==== 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 HYDROLASE 30-MAR-09 3GUK . COMPND 2 MOLECULE: LYSOZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR L.LIU,B.W.MATTHEWS . 324 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15938.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 234 72.2 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 . 22 6.8 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 . 4 1.2 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 . 16 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 166 51.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 0 4 0 2 2 4 0 0 2 2 2 0 0 0 0 0 0 2 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 4 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 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 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 M 0 0 71 0, 0.0 2,-0.3 0, 0.0 234,-0.1 0.000 360.0 360.0 360.0 138.6 1.9 14.8 -12.9 2 2 A N > - 0 0 16 95,-0.0 4,-2.6 233,-0.0 5,-0.2 -0.911 360.0 -78.5-155.4 177.8 4.3 14.3 -9.9 3 3 A I H > S+ 0 0 12 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.794 125.2 51.1 -60.8 -35.0 4.2 12.8 -6.4 4 4 A F H > S+ 0 0 16 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.948 112.4 43.7 -68.7 -49.2 2.3 15.7 -4.9 5 5 A E H > S+ 0 0 72 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.907 114.1 54.3 -60.3 -38.2 -0.5 15.7 -7.5 6 6 A M H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.921 112.1 41.1 -60.9 -50.3 -0.6 11.9 -7.2 7 7 A L H X>S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.5 0.825 109.8 59.2 -69.2 -33.2 -1.0 11.9 -3.5 8 8 A R H X5S+ 0 0 82 -4,-2.5 4,-1.1 2,-0.2 -2,-0.2 0.885 109.7 44.5 -62.4 -37.1 -3.5 14.8 -3.6 9 9 A I H <5S+ 0 0 85 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.938 118.7 43.2 -65.8 -47.0 -5.7 12.6 -5.9 10 10 A D H <5S+ 0 0 7 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.832 130.0 22.3 -72.8 -38.6 -5.3 9.5 -3.7 11 11 A E H <5S- 0 0 18 -4,-3.0 19,-0.4 1,-0.1 -3,-0.2 0.606 89.7-169.5-104.0 -17.2 -5.7 11.1 -0.2 12 12 A G << - 0 0 27 -4,-1.1 2,-0.4 -5,-0.5 -1,-0.1 -0.128 37.3 -61.3 56.7-159.7 -7.6 14.2 -1.2 13 13 A L + 0 0 71 16,-0.1 2,-0.3 -4,-0.1 16,-0.2 -0.951 48.4 174.7-115.8 144.7 -8.1 17.0 1.4 14 14 A R E -A 28 0A 147 14,-0.7 14,-2.7 -2,-0.4 4,-0.1 -0.904 13.1-168.9-146.6 122.1 -9.9 16.6 4.8 15 15 A L E S+ 0 0 65 -2,-0.3 2,-0.3 12,-0.2 43,-0.1 -0.198 71.7 56.9-105.4 39.1 -10.0 19.5 7.3 16 16 A K E S- 0 0 151 41,-0.2 2,-0.3 12,-0.1 41,-0.2 -0.910 100.3 -83.8-164.3 146.9 -11.4 17.5 10.2 17 17 A I E + 0 0 29 39,-1.2 2,-0.3 -2,-0.3 10,-0.2 -0.260 53.0 174.4 -68.3 113.6 -10.2 14.3 11.9 18 18 A Y E -A 26 0A 40 8,-2.2 8,-3.3 -2,-0.3 2,-0.7 -0.801 34.2-116.0-114.2 157.0 -11.3 11.1 10.1 19 19 A K E -A 25 0A 137 -2,-0.3 6,-0.2 6,-0.2 8,-0.0 -0.852 38.0-140.1 -92.5 120.2 -10.5 7.4 10.5 20 20 A D > - 0 0 25 4,-2.8 3,-2.0 -2,-0.7 -1,-0.1 0.169 32.9 -83.3 -71.5 179.8 -8.7 6.1 7.5 21 21 A a T 3 S+ 0 0 34 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.774 131.9 52.6 -61.4 -26.0 -9.1 2.8 5.7 22 22 A E T 3 S- 0 0 36 2,-0.1 -1,-0.3 120,-0.1 -2,-0.1 0.591 122.4-109.1 -82.8 -11.5 -6.8 1.1 8.3 23 23 A G S < S+ 0 0 39 