==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN TRANSPORT 07-AUG-79 2HCO . COMPND 2 MOLECULE: HEMOGLOBIN (CARBONMONOXY) (ALPHA CHAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.M.BALDWIN . 287 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14542.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 211 73.5 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 . 9 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 48 16.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 148 51.6 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 3 0 0 0 2 0 0 1 0 0 0 2 0 1 5 0 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 V 0 0 184 0, 0.0 2,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-140.7 5.9 17.0 7.2 2 2 A L - 0 0 35 71,-0.1 5,-0.1 4,-0.1 122,-0.0 -0.627 360.0-151.7 -84.2 77.9 9.3 17.7 5.6 3 3 A S >> - 0 0 42 -2,-1.9 4,-2.5 1,-0.1 3,-1.2 0.076 26.9 -97.1 -48.4 157.2 10.8 19.4 8.6 4 4 A P T 34 S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.663 126.4 43.7 -42.5 -27.9 13.5 22.1 8.7 5 5 A A T 3> S+ 0 0 55 2,-0.2 4,-1.3 3,-0.1 5,-0.1 0.657 107.5 53.9-105.0 -16.8 16.0 19.4 9.3 6 6 A D H <> S+ 0 0 22 -3,-1.2 4,-1.7 2,-0.2 5,-0.2 0.907 105.4 57.5 -78.4 -35.2 14.9 16.8 6.8 7 7 A K H X S+ 0 0 72 -4,-2.5 4,-0.9 1,-0.2 -1,-0.2 0.661 108.3 49.5 -61.0 -17.2 15.2 19.5 4.3 8 8 A T H > S+ 0 0 78 -5,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.812 105.3 52.2 -98.2 -30.1 18.8 19.7 5.5 9 9 A N H X S+ 0 0 47 -4,-1.3 4,-1.9 -3,-0.2 -2,-0.2 0.778 113.2 46.5 -75.7 -24.8 19.7 16.0 5.3 10 10 A V H X S+ 0 0 5 -4,-1.7 4,-2.1 2,-0.2 5,-0.3 0.890 108.5 52.4 -85.6 -36.2 18.5 15.9 1.7 11 11 A K H < S+ 0 0 100 -4,-0.9 -2,-0.2 -5,-0.2 4,-0.2 0.787 119.3 40.3 -69.7 -17.8 20.2 19.0 0.5 12 12 A A H X S+ 0 0 55 -4,-1.0 4,-1.6 2,-0.2 -1,-0.2 0.818 112.6 49.7 -94.5 -41.7 23.3 17.5 2.0 13 13 A A H < S+ 0 0 6 -4,-1.9 4,-0.4 1,-0.2 -2,-0.2 0.868 117.5 42.1 -70.4 -31.4 23.0 13.8 1.0 14 14 A W T X S+ 0 0 31 -4,-2.1 4,-1.5 2,-0.2 3,-0.3 0.764 104.9 70.7 -81.8 -22.7 22.3 14.8 -2.6 15 15 A G T 4 S+ 0 0 51 -5,-0.3 3,-0.4 1,-0.3 -2,-0.2 0.925 104.9 36.6 -59.4 -45.5 25.1 17.4 -2.2 16 16 A K T < S+ 0 0 148 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.585 106.1 67.6 -90.3 -1.2 27.7 14.7 -2.1 17 17 A V T >4 S+ 0 0 1 -4,-0.4 3,-1.9 -3,-0.3 -1,-0.2 0.862 77.2 125.0 -81.4 -23.9 25.9 12.6 -4.7 18 18 A G G >< + 0 0 43 -4,-1.5 3,-1.8 -3,-0.4 -1,-0.2 0.184 64.9 29.0 13.8-111.1 26.7 15.4 -7.1 19 19 A A G 3 S+ 0 