==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CYTOKINE 27-APR-93 1BGD . COMPND 2 MOLECULE: GRANULOCYTE COLONY-STIMULATING FACTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: CANIS LUPUS FAMILIARIS; . AUTHOR B.LOVEJOY,D.CASCIO,D.EISENBERG . 157 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7759.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 128 81.5 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 . 5 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 1 1 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 10 A L 0 0 50 0, 0.0 5,-0.0 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 154.7 89.1 70.9 -5.5 2 11 A P >> - 0 0 64 0, 0.0 4,-1.7 0, 0.0 3,-1.2 -0.403 360.0-123.0 -63.4 141.4 89.3 71.2 -1.7 3 12 A Q H 3> S+ 0 0 134 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.814 111.4 62.0 -47.9 -36.6 87.4 68.6 0.3 4 13 A S H 3> S+ 0 0 81 2,-0.2 4,-2.3 1,-0.2 -1,-0.3 0.837 102.9 49.7 -67.1 -29.7 85.5 71.5 2.0 5 14 A F H <> S+ 0 0 5 -3,-1.2 4,-3.0 2,-0.2 -2,-0.2 0.952 113.2 45.9 -71.4 -45.9 84.1 72.6 -1.3 6 15 A L H X S+ 0 0 12 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.886 114.3 48.0 -59.8 -42.9 83.0 69.0 -2.2 7 16 A L H X S+ 0 0 99 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.934 114.4 46.3 -65.3 -44.9 81.5 68.6 1.3 8 17 A K H X S+ 0 0 92 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.923 112.0 51.4 -65.3 -38.6 79.7 72.0 1.0 9 18 A C H X S+ 0 0 0 -4,-3.0 4,-2.7 2,-0.2 5,-0.3 0.955 109.3 51.1 -63.2 -45.0 78.5 71.1 -2.6 10 19 A L H X S+ 0 0 56 -4,-2.9 4,-2.3 1,-0.2 5,-0.2 0.927 111.3 46.5 -55.3 -50.9 77.1 67.8 -1.3 11 20 A E H X S+ 0 0 55 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.916 116.2 45.7 -60.8 -39.9 75.2 69.4 1.5 12 21 A Q H X S+ 0 0 13 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.892 112.7 47.1 -74.3 -39.6 73.8 72.1 -0.8 13 22 A M H X S+ 0 0 3 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.879 109.2 54.6 -70.7 -41.4 72.8 69.9 -3.7 14 23 A R H X S+ 0 0 104 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.2 0.838 108.8 49.3 -65.0 -26.6 71.0 67.4 -1.4 15 24 A K H X S+ 0 0 103 -4,-1.2 4,-3.2 -5,-0.2 5,-0.2 0.980 111.7 47.7 -74.1 -46.4 69.0 70.3 0.0 16 25 A V H X S+ 0 0 2 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.877 113.7 49.6 -61.9 -35.3 68.0 71.6 -3.6 17 26 A Q H X S+ 0 0 25 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.940 110.9 47.7 -66.3 -41.1 67.1 68.0 -4.4 18 27 A A H X S+ 0 0 61 -4,-2.0 4,-1.9 1,-0.2 3,-0.4 0.977 112.1 51.5 -65.4 -45.8 65.0 67.6 -1.3 19 28 A D H X S+ 0 0 22 -4,-3.2 4,-1.7 1,-0.3 -1,-0.2 0.787 109.4 49.9 -55.8 -34.6 63.3 70.9 -2.1 20 29 