==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER NUCLEASE 21-SEP-05 2C1W . COMPND 2 MOLECULE: ENDOU PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: XENOPUS LAEVIS; . AUTHOR F.RENZI,E.CAFFARELLI,P.LANEVE,I.BOZZONI,M.BRUNORI,B.VALLONE . 820 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35200.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 553 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 124 15.1 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 . 13 1.6 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 . 1 0.1 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 . 76 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 233 28.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.6 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 2 4 0 0 0 3 2 0 8 5 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 9 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 . 5 1 3 3 3 0 0 6 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 3 3 3 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 6 A G 0 0 113 0, 0.0 2,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -73.7 49.5 -7.0 17.0 2 7 A Q - 0 0 164 1,-0.1 241,-0.5 241,-0.0 2,-0.1 -0.392 360.0 -74.8 -88.6 164.9 50.0 -8.0 13.4 3 8 A L B -a 243 0A 46 1,-0.1 2,-1.5 -2,-0.1 241,-0.2 -0.324 43.4-129.3 -59.6 126.5 47.7 -7.7 10.4 4 9 A N > - 0 0 32 239,-2.8 4,-2.5 1,-0.2 5,-0.3 -0.710 25.6-171.2 -84.6 86.7 44.9 -10.3 10.6 5 10 A H H > S+ 0 0 136 -2,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.921 78.8 45.7 -37.7 -67.6 45.2 -11.9 7.1 6 11 A E H > S+ 0 0 82 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.839 117.6 44.7 -56.5 -36.8 42.0 -14.1 7.1 7 12 A L H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.826 109.4 52.4 -80.4 -33.1 39.8 -11.3 8.6 8 13 A S H X S+ 0 0 12 -4,-2.5 4,-2.0 235,-0.2 -2,-0.2 0.862 116.0 45.7 -64.7 -29.9 41.0 -8.5 6.3 9 14 A K H X S+ 0 0 128 -4,-1.7 4,-1.7 -5,-0.3 -2,-0.2 0.933 114.0 44.2 -76.8 -51.6 40.2 -10.8 3.5 10 15 A L H X S+ 0 0 14 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.912 116.7 48.4 -60.7 -42.7 36.8 -12.0 4.7 11 16 A F H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 3,-0.3 0.957 105.2 56.0 -67.1 -52.1 35.8 -8.5 5.6 12 17 A N H X S+ 0 0 44 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.850 108.8 50.9 -40.7 -42.7 37.0 -7.0 2.2 13 18 A E H X S+ 0 0 75 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.901 108.8 49.1 -63.2 -44.9 34.6 -9.6 0.7 14 19 A L H < S+ 0 0 0 -4,-1.8 -2,-0.2 -3,-0.3 -1,-0.2 0.838 110.5 52.3 -63.3 -34.2 31.7 -8.4 3.0 15 20 A W H >< S+ 0 0 36 -4,-2.6 3,-1.3 2,-0.2 -2,-0.2 0.934 110.9 46.0 -64.3 -49.0 32.6 -4.9 1.9 16 21 A D H 3< S+ 0 0 126 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.838 114.8 49.7 -59.8 -35.5 32.4 -6.0 -1.8 17 22 A A T 3< S+ 0 0 2 -4,-2.2 2,-2.5 1,-0.1 84,-0.4 0.282 73.1 120.2 -89.8 8.9 29.1 -7.8 -0.9 18 23 A D X + 0 0 20 -3,-1.3 3,-2.3 1,-0.2 -1,-0.1 -0.352 29.8 165.1 -77.8 64.4 27.5 -4.8 0.9 19 24 A Q T 3 + 0 0 119 -2,-2.5 -1,-0.2 1,-0.3 3,-0.1 0.815 65.7 69.4 -44.8 -40.5 24.5 -4.6 -1.5 20 25 A N T 3 S+ 0 0 42 -3,-0.2 2,-1.2 1,-0.2 -1,-0.3 0.347 81.5 164.6 -86.4 4.0 22.6 -2.4 1.0 21 26 A R < - 0 0 130 -3,-2.3 -1,-0.2 199,-0.1 199,-0.1 -0.365 36.9-155.5 94.7 -77.7 25.0 0.2 0.2 22 27 A M - 0 0 0 -2,-1.2 2,-0.3 197,-0.1 -1,-0.1 0.884 25.4-149.2 -31.6 133.1 24.5 3.6 1.0 23 28 A K >> - 0 0 102 1,-0.1 4,-1.6 6,-0.0 5,-1.0 -0.675 14.4-113.1-106.3 138.5 26.6 5.6 -1.5 24 29 A S B 45S+d 28 0B 23 -2,-0.3 2,-0.4 171,-0.2 5,-0.2 -0.492 96.3 17.5 -70.9 109.0 28.4 8.9 -1.1 25 30 A G T 45S+ 0 0 35 3,-2.7 -1,-0.1 -2,-0.6 170,-0.0 -0.793 128.0 36.5 137.8 -86.7 26.8 11.5 -3.4 26 31 A K T 45S+ 0 0 181 -2,-0.4 -2,-0.1 1,-0.2 3,-0.1 0.859 128.3 35.1 -65.8 -35.6 23.4 10.4 -4.5 27 32 A D T <5S- 0 0 12 -4,-1.6 24,-3.5 1,-0.3 2,-0.3 0.760 131.4 -3.5 -95.1 -30.0 22.5 8.7 -1.1 28 33 A Y E < -dE 24 50B 0 -5,-1.0 -3,-2.7 22,-0.3 2,-0.4 -0.952 55.5-155.0-156.3 151.0 24.2 11.0 1.4 29 34 A R E - E 0 49B 135 20,-2.0 20,-1.8 -2,-0.3 19,-1.4 -0.998 13.7-160.6-127.9 127.8 26.4 14.0 1.3 30 35 A I E - E 0 47B 6 -2,-0.4 2,-0.6 164,-0.3 17,-0.2 -0.818 9.9-147.2-108.6 150.3 28.8 14.9 4.2 31 36 A S - 0 0 38 15,-3.1 3,-0.2 -2,-0.3 -2,-0.0 -0.893 13.8-180.0-119.2 100.3 30.4 18.2 5.0 32 37 A L + 0 0 19 -2,-0.6 2,-3.3 1,-0.2 151,-0.2 0.882 16.5 168.4 -68.1 -38.1 33.8 17.8 6.5 33 38 A Q - 0 0 64 149,-0.1 2,-0.3 9,-0.1 -1,-0.2 -0.274 52.0 -24.7 63.9 -61.6 34.3 21.6 6.8 34 39 A G S S- 0 0 6 -2,-3.3 149,-2.1 -3,-0.2 2,-0.2 -0.958 74.2 -62.2-172.2 174.8 37.4 21.7 9.0 35 40 A K B -f 183 0C 70 147,-0.3 2,-0.6 -2,-0.3 7,-0.3 -0.537 43.8-117.7 -84.9 143.8 39.7 20.1 11.6 36 41 A A S S- 0 0 1 147,-2.7 2,-1.7 -2,-0.2 146,-0.2 -0.693 84.1 -29.2 -76.4 117.7 38.7 19.2 15.2 37 42 A G S S+ 0 0 1 -2,-0.6 356,-0.4 144,-0.4 365,-0.3 -0.474 113.4 80.1 82.9 -74.7 40.8 21.3 17.5 38 43 A Y 0 0 43 -2,-1.7 -3,-0.2 363,-0.1 354,-0.1 -0.125 360.0 360.0 -74.8 163.9 44.1 22.0 15.8 39 44 A V 0 0 89 352,-0.3 -1,-0.1 354,-0.1 354,-0.0 -0.921 360.0 360.0-105.3 360.0 45.2 24.6 13.2 40 ! 