==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HEME PROTEIN 25-MAR-99 1VRF . COMPND 2 MOLECULE: PROTEIN (GLOBIN, MONOMERIC COMPONENT M-IV); . SOURCE 2 ORGANISM_SCIENTIFIC: GLYCERA DIBRANCHIATA; . AUTHOR B.F.VOLKMAN,S.L.ALAM,J.D.SATTERLEE,J.L.MARKLEY . 147 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7361.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 113 76.9 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 . 5 3.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 16.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 55.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 0 0 0 1 0 0 0 0 1 0 2 0 0 2 1 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 G 0 0 108 0, 0.0 2,-0.1 0, 0.0 132,-0.1 0.000 360.0 360.0 360.0-160.2 11.4 7.9 9.8 2 2 A L - 0 0 37 130,-0.1 2,-0.2 131,-0.1 127,-0.1 -0.456 360.0-147.7 -71.6 143.0 13.0 6.2 6.8 3 3 A S > - 0 0 52 -2,-0.1 4,-2.4 1,-0.1 5,-0.3 -0.582 28.1-103.5-105.8 172.2 16.8 5.7 7.0 4 4 A A H > S+ 0 0 85 -2,-0.2 4,-0.7 1,-0.2 -1,-0.1 0.848 123.9 42.9 -64.5 -30.0 19.4 5.8 4.2 5 5 A A H > S+ 0 0 63 2,-0.2 4,-3.7 3,-0.1 3,-0.4 0.939 112.9 49.4 -81.7 -49.5 19.6 2.0 4.4 6 6 A Q H > S+ 0 0 34 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.962 107.4 55.4 -54.6 -51.1 15.8 1.3 4.7 7 7 A R H X S+ 0 0 118 -4,-2.4 4,-1.2 1,-0.2 -1,-0.3 0.888 115.4 40.5 -50.3 -36.9 15.1 3.6 1.7 8 8 A Q H X S+ 0 0 87 -4,-0.7 4,-1.3 -3,-0.4 -2,-0.2 0.916 110.2 55.7 -79.3 -43.4 17.6 1.4 -0.2 9 9 A V H X S+ 0 0 29 -4,-3.7 4,-0.9 1,-0.2 -2,-0.2 0.758 104.6 59.2 -61.0 -19.1 16.4 -1.9 1.3 10 10 A V H >X S+ 0 0 0 -4,-2.1 4,-1.6 -5,-0.3 3,-0.7 0.958 104.8 44.2 -75.4 -50.6 13.0 -0.9 -0.1 11 11 A A H 3X S+ 0 0 18 -4,-1.2 4,-0.6 1,-0.2 -1,-0.2 0.701 111.4 58.6 -67.5 -14.7 14.0 -0.6 -3.7 12 12 A S H 3< S+ 0 0 65 -4,-1.3 -1,-0.2 2,-0.2 -2,-0.2 0.772 111.1 38.6 -85.4 -25.7 15.8 -3.9 -3.3 13 13 A T H S+ 0 0 22 -4,-1.6 5,-0.9 1,-0.2 4,-0.8 0.717 96.5 64.3 -88.7 -20.1 10.3 -4.1 -4.7 15 15 A K H <5S+ 0 0 148 -4,-0.6 -1,-0.2 -5,-0.2 -2,-0.1 0.444 112.6 35.9 -81.4 4.1 12.5 -5.1 -7.7 16 16 