==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-FEB-12 4AH9 . COMPND 2 MOLECULE: INTEGRASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS; . AUTHOR J.WIELENS,S.J.HEADY,D.I.RHODES,R.J.MULDER,O.DOLEZAL,J.J.DEAD . 304 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14907.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 229 75.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 12.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.0 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 . 3 1.0 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 . 18 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 43.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 2 0 0 0 0 2 0 0 1 4 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 1 0 0 0 1 1 2 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 . 1 0 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 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 56 A S 0 0 117 0, 0.0 22,-0.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 34.8 21.2 -29.3 -3.1 2 57 A S > - 0 0 49 1,-0.1 3,-1.6 2,-0.1 23,-0.4 -0.328 360.0-100.7 -59.4 162.8 20.9 -30.5 0.5 3 58 A P T 3 S+ 0 0 27 0, 0.0 -1,-0.1 0, 0.0 145,-0.1 0.715 119.4 50.4 -62.8 -21.9 18.6 -28.3 2.7 4 59 A G T 3 S+ 0 0 10 51,-0.1 53,-2.2 52,-0.1 52,-2.0 0.318 85.7 110.1 -99.3 8.9 21.5 -26.5 4.4 5 60 A I E < +a 57 0A 20 -3,-1.6 19,-1.7 51,-0.2 20,-0.4 -0.738 37.6 171.9-101.8 124.8 23.5 -25.5 1.3 6 61 A W E -aB 58 23A 0 51,-2.6 53,-2.9 -2,-0.5 2,-0.4 -0.884 19.0-147.4-122.4 159.2 23.8 -21.9 0.1 7 62 A Q E -aB 59 22A 34 15,-2.9 15,-2.8 -2,-0.3 2,-0.2 -0.989 12.4-139.4-124.6 134.9 25.8 -20.1 -2.6 8 63 A L E - B 0 21A 2 51,-3.1 2,-0.3 -2,-0.4 13,-0.2 -0.617 21.7-179.2 -89.4 150.6 27.2 -16.5 -2.5 9 64 A D E - B 0 20A 11 11,-2.2 11,-3.2 -2,-0.2 2,-0.5 -0.971 11.2-161.2-150.3 129.7 26.9 -14.4 -5.7 10 65 A C E + B 0 19A 25 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.990 15.5 176.4-122.2 125.0 28.2 -10.8 -6.0 11 66 A T E - B 0 18A 11 7,-2.8 7,-3.7 -2,-0.5 2,-0.4 -0.882 18.0-139.2-126.3 155.4 26.8 -8.8 -8.9 12 67 A H E - B 0 17A 101 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.927 12.2-172.2-120.1 144.3 27.4 -5.1 -9.8 13 68 A L E > S- B 0 16A 39 3,-2.0 3,-2.1 -2,-0.4 -2,-0.0 -0.949 81.0 -21.5-140.5 115.4 24.9 -2.5 -11.0 14 69 A E T 3 S- 0 0 139 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.911 126.8 -56.0 58.1 40.1 26.3 0.9 -12.1 15 70 A G T 3 S+ 0 0 67 1,-0.2 -1,-0.3 0, 0.0 