==== 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 TRANSFERASE 30-JAN-08 3C4Y . COMPND 2 MOLECULE: RHODOPSIN KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR P.SINGH,J.J.G.TESMER . 944 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 50820.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 583 61.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 76 8.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 60 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 304 32.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 1.9 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 8 10 0 0 0 2 6 4 2 4 4 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 . 9 8 3 0 1 1 0 1 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 . 2 1 2 0 1 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 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 30 A S 0 0 148 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 166.3 -45.4 -42.3 -38.8 2 31 A R - 0 0 164 5,-0.0 2,-0.3 0, 0.0 174,-0.1 -0.979 360.0-142.3-134.9 144.4 -43.4 -41.6 -35.6 3 32 A D - 0 0 57 172,-0.7 0, 0.0 173,-0.6 0, 0.0 -0.691 8.7-169.3 -98.9 155.8 -40.7 -43.3 -33.5 4 33 A R S > S+ 0 0 217 -2,-0.3 4,-1.2 3,-0.1 -1,-0.1 0.793 76.2 56.7-112.8 -49.4 -40.6 -43.1 -29.7 5 34 A K H > S+ 0 0 154 1,-0.2 4,-0.5 2,-0.2 171,-0.1 0.844 114.8 41.0 -60.7 -37.6 -37.3 -44.5 -28.4 6 35 A Y H 4 S+ 0 0 37 1,-0.2 -1,-0.2 2,-0.2 170,-0.2 0.703 113.7 53.3 -81.5 -23.3 -35.2 -42.1 -30.5 7 36 A L H >4 S+ 0 0 54 169,-0.2 3,-0.6 1,-0.2 -2,-0.2 0.622 101.2 64.4 -79.9 -15.4 -37.6 -39.2 -29.7 8 37 A A H 3< S+ 0 0 60 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.746 87.2 66.2 -78.8 -27.3 -37.1 -40.1 -26.0 9 38 A R T 3< S+ 0 0 145 -4,-0.5 2,-0.5 1,-0.1 -1,-0.2 0.233 88.8 83.0 -75.7 16.4 -33.3 -39.2 -26.0 10 39 A L < + 0 0 35 -3,-0.6 2,-0.3 2,-0.0 -1,-0.1 -0.836 58.8 156.7-131.4 90.5 -34.4 -35.6 -26.6 11 40 A K - 0 0 108 -2,-0.5 521,-0.1 521,-0.0 134,-0.0 -0.768 47.5-102.8-118.5 160.0 -35.4 -33.7 -23.4 12 41 A L - 0 0 28 -2,-0.3 130,-0.1 519,-0.1 126,-0.0 -0.717 48.3-140.7 -83.2 123.2 -35.7 -30.0 -22.3 13 42 A P - 0 0 14 0, 0.0 128,-0.1 0, 0.0 -1,-0.1 -0.085 7.1-104.4 -85.0 175.3 -32.6 -29.3 -20.1 14 43 A P - 0 0 45 0, 0.0 598,-0.2 0, 0.0 4,-0.2 0.033 32.4-110.7 -76.9-163.5 -31.9 -27.3 -16.9 15 44 A L S S+ 0 0 35 596,-0.9 