0 103 1,-0.3 -1,-0.3 -3,-0.1 3,-0.2 0.462 121.9 53.1 -49.7 -19.9 28.6 14.4 -10.3 20 20 A H G X> + 0 0 82 -3,-1.9 4,-1.9 1,-0.1 3,-1.2 0.381 68.2 109.9-102.9 -7.8 27.1 10.9 -10.2 21 21 A A H <> S+ 0 0 14 -3,-1.8 4,-2.1 1,-0.3 5,-0.2 0.822 81.6 50.5 -44.9 -37.0 23.4 11.6 -10.1 22 22 A G H 3> S+ 0 0 23 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.793 109.9 48.3 -75.3 -31.1 22.9 10.4 -13.6 23 23 A E H <> S+ 0 0 125 -3,-1.2 4,-1.0 1,-0.2 -1,-0.2 0.776 114.2 48.7 -74.4 -29.9 24.8 7.1 -13.1 24 24 A Y H X S+ 0 0 18 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.855 105.7 54.0 -79.9 -38.7 22.8 6.5 -10.0 25 25 A G H < S+ 0 0 2 -4,-2.1 4,-0.3 1,-0.2 -1,-0.2 0.686 113.1 46.4 -67.5 -20.1 19.4 7.3 -11.4 26 26 A A H X S+ 0 0 10 -4,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.708 106.9 55.7 -95.7 -24.2 20.1 4.7 -14.1 27 27 A E H X S+ 0 0 36 -4,-1.0 4,-1.7 1,-0.2 -2,-0.2 0.874 108.0 51.0 -72.5 -32.5 21.4 2.1 -11.6 28 28 A A H X S+ 0 0 0 -4,-2.0 4,-1.3 2,-0.2 -1,-0.2 0.707 106.4 52.6 -81.8 -16.4 18.1 2.4 -9.8 29 29 A L H > S+ 0 0 3 -4,-0.3 4,-2.9 2,-0.2 3,-0.4 0.956 108.7 51.1 -76.0 -46.2 16.1 1.9 -12.9 30 30 A E H X S+ 0 0 35 -4,-1.9 4,-1.1 1,-0.3 -2,-0.2 0.845 110.5 50.3 -55.4 -37.6 18.1 -1.3 -13.6 31 31 A R H X S+ 0 0 3 -4,-1.7 4,-2.5 2,-0.2 5,-0.3 0.854 111.4 46.8 -70.2 -38.3 17.4 -2.4 -10.1 32 32 A M H X S+ 0 0 9 -4,-1.3 4,-2.0 -3,-0.4 7,-0.3 0.899 112.1 49.8 -72.0 -39.6 13.7 -1.8 -10.4 33 33 A F H < S+ 0 0 3 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.752 117.7 42.2 -69.5 -25.1 13.4 -3.5 -13.7 34 34 A L H < S+ 0 0 62 -4,-1.1 -2,-0.2 -5,-0.3 -1,-0.2 0.874 120.6 36.0 -87.8 -48.2 15.3 -6.5 -12.3 35 35 A S H < S+ 0 0 9 -4,-2.5 -3,-0.2 1,-0.3 -2,-0.2 0.878 128.0 31.6 -77.2 -44.6 13.7 -6.9 -8.9 36 36 A F >< - 0 0 43 -4,-2.0 3,-1.6 -5,-0.3 -1,-0.3 -0.790 69.2-179.9-118.2 81.2 10.1 -6.0 -9.7 37 37 A P G > + 0 0 74 0, 0.0 3,-1.4 0, 0.0 4,-0.2 0.513 67.9 82.7 -64.5 -10.4 9.7 -7.2 -13.3 38 38 A T G 3 S+ 0 0 99 1,-0.3 3,-0.3 2,-0.1 -5,-0.1 0.506 82.8 63.3 -74.4 -2.9 6.0 -6.0 -13.3 39 39 A T G X S+ 0 0 4 -3,-1.6 3,-1.3 -7,-0.3 4,-0.3 0.493 78.3 82.3 -96.2 -7.7 7.3 -2.5 -14.1 40 40 A K G X S+ 0 0 84 -3,-1.4 3,-1.6 1,-0.3 6,-0.2 0.740 70.9 84.2 -69.7 -19.1 8.8 -3.5 -17.4 41 41 A T G 3 S+ 0 0 103 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.677 88.3 51.0 -48.5 -30.3 5.3 -3.1 -18.9 42 42 A Y G < S+ 0 0 70 -3,-1.3 -1,-0.3 1,-0.2 3,-0.2 0.604 106.6 50.7 -95.2 -14.4 5.8 0.7 -19.3 43 43 A F X + 0 