2,-0.3 0.668 111.7 121.6 64.4 9.9 29.3 0.1 -10.0 16 71 A K E < -B 13 0A 109 -3,-2.1 -3,-2.0 20,-0.0 2,-0.5 -0.760 63.6-121.2 -97.3 160.2 27.3 -0.5 -6.8 17 72 A V E -BC 12 34A 10 17,-1.0 17,-2.5 -2,-0.3 2,-0.5 -0.883 22.2-166.9-113.1 126.3 27.8 -4.0 -5.3 18 73 A I E -BC 11 33A 5 -7,-3.7 -7,-2.8 -2,-0.5 2,-0.5 -0.974 7.0-160.9-114.4 119.3 24.9 -6.4 -4.7 19 74 A L E -BC 10 32A 0 13,-2.9 13,-2.3 -2,-0.5 2,-0.4 -0.882 13.1-175.0-104.5 130.3 25.7 -9.4 -2.5 20 75 A V E -BC 9 31A 0 -11,-3.2 -11,-2.2 -2,-0.5 2,-0.4 -0.967 18.8-159.9-125.3 139.8 23.3 -12.3 -2.8 21 76 A A E -BC 8 30A 1 9,-2.7 9,-1.8 -2,-0.4 2,-0.5 -0.986 16.6-163.7-114.1 130.2 23.0 -15.7 -1.0 22 77 A V E -BC 7 29A 10 -15,-2.8 -15,-2.9 -2,-0.4 2,-0.9 -0.958 20.3-134.8-118.5 129.9 21.0 -18.3 -2.9 23 78 A H E >>> -BC 6 28A 0 5,-3.1 4,-2.9 -2,-0.5 3,-0.9 -0.811 25.2-146.4 -79.0 115.3 19.6 -21.4 -1.2 24 79 A V T 345S+ 0 0 68 -19,-1.7 -1,-0.2 -2,-0.9 -18,-0.1 0.854 87.5 48.2 -62.9 -43.1 20.7 -23.8 -3.9 25 80 A A T 345S+ 0 0 33 -20,-0.4 -1,-0.3 -23,-0.4 -19,-0.1 0.747 126.1 25.7 -67.1 -29.9 17.8 -26.3 -3.7 26 81 A S T <45S- 0 0 4 -3,-0.9 -2,-0.2 2,-0.1 -1,-0.2 0.698 91.6-127.8-108.1 -26.0 15.0 -23.8 -3.8 27 82 A G T <5 + 0 0 22 -4,-2.9 -3,-0.1 1,-0.3 113,-0.1 0.406 58.0 147.9 81.7 7.6 16.4 -20.6 -5.6 28 83 A Y E < -C 23 0A 3 -5,-0.5 -5,-3.1 112,-0.3 -1,-0.3 -0.447 28.4-166.7 -70.4 149.9 15.2 -18.5 -2.5 29 84 A I E -C 22 0A 0 -7,-0.2 2,-0.3 96,-0.2 -7,-0.2 -0.871 28.5-163.8-133.6 162.6 17.5 -15.6 -1.9 30 85 A E E +C 21 0A 9 -9,-1.8 -9,-2.7 -2,-0.3 2,-0.3 -0.970 25.6 175.3-130.5 153.6 18.5 -12.9 0.4 31 86 A A E -C 20 0A 1 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.988 14.3-171.2-155.0 161.7 20.6 -9.9 -0.8 32 87 A E E -C 19 0A 22 -13,-2.3 -13,-2.9 -2,-0.3 2,-0.5 -0.988 27.2-121.3-149.0 150.0 22.0 -6.5 0.3 33 88 A V E -C 18 0A 41 -2,-0.3 -15,-0.2 -15,-0.2 3,-0.1 -0.804 37.5-173.2 -86.3 137.5 23.7 -3.5 -1.3 34 89 A I E -C 17 0A 9 -17,-2.5 -17,-1.0 -2,-0.5 3,-0.1 -0.911 35.4-120.2-132.8 157.1 27.1 -3.1 0.2 35 90 A P S S- 0 0 110 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.883 92.5 -18.8 -67.1 -31.6 29.6 -0.4 -0.3 36 91 A A S S- 0 0 46 -20,-0.1 2,-2.0 -19,-0.1 5,-0.1 -0.958 75.5 -97.3-165.8 154.5 32.3 -2.8 -1.6 37 92 A E + 0 0 50 -2,-0.3 2,-0.2 -3,-0.1 -27,-0.0 -0.454 61.7 156.8 -83.6 77.8 32.8 -6.6 -1.4 38 93 A T > - 0 0 62 -2,-2.0 4,-2.6 1,-0.1 5,-0.2 -0.542 56.7-111.6 -94.5 166.7 35.1 -6.8 1.5 39 94 A G H > S+ 0 0 20 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.917 