A G H X S+ 0 0 2 -4,-1.4 4,-2.5 -5,-0.2 -1,-0.3 0.862 106.9 53.2 -76.9 -36.7 62.6 69.8 -5.6 21 30 A T H X S+ 0 0 51 -4,-2.2 4,-2.8 -3,-0.4 -2,-0.2 0.889 106.1 54.6 -67.6 -32.9 61.1 66.5 -4.5 22 31 A A H X S+ 0 0 40 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.942 109.4 46.7 -63.9 -50.1 58.7 68.5 -2.2 23 32 A L H X S+ 0 0 1 -4,-1.7 4,-1.8 1,-0.2 5,-0.2 0.951 115.1 48.3 -55.6 -46.4 57.5 70.6 -5.1 24 33 A Q H X S+ 0 0 37 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.910 109.7 49.2 -65.9 -41.9 57.1 67.5 -7.2 25 34 A E H X S+ 0 0 134 -4,-2.8 4,-2.1 2,-0.2 5,-0.2 0.888 111.9 50.0 -68.9 -34.7 55.2 65.4 -4.5 26 35 A T H X S+ 0 0 53 -4,-2.1 4,-2.6 1,-0.2 5,-0.3 0.997 111.9 45.6 -64.1 -65.4 52.7 68.3 -3.8 27 36 A L H X S+ 0 0 0 -4,-1.8 6,-1.4 1,-0.2 4,-1.1 0.711 113.5 51.2 -53.9 -19.7 51.8 69.0 -7.5 28 37 A a H >X S+ 0 0 40 -4,-1.2 4,-1.9 -5,-0.2 3,-0.6 0.962 115.7 39.6 -78.9 -51.5 51.4 65.3 -8.2 29 38 A A H 3< S+ 0 0 71 -4,-2.1 3,-0.4 1,-0.3 -2,-0.2 0.968 123.8 42.1 -54.5 -53.0 49.0 64.7 -5.3 30 39 A T H 3< S+ 0 0 70 -4,-2.6 -1,-0.3 -5,-0.2 -3,-0.2 0.598 134.7 9.4 -71.2 -25.7 47.3 67.9 -5.9 31 40 A H H << S- 0 0 56 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.094 96.0-108.9-153.3 21.7 46.9 68.0 -9.8 32 41 A Q S < S+ 0 0 154 -4,-1.9 2,-1.9 -3,-0.4 3,-0.2 0.486 70.4 141.4 62.9 9.6 47.9 64.6 -11.1 33 42 A L + 0 0 23 -6,-1.4 -1,-0.2 1,-0.2 -4,-0.1 -0.539 20.3 128.5 -80.1 78.4 51.1 65.9 -12.5 34 43 A a + 0 0 48 -2,-1.9 -1,-0.2 -6,-0.2 3,-0.1 0.393 51.0 66.6-114.2 -4.3 53.3 62.9 -11.6 35 44 A H >> + 0 0 131 -3,-0.2 3,-2.4 1,-0.2 4,-0.8 -0.748 47.8 177.0-124.3 91.5 55.1 61.8 -14.7 36 45 A P G >4 S+ 0 0 36 0, 0.0 3,-0.6 0, 0.0 4,-0.4 0.829 79.9 74.6 -65.0 -23.0 57.5 64.5 -15.9 37 46 A E G 34 S+ 0 0 82 1,-0.3 3,-0.4 2,-0.2 -2,-0.0 0.755 96.3 48.3 -53.7 -30.0 58.3 62.0 -18.6 38 47 A E G X4 S+ 0 0 75 -3,-2.4 3,-0.6 1,-0.2 4,-0.4 0.819 101.0 62.8 -83.3 -28.2 55.0 63.0 -20.2 39 48 A L T S+ 0 0 92 -3,-0.4 4,-2.5 -4,-0.4 -1,-0.2 0.918 81.5 47.3 -59.6 -45.6 58.6 66.8 -22.3 41 50 A L H <> S+ 0 0 139 -3,-0.6 4,-2.0 1,-0.2 -1,-0.2 0.903 113.8 49.3 -61.9 -41.8 56.7 67.9 -25.4 42 51 A L H > S+ 0 0 52 -4,-0.4 4,-3.2 2,-0.2 -1,-0.2 0.901 106.7 54.1 -67.7 -39.3 55.0 70.6 -23.5 43 52 A G H X>S+ 0 0 3 -4,-2.9 4,-2.2 1,-0.3 5,-1.8 0.970 110.4 49.6 -55.5 -46.5 58.2 71.8 -21.9 44 53 A H H <5S+ 0 0 154 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.793 110.7 47.9 -57.0 -44.9 59.4 72.1 -25.5 45 54 A A H <5S+ 0 0 76 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.907 112.4 50.2 -62.8 -41.7 56.3 74.0 -26.5 46 55 A L H <5S- 0 0 28 -4,-3.2 79,-0.5 -5,-0.1 -2,-0.2 0.783 113.1-115.5 -70.8 -28.4 56.7 76.4 -23.5 47 56 A G T <5 + 0 0 41 -4,-2.2 -3,-0.2 -5,-0.2 -4,-0.1 0.797 50.9 165.9 97.0 38.6 60.3 77.1 -24.2 48 57 A I < - 0 0 18 -5,-1.8 -1,-0.2 -6,-0.1 -2,-0.1 -0.789 27.3-144.9 -94.0 106.3 61.9 75.6 -21.1 49 58 A P - 0 0 43 0, 0.0 -1,-0.0 0, 0.0 31,-0.0 -0.101 1.3-142.7 -65.8 168.3 65.7 75.4 -21.8 50 59 A Q - 0 0 128 92,-0.0 23,-0.0 96,-0.0 -2,-0.0 -0.770 19.0-126.6-143.0 93.9 67.7 72.6 -20.6 51 60 A P - 0 0 18 0, 0.0 2,-0.3 0, 0.0 22,-0.0 -0.014 20.1-131.5 -44.7 123.5 71.3 73.4 -19.5 52 61 A P - 0 0 87 0, 0.0 21,-0.1 0, 0.0 3,-0.1 -0.605 19.0-173.2 -73.1 133.2 74.2 71.5 -20.9 53 62 A L > + 0 0 11 -2,-0.3 3,-1.2 1,-0.1 4,-0.2 -0.384 36.1 139.5-115.2 50.9 76.8 70.0 -18.8 54 63 A S G > + 0 0 61 1,-0.3 3,-2.7 2,-0.2 6,-0.3 0.964 69.0 51.9 -66.6 -47.7 79.0 68.9 -21.7 55 64 A S G 3 S+ 0 0 23 1,-0.3 7,-1.9 10,-0.2 11,-0.5 0.514 105.3 58.4 -66.1 -4.7 82.3 69.8 -20.2 56 65 A b G < S+ 0 0 10 -3,-1.2 2,-0.3 5,-0.2 -1,-0.3 0.438 87.8 97.7-101.4 2.2 81.3 67.8 -17.2 57 66 A S S X> S- 0 0 54 -3,-2.7 3,-2.6 -4,-0.2 4,-0.6 -0.712 87.2-114.4 -88.4 139.3 80.9 64.7 -19.4 58 67 A S G >4 S+ 0 0 88 -2,-0.3 3,-1.9 1,-0.3 -1,-0.1 0.844 113.5 50.5 -37.0 -61.3 83.8 62.2 -19.5 59 68 A Q G 34 S+ 0 0 108 1,-0.3 -1,-0.3 -3,-0.0 -4,-0.1 0.548 125.7 29.9 -63.8 -4.1 84.8 62.7 -23.2 60 69 A A G <4 S+ 0 0 49 -3,-2.6 2,-0.3 -6,-0.3 -1,-0.3 0.259 81.9 153.6-134.9 19.7 84.9 66.5 -22.6 61 70 A L << + 0 0 71 -3,-1.9 2,-0.4 -4,-0.6 -5,-0.2 -0.239 7.7 154.1 -58.8 110.2 85.9 66.8 -18.9 62 71 A Q > - 0 0 49 -7,-1.9 4,-3.1 -2,-0.3 3,-0.5 -0.951 39.8-141.3-138.2 119.5 87.6 70.1 -18.2 63 72 A L H > S+ 0 0 57 -2,-0.4 4,-2.5 1,-0.3 5,-0.3 0.882 102.3 44.2 -51.7 -48.0 87.5 71.7 -14.7 64 73 A M H > S+ 0 0 88 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.899 117.7 45.7 -62.4 -36.5 87.0 75.3 -15.9 65 74 A G H > S+ 0 0 18 -3,-0.5 4,-2.0 2,-0.2 -10,-0.2 0.909 112.6 48.3 -76.9 -43.6 84.4 74.3 -18.4 66 75 A b H X S+ 0 0 0 -4,-3.1 4,-3.1 -11,-0.5 3,-0.3 0.978 114.5 46.6 -61.1 -49.1 82.4 72.0 -16.2 67 76 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.3 -2,-0.2 0.869 112.1 49.9 -61.7 -40.5 82.4 74.7 -13.4 68 77 A R H X S+ 0 0 81 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.855 113.8 45.0 -73.4 -29.3 81.4 77.4 -15.8 69 78 A Q H X S+ 0 0 30 -4,-2.0 4,-2.8 -3,-0.3 5,-0.2 0.939 111.4 54.3 -72.7 -45.6 78.6 75.4 -17.3 70 79 A L H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 5,-0.2 0.957 113.3 42.2 -50.5 -53.6 77.4 74.3 -13.9 71 80 A H H X S+ 0 0 41 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.917 113.3 49.3 -64.2 -46.9 77.2 77.9 -12.8 72 81 A S H X S+ 0 0 64 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.862 