==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN TRANSPORT 23-APR-82 1LH1 . COMPND 2 MOLECULE: LEGHEMOGLOBIN (ACETO MET); . SOURCE 2 ORGANISM_SCIENTIFIC: LUPINUS LUTEUS; . AUTHOR B.K.VAINSHTEIN,E.H.HARUTYUNYAN,I.P.KURANOVA,V.V.BORISOV, . 153 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8228.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 119 77.8 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 . 1 0.7 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 . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 0 0 0 1 0 0 2 1 0 0 0 0 0 0 0 1 1 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 G 0 0 92 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -47.9 36.6 49.0 31.7 2 2 A A - 0 0 78 1,-0.1 80,-0.0 2,-0.1 0, 0.0 -0.708 360.0 -84.8 115.6 -76.4 35.0 49.5 28.2 3 3 A L - 0 0 12 -2,-0.3 -1,-0.1 76,-0.0 79,-0.1 0.506 55.9-168.8 117.9 70.9 36.0 46.8 25.9 4 4 A T > - 0 0 56 1,-0.1 4,-2.4 -3,-0.1 5,-0.2 -0.280 41.1-102.6 -72.7 166.3 39.4 48.1 24.5 5 5 A E H > S+ 0 0 155 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.838 128.1 56.1 -63.8 -29.0 40.8 46.4 21.7 6 6 A S H > S+ 0 0 64 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.926 105.6 48.7 -74.3 -36.2 43.0 44.8 24.2 7 7 A Q H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.923 110.8 49.9 -63.3 -40.4 40.0 43.4 26.3 8 8 A A H X S+ 0 0 3 -4,-2.4 4,-2.4 1,-0.3 -1,-0.2 0.856 105.1 56.7 -70.0 -33.3 38.1 41.8 23.3 9 9 A A H X S+ 0 0 60 -4,-1.5 4,-1.6 -5,-0.2 -1,-0.3 0.804 105.0 53.2 -65.8 -32.4 41.1 40.2 22.2 10 10 A L H X S+ 0 0 63 -4,-1.3 4,-2.0 2,-0.2 -2,-0.2 0.871 108.4 48.2 -73.7 -37.4 41.2 38.6 25.6 11 11 A V H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.949 112.4 50.0 -64.6 -37.6 37.4 37.2 25.5 12 12 A K H X S+ 0 0 82 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.897 108.9 49.6 -67.3 -46.8 37.9 35.7 22.1 13 13 A S H X S+ 0 0 58 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.901 112.1 47.8 -59.6 -44.4 40.9 34.1 23.0 14 14 A S H X S+ 0 0 3 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.908 110.6 53.0 -66.8 -29.3 39.2 32.5 26.2 15 15 A W H X S+ 0 0 37 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.923 104.2 54.3 -71.7 -36.2 36.1 31.3 24.2 16 16 A E H X S+ 0 0 98 -4,-2.1 4,-0.9 -5,-0.2 -1,-0.2 0.959 105.8 53.8 -63.9 -41.0 38.1 29.5 21.8 17 17 A E H >< S+ 0 0 61 -4,-1.9 3,-0.8 1,-0.2 4,-0.3 0.903 108.0 49.0 -57.4 -43.7 39.6 27.9 24.7 18 18 A F H >< S+ 0 0 0 -4,-2.3 3,-2.3 1,-0.2 7,-0.3 0.934 108.9 52.7 -57.7 -43.1 36.0 26.7 26.1 19 19 A N H >< S+ 0 0 75 -4,-2.6 3,-0.7 