120.7 53.5 -54.4 -44.5 35.8 -9.7 3.9 40 95 A Q H > S+ 0 0 140 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.855 110.5 45.1 -61.7 -40.9 34.2 -7.6 6.6 41 96 A E H > S+ 0 0 52 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.902 115.7 46.6 -68.4 -44.7 31.0 -7.0 4.6 42 97 A T H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.905 111.3 51.4 -67.9 -42.0 30.8 -10.6 3.5 43 98 A A H X S+ 0 0 8 -4,-3.1 4,-2.2 -5,-0.2 -1,-0.2 0.889 111.4 47.4 -58.0 -48.1 31.3 -11.9 7.0 44 99 A Y H X S+ 0 0 23 -4,-1.7 4,-2.5 -5,-0.2 -2,-0.2 0.910 110.9 51.4 -61.9 -41.7 28.6 -9.7 8.4 45 100 A F H X S+ 0 0 8 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.932 110.6 48.9 -61.3 -42.0 26.2 -10.7 5.7 46 101 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.909 107.9 54.0 -64.9 -36.8 26.9 -14.4 6.4 47 102 A L H X S+ 0 0 9 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.941 111.2 46.7 -62.1 -44.6 26.3 -13.9 10.1 48 103 A K H X S+ 0 0 22 -4,-2.5 4,-0.7 2,-0.2 3,-0.3 0.945 112.3 48.9 -61.4 -49.1 22.9 -12.3 9.4 49 104 A L H >X S+ 0 0 2 -4,-2.6 4,-1.8 1,-0.2 3,-1.1 0.926 111.0 50.6 -57.6 -44.5 21.9 -15.1 6.9 50 105 A A H 3< S+ 0 0 1 -4,-2.6 5,-0.3 1,-0.3 -1,-0.2 0.755 105.5 54.7 -75.6 -17.5 22.9 -17.9 9.4 51 106 A G H 3< S+ 0 0 2 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.684 115.5 41.4 -80.0 -12.9 20.9 -16.4 12.2 52 107 A R H << S+ 0 0 8 -3,-1.1 -2,-0.2 -4,-0.7 -1,-0.2 0.681 124.3 20.2-106.1 -26.8 17.9 -16.4 10.0 53 108 A W S < S- 0 0 6 -4,-1.8 2,-1.7 -5,-0.1 -1,-0.3 -0.959 91.2 -94.3-138.4 160.2 18.1 -19.8 8.2 54 109 A P - 0 0 58 0, 0.0 2,-0.8 0, 0.0 -4,-0.1 -0.552 46.4-171.2 -85.1 90.3 19.9 -23.0 9.0 55 110 A V + 0 0 10 -2,-1.7 -50,-0.2 -5,-0.3 3,-0.1 -0.642 18.8 161.5 -88.1 103.9 23.1 -22.4 6.9 56 111 A K + 0 0 127 -52,-2.0 25,-3.1 -2,-0.8 2,-0.4 0.860 66.8 12.6 -89.5 -40.6 25.2 -25.6 6.9 57 112 A T E -ad 5 81A 5 -53,-2.2 -51,-2.6 23,-0.2 2,-0.5 -0.996 60.2-163.8-139.3 138.9 27.4 -24.9 4.0 58 113 A V E -ad 6 82A 0 23,-2.4 25,-2.2 -2,-0.4 2,-0.8 -0.988 13.1-147.7-125.1 129.3 28.2 -21.9 1.9 59 114 A H E -ad 7 83A 44 -53,-2.9 -51,-3.1 -2,-0.5 26,-0.2 -0.803 31.0-132.8 -88.5 112.8 29.9 -22.0 -1.5 60 115 A T - 0 0 1 23,-2.5 3,-0.1 -2,-0.8 6,-0.0 -0.289 3.7-130.0 -71.0 159.4 31.8 -18.8 -1.5 61 116 A D S S+ 0 0 39 1,-0.1 2,-0.3 23,-0.1 -51,-0.1 0.662 80.1 0.8 -89.2 -19.5 31.6 -16.5 -4.5 62 117 A N S > S- 0 0 57 1,-0.1 4,-1.7 -53,-0.1 5,-0.1 -0.971 74.4 -99.5-159.7 172.9 35.4 -15.9 -5.1 63 118 