==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CONTRACTILE PROTEIN 25-NOV-08 2W4H . COMPND 2 MOLECULE: MYOSIN REGULATORY LIGHT CHAIN 2, SKELETAL MUSCLE . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR S.WU,J.LIU,M.C.REEDY,R.T.TREGEAR,H.WINKLER,C.FRANZINI-ARMSTR . 1099 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 54132.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 797 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 73 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 5 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 66 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 157 14.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 431 39.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.2 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 5 2 4 4 5 5 6 4 1 1 3 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 3 RESIDUES PER ALPHA HELIX . 3 0 1 0 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 PARALLEL BRIDGES PER LADDER . 2 4 4 5 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 4 1 0 0 0 0 1 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 14 B N > 0 0 146 0, 0.0 4,-0.8 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 -37.0 -146.5 -43.3 -37.2 2 15 B V T 4 + 0 0 23 1,-0.2 72,-0.1 2,-0.2 71,-0.0 0.478 360.0 42.5 -67.9 -13.7 -149.8 -41.7 -36.4 3 16 B F T 4 S+ 0 0 154 69,-0.1 -1,-0.2 1,-0.0 66,-0.0 0.565 103.4 72.4-103.1 -12.9 -151.1 -44.4 -34.1 4 17 B S T 4 S+ 0 0 105 -3,-0.5 -2,-0.2 3,-0.0 -1,-0.0 0.723 105.5 26.1 -74.1 -35.2 -147.7 -44.9 -32.3 5 18 B M S < S+ 0 0 62 -4,-0.8 74,-0.1 73,-0.1 -3,-0.1 0.520 96.0 106.1 -79.6-108.8 -147.3 -41.8 -30.0 6 19 B F - 0 0 15 72,-0.3 73,-0.1 1,-0.1 -1,-0.0 0.779 56.7-156.4 50.4 64.0 -151.0 -41.0 -29.6 7 20 B D > - 0 0 91 1,-0.1 4,-2.5 4,-0.0 5,-0.3 -0.119 30.7-101.7 -69.0 159.5 -152.4 -41.8 -26.2 8 21 B Q H > S+ 0 0 156 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.899 121.4 53.0 -48.8 -43.1 -156.0 -42.6 -25.1 9 22 B T H > S+ 0 0 90 2,-0.2 4,-2.7 1,-0.2 3,-0.4 0.964 109.1 47.8 -57.9 -57.8 -156.4 -39.1 -23.6 10 23 B Q H > S+ 0 0 27 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.925 113.1 49.8 -46.0 -50.1 -155.3 -37.3 -26.9 11 24 B I H X S+ 0 0 31 -4,-2.5 4,-2.7 2,-0.2 -1,-0.3 0.872 110.3 49.5 -61.6 -39.0 -157.7 -39.6 -28.8 12 25 B Q H X S+ 0 0 97 -4,-2.4 4,-2.9 -3,-0.4 5,-0.3 0.963 107.6 53.7 -66.6 -43.4 -160.6 -38.7 -26.4 13 26 B D H X S+ 0 0 58 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.942 112.6 46.0 -51.1 -49.4 -159.9 -34.9 -26.7 14 27 B F H X S+ 0 0 18 -4,-2.5 4,-2.9 -5,-0.2 -2,-0.2 0.956 110.4 52.4 -58.9 -50.7 -160.2 -35.6 -30.5 15 28 B K H X S+ 0 0 95 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.930 112.1 