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 41 54 A S 0 0 78 0, 0.0 141,-0.1 0, 0.0 -5,-0.1 0.000 360.0 360.0 360.0 109.6 35.8 25.5 11.8 42 55 A A + 0 0 8 139,-0.5 -9,-0.1 -7,-0.3 -10,-0.1 -0.206 360.0 144.5 -50.6 142.5 32.8 23.1 11.6 43 56 A S + 0 0 100 1,-0.3 137,-0.2 2,-0.1 -1,-0.2 0.326 54.4 68.6-146.7 -64.2 29.4 24.8 12.1 44 57 A F S S- 0 0 144 1,-0.1 -1,-0.3 135,-0.1 4,-0.1 -0.192 97.5 -86.8 -49.7 153.8 27.0 22.9 9.8 45 58 A P - 0 0 68 0, 0.0 -14,-0.2 0, 0.0 -1,-0.1 -0.328 32.4-121.8 -57.8 150.1 26.0 19.3 10.6 46 59 A L S S+ 0 0 0 1,-0.2 -15,-3.1 -16,-0.1 2,-1.1 0.872 103.1 63.0 -57.8 -43.8 28.3 16.6 9.2 47 60 A F E +E 30 0B 10 -17,-0.2 -17,-0.2 1,-0.2 -1,-0.2 -0.734 59.4 174.9 -95.8 94.4 25.5 15.0 7.3 48 61 A Q E S- 0 0 109 -19,-1.4 2,-0.3 -2,-1.1 -18,-0.2 0.824 71.3 -1.6 -69.5 -26.2 24.4 17.6 4.7 49 62 A F E -E 29 0B 79 -20,-1.8 -20,-2.0 -3,-0.1 2,-0.3 -0.988 56.1-178.4-159.2 149.7 22.0 15.2 3.1 50 63 A V E -E 28 0B 8 -2,-0.3 2,-1.1 -22,-0.2 -22,-0.3 -0.892 40.0-110.5-151.3 128.9 20.8 11.6 3.4 51 64 A D > - 0 0 31 -24,-3.5 4,-1.5 -2,-0.3 3,-0.3 -0.381 33.2-170.2 -54.9 93.5 18.2 9.8 1.2 52 65 A E H > S+ 0 0 84 -2,-1.1 4,-3.3 1,-0.2 -1,-0.2 0.814 78.7 57.4 -59.0 -35.9 15.4 9.5 3.8 53 66 A E H 4 S+ 0 0 115 2,-0.2 6,-0.2 1,-0.2 -1,-0.2 0.871 104.7 50.6 -66.4 -41.0 13.2 7.1 1.6 54 67 A K H 4>S+ 0 0 26 -3,-0.3 5,-0.6 1,-0.2 7,-0.3 0.862 119.2 38.8 -62.8 -38.0 16.0 4.5 1.2 55 68 A L H <5S+ 0 0 4 -4,-1.5 2,-3.0 1,-0.2 -2,-0.2 0.887 102.8 74.4 -68.5 -43.0 16.3 4.7 5.0 56 69 A K T <5S- 0 0 169 -4,-3.3 -1,-0.2 -5,-0.2 -3,-0.1 -0.273 122.6 -66.8 -76.6 56.1 12.6 5.0 5.4 57 70 A S T 5S+ 0 0 71 -2,-3.0 -1,-0.1 2,-0.2 3,-0.1 -0.026 106.8 95.4 69.9 179.4 12.2 1.3 4.6 58 71 A R T 5S+ 0 0 173 1,-0.2 2,-0.2 -3,-0.1 -4,-0.1 -0.340 97.5 64.1 85.0 -39.4 12.9 -0.6 1.4 59 72 A K S > S+ 0 0 13 1,-0.3 4,-1.4 -2,-0.2 36,-0.1 0.407 109.0 79.8 -64.0 -4.7 17.5 -2.9 6.6 61 74 A F H 3> S+ 0 0 0 -7,-0.3 4,-3.2 2,-0.2 -1,-0.3 0.786 83.8 61.6 -68.0 -32.1 18.1 0.6 7.8 62 75 A A H <> S+ 0 0 15 -3,-1.9 4,-2.4 -8,-0.2 -2,-0.2 0.955 106.7 40.2 -58.6 -58.0 14.4 0.8 8.6 63 76 A T H > S+ 0 0 28 -4,-0.4 4,-1.1 1,-0.2 29,-0.2 0.883 117.7 52.5 -58.3 -42.8 14.4 -2.1 11.1 64 77 A F H >X S+ 0 0 0 -4,-1.4 4,-2.1 2,-0.2 3,-0.5 0.916 108.7 47.8 -52.8 -51.3 17.7 -0.6 12.4 65 78 A I H 3X S+ 0 0 25 -4,-3.2 4,-2.9 1,-0.2 5,-0.2 0.894 106.4 58.7 -67.2 -34.7 16.2 2.9 12.8 66 79 A S H 3X S+ 0 0 60 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.764 108.1 46.1 -62.2 -31.0 13.2 1.4 14.7 67 80 A L H X S+ 0 0 1 -4,-2.1 3,-0.6 1,-0.2 4,-0.6 0.955 111.5 48.2 -58.3 -49.5 17.5 3.2 17.6 69 82 A D H 3X S+ 0 0 55 -4,-2.9 4,-2.1 1,-0.2 3,-0.5 0.761 101.6 65.3 -59.8 -34.0 14.2 5.2 18.1 70 83 A N H 3X S+ 0 0 18 -4,-0.8 4,-2.2 1,-0.3 -1,-0.2 0.898 103.7 45.2 -58.4 -41.9 13.0 2.7 20.7 71 84 A Y H << S+ 0 0 31 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.587 107.2 61.8 -78.5 -14.6 15.9 3.7 23.0 72 85 A E H < S+ 0 0 60 -4,-0.6 -2,-0.2 -3,-0.5 -1,-0.2 0.969 115.2 29.9 -68.9 -60.9 15.2 7.4 22.2 73 86 A M H < S+ 0 0 127 -4,-2.1 -2,-0.2 1,-0.1 3,-0.1 0.980 82.2 173.9 -59.8 -66.2 11.6 7.2 23.7 74 87 A D < - 0 0 56 -4,-2.2 -3,-0.1 1,-0.3 -1,-0.1 0.248 7.1-176.4 96.3 -3.5 12.5 4.5 26.3 75 88 A T + 0 0 124 -5,-0.1 -1,-0.3 0, 0.0 2,-0.1 0.050 56.8 52.3 -60.7 132.9 9.1 4.6 27.9 76 89 A G S S- 0 0 35 -3,-0.1 6,-0.0 5,-0.0 5,-0.0 -0.232 90.7 -79.9 115.0 130.1 10.3 2.1 30.5 77 90 A V - 0 0 93 -2,-0.1 3,-0.5 1,-0.1 79,-0.1 -0.171 47.0-114.4 -50.7 160.3 12.8 1.0 33.1 78 91 A A S S+ 0 0 14 1,-0.2 -1,-0.1 77,-0.1 78,-0.0 0.702 109.3 59.2 -83.4 -22.4 16.0 -0.7 31.8 79 92 A E S S+ 0 0 98 54,-0.0 2,-0.6 2,-0.0 -1,-0.2 0.483 88.6 94.8 -82.5 -3.6 15.5 -4.2 33.2 80 93 A V - 0 0 65 -3,-0.5 2,-0.7 62,-0.1 62,-0.0 -0.816 55.3-167.3 -96.4 118.7 12.2 -4.5 31.3 81 94 A V - 0 0 71 -2,-0.6 -3,-0.0 4,-0.0 -2,-0.0 -0.939 20.5-154.5 -97.0 113.1 12.2 -6.2 27.9 82 95 A T > - 0 0 38 -2,-0.7 4,-2.0 1,-0.1 3,-0.5 -0.600 27.6-112.4 -89.6 145.7 8.7 -5.3 26.5 83 96 A P H > S+ 0 0 115 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.816 118.5 56.2 -40.1 -36.5 6.9 -7.4 23.8 84 97 A E H > S+ 0 0 125 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.906 103.5 48.6 -64.9 -52.1 7.5 -4.5 21.5 85 98 A E H > S+ 0 0 19 -3,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.859 111.1 55.8 -58.4 -36.5 11.3 -4.3 21.8 86 99 A I H X S+ 0 0 51 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.953 106.2 45.8 -59.9 -55.8 11.2 -8.1 21.2 87 100 A A H X S+ 0 0 45 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.881 114.1 51.5 -59.1 -38.5 9.3 -8.0 17.8 88 101 A E H X S+ 0 0 34 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.885 108.9 49.4 -60.6 -43.9 11.6 -5.1 16.7 89 102 A N H X S+ 0 0 6 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.928 113.9 48.2 -59.1 -47.2 14.7 -7.2 17.7 90 103 A N H X S+ 0 0 49 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.893 108.2 51.9 -56.6 -49.0 13.1 -10.0 15.7 91 104 A N H X S+ 0 0 87 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.877 111.4 48.8 -58.7 -43.9 12.3 -7.8 12.6 92 105 A F H X S+ 0 0 0 -4,-2.1 4,-2.7 -29,-0.2 5,-0.3 0.939 112.1 46.3 -60.3 -52.4 16.0 -6.7 12.5 93 106 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.981 112.8 52.4 -54.5 -54.5 17.4 -10.1 12.8 94 107 A D H < S+ 0 0 73 -4,-2.9 4,-0.4 1,-0.2 -1,-0.2 0.840 112.2 44.9 -44.0 -50.2 14.9 -11.3 10.1 95 108 A A H >< S+ 0 0 18 -4,-2.2 3,-1.4 1,-0.2 4,-0.3 0.950 114.4 45.0 -66.5 -52.9 16.0 -8.6 7.7 96 109 A I H >< S+ 0 0 0 -4,-2.7 3,-1.6 1,-0.2 6,-0.4 0.883 105.5 64.2 -63.0 -35.2 19.7 -8.8 8.1 97 110 A L T 3< S+ 0 0 6 