==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 31-MAR-06 2GJU . COMPND 2 MOLECULE: 252AA LONG HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR H.YAMAMOTO,N.KUNISHIMA,RIKEN STRUCTURAL GENOMICS/PROTEOMICS . 1008 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43766.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 735 72.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 91 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 99 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.8 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 . 12 1.2 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 . 75 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 293 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 4 4 5 3 0 0 0 5 1 2 0 0 0 0 0 0 1 3 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 5 7 0 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 PARALLEL BRIDGES PER LADDER . 1 0 0 4 7 5 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 8 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 0 118 0, 0.0 32,-2.1 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 179.5 25.2 -23.6 37.3 2 2 A V E +a 33 0A 42 30,-0.2 210,-1.9 32,-0.1 211,-0.4 -0.864 360.0 172.2-109.0 132.8 22.3 -21.4 38.5 3 3 A Y E -aB 34 211A 18 30,-3.0 32,-1.4 -2,-0.4 33,-0.6 -0.859 28.4-129.4-129.8 162.2 22.6 -17.7 39.3 4 4 A V E -aB 36 210A 0 206,-2.0 206,-2.5 -2,-0.3 2,-0.4 -0.972 25.2-134.8-113.5 129.2 20.0 -15.1 40.2 5 5 A A E -aB 37 209A 0 31,-2.1 33,-2.9 -2,-0.5 2,-0.5 -0.719 19.6-167.7 -87.3 132.5 20.3 -11.9 38.2 6 6 A V E +aB 38 208A 2 202,-2.9 202,-2.5 -2,-0.4 2,-0.3 -0.981 10.0 173.8-123.9 121.0 20.1 -8.6 40.2 7 7 A L E +a 39 0A 0 31,-3.3 33,-3.9 -2,-0.5 2,-0.3 -0.883 3.0 179.3-123.4 156.0 19.7 -5.3 38.4 8 8 A A E +a 40 0A 0 198,-0.4 187,-3.0 -2,-0.3 188,-0.3 -0.998 49.3 20.9-156.4 156.3 19.0 -1.8 39.7 9 9 A N + 0 0 0 31,-0.7 187,-2.3 32,-0.3 188,-0.9 0.932 48.9 158.7 52.2 61.1 18.6 1.8 38.7 10 10 A I > - 0 0 0 32,-1.1 3,-1.9 30,-0.5 33,-0.2 0.883 23.4-173.2 -73.2 -39.1 17.5 1.5 35.1 11 11 A A T 3 - 0 0 0 31,-3.3 36,-2.6 1,-0.3 35,-1.1 0.758 68.9 -52.3 49.4 36.0 16.0 5.0 35.6 12 12 A G T 3 S+ 0 0 0 31,-2.4 37,-1.6 30,-0.2 2,-1.2 0.570 99.0 136.4 83.4 8.7 14.4 5.1 32.2 13 13 A N <> + 0 0 0 -3,-1.9 4,-1.8 30,-0.2 -1,-0.2 -0.725 24.2 174.6 -93.2 88.9 17.6 4.2 30.2 14 14 A F H > S+ 0 0 64 -2,-1.2 4,-3.1 1,-0.2 5,-0.2 0.886 74.3 55.0 -61.7 -45.1 16.3 1.6 