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.548 75.4 130.2 95.9 11.9 -9.0 2.5 11.0 24 24 A Y - 0 0 66 1,-0.1 -4,-2.8 -6,-0.0 -1,-0.3 -0.686 65.6 -93.5-101.9 155.8 -6.6 5.1 12.4 25 25 A Y E +AB 19 34A 29 9,-0.9 8,-3.0 11,-0.4 9,-1.0 -0.483 53.9 164.8 -74.1 124.4 -7.0 8.8 13.1 26 26 A T E +AB 18 32A 4 -8,-3.3 -8,-2.2 -2,-0.3 2,-0.3 -0.844 15.8 177.5-141.7 158.2 -6.0 11.1 10.2 27 27 A I E > + B 0 31A 0 4,-1.6 4,-2.4 -2,-0.3 -12,-0.2 -0.962 52.2 14.8-155.4 168.2 -6.3 14.7 8.8 28 28 A G E 4 S-A 14 0A 0 -14,-2.7 2,-0.9 -2,-0.3 -14,-0.7 -0.422 124.4 -11.0 69.6-133.4 -5.2 17.0 5.9 29 29 A I T 4 S- 0 0 3 34,-0.4 -1,-0.2 -16,-0.2 -17,-0.1 -0.730 129.1 -50.7-101.7 76.7 -3.7 15.1 2.9 30 30 A G T 4 S+ 0 0 12 -2,-0.9 2,-0.9 -19,-0.4 -2,-0.2 0.785 83.9 165.6 62.0 32.3 -3.4 11.6 4.5 31 31 A H E < -B 27 0A 29 -4,-2.4 -4,-1.6 1,-0.0 2,-0.3 -0.707 29.4-143.3 -82.9 107.8 -1.6 12.8 7.7 32 32 A L E -B 26 0A 74 -2,-0.9 -6,-0.2 -6,-0.2 3,-0.1 -0.555 17.9-176.2 -68.4 126.6 -1.7 10.0 10.3 33 33 A L E - 0 0 12 -8,-3.0 2,-0.3 1,-0.4 -7,-0.2 0.859 60.3 -30.4 -91.9 -41.6 -2.1 11.4 13.8 34 34 A T E -B 25 0A 32 -9,-1.0 -9,-0.9 2,-0.1 -1,-0.4 -0.950 34.2-133.9-170.6 156.3 -1.9 8.2 15.8 35 35 A K S S+ 0 0 119 -2,-0.3 -1,-0.0 -11,-0.2 -3,-0.0 0.372 75.0 113.1 -95.2 -0.9 -2.6 4.4 15.8 36 36 A S S S- 0 0 43 2,-0.1 -11,-0.4 1,-0.1 -2,-0.1 -0.414 73.2-132.5 -63.8 144.7 -4.1 4.8 19.3 37 37 A P S S+ 0 0 121 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.437 79.8 103.2 -78.2 3.0 -7.9 4.2 19.6 38 38 A D >> - 0 0 78 1,-0.2 4,-1.4 -13,-0.0 3,-0.5 -0.791 55.9-164.1 -95.3 114.3 -8.2 7.4 21.6 39 39 A L H 3> S+ 0 0 60 -2,-0.6 4,-2.3 1,-0.2 5,-0.2 0.892 89.4 58.2 -60.0 -45.0 -9.5 10.5 19.7 40 40 A N H 3> S+ 0 0 106 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.762 102.8 54.5 -62.0 -26.0 -8.3 13.0 22.3 41 41 A A H <> S+ 0 0 25 -3,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.912 110.8 44.7 -68.6 -45.9 -4.8 11.7 21.8 42 42 A A H X S+ 0 0 0 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.796 110.0 57.2 -65.4 -31.3 -5.1 12.4 18.1 43 43 A K H X S+ 0 0 69 -4,-2.3 4,-1.4 2,-0.2 11,-0.3 0.886 110.7 41.8 -66.7 -39.3 -6.6 15.7 19.0 44 44 A S H X S+ 0 0 62 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.809 108.9 60.7 -73.8 -31.6 -3.5 16.6 21.0 45 45 A E H X S+ 0 0 67 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.906 104.3 49.5 -62.3 -43.1 -1.3 15.2 18.2 46 46 A L H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 5,-0.3 0.927 109.1 50.9 -57.0 -51.2 -2.8 17.8 15.8 47 47 A D H X>S+ 0 0 34 -4,-1.4 4,-2.6 1,-0.2 5,-1.1 0.896 112.9 47.1 -54.4 -42.6 -2.1 20.7 18.2 48 48 A K H <5S+ 0 0 153 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.863 110.7 51.8 -69.0 -37.1 1.5 19.5 18.6 49 49 A A H <5S+ 0 0 40 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.842 120.4 32.7 -68.4 -35.1 1.9 19.1 14.8 50 50 A I H <5S- 0 0 41 -4,-2.1 -2,-0.2 2,-0.3 -3,-0.2 0.834 103.7-120.6 -92.5 -36.7 0.7 22.6 14.0 51 51 A G T <5S+ 0 0 69 -4,-2.6 2,-0.3 1,-0.4 -3,-0.2 0.644 80.6 68.6 99.2 22.9 1.9 24.6 17.1 52 52 A R S - 0 0 70 -2,-0.2 4,-1.6 1,-0.1 -1,-0.1 -0.374 30.1-108.2 -90.0 175.0 -6.5 25.2 7.5 60 60 A K H > S+ 0 0 127 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.862 