0 40 -3,-1.6 3,-1.5 -4,-0.3 -1,-0.2 -0.407 57.6 141.1-119.7 59.8 9.1 0.6 -21.1 44 44 A P T 3 S+ 0 0 111 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.570 75.7 57.6 -74.9 -12.0 8.5 -1.8 -24.1 45 45 A H T 3 S+ 0 0 128 -3,-0.2 2,-0.4 2,-0.1 -2,-0.1 0.291 94.0 87.2-103.9 8.2 10.6 0.5 -26.2 46 46 A F S < S- 0 0 30 -3,-1.5 2,-0.8 -6,-0.2 -3,-0.1 -0.885 80.9-126.8-105.4 147.0 13.6 0.3 -24.0 47 47 A D - 0 0 87 -2,-0.4 8,-0.4 1,-0.1 7,-0.2 -0.706 25.1-161.6 -78.0 102.5 16.3 -2.2 -24.1 48 48 A L + 0 0 48 -2,-0.8 -1,-0.1 -4,-0.1 2,-0.1 0.065 49.8 124.8 -83.5 33.3 15.9 -3.1 -20.4 49 49 A S S S- 0 0 56 1,-0.1 3,-0.5 0, 0.0 6,-0.2 -0.339 75.5-107.5 -94.1 158.3 19.3 -4.6 -20.7 50 50 A H S S+ 0 0 144 1,-0.2 -20,-0.1 -2,-0.1 -1,-0.1 0.884 115.7 38.8 -56.3 -45.9 22.3 -3.7 -18.5 51 51 A G S S+ 0 0 52 4,-0.0 -1,-0.2 5,-0.0 5,-0.1 0.548 84.7 143.0 -82.5 -13.3 24.4 -1.7 -21.0 52 52 A S > - 0 0 7 -3,-0.5 4,-2.0 1,-0.2 3,-0.4 -0.100 44.7-153.8 -43.6 118.8 21.3 -0.0 -22.5 53 53 A A H > S+ 0 0 75 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.640 93.6 60.4 -62.6 -21.5 21.9 3.6 -23.5 54 54 A Q H > S+ 0 0 87 2,-0.2 4,-1.1 -7,-0.2 -1,-0.2 0.916 107.5 41.1 -78.0 -42.3 18.2 4.2 -23.1 55 55 A V H > S+ 0 0 9 -8,-0.4 4,-1.3 -3,-0.4 -2,-0.2 0.865 117.7 49.7 -71.9 -30.3 18.1 3.3 -19.4 56 56 A K H X S+ 0 0 116 -4,-2.0 4,-1.0 1,-0.2 -2,-0.2 0.858 112.3 47.6 -77.6 -28.8 21.4 5.1 -19.0 57 57 A G H X S+ 0 0 36 -4,-1.5 4,-0.5 1,-0.2 -1,-0.2 0.693 111.9 50.3 -80.8 -22.5 19.9 8.1 -20.8 58 58 A H H X S+ 0 0 49 -4,-1.1 4,-2.3 2,-0.2 5,-0.2 0.710 97.3 66.9 -90.0 -19.5 16.8 8.0 -18.7 59 59 A G H X S+ 0 0 0 -4,-1.3 4,-2.6 1,-0.3 5,-0.2 0.922 98.1 55.7 -64.4 -37.8 18.8 7.8 -15.5 60 60 A K H X S+ 0 0 140 -4,-1.0 4,-1.0 1,-0.2 -1,-0.3 0.816 108.3 47.8 -60.0 -36.7 19.8 11.3 -16.3 61 61 A K H X S+ 0 0 135 -4,-0.5 4,-1.7 2,-0.2 -1,-0.2 0.886 111.3 46.8 -75.7 -41.9 16.2 12.4 -16.6 62 62 A V H X S+ 0 0 30 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.926 115.3 48.9 -66.4 -35.3 15.0 10.9 -13.3 63 63 A A H X S+ 0 0 0 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.725 108.2 53.4 -75.1 -25.4 18.1 12.4 -11.7 64 64 A D H X S+ 0 0 112 -4,-1.0 4,-1.6 -5,-0.2 -1,-0.2 0.839 110.8 46.6 -76.0 -32.9 17.4 15.8 -13.2 65 65 A A H < S+ 0 0 34 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.770 109.0 54.3 -81.9 -22.5 13.9 15.7 -11.8 66 66 A L H >X S+ 0 0 12 -4,-1.6 4,-2.0 2,-0.2 3,-1.0 0.881 108.7 49.7 -74.2 -36.8 15.0 14.6 -8.4 67 67 A T H 3X S+ 0 