==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 03-MAR-03 1OOI . COMPND 2 MOLECULE: ODORANT BINDING PROTEIN LUSH; . SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; . AUTHOR S.W.KRUSE,R.ZHAO,D.P.SMITH,D.N.M.JONES . 124 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6843.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 89 71.8 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 . 2 1.6 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 . 1 0.8 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 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 62 50.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.6 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 1 0 0 0 0 0 2 2 0 0 0 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 . 1 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 X M 0 0 75 0, 0.0 2,-0.2 0, 0.0 75,-0.0 0.000 360.0 360.0 360.0 141.6 30.6 37.1 2.1 2 2 X T > - 0 0 57 76,-0.1 4,-2.2 1,-0.1 5,-0.1 -0.628 360.0-118.6 -96.2 159.0 33.4 39.2 3.3 3 3 X M H > S+ 0 0 57 -2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.806 121.5 59.0 -60.2 -24.2 37.0 38.2 3.2 4 4 X E H > S+ 0 0 128 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.931 104.6 44.2 -71.0 -46.6 36.5 38.6 6.9 5 5 X Q H > S+ 0 0 103 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.848 111.2 57.2 -64.9 -34.0 33.7 36.0 7.1 6 6 X F H X S+ 0 0 14 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.937 107.1 46.6 -62.1 -46.4 35.7 33.7 4.9 7 7 X L H X S+ 0 0 79 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.897 111.0 50.9 -64.4 -45.2 38.7 33.6 7.2 8 8 X T H X S+ 0 0 55 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.899 110.2 51.6 -59.0 -41.5 36.6 33.1 10.3 9 9 X S H X S+ 0 0 30 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.929 106.0 53.7 -62.5 -43.9 35.0 30.2 8.5 10 10 X L H X S+ 0 0 5 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.898 111.7 46.2 -55.8 -40.5 38.4 28.7 7.6 11 11 X D H X S+ 0 0 78 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.854 112.0 49.6 -73.3 -34.5 39.3 28.8 11.3 12 12 X M H X S+ 0 0 107 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.948 111.0 49.7 -68.6 -48.4 36.0 27.3 12.5 13 13 X I H X S+ 0 0 31 -4,-2.9 4,-1.9 1,-0.2 3,-0.4 0.922 110.1 50.1 -55.9 -48.1 36.2 24.4 10.0 14 14 X R H X S+ 0 0 48 -4,-2.0 4,-3.0 -5,-0.2 -1,-0.2 0.861 106.4 56.3 -60.8 -36.4 39.8 23.6 11.0 15 15 X S H < S+ 0 0 75 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.829 109.4 46.0 -65.5 -32.9 38.8 23.5 14.7 16 16 X G H < S+ 0 0 35 -4,-1.5 4,-0.3 -3,-0.4 -1,-0.2 0.848 121.4 36.1 -75.8 -35.5 36.1 20.9 14.1 17 17 X a H >X S+ 0 0 1 -4,-1.9 3,-1.2 -5,-0.2 4,-0.5 0.887 103.7 