27.7 15 15 A P H > S+ 0 0 23 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.915 109.5 47.7 -57.2 -43.9 19.5 1.2 25.8 16 16 A A H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.917 113.1 48.8 -62.9 -44.1 21.5 0.3 28.9 17 17 A L H X S+ 0 0 2 -4,-1.8 4,-2.8 2,-0.2 5,-0.2 0.945 110.8 49.5 -61.5 -49.4 18.8 -2.1 30.0 18 18 A T H X S+ 0 0 36 -4,-3.1 4,-2.2 1,-0.2 -1,-0.2 0.895 109.5 52.3 -57.8 -41.4 18.7 -3.8 26.6 19 19 A A H X S+ 0 0 14 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.919 111.6 47.1 -61.2 -43.2 22.5 -4.1 26.6 20 20 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.935 111.9 48.5 -64.4 -48.0 22.4 -5.8 30.0 21 21 A L H X S+ 0 0 27 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.860 112.0 50.0 -62.5 -35.4 19.6 -8.2 29.1 22 22 A E H X S+ 0 0 121 -4,-2.2 4,-1.7 -5,-0.2 -1,-0.2 0.865 107.5 53.2 -71.4 -36.1 21.4 -9.2 25.9 23 23 A K H X S+ 0 0 43 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.908 109.0 51.1 -63.8 -39.6 24.7 -9.8 27.8 24 24 A I H X S+ 0 0 1 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.883 105.9 53.5 -64.9 -39.0 22.7 -12.1 30.1 25 25 A E H < S+ 0 0 98 -4,-1.7 4,-0.3 1,-0.2 -1,-0.2 0.878 111.9 47.5 -62.5 -35.6 21.3 -14.0 27.2 26 26 A E H >< S+ 0 0 85 -4,-1.7 3,-1.5 1,-0.2 4,-0.2 0.870 105.9 55.3 -71.7 -42.1 24.9 -14.5 26.0 27 27 A L H ><>S+ 0 0 9 -4,-2.3 5,-2.1 1,-0.3 3,-1.1 0.756 97.8 64.8 -64.0 -24.7 26.2 -15.6 29.4 28 28 A K G ><5S+ 0 0 76 -4,-1.3 3,-0.6 1,-0.3 -1,-0.3 0.711 98.5 53.9 -70.6 -18.0 23.5 -18.3 29.4 29 29 A E G < 5S+ 0 0 65 -3,-1.5 679,-0.4 -4,-0.3 -1,-0.3 0.521 104.6 60.0 -88.4 -7.1 25.4 -19.7 26.4 30 30 A E G < 5S- 0 0 13 -3,-1.1 -1,-0.2 -4,-0.2 -2,-0.2 0.010 132.4 -78.4-110.8 27.4 28.4 -19.6 28.7 31 31 A G T < 5S+ 0 0 47 -3,-0.6 2,-0.5 1,-0.3 -3,-0.2 0.367 91.5 127.0 96.7 -7.1 27.3 -21.9 31.5 32 32 A Y < - 0 0 28 -5,-2.1 2,-0.5 -6,-0.1 -1,-0.3 -0.744 36.8-170.4 -90.6 130.6 25.1 -19.5 33.3 33 33 A E E -a 2 0A 128 -32,-2.1 -30,-3.0 -2,-0.5 2,-0.7 -0.986 7.9-159.0-120.1 123.0 21.6 -20.6 34.1 34 34 A I E +a 3 0A 22 -2,-0.5 -30,-0.2 -32,-0.2 3,-0.1 -0.873 13.4 179.8-113.2 103.2 19.4 -17.8 35.4 35 35 A E E - 0 0 98 -32,-1.4 30,-0.6 -2,-0.7 2,-0.3 0.808 67.1 -6.4 -76.6 -26.0 16.4 -19.0 37.3 36 36 A K E -ac 4 65A 16 -33,-0.6 -31,-2.1 28,-0.1 2,-0.4 -0.984 60.5-126.7-161.1 167.0 15.0 -15.5 38.2 37 37 A Y E -ac 5 66A 1 28,-3.0 30,-2.6 -2,-0.3 2,-0.5 -0.963 6.6-159.7-125.9 141.6 15.6 -11.8 38.1 38 38 