597,-0.1 593,-0.2 3,-0.1 0.521 97.6 77.9-117.6 -11.6 -30.1 -23.9 -16.7 16 45 A S S S+ 0 0 72 595,-0.2 3,-0.2 1,-0.2 -1,-0.1 0.535 95.8 54.5 -76.8 -5.8 -26.7 -24.5 -15.1 17 46 A K S > S+ 0 0 111 1,-0.2 2,-1.9 2,-0.1 3,-1.1 0.756 87.8 74.8 -94.8 -33.3 -25.4 -25.8 -18.4 18 47 A C T 3 S+ 0 0 12 1,-0.2 -1,-0.2 -4,-0.2 122,-0.1 -0.368 74.9 85.7 -81.0 57.4 -26.3 -22.9 -20.7 19 48 A E T 3> S+ 0 0 113 -2,-1.9 4,-0.7 -3,-0.2 -1,-0.2 0.521 78.9 57.4-124.3 -26.8 -23.4 -20.8 -19.3 20 49 A A H <> S+ 0 0 73 -3,-1.1 4,-0.9 1,-0.2 -2,-0.1 0.671 107.6 53.4 -73.6 -20.0 -20.5 -22.0 -21.6 21 50 A L H > S+ 0 0 37 -4,-0.3 4,-1.4 2,-0.1 -1,-0.2 0.820 94.7 69.9 -77.9 -36.6 -22.8 -20.8 -24.5 22 51 A R H 4 S+ 0 0 169 1,-0.2 -2,-0.2 2,-0.2 -1,-0.1 0.835 109.2 29.0 -53.5 -43.5 -23.2 -17.3 -23.0 23 52 A E H < S+ 0 0 150 -4,-0.7 -1,-0.2 1,-0.1 -2,-0.1 0.886 115.6 54.2 -88.7 -44.4 -19.6 -16.1 -23.7 24 53 A S H < S+ 0 0 97 -4,-0.9 2,-0.3 2,-0.0 -2,-0.2 0.669 98.5 71.5 -73.8 -19.9 -18.4 -18.1 -26.7 25 54 A L < + 0 0 95 -4,-1.4 -4,-0.0 -5,-0.1 0, 0.0 -0.772 52.3 178.2 -96.3 146.9 -21.3 -17.0 -29.0 26 55 A D + 0 0 150 -2,-0.3 2,-0.7 2,-0.1 -1,-0.1 -0.220 7.9 176.0-142.5 44.5 -21.6 -13.5 -30.3 27 56 A L - 0 0 69 4,-0.1 2,-0.2 3,-0.1 5,-0.1 -0.398 18.6-151.7 -63.1 103.6 -24.7 -13.4 -32.5 28 57 A G >> - 0 0 49 -2,-0.7 3,-1.7 1,-0.1 4,-0.6 -0.500 40.9 -89.4 -65.5 147.1 -25.2 -9.8 -33.7 29 58 A F G >4>S+ 0 0 45 1,-0.3 3,-1.5 2,-0.2 5,-0.6 0.734 125.2 54.3 -23.8 -57.2 -28.9 -9.1 -34.3 30 59 A E G 345S+ 0 0 142 1,-0.3 5,-0.4 2,-0.1 -1,-0.3 0.842 103.1 54.3 -57.0 -42.2 -28.8 -10.2 -38.0 31 60 A G G <45S+ 0 0 22 -3,-1.7 -1,-0.3 3,-0.1 -2,-0.2 0.530 113.5 40.4 -74.1 -6.8 -27.3 -13.6 -37.5 32 61 A M T XX5S+ 0 0 21 -3,-1.5 4,-3.9 -4,-0.6 3,-0.9 0.682 117.6 10.8-107.8 -97.6 -30.0 -14.7 -35.0 33 62 A C T 345S+ 0 0 2 -4,-0.4 7,-0.6 1,-0.3 -3,-0.1 0.812 120.5 55.6 -66.8 -38.5 -33.8 -14.0 -35.2 34 63 A L T 34X - 0 0 23 -4,-3.9 4,-3.5 1,-0.2 3,-1.0 -0.718 66.9-156.5 -85.8 109.7 -32.9 -18.5 -37.5 37 66 A P H 3> S+ 0 0 25 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.790 93.6 53.9 -63.2 -30.6 -36.6 -19.5 -37.5 38 67 A I H 3> S+ 0 0 0 2,-0.2 4,-1.7 3,-0.2 5,-0.1 0.816 115.3 42.6 -69.1 -30.1 -36.6 -20.8 -34.0 39 68 A G H <> S+ 0 0 0 -3,-1.0 4,-3.4 -7,-0.2 5,-0.4 0.964 113.1 52.7 -70.3 -60.2 -35.2 -17.4 -33.1 40 69 A K H X S+ 0 0 66 -4,-3.5 4,-3.2 -7,-0.6 -2,-0.2 0.896 115.9 40.0 -31.3 -61.6 -37.7 -15.7 -35.4 41 70 A R H X S+ 0 0 107 -4,-3.2 4,-4.2 2,-0.2 -1,-0.2 0.909 114.0 50.6 -68.3 -47.1 -40.6 -17.5 -33.7 42 71 A L H X S+ 0 0 0 -4,-1.7 4,-1.0 2,-0.2 -1,-0.2 0.907 117.2 42.1 -58.1 -40.9 -39.4 -17.3 -30.1 43 72 A F H X S+ 0 0 16 -4,-3.4 4,-1.9 2,-0.3 -2,-0.2 0.876 111.8 53.9 -75.3 -38.0 -38.9 -13.5 -30.6 44 73 A Q H >X S+ 0 0 23 -4,-3.2 4,-0.8 -5,-0.4 3,-0.8 0.978 109.2 50.6 -47.6 -55.4 -42.1 -13.3 -32.5 45 74 A Q H 3X S+ 0 0 2 -4,-4.2 4,-1.2 1,-0.3 -2,-0.3 0.738 105.2 55.8 -59.4 -27.0 -43.5 -15.0 -29.4 46 75 A F H 3X S+ 0 0 1 -4,-1.0 4,-1.3 1,-0.2 -1,-0.3 0.853 109.4 46.0 -71.3 -35.5 -41.8 -12.3 -27.3 47 76 A L H << S+ 0 0 15 -4,-1.9 6,-0.2 -3,-0.8 -2,-0.2 0.553 106.3 63.1 -80.8 -9.4 -43.6 -9.6 -29.2 48 77 A R H < S+ 0 0 129 -4,-0.8 -2,-0.2 -5,-0.2 -1,-0.2 0.891 111.3 32.0 -82.6 -44.8 -46.9 -11.5 -28.9 49 78 A T H < S+ 0 0 12 -4,-1.2 2,-0.9 902,-0.1 -2,-0.2 0.806 106.4 77.2 -82.3 -34.3 -47.3 -11.4 -25.1 50 79 A H S >< S- 0 0 20 -4,-1.3 3,-1.1 -5,-0.2 -1,-0.1 -0.733 73.6-160.9 -78.2 108.4 -45.5 -8.0 -24.8 51 80 A E G > S+ 0 0 119 -2,-0.9 3,-1.0 1,-0.2 -1,-0.1 0.660 74.5 72.5 -72.2 -21.9 -48.4 -5.7 -26.0 52 81 A Q G 3 S+ 0 0 72 1,-0.3 -1,-0.2 2,-0.1 4,-0.1 0.660 98.6 48.0 -71.9 -17.6 -46.4 -2.6 -26.9 53 82 A H G <> S+ 0 0 25 -3,-1.1 4,-0.6 -6,-0.2 -1,-0.3 -0.251 74.5 106.6-121.4 42.7 -44.9 -4.1 -30.0 54 83 A G H X> S+ 0 0 28 -3,-1.0 4,-2.5 2,-0.2 3,-0.5 0.934 80.2 51.1 -72.9 -57.8 -48.0 -5.6 -31.7 55 84 A P H 3> S+ 0 0 31 0, 0.0 4,-1.4 0, 0.0 39,-0.1 0.807 112.1 47.1 -49.6 -38.4 -48.2 -2.9 -34.4 56 85 A A H 3> S+ 0 0 0 2,-0.2 4,-1.8 3,-0.2 -2,-0.2 0.806 114.1 47.8 -74.8 -33.1 -44.5 -3.4 -35.3 57 86 A L H S+ 0 0 83 2,-0.1 4,-3.0 3,-0.1 5,-0.2 0.278 83.6 87.3-119.4 3.3 -54.4 -8.9 -55.2 74 103 A R H > S+ 0 0 44 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.899 89.7 50.9 -70.0 -44.0 -51.2 -6.8 -54.8 75 104 A P H > S+ 0 0 97 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.888 116.4 43.3 -53.3 -39.6 -53.2 -3.6 -55.5 76 105 A Q H > S+ 0 0 128 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.911 113.1 48.2 -75.4 -46.5 -55.7 -4.8 -52.8 77 106 A K H X S+ 0 0 81 -4,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.779 112.1 53.2 -65.2 -27.0 -53.2 -5.9 -50.2 78 107 A A H X S+ 0 0 10 -4,-1.9 4,-3.2 2,-0.2 