117.7 50.8 -72.8 -40.9 -5.5 24.5 3.8 61 61 A D H > S+ 0 0 129 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.908 111.2 48.7 -63.1 -42.6 -2.0 26.1 4.1 62 62 A E H > S+ 0 0 44 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.862 108.6 54.7 -62.9 -38.2 -1.3 24.1 7.3 63 63 A A H X S+ 0 0 0 -4,-1.6 4,-1.8 1,-0.2 -34,-0.4 0.839 108.7 48.0 -62.5 -36.2 -2.4 20.9 5.5 64 64 A E H X S+ 0 0 48 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.775 108.9 53.4 -77.5 -30.4 0.1 21.6 2.7 65 65 A K H X S+ 0 0 146 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.959 111.8 45.0 -67.0 -48.7 2.8 22.3 5.2 66 66 A L H X S+ 0 0 4 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.862 110.9 56.0 -57.6 -39.7 2.1 18.8 6.8 67 67 A F H X S+ 0 0 1 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.926 106.7 47.4 -62.0 -49.2 2.0 17.3 3.3 68 68 A N H X S+ 0 0 20 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.929 114.1 49.2 -55.3 -44.3 5.5 18.5 2.3 69 69 A Q H X S+ 0 0 91 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.899 112.1 47.4 -62.5 -43.1 6.8 17.2 5.7 70 70 A D H X S+ 0 0 31 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.854 111.1 49.3 -71.4 -38.6 5.1 13.8 5.2 71 71 A V H X S+ 0 0 7 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.950 112.8 49.4 -64.3 -47.2 6.4 13.4 1.6 72 72 A D H X S+ 0 0 38 -4,-2.5 4,-2.9 -5,-0.2 5,-0.2 0.933 110.5 50.6 -51.6 -50.9 9.9 14.3 2.8 73 73 A A H X S+ 0 0 41 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.865 109.2 51.2 -56.0 -39.7 9.5 11.8 5.7 74 74 A A H X S+ 0 0 7 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.909 112.4 45.5 -66.9 -43.6 8.5 9.0 3.2 75 75 A V H X S+ 0 0 5 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.957 115.4 46.0 -64.6 -53.2 11.4 9.6 1.0 76 76 A R H X S+ 0 0 81 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.905 109.8 56.4 -54.8 -39.5 13.9 9.8 3.9 77 77 A G H X S+ 0 0 19 -4,-2.7 4,-0.7 -5,-0.2 -2,-0.2 0.900 109.9 45.1 -60.4 -43.5 12.2 6.6 5.3 78 78 A I H >< S+ 0 0 2 -4,-2.0 3,-0.9 1,-0.2 7,-0.5 0.941 113.4 48.9 -61.2 -51.5 12.9 4.7 2.1 79 79 A L H 3< S+ 0 0 26 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.777 112.2 48.9 -67.5 -25.5 16.5 6.0 1.8 80 80 A R H 3< S+ 0 0 196 -4,-2.1 2,-0.5 -5,-0.2 -1,-0.3 0.606 93.5 90.4 -87.8 -12.8 17.3 5.0 5.4 81 81 A N S+ 0 0 129 2,-0.1 4,-0.6 1,-0.1 -1,-0.2 0.887 118.7 39.0 -76.5 -38.4 15.5 -3.3 2.5 84 84 A L H > S+ 0 0 7 -6,-0.2 4,-3.2 -7,-0.2 5,-0.2 0.869 101.9 66.0 -86.1 -40.1 13.9 -0.5 0.6 85 85 A K H X S+ 0 0 58 -4,-2.7 4,-3.2 -7,-0.5 5,-0.2 0.893 102.0 45.3 -55.7 -53.3 16.7 1.7 -0.7 86 86 A P H > S+ 0 0 62 0, 0.0 4,-0.7 0, 0.0 -1,-0.2 0.860 116.5 47.4 -61.0 -33.2 18.3 -0.8 -3.2 87 87 A V H >X S+ 0 0 8 -4,-0.6 3,-0.8 -3,-0.2 4,-0.7 0.951 114.0 48.2 -69.1 -47.2 14.9 -1.7 -4.5 88 88 A Y H >< S+ 0 0 13 -4,-3.2 3,-1.5 1,-0.2 -3,-0.2 0.918 108.5 52.6 -54.4 -50.6 14.0 2.0 -4.8 89 89 A D H 3< S+ 0 0 15 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.689 104.3 57.3 -68.5 -14.8 17.2 2.9 -6.5 90 90 A S H << S+ 0 0 32 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.626 90.9 98.3 -84.2 -15.8 16.6 0.2 -9.1 91 91 A L S << S- 0 0 6 -3,-1.5 2,-0.1 -4,-0.7 31,-0.0 -0.409 