A G H > S+ 0 0 47 -2,-0.3 4,-2.1 2,-0.2 5,-0.1 0.804 113.9 61.4 -76.7 -21.5 38.8 -16.8 -3.8 64 119 A S H > S+ 0 0 97 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.940 110.1 40.5 -70.6 -47.2 39.3 -13.6 -1.8 65 120 A N H 4 S+ 0 0 4 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.832 113.7 55.1 -73.4 -28.8 36.2 -14.3 0.4 66 121 A F H < S+ 0 0 69 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.902 116.9 36.6 -62.8 -39.9 37.2 -18.0 0.6 67 122 A T H < S+ 0 0 97 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.838 89.2 115.3 -78.9 -34.8 40.7 -17.0 1.9 68 123 A S X - 0 0 24 -4,-2.4 4,-2.7 -5,-0.1 5,-0.2 -0.027 57.2-150.4 -48.4 124.1 39.6 -14.0 4.1 69 124 A T H > S+ 0 0 114 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.851 98.9 56.2 -66.7 -28.7 40.3 -14.6 7.8 70 125 A T H > S+ 0 0 63 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.933 109.1 44.6 -66.6 -43.2 37.3 -12.4 8.6 71 126 A V H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.931 113.5 51.2 -66.2 -42.8 34.9 -14.5 6.4 72 127 A K H X S+ 0 0 83 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.895 108.5 52.3 -61.6 -38.0 36.4 -17.7 8.0 73 128 A A H X S+ 0 0 49 -4,-2.5 4,-3.1 2,-0.2 -1,-0.2 0.890 110.6 46.7 -63.8 -39.3 35.9 -16.3 11.5 74 129 A A H X S+ 0 0 14 -4,-2.0 4,-2.8 2,-0.2 6,-0.2 0.922 111.9 51.1 -71.7 -36.8 32.2 -15.6 10.8 75 130 A C H X>S+ 0 0 3 -4,-2.5 5,-2.8 2,-0.2 4,-0.6 0.946 112.5 46.3 -64.9 -42.2 31.8 -19.0 9.3 76 131 A W H ><5S+ 0 0 192 -4,-2.7 3,-1.3 3,-0.2 -2,-0.2 0.963 113.6 49.9 -59.5 -47.3 33.4 -20.6 12.4 77 132 A W H 3<5S+ 0 0 47 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.928 116.2 39.9 -57.8 -47.8 31.2 -18.4 14.7 78 133 A A H 3<5S- 0 0 6 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.386 112.9-113.7 -89.8 7.3 28.0 -19.3 12.9 79 134 A G T <<5 + 0 0 62 -3,-1.3 2,-0.5 -4,-0.6 -3,-0.2 0.849 63.6 151.8 68.1 31.9 28.8 -23.1 12.4 80 135 A I < - 0 0 12 -5,-2.8 2,-0.7 -6,-0.2 -1,-0.2 -0.859 45.5-133.9 -96.2 132.2 29.0 -22.7 8.6 81 136 A K E -d 57 0A 127 -25,-3.1 -23,-2.4 -2,-0.5 2,-0.3 -0.761 23.8-142.1 -78.2 120.0 31.2 -25.0 6.5 82 137 A Q E +d 58 0A 32 -2,-0.7 2,-0.3 -25,-0.2 -23,-0.2 -0.586 27.8 171.4 -85.4 133.1 33.0 -22.8 4.1 83 138 A E E -d 59 0A 56 -25,-2.2 -23,-2.5 -2,-0.3 2,-0.0 -0.924 34.7-102.2-133.9 160.1 33.5 -24.3 0.7 84 139 A D - 0 0 48 -2,-0.3 -23,-0.1 -25,-0.2 -21,-0.0 -0.247 22.2-134.9 -74.2 175.2 34.7 -23.0 -2.7 85 140 A G + 0 0 28 -26,-0.2 -1,-0.1 -78,-0.1 -26,-0.1 -0.100 