67.3 -88.8 -39.9 38.3 18.7 11.9 18 18 X A G >< S+ 0 0 27 -4,-3.0 3,-2.5 1,-0.2 -3,-0.1 0.900 91.2 64.1 -45.3 -53.3 41.7 19.0 13.5 19 19 X P G 34 S+ 0 0 98 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.744 95.2 58.3 -45.4 -39.3 40.6 17.2 16.8 20 20 X K G <4 S+ 0 0 153 -3,-1.2 2,-0.3 -4,-0.3 -2,-0.2 0.659 108.0 49.6 -67.4 -19.3 39.9 13.8 15.0 21 21 X F S << S- 0 0 48 -3,-2.5 2,-0.9 -4,-0.5 23,-0.0 -0.781 79.1-118.7-124.5 164.6 43.4 13.5 13.7 22 22 X K + 0 0 181 -2,-0.3 2,-0.3 2,-0.0 21,-0.1 -0.879 51.5 164.9-102.0 103.1 47.0 13.7 14.7 23 23 X L - 0 0 37 -2,-0.9 2,-0.5 -5,-0.1 3,-0.0 -0.847 40.4-120.0-123.7 153.3 48.4 16.5 12.7 24 24 X K >> - 0 0 147 -2,-0.3 3,-1.8 1,-0.1 4,-1.6 -0.833 20.8-139.6 -93.7 125.6 51.4 18.8 12.6 25 25 X T H 3> S+ 0 0 86 -2,-0.5 4,-2.2 1,-0.3 -1,-0.1 0.809 103.2 56.6 -55.2 -36.0 50.5 22.5 13.0 26 26 X E H 3> S+ 0 0 118 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.778 103.6 55.8 -67.4 -25.4 53.1 23.5 10.4 27 27 X D H <> S+ 0 0 19 -3,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.953 108.4 46.1 -69.5 -47.8 51.4 21.1 7.9 28 28 X L H X S+ 0 0 10 -4,-1.6 4,-2.8 1,-0.2 -2,-0.2 0.897 109.5 55.8 -58.9 -41.8 48.1 22.9 8.4 29 29 X D H X S+ 0 0 82 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.867 107.5 49.1 -58.6 -40.6 49.8 26.2 8.1 30 30 X R H ><>S+ 0 0 89 -4,-1.5 5,-2.7 -3,-0.2 3,-0.5 0.934 111.6 48.0 -65.1 -47.5 51.2 25.2 4.7 31 31 X L H ><5S+ 0 0 0 -4,-2.3 3,-2.5 1,-0.2 -2,-0.2 0.914 103.1 63.9 -60.1 -42.1 47.8 24.0 3.5 32 32 X R H 3<5S+ 0 0 36 -4,-2.8 91,-0.9 1,-0.3 -1,-0.2 0.857 106.7 42.1 -51.1 -40.4 46.2 27.3 4.7 33 33 X V T <<5S- 0 0 105 -4,-1.1 -1,-0.3 -3,-0.5 88,-0.3 0.259 124.5-102.2 -95.1 13.8 48.3 29.3 2.2 34 34 X G T < 5S+ 0 0 18 -3,-2.5 2,-1.1 1,-0.2 -3,-0.2 0.712 74.2 142.8 79.9 19.9 47.7 26.7 -0.6 35 35 X D < + 0 0 61 -5,-2.7 -1,-0.2 -6,-0.2 -2,-0.1 -0.780 7.8 156.8 -94.1 93.0 51.1 25.0 -0.3 36 36 X F + 0 0 3 -2,-1.1 2,-1.8 75,-0.2 -1,-0.1 0.242 36.3 115.3 -96.3 10.4 50.2 21.4 -1.0 37 37 X N + 0 0 134 -7,-0.1 -1,-0.1 2,-0.1 -2,-0.0 -0.479 56.2 77.1 -84.5 69.4 53.8 20.6 -2.1 38 38 X F S S- 0 0 22 -2,-1.8 0, 0.0 -11,-0.0 0, 0.0 -0.910 92.4 -86.9-167.5 147.9 54.8 18.2 0.6 39 39 X P - 0 0 120 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.460 47.0-142.2 -65.5 120.4 54.1 14.6 1.4 40 40 X P - 0 0 41 0, 0.0 2,-0.1 0, 0.0 -4,-0.0 -0.555 7.6-126.1 -85.7 146.1 50.8 14.3 3.4 41 41 X S > - 0 0 53 -2,-0.2 4,-2.0 1,-0.1 5,-0.1 -0.396 29.9-109.1 -75.9 165.6 50.3 11.9 6.2 42 42 X Q H > S+ 0 0 93 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.931 122.9 53.1 -60.4 -44.3 47.2 9.6 5.9 43 43 X D H > S+ 0 0 61 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.872 107.3 