0 58 -4,-1.3 4,-2.9 1,-0.3 -2,-0.2 0.891 105.6 55.6 -67.0 -38.3 17.4 17.6 -8.3 68 68 A N H 3< S+ 0 0 71 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.434 111.0 46.8 -83.4 11.8 14.7 20.0 -9.3 69 69 A A H <4 S+ 0 0 1 -3,-1.0 -1,-0.2 -5,-0.1 -2,-0.2 0.696 107.8 53.6-111.9 -32.6 12.8 18.6 -6.3 70 70 A V H >< S+ 0 0 13 -4,-2.0 3,-0.7 1,-0.2 2,-0.6 0.920 113.4 48.1 -67.0 -38.1 15.7 18.9 -3.9 71 71 A A T 3< S+ 0 0 53 -4,-2.9 -1,-0.2 1,-0.2 0, 0.0 -0.927 121.1 27.5-108.7 113.2 16.0 22.5 -5.0 72 72 A H T > S+ 0 0 112 -2,-0.6 3,-1.8 6,-0.0 -1,-0.2 0.553 79.9 143.0 104.7 18.7 12.4 23.9 -4.8 73 73 A V G X + 0 0 19 -3,-0.7 3,-0.6 1,-0.3 -2,-0.1 0.735 63.3 63.5 -63.2 -19.6 11.6 21.4 -2.0 74 74 A D G 3 S+ 0 0 118 1,-0.3 -1,-0.3 -4,-0.1 -4,-0.1 0.359 116.6 31.6 -84.7 9.0 9.5 23.9 -0.2 75 75 A D G <> + 0 0 67 -3,-1.8 4,-1.2 -6,-0.2 -1,-0.3 -0.358 64.9 153.2-164.3 61.6 7.3 23.9 -3.3 76 76 A M H <> + 0 0 9 -3,-0.6 4,-2.5 1,-0.2 5,-0.2 0.930 69.1 66.0 -58.4 -49.4 7.3 20.5 -5.0 77 77 A P H 4 S+ 0 0 88 0, 0.0 4,-0.2 0, 0.0 -1,-0.2 0.833 105.4 40.5 -39.5 -54.7 3.7 20.9 -6.5 78 78 A N H >4 S+ 0 0 118 1,-0.2 3,-0.8 2,-0.1 4,-0.2 0.897 117.9 46.5 -69.9 -41.4 4.7 23.8 -8.8 79 79 A A H 3< S+ 0 0 32 -4,-1.2 3,-0.3 -7,-0.2 -1,-0.2 0.843 115.8 40.7 -70.4 -41.4 8.0 22.4 -9.9 80 80 A L T >X S+ 0 0 7 -4,-2.5 3,-0.9 1,-0.2 4,-0.8 0.228 81.8 117.8 -94.3 10.8 7.1 18.8 -10.7 81 81 A S T <4 S+ 0 0 72 -3,-0.8 3,-0.3 1,-0.2 -1,-0.2 0.805 72.3 45.8 -46.1 -53.5 3.8 19.7 -12.4 82 82 A A T 3> S+ 0 0 73 -3,-0.3 4,-1.2 1,-0.3 3,-0.4 0.675 113.2 51.1 -78.1 -9.4 4.4 18.5 -15.9 83 83 A L H <> S+ 0 0 64 -3,-0.9 4,-1.4 1,-0.2 -1,-0.3 0.593 105.7 57.5 -94.3 -12.8 5.8 15.2 -14.6 84 84 A S H < S+ 0 0 12 -4,-0.8 55,-0.3 -3,-0.3 -1,-0.2 0.117 112.5 39.6-103.8 23.8 2.7 15.0 -12.5 85 85 A D H >>S+ 0 0 84 -3,-0.4 4,-2.1 -5,-0.1 5,-1.9 0.430 113.2 54.1-133.6 -31.8 0.6 15.1 -15.6 86 86 A L H <>S+ 0 0 61 -4,-1.2 5,-2.4 3,-0.2 6,-0.3 0.971 117.2 35.8 -67.4 -52.7 2.8 13.0 -17.7 87 87 A H T <5S+ 0 0 50 -4,-1.4 6,-2.3 3,-0.2 5,-0.3 0.739 127.8 37.5 -72.0 -27.9 2.9 10.1 -15.3 88 88 A A T 45S+ 0 0 5 4,-0.2 -2,-0.2 3,-0.2 -1,-0.2 0.776 131.1 19.8-101.4 -29.4 -0.7 10.6 -14.1 89 89 A H T <5S+ 0 0 93 -4,-2.1 -3,-0.2 3,-0.0 -2,-0.1 0.847 131.6 33.2-102.0 -56.9 -2.6 11.6 -17.2 90 90 A K T - 0 0 82 -2,-0.4 3,-2.7 1,-0.2 4,-0.3 -0.515 24.9-131.9 -62.2 120.7 0.1 2.6 -11.0 95 95 A P T >> S+ 0 0 60 0, 0.0 4,-0.7 0, 0.0 3,-0.6 0.560 101.2 73.0 -57.2 -9.9 1.1 4.6 -7.9 96 96 A V H 