1,-0.3 -1,-0.2 0.705 88.5 78.7 -72.1 -15.6 34.8 25.3 22.7 20 20 A A T << S+ 0 0 85 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.675 106.8 26.3 -72.3 -14.0 37.7 23.3 22.5 21 21 A N T <> + 0 0 59 -3,-2.3 4,-2.7 -4,-0.3 3,-0.3 -0.337 64.6 162.8-146.6 66.9 36.1 20.8 25.1 22 22 A I H <> S+ 0 0 38 -3,-0.7 4,-2.4 2,-0.2 5,-0.4 0.876 73.1 52.5 -49.8 -51.6 32.3 20.8 25.1 23 23 A P H > S+ 0 0 59 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.918 119.8 39.3 -64.0 -31.0 31.4 17.4 26.9 24 24 A K H > S+ 0 0 125 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.930 117.2 43.3 -76.4 -55.2 33.7 18.5 29.8 25 25 A H H X S+ 0 0 21 -4,-2.7 4,-1.8 -7,-0.3 -3,-0.2 0.813 117.1 50.2 -65.8 -31.4 33.1 22.2 30.1 26 26 A T H X S+ 0 0 0 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.852 110.6 44.6 -75.3 -37.0 29.3 21.6 29.8 27 27 A H H X S+ 0 0 42 -4,-1.3 4,-2.4 -5,-0.4 -2,-0.2 0.922 117.3 51.3 -72.2 -36.8 28.8 18.8 32.4 28 28 A R H X S+ 0 0 81 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.845 104.6 52.8 -61.3 -48.8 31.1 21.1 34.6 29 29 A F H X S+ 0 0 5 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.944 110.9 48.9 -54.6 -48.2 29.1 24.0 34.1 30 30 A F H X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.858 111.7 48.7 -66.1 -29.7 25.8 21.7 35.3 31 31 A I H X S+ 0 0 45 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.919 110.6 49.2 -72.5 -40.1 27.6 20.5 38.3 32 32 A L H X S+ 0 0 4 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.853 112.3 52.0 -69.1 -32.2 28.7 24.2 39.4 33 33 A V H X S+ 0 0 4 -4,-2.1 4,-2.1 2,-0.2 3,-0.3 0.947 109.9 44.2 -60.9 -52.6 25.1 25.1 38.8 34 34 A L H < S+ 0 0 31 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.706 113.7 56.6 -69.7 -22.4 23.7 22.2 41.1 35 35 A E H < S+ 0 0 123 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.840 110.6 38.7 -75.8 -35.8 26.4 23.2 43.7 36 36 A I H < S+ 0 0 69 -4,-1.5 -2,-0.2 -3,-0.3 -1,-0.2 0.848 142.0 9.0 -76.3 -42.5 25.5 26.7 43.9 37 37 A A >< - 0 0 27 -4,-2.1 3,-2.3 -5,-0.1 4,-0.2 -0.675 60.5-177.3-145.5 87.7 21.6 25.6 43.8 38 38 A P G > S+ 0 0 96 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.832 80.7 65.5 -57.4 -31.6 20.5 21.8 44.0 39 39 A A G > S+ 0 0 80 1,-0.3 3,-1.1 2,-0.1 4,-0.2 0.709 81.2 83.6 -62.5 -20.3 16.8 22.2 43.5 40 40 A A G X S+ 0 0 6 -3,-2.3 3,-1.5 1,-0.2 4,-0.4 0.662 72.2 81.5 -62.1 -16.1 17.6 23.5 40.0 41 41 A K G X S+ 0 0 36 -3,-1.8 3,-1.7 1,-0.3 -1,-0.2 0.909 76.8 61.5 -59.2 -39.2 17.7 19.9 38.9 42 42 A D G < S+ 0 0 106 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.1 