113.1 50.7 -63.9 -30.6 75.6 79.3 -16.0 73 82 A G H X S+ 0 0 2 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.899 109.5 48.9 -67.8 -46.3 73.0 76.5 -15.8 74 83 A L H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.882 110.5 52.8 -61.2 -36.8 72.3 77.2 -12.1 75 84 A F H X S+ 0 0 130 -4,-2.4 4,-1.7 -5,-0.2 -1,-0.2 0.920 108.0 49.4 -66.8 -42.4 71.9 80.8 -13.1 76 85 A L H X S+ 0 0 49 -4,-1.6 4,-2.4 2,-0.2 3,-0.4 0.962 108.9 52.5 -58.7 -50.0 69.4 79.9 -15.8 77 86 A Y H X S+ 0 0 3 -4,-2.5 4,-2.9 1,-0.3 5,-0.2 0.858 103.2 59.7 -58.5 -33.0 67.4 77.8 -13.3 78 87 A Q H X S+ 0 0 44 -4,-2.1 4,-1.9 2,-0.2 -1,-0.3 0.930 107.9 44.3 -59.9 -42.9 67.4 80.9 -11.0 79 88 A G H X S+ 0 0 22 -4,-1.7 4,-2.4 -3,-0.4 -2,-0.2 0.949 111.7 52.6 -66.7 -46.9 65.6 82.8 -13.8 80 89 A L H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.929 110.4 47.9 -53.1 -48.0 63.2 79.8 -14.5 81 90 A L H X S+ 0 0 3 -4,-2.9 4,-0.6 1,-0.2 5,-0.5 0.872 111.2 51.4 -64.6 -36.2 62.3 79.7 -10.8 82 91 A Q H >< S+ 0 0 128 -4,-1.9 3,-0.9 -5,-0.2 -1,-0.2 0.890 107.6 54.0 -63.9 -37.6 61.7 83.5 -10.8 83 92 A A H 3< S+ 0 0 25 -4,-2.4 43,-0.3 1,-0.2 -2,-0.2 0.847 95.6 64.2 -72.2 -31.8 59.5 83.1 -13.8 84 93 A L H >< S- 0 0 1 -4,-1.8 3,-1.9 -5,-0.2 -1,-0.2 0.756 91.6-153.3 -61.5 -21.6 57.1 80.5 -12.2 85 94 A A T << - 0 0 64 -3,-0.9 2,-0.2 -4,-0.6 -3,-0.1 0.939 65.9 -47.0 45.7 59.1 56.3 83.3 -9.8 86 95 A G T 3 S- 0 0 14 -5,-0.5 2,-1.5 6,-0.1 -1,-0.3 0.110 74.2-129.3 79.2 -20.0 55.3 81.1 -6.8 87 96 A I S < S- 0 0 13 -3,-1.9 46,-0.1 -2,-0.2 45,-0.1 -0.667 78.5 -13.5 69.2 -79.8 53.1 78.8 -9.1 88 97 A S S >> S- 0 0 9 -2,-1.5 3,-2.8 44,-0.1 4,-1.6 -0.966 78.0-101.3-142.7 152.5 50.1 79.0 -6.8 89 98 A P T 34 S+ 0 0 110 0, 0.0 -1,-0.0 0, 0.0 -3,-0.0 0.833 121.8 57.4 -40.7 -43.4 49.8 80.3 -3.1 90 99 A E T 34 S+ 0 0 105 1,-0.2 4,-0.2 2,-0.1 -3,-0.1 0.676 117.8 33.4 -58.7 -27.7 49.8 76.8 -1.8 91 100 A L T <> S+ 0 0 0 -3,-2.8 4,-1.7 -5,-0.2 3,-0.4 0.580 91.2 90.3-106.5 -20.7 53.1 76.2 -3.5 92 101 A A H X S+ 0 0 24 -4,-1.6 4,-3.2 1,-0.2 3,-0.2 0.891 85.1 54.8 -58.8 -39.7 54.8 79.5 -3.3 93 102 A P H > S+ 0 0 82 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.927 109.6 47.9 -53.9 -44.2 56.6 78.8 0.1 94 103 A T H > S+ 0 0 37 -3,-0.4 4,-1.8 1,-0.2 -2,-0.2 0.864 113.3 48.5 -67.2 -27.3 58.1 75.6 -1.4 95 104 A L H X S+ 0 0 2 -4,-1.7 4,-2.1 -9,-0.3 -1,-0.2 0.942 107.3 55.6 -78.9 -45.2 59.2 77.5 -4.4 96 105 A D H X S+ 0 0 80 -4,-3.2 4,-2.5 2,-0.2 -2,-0.2 0.924 109.6 45.7 -50.2 -47.2 60.7 80.2 -2.2 97 106 A T H X S+ 0 0 62 -4,-2.2 4,-3.0 1,-0.2 5,-0.2 0.941 112.2 50.6 -61.1 -47.2 62.9 77.7 -0.4 98 107 A L H X S+ 0 0 1 