45.3 -52.8 -47.1 -163.4 -37.7 -30.1 16 29 B E H X S+ 0 0 64 -4,-2.9 4,-1.7 2,-0.2 5,-0.2 0.963 112.2 52.4 -62.0 -46.3 -165.1 -34.9 -28.1 17 30 B A H X S+ 0 0 2 -4,-2.7 4,-1.7 -5,-0.3 3,-0.2 0.922 109.7 49.2 -54.7 -43.7 -163.8 -32.3 -30.7 18 31 B F H >X S+ 0 0 5 -4,-2.9 4,-3.0 1,-0.2 3,-1.0 0.995 109.2 51.4 -60.1 -56.3 -165.4 -34.4 -33.5 19 32 B T H 3< S+ 0 0 86 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.707 108.7 52.6 -57.2 -23.9 -168.8 -34.7 -31.6 20 33 B V H 3< S+ 0 0 58 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.832 114.9 39.8 -76.4 -36.4 -168.8 -30.9 -31.2 21 34 B I H << S+ 0 0 6 -4,-1.7 2,-2.4 -3,-1.0 -2,-0.2 0.847 98.4 85.1 -77.6 -31.2 -168.2 -30.3 -34.9 22 35 B D >< + 0 0 12 -4,-3.0 3,-1.8 -5,-0.2 -1,-0.2 -0.299 58.7 173.1 -62.3 64.5 -170.7 -33.2 -35.7 23 36 B Q T 3 S+ 0 0 57 -2,-2.4 -1,-0.2 1,-0.3 6,-0.1 0.853 73.2 47.3 -45.1 -47.0 -173.9 -31.1 -35.5 24 37 B N T 3 S- 0 0 88 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.633 96.7-135.3 -75.5 -11.2 -176.3 -33.8 -36.7 25 38 B R < + 0 0 87 -3,-1.8 -2,-0.1 -6,-0.1 -1,-0.1 0.271 68.7 124.1 65.7 -8.4 -174.9 -36.6 -34.3 26 39 B D S S- 0 0 135 2,-0.2 3,-0.1 1,-0.1 -1,-0.1 0.782 82.6-108.5 -43.0 -42.1 -175.0 -39.0 -37.3 27 40 B G S S+ 0 0 14 1,-0.2 37,-0.8 -9,-0.1 2,-0.4 0.287 92.4 83.0 123.1 -11.9 -171.3 -40.0 -37.1 28 41 B I - 0 0 60 35,-0.2 2,-0.4 34,-0.1 -1,-0.2 -0.992 67.9-141.5-123.2 122.9 -170.0 -38.2 -40.2 29 42 B I + 0 0 0 -2,-0.4 33,-0.6 -3,-0.1 2,-0.2 -0.753 31.1 169.3 -79.5 135.7 -169.0 -34.5 -40.3 30 43 B D > - 0 0 80 -2,-0.4 4,-2.4 31,-0.1 5,-0.2 -0.596 51.3 -74.5-128.6-167.7 -170.0 -32.7 -43.5 31 44 B K H > S+ 0 0 66 2,-0.2 4,-2.7 -2,-0.2 -2,-0.0 0.907 129.3 50.5 -57.5 -41.3 -170.2 -29.1 -45.0 32 45 B D H > S+ 0 0 90 2,-0.2 4,-2.0 1,-0.2 5,-0.3 0.972 108.2 52.0 -62.6 -51.0 -173.3 -28.4 -43.0 33 46 B D H > S+ 0 0 4 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.915 112.6 46.1 -51.9 -47.3 -171.7 -29.5 -39.7 34 47 B L H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.966 108.5 57.4 -60.1 -52.4 -168.7 -27.2 -40.4 35 48 B R H X S+ 0 0 93 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.925 111.7 37.8 -47.2 -57.3 -170.9 -24.2 -41.4 36 49 B E H X S+ 0 0 120 -4,-2.0 4,-3.0 2,-0.2 -1,-0.2 0.807 111.4 58.9 -75.7 -21.2 -172.9 -24.0 -38.1 37 50 B T H X S+ 0 0 11 -4,-1.7 4,-1.9 -5,-0.3 6,-0.2 0.964 110.3 45.0 -65.1 -41.2 -169.9 -24.8 -35.9 38 51 B F H <>S+ 0 0 16 -4,-2.5 5,-2.3 2,-0.2 -2,-0.2 0.953 114.4 48.8 -58.8 -48.5 -168.2 -21.8 -37.4 39 52 B A H ><5S+ 0 0 42 -4,-2.4 3,-1.7 -5,-0.2 -2,-0.2 0.922 108.9 52.2 -56.5 -46.4 -171.5 -19.8 -36.9 40 53 B A H 3<5S+ 0 0 87 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.844 108.3 52.2 -59.3 -35.9 -171.8 -21.0 -33.2 41 54 B M T 3<5S- 0 0 83 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.387 129.7 -97.8 -78.5 2.4 -168.2 -19.7 -32.7 42 55 B G T < 5S+ 0 0 57 -3,-1.7 2,-1.1 1,-0.2 -3,-0.2 0.240 83.9 128.6 101.4 -11.7 -169.1 -16.3 -34.2 43 56 B R < + 0 0 92 -5,-2.3 3,-0.3 -6,-0.2 -1,-0.2 -0.583 14.9 154.0 -85.4 100.0 -167.9 -16.8 -37.8 44 57 B L + 0 0 139 -2,-1.1 -1,-0.2 1,-0.2 -5,-0.1 0.745 56.5 77.1 -94.1 -20.0 -170.6 -15.9 -40.2 45 58 B N + 0 0 148 2,-0.0 2,-0.3 -6,-0.0 -1,-0.2 0.196 61.6 145.3 -80.7 21.6 -168.5 -14.9 -43.3 46 59 B V - 0 0 44 -3,-0.3 2,-0.3 -11,-0.1 3,-0.0 -0.381 34.5-153.8 -72.6 122.7 -167.7 -18.4 -44.4 47 60 B K >> - 0 0 135 -2,-0.3 3,-1.6 1,-0.1 4,-1.4 -0.718 24.2-118.4 -95.5 140.5 -167.4 -19.0 -48.2 48 61 B N H 3> S+ 0 0 94 -2,-0.3 4,-3.2 1,-0.2 5,-0.3 0.875 110.4 63.0 -43.6 -44.4 -168.0 -22.5 -49.8 49 62 B E H 3> S+ 0 0 160 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.819 104.2 48.3 -51.2 -34.4 -164.4 -22.7 -51.2 50 63 B E H <> S+ 0 0 96 -3,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.951 114.0 45.3 -72.5 -46.7 -163.0 -22.7 -47.6 51 64 B L H X S+ 0 0 2 -4,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.939 115.8 47.4 -59.5 -47.8 -165.5 -25.4 -46.4 52 65 B D H X S+ 0 0 39 -4,-3.2 4,-3.0 -5,-0.2 -1,-0.2 0.913 107.2 56.2 -59.7 -47.1 -164.7 -27.4 -49.5 53 66 B A H X S+ 0 0 48 -4,-2.3 4,-0.6 -5,-0.3 -2,-0.2 0.937 107.6 50.5 -52.6 -46.2 -160.9 -27.0 -49.0 54 67 B M H >< S+ 0 0 14 -4,-2.2 3,-1.2 1,-0.2 4,-0.2 0.964 114.2 42.2 -52.0 -59.8 -161.3 -28.5 -45.5 55 68 B I H >< S+ 0 0 42 -4,-2.2 3,-2.4 1,-0.2 -2,-0.2 0.917 101.4 70.2 -60.3 -42.4 -163.2 -31.5 -46.8 56 69 B K H 3< S+ 0 0 150 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.669 81.3 75.9 -49.6 -23.0 -161.0 -32.1 -49.9 57 70 B E T << S+ 0 0 64 -3,-1.2 2,-0.3 -4,-0.6 -1,-0.3 0.750 91.7 63.5 -63.0 -23.5 -158.1 -33.2 -47.6 58 71 B A S < S- 0 0 18 -3,-2.4 4,-0.1 -4,-0.2 9,-0.0 -0.797 71.9-145.2-105.1 147.2 -159.9 -36.6 -47.1 59 72 B S S S+ 0 0 138 -2,-0.3 -1,-0.1 2,-0.1 3,-0.1 0.715 80.8 14.9 -79.5 -20.9 -160.7 -39.3 -49.8 60 73 B G S S- 0 0 36 1,-0.2 2,-0.1 3,-0.1 -2,-0.1 -0.559 110.9 -35.5-130.2-163.3 -164.0 -40.4 -48.2 61 74 B P - 0 0 70 0, 0.0 5,-0.2 0, 0.0 -1,-0.2 -0.440 65.0-116.6 -55.3 137.8 -166.7 -39.5 -45.7 62 75 B I > + 0 0 7 -33,-0.6 5,-0.9 -2,-0.1 -34,-0.1 0.502 54.1 164.1 -72.4 2.7 -164.9 -37.8 -42.8 63 76 B N T >>5 - 0 0 53 3,-0.2 4,-1.7 2,-0.1 3,-1.4 0.417 57.0 -85.0 -6.7 134.3 -165.9 -40.4 -40.1 64 77 B F H 3>5S+ 0 0 84 -37,-0.8 4,-2.8 1,-0.3 5,-0.2 0.646 130.4 44.3 -18.9 -53.1 -164.1 -40.7 -36.7 65 78 B T H 3>5S+ 0 0 94 2,-0.2 4,-3.0 1,-0.2 -1,-0.3 0.936 111.8 50.7 -65.1 -48.7 -161.2 -42.8 -38.1 66 79 B V H <>5S+ 0 0 33 -3,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.922 114.7 47.0 -59.1 -43.7 -160.7 -40.8 -41.3 67 80 B F H X< S+ 0 0 2 -4,-2.4 3,-1.5 -5,-0.4 -2,-0.2 0.980 103.8 60.9 -61.8 -53.8 -152.5 -37.7 -36.8 73 86 B E H 3< S+ 0 0 94 -4,-3.0 3,-0.4 1,-0.3 -1,-0.2 0.730 105.4 46.9 -46.2 -29.0 -150.8 -37.5 -40.3 74 87 B K H 3< S+ 0 0 53 -4,-0.6 -1,-0.3 -3,-0.3 3,-0.2 0.756 113.4 48.3 -84.7 -25.0 -150.0 -33.8 -39.9 75 88 B L X< + 0 0 18 -3,-1.5 3,-1.8 -4,-1.0 -2,-0.2 0.071 67.9 139.0-102.4 27.3 -148.7 -34.2 -36.3 76 89 B K T 3 S+ 0 0 92 -3,-0.4 -1,-0.1 1,-0.3 -3,-0.1 0.590 81.0 35.9 -47.3 -17.7 -146.3 -37.2 -37.2 77 90 B G T 3 S+ 0 0 18 -3,-0.2 1010,-0.5 1006,-0.1 2,-0.4 -0.321 94.7 113.8-131.6 46.4 -143.7 -35.7 -34.9 78 91 B A < - 0 0 15 -3,-1.8 -72,-0.3 1009,-0.1 -3,-0.1 -0.960 40.6-169.6-128.9 121.1 -145.8 -34.2 -32.1 79 92 B D - 0 0 35 -2,-0.4 2,-0.2 1001,-0.2 -2,-0.1 -0.432 34.3 -90.6 -90.9 167.4 -146.0 -35.2 -28.5 80 93 B P >> - 0 0 40 0, 0.0 4,-1.6 0, 0.0 3,-1.0 -0.565 49.1-101.6 -70.3 147.8 -148.3 -34.3 -25.6 81 94 B E H 3> S+ 0 0 40 1,-0.2 4,-2.8 -2,-0.2 5,-0.2 0.794 117.0 53.4 -42.1 -49.6 -147.2 -31.3 -23.5 82 95 B D H 3> S+ 0 0 122 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.898 109.0 50.8 -53.6 -40.3 -145.7 -33.1 -20.4 83 96 B V H <> S+ 0 0 76 -3,-1.0 4,-1.4 2,-0.2 3,-0.2 0.947 111.1 48.1 -64.6 -44.5 -143.4 -35.2 -22.7 84 97 B I H X S+ 0 0 2 -4,-1.6 4,-1.5 1,-0.2 3,-0.3 0.948 108.7 54.4 -61.8 -46.7 -142.2 -32.0 -24.4 85 98 B M H X S+ 0 0 21 -4,-2.8 4,-3.1 1,-0.2 -1,-0.2 0.834 100.5 61.7 -54.8 -38.0 -141.6 -30.4 -21.0 86 99 B G H X S+ 0 0 27 -4,-1.7 4,-1.8 -3,-0.2 5,-0.2 0.939 100.3 53.0 -55.5 -45.6 -139.4 -33.4 -20.0 87 100 B A H X S+ 0 0 2 -4,-1.4 4,-1.6 -3,-0.3 3,-0.2 0.937 112.7 44.2 -56.2 -45.5 -137.0 -32.6 -22.9 88 101 B F H >X S+ 0 0 3 -4,-1.5 4,-2.2 1,-0.2 3,-0.6 0.978 109.2 56.2 -64.8 -48.9 -136.7 -29.0 -21.6 89 102 B K H 3< S+ 0 0 112 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.753 106.7 51.7 -53.1 -29.8 -136.3 -30.3 -17.9 90 103 B V H 3< S+ 0 0 63 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 0.855 112.1 45.0 -71.3 -41.4 -133.3 -32.4 -19.1 91 104 B L H << S+ 0 0 24 -4,-1.6 -2,-0.2 -3,-0.6 3,-0.2 0.757 114.6 49.2 -70.8 -26.9 -131.8 -29.3 -20.7 92 105 B D S >< S+ 0 0 25 -4,-2.2 3,-2.6 1,-0.2 2,-0.6 0.385 76.9 156.9 -73.3 -0.2 -132.7 -27.3 -17.5 93 106 B P T 3 + 0 0 97 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.267 66.0 56.0 -42.6 -29.0 -131.1 -30.1 -15.4 94 107 B D T 3 S- 0 0 162 -2,-0.6 2,-0.1 1,-0.2 -2,-0.1 0.728 113.2-125.0 -57.4 -30.8 -130.4 -27.9 -12.4 95 108 B G < + 0 0 39 -3,-2.6 2,-2.3 -6,-0.2 -1,-0.2 -0.328 62.2 32.2 112.7 175.5 -134.2 -27.0 -12.3 96 109 B K S S+ 0 0 195 -3,-0.1 2,-0.6 -2,-0.1 -1,-0.1 -0.084 91.8 71.1 30.9 -49.3 -137.0 -24.4 -12.3 97 110 B G S S- 0 0 56 -2,-2.3 -2,-0.1 -5,-0.2 -3,-0.1 -0.871 82.6-124.2 -97.6 120.9 -135.7 -21.3 -14.4 98 111 B S - 0 0 14 -2,-0.6 38,-0.1 1,-0.1 -1,-0.0 -0.036 30.5 -78.1 -79.1 165.5 -135.6 -22.1 -18.1 99 112 B I - 0 0 23 36,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.273 36.0-108.0 -60.3 167.3 -132.7 -21.8 -20.6 100 113 B K > - 0 0 132 35,-0.0 4,-1.5 1,-0.0 2,-0.6 -0.707 27.5-108.7 -99.1 143.8 -130.8 -19.1 -22.6 101 114 B K T 4 S+ 0 0 75 -2,-0.3 2,-0.1 30,-0.3 -1,-0.0 -0.600 110.6 38.7 -72.8 107.3 -130.7 -18.2 -26.3 102 115 B S T > S+ 0 0 40 -2,-0.6 4,-2.7 0, 0.0 5,-0.3 -0.753 106.8 65.6 150.9 -55.4 -127.3 -19.3 -27.5 103 116 B F H > S+ 0 0 107 1,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.891 114.0 30.9 -52.6 -52.0 -127.2 -22.5 -25.4 104 117 B L H X S+ 0 0 12 -4,-1.5 4,-2.2 2,-0.2 5,-0.3 0.853 112.2 64.1 -80.0 -26.7 -130.1 -24.0 -27.5 105 118 B E H > S+ 0 0 69 -5,-0.3 4,-1.7 2,-0.2 3,-0.4 0.985 111.1 40.2 -54.7 -52.8 -129.2 -22.2 -30.8 106 119 B E H X S+ 0 0 107 -4,-2.7 4,-3.1 1,-0.2 3,-0.5 0.955 113.5 53.0 -59.7 -56.4 -126.0 -24.2 -30.8 107 120 B L H < S+ 0 0 23 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.745 109.7 48.4 -59.3 -24.1 -127.6 -27.5 -29.5 108 121 B L H < S+ 0 0 20 -4,-2.2 7,-0.3 -3,-0.4 -1,-0.2 0.795 120.9 37.2 -79.3 -34.5 -130.3 -27.5 -32.3 109 122 B T H < S+ 0 0 46 -4,-1.7 -2,-0.2 -3,-0.5 -3,-0.2 0.797 112.7 59.8 -81.0 -31.9 -127.6 -26.8 -35.0 110 123 B T S < S+ 0 0 12 -4,-3.1 57,-0.3 -5,-0.2 -3,-0.1 0.969 90.5 43.7 -73.4 -96.7 -124.7 -28.9 -33.6 111 124 B Q S S+ 0 0 16 55,-0.2 2,-0.2 54,-0.1 52,-0.1 -0.341 113.4 20.6 -52.4 141.0 -125.0 -32.7 -33.1 112 125 B C S S- 0 0 36 50,-0.7 55,-0.7 1,-0.1 57,-0.1 -0.527 110.6 -68.7 84.5-164.4 -126.8 -34.3 -36.2 113 126 B D S S- 0 0 106 1,-0.2 2,-0.2 -2,-0.2 -1,-0.1 0.875 94.3 -27.8 -87.9 -43.9 -126.9 -32.6 -39.6 114 127 B R - 0 0 125 54,-0.1 2,-0.7 -3,-0.1 -1,-0.2 -0.791 16.8-174.2 179.6 123.3 -129.2 -29.6 -39.0 115 128 B F - 0 0 13 -7,-0.3 5,-0.1 -2,-0.2 -7,-0.1 -0.967 67.7-123.7-105.9 103.8 -132.0 -27.7 -37.4 116 129 B T > - 0 0 24 -2,-0.7 4,-2.8 1,-0.1 5,-0.2 -0.081 3.9-120.2 -56.3 145.3 -131.3 -25.1 -40.0 117 130 B P T 4 S+ 0 0 64 0, 0.0 4,-0.4 0, 0.0 -1,-0.1 0.485 117.1 54.7 -60.0 0.3 -130.5 -21.4 -39.4 118 131 B E T > S+ 0 0 136 2,-0.1 4,-2.1 3,-0.1 3,-0.3 0.825 110.0 45.7 -89.3 -55.2 -133.7 -20.5 -41.4 119 132 B E H > S+ 0 0 55 1,-0.2 4,-2.4 2,-0.2 -3,-0.1 0.918 111.9 52.8 -48.6 -50.0 -135.8 -22.8 -39.1 120 133 B I H X S+ 0 0 12 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.891 107.4 48.9 -61.0 -41.7 -134.1 -21.3 -35.9 121 134 B K H > S+ 0 0 149 -4,-0.4 4,-1.6 -3,-0.3 -1,-0.2 0.948 111.5 50.7 -64.6 -40.3 -134.8 -17.6 -36.8 122 135 B