0.656 94.9 70.3 -64.3 -16.2 13.9 19.2 38.5 43 43 A L G < S+ 0 0 46 -3,-1.5 2,-0.6 -4,-0.2 -1,-0.3 0.647 82.2 73.4 -72.8 -26.1 13.8 21.9 35.8 44 44 A F X> - 0 0 47 -3,-1.7 3,-2.3 -4,-0.4 4,-1.9 -0.839 69.7-149.3-102.6 121.1 15.7 20.1 33.1 45 45 A S T 34 S+ 0 0 60 -2,-0.6 -1,-0.1 1,-0.3 -3,-0.0 0.819 103.3 51.4 -56.0 -36.8 13.9 17.1 31.2 46 46 A F T 34 S+ 0 0 20 1,-0.2 -1,-0.3 -3,-0.1 14,-0.1 0.441 112.4 43.9 -83.9 -4.2 17.0 15.4 30.7 47 47 A L T X4 S+ 0 0 1 -3,-2.3 3,-1.2 -6,-0.2 2,-0.3 0.640 90.0 102.1-105.0 -25.1 17.9 15.7 34.5 48 48 A K T 3< S+ 0 0 124 -4,-1.9 3,-0.1 1,-0.2 -6,-0.1 -0.442 90.6 13.3 -60.0 117.5 14.4 14.6 35.9 49 49 A G T 3 S+ 0 0 85 1,-0.5 -1,-0.2 -2,-0.3 2,-0.2 0.030 106.4 104.3 105.0 -22.3 14.1 11.1 37.1 50 50 A T < - 0 0 44 -3,-1.2 -1,-0.5 1,-0.1 3,-0.1 -0.386 61.3-154.1 -77.9 161.1 17.9 10.8 37.0 51 51 A S S S+ 0 0 121 1,-0.2 2,-0.3 -2,-0.2 -1,-0.1 0.810 79.1 34.6 -98.5 -34.0 19.8 10.9 40.4 52 52 A E S S- 0 0 144 1,-0.0 -1,-0.2 0, 0.0 3,-0.1 -0.874 96.8 -90.5-113.1 157.2 23.1 12.3 38.9 53 53 A V - 0 0 11 -2,-0.3 -6,-0.1 1,-0.1 -22,-0.0 -0.482 47.4-122.3 -66.0 114.1 24.0 14.7 35.9 54 54 A P - 0 0 32 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 -0.170 18.9-157.3 -54.7 142.8 24.3 12.5 32.8 55 55 A Q S S+ 0 0 108 1,-0.2 -28,-0.1 -3,-0.1 -29,-0.1 0.782 83.8 36.2 -98.5 -22.4 27.8 13.0 31.3 56 56 A N S S+ 0 0 131 -29,-0.0 -1,-0.2 4,-0.0 3,-0.1 -0.362 75.0 133.0-127.6 52.1 27.0 11.9 27.7 57 57 A N > - 0 0 41 -3,-0.2 4,-2.2 1,-0.2 5,-0.2 -0.916 43.0-156.4-107.3 124.2 23.7 13.1 27.0 58 58 A P H > S+ 0 0 97 0, 0.0 4,-2.2 0, 0.0 5,-0.3 0.769 95.1 59.2 -73.1 -22.4 23.5 14.9 23.6 59 59 A E H > S+ 0 0 117 1,-0.2 4,-2.2 2,-0.2 -2,-0.0 0.934 107.7 43.9 -70.5 -47.6 20.6 16.7 24.8 60 60 A L H > S+ 0 0 1 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.927 114.4 49.8 -58.7 -42.5 22.5 18.3 27.7 61 61 A Q H X S+ 0 0 41 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.921 111.6 46.5 -65.3 -40.1 25.7 19.1 25.6 62 62 A A H X S+ 0 0 60 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.927 111.6 52.8 -73.3 -36.4 24.0 20.8 22.8 63 63 A H H >X S+ 0 0 64 -4,-2.2 4,-1.4 -5,-0.3 3,-0.5 0.971 112.0 41.5 -56.9 -61.9 22.0 22.6 25.2 64 64 A A H 3X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 5,-0.2 0.888 110.4 59.9 -60.3 -31.4 25.1 24.1 27.4 65 65 A G H 3X S+ 0 0 14 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.922 101.5 51.6 -57.4 -43.8 27.2 24.9 24.2 66 66 A K H S+ 0 0 66 -4,-2.2 4,-2.5 -5,-0.2 6,-0.8 0.935 108.4 51.7 -63.1 -33.7 29.9 42.8 19.5 78 78 A L H X5S+ 0 0 