46.7 150.9-119.1 29.8 32.1 -22.1 -5.4 86 141 A I - 0 0 93 1,-0.1 2,-1.9 -24,-0.0 3,-0.2 -0.487 51.1-125.5 -66.5 131.2 34.0 -23.8 -8.3 87 142 A P + 0 0 52 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 -0.537 40.5 166.1 -87.9 83.9 31.3 -24.9 -10.8 88 143 A Y S S+ 0 0 180 -2,-1.9 3,-0.1 1,-0.2 -2,-0.0 0.836 80.4 53.2 -61.6 -31.7 32.0 -28.6 -11.1 89 144 A N S > S- 0 0 89 -3,-0.2 3,-2.3 1,-0.1 4,-0.3 -0.944 86.8-154.5 -99.7 111.7 28.6 -28.7 -12.7 90 145 A P T >> S+ 0 0 83 0, 0.0 3,-1.3 0, 0.0 4,-0.8 0.771 86.8 75.2 -67.2 -24.5 29.1 -26.1 -15.4 91 146 A Q H 3> S+ 0 0 145 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.762 82.0 75.0 -55.4 -22.0 25.3 -25.4 -15.5 92 147 A S H <> S+ 0 0 54 -3,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.893 90.4 52.7 -55.3 -43.4 25.9 -23.6 -12.1 93 148 A Q H <> S+ 0 0 124 -3,-1.3 4,-2.7 -4,-0.3 -1,-0.2 0.904 110.3 46.8 -65.5 -40.6 27.4 -20.5 -13.8 94 149 A G H X S+ 0 0 29 -4,-0.8 4,-2.6 2,-0.2 -1,-0.2 0.834 110.0 53.2 -70.4 -31.9 24.5 -20.1 -16.2 95 150 A V H X S+ 0 0 100 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.952 113.3 43.5 -69.7 -44.5 21.9 -20.4 -13.4 96 151 A I H X S+ 0 0 37 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.938 113.3 51.6 -65.5 -44.7 23.7 -17.7 -11.4 97 152 A E H X S+ 0 0 125 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.927 110.6 49.1 -57.9 -46.1 24.1 -15.5 -14.5 98 153 A S H X S+ 0 0 74 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.903 109.9 50.9 -63.4 -41.8 20.4 -15.8 -15.3 99 154 A M H X S+ 0 0 17 -4,-2.2 4,-3.3 2,-0.2 5,-0.2 0.930 109.5 50.7 -59.1 -42.6 19.4 -14.9 -11.7 100 155 A N H X S+ 0 0 21 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.892 111.2 48.1 -66.7 -41.0 21.6 -11.8 -11.8 101 156 A K H X S+ 0 0 149 -4,-2.3 4,-2.0 -5,-0.2 -1,-0.2 0.942 112.6 48.6 -62.6 -39.5 20.0 -10.7 -15.0 102 157 A E H X S+ 0 0 46 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.933 111.7 50.5 -64.3 -49.8 16.5 -11.4 -13.6 103 158 A L H X S+ 0 0 8 -4,-3.3 4,-2.6 1,-0.2 -1,-0.2 0.944 110.1 48.9 -57.8 -43.2 17.4 -9.4 -10.5 104 159 A K H X S+ 0 0 70 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.886 108.8 53.9 -65.2 -30.8 18.6 -6.5 -12.5 105 160 A K H X S+ 0 0 145 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.911 109.1 47.7 -68.3 -41.9 15.5 -6.5 -14.6 106 161 A I H X S+ 0 0 7 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.933 107.9 55.7 -67.0 -40.8 13.3 -6.3 -11.6 107 162 A I H >< S+ 0 0 13 -4,-2.6 3,-0.6 