A D H 45S+ 0 0 61 -3,-0.4 4,-0.2 3,-0.1 -2,-0.2 0.695 118.0 42.5-120.7 -50.3 11.7 -8.8 -6.9 17 17 A I H <5S+ 0 0 2 -4,-1.4 6,-0.5 1,-0.1 8,-0.2 0.966 128.0 32.2 -65.6 -49.2 8.1 -9.1 -5.6 18 18 A A T >X>S+ 0 0 3 -4,-0.8 4,-2.2 -5,-0.3 3,-1.0 0.968 79.4 139.9 -72.7 -51.9 6.8 -6.6 -8.2 19 19 A G T 34> S+ 0 0 32 1,-0.3 4,-1.2 -6,-0.2 3,-0.2 0.942 82.0 38.6 -57.9 -44.9 -0.2 -8.2 -8.7 25 25 A G H 34 S+ 0 0 30 -8,-0.2 -1,-0.3 1,-0.2 91,-0.1 0.262 111.6 64.2 -89.1 15.4 -0.2 -11.1 -6.3 26 26 A V H <> S+ 0 0 2 -3,-1.7 4,-0.5 3,-0.1 -2,-0.2 0.739 107.2 35.2-105.9 -32.6 0.7 -8.7 -3.4 27 27 A G H X>S+ 0 0 0 -4,-1.8 4,-2.1 -3,-0.2 5,-0.7 0.859 115.0 54.5 -89.4 -39.2 -2.4 -6.6 -3.3 28 28 A K H <5S+ 0 0 92 -4,-1.2 4,-0.3 -5,-0.3 28,-0.2 0.852 118.4 37.1 -63.9 -30.0 -4.9 -9.3 -4.2 29 29 A E H >5S+ 0 0 43 -5,-0.2 4,-0.9 3,-0.1 -1,-0.2 0.678 120.5 48.3 -94.1 -18.6 -3.6 -11.4 -1.3 30 30 A C H X5S+ 0 0 0 -4,-0.5 4,-1.9 2,-0.2 3,-0.2 0.953 114.4 39.4 -84.7 -61.8 -3.0 -8.3 1.0 31 31 A F H X5S+ 0 0 11 -4,-2.1 4,-3.6 1,-0.2 5,-0.4 0.871 108.5 67.9 -57.4 -33.1 -6.3 -6.4 0.8 32 32 A T H >X + 0 0 45 -4,-2.6 4,-1.3 -5,-0.4 3,-0.5 -0.810 59.4 163.9-117.2 93.8 -12.1 -5.8 8.5 39 39 A H H 3> S+ 0 0 143 -2,-0.6 4,-0.8 1,-0.2 -1,-0.1 0.731 74.4 68.0 -80.1 -19.7 -15.8 -6.2 7.5 40 40 A D H 34 S+ 0 0 80 1,-0.2 -1,-0.2 -3,-0.1 4,-0.1 0.737 110.9 34.2 -71.4 -18.5 -16.3 -2.4 8.2 41 41 A M H X> S+ 0 0 9 -3,-0.5 4,-2.2 -6,-0.2 3,-1.1 0.683 96.2 82.4-106.5 -25.1 -14.2 -1.7 5.2 42 42 A A H 3X>S+ 0 0 9 -4,-1.3 5,-2.0 -7,-0.4 4,-1.6 0.888 98.6 45.2 -48.0 -37.9 -15.1 -4.7 3.0 43 43 A A H 3<5S+ 0 0 82 -4,-0.8 -1,-0.3 1,-0.2 -2,-0.1 0.766 107.3 59.6 -78.5 -22.8 -18.2 -2.6 1.9 44 44 A V H <45S+ 0 0 29 -3,-1.1 51,-0.4 1,-0.2 50,-0.2 0.873 107.6 44.6 -73.0 -34.7 -16.0 0.5 1.5 45 45 A F H <5S- 0 0 53 -4,-2.2 -2,-0.2 2,-0.1 -1,-0.2 0.918 118.1-108.9 -76.2 -42.2 -13.9 -1.2 -1.2 46 46 A G T <5S+ 0 0 56 -4,-1.6 2,-0.3 -5,-0.3 -3,-0.2 0.672 75.2 117.2 118.3 34.8 -16.9 -2.8 -3.1 47 47 A F < - 0 0 31 -5,-2.0 -1,-0.3 7,-0.1 3,-0.1 -0.811 63.5-132.9-125.9 168.9 -16.6 -6.5 -2.3 