3> S+ 0 0 72 1,-0.2 4,-0.8 2,-0.2 3,-0.1 0.735 87.2 64.4 -79.2 -13.7 2.5 1.5 -6.2 97 97 A N H <> S+ 0 0 16 -3,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.729 91.5 63.2 -77.6 -22.6 5.4 1.6 -8.6 98 98 A F H <> S+ 0 0 19 -3,-0.6 4,-2.4 -4,-0.3 -1,-0.2 0.895 99.5 53.7 -71.1 -33.4 6.5 4.9 -7.1 99 99 A K H X S+ 0 0 126 -4,-0.7 4,-1.0 1,-0.2 -1,-0.2 0.825 109.9 48.9 -62.1 -38.2 7.1 3.1 -3.8 100 100 A L H X S+ 0 0 32 -4,-0.8 4,-2.3 2,-0.2 -1,-0.2 0.886 110.9 46.3 -74.6 -40.2 9.3 0.6 -5.6 101 101 A L H X S+ 0 0 38 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.916 110.1 55.7 -71.3 -33.7 11.4 3.1 -7.4 102 102 A S H X S+ 0 0 16 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.813 109.5 48.5 -61.7 -33.1 11.8 5.1 -4.2 103 103 A H H X S+ 0 0 13 -4,-1.0 4,-1.9 2,-0.2 -1,-0.2 0.912 110.6 46.8 -78.0 -40.5 13.1 1.9 -2.6 104 104 A C H X S+ 0 0 0 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.867 109.3 57.4 -67.0 -32.7 15.6 1.1 -5.3 105 105 A L H X S+ 0 0 13 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.881 108.1 46.3 -65.0 -36.5 16.7 4.7 -5.2 106 106 A L H X S+ 0 0 2 -4,-1.2 4,-2.5 2,-0.2 -1,-0.2 0.833 107.4 55.8 -77.1 -30.2 17.5 4.3 -1.5 107 107 A V H X S+ 0 0 0 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.776 110.2 49.2 -74.3 -15.0 19.3 1.0 -2.1 108 108 A T H X S+ 0 0 1 -4,-1.2 4,-0.7 2,-0.2 -2,-0.2 0.870 108.3 48.6 -91.6 -34.3 21.4 3.0 -4.5 109 109 A L H >X S+ 0 0 8 -4,-2.0 4,-1.6 1,-0.2 3,-0.9 0.958 115.2 49.3 -66.7 -41.4 22.2 5.9 -2.2 110 110 A A H 3< S+ 0 0 1 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.833 108.2 51.0 -57.0 -49.6 23.1 3.2 0.3 111 111 A A H 3< S+ 0 0 6 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.584 121.4 32.8 -75.5 -7.7 25.3 1.2 -1.9 112 112 A H H << S+ 0 0 43 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.500 121.2 42.4-120.1 -13.6 27.3 4.2 -3.0 113 113 A L X + 0 0 18 -4,-1.6 4,-0.9 -5,-0.1 3,-0.2 -0.498 57.3 161.3-136.5 72.7 27.4 6.5 0.1 114 114 A P T 4 S+ 0 0 81 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.683 75.0 45.1 -71.5 -28.0 28.0 4.5 3.4 115 115 A A T 4 S+ 0 0 82 1,-0.2 3,-0.1 3,-0.0 -2,-0.0 0.789 115.8 45.3 -89.2 -29.8 29.1 7.3 5.8 116 116 A E T 4 S+ 0 0 49 -3,-0.2 2,-2.2 1,-0.2 -1,-0.2 0.566 93.8 85.2 -69.3 -39.9 26.4 9.8 4.8 117 117 A F < + 0 0 4 -4,-0.9 -1,-0.2 -7,-0.1 -4,-0.0 -0.489 60.5 158.5 -79.2 65.8 23.8 7.2 4.9 118 118 A T >> - 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0 0 43 -2,-1.8 4,-1.4 1,-0.1 