74.8-119.8 -75.8 145.6 13.2 1.7 -10.1 92 92 A D > - 0 0 51 -2,-0.1 4,-1.7 1,-0.1 -1,-0.1 -0.342 43.4 -90.2 -70.9 170.5 12.5 4.0 -13.0 93 93 A A H > S+ 0 0 5 1,-0.2 4,-1.2 2,-0.2 -2,-0.1 0.856 122.5 44.9 -55.1 -52.4 11.1 7.5 -12.3 94 94 A V H >> S+ 0 0 21 62,-0.3 4,-1.4 1,-0.2 3,-0.5 0.930 112.7 49.6 -64.2 -48.0 7.4 6.7 -12.4 95 95 A R H 3> S+ 0 0 22 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.820 103.1 61.9 -61.2 -29.1 7.6 3.5 -10.3 96 96 A R H 3X S+ 0 0 3 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.884 101.5 54.0 -63.4 -36.6 9.6 5.5 -7.7 97 97 A X H S+ 0 0 35 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.883 124.4 53.9 -55.2 -46.7 8.1 2.1 6.1 109 109 A T H > S+ 0 0 131 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.923 109.3 47.4 -59.6 -46.9 7.7 -0.9 8.5 110 110 A G H >4 S+ 0 0 33 -4,-0.5 3,-0.9 1,-0.2 4,-0.3 0.942 116.5 43.6 -59.1 -51.5 4.6 -2.2 6.7 111 111 A V H >< S+ 0 0 9 -4,-1.9 3,-1.8 1,-0.2 -1,-0.2 0.873 105.6 60.2 -61.4 -45.4 6.1 -2.0 3.3 112 112 A A H 3< S+ 0 0 9 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.687 96.3 64.2 -63.9 -15.8 9.5 -3.4 4.2 113 113 A G T << S+ 0 0 55 -3,-0.9 2,-2.3 -4,-0.8 -1,-0.3 0.646 75.3 90.2 -80.3 -17.8 7.8 -6.6 5.3 114 114 A F <> + 0 0 53 -3,-1.8 4,-2.2 -4,-0.3 3,-0.2 -0.404 55.3 163.5 -74.3 62.3 6.7 -7.4 1.7 115 115 A T H > + 0 0 83 -2,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.835 66.4 45.6 -58.5 -45.7 9.9 -9.3 1.1 116 116 A N H > S+ 0 0 79 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.852 111.5 51.9 -69.7 -36.5 8.9 -11.2 -2.1 117 117 A V H > S+ 0 0 8 2,-0.2 4,-2.8 -3,-0.2 5,-0.2 0.896 107.8 52.9 -62.8 -44.9 7.3 -8.2 -3.8 118 118 A L H X S+ 0 0 21 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.925 111.1 47.3 -56.2 -43.8 10.5 -6.2 -3.1 119 119 A R H X S+ 0 0 111 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.926 112.5 48.5 -62.5 -46.6 12.4 -9.1 -4.8 120 120 A M H <>S+ 0 0 13 -4,-2.5 5,-3.8 1,-0.2 -2,-0.2 0.870 112.7 48.9 -62.5 -38.3 10.0 -9.1 -7.7 121 121 A L H ><5S+ 0 0 6 -4,-2.8 3,-1.4 3,-0.2 -2,-0.2 0.892 109.5 51.5 -67.6 -43.3 10.3 -5.3 -8.1 122 122 A Q H 3<5S+ 0 0 94 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.802 112.4 46.1 -64.9 -29.3 14.1 -5.4 -8.0 123 123 A Q T 3<5S- 0 0 108 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.272 116.9-116.2 -96.3 10.9 14.1 -8.1 -10.7 124 124 A K T < 5 + 0 0 125 -3,-1.4 2,-1.4 1,-0.2 -3,-0.2 0.799 62.5 150.9 63.6 33.2 11.6 -6.1 -12.8 125 125 A R >< + 0 0 74 -5,-3.8 4,-2.1 1,-0.2 -1,-0.2 -0.627 14.6 168.0 -94.0 73.1 8.9 -8.8 -12.5 126 126 A W H > + 0 0 45 -2,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.817 65.2 53.0 -63.5 -39.3 6.1 -6.2 -12.7 127 127 A D H > S+ 0 0 93 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.940 111.9 42.6 -63.9 -52.4 3.2 -8.5 -13.3 128 128 A E H > S+ 0 0 84 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.912 113.3 53.5 -61.9 -46.0 3.8 -10.8 -10.3 129 129 A A H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.919 109.0 49.9 -51.9 -47.4 4.6 -7.8 -8.0 130 130 A A H X S+ 0 0 9 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.885 112.6 46.7 -59.8 -43.5 1.3 -6.3 -9.0 131 131 A V H X S+ 0 0 81 -4,-1.9 4,-1.0 2,-0.2 -1,-0.2 0.884 113.1 48.8 -65.6 -42.2 -0.6 -9.5 -8.3 132 132 A N H < S+ 0 0 45 -4,-2.9 3,-0.3 1,-0.2 -2,-0.2 0.870 112.5 47.4 -70.4 -37.9 1.2 -9.9 -4.9 133 133 A L H >< S+ 0 0 0 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56.3 -67.2 -28.0 12.4 32.3 -34.9 204 41 B A H <> S+ 0 0 33 -3,-1.1 4,-2.0 2,-0.2 -1,-0.2 0.900 109.2 46.2 -67.6 -43.1 13.9 28.8 -34.2 205 42 B A H X S+ 0 0 0 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.787 110.6 54.6 -65.8 -29.3 12.9 29.3 -30.5 206 43 B K H X S+ 0 0 75 -4,-1.6 4,-1.9 -5,-0.2 -2,-0.2 0.946 107.7 48.6 -69.6 -46.1 9.5 30.5 -31.7 207 44 B S H X S+ 0 0 60 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.939 110.9 50.5 -51.5 -52.2 9.0 27.3 -33.7 208 45 B E H X S+ 0 0 78 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.808 108.0 53.8 -62.7 -34.8 10.0 25.1 -30.7 209 46 B L H X S+ 0 0 0 -4,-1.5 4,-1.9 2,-0.2 5,-0.3 0.911 107.3 47.7 -67.2 -46.8 7.6 27.0 -28.4 210 47 B D H X>S+ 0 0 37 -4,-1.9 4,-2.9 1,-0.2 5,-0.9 0.873 112.5 52.3 -59.7 -37.5 4.5 26.4 -30.6 211 48 B K H <5S+ 0 0 140 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.813 108.5 50.6 -65.7 -35.7 5.5 22.8 -30.9 212 49 B A H <5S+ 0 0 40 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.848 121.4 30.9 -73.1 -36.8 5.8 22.5 -27.1 213 50 B I H <5S- 0 0 40 -4,-1.9 -2,-0.2 2,-0.2 -3,-0.2 0.857 101.5-122.7 -90.2 -38.5 2.4 24.0 -26.4 214 51 B G T <5S+ 0 0 68 -4,-2.9 2,-0.3 1,-0.3 -3,-0.2 0.638 78.4 67.8 98.5 22.6 0.4 22.9 -29.4 215 52 B R S - 0 0 67 -2,-0.2 4,-1.7 1,-0.1 5,-0.1 -0.406 30.4-107.5 -91.9 174.3 -0.2 31.3 -19.8 223 60 B K H > S+ 0 0 125 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.862 117.9 50.7 -70.6 -40.9 0.5 30.2 -16.2 224 61 B D H > S+ 0 0 129 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.921 111.6 48.1 -64.8 -43.3 -1.2 26.8 -16.5 225 62 B E H > S+ 0 0 44 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.876 108.8 54.9 -62.0 -39.2 0.8 26.0 -19.7 226 63 B A H X S+ 0 0 1 -4,-1.7 4,-1.7 1,-0.2 -34,-0.4 0.829 109.1 47.4 -60.8 -35.0 4.0 27.2 -17.9 227 64 B E H X S+ 0 0 53 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.743 108.9 53.9 -79.6 -30.7 3.3 24.7 -15.1 228 65 B K H X S+ 0 0 145 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.962 111.5 45.1 -65.8 -51.4 2.6 21.9 -17.6 229 66 B L H X S+ 0 0 5 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.877 111.2 55.5 -54.3 -40.8 6.0 22.6 -19.1 230 67 B F H X S+ 0 0 1 -4,-1.7 4,-2.7 2,-0.2 5,-0.2 0.936 106.9 47.6 -61.5 -49.9 7.5 22.7 -15.6 231 68 B N H X S+ 0 0 20 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.903 113.8 49.4 -55.3 -41.9 6.2 19.3 -14.6 232 69 B Q H X S+ 0 0 91 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.915 112.1 46.9 -65.1 -42.0 7.6 17.9 -17.9 233 70 B D H X S+ 0 0 33 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.868 111.0 50.0 -73.9 -39.5 11.0 19.5 -17.5 234 71 B V H X S+ 0 0 7 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.958 113.0 48.6 -61.4 -49.0 11.4 18.3 -13.9 235 72 B D H X S+ 0 0 38 -4,-2.3 4,-2.9 -5,-0.2 -2,-0.2 0.923 111.1 50.5 -51.3 -48.8 10.4 14.8 -15.1 236 73 B A H X S+ 0 0 42 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.877 109.7 51.0 -58.7 -41.3 13.0 