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.794 111.6 49.8 -59.7 -34.5 64.0 76.0 -3.6 99 108 A Q H X S+ 0 0 50 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.956 111.2 47.6 -72.9 -46.6 64.9 79.4 -4.9 100 109 A L H X S+ 0 0 121 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.927 114.9 46.1 -56.4 -48.8 66.9 80.4 -1.8 101 110 A D H X S+ 0 0 33 -4,-3.0 4,-1.6 2,-0.2 -1,-0.2 0.829 111.5 50.3 -71.2 -29.7 68.8 77.1 -1.8 102 111 A T H X S+ 0 0 0 -4,-1.7 4,-1.9 -5,-0.2 -1,-0.2 0.882 109.9 51.2 -74.7 -37.7 69.6 77.2 -5.5 103 112 A T H X S+ 0 0 45 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.878 108.5 52.7 -63.2 -36.1 70.9 80.7 -5.2 104 113 A D H X S+ 0 0 79 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.902 109.3 48.5 -68.2 -39.1 73.2 79.6 -2.3 105 114 A F H X S+ 0 0 3 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.892 111.2 50.5 -66.8 -38.2 74.6 76.8 -4.3 106 115 A A H X S+ 0 0 3 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.920 107.4 52.2 -73.1 -39.2 75.3 79.1 -7.2 107 116 A I H X S+ 0 0 70 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.918 110.5 50.2 -54.4 -43.5 77.1 81.7 -5.0 108 117 A N H X S+ 0 0 11 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.915 110.1 49.5 -62.5 -44.1 79.3 78.8 -3.7 109 118 A I H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.894 115.9 43.1 -62.5 -43.0 80.1 77.6 -7.3 110 119 A W H X S+ 0 0 87 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.911 109.3 55.5 -71.1 -42.1 81.0 81.1 -8.4 111 120 A Q H X S+ 0 0 89 -4,-2.8 4,-2.4 1,-0.2 3,-0.2 0.971 110.2 48.9 -52.5 -47.8 83.0 81.9 -5.2 112 121 A Q H X S+ 0 0 16 -4,-2.4 4,-1.7 1,-0.3 6,-0.2 0.831 105.9 54.5 -63.6 -40.5 85.1 78.8 -5.9 113 122 A M H <>S+ 0 0 1 -4,-1.6 5,-1.8 2,-0.2 6,-0.5 0.941 109.5 49.3 -59.1 -43.5 85.7 79.8 -9.5 114 123 A E H ><5S+ 0 0 103 -4,-2.4 3,-2.5 1,-0.2 -2,-0.2 0.951 106.3 55.4 -61.9 -45.3 87.0 83.1 -8.3 115 124 A D H 3<5S+ 0 0 122 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.857 112.9 43.6 -54.5 -29.8 89.3 81.3 -5.8 116 125 A L T 3<5S- 0 0 77 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.417 111.1-120.5 -97.8 5.7 90.7 79.4 -8.7 117 126 A G T < 5S+ 0 0 67 -3,-2.5 -3,-0.2 -4,-0.2 -2,-0.1 0.484 85.2 110.9 64.6 5.9 91.0 82.5 -11.0 118 127 A M < + 0 0 24 -5,-1.8 -4,-0.2 -6,-0.2 -5,-0.1 0.030 48.8 145.0-104.5 32.4 88.6 80.7 -13.6 119 128 A A 0 0 23 -6,-0.5 -51,-0.0 -5,-0.2 -9,-0.0 -0.624 360.0 360.0 -83.4 160.5 85.6 82.9 -13.2 120 129 A P 0 0 124 0, 0.0 -1,-0.1 0, 0.0 -52,-0.1 0.525 360.0 360.0 -87.9 360.0 83.4 84.0 -15.1 121 ! 