1,-0.3 -1,-0.2 0.932 108.7 48.4 -55.2 -45.0 15.4 -3.5 -10.2 108 163 A G H >< S+ 0 0 19 -4,-2.1 3,-1.4 1,-0.2 -1,-0.3 0.909 105.7 56.9 -59.0 -39.2 14.8 -1.6 -13.4 109 164 A Q H 3< S+ 0 0 115 -4,-2.2 3,-0.3 1,-0.2 -1,-0.2 0.638 108.2 49.4 -68.1 -21.4 11.0 -2.3 -13.2 110 165 A V T XX S+ 0 0 4 -4,-1.4 3,-2.4 -3,-0.6 4,-1.8 0.325 76.6 105.0-101.0 16.5 10.9 -0.6 -9.7 111 166 A R T <4 S+ 0 0 197 -3,-1.4 -1,-0.1 1,-0.3 -2,-0.1 0.732 75.0 57.4 -74.8 -16.0 12.8 2.5 -10.6 112 167 A D T 34 S+ 0 0 131 -3,-0.3 -1,-0.3 -4,-0.2 3,-0.1 0.398 115.7 41.0 -82.1 2.2 9.7 4.7 -10.6 113 168 A Q T <4 S+ 0 0 86 -3,-2.4 2,-0.5 1,-0.2 -2,-0.2 0.719 102.9 59.0-123.2 -34.0 9.2 3.5 -7.0 114 169 A A < - 0 0 16 -4,-1.8 -1,-0.2 1,-0.2 3,-0.0 -0.911 51.2-165.0-111.1 128.5 12.4 3.4 -5.1 115 170 A E S S+ 0 0 175 -2,-0.5 2,-0.3 -3,-0.1 -1,-0.2 0.862 80.0 45.5 -71.6 -39.2 14.6 6.5 -4.6 116 171 A H S >> S- 0 0 109 1,-0.1 4,-1.6 0, 0.0 3,-0.5 -0.817 81.2-126.7-109.8 145.1 17.7 4.4 -3.4 117 172 A L H 3> S+ 0 0 29 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.840 106.8 65.7 -53.3 -41.5 19.1 1.2 -4.9 118 173 A K H 3> S+ 0 0 96 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.927 102.4 47.1 -57.9 -33.9 18.9 -0.5 -1.6 119 174 A T H <> S+ 0 0 35 -3,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.930 110.6 51.5 -67.5 -44.9 15.1 -0.4 -1.6 120 175 A A H X S+ 0 0 6 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.881 107.9 52.7 -59.8 -40.0 14.9 -1.6 -5.2 121 176 A V H X S+ 0 0 3 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.929 110.6 47.0 -62.4 -40.5 17.1 -4.6 -4.3 122 177 A Q H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.830 110.5 52.3 -71.8 -31.2 14.8 -5.5 -1.4 123 178 A M H X S+ 0 0 14 -4,-2.4 4,-2.9 2,-0.2 -1,-0.2 0.909 111.0 49.2 -62.5 -40.1 11.8 -5.1 -3.7 124 179 A A H X S+ 0 0 2 -4,-2.3 4,-3.2 2,-0.2 -2,-0.2 0.890 108.1 51.3 -64.1 -41.1 13.6 -7.5 -6.1 125 180 A V H X S+ 0 0 1 -4,-2.1 4,-2.7 2,-0.2 -96,-0.2 0.933 112.4 49.3 -61.0 -44.5 14.3 -10.0 -3.4 126 181 A F H X S+ 0 0 30 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.958 113.3 43.3 -59.9 -49.7 10.6 -9.9 -2.5 127 182 A I H X S+ 0 0 57 -4,-2.9 4,-1.3 1,-0.2 3,-0.3 0.942 115.5 50.8 -66.9 -40.7 9.4 -10.3 -6.1 128 183 A H H < S+ 0 0 28 -4,-3.2 12,-0.5 1,-0.2 3,-0.5 0.919 113.2 44.4 -55.7 -50.0 12.0 -13.2 -6.7 129 184 A N H < S+ 0 0 3 -4,-2.7 12,-2.2 1,-0.2 13,-0.3 0.747 117.6 43.3 -74.4 -23.7 11.1 -15.1 -3.6 130 185 A H H < S+ 0 0 74 -4,-1.7 -1,-0.2 -3,-0.3 