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.575 97.6 53.9 -64.5 -14.7 19.6 -12.7 7.9 98 111 A E T < S+ 0 0 146 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.486 91.0 103.6 -97.3 1.1 18.3 -12.6 4.2 99 112 A T S <> S- 0 0 11 -3,-1.6 4,-1.5 -4,-0.3 5,-0.1 -0.311 76.5-132.3 -81.1 150.6 21.2 -10.4 3.3 100 113 A K H > S+ 0 0 98 -83,-0.2 4,-2.7 2,-0.2 5,-0.2 0.843 108.2 57.5 -76.4 -33.1 24.3 -11.8 1.4 101 114 A V H > S+ 0 0 2 -84,-0.4 4,-3.4 2,-0.2 5,-0.2 0.955 112.1 41.7 -53.2 -54.5 26.7 -10.1 3.8 102 115 A M H > S+ 0 0 4 -6,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.822 114.4 49.9 -67.3 -33.2 25.0 -12.0 6.7 103 116 A K H X S+ 0 0 83 -4,-1.5 4,-2.7 2,-0.2 -1,-0.2 0.853 114.1 47.5 -67.9 -37.7 24.8 -15.2 4.7 104 117 A M H X S+ 0 0 42 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.958 112.7 46.8 -62.8 -56.7 28.5 -14.7 3.9 105 118 A A H X S+ 0 0 3 -4,-3.4 4,-1.9 2,-0.2 -2,-0.2 0.920 113.2 51.8 -47.9 -49.7 29.3 -14.0 7.6 106 119 A H H X S+ 0 0 15 -4,-2.5 4,-2.1 1,-0.2 3,-0.5 0.958 106.7 51.8 -52.0 -61.7 27.2 -17.0 8.5 107 120 A D H X S+ 0 0 103 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.825 108.1 53.0 -47.7 -46.1 29.2 -19.3 6.0 108 121 A Y H X S+ 0 0 35 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.967 111.5 43.6 -53.0 -52.6 32.5 -18.2 7.6 109 122 A L H <>S+ 0 0 0 -4,-1.9 5,-2.7 -3,-0.5 6,-0.8 0.824 109.2 57.2 -74.2 -31.2 31.5 -19.0 11.1 110 123 A V H ><5S+ 0 0 49 -4,-2.1 3,-1.8 4,-0.2 -1,-0.2 0.926 102.3 56.2 -55.1 -50.4 29.9 -22.4 10.1 111 124 A R H 3<5S+ 0 0 226 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.715 113.0 41.4 -51.2 -30.4 33.2 -23.4 8.6 112 125 A K T 3<5S- 0 0 98 -4,-0.8 -1,-0.3 -3,-0.4 -2,-0.2 0.372 111.8-121.5 -98.5 -0.4 34.8 -22.8 12.0 113 126 A N T < 5S+ 0 0 102 -3,-1.8 -3,-0.2 -4,-0.2 -2,-0.1 0.765 79.8 124.9 54.9 28.8 31.9 -24.4 13.9 114 127 A Q S S- 0 0 63 1,-0.1 4,-1.6 4,-0.0 -2,-0.2 -0.264 72.7-136.2 -71.6 147.8 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-37.2 35.8 16.1 35.2 366 102 B N H X S+ 0 0 11 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.942 112.4 46.7 -67.0 -43.7 37.9 16.9 32.1 367 103 B N H X S+ 0 0 5 -4,-2.6 4,-3.6 1,-0.2 -2,-0.2 0.890 109.5 52.1 -62.7 -47.0 35.1 19.2 31.0 368 104 B N H X S+ 0 0 80 -4,-2.7 4,-3.6 2,-0.2 -1,-0.2 0.893 112.0 47.1 -55.0 -48.7 34.6 20.9 34.4 369 105 B F H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.963 115.4 43.1 -62.8 -48.8 38.3 21.7 34.6 370 106 B L H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.927 115.5 52.3 -60.6 -43.5 38.5 23.0 31.0 371 107 B D H < S+ 0 0 66 -4,-3.6 4,-0.5 1,-0.2 -2,-0.2 0.978 111.0 45.4 -54.0 -61.7 35.3 24.8 31.7 372 108 B A H >< S+ 