51.6 -56.8 -40.1 45.7 11.6 8.8 44 44 X L H > S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.885 108.8 50.2 -67.7 -38.2 46.3 14.9 6.9 45 45 X M H X S+ 0 0 14 -4,-2.0 4,-1.3 1,-0.2 3,-0.2 0.920 110.8 49.3 -64.1 -41.2 44.6 13.5 3.8 46 46 X b H X S+ 0 0 24 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.826 103.7 61.0 -69.5 -29.8 41.7 12.5 6.0 47 47 X Y H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.905 102.3 52.2 -58.4 -42.8 41.6 16.0 7.4 48 48 X T H X S+ 0 0 0 -4,-1.5 4,-2.0 -3,-0.2 -1,-0.2 0.844 108.6 49.7 -65.6 -34.0 41.0 17.3 3.9 49 49 X K H X S+ 0 0 37 -4,-1.3 4,-3.0 2,-0.2 5,-0.2 0.925 110.2 50.8 -66.8 -44.4 38.0 15.0 3.4 50 50 X a H X S+ 0 0 17 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.938 110.9 48.7 -58.6 -47.5 36.6 16.1 6.8 51 51 X V H X S+ 0 0 5 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.889 113.1 47.8 -59.2 -40.6 37.0 19.7 5.8 52 52 X S H X>S+ 0 0 8 -4,-2.0 4,-1.8 2,-0.2 5,-1.6 0.893 109.6 50.5 -71.6 -39.8 35.3 19.0 2.4 53 53 X L H <5S+ 0 0 57 -4,-3.0 -2,-0.2 2,-0.2 -1,-0.2 0.951 110.7 51.5 -60.0 -47.8 32.4 17.1 3.9 54 54 X M H <5S+ 0 0 108 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.900 113.0 44.0 -53.2 -46.2 31.9 20.0 6.3 55 55 X A H <5S- 0 0 34 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.728 112.2-129.0 -71.8 -24.2 31.9 22.4 3.4 56 56 X G T <5S+ 0 0 15 -4,-1.8 -3,-0.2 -5,-0.1 -2,-0.1 0.652 73.2 117.2 87.6 18.8 29.6 19.9 1.6 57 57 X T S - 0 0 64 4,-1.5 3,-2.2 -2,-0.3 -6,-0.1 -0.546 42.7 -90.5-102.4 178.0 30.5 12.7 -0.6 60 60 X K T 3 S+ 0 0 170 1,-0.3 42,-0.1 -2,-0.2 -7,-0.0 0.687 125.6 60.8 -67.3 -15.6 31.7 10.1 1.9 61 61 X K T 3 S- 0 0 128 2,-0.1 -1,-0.3 41,-0.1 44,-0.1 0.403 119.8-110.4 -86.0 1.6 33.4 8.1 -0.9 62 62 X G < + 0 0 0 -3,-2.2 2,-0.4 1,-0.3 -2,-0.1 0.560 67.4 150.2 84.0 8.7 35.6 11.2 -1.4 63 63 X E - 0 0 61 1,-0.1 -4,-1.5 34,-0.0 -1,-0.3 -0.617 46.4-124.5 -80.8 128.5 34.0 12.0 -4.8 64 64 X F B -A 58 0A 17 -2,-0.4 2,-0.9 -6,-0.2 -6,-0.2 -0.529 11.3-145.3 -73.0 133.9 34.0 15.7 -5.7 65 65 X N > + 0 0 74 -8,-2.8 4,-2.5 -2,-0.2 5,-0.2 -0.763 20.7 177.7-101.4 85.7 30.5 17.2 -6.5 66 66 X A H > S+ 0 0 5 -2,-0.9 4,-3.0 1,-0.2 5,-0.2 0.908 77.3 49.8 -56.4 -49.9 31.4 19.8 -9.2 67 67 X P H > S+ 0 0 81 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.939 113.1 46.6 -57.5 -46.8 27.8 20.9 -9.9 68 68 X K H > S+ 0 0 88 1,-0.2 4,-3.2 2,-0.2 -2,-0.2 0.930 114.5 47.6 -61.2 -45.8 27.0 21.4 -6.2 69 69 X A H X S+ 0 0 4 -4,-2.5 4,-0.9 1,-0.2 -1,-0.2 0.920 112.4 48.7 -59.8 -45.4 30.3 23.3 -5.7 70 70 X L H < S+ 0 0 52 -4,-3.0 3,-0.3 -5,-0.2 -1,-0.2 0.861 115.3 45.2 -64.3 -35.7 29.7 25.5 -8.8 71 71 X A H < S+ 0 0 76 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.925 