A Y E -ac 6 67A 0 -33,-2.9 -31,-3.3 -2,-0.4 2,-0.6 -0.989 14.0-168.8-116.5 121.4 15.5 -9.1 40.8 39 39 A I E -ac 7 68A 1 28,-2.8 30,-2.3 -2,-0.5 -31,-0.2 -0.917 2.6-166.1-120.3 107.5 15.0 -5.6 39.4 40 40 A L E -a 8 0A 1 -33,-3.9 -31,-0.7 -2,-0.6 -30,-0.5 -0.593 26.4 -76.0 -89.7 151.4 15.5 -2.8 41.8 41 41 A G S S+ 0 0 0 28,-0.4 -32,-0.3 29,-0.3 -1,-0.1 -0.275 89.0 83.3 -78.5 173.3 14.5 0.8 41.1 42 42 A N + 0 0 0 2,-0.2 -31,-3.3 -34,-0.2 -32,-1.1 0.263 53.5 168.0 -76.1 139.4 14.6 3.4 40.0 43 43 A I - 0 0 0 -33,-0.2 -31,-2.4 -32,-0.2 2,-0.2 0.911 66.8 -3.1 -83.8 -43.2 12.9 1.9 37.0 44 44 A V S S+ 0 0 0 -33,-0.3 -2,-0.2 -32,-0.1 -33,-0.2 -0.690 83.2 92.4-133.4-175.2 12.0 5.2 35.3 45 45 A G S S+ 0 0 0 2,-0.4 61,-0.2 -2,-0.2 -33,-0.1 0.003 83.7 45.2 119.9 -34.8 12.3 8.9 36.0 46 46 A L S S+ 0 0 1 -35,-1.1 -34,-0.2 1,-0.2 -35,-0.1 0.824 98.6 52.9-109.2 -60.6 15.5 10.4 34.5 47 47 A F S S- 0 0 0 -36,-2.6 2,-0.6 -37,-0.1 -2,-0.4 -0.541 87.4-110.1 -83.4 148.9 16.1 9.2 30.9 48 48 A P S S+ 0 0 0 0, 0.0 3,-0.2 0, 0.0 -35,-0.1 0.062 94.3 83.6 -64.9 20.9 13.4 9.5 28.2 49 49 A Y > + 0 0 16 -37,-1.6 4,-2.1 -2,-0.6 5,-0.2 -0.228 41.8 136.5-120.5 46.4 12.5 5.8 27.6 50 50 A P H > S+ 0 0 2 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.925 76.3 44.7 -57.3 -47.7 9.9 5.1 30.4 51 51 A R H > S+ 0 0 149 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.909 113.3 49.6 -63.7 -44.1 7.5 3.2 28.2 52 52 A E H > S+ 0 0 60 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.845 109.9 52.3 -65.4 -33.7 10.2 1.1 26.5 53 53 A V H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.956 112.2 43.9 -66.6 -50.3 11.7 0.2 29.9 54 54 A I H X S+ 0 0 8 -4,-2.1 4,-3.0 1,-0.2 5,-0.2 0.907 113.3 51.6 -62.0 -41.5 8.4 -1.0 31.3 55 55 A E H X S+ 0 0 84 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.911 109.3 50.6 -62.3 -42.1 7.5 -2.9 28.1 56 56 A A H X S+ 0 0 18 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.865 113.2 45.6 -63.4 -38.0 10.9 -4.7 28.2 57 57 A I H X S+ 0 0 2 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.925 111.5 51.4 -71.4 -45.5 10.4 -5.7 31.8 58 58 A K H X S+ 0 0 88 -4,-3.0 4,-0.7 1,-0.2 -2,-0.2 0.900 111.0 49.4 -57.9 -40.2 6.8 -6.8 31.2 59 59 A N H >X S+ 0 0 83 -4,-2.4 3,-0.6 -5,-0.2 4,-0.6 0.888 110.6 49.3 -66.9 -39.7 8.0 -9.0 28.3 60 60 A L H >X S+ 0 0 22 -4,-1.7 3,-1.2 1,-0.2 4,-1.2 0.907 105.4 58.3 -64.9 -42.0 10.8 -10.5 30.4 61 61 A A H 3< S+ 0 0 48 -4,-2.6 5,-0.3 1,-0.2 -1,-0.2 0.670 96.7 64.0 -62.5 -20.0 8.3 -11.3 33.2 62 62 A K H << S+ 0 0 155 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.772 117.1 24.2 -75.7 -28.0 6.2 -13.4 30.8 63 63 A T H << S+ 0 0 124 -3,-1.2 2,-0.3 -4,-0.6 -2,-0.2 0.377 127.2 39.8-119.3 0.3 8.9 -16.0 30.2 64 64 A S S < S- 0 0 37 -4,-1.2 2,-0.9 -5,-0.1 -28,-0.1 -0.929 88.8 -97.5-143.6 164.9 11.0 -15.6 33.3 65 65 A N E +c 36 0A 82 -30,-0.6 -28,-3.0 -2,-0.3 2,-0.5 -0.784 49.4 177.4 -88.4 105.1 10.4 -15.1 37.1 66 66 A V E -c 37 0A 24 -2,-0.9 2,-0.6 -5,-0.3 -28,-0.2 -0.947 16.6-171.0-117.9 122.6 10.9 -11.4 37.5 67 67 A K E -c 38 0A 53 -30,-2.6 -28,-2.8 -2,-0.5 2,-0.4 -0.955 13.6-173.3-111.9 119.7 10.4 -9.6 40.9 68 68 A V E -c 39 0A 16 -2,-0.6 2,-0.4 -30,-0.2 -28,-0.2 -0.894 7.2-168.6-114.8 141.4 10.5 -5.8 40.5 69 69 A I - 0 0 4 -30,-2.3 -28,-0.4 -2,-0.4 54,-0.2 -0.984 24.6-112.6-129.6 144.8 10.5 -3.2 43.3 70 70 A R - 0 0 8 52,-2.3 68,-0.4 -2,-0.4 -29,-0.3 -0.334 25.2-151.6 -75.4 154.7 10.0 0.6 43.0 71 71 A G > - 0 0 0 -31,-0.1 4,-2.2 67,-0.1 5,-0.2 -0.498 38.7 -82.4-113.2-176.2 12.6 3.3 43.6 72 72 A K H > S+ 0 0 50 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.923 127.8 46.4 -53.9 -51.9 12.4 6.9 44.8 73 73 A Y H > S+ 0 0 2 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.881 111.2 52.2 -61.0 -40.5 11.6 8.3 41.3 74 74 A D H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 3,-0.5 0.897 109.9 49.7 -62.5 -40.5 9.0 5.7 40.7 75 75 A Q H X S+ 0 0 23 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.855 101.9 60.7 -67.5 -36.7 7.3 6.6 44.0 76 76 A L H < S+ 0 0 10 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.786 114.4 37.5 -63.0 -24.8 7.3 10.3 43.2 77 77 A I H >< S+ 0 0 0 -4,-0.9 3,-1.4 -3,-0.5 -2,-0.2 0.879 115.0 51.9 -90.2 -47.5 5.1 9.5 40.2 78 78 A A H 3< S+ 0 0 8 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.2 0.804 101.1 63.7 -59.9 -30.9 3.0 6.7 41.7 79 79 A M T 3< S+ 0 0 87 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.1 0.641 80.3 105.9 -70.8 -15.4 2.1 8.9 44.7 80 80 A S S < S- 0 0 7 -3,-1.4 -3,-0.0 -5,-0.2 4,-0.0 -0.324 90.6 -84.4 -68.0 148.5 0.2 11.4 42.5 81 81 A D > - 0 0 97 1,-0.1 3,-1.9 2,-0.1 -1,-0.1 -0.281 41.7-123.7 -50.3 129.1 -3.6 11.5 42.5 82 82 A P T 3 S+ 0 0 53 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.786 107.6 37.0 -50.1 -35.9 -4.7 8.8 40.0 83 83 A H T 3 S+ 0 0 161 3,-0.0 2,-0.1 2,-0.0 -2,-0.1 -0.140 79.1 145.8-112.9 42.3 -6.8 11.3 37.9 