15.1 -18.0 237 74 B A H X S+ 0 0 6 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.917 112.0 45.6 -62.7 -47.5 15.7 16.2 -15.5 238 75 B V H X S+ 0 0 5 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.948 115.7 46.1 -62.9 -50.3 15.0 13.2 -13.2 239 76 B R H X S+ 0 0 83 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.902 109.0 57.1 -56.9 -40.1 14.9 10.7 -16.1 240 77 B G H X S+ 0 0 19 -4,-2.7 4,-0.8 -5,-0.2 -1,-0.2 0.900 109.8 45.0 -56.8 -43.0 18.1 12.4 -17.6 241 78 B I H >< S+ 0 0 3 -4,-1.9 3,-0.9 1,-0.2 7,-0.5 0.949 112.8 48.9 -65.2 -50.3 19.9 11.6 -14.3 242 79 B L H 3< S+ 0 0 24 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.790 112.4 49.0 -67.0 -26.6 18.7 8.0 -14.0 243 80 B R H 3< S+ 0 0 197 -4,-2.2 2,-0.5 -5,-0.2 -1,-0.3 0.608 93.1 90.4 -86.7 -14.9 19.6 7.2 -17.7 244 81 B N S+ 0 0 126 2,-0.1 4,-0.5 1,-0.1 -1,-0.2 0.889 118.6 39.5 -76.6 -37.4 28.0 8.9 -14.7 247 84 B L H > S+ 0 0 6 -6,-0.2 4,-3.2 -7,-0.2 5,-0.2 0.846 101.2 65.7 -87.3 -38.9 25.1 10.6 -12.8 248 85 B K H X S+ 0 0 61 -4,-2.5 4,-3.1 -7,-0.5 5,-0.2 0.898 102.1 46.1 -56.4 -52.7 22.9 7.7 -11.5 249 86 B P H > S+ 0 0 60 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.858 116.6 46.7 -61.6 -32.6 25.4 6.1 -9.0 250 87 B V H X S+ 0 0 7 -4,-0.5 4,-0.8 2,-0.2 3,-0.4 0.950 114.3 48.4 -70.5 -46.9 26.3 9.6 -7.7 251 88 B Y H >< S+ 0 0 16 -4,-3.2 3,-1.2 1,-0.2 -3,-0.2 0.913 109.2 51.3 -55.3 -47.6 22.7 10.5 -7.4 252 89 B D H 3< S+ 0 0 14 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.772 105.0 57.4 -71.7 -20.0 21.7 7.3 -5.7 253 90 B S H 3< S+ 0 0 29 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.706 91.8 97.7 -73.9 -22.7 24.5 7.9 -3.1 254 91 B L S << S- 0 0 5 -3,-1.2 2,-0.0 -4,-0.8 31,-0.0 -0.322 75.5-119.3 -73.1 147.0 23.0 11.3 -2.1 255 92 B D > - 0 0 46 -2,-0.1 4,-2.0 1,-0.1 -1,-0.1 -0.314 43.0 -90.3 -72.9 170.3 20.7 12.1 0.8 256 93 B A H > S+ 0 0 5 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.860 122.5 44.3 -52.5 -53.8 17.2 13.5 0.1 257 94 B V H > S+ 0 0 18 62,-0.3 4,-1.6 1,-0.2 3,-0.4 0.904 113.1 49.9 -66.6 -43.1 17.9 17.2 0.1 258 95 B R H > S+ 0 0 21 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.853 102.7 62.0 -63.8 -31.5 21.1 16.9 -2.0 259 96 B R H X S+ 0 0 3 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.875 102.2 53.3 -59.2 -35.1 19.2 14.9 -4.5 260 97 B X H X S+ 0 0 37 -4,-1.1 4,-2.4 -3,-0.4 -2,-0.2 0.910 107.0 49.6 -64.7 -41.7 17.0 18.0 -4.9 261 98 B A H X S+ 0 0 0 -4,-1.6 4,-2.6 1,-0.2 -2,-0.2 0.905 111.1 51.2 -63.0 -39.7 20.1 20.1 -5.6 262 99 B A H X S+ 0 0 15 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.914 110.2 46.8 -63.1 -46.9 21.2 17.5 -8.2 263 100 B I H X S+ 0 0 6 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.933 112.7 52.6 -57.4 -42.8 17.8 17.6 -10.0 264 101 B N H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.925 107.9 49.2 -60.5 -46.9 18.1 21.4 -9.9 265 102 B E H X S+ 0 0 9 -4,-2.6 4,-3.0 2,-0.2 5,-0.4 0.924 113.9 45.5 -61.2 -45.6 21.6 21.5 -11.4 266 103 B V H X S+ 0 0 9 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.905 110.6 54.6 -63.3 -42.3 20.5 19.1 -14.3 267 104 B F H < S+ 0 0 24 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.928 118.4 34.8 -54.3 -49.3 