5,-0.3 0.959 110.0 44.6 -66.1 -54.3 -51.4 -2.6 -50.8 79 108 A Q H X S+ 0 0 154 -4,-1.9 4,-0.7 1,-0.2 -2,-0.2 0.676 115.3 51.8 -65.6 -18.2 -54.7 -0.6 -50.1 80 109 A A H X S+ 0 0 58 -4,-1.4 4,-0.5 2,-0.1 -1,-0.2 0.882 114.0 40.8 -78.5 -46.7 -55.1 -3.0 -47.1 81 110 A L H X S+ 0 0 27 -4,-2.3 4,-1.1 1,-0.2 5,-0.5 0.830 114.2 52.7 -71.6 -34.9 -51.6 -2.3 -45.7 82 111 A R H X>S+ 0 0 58 -4,-3.2 5,-0.9 1,-0.2 4,-0.7 0.838 109.2 49.8 -68.4 -33.9 -51.8 1.4 -46.5 83 112 A A H <5S+ 0 0 82 -4,-0.7 -1,-0.2 -5,-0.3 -2,-0.2 0.603 111.4 50.1 -80.1 -11.8 -55.1 1.8 -44.6 84 113 A A H <5S+ 0 0 33 -4,-0.5 8,-1.2 -3,-0.4 -2,-0.2 0.749 126.5 6.1 -99.0 -29.7 -53.9 -0.1 -41.5 85 114 A Y H <5S+ 0 0 25 -4,-1.1 5,-0.3 6,-0.1 9,-0.2 0.676 114.5 56.9-129.7 -32.0 -50.5 1.6 -40.6 86 115 A L T <5S+ 0 0 19 -4,-0.7 3,-0.2 -5,-0.5 4,-0.2 0.984 85.6 47.7 -72.2 -64.5 -49.6 4.7 -42.6 87 116 A E S - 0 0 12 -5,-0.3 3,-0.9 -4,-0.2 -6,-0.1 -0.404 21.6-121.5 -74.0 162.7 -54.2 4.7 -38.2 91 120 A Q T 3 S+ 0 0 199 1,-0.3 -6,-0.1 -7,-0.2 -1,-0.1 0.699 115.3 37.1 -86.9 -21.8 -55.4 2.3 -35.5 92 121 A L T 3 S+ 0 0 71 -8,-1.2 2,-0.7 -37,-0.1 -1,-0.3 -0.209 84.2 149.2-112.5 36.8 -52.1 0.3 -35.4 93 122 A F < - 0 0 82 -3,-0.9 -7,-0.1 -6,-0.1 -8,-0.1 -0.633 40.3-143.3 -71.8 110.9 -50.1 3.5 -36.0 94 123 A C - 0 0 32 -2,-0.7 2,-0.2 -9,-0.2 -4,-0.1 -0.372 7.7-149.9 -77.1 157.3 -46.9 2.7 -34.2 95 124 A S S S+ 0 0 108 -2,-0.1 3,-0.1 1,-0.1 -1,-0.1 -0.579 70.3 78.7-133.4 69.4 -45.0 5.4 -32.3 96 125 A F S S+ 0 0 62 1,-0.3 2,-0.2 -2,-0.2 -1,-0.1 0.455 82.6 61.1-135.3 -36.0 -41.2 4.8 -32.3 97 126 A L S S- 0 0 69 1,-0.2 -1,-0.3 2,-0.0 21,-0.0 -0.599 79.2-130.9 -85.9 158.5 -40.1 5.9 -35.7 98 127 A D - 0 0 117 -2,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.784 40.2 -85.0 -76.5-114.4 -40.5 9.6 -36.7 99 128 A A S S+ 0 0 73 2,-0.0 4,-0.2 3,-0.0 -2,-0.0 0.004 94.3 97.6-157.6 41.0 -42.1 10.4 -40.2 100 129 A E S > S+ 0 0 151 2,-0.1 4,-0.7 3,-0.1 3,-0.2 0.741 86.4 48.2 -98.7 -33.1 -39.4 10.3 -42.8 101 130 A T H > S+ 0 0 32 2,-0.2 4,-1.2 1,-0.2 -1,-0.1 0.596 98.4 70.6 -83.0 -13.2 -40.0 6.7 -44.1 102 131 A V H 4 S+ 0 0 32 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.852 102.2 45.6 -65.8 -36.2 -43.7 7.5 -44.4 103 132 A A H >4 S+ 0 0 57 -4,-0.2 3,-0.7 -3,-0.2 -2,-0.2 0.827 104.2 64.9 -71.2 -36.5 -42.8 9.7 -47.3 104 133 A R H >< S+ 0 0 146 -4,-0.7 3,-0.6 1,-0.2 -2,-0.2 0.886 102.8 43.3 -56.8 -46.6 -40.5 7.1 -48.8 105 134 A A T 3< S+ 0 0 3 -4,-1.2 3,-0.2 1,-0.2 -1,-0.2 0.586 83.6 96.7 -81.9 -11.0 -43.1 4.4 -49.7 106 135 A R T < S+ 0 0 133 -3,-0.7 -1,-0.2 -4,-0.4 -2,-0.1 0.570 75.6 62.7 -61.9 -11.0 -45.9 6.6 -51.1 107 136 A A < 0 0 94 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.1 0.985 360.0 360.0 -79.3 -63.2 -44.9 6.1 -54.8 108 137 A G 0 0 60 2,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.188 360.0 360.0 -55.5 360.0 -45.3 2.4 -55.6 109 ! 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 0.0 110 142 A L 0 0 113 0, 0.0 -2,-0.3 0, 0.0 -3,-0.2 0.000 360.0 360.0 360.0 104.5 -42.8 -1.2 -53.7 111 143 A F > + 0 0 12 1,-0.2 4,-0.9 2,-0.1 -6,-0.1 -0.234 360.0 115.4-112.0 41.5 -42.5 -1.2 -49.8 112 144 A Q H > S+ 0 0 30 2,-0.2 4,-1.5 1,-0.2 3,-0.4 0.916 78.1 47.5 -77.5 -45.0 -39.0 -2.7 -49.4 113 145 A P H > S+ 0 0 29 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.739 105.3 62.7 -66.8 -23.5 -37.4 0.4 -47.8 114 146 A L H > S+ 0 0 36 2,-0.2 4,-1.1 1,-0.2 3,-0.2 0.898 103.0 50.1 -61.5 -42.6 -40.4 0.5 -45.5 115 147 A L H >X S+ 0 0 28 -4,-0.9 4,-2.2 -3,-0.4 3,-0.7 0.936 107.8 49.5 -64.3 -51.1 -39.4 -2.9 -44.1 116 148 A R H 3X S+ 0 0 162 -4,-1.5 4,-2.0 1,-0.2 -1,-0.2 0.693 103.0 64.5 -65.8 -19.4 -35.7 -2.1 -43.4 117 149 A A H 3X S+ 0 0 17 -4,-0.9 4,-1.1 -3,-0.2 -1,-0.2 0.894 109.1 37.5 -68.3 -42.0 -36.8 1.1 -41.6 118 150 A V H X S+ 0 0 48 -4,-1.1 3,-3.0 1,-0.2 4,-0.7 0.918 111.4 60.0 -68.1 -48.2 -35.0 0.1 -35.0 122 154 A L H 3< S+ 0 0 19 -4,-3.7 -1,-0.2 1,-0.3 -2,-0.2 0.776 104.6 54.1 -53.6 -27.3 -36.7 -3.2 -34.0 123 155 A G T 3< S+ 0 0 12 -4,-2.0 -1,-0.3 -3,-0.4 -2,-0.2 0.355 113.5 40.8 -85.9 5.3 -33.2 -4.6 -33.6 124 156 A Q T <> S+ 0 0 126 -3,-3.0 4,-0.6 -5,-0.1 -2,-0.1 0.727 119.2 16.5-117.6 -80.1 -31.9 -1.8 -31.2 125 157 A A T >< S+ 0 0 60 -4,-0.7 3,-0.7 1,-0.2 4,-0.2 0.954 133.1 36.5 -71.1 -51.7 -34.1 -0.3 -28.4 126 158 A P T >> S+ 0 0 6 0, 0.0 3,-1.2 0, 0.0 4,-0.6 0.779 106.0 70.4 -70.0 -26.1 -36.8 -3.0 -28.1 127 159 A F H 3> S+ 0 0 17 -6,-0.4 4,-1.0 1,-0.2 -2,-0.2 0.726 80.0 76.5 -66.1 -22.7 -34.3 -5.8 -28.8 128 160 A Q H < S+ 0 0 2 -4,-0.6 3,-1.2 1,-0.3 6,-0.7 0.887 106.0 54.2 -36.5 -51.5 -35.7 -10.5 -25.4 131 163 A L H 3< S+ 0 0 51 -4,-1.0 2,-0.9 1,-0.3 -1,-0.3 0.920 112.7 41.3 -50.7 -54.5 -32.1 -11.1 -24.3 132 164 A D T 3< S+ 0 0 56 -4,-1.2 365,-0.9 -3,-0.4 -1,-0.3 -0.462 111.3 78.3 -93.4 57.1 -33.0 -10.4 -20.7 133 165 A S S <> S- 0 0 5 -3,-1.2 4,-1.0 -2,-0.9 3,-0.3 -0.967 87.8-101.6-155.8 170.8 -36.3 -12.4 -21.0 134 166 A L H >> S+ 0 0 2 -2,-0.3 3,-1.7 1,-0.2 4,-1.6 0.949 106.8 63.0 -61.8 -59.6 -37.5 -16.0 -21.0 135 167 A Y H 3> S+ 0 0 2 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.777 105.1 50.1 -41.4 -43.4 -38.2 -16.7 -24.7 136 168 A F H 3> S+ 0 0 47 -6,-0.7 4,-1.8 -3,-0.3 -1,-0.3 0.893 106.6 55.0 -59.8 -44.7 -34.5 -16.2 -25.5 137 169 A L H X S+ 0 0 33 -4,-4.3 4,-1.5 -5,-0.2 3,-0.7 0.897 105.1 59.5 -62.6 -43.8 -29.6 -24.3 -29.0 144 176 A W H 3< S+ 0 0 52 -4,-2.5 3,-0.4 1,-0.3 -1,-0.2 0.916 104.9 48.2 -51.9 -48.8 -28.0 -26.5 -26.4 145 177 A L H 3< S+ 0 0 35 -4,-1.6 -1,-0.3 1,-0.2 3,-0.2 0.694 103.7 62.1 -71.6 -19.6 -29.5 -29.7 -27.8 146 178 A E H << S+ 0 0 9 -4,-0.8 2,-2.5 -3,-0.7 -1,-0.2 0.888 91.1 68.3 -68.1 -40.3 -28.4 -28.7 -31.4 147 179 A A S < S+ 0 0 67 -4,-1.5 -1,-0.2 -3,-0.4 311,-0.1 -0.396 85.5 111.9 -77.5 63.7 -24.8 -28.8 -30.2 148 180 A Q S S- 0 0 78 -2,-2.5 2,-0.9 -3,-0.2 311,-0.1 -0.922 76.9 -98.9-138.3 159.9 -25.0 -32.6 -29.8 149 181 A P - 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0 0 162 5,-0.0 2,-0.2 0, 0.0 164,-0.1 -0.981 360.0-143.1-135.7 144.1 -62.9 -5.0 -15.8 485 32 B D - 0 0 60 162,-0.7 0, 0.0 163,-0.6 0, 0.0 -0.673 8.3-168.8 -98.4 156.7 -60.8 -1.9 -15.8 486 33 B R S > S+ 0 0 213 -2,-0.2 4,-1.2 3,-0.1 -1,-0.1 0.785 76.0 57.0-113.7 -48.9 -58.0 -1.3 -18.3 487 34 B K H > S+ 0 0 152 1,-0.2 4,-0.5 2,-0.2 161,-0.1 0.845 114.4 41.3 -60.8 -38.1 -55.8 1.7 -17.3 488 35 B Y H 4 S+ 0 0 40 1,-0.2 -1,-0.2 2,-0.2 160,-0.2 0.707 113.5 53.5 -80.6 -23.8 -55.0 0.2 -13.9 489 36 B L H >4 S+ 0 0 53 159,-0.2 3,-0.6 1,-0.2 -2,-0.2 0.609 101.1 64.1 -80.0 -14.7 -54.5 -3.2 -15.5 490 37 B A H 3< S+ 0 0 60 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.747 87.4 66.2 -79.6 -27.5 -52.0 -1.5 -17.9 491 38 B R T 3< S+ 0 0 143 -4,-0.5 2,-0.5 -3,-0.1 -1,-0.2 0.237 89.2 82.6 -75.3 15.7 -49.5 -0.6 -15.1 492 39 B L < + 0 0 39 -3,-0.6 2,-0.3 2,-0.0 -1,-0.1 -0.841 58.9 156.2-131.4 91.2 -48.9 -4.3 -14.7 493 40 B K - 0 0 99 -2,-0.5 -443,-0.1 -443,-0.0 131,-0.0 -0.755 47.9-102.1-118.6 161.3 -46.5 -5.9 -17.1 494 41 B L - 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