115.7 45.9 -73.0 -44.1 26.2 26.2 -7.6 72 72 X Q H >< S+ 0 0 72 -4,-3.2 3,-2.2 1,-0.2 4,-0.2 0.470 78.8 108.4 -78.2 -3.4 27.2 26.9 -4.0 73 73 X L G >X S+ 0 0 14 -4,-0.9 4,-2.4 -3,-0.3 3,-2.3 0.828 71.9 58.7 -46.7 -45.2 30.2 29.1 -4.8 74 74 X P G 34 S+ 0 0 67 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.762 111.1 43.3 -57.0 -27.0 28.6 32.4 -3.6 75 75 X H G <4 S+ 0 0 142 -3,-2.2 -2,-0.2 -4,-0.1 -3,-0.1 0.207 116.0 50.3-102.7 13.8 28.2 30.8 -0.2 76 76 X L T <4 S+ 0 0 42 -3,-2.3 -3,-0.1 1,-0.4 -1,-0.1 0.742 113.3 20.6-116.5 -42.3 31.6 29.4 -0.2 77 77 X V S < S- 0 0 16 -4,-2.4 -1,-0.4 1,-0.0 5,-0.1 -0.905 82.3 -95.8-130.6 156.8 34.1 32.1 -1.1 78 78 X P >> - 0 0 0 0, 0.0 3,-2.3 0, 0.0 4,-0.5 -0.264 48.0-101.2 -63.6 161.2 34.2 35.9 -1.2 79 79 X P H >> S+ 0 0 88 0, 0.0 3,-0.7 0, 0.0 4,-0.5 0.774 121.1 58.2 -60.6 -31.2 33.3 37.5 -4.5 80 80 X E H 34 S+ 0 0 126 1,-0.2 4,-0.2 2,-0.1 -77,-0.0 0.439 108.0 47.6 -79.0 -0.1 36.9 38.2 -5.4 81 81 X M H <> S+ 0 0 11 -3,-2.3 4,-2.3 2,-0.1 -1,-0.2 0.432 89.0 90.6-114.7 -3.7 37.7 34.5 -5.2 82 82 X M H S+ 0 0 19 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.907 113.7 50.1 -65.7 -38.3 39.4 31.7 -9.7 85 85 X S H X S+ 0 0 16 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.933 109.5 51.6 -64.5 -42.7 37.4 29.2 -7.6 86 86 X R H X S+ 0 0 92 -4,-3.2 4,-2.0 1,-0.2 -1,-0.2 0.878 110.5 47.0 -60.7 -43.9 35.1 28.4 -10.6 87 87 X K H X S+ 0 0 100 -4,-2.1 4,-3.0 2,-0.2 -1,-0.2 0.909 110.9 51.8 -67.1 -44.1 38.0 27.8 -13.0 88 88 X S H X S+ 0 0 3 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.901 110.5 48.7 -58.0 -44.3 39.8 25.5 -10.4 89 89 X V H X S+ 0 0 8 -4,-2.3 4,-0.9 2,-0.2 -1,-0.2 0.917 111.5 51.1 -59.4 -40.3 36.6 23.5 -10.0 90 90 X E H < S+ 0 0 85 -4,-2.0 3,-0.4 1,-0.2 -2,-0.2 0.925 114.2 42.8 -67.7 -39.0 36.5 23.4 -13.8 91 91 X A H < S+ 0 0 56 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.714 121.8 38.3 -77.4 -19.9 40.1 22.1 -14.0 92 92 X c H >< S+ 0 0 0 -4,-1.8 3,-1.1 -5,-0.2 4,-0.4 0.335 77.3 109.1-116.1 9.6 39.9 19.6 -11.1 93 93 X R T 3< S+ 0 0 74 -4,-0.9 -27,-0.2 -3,-0.4 3,-0.2 0.782 88.4 35.9 -61.2 -30.9 36.4 18.1 -11.4 94 94 X D T > S+ 0 0 81 -4,-0.2 3,-1.7 -3,-0.2 4,-0.3 0.424 86.0 101.1-103.1 0.9 37.6 14.7 -12.5 95 95 X T G X S+ 0 0 24 -3,-1.1 3,-1.7 1,-0.3 -1,-0.1 0.860 75.9 59.7 -51.2 -41.9 40.8 14.4 -10.5 96 96 X H G > S+ 0 0 14 -4,-0.4 3,-1.6 1,-0.3 -1,-0.3 0.693 86.6 78.4 -64.2 -16.8 39.3 12.1 -7.9 97 97 X K G < S+ 0 0 143 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.696 86.4 59.8 -68.3 -15.8 38.5 9.6 -10.5 98 98 X Q G < S+ 0 0 145 -3,-1.7 2,-0.3 -4,-0.3 -1,-0.3 0.252 98.8 66.1 -96.5 10.6 42.1 8.4 -10.5 99 99 X F < - 0 0 45 -3,-1.6 3,-0.0 1,-0.1 