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 0.0 122 137 A T 0 0 173 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 137.7 65.7 84.4 -22.7 123 138 A M - 0 0 82 -75,-0.1 -75,-0.1 1,-0.1 -76,-0.0 -0.915 360.0-114.0-115.2 124.9 62.9 83.4 -20.1 124 139 A P - 0 0 17 0, 0.0 2,-0.6 0, 0.0 -77,-0.1 0.081 20.1-138.1 -41.8 144.8 59.7 81.4 -20.6 125 140 A A - 0 0 73 -79,-0.5 2,-0.6 -41,-0.0 -41,-0.1 -0.973 20.5-179.7-110.8 117.6 56.3 83.0 -20.2 126 141 A F + 0 0 5 -2,-0.6 -80,-0.0 -43,-0.3 6,-0.0 -0.983 9.7 165.6-115.3 109.6 53.9 80.8 -18.3 127 142 A T + 0 0 118 -2,-0.6 2,-0.2 5,-0.0 -1,-0.1 0.768 52.6 63.2-102.5 -27.5 50.7 82.8 -18.2 128 143 A S S > S- 0 0 52 1,-0.1 4,-1.9 0, 0.0 5,-0.1 -0.535 83.8-120.4 -89.0 167.3 48.1 80.2 -17.1 129 144 A A H > S+ 0 0 48 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.802 115.5 57.1 -75.0 -27.9 48.2 78.3 -13.8 130 145 A F H > S+ 0 0 122 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.875 105.4 52.2 -68.4 -34.5 48.4 75.0 -15.7 131 146 A Q H > S+ 0 0 51 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.964 111.1 45.0 -64.6 -50.2 51.5 76.3 -17.4 132 147 A R H X S+ 0 0 56 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.886 113.1 53.0 -61.7 -35.5 53.2 77.2 -14.1 133 148 A R H X S+ 0 0 44 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.893 116.4 35.6 -71.1 -37.4 52.1 73.9 -12.6 134 149 A A H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.838 117.1 54.6 -82.4 -29.5 53.6 71.7 -15.4 135 150 A G H X S+ 0 0 0 -4,-2.8 4,-2.7 -5,-0.3 5,-0.2 0.954 106.7 53.4 -63.4 -42.3 56.6 74.1 -15.8 136 151 A G H X S+ 0 0 1 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.862 109.8 45.5 -61.0 -41.5 57.2 73.7 -12.0 137 152 A V H X S+ 0 0 2 -4,-1.2 4,-1.2 2,-0.2 -1,-0.2 0.843 115.3 48.2 -74.4 -30.9 57.3 69.8 -12.3 138 153 A L H >X S+ 0 0 12 -4,-1.8 4,-2.5 2,-0.2 3,-0.6 0.986 113.1 44.9 -68.8 -59.7 59.6 70.0 -15.3 139 154 A V H 3X S+ 0 0 1 -4,-2.7 4,-3.0 1,-0.3 5,-0.3 0.941 111.8 54.9 -50.9 -51.5 62.1 72.5 -14.0 140 155 A A H 3X S+ 0 0 3 -4,-2.0 4,-1.3 -5,-0.2 -1,-0.3 0.805 113.6 39.3 -53.9 -38.2 62.2 70.6 -10.6 141 156 A S H X S+ 0 0 7 -4,-2.0 3,-0.7 2,-0.2 4,-0.5 0.972 113.6 45.0 -64.2 -55.2 81.8 65.2 -12.3 154 169 A L H >< S+ 0 0 2 -4,-2.9 3,-1.6 1,-0.2 -2,-0.2 0.907 109.4 55.2 -57.0 -45.7 83.0 67.3 -9.3 155 170 A R H 3< S+ 0 0 163 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.789 106.9 52.0 -57.0 -31.4 83.7 64.2 -7.1 156 171 A H H << S+ 0 0 67 -4,-1.2 2,-0.8 -3,-0.7 -1,-0.3 0.542 89.8 77.3 -82.8 -11.8 85.9 62.9 -9.9 157 172 A F << 0 0 41 -3,-1.6 -1,-0.2 -4,-0.5 -2,-0.1 -0.337 360.0 360.0 -92.1 55.4 87.9 66.2 -9.9 158 173 A A 0 0 107 -2,-0.8 -3,-0.1 -3,-0.2 -2,-0.1 -0.689 360.0 360.0-177.7 360.0 89.4 64.7 -6.8