84 84 A A < - 0 0 30 -3,-1.9 -4,-0.0 1,-0.1 0, 0.0 -0.483 45.7-142.2 -69.6 148.1 -4.5 14.3 38.1 85 85 A G S S+ 0 0 75 1,-0.1 -1,-0.1 -2,-0.1 -2,-0.0 0.684 76.5 4.0 -87.2 -18.5 -4.8 16.2 34.9 86 86 A D S S- 0 0 72 21,-0.0 3,-0.4 0, 0.0 -1,-0.1 -0.937 74.2-106.3-155.1 170.5 -1.1 17.2 34.8 87 87 A P S > S+ 0 0 4 0, 0.0 3,-1.6 0, 0.0 4,-0.3 -0.007 73.1 122.9 -94.2 27.5 2.2 16.6 36.7 88 88 A K G > + 0 0 126 1,-0.3 3,-2.3 2,-0.2 4,-0.3 0.793 56.7 75.7 -59.9 -31.1 2.3 20.1 38.2 89 89 A Y G >> S+ 0 0 48 -3,-0.4 3,-1.6 1,-0.3 4,-0.6 0.826 85.1 69.2 -50.8 -29.7 2.4 18.8 41.8 90 90 A I G X4 S+ 0 0 0 -3,-1.6 3,-0.7 1,-0.3 -1,-0.3 0.790 83.2 68.7 -61.1 -29.7 6.1 18.0 40.9 91 91 A D G <4 S+ 0 0 70 -3,-2.3 -1,-0.3 -4,-0.3 -2,-0.2 0.595 98.7 51.6 -67.0 -10.9 7.0 21.7 40.9 92 92 A K G <4 S+ 0 0 171 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.2 0.656 86.3 104.2 -97.8 -21.9 6.5 21.9 44.6 93 93 A L S << S- 0 0 45 -3,-0.7 2,-1.9 -4,-0.6 7,-0.1 -0.261 82.6-113.3 -62.3 148.0 8.7 19.0 45.5 94 94 A E S S+ 0 0 191 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 -0.512 75.6 114.3 -83.0 71.7 12.1 19.7 47.0 95 95 A I S S- 0 0 33 -2,-1.9 5,-0.1 -5,-0.2 0, 0.0 -0.947 73.2 -77.7-139.6 157.8 14.1 18.4 44.0 96 96 A P > - 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0 0 0 -33,-0.2 -31,-2.1 -32,-0.2 2,-0.2 0.944 65.3 -5.1 -73.2 -50.1 8.6 -0.9 72.8 297 44 B V S S+ 0 0 0 -33,-0.3 -2,-0.2 -32,-0.1 -32,-0.2 -0.733 85.1 94.2-132.2-180.0 10.1 1.8 75.1 298 45 B G S S+ 0 0 0 2,-0.4 61,-0.2 -2,-0.2 -33,-0.1 -0.016 82.0 43.1 128.0 -38.6 10.5 5.6 75.1 299 46 B L S S+ 0 0 1 -35,-1.2 -34,-0.2 1,-0.2 -35,-0.1 0.834 99.5 53.5-107.9 -58.4 7.8 7.5 76.8 300 47 B F S S- 0 0 0 -36,-2.6 2,-0.7 -37,-0.1 -2,-0.4 -0.547 86.9-110.2 -85.0 148.9 6.9 5.9 80.2 301 48 B P S S+ 0 0 0 0, 0.0 3,-0.2 0, 0.0 -35,-0.1 0.072 94.4 83.8 -63.7 21.0 9.5 5.1 82.9 302 49 B Y > + 0 0 17 -37,-1.4 4,-2.1 -2,-0.7 5,-0.2 -0.196 42.3 134.1-120.7 44.4 9.5 1.3 82.8 303 50 B P H > S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.934 76.0 44.8 -57.4 -50.7 11.9 0.4 79.9 304 51 B R H > S+ 0 0 126 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.896 114.4 49.0 -63.0 -39.7 13.8 -2.3 81.7 305 52 B E H > S+ 0 0 58 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.842 109.1 53.2 -69.9 -32.7 10.7 -3.9 83.0 306 53 B V H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.955 111.5 45.1 -66.0 -48.9 9.0 -3.9 79.6 307 54 B I H X S+ 