17.3 21.1 -14.8 268 105 B Q H < S+ 0 0 29 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.938 133.4 24.0 -71.6 -47.9 19.3 24.3 -15.2 269 106 B M H < S- 0 0 23 -4,-3.0 4,-0.5 -5,-0.2 -3,-0.2 0.657 102.1-122.9 -99.3 -22.4 22.4 23.0 -17.0 270 107 B G X - 0 0 31 -4,-2.4 4,-1.8 -5,-0.4 5,-0.2 0.113 30.7 -80.8 87.8 155.6 21.3 19.8 -18.7 271 108 B V H > S+ 0 0 34 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.904 124.2 54.3 -57.9 -47.0 22.7 16.3 -18.3 272 109 B T H > S+ 0 0 133 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.918 109.4 47.5 -57.3 -47.9 25.7 16.7 -20.7 273 110 B G H >4 S+ 0 0 32 -4,-0.5 3,-1.1 1,-0.2 4,-0.4 0.951 115.7 44.1 -59.0 -54.3 27.0 19.8 -18.9 274 111 B V H >< S+ 0 0 8 -4,-1.8 3,-1.7 1,-0.2 -1,-0.2 0.858 105.9 60.3 -57.8 -43.3 26.7 18.3 -15.5 275 112 B A H 3< S+ 0 0 10 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.646 95.9 64.0 -67.6 -14.4 28.2 14.9 -16.4 276 113 B G T << S+ 0 0 54 -3,-1.1 2,-2.4 -4,-0.7 -1,-0.3 0.658 75.4 89.9 -81.1 -18.6 31.4 16.5 -17.5 277 114 B F <> + 0 0 51 -3,-1.7 4,-2.2 -4,-0.4 5,-0.2 -0.394 55.1 162.8 -73.8 61.4 32.1 17.7 -13.9 278 115 B T H > + 0 0 82 -2,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.815 66.2 46.3 -58.7 -41.9 34.0 14.4 -13.3 279 116 B N H > S+ 0 0 83 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.880 111.3 51.5 -73.1 -37.3 35.9 15.4 -10.1 280 117 B V H > S+ 0 0 7 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.903 108.0 53.1 -61.3 -44.7 32.9 17.0 -8.4 281 118 B L H X S+ 0 0 19 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.918 110.7 47.4 -57.6 -43.2 30.9 13.8 -9.1 282 119 B R H X S+ 0 0 113 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.926 112.8 48.5 -61.8 -46.3 33.7 11.9 -7.4 283 120 B M H <>S+ 0 0 13 -4,-2.5 5,-3.6 2,-0.2 -2,-0.2 0.892 112.5 48.6 -61.7 -42.0 33.8 14.3 -4.4 284 121 B L H ><5S+ 0 0 6 -4,-3.1 3,-1.7 3,-0.2 -2,-0.2 0.924 109.6 51.9 -64.3 -45.8 30.0 14.1 -4.1 285 122 B Q H 3<5S+ 0 0 93 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.822 112.0 46.2 -62.9 -30.5 30.0 10.3 -4.1 286 123 B Q T 3<5S- 0 0 107 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.304 117.2-115.9 -94.7 9.1 32.7 10.3 -1.4 287 124 B K T < 5 + 0 0 123 -3,-1.7 2,-1.5 1,-0.2 -3,-0.2 0.787 62.5 151.2 64.7 32.4 30.7 12.8 0.6 288 125 B R >< + 0 0 69 -5,-3.6 4,-2.2 1,-0.2 -1,-0.2 -0.614 13.8 167.1 -91.2 72.6 33.4 15.5 0.3 289 126 B W H > + 0 0 45 -2,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.840 65.2 53.6 -62.4 -40.6 30.9 18.3 0.5 290 127 B D H > S+ 0 0 94 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.946 112.2 41.9 -63.0 -51.9 33.3 21.1 1.1 291 128 B E H > S+ 0 0 81 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.911 113.1 53.9 -61.3 -47.9 35.5 20.5 -1.9 292 129 B A H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.927 109.1 49.1 -48.9 -51.1 32.6 19.8 -4.2 293 130 B A H X S+ 0 0 7 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.886 112.4 48.0 -59.0 -42.4 31.0 23.1 -3.2 294 131 B V H X S+ 0 0 83 -4,-1.9 4,-0.9 2,-0.2 -1,-0.2 0.887 113.2 47.4 -64.9 -40.4 34.3 24.9 -3.9 295 132 B N H < S+ 0 0 43 -4,-2.7 -2,-0.2 1,-0.2 3,-0.2 0.849 112.6 48.7 -74.3 -35.5 34.8 23.2 -7.3 296 133 B L H >< S+ 0 