0 0 21 -4,-3.6 3,-1.2 1,-0.2 -2,-0.2 0.875 116.2 44.8 -46.8 -49.5 36.6 26.4 34.9 373 109 B I H >< S+ 0 0 0 -4,-2.8 3,-2.1 1,-0.3 6,-0.5 0.872 102.7 63.9 -71.8 -33.8 39.9 27.5 33.4 374 110 B L T 3< S+ 0 0 9 -4,-2.9 -1,-0.3 -5,-0.3 -2,-0.2 0.601 96.4 62.1 -62.8 -10.5 38.4 28.8 30.2 375 111 B E T < S+ 0 0 128 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.534 86.7 97.0 -89.5 -9.6 36.6 31.4 32.4 376 112 B T S <> S- 0 0 17 -3,-2.1 4,-2.2 -4,-0.2 5,-0.2 -0.452 79.3-125.8 -92.4 153.7 39.8 33.0 33.7 377 113 B K H > S+ 0 0 117 1,-0.2 4,-1.6 -84,-0.2 5,-0.2 0.893 111.4 61.4 -59.8 -35.2 41.6 36.1 32.5 378 114 B V H > S+ 0 0 2 -85,-0.4 4,-2.1 1,-0.2 3,-0.3 0.939 108.9 40.2 -55.5 -45.7 44.7 34.0 32.2 379 115 B M H > S+ 0 0 2 -6,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.825 109.0 57.6 -79.3 -34.2 43.1 31.7 29.7 380 116 B K H X S+ 0 0 105 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.788 111.7 46.3 -60.5 -27.5 41.3 34.4 27.7 381 117 B M H X S+ 0 0 38 -4,-1.6 4,-2.4 -3,-0.3 -2,-0.2 0.903 109.8 50.2 -83.2 -44.0 44.7 36.0 27.2 382 118 B A H X S+ 0 0 1 -4,-2.1 4,-2.7 -5,-0.2 -2,-0.2 0.935 113.1 48.3 -51.7 -49.7 46.5 32.8 26.2 383 119 B H H X S+ 0 0 26 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.908 108.6 52.0 -64.5 -45.6 43.7 32.1 23.7 384 120 B D H X S+ 0 0 110 -4,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.905 111.9 49.0 -59.6 -39.0 43.9 35.6 22.2 385 121 B Y H X S+ 0 0 22 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.952 110.3 48.6 -62.0 -57.3 47.7 35.1 21.8 386 122 B L H <>S+ 0 0 0 -4,-2.7 5,-4.1 1,-0.2 6,-0.7 0.869 113.0 49.0 -50.9 -41.1 47.4 31.7 20.1 387 123 B V H ><5S+ 0 0 47 -4,-2.5 3,-2.5 4,-0.2 -2,-0.2 0.941 107.8 52.7 -63.8 -51.3 44.7 33.2 17.7 388 124 B R H 3<5S+ 0 0 160 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.903 113.6 45.7 -49.0 -40.7 46.9 36.2 16.8 389 125 B K T 3<5S- 0 0 72 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.318 115.9-120.3 -83.4 3.9 49.6 33.7 16.0 390 126 B N T < 5S+ 0 0 119 -3,-2.5 -3,-0.2 -5,-0.1 -2,-0.1 0.836 82.6 117.1 54.5 39.4 47.1 31.6 14.0 391 127 B Q < + 0 0 45 -5,-4.1 2,-0.3 -6,-0.2 -352,-0.3 0.384 67.3 42.9-115.8 -2.3 47.8 28.6 16.4 392 128 B A S S- 0 0 5 -6,-0.7 -354,-0.1 -354,-0.1 -2,-0.1 -0.980 87.2 -97.7-141.5 157.8 44.3 28.2 17.9 393 129 B K - 0 0 14 -356,-0.4 6,-0.1 -2,-0.3 -6,-0.1 -0.484 35.6-128.5 -66.8 143.8 40.6 28.2 16.9 394 130 B P S S+ 0 0 89 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.162 81.1 75.3 -93.3 20.4 39.0 31.7 17.5 395 131 B T S > S- 0 0 46 1,-0.1 4,-1.9 -12,-0.0 5,-0.2 -0.867 80.0-124.1-119.8 158.9 36.0 30.5 19.6 396 132 B R H > S+ 0 0 128 -2,-0.3 4,-2.3 2,-0.2 5,-0.1 