N H X S+ 0 0 92 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.919 108.1 55.2 -58.1 -43.3 -138.4 -18.5 -37.5 123 136 B M H X S+ 0 0 23 -4,-2.4 4,-2.3 -5,-0.2 3,-0.3 0.979 106.0 48.7 -53.2 -58.1 -138.3 -20.2 -34.0 124 137 B W H < S+ 0 0 50 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.742 117.5 43.4 -56.1 -29.7 -137.1 -16.9 -32.2 125 138 B A H < S+ 0 0 80 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.815 121.8 36.1 -79.8 -38.6 -139.9 -15.0 -34.0 126 139 B A H < S+ 0 0 23 -4,-2.7 -2,-0.2 1,-0.3 -3,-0.2 0.504 124.3 44.6 -92.0 -15.4 -142.8 -17.6 -33.5 127 140 B F S < S+ 0 0 0 -4,-2.3 -1,-0.3 -5,-0.3 13,-0.0 -0.819 100.6 159.5-127.1 67.8 -141.5 -18.5 -30.1 128 141 B P + 0 0 36 0, 0.0 4,-0.4 0, 0.0 -2,-0.1 0.967 46.5 4.7 44.8 164.9 -140.9 -15.0 -29.0 129 142 B P S >> S+ 0 0 113 0, 0.0 4,-2.8 0, 0.0 3,-1.3 0.876 125.7 64.7 -9.2 -68.2 -140.4 -12.8 -26.3 130 143 B D H 3>>S+ 0 0 19 1,-0.3 6,-1.6 2,-0.2 5,-1.5 0.969 102.1 46.8 -43.7 -58.6 -140.6 -16.2 -24.5 131 144 B V H 345S+ 0 0 2 4,-0.4 -1,-0.3 1,-0.2 -30,-0.3 0.605 116.1 47.2 -60.8 -20.0 -137.3 -17.3 -26.2 132 145 B A H <45S+ 0 0 59 -3,-1.3 -1,-0.2 -4,-0.4 -31,-0.2 0.857 117.2 38.0 -85.1 -44.3 -135.8 -13.9 -25.3 133 146 B G H <5S- 0 0 68 -4,-2.8 -3,-0.2 1,-0.1 -2,-0.2 0.990 146.3 -18.6 -72.0 -70.1 -136.8 -13.7 -21.7 134 147 B N T ><5S- 0 0 52 -4,-1.1 3,-0.5 -5,-0.2 -3,-0.2 0.196 86.9-109.6-120.6 15.4 -136.5 -17.1 -20.0 135 148 B V T 3 < - 0 0 4 -5,-1.5 2,-1.7 -6,-0.3 -4,-0.4 0.980 48.9-134.1 31.3 55.7 -136.6 -18.9 -23.4 136 149 B D T 3> + 0 0 32 -6,-1.6 4,-2.9 1,-0.2 -1,-0.2 -0.027 40.4 173.9 -40.5 74.0 -139.9 -19.6 -21.7 137 150 B Y H <> S+ 0 0 5 -2,-1.7 4,-2.8 -3,-0.5 5,-0.2 0.843 77.9 56.9 -60.3 -32.7 -140.1 -23.4 -22.3 138 151 B K H > S+ 0 0 99 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.986 112.7 41.6 -56.8 -54.2 -143.2 -23.7 -20.1 139 152 B N H > S+ 0 0 75 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.961 111.0 56.9 -59.1 -50.2 -144.8 -21.1 -22.4 140 153 B I H X S+ 0 0 5 -4,-2.9 4,-2.0 1,-0.2 5,-0.2 0.902 109.1 46.9 -45.0 -53.8 -143.3 -22.8 -25.6 141 154 B C H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 5,-0.4 0.942 111.1 50.3 -58.4 -48.2 -145.0 -26.1 -24.6 142 155 B Y H X S+ 0 0 111 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.878 110.7 49.9 -62.0 -35.6 -148.4 -24.5 -23.9 143 156 B V H X S+ 0 0 19 -4,-2.6 4,-0.9 2,-0.2 -1,-0.2 0.849 111.9 47.3 -70.6 -36.6 -148.4 -22.7 -27.3 144 157 B I H < S+ 0 0 16 -4,-2.0 3,-0.2 -5,-0.3 -2,-0.2 0.947 123.3 32.6 -72.3 -41.1 -147.6 -25.8 -29.3 145 158 B T H < S+ 0 0 16 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.893 131.4 33.2 -79.5 -36.3 -150.2 -28.0 -27.6 146 159 B H H < S- 0 0 90 -4,-2.4 4,-0.2 -5,-0.4 -2,-0.2 0.186 114.2 -87.7-110.0 22.2 -152.8 -25.2 -26.9 147 160 B G < - 0 0 7 -4,-0.9 -1,-0.3 -3,-0.2 -2,-0.1 -0.039 39.2 -83.6 96.2 161.4 -152.6 -22.7 -29.9 148 161 B E S S+ 0 0 75 1,-0.2 -1,-0.1 944,-0.1 -5,-0.1 0.801 115.5 49.0 -78.1 -35.0 -150.6 -19.5 -30.7 149 162 B D 0 0 172 -3,-0.1 -1,-0.2 -6,-0.1 -2,-0.1 0.835 360.0 360.0 -71.9 -41.5 -152.5 -16.7 -29.0 150 163 B K 0 0 87 -4,-0.2 -4,-0.1 -7,-0.1 -3,-0.0 -0.247 360.0 360.0 -59.3 360.0 -152.7 -18.4 -25.6 151 !* 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 0.0 152 5 C D 0 0 88 0, 0.0 2,-0.2 0, 0.0 64,-0.0 0.000 360.0 360.0 360.0 170.7 -106.8 -49.4 -37.0 153 6 C E + 0 0 156 63,-0.1 2,-0.2 64,-0.0 0, 0.0 -0.839 360.0 76.5-175.3 149.0 -109.9 -51.2 -35.2 154 7 C I - 0 0 97 -2,-0.2 4,-0.1 1,-0.0 0, 0.0 -0.677 50.1-127.5 153.7 166.8 -113.1 -51.4 -33.0 155 8 C N S >> S+ 0 0 109 -2,-0.2 3,-2.6 2,-0.1 4,-0.7 0.863 88.2 64.7-102.6 -63.2 -116.8 -50.1 -33.9 156 9 C D H 3> S+ 0 0 111 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.689 93.0 66.2 -24.6 -45.4 -118.4 -47.8 -31.2 157 10 C F H 3> S+ 0 0 67 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.902 98.4 53.4 -56.6 -33.9 -115.7 -45.0 -31.6 158 11 C K H <> S+ 0 0 72 -3,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.926 108.1 49.9 -67.1 -40.5 -117.1 -44.4 -35.2 159 12 C E H X S+ 0 0 138 -4,-0.7 4,-0.8 1,-0.2 -2,-0.2 0.949 109.9 51.8 -61.8 -45.5 -120.6 -44.0 -33.7 160 13 C A H < S+ 0 0 4 -4,-2.7 4,-0.5 1,-0.2 3,-0.4 0.834 98.8 64.9 -60.9 -34.8 -119.2 -41.5 -31.2 161 14 C F H >< S+ 0 0 0 -4,-1.9 3,-2.4 1,-0.2 4,-0.3 0.979 99.7 51.6 -54.5 -50.5 -117.4 -39.4 -34.0 162 15 C L H >< S+ 0 0 80 -4,-1.3 3,-0.9 1,-0.3 -50,-0.7 0.775 99.1 66.0 -56.8 -27.8 -120.8 -38.4 -35.5 163 16 C L T 3< S+ 0 0 17 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.707 108.2 39.4 -69.0 -15.8 -122.0 -37.3 -32.0 164 17 C F T < S+ 0 0 28 -3,-2.4 -1,-0.2 -4,-0.5 -2,-0.2 0.228 85.2 102.3-120.1 17.2 -119.4 -34.5 -32.2 165 18 C D < - 0 0 10 -3,-0.9 4,-0.2 -4,-0.3 -54,-0.1 0.888 52.8-173.5 -61.2 -50.9 -119.7 -33.5 -35.9 166 19 C R S S+ 0 0 84 -4,-0.4 -55,-0.2 1,-0.2 -53,-0.1 0.739 75.9 47.6 52.3 42.7 -121.7 -30.4 -35.2 167 20 C T S S- 0 0 71 -55,-0.7 -1,-0.2 -57,-0.3 -56,-0.1 0.134 107.6-115.5-170.8 -38.1 -122.4 -29.6 -38.9 168 21 C G S S+ 0 0 30 -6,-0.1 -55,-0.2 -58,-0.1 -54,-0.1 0.311 85.1 110.8 100.6 -1.5 -123.6 -33.1 -40.1 169 22 C D S S- 0 0 106 -4,-0.2 -56,-0.1 2,-0.1 3,-0.1 0.489 78.9-127.5 -78.9 -10.3 -120.7 -33.6 -42.5 170 23 C A S S+ 0 0 26 1,-0.1 2,-0.5 -8,-0.1 42,-0.2 0.691 78.0 113.0 61.0 19.8 -118.8 -36.5 -40.6 171 24 C K - 0 0 129 40,-0.1 40,-0.2 -6,-0.1 -2,-0.1 -0.807 51.4-165.5-122.0 95.0 -115.7 -34.4 -40.8 172 25 C I - 0 0 0 38,-1.3 38,-0.3 -2,-0.5 2,-0.2 -0.361 23.5-101.7 -83.9 154.0 -114.4 -33.1 -37.5 173 26 C T > - 0 0 38 36,-0.2 4,-1.6 -8,-0.1 36,-0.1 -0.457 19.5-117.8 -80.1 150.7 -111.8 -30.3 -37.0 174 27 C L H > S+ 0 0 15 1,-0.2 4,-0.5 2,-0.2 -1,-0.1 0.758 117.1 51.2 -52.2 -24.7 -108.0 -30.6 -36.2 175 28 C S H >> S+ 0 0 91 2,-0.2 3,-1.3 1,-0.2 4,-0.6 0.962 106.4 51.2 -79.1 -48.4 -108.7 -28.6 -33.0 176 29 C Q H 3> S+ 0 0 60 1,-0.3 4,-2.8 2,-0.2 3,-0.4 0.721 94.8 79.9 -59.2 -22.8 -111.6 -30.8 -31.8 177 30 C V H 3X S+ 0 0 3 -4,-1.6 4,-1.8 1,-0.2 -1,-0.3 0.924 87.9 51.8 -41.0 -53.7 -109.1 -33.7 -32.4 178 31 C G H << S+ 0 0 7 -3,-1.3 4,-0.3 -4,-0.5 -1,-0.2 0.752 113.6 44.4 -64.0 -29.4 -107.4 -33.0 -29.0 179 32 C D H >X S+ 0 0 52 -4,-0.6 3,-1.4 -3,-0.4 4,-0.8 0.921 107.6 53.9 -84.5 -46.0 -110.7 -33.1 -27.1 180 33 C I H >X S+ 0 0 16 -4,-2.8 4,-1.4 1,-0.3 3,-0.8 0.909 103.9 59.4 -56.6 -39.5 -112.4 -36.3 -28.8 181 34 C V H 3< S+ 0 0 11 -4,-1.8 5,-0.3 -5,-0.3 -1,-0.3 0.803 96.8 63.6 -55.8 -29.6 -109.2 -38.3 -27.9 182 35 C R H <4 S+ 0 0 21 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.2 0.793 106.5 38.5 -70.0 -36.3 -109.7 -37.5 -24.2 183 36 C A H << S+ 0 0 25 -4,-0.8 2,-2.5 -3,-0.8 -1,-0.2 0.701 91.5 91.0 -87.7 -22.7 -113.0 -39.3 -23.7 184 37 C L S < S- 0 0 20 -4,-1.4 2,-1.8 2,-0.1 -1,-0.1 -0.437 118.5 -69.7 -75.7 75.0 -112.2 -42.3 -26.0 185 38 C G S S+ 0 0 51 -2,-2.5 2,-0.4 880,-0.0 -1,-0.1 -0.422 107.4 40.0 80.0 -67.1 -110.8 -44.3 -23.1 186 39 C Q S S- 0 0 88 -2,-1.8 -2,-0.1 -5,-0.3 40,-0.1 -0.909 75.2 -95.4-136.3 149.1 -107.5 -42.6 -22.0 187 40 C N - 0 0 30 -2,-0.4 2,-0.3 39,-0.1 871,-0.1 0.054 26.2-175.6 -50.5 141.3 -105.7 -39.3 -21.3 188 41 C P - 0 0 14 0, 0.0 2,-0.1 0, 0.0 873,-0.1 -0.991 21.8-128.3-131.6 140.1 -103.4 -37.3 -23.6 189 42 C T > - 0 0 19 -2,-0.3 4,-2.2 1,-0.1 2,-1.1 -0.465 22.3-114.4 -81.4 154.6 -101.4 -34.1 -22.7 190 43 C N T 4 S+ 0 0 36 1,-0.2 -1,-0.1 2,-0.2 867,-0.0 -0.741 112.3 45.7 -91.4 110.4 -101.5 -30.8 -24.7 191 44 C A T > S+ 0 0 45 -2,-1.1 4,-1.9 0, 0.0 -1,-0.2 -0.476 111.0 56.3 144.5 -52.9 -97.9 -30.6 -25.8 192 45 C E H > S+ 0 0 57 2,-0.2 4,-1.4 -3,-0.2 -2,-0.2 0.964 111.3 41.3 -64.6 -47.5 -98.1 -34.3 -26.8 193 46 C I H <>S+ 0 0 25 -4,-2.2 5,-0.9 1,-0.2 6,-0.3 0.964 115.6 52.5 -60.3 -48.4 -101.1 -33.8 -29.1 194 47 C N H 4>S+ 0 0 83 -5,-0.3 5,-1.0 4,-0.2 -1,-0.2 0.817 105.6 59.8 -56.1 -31.9 -99.4 -30.5 -30.3 195 48 C K H <5S+ 0 0 118 -4,-1.9 2,-0.6 3,-0.2 4,-0.4 0.999 101.9 41.5 -63.4 -70.5 -96.2 -32.5 -31.1 196 49 C I T <5S- 0 0 122 -4,-1.4 2,-1.4 1,-0.1 -1,-0.2 -0.761 134.2 -23.4-108.4 127.9 -97.1 -35.1 -33.7 197 50 C L T 5S+ 0 0 60 -2,-0.6 7,-0.6 1,-0.1 -1,-0.1 -0.381 128.0 76.8 71.4 -37.8 -99.4 -34.5 -36.5 198 51 C G T - 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