6 53.3 -66.9 -34.7 6.5 5.3 -7.8 247 104 B K H X S+ 0 0 74 -4,-1.0 4,-1.6 2,-0.2 -1,-0.2 0.854 106.3 50.9 -63.3 -38.0 7.2 3.7 -4.5 248 105 B L H X S+ 0 0 29 -4,-1.1 4,-1.9 2,-0.2 -2,-0.2 0.954 112.4 45.0 -66.4 -48.9 8.6 0.6 -6.1 249 106 B L H X S+ 0 0 38 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.904 110.4 54.4 -62.3 -42.9 11.0 2.5 -8.4 250 107 B S H X S+ 0 0 7 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.881 106.4 52.7 -59.1 -37.1 12.1 4.7 -5.5 251 108 B D H X S+ 0 0 19 -4,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.919 109.0 50.1 -66.4 -37.6 12.9 1.5 -3.6 252 109 B C H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 5,-0.3 0.851 107.0 53.0 -67.6 -36.8 15.0 0.3 -6.6 253 110 B I H X S+ 0 0 5 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.934 110.4 49.3 -60.1 -45.4 16.9 3.6 -6.8 254 111 B T H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.913 111.0 48.8 -57.8 -44.8 17.7 3.3 -3.1 255 112 B I H X S+ 0 0 3 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.910 114.3 45.0 -64.2 -42.3 19.0 -0.3 -3.5 256 113 B V H X S+ 0 0 10 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.901 113.8 50.1 -69.0 -41.3 21.2 0.6 -6.5 257 114 B L H X S+ 0 0 3 -4,-2.9 4,-2.4 -5,-0.3 5,-0.3 0.908 107.9 53.9 -65.1 -35.0 22.5 3.7 -4.7 258 115 B A H X S+ 0 0 0 -4,-2.7 4,-1.5 -5,-0.2 7,-0.2 0.874 107.9 50.4 -65.1 -31.3 23.2 1.5 -1.6 259 116 B A H < S+ 0 0 32 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.793 113.3 46.4 -77.9 -24.5 25.3 -0.9 -3.7 260 117 B K H < S+ 0 0 84 -4,-1.5 -2,-0.2 -3,-0.1 -1,-0.2 0.924 118.8 37.6 -79.0 -49.6 27.3 2.0 -5.2 261 118 B M H >< S- 0 0 60 -4,-2.4 3,-1.9 1,-0.2 -2,-0.2 0.690 85.7-178.5 -76.4 -20.7 28.0 3.9 -2.0 262 119 B G G >< + 0 0 17 -4,-1.5 3,-1.8 1,-0.3 -1,-0.2 -0.267 69.1 0.1 58.6-130.0 28.6 0.9 0.2 263 120 B H G 3 S+ 0 0 143 1,-0.3 -1,-0.3 -151,-0.2 -2,-0.1 0.693 124.8 70.8 -64.9 -17.4 29.4 1.7 3.8 264 121 B A G < S+ 0 0 60 -3,-1.9 2,-1.9 1,-0.2 -1,-0.3 0.676 78.5 83.6 -72.4 -17.9 29.1 5.4 3.1 265 122 B F S < S+ 0 0 0 -3,-1.8 -1,-0.2 -7,-0.2 -3,-0.1 -0.464 74.2 177.5 -86.7 70.1 25.3 4.9 2.7 266 123 B T > - 0 0 55 -2,-1.9 4,-4.0 1,-0.1 5,-0.3 0.012 45.6-100.3 -71.5 170.9 24.7 5.1 6.4 267 124 B A H > S+ 0 0 16 2,-0.2 4,-2.8 1,-0.2 5,-0.1 0.960 125.7 46.5 -57.8 -46.8 21.4 4.9 8.3 268 125 B E H > S+ 0 0 97 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.951 113.1 49.2 -64.8 -46.0 21.3 8.7 8.6 269 126 B T H > S+ 0 0 18 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.962 113.2 48.1 -52.9 -49.8 22.2 9.1 4.9 270 127 B Q H X S+ 0 0 0 -4,-4.0 4,-2.4 1,-0.2 5,-0.3 0.917 108.1 55.6 -59.2 -38.4 19.5 6.6 4.1 271 128 B G H X S+ 0 0 22 -4,-2.8 4,-1.6 -5,-0.3 -1,-0.2 0.878 110.3 44.0 -63.5 -39.0 17.1 8.5 6.4 272 129 B A H X S+ 0 0 4 -4,-2.0 4,-2.5 -3,-0.3 -2,-0.2 0.932 114.1 48.9 -69.5 -51.1 17.6 11.8 4.5 273 130 B F H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.888 111.7 51.0 -56.7 -38.0 17.4 10.3 1.0 274 131 B Q H X S+ 0 0 23 -4,-2.4 4,-2.5 -5,-0.3 5,-0.2 0.923 108.1 50.4 -68.2 -43.7 14.2 8.4 2.0 275 132 B K H X S+ 0 0 65 -4,-1.6 4,-1.4 -5,-0.3 -2,-0.2 0.940 111.4 51.3 -58.0 -43.4 12.6 11.6 3.3 276 133 B F H >X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 3,-0.5 0.974 112.6 43.1 -55.1 -58.6 13.5 13.3 -0.0 277 134 B L H 3X S+ 0 0 4 -4,-2.5 4,-3.3 1,-0.3 5,-0.3 0.847 108.9 57.1 -60.9 -36.1 12.0 10.5 -2.2 278 135 B A H 3X S+ 0 0 52 -4,-2.5 4,-1.8 -5,-0.2 -1,-0.3 0.869 108.9 49.0 -64.6 -31.1 8.8 10.2 -0.0 279 136 B A H < S+ 0 0 18 -4,-1.2 3,-0.6 -3,-0.5 -2,-0.2 0.720 89.9 101.7 -98.3 -26.0 0.6 11.4 -7.1 286 143 B K T 3< + 0 0 104 -4,-1.6 -1,-0.1 -5,-0.3 -2,-0.1 0.597 67.2 73.3 -28.1 -38.0 -0.6 14.7 -5.7 287 144 B Q T 3 S+ 0 0 67 -4,-0.3 2,-0.4 -3,-0.2 -1,-0.2 0.961 98.0 24.1 -56.3 -72.3 -2.7 15.4 -8.8 288 145 B Y < 0 0 120 -3,-0.6 -1,-0.1 -56,-0.2 -51,-0.0 -0.779 360.0 360.0-115.7 144.9 -5.8 13.1 -8.6 289 146 B H 0 0 250 -2,-0.4 -1,-0.1 -3,-0.0 -3,-0.0 0.321 360.0 360.0-113.1 360.0 -7.6 11.3 -5.8