0.949 110.7 46.5 -61.7 -52.3 35.8 29.2 23.2 397 133 B N H > S+ 0 0 72 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.887 113.7 46.8 -64.1 -44.7 34.2 25.9 22.3 398 134 B D H > S+ 0 0 8 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.879 113.1 49.2 -62.6 -44.5 36.6 25.1 19.5 399 135 B F H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.883 106.5 57.1 -59.8 -39.4 39.6 26.0 21.6 400 136 B K H X S+ 0 0 16 -4,-2.3 4,-1.9 1,-0.3 -2,-0.2 0.882 107.4 48.1 -63.1 -38.0 38.2 23.8 24.4 401 137 B V H X S+ 0 0 1 -4,-1.5 4,-2.0 2,-0.2 -1,-0.3 0.883 108.4 54.5 -66.2 -41.2 38.2 20.9 22.0 402 138 B Q H X S+ 0 0 7 -4,-1.8 4,-1.9 -365,-0.3 -2,-0.2 0.956 111.9 44.0 -59.7 -47.5 41.8 21.8 21.0 403 139 B L H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 5,-0.4 0.798 108.1 59.6 -65.4 -35.5 42.9 21.6 24.7 404 140 B Y H X>S+ 0 0 0 -4,-1.9 4,-3.2 -5,-0.2 5,-1.2 0.968 108.5 42.5 -54.5 -55.0 41.0 18.5 25.3 405 141 B N H <5S+ 0 0 19 -4,-2.0 4,-0.4 1,-0.2 -2,-0.2 0.877 115.7 49.1 -66.5 -36.8 42.9 16.5 22.6 406 142 B I H <5S+ 0 0 8 -4,-1.9 134,-2.0 -5,-0.2 17,-0.3 0.839 128.4 19.7 -63.9 -41.9 46.3 18.0 23.7 407 143 B W H <5S+ 0 0 0 -4,-1.9 17,-2.8 16,-0.2 18,-0.4 0.712 132.8 28.3-107.7 -32.2 45.8 17.3 27.4 408 144 B F T <5S+ 0 0 6 -4,-3.2 -3,-0.2 -5,-0.4 2,-0.1 0.624 85.0 106.3-115.5 -17.6 43.2 14.7 28.0 409 145 B Q S S- 0 0 54 -2,-2.1 3,-1.7 3,-0.2 -1,-0.1 -0.612 94.3-129.5-172.7 84.3 54.5 2.7 21.6 415 151 B P T 3 S+ 0 0 131 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.229 88.6 31.3 -74.6 132.8 52.3 2.4 18.5 416 152 B G T 3 S+ 0 0 59 1,-0.6 2,-0.1 -4,-0.1 0, 0.0 -0.297 98.4 96.9 116.9 -45.6 50.1 -0.7 18.3 417 153 B S S < S- 0 0 63 -3,-1.7 -1,-0.6 1,-0.1 -3,-0.2 -0.345 91.0 -80.4 -72.2 159.0 49.7 -0.9 22.1 418 154 B R - 0 0 84 1,-0.1 2,-0.3 -3,-0.1 -1,-0.1 -0.323 46.9-103.7 -65.3 139.5 46.5 0.5 23.7 419 155 B P + 0 0 42 0, 0.0 -7,-0.3 0, 0.0 -1,-0.1 -0.498 51.3 165.1 -63.2 124.4 46.5 4.3 24.4 420 156 B D + 0 0 41 -9,-1.7 14,-0.4 -2,-0.3 2,-0.3 0.382 45.3 32.1-135.2 0.3 47.1 4.5 28.2 421 157 B S B -T 411 0H 0 -10,-1.7 -10,-2.5 12,-0.1 2,-0.3 -0.970 54.7-150.8-151.8 173.1 48.1 8.0 29.3 422 158 B C > - 0 0 3 -2,-0.3 4,-1.8 -12,-0.2 5,-0.2 -0.876 34.2-102.3-141.4 171.8 47.5 11.7 28.6 423 159 B G H > S+ 0 0 0 -14,-0.4 4,-2.1 -17,-0.3 5,-0.3 0.843 115.7 58.9 -71.0 -37.2 49.3 15.0 28.9 424 160 B F H >>S+ 0 0 1 -17,-2.8 4,-2.2 1,-0.2 5,-1.4 0.899 108.4 49.0 -52.1 -44.5 47.5 16.2 32.0 425 161 B E H 4>S+ 0 0 2 -18,-0.4 6,-1.6 3,-0.2 5,-1.3 0.934 112.9 43.1 -66.7 -46.2 48.8 13.1 33.7 426 162 B H H <5S+ 0 0 2 -4,-1.8 117,-0.4 4,-0.2 -1,-0.2 0.820 124.8 36.9 -65.3 -31.8 52.6 13.5 32.6 427 163 B V H <5S+ 0 0 3 -4,-2.1 15,-0.5 -5,-0.2 16,-0.4 0.948 135.3 13.8 -86.5 -53.1 52.5 17.2 33.4 428 164 B F T <5S+ 0 0 2 -4,-2.2 -3,-0.2 -5,-0.3 15,-0.2 0.815 127.8 47.3 -98.0 -37.3 50.4 17.6 36.4 429 165 B V T > S- 0 0 32 -8,-0.1 4,-1.7 5,-0.1 3,-0.7 -0.904 81.5-115.9-166.6 129.4 51.4 5.7 33.6 434 170 B R T 34 S+ 0 0 37 -14,-0.4 -13,-0.0 -2,-0.3 -1,-0.0 0.601 111.5 21.2 -43.9 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445 181 B V H > S+ 0 0 1 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.948 114.2 43.5 -64.4 -48.3 49.4 21.6 44.4 446 182 B Q H > S+ 0 0 5 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.863 110.0 56.3 -64.8 -39.6 50.2 18.0 43.7 447 183 B F H X S+ 0 0 4 -4,-2.8 4,-2.4 1,-0.2 5,-0.3 0.981 108.7 49.7 -50.2 -55.6 53.4 18.2 45.7 448 184 B Y H X S+ 0 0 24 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.869 112.8 43.9 -51.0 -48.8 51.2 19.3 48.6 449 185 B L H X S+ 0 0 9 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.911 115.3 47.1 -71.2 -44.3 48.7 16.5 48.3 450 186 B Q H <>S+ 0 0 4 -4,-2.7 5,-2.6 2,-0.2 6,-1.7 0.767 114.0 49.0 -66.7 -30.7 51.3 13.8 47.8 451 187 B E H ><5S+ 0 0 16 -4,-2.4 3,-1.8 -5,-0.3 -2,-0.2 0.902 107.4 54.8 -72.1 -42.7 53.3 15.1 50.8 452 188 B K H 3<5S+ 0 0 101 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.763 110.5 46.8 -62.1 -27.4 50.2 15.2 52.9 453 189 B R T 3<5S- 0 0 88 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.328 117.2-114.1 -97.7 10.9 49.6 11.6 52.2 454 190 B K T < 5S+ 0 0 180 -3,-1.8 -3,-0.2 2,-0.1 -2,-0.1 0.748 88.1 111.9 65.1 28.7 53.3 10.6 52.9 455 191 B N S - 0 0 69 -2,-0.6 3,-0.7 1,-0.2 86,-0.2 -0.648 59.3-141.6 -62.1 83.5 72.4 27.5 42.0 465 201 B Q T 3 S+ 0 0 77 -2,-2.1 -1,-0.2 1,-0.3 347,-0.0 0.474 79.2 60.9 -63.6 -46.4 74.4 28.6 44.8 466 202 B N T 3 S+ 0 0 158 -3,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.222 91.4 89.8 -69.0 15.8 76.2 32.0 44.4 467 203 B K S < S- 0 0 34 -3,-0.7 2,-0.3 1,-0.2 84,-0.1 -0.013 100.1 -69.3 -78.9-162.5 72.8 33.6 44.0 468 204 B S - 0 0 70 82,-0.1 -1,-0.2 1,-0.1 82,-0.1 -0.684 60.0 -93.6 -86.4 152.4 70.9 34.8 47.1 469 205 B R - 0 0 141 -2,-0.3 2,-0.2 1,-0.1 -1,-0.1 -0.504 48.1-114.7 -63.7 129.7 69.6 32.2 49.5 470 206 B P - 0 0 5 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.502 33.1-152.0 -71.5 137.8 66.0 31.5 48.5 471 207 B D > - 0 0 87 -2,-0.2 3,-1.8 -163,-0.0 -164,-0.0 -0.515 32.9 -91.6-102.4 175.3 63.4 32.5 51.1 472 208 B E T 3 S+ 0 0 76 1,-0.3 -166,-0.3 -2,-0.2 -171,-0.1 0.513 120.9 59.6 -63.4 -7.4 59.9 31.2 51.9 473 209 B D T 3 S+ 0 0 79 -173,-0.1 -1,-0.3 -168,-0.1 2,-0.2 0.297 71.9 123.0-108.5 5.3 58.3 33.7 49.4 474 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