3,-1.2 -0.446 42.4-102.4 -70.9 150.9 24.9 -5.8 -7.8 266 124 B P H 3> S+ 0 0 14 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.800 121.3 48.9 -42.0 -45.8 21.3 -5.4 -9.1 267 125 B P H 3> S+ 0 0 70 0, 0.0 4,-0.8 0, 0.0 -115,-0.1 0.774 111.1 52.8 -72.4 -19.3 20.7 -9.1 -10.0 268 126 B V H <> S+ 0 0 25 -3,-1.2 4,-0.6 2,-0.2 -4,-0.1 0.759 112.0 45.1 -87.9 -15.2 22.1 -10.0 -6.6 269 127 B Q H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 3,-0.4 0.857 104.9 61.8 -83.3 -41.6 19.5 -7.6 -5.2 270 128 B A H X S+ 0 0 6 -4,-2.4 4,-0.5 1,-0.3 -2,-0.2 0.776 103.4 50.6 -59.6 -27.0 16.7 -9.0 -7.4 271 129 B A H X S+ 0 0 0 -4,-0.8 4,-1.5 2,-0.2 -1,-0.3 0.801 107.5 52.6 -80.3 -31.6 17.1 -12.4 -5.8 272 130 B Y H X S+ 0 0 2 -4,-0.6 4,-2.8 -3,-0.4 5,-0.2 0.817 101.8 58.5 -76.7 -27.2 16.9 -10.9 -2.3 273 131 B Q H X S+ 0 0 9 -4,-2.0 4,-1.5 1,-0.2 -1,-0.2 0.799 107.5 50.3 -70.5 -20.8 13.7 -9.2 -3.1 274 132 B K H X S+ 0 0 93 -4,-0.5 4,-1.6 -5,-0.2 -2,-0.2 0.854 111.6 45.1 -79.7 -38.5 12.4 -12.7 -3.9 275 133 B V H X S+ 0 0 3 -4,-1.5 4,-2.6 2,-0.2 5,-0.2 0.948 116.2 46.3 -69.3 -45.6 13.5 -14.2 -0.7 276 134 B V H X S+ 0 0 5 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.881 110.9 51.1 -64.7 -41.7 12.2 -11.3 1.4 277 135 B A H X S+ 0 0 38 -4,-1.5 4,-1.3 -5,-0.2 -1,-0.2 0.889 112.4 48.9 -67.0 -31.0 8.9 -11.2 -0.4 278 136 B G H X S+ 0 0 11 -4,-1.6 4,-1.1 2,-0.2 -2,-0.2 0.889 109.4 49.5 -71.0 -44.9 8.6 -15.0 0.2 279 137 B V H X S+ 0 0 8 -4,-2.6 4,-1.9 1,-0.2 3,-0.4 0.909 112.7 50.4 -63.5 -32.8 9.4 -14.7 3.9 280 138 B A H X S+ 0 0 1 -4,-2.4 4,-0.5 1,-0.3 -1,-0.2 0.769 107.4 51.4 -79.2 -23.5 6.8 -11.9 4.1 281 139 B N H < S+ 0 0 101 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.693 111.0 52.5 -79.6 -19.5 4.2 -14.1 2.4 282 140 B A H >< S+ 0 0 1 -4,-1.1 3,-1.2 -3,-0.4 -2,-0.2 0.876 105.6 48.1 -85.2 -41.8 5.0 -16.8 4.9 283 141 B L H 3< S+ 0 0 25 -4,-1.9 3,-0.4 1,-0.2 -1,-0.2 0.679 111.8 53.7 -65.9 -25.6 4.6 -14.8 8.2 284 142 B A T >< S+ 0 0 7 -4,-0.5 3,-1.8 -5,-0.2 -1,-0.2 0.355 74.0 107.2 -93.0 1.0 1.3 -13.4 6.9 285 143 B H G X + 0 0 102 -3,-1.2 3,-0.5 1,-0.3 -1,-0.2 0.607 69.4 65.6 -60.0 -10.3 -0.2 -16.8 6.1 286 144 B K G 3 S+ 0 0 112 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.382 75.3 81.0-105.2 20.7 -2.5 -16.6 9.1 287 145 B Y G < 0 0 98 -3,-1.8 -1,-0.2 -45,-0.0 -2,-0.1 0.162 360.0 360.0 -95.9 15.2 -4.7 -13.7 7.9 288 146 B H < 0 0 185 -3,-0.5 0, 0.0 -4,-0.0 0, 0.0 -0.959 360.0 360.0-117.9 360.0 -6.5 -16.3 5.9