17 -4,-2.4 4,-1.3 4,-0.2 -1,-0.2 0.939 111.4 44.7 -66.8 -34.3 30.5 45.2 22.5 79 79 A E H <5S+ 0 0 59 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.937 121.5 38.0 -76.1 -39.4 34.2 46.1 21.5 80 80 A V H <5S+ 0 0 100 -4,-3.0 -2,-0.2 1,-0.1 -1,-0.2 0.904 135.5 17.0 -71.3 -54.1 33.3 46.7 17.8 81 81 A T H <5S- 0 0 81 -4,-2.5 -3,-0.2 -5,-0.4 -2,-0.2 0.522 94.7-121.6 -98.2 -31.9 30.1 48.2 18.0 82 82 A G S < - 0 0 74 -2,-0.7 4,-2.1 1,-0.0 3,-0.3 -0.489 49.1 -79.5-114.6-174.3 17.4 39.2 17.7 88 88 A A H > S+ 0 0 77 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.895 126.2 55.5 -54.3 -38.2 14.5 36.3 17.2 89 89 A T H > S+ 0 0 73 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.906 104.1 48.8 -64.0 -42.0 16.5 33.9 18.8 90 90 A L H > S+ 0 0 9 -3,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.869 112.1 52.6 -69.3 -35.0 17.0 35.8 22.1 91 91 A K H X S+ 0 0 107 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.918 107.6 47.3 -63.0 -44.9 13.2 36.4 22.1 92 92 A N H X S+ 0 0 105 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.906 109.0 60.8 -65.4 -29.5 12.3 32.6 21.7 93 93 A L H X S+ 0 0 38 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.862 95.8 55.4 -65.0 -39.4 14.8 32.1 24.4 94 94 A G H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.912 109.4 50.3 -60.2 -36.0 12.9 34.1 26.8 95 95 A S H X S+ 0 0 53 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.919 106.7 50.6 -69.0 -44.1 9.6 31.8 26.1 96 96 A V H X S+ 0 0 53 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.912 107.7 55.5 -65.7 -33.3 11.1 28.6 26.6 97 97 A H H <>S+ 0 0 52 -4,-1.8 5,-2.3 1,-0.2 4,-0.4 0.917 107.6 48.1 -66.6 -41.1 12.6 29.8 30.0 98 98 A V H ><5S+ 0 0 46 -4,-1.9 3,-2.2 1,-0.2 -1,-0.2 0.964 108.1 55.5 -62.7 -42.4 9.4 30.8 31.3 99 99 A S H 3<5S+ 0 0 97 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.756 107.4 53.1 -54.7 -32.8 7.6 27.3 30.2 100 100 A K T 3<5S- 0 0 114 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.425 121.7-106.2 -91.5 1.5 10.1 25.5 32.1 101 101 A G T < 5 + 0 0 50 -3,-2.2 2,-0.2 -4,-0.4 -3,-0.2 0.771 63.0 154.8 86.7 26.2 9.6 27.3 35.3 102 102 A V < - 0 0 31 -5,-2.3 2,-0.2 -6,-0.1 -1,-0.2 -0.672 18.9-169.8 -87.9 137.4 13.0 29.7 35.3 103 103 A A > - 0 0 50 -2,-0.2 3,-1.6 0, 0.0 4,-0.4 -0.777 34.9-101.9-124.7 170.8 13.2 33.0 37.2 104 104 A D G > S+ 0 0 69 1,-0.3 3,-0.8 -2,-0.2 42,-0.1 0.712 116.4 62.3 -58.1 -32.8 15.8 36.2 37.5 105 105 A A G 3 S+ 0 0 84 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.658 91.6 66.5 -78.6 -2.5 17.2 35.0 40.7 106 106 A H G X> S+ 0 