6,-0.0 -0.964 57.6-160.3-134.7 150.6 42.2 7.4 -6.9 100 100 X K + 0 0 193 -2,-0.3 2,-0.4 5,-0.0 -1,-0.1 0.743 67.3 79.4-101.4 -27.5 40.5 4.7 -4.9 101 101 X E S > S- 0 0 73 1,-0.1 4,-2.9 -39,-0.0 5,-0.2 -0.708 73.3-134.7 -93.0 134.1 40.7 5.7 -1.3 102 102 X S H > S+ 0 0 27 -2,-0.4 4,-1.7 1,-0.2 5,-0.2 0.859 103.8 46.2 -52.1 -45.8 38.2 8.3 -0.0 103 103 X b H > S+ 0 0 8 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.938 114.4 47.8 -64.9 -45.8 40.8 10.4 1.9 104 104 X E H > S+ 0 0 63 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.911 106.8 57.2 -62.5 -44.3 43.3 10.4 -1.0 105 105 X R H X S+ 0 0 46 -4,-2.9 4,-2.0 2,-0.2 -1,-0.2 0.912 112.0 41.3 -48.9 -50.3 40.6 11.3 -3.5 106 106 X V H X S+ 0 0 3 -4,-1.7 4,-2.9 2,-0.2 5,-0.2 0.936 114.3 51.3 -67.9 -47.2 39.8 14.5 -1.6 107 107 X Y H X S+ 0 0 4 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.928 111.3 48.3 -55.4 -45.6 43.3 15.3 -0.9 108 108 X Q H X S+ 0 0 45 -4,-3.4 4,-2.3 1,-0.2 -1,-0.2 0.886 111.4 50.2 -64.3 -37.9 44.3 14.9 -4.5 109 109 X T H X S+ 0 0 3 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.928 111.8 47.7 -64.3 -44.6 41.3 17.1 -5.6 110 110 X A H X S+ 0 0 2 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.916 109.2 53.2 -64.3 -43.0 42.3 19.8 -3.1 111 111 X K H X S+ 0 0 41 -4,-2.8 4,-2.0 -5,-0.2 -1,-0.2 0.940 108.3 52.1 -54.0 -47.2 46.0 19.6 -4.3 112 112 X c H X S+ 0 0 19 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.903 106.0 52.4 -58.7 -43.9 44.6 20.2 -7.8 113 113 X F H >X S+ 0 0 25 -4,-2.2 3,-0.7 1,-0.2 4,-0.6 0.944 110.1 50.7 -54.3 -47.5 42.7 23.3 -6.7 114 114 X S H 3< S+ 0 0 20 -4,-2.4 3,-0.5 1,-0.2 -2,-0.2 0.847 110.2 47.7 -60.7 -37.4 45.9 24.6 -5.2 115 115 X E H 3< S+ 0 0 136 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.664 114.2 47.6 -80.2 -16.5 47.9 24.1 -8.4 116 116 X N H << S+ 0 0 75 -4,-1.3 2,-0.6 -3,-0.7 -1,-0.2 0.424 78.2 126.1-104.3 1.1 45.3 25.7 -10.5 117 117 X A < - 0 0 25 -4,-0.6 2,-2.0 -3,-0.5 4,-0.1 -0.454 46.8-158.9 -67.8 108.4 44.7 28.8 -8.4 118 118 X D S S- 0 0 131 -2,-0.6 2,-0.3 -34,-0.2 -1,-0.1 -0.571 76.9 -11.8 -81.1 73.3 45.1 31.9 -10.6 119 119 X G S S+ 0 0 50 -2,-2.0 2,-0.1 -35,-0.1 -38,-0.0 -0.853 118.5 0.2 131.3-166.0 45.7 33.9 -7.5 120 120 X Q - 0 0 140 -2,-0.3 2,-0.4 1,-0.0 -2,-0.1 -0.326 59.6-175.5 -60.4 129.2 45.4 33.6 -3.7 121 121 X F - 0 0 26 -88,-0.3 2,-0.3 -4,-0.1 -86,-0.1 -0.985 0.8-171.3-129.4 138.8 44.1 30.2 -2.6 122 122 X M - 0 0 29 -2,-0.4 -89,-0.2 -89,-0.1 -90,-0.2 -0.964 9.6-165.8-134.9 152.2 43.3 29.2 1.0 123 123 X W 0 0 20 -91,-0.9 -89,-0.1 -2,-0.3 -2,-0.0 -0.991 360.0 360.0-135.7 139.2 42.4 26.0 2.9 124 124 X P 0 0 9 0, 0.0 -92,-0.1 0, 0.0 -1,-0.1 0.918 360.0 360.0 -52.9 360.0 41.0 25.6 6.4