0 0 -4,-2.8 3,-1.3 -5,-0.2 6,-0.5 0.820 105.1 60.4 -67.5 -33.0 31.2 23.9 -8.3 297 134 B A H 3< S+ 0 0 34 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.782 104.5 48.7 -67.8 -26.4 31.8 27.5 -7.2 298 135 B K T 3< S+ 0 0 138 -4,-0.9 -1,-0.3 -3,-0.2 -2,-0.2 0.306 91.0 116.8 -95.0 8.5 34.6 27.9 -9.8 299 136 B S S <> S- 0 0 8 -3,-1.3 4,-1.9 1,-0.1 5,-0.1 -0.214 77.5-120.0 -70.4 163.1 32.4 26.4 -12.6 300 137 B R H > S+ 0 0 110 2,-0.2 4,-1.6 1,-0.2 5,-0.3 0.879 115.5 58.6 -68.0 -39.4 31.3 28.2 -15.8 301 138 B W H > S+ 0 0 6 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.924 110.1 41.3 -49.0 -52.8 27.7 27.6 -14.6 302 139 B Y H 4 S+ 0 0 70 -6,-0.5 7,-0.2 1,-0.2 -2,-0.2 0.903 111.8 53.2 -69.2 -45.5 28.3 29.5 -11.3 303 140 B N H < S+ 0 0 111 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.754 119.8 34.3 -63.1 -27.9 30.4 32.3 -12.7 304 141 B Q H < S+ 0 0 97 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.757 129.6 32.5 -96.9 -31.1 27.7 33.2 -15.4 305 142 B b S X S+ 0 0 7 -4,-2.2 4,-2.6 -5,-0.3 3,-0.4 -0.367 70.3 152.3-120.7 54.0 24.5 32.3 -13.4 306 143 B P H > S+ 0 0 50 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.764 75.2 44.9 -65.8 -28.5 25.6 33.2 -9.8 307 144 B D H 4 S+ 0 0 118 2,-0.2 4,-0.4 1,-0.2 -2,-0.1 0.817 117.8 43.6 -82.0 -33.7 22.1 34.0 -8.6 308 145 B R H 4 S+ 0 0 56 -3,-0.4 4,-0.2 1,-0.1 -1,-0.2 0.780 124.5 37.5 -76.7 -27.6 20.6 30.9 -10.2 309 146 B A H X S+ 0 0 0 -4,-2.6 4,-1.9 -7,-0.2 3,-0.5 0.742 95.7 80.3 -94.1 -30.1 23.5 28.8 -9.0 310 147 B K H X S+ 0 0 99 -4,-1.9 4,-1.8 -5,-0.3 5,-0.1 0.836 94.3 43.7 -55.3 -46.7 24.3 30.2 -5.5 311 148 B R H > S+ 0 0 47 -4,-0.4 4,-1.8 1,-0.2 -1,-0.3 0.811 111.1 57.0 -72.2 -30.0 21.6 28.4 -3.4 312 149 B V H > S+ 0 0 0 -3,-0.5 4,-1.8 -4,-0.2 -2,-0.2 0.930 107.0 46.6 -66.9 -49.3 22.2 25.2 -5.2 313 150 B I H X S+ 0 0 11 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.914 112.3 51.3 -54.2 -47.4 26.0 25.0 -4.3 314 151 B T H X S+ 0 0 68 -4,-1.8 4,-2.2 1,-0.2 5,-0.3 0.871 107.2 54.1 -63.7 -35.3 25.2 25.9 -0.7 315 152 B T H X S+ 0 0 0 -4,-1.8 4,-2.6 1,-0.2 -1,-0.2 0.876 107.1 50.1 -66.0 -38.7 22.6 23.1 -0.6 316 153 B F H < S+ 0 0 1 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.841 112.3 49.4 -66.5 -36.4 25.2 20.6 -1.8 317 154 B R H < S+ 0 0 142 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.924 126.0 22.2 -65.6 -44.2 27.5 21.8 0.9 318 155 B T H < S- 0 0 67 -4,-2.2 -2,-0.2 2,-0.2 -3,-0.2 0.725 82.9-140.2-102.5 -26.6 25.0 21.7 3.9 319 156 B G < + 0 0 15 -4,-2.6 -62,-0.3 1,-0.3 2,-0.3 0.708 68.4 107.7 63.4 22.3 22.3 19.2 2.8 320 157 B T S S- 0 0 49 -6,-0.2 3,-0.4 -5,-0.2 -1,-0.3 -0.780 78.2-123.2-115.9 170.2 19.7 21.4 4.4 321 158 B W S > S+ 0 0 49 -2,-0.3 3,-1.9 1,-0.2 4,-0.4 0.230 76.2 114.6 -91.8 11.5 17.0 23.7 2.9 322 159 B D G > + 0 0 96 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.774 64.9 63.7 -60.6 -30.8 18.4 26.8 4.7 323 160 B A G 3 S+ 0 0 34 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.680 110.8 39.1 -64.8 -19.7 19.4 28.6 1.5 324 161 B Y G < 0 0 17 -3,-1.9 -1,-0.2 -13,-0.1 -2,-0.2 0.385 360.0 360.0-106.6 -1.2 15.7 28.7 0.4 325 162 B K < 0 0 186 -3,-1.1 -3,-0.1 -4,-0.4 0, 0.0 -0.301 360.0 360.0 -67.2 360.0 14.3 29.4 3.8