48 48 A S S S- 0 0 114 -2,-0.3 2,-0.3 1,-0.2 -5,-0.1 0.131 80.7 -46.0-107.3 20.8 -18.8 -9.0 -0.5 49 49 A G S > S- 0 0 14 -7,-0.2 3,-0.7 1,-0.0 -1,-0.2 -0.952 85.2 -52.5 146.4-165.8 -16.0 -10.5 1.6 50 50 A A T 3 S+ 0 0 43 -2,-0.3 -14,-0.1 1,-0.2 -18,-0.1 0.124 120.7 72.4 -92.7 23.9 -12.4 -11.7 1.1 51 51 A S T 3 S+ 0 0 112 -19,-0.1 -1,-0.2 -15,-0.0 -19,-0.0 0.134 70.2 107.7-121.6 19.8 -13.5 -14.0 -1.7 52 52 A D X - 0 0 58 -3,-0.7 3,-1.2 1,-0.1 4,-0.5 -0.836 65.2-141.7-102.4 136.5 -14.2 -11.4 -4.4 53 53 A P T 3> S+ 0 0 110 0, 0.0 4,-1.0 0, 0.0 3,-0.3 0.731 94.6 80.6 -65.8 -19.9 -11.9 -10.9 -7.4 54 54 A G H >> S+ 0 0 19 1,-0.2 4,-1.6 2,-0.2 3,-1.1 0.896 81.8 65.2 -54.9 -37.2 -12.4 -7.2 -7.1 55 55 A V H X> S+ 0 0 0 -3,-1.2 4,-2.2 1,-0.3 3,-1.1 0.965 98.0 51.0 -51.1 -55.4 -9.8 -7.2 -4.3 56 56 A A H 3> S+ 0 0 27 -4,-0.5 4,-1.0 -3,-0.3 -1,-0.3 0.790 106.4 59.4 -54.9 -21.8 -7.1 -8.2 -6.7 57 57 A D H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.3 3,-1.0 0.731 97.6 67.3 -85.8 -21.6 6.5 5.7 -4.1 70 70 A V H 3< S+ 0 0 6 -4,-2.2 -59,-0.2 -3,-0.4 -1,-0.2 0.744 90.0 66.5 -70.1 -19.4 9.3 3.2 -3.3 71 71 A S T 3< S+ 0 0 83 -4,-0.7 -1,-0.3 -3,-0.2 -2,-0.1 0.028 117.0 21.1 -89.9 31.0 11.5 5.2 -5.7 72 72 A H T X4 + 0 0 52 -3,-1.0 3,-4.2 -65,-0.1 2,-0.7 0.335 67.2 159.2-159.5 -43.3 11.4 8.3 -3.4 73 73 A L T 3< S+ 0 0 0 -4,-2.2 -2,-0.1 1,-0.3 -3,-0.1 -0.119 92.4 20.3 42.9 -88.8 10.5 7.4 0.2 74 74 A G T 3 S+ 0 0 42 -2,-0.7 2,-1.7 -71,-0.1 -1,-0.3 0.819 105.4 95.0 -75.7 -28.2 12.0 10.6 1.7 75 75 A D <> + 0 0 82 -3,-4.2 4,-0.7 1,-0.2 3,-0.4 -0.409 45.3 164.7 -64.7 89.8 11.9 12.3 -1.7 76 76 A E T 4 + 0 0 125 -2,-1.7 -1,-0.2 1,-0.2 -2,-0.1 0.115 47.8 97.9 -95.4 24.2 8.5 14.1 -1.1 77 77 A G T 4 S- 0 0 69 3,-0.1 -1,-0.2 -5,-0.1 -2,-0.1 0.887 111.7 -9.7 -78.3 -37.9 9.1 16.4 -4.1 78 78 A K T >> S+ 0 0 110 -3,-0.4 4,-1.6 3,-0.1 3,-0.7 0.604 124.7 72.9-128.8 -37.3 7.0 14.4 -6.5 79 79 A M H 3X S+ 0 0 3 -4,-0.7 4,-2.2 1,-0.3 3,-0.4 0.936 105.8 42.8 -48.1 -49.3 6.2 11.1 -4.7 80 80 A V H 3> S+ 0 0 22 -5,-0.3 4,-2.7 1,-0.2 5,-0.4 0.773 102.2 72.2 -70.0 -21.9 3.7 12.9 -2.5 81 81 A A H <> S+ 0 0 57 -3,-0.7 4,-0.7 2,-0.2 -1,-0.2 0.938 110.7 28.1 -59.5 -44.0 2.5 14.8 -5.6 82 82 A E H X S+ 0 0 75 -4,-1.6 4,-1.9 -3,-0.4 -2,-0.2 0.913 124.0 48.9 -84.0 -45.4 0.8 11.6 -6.9 83 83 A M H X S+ 0 0 5 -4,-2.2 4,-1.7 -5,-0.3 3,-0.3 0.962 108.8 53.5 -59.7 -49.1 0.1 10.0 -3.5 84 84 A K H X S+ 0 0 103 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.890 106.4 55.1 -54.2 -35.8 -1.4 13.2 -2.1 85 85 A A H X S+ 0 0 42 -4,-0.7 4,-1.5 -5,-0.4 -1,-0.2 0.925 99.8 59.6 -65.0 -41.1 -3.7 13.2 -5.1 86 86 A V H >X S+ 0 0 26 -4,-1.9 4,-2.9 -3,-0.3 3,-1.0 0.956 103.4 51.1 -52.6 -50.7 -4.9 9.7 -4.3 87 87 A G H 3X S+ 0 0 0 -4,-1.7 4,-2.8 1,-0.3 5,-0.3 0.962 105.1 55.4 -52.7 -52.2 -6.2 10.9 -0.9 88 88 A V H 3< S+ 0 0 54 -4,-1.7 -1,-0.3 1,-0.2 4,-0.2 0.834 112.2 46.0 -51.7 -28.0 -8.1 13.8 -2.6 89 89 A R H X< S+ 0 0 177 -4,-1.5 3,-1.4 -3,-1.0 -2,-0.2 0.911 108.6 52.9 -82.2 -43.8 -9.7 11.0 -4.7 90 90 A H H >< S+ 0 0 37 -4,-2.9 3,-2.0 1,-0.3 6,-0.2 0.944 102.4 59.0 -57.3 -46.2 -10.4 8.7 -1.7 91 91 A K T 3< S+ 0 0 70 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.759 108.2 48.7 -56.5 -19.1 -12.2 11.5 0.1 92 92 A G T < S+ 0 0 51 -3,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 -0.129 90.0 117.5-111.8 37.8 -14.5 11.6 -3.0 93 93 A Y S < S- 0 0 98 -3,-2.0 -3,-0.1 1,-0.1 -49,-0.0 -0.064 77.6-101.9 -88.6-164.8 -15.2 7.8 -3.1 94 94 A G S S+ 0 0 75 -50,-0.2 -49,-0.1 1,-0.1 -1,-0.1 0.894 117.8 52.7 -89.2 -45.9 -18.5 6.0 -2.7 95 95 A N S S- 0 0 35 -51,-0.4 -1,-0.1 1,-0.1 -51,-0.1 0.863 90.6-151.9 -59.1 -30.8 -18.2 4.8 0.9 96 96 A K S S+ 0 0 139 -6,-0.2 -1,-0.1 -52,-0.1 -5,-0.1 0.850 70.2 81.4 63.1 31.7 -17.4 8.5 1.8 97 97 A H + 0 0 139 -7,-0.2 49,-0.2 -53,-0.1 -1,-0.1 0.369 45.3 151.1-128.4 -93.9 -15.4 7.2 4.8 98 98 A I - 0 0 10 1,-0.1 2,-0.3 48,-0.1 3,-0.1 0.586 26.2-157.2 61.5 134.2 -11.8 6.0 4.4 99 99 A K >> - 0 0 89 1,-0.1 4,-0.8 47,-0.0 3,-0.8 -1.000 27.5-137.8-146.5 144.1 -9.3 6.3 7.3 100 100 A A H 3> S+ 0 0 19 -2,-0.3 4,-1.5 1,-0.2 3,-0.1 0.773 104.4 70.6 -71.5 -22.4 -5.6 6.5 7.7 101 