0 66 -3,-1.6 4,-1.6 1,-0.2 3,-0.9 0.722 86.4 74.8 -79.3 -28.7 18.4 32.0 38.8 107 107 A F H <> S+ 0 0 22 -3,-0.8 4,-2.4 -4,-0.4 -1,-0.2 0.808 90.1 49.8 -57.9 -39.5 20.9 34.3 36.7 108 108 A P H 3> S+ 0 0 79 0, 0.0 4,-2.2 0, 0.0 -1,-0.3 0.729 109.1 60.0 -70.4 -23.3 23.7 35.1 39.3 109 109 A V H <> S+ 0 0 25 -3,-0.9 4,-1.8 -4,-0.3 -2,-0.2 0.944 109.7 37.5 -65.1 -56.1 23.6 31.3 39.7 110 110 A V H X S+ 0 0 36 -4,-1.6 4,-2.7 2,-0.2 -1,-0.2 0.884 116.5 55.8 -64.1 -34.3 24.4 30.7 36.1 111 111 A K H X S+ 0 0 41 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.960 111.0 42.7 -63.2 -46.2 27.1 33.9 36.1 112 112 A E H X S+ 0 0 82 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.912 113.2 53.1 -66.7 -36.1 29.1 32.7 38.9 113 113 A A H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.820 113.2 44.3 -66.3 -37.5 28.9 29.2 37.3 114 114 A I H X S+ 0 0 2 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.940 115.6 45.8 -73.3 -39.8 30.2 30.8 33.9 115 115 A L H X S+ 0 0 20 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.900 117.5 45.3 -70.1 -38.0 33.1 33.0 35.5 116 116 A K H X S+ 0 0 99 -4,-2.8 4,-2.2 -5,-0.2 -1,-0.2 0.907 111.7 50.6 -75.8 -35.2 34.2 30.2 37.5 117 117 A T H X S+ 0 0 1 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.894 115.6 43.4 -58.5 -52.0 33.9 27.9 34.5 118 118 A I H X S+ 0 0 3 -4,-3.0 4,-2.8 2,-0.3 5,-0.4 0.923 111.4 53.5 -70.9 -26.5 36.2 30.5 32.3 119 119 A K H X S+ 0 0 109 -4,-2.6 4,-1.6 -5,-0.2 -2,-0.2 0.938 113.3 45.2 -73.5 -30.3 38.6 31.0 35.2 120 120 A E H < S+ 0 0 102 -4,-2.2 -2,-0.3 1,-0.2 -1,-0.2 0.881 112.6 49.6 -74.5 -41.1 38.8 27.3 35.2 121 121 A V H < S+ 0 0 17 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.884 119.5 34.6 -61.6 -45.2 39.1 27.2 31.4 122 122 A V H >< S+ 0 0 7 -4,-2.8 3,-1.6 1,-0.2 2,-0.2 0.704 80.7 178.0 -95.6 -11.0 42.2 30.0 31.1 123 123 A G G >< + 0 0 41 -4,-1.6 3,-1.5 -5,-0.4 -1,-0.2 -0.283 63.5 9.0 45.6-124.3 44.0 29.2 34.2 124 124 A A G 3 S+ 0 0 112 1,-0.3 -1,-0.2 -2,-0.2 -2,-0.1 0.623 119.5 69.1 -68.7 -11.0 47.4 31.4 34.7 125 125 A K G < S+ 0 0 123 -3,-1.6 -1,-0.3 2,-0.1 -2,-0.1 0.269 73.0 123.9 -80.0 -1.7 46.5 33.7 31.9 126 126 A W < + 0 0 79 -3,-1.5 2,-0.3 -7,-0.1 3,-0.1 -0.385 39.0 172.9 -64.5 138.4 43.8 34.9 34.0 127 127 A S > - 0 0 39 1,-0.1 4,-1.9 -2,-0.1 5,-0.1 -0.947 47.1-115.2-136.8 169.1 44.0 38.7 34.6 128 128 A E H > S+ 0 0 165 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.829 119.1 58.1 -66.4 -44.3 42.0 41.3 36.1 129 129 A E H > S+ 0 0 87 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.793 108.6 47.2 -55.3 -36.5 41.6 42.8 32.8 130 130 A L H > S+ 0 0 5 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.893 111.7 47.7 -71.1 -42.3 40.0 39.3 31.4 131 131 A N H X S+ 0 0 52 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.915 112.5 51.7 -66.4 -40.1 37.6 38.8 34.4 132 132 A S H X S+ 0 0 34 -4,-2.3 4,-2.0 1,-0.2 5,-0.2 0.895 108.1 50.5 -66.0 -39.8 36.7 42.3 33.9 133 133 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.939 114.2 41.0 -63.9 -47.7 36.1 41.6 30.2 134 134 A W H X S+ 0 0 2 -4,-2.5 4,-2.2 2,-0.2 5,-0.2 0.813 114.3 55.8 -69.0 -27.5 33.6 38.3 30.6 135 135 A T H X S+ 0 0 30 -4,-1.8 4,-2.7 -5,-0.3 -1,-0.2 0.939 108.2 44.8 -70.3 -46.4 31.9 40.0 33.5 136 136 A I H X S+ 0 0 35 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.901 114.7 48.7 -65.4 -45.9 31.1 42.9 31.4 137 137 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.899 115.2 43.3 -61.6 -39.0 29.9 40.6 28.4 138 138 A Y H X S+ 0 0 18 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.953 114.6 50.4 -69.3 -47.9 27.6 38.2 30.7 139 139 A D H X S+ 0 0 56 -4,-2.7 4,-1.7 -5,-0.2 -2,-0.2 0.886 112.0 46.9 -59.2 -44.6 26.2 41.1 32.5 140 140 A E H X S+ 0 0 79 -4,-2.4 4,-1.2 2,-0.2 -2,-0.2 0.904 116.3 43.7 -65.0 -42.0 25.4 42.8 29.2 141 141 A L H X S+ 0 0 10 -4,-2.3 4,-2.6 -5,-0.2 5,-0.2 0.906 112.2 52.6 -68.7 -34.0 23.8 39.6 27.6 142 142 A A H X S+ 0 0 6 -4,-3.1 4,-2.6 1,-0.3 5,-0.3 0.895 102.2 59.2 -73.5 -32.9 21.7 38.7 30.8 143 143 A I H X S+ 0 0 99 -4,-1.7 4,-1.1 -5,-0.2 -1,-0.3 0.911 107.4 47.4 -57.4 -44.2 20.4 42.0 30.9 144 144 A V H X S+ 0 0 13 -4,-1.2 4,-1.9 2,-0.2 -2,-0.2 0.936 114.2 43.1 -63.8 -49.4 19.0 41.2 27.3 145 145 A I H X S+ 0 0 17 -4,-2.6 4,-2.0 1,-0.3 5,-0.2 0.933 111.6 53.9 -68.0 -38.1 17.4 37.7 28.1 146 146 A K H X S+ 0 0 66 -4,-2.6 4,-1.7 1,-0.3 -1,-0.3 0.822 105.3 55.5 -62.6 -35.5 15.8 38.7 31.3 147 147 A K H X S+ 0 0 111 -4,-1.1 4,-1.5 -5,-0.3 -1,-0.3 0.887 108.6 45.5 -64.8 -42.1 14.3 41.4 29.5 148 148 A E H X S+ 0 0 23 -4,-1.9 4,-1.2 1,-0.2 -2,-0.2 0.788 109.8 55.1 -74.3 -20.7 12.7 38.8 27.0 149 149 A M H X S+ 0 0 6 -4,-2.0 4,-0.9 2,-0.2 -1,-0.2 0.924 103.4 54.3 -74.5 -41.7 11.4 36.4 29.7 150 150 A D H >< S+ 0 0 100 -4,-1.7 3,-0.7 1,-0.3 -2,-0.2 0.900 109.7 48.4 -60.0 -36.0 9.7 39.0 31.4 151 151 A D H 3< S+ 0 0 126 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.753 106.9 54.3 -74.1 -20.2 8.1 39.6 28.1 152 152 A A H 3< 0 0 39 -4,-1.2 -1,-0.2 1,-0.1 -2,-0.2 0.613 360.0 360.0 -85.8 -7.9 7.2 35.8 27.4 153 153 A A << 0 0 128 -4,-0.9 -1,-0.1 -3,-0.7 -58,-0.0 -0.738 360.0 360.0 -90.7 360.0 5.3 35.6 30.8