0 0 7 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.900 111.9 52.1 -62.1 -41.4 11.9 -5.7 78.0 308 55 B E H X S+ 0 0 82 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.899 108.5 51.4 -62.7 -39.9 12.3 -8.2 80.8 309 56 B A H X S+ 0 0 20 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.898 112.8 45.1 -64.5 -40.7 8.6 -9.1 80.5 310 57 B I H X S+ 0 0 4 -4,-2.0 4,-3.0 2,-0.2 5,-0.2 0.956 111.8 52.0 -67.1 -49.4 8.9 -9.6 76.8 311 58 B K H X S+ 0 0 71 -4,-2.9 4,-0.9 1,-0.2 -2,-0.2 0.901 111.0 47.1 -53.3 -46.2 12.1 -11.7 77.1 312 59 B N H >X S+ 0 0 74 -4,-2.4 4,-1.0 1,-0.2 3,-0.5 0.894 111.7 51.1 -66.0 -36.3 10.5 -14.0 79.7 313 60 B L H >X S+ 0 0 22 -4,-1.8 4,-2.3 1,-0.2 3,-0.8 0.925 105.3 56.1 -63.9 -43.1 7.5 -14.3 77.4 314 61 B A H 3< S+ 0 0 52 -4,-3.0 5,-0.2 1,-0.2 -1,-0.2 0.712 99.5 63.1 -60.1 -23.2 9.8 -15.2 74.5 315 62 B K H << S+ 0 0 167 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.887 117.3 24.1 -69.1 -40.7 11.2 -18.0 76.6 316 63 B T H << S+ 0 0 114 -4,-1.0 2,-0.3 -3,-0.8 -2,-0.2 0.596 125.3 38.1-103.6 -15.7 7.9 -19.9 76.9 317 64 B S S < S- 0 0 32 -4,-2.3 2,-0.9 -5,-0.1 -28,-0.1 -0.899 88.8 -93.1-135.3 164.1 6.0 -18.7 73.8 318 65 B N + 0 0 88 -30,-0.5 -28,-3.0 -2,-0.3 2,-0.5 -0.677 53.3 175.3 -78.9 107.1 6.6 -17.8 70.1 319 66 B V E -k 290 0C 26 -2,-0.9 2,-0.5 -5,-0.2 -28,-0.2 -0.953 18.1-174.5-125.7 121.0 7.2 -14.1 70.2 320 67 B K E -k 291 0C 61 -30,-2.5 -28,-2.9 -2,-0.5 2,-0.4 -0.941 12.6-172.7-112.0 126.5 8.2 -11.8 67.3 321 68 B V E -k 292 0C 15 -2,-0.5 2,-0.4 -30,-0.2 -28,-0.2 -0.928 8.1-168.7-121.8 141.9 9.0 -8.2 68.0 322 69 B I - 0 0 4 -30,-2.2 54,-0.2 -2,-0.4 -28,-0.1 -0.973 25.6-112.2-128.7 147.6 9.7 -5.2 65.8 323 70 B R - 0 0 8 52,-2.2 68,-0.4 -2,-0.4 -29,-0.3 -0.364 24.7-151.3 -77.9 155.1 11.0 -1.8 66.7 324 71 B G > - 0 0 0 -31,-0.1 4,-2.5 -27,-0.1 5,-0.2 -0.532 39.2 -81.3-113.4-178.6 9.2 1.5 66.6 325 72 B K H > S+ 0 0 49 1,-0.2 4,-2.1 73,-0.2 5,-0.1 0.885 127.7 46.2 -49.9 -50.2 10.2 5.2 66.1 326 73 B Y H > S+ 0 0 3 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.897 111.5 51.7 -64.1 -40.9 11.2 5.7 69.7 327 74 B D H >> S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 3,-0.7 0.905 109.8 50.5 -62.7 -40.8 13.2 2.5 69.9 328 75 B Q H 3X S+ 0 0 23 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.902 102.0 59.8 -64.1 -41.9 15.1 3.5 66.7 329 76 B L H 3< S+ 0 0 10 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.744 114.7 38.0 -59.5 -22.2 16.0 6.9 68.1 330 77 B I H X< S+ 0 0 0 -4,-0.8 3,-1.4 -3,-0.7 -2,-0.2 0.860 114.6 51.8 -92.9 -47.2 17.8 5.0 70.9 331 78 B A H 3< S+ 0 0 8 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.791 100.3 63.6 -60.9 -31.4 19.2 2.2 68.8 332 79 B M T 3< S+ 0 0 87 -4,-2.7 -1,-0.3 -5,-0.2 -3,-0.1 0.611 82.4 108.0 -71.5 -11.6 20.8 4.5 66.2 333 80 B S S < S- 0 0 8 -3,-1.4 -3,-0.1 -5,-0.2 -4,-0.0 -0.243 88.4 -83.9 -68.0 155.1 23.1 6.0 68.9 334 81 B D > - 0 0 91 1,-0.2 3,-2.1 2,-0.1 -1,-0.1 -0.387 37.2-129.7 -57.9 126.2 26.8 5.3 69.0 335 82 B P T 3 S+ 0 0 55 0, 0.0 -1,-0.2 0, 0.0 34,-0.1 0.743 106.5 37.1 -52.9 -25.9 27.3 2.0 70.9 336 83 B H T 3 S+ 0 0 160 3,-0.0 2,-0.1 29,-0.0 -2,-0.1 -0.018 80.1 138.5-117.1 31.9 29.9 3.6 73.1 337 84 B A < - 0 0 29 -3,-2.1 -4,-0.0 1,-0.1 0, 0.0 -0.487 49.3-141.9 -70.9 148.9 28.5 7.1 73.5 338 85 B G S S+ 0 0 71 -2,-0.1 -1,-0.1 1,-0.1 -2,-0.0 0.621 76.9 7.9 -88.5 -12.7 28.9 8.2 77.2 339 86 B D S S- 0 0 45 21,-0.0 3,-0.4 22,-0.0 -1,-0.1 -0.942 74.8-108.2-155.8 170.9 25.5 10.0 77.4 340 87 B P S > S+ 0 0 5 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.023 72.1 126.3 -96.1 28.5 22.3 10.5 75.4 341 88 B K G > + 0 0 133 1,-0.3 3,-1.5 2,-0.2 4,-0.4 0.735 55.5 74.2 -58.4 -26.2 23.2 14.1 74.6 342 89 B Y G > S+ 0 0 55 -3,-0.4 3,-1.4 1,-0.3 -1,-0.3 0.832 85.1 69.1 -57.3 -30.3 22.7 13.6 70.8 343 90 B I G X S+ 0 0 0 -3,-1.6 3,-1.6 1,-0.3 5,-0.3 0.765 84.6 67.0 -59.9 -29.1 19.0 13.6 71.5 344 91 B D G < S+ 0 0 74 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.2 0.781 99.9 51.7 -64.4 -24.8 18.9 17.3 72.4 345 92 B K G < S+ 0 0 182 -3,-1.4 2,-0.3 -4,-0.4 -1,-0.3 0.337 88.0 104.4 -93.1 4.0 19.7 18.1 68.8 346 93 B L S < S- 0 0 43 -3,-1.6 2,-2.0 -4,-0.1 7,-0.1 -0.656 82.4-117.1 -86.3 146.2 16.9 16.0 67.4 347 94 B E S S+ 0 0 207 -2,-0.3 -1,-0.1 0, 0.0 -3,-0.1 -0.409 74.8 115.8 -82.9 64.4 13.9 17.8 66.1 348 95 B I S S- 0 0 32 -2,-2.0 5,-0.1 -5,-0.3 -2,-0.0 -0.880 73.8 -79.0-127.2 157.8 11.5 16.2 68.6 349 96 B P > - 0 0 70 0, 0.0 4,-1.5 0, 0.0 3,-0.4 -0.124 43.0-111.5 -56.9 156.2 9.4 17.8 71.4 350 97 B D H > S+ 0 0 134 1,-0.2 4,-1.9 2,-0.2 3,-0.4 0.903 114.8 53.7 -53.9 -49.4 11.1 18.7 74.7 351 98 B H H > S+ 0 0 26 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.852 106.3 53.8 -58.5 -34.6 9.3 16.0 76.8 352 99 B L H > S+ 0 0 6 -3,-0.4 4,-2.7 2,-0.2 5,-0.3 0.856 103.7 55.2 -70.4 -33.5 10.5 13.3 74.4 353 100 B K H X S+ 0 0 40 -4,-1.5 4,-2.6 -3,-0.4 5,-0.3 0.956 110.7 47.3 -61.5 -46.3 14.1 14.4 74.7 354 101 B A H X S+ 0 0 33 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.940 115.4 42.3 -60.4 -51.3 13.8 13.9 78.4 355 102 B T H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 -1,-0.2 0.876 115.1 50.1 -68.1 -35.1 12.1 10.5 78.3 356 103 B L H X S+ 0 0 0 -4,-2.7 4,-3.5 2,-0.2 -2,-0.2 0.932 112.5 46.4 -68.7 -43.6 14.4 9.2 75.6 357 104 B K H X S+ 0 0 60 -4,-2.6 4,-2.3 -5,-0.3 5,-0.3 0.924 114.2 49.2 -62.5 -42.3 17.5 10.3 77.4 358 105 B Y H X S+ 0 0 30 -4,-2.4 4,-2.7 -5,-0.3 5,-0.2 0.952 114.1 45.7 -59.2 -49.0 16.0 8.7 80.6 359 106 B T H X S+ 0 0 1 -4,-3.0 4,-2.2 -61,-0.2 -2,-0.2 0.909 109.7 55.4 -61.0 -43.9 15.3 5.6 78.6 360 107 B W H X S+ 0 0 8 -4,-3.5 4,-0.9 1,-0.2 -1,-0.2 0.945 115.3 36.2 -55.2 -52.9 18.7 5.5 77.0 361 108 B E H < S+ 0 0 109 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.895 115.7 53.6 -71.4 -38.7 20.6 5.6 80.3 362 109 B K H < S+ 0 0 98 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.832 103.3 59.7 -65.2 -31.3 18.2 3.4 82.2 363 110 B L H X S- 0 0 1 -4,-2.2 4,-1.3 -5,-0.2 -1,-0.2 0.840 93.3-156.7 -65.5 -35.7 18.5 0.7 79.5 364 111 B G H X - 0 0 23 -4,-0.9 4,-2.5 -3,-0.4 3,-0.3 0.024 42.9 -64.4 74.2 167.0 22.2 0.3 80.0 365 112 B H H > S+ 0 0 100 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.903 139.7 52.3 -54.4 -43.1 24.4 -1.1 77.3 366 113 B E H > S+ 0 0 136 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.856 110.5 47.9 -63.0 -36.2 22.6 -4.4 77.5 367 114 B G H X S+ 0 0 8 -4,-1.3 4,-1.4 -3,-0.3 -2,-0.2 0.920 113.1 46.3 -71.6 -44.5 19.2 -2.7 77.1 368 115 B R H X S+ 0 0 21 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.868 109.9 54.4 -66.2 -37.3 20.2 -0.6 74.2 369 116 B E H X S+ 0 0 42 -4,-2.5 4,-1.0 -5,-0.3 -1,-0.2 0.843 103.3 58.1 -65.2 -31.8 21.8 -3.5 72.4 370 117 B Y H >< S+ 0 0 43 -4,-1.2 3,-0.5 1,-0.2 4,-0.4 0.915 106.8 46.4 -64.3 -42.0 18.5 -5.3 72.8 371 118 B L H >< S+ 0 0 0 -4,-1.4 3,-1.3 1,-0.2 -2,-0.2 0.886 107.4 58.8 -66.5 -37.1 16.8 -2.6 70.8 372 119 B R H 3< S+ 0 0 15 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.737 103.0 53.2 -64.5 -22.9 19.6 -2.7 68.3 373 120 B D T << S+ 0 0 60 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.543 84.0 111.1 -88.2 -8.9 18.8 -6.4 67.7 374 121 B L < - 0 0 9 -3,-1.3 -52,-0.1 -4,-0.4 -51,-0.0 -0.476 69.9-125.1 -70.3 128.8 15.1 -5.7 67.0 375 122 B P - 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