101 A E H 34 S+ 0 0 125 1,-0.2 -1,-0.2 2,-0.2 -3,-0.0 0.864 99.6 47.8 -62.8 -30.6 -6.0 4.2 10.8 102 102 A Y H <> S+ 0 0 67 -3,-0.8 4,-2.5 2,-0.2 -1,-0.2 0.773 101.4 66.5 -80.5 -25.0 -6.9 1.5 8.2 103 103 A F H X S+ 0 0 38 -4,-0.8 4,-2.4 2,-0.2 5,-0.2 0.983 97.2 51.6 -60.0 -57.3 -3.9 2.3 6.1 104 104 A E H X S+ 0 0 128 -4,-1.5 4,-4.0 1,-0.2 3,-0.4 0.934 113.2 44.7 -44.6 -58.1 -1.3 1.2 8.7 105 105 A P H > S+ 0 0 40 0, 0.0 4,-2.9 0, 0.0 5,-0.4 0.955 113.8 48.7 -54.9 -51.8 -3.0 -2.2 9.1 106 106 A L H < S+ 0 0 16 -4,-2.5 4,-0.4 1,-0.2 -2,-0.2 0.808 117.1 46.0 -60.0 -24.0 -3.4 -2.7 5.4 107 107 A G H X S+ 0 0 4 -4,-2.4 4,-1.4 -3,-0.4 3,-0.3 0.941 115.3 42.0 -83.8 -52.7 0.3 -1.7 5.1 108 108 A A H >X S+ 0 0 63 -4,-4.0 4,-1.2 1,-0.2 3,-0.6 0.964 114.7 51.3 -59.4 -49.6 1.7 -3.9 7.9 109 109 A S H 3X S+ 0 0 40 -4,-2.9 4,-0.8 -5,-0.3 -1,-0.2 0.820 102.8 63.8 -58.3 -26.0 -0.5 -6.9 6.9 110 110 A L H >> S+ 0 0 0 -5,-0.4 4,-2.4 -4,-0.4 3,-1.2 0.935 94.9 56.9 -65.4 -43.3 0.9 -6.3 3.4 111 111 A L H X S+ 0 0 0 -4,-2.4 3,-1.6 1,-0.3 4,-1.1 0.920 91.0 64.9 -48.4 -45.4 5.3 -9.9 0.5 115 115 A E H 3< S+ 0 0 98 -4,-1.7 -1,-0.3 1,-0.3 4,-0.2 0.816 86.9 74.7 -49.9 -27.0 7.2 -12.8 2.1 116 116 A H H <4 S+ 0 0 114 -3,-2.5 3,-0.4 -4,-0.2 -1,-0.3 0.937 107.7 28.3 -53.9 -46.8 5.0 -15.0 -0.2 117 117 A R H << S+ 0 0 141 -3,-1.6 2,-1.0 -4,-0.6 3,-0.4 0.974 136.9 25.5 -79.7 -68.0 7.1 -14.0 -3.2 118 118 A I S X S+ 0 0 10 -4,-1.1 4,-3.4 1,-0.2 3,-0.4 -0.293 75.9 141.5 -92.0 53.4 10.6 -13.2 -1.8 119 119 A G T 4 S+ 0 0 29 -2,-1.0 -1,-0.2 -3,-0.4 -3,-0.1 0.819 77.4 46.0 -64.1 -26.8 10.1 -15.5 1.2 120 120 A G T 4 S+ 0 0 86 -3,-0.4 -1,-0.2 1,-0.1 -2,-0.1 0.678 121.9 36.3 -89.0 -17.1 13.8 -16.6 0.8 121 121 A K T 4 S+ 0 0 132 -3,-0.4 2,-1.4 -6,-0.1 -2,-0.2 0.646 86.7 104.2-106.6 -20.2 15.0 -12.9 0.4 122 122 A M < + 0 0 17 -4,-3.4 2,-0.1 -7,-0.2 -1,-0.0 -0.421 53.7 167.7 -64.1 94.1 12.6 -11.2 2.8 123 123 A N >> - 0 0 84 -2,-1.4 4,-2.2 1,-0.1 3,-0.9 -0.382 52.5 -89.0-100.7-177.0 15.1 -10.6 5.6 124 124 A A H 3> S+ 0 0 71 1,-0.3 4,-2.3 2,-0.2 5,-0.3 0.940 128.8 51.4 -59.8 -46.2 14.8 -8.5 8.8 125 125 A A H 3> S+ 0 0 38 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.694 111.2 51.9 -66.2 -13.6 16.1 -5.4 7.0 126 126 A A H <> S+ 0 0 0 -3,-0.9 4,-1.6 2,-0.2 -2,-0.2 0.881 113.0 39.0 -89.7 -43.0 13.5 -6.0 4.3 127 127 A K H X S+ 0 0 104 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.806 119.4 48.3 -77.7 -26.7 10.4 -6.3 6.5 128 128 A D H X S+ 0 0 68 -4,-2.3 4,-1.7 -5,-0.3 5,-0.2 0.850 111.4 49.3 -81.2 -33.0 11.6 -3.5 8.7 129 129 A A H X S+ 0 0 0 -4,-0.6 4,-2.1 -5,-0.3 5,-0.2 0.925 116.1 41.7 -71.8 -42.3 12.4 -1.1 5.8 130 130 A W H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 5,-0.2 0.837 112.0 56.5 -74.2 -29.5 9.1 -1.7 4.1 131 131 A A H < S+ 0 0 48 -4,-1.2 4,-0.5 -5,-0.2 -2,-0.2 0.904 115.4 36.8 -68.8 -37.5 7.2 -1.5 7.5 132 132 A A H X S+ 0 0 30 -4,-1.7 4,-0.6 2,-0.2 -2,-0.2 0.819 119.8 48.9 -83.2 -30.6 8.7 2.0 8.1 133 133 A A H >X S+ 0 0 0 -4,-2.1 4,-2.6 -5,-0.2 3,-1.2 0.902 100.4 63.4 -75.8 -39.6 8.5 3.0 4.5 134 134 A Y H 3X S+ 0 0 7 -4,-2.8 4,-2.2 1,-0.3 5,-0.5 0.834 98.5 59.0 -54.6 -27.7 4.8 1.9 4.1 135 135 A A H 3> S+ 0 0 54 -4,-0.5 4,-0.9 -5,-0.2 -1,-0.3 0.865 108.9 42.5 -70.9 -32.9 4.1 4.6 6.8 136 136 A D H < S+ 0 0 24 -4,-0.9 3,-2.0 -5,-0.5 4,-0.2 0.943 101.3 55.4 -68.9 -45.1 1.0 8.5 5.1 140 140 A A H >< S+ 0 0 11 -4,-2.6 3,-1.2 1,-0.3 4,-0.4 0.828 101.7 60.3 -57.8 -27.3 1.8 10.8 2.1 141 141 A L T 3< S+ 0 0 11 -4,-1.0 4,-0.3 1,-0.3 -1,-0.3 0.730 90.4 69.2 -73.6 -18.3 -1.6 9.8 0.8 142 142 A I T < S+ 0 0 56 -3,-2.0 -1,-0.3 -4,-0.5 -2,-0.2 0.502 81.4 79.8 -78.0 0.7 -3.3 11.2 3.9 143 143 A S S < S+ 0 0 77 -3,-1.2 -1,-0.2 -4,-0.2 -2,-0.2 0.978 107.7 22.1 -71.7 -54.5 -2.3 14.7 2.7 144 144 A G S S+ 0 0 10 -4,-0.4 -53,-0.3 -3,-0.3 -1,-0.2 0.339 110.9 99.6 -93.6 8.9 -5.2 15.1 0.2 145 145 A L + 0 0 5 -4,-0.3 -57,-0.2 1,-0.1 -58,-0.1 -0.407 64.8 41.1 -88.5 170.3 -7.3 12.4 2.0 146 146 A Q 0 0 79 -59,-0.3 -1,-0.1 -49,-0.2 -58,-0.1 0.977 360.0 360.0 57.1 81.3 -10.1 13.2 4.5 147 147 A S 0 0 147 -60,-0.1 -2,-0.1 -59,-0.1 -1,-0.1 -0.235 360.0 360.0 -49.8 360.0 -11.8 16.2 2.7