2,-0.2 0.553 83.8 116.7 -97.2 -9.2 7.3 -14.8 -4.1 131 186 A K < - 0 0 129 -4,-1.3 9,-0.5 -3,-0.5 2,-0.4 -0.385 65.6-129.8 -63.7 126.0 7.3 -15.5 -7.9 132 187 A R E -E 139 0B 150 -2,-0.2 2,-0.5 7,-0.2 7,-0.2 -0.646 33.6-105.7 -78.0 130.0 5.4 -18.7 -8.7 133 188 A K E E 138 0B 136 5,-2.0 5,-0.5 -2,-0.4 4,-0.3 -0.890 360.0 360.0-112.4 117.0 7.4 -21.0 -11.0 134 189 A G 0 0 115 -2,-0.5 3,-0.1 3,-0.2 -2,-0.0 0.332 360.0 360.0-120.6 360.0 6.5 -21.1 -13.7 135 ! 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 0.0 136 192 A G 0 0 94 0, 0.0 -2,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -87.4 3.8 -26.3 -8.9 137 193 A G + 0 0 33 -4,-0.3 2,-0.2 1,-0.2 -3,-0.2 0.319 360.0 147.1 -77.7 102.8 3.5 -23.5 -9.2 138 194 A Y E -E 133 0B 111 -5,-0.5 -5,-2.0 -6,-0.1 -1,-0.2 -0.654 41.8-126.6 -86.6 154.7 5.3 -23.0 -5.9 139 195 A S E > -E 132 0B 10 -2,-0.2 4,-2.4 -7,-0.2 5,-0.2 -0.502 26.5-105.4 -93.9 168.7 7.5 -20.0 -5.2 140 196 A A H > S+ 0 0 1 -9,-0.5 4,-2.2 -12,-0.5 -112,-0.3 0.851 122.2 55.0 -57.0 -39.0 11.1 -20.1 -4.0 141 197 A G H > S+ 0 0 20 -12,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.866 109.5 46.8 -64.6 -40.9 9.9 -19.0 -0.5 142 198 A E H > S+ 0 0 37 -13,-0.3 4,-2.3 1,-0.2 -2,-0.2 0.918 112.0 50.1 -65.2 -43.2 7.5 -21.9 -0.4 143 199 A R H X S+ 0 0 59 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.858 108.3 51.5 -68.3 -38.2 10.1 -24.4 -1.6 144 200 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.952 112.5 45.6 -66.7 -42.3 12.7 -23.4 1.0 145 201 A V H X S+ 0 0 4 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.929 114.9 48.6 -60.4 -47.0 10.3 -23.7 3.9 146 202 A D H X S+ 0 0 65 -4,-2.3 4,-2.8 2,-0.2 5,-0.3 0.909 113.2 48.4 -58.7 -45.7 9.0 -27.2 2.5 147 203 A I H X S+ 0 0 42 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.946 115.1 41.8 -64.6 -47.0 12.6 -28.4 2.0 148 204 A I H X S+ 0 0 8 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.916 115.1 50.8 -70.5 -39.2 13.8 -27.4 5.4 149 205 A A H X S+ 0 0 4 -4,-2.7 4,-2.3 -5,-0.3 5,-0.2 0.922 108.1 52.1 -65.1 -40.1 10.6 -28.6 7.2 150 206 A T H X S+ 0 0 76 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.939 110.1 52.0 -60.9 -36.8 10.8 -32.0 5.4 151 207 A D H X S+ 0 0 63 -4,-2.0 4,-1.8 -5,-0.3 -2,-0.2 0.900 107.5 49.4 -64.6 -44.4 14.4 -32.1 6.8 152 208 A I H < S+ 0 0 32 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.909 109.5 52.3 -59.7 -43.4 13.4 -31.4 10.4 153 209 A Q H < S+ 0 0 101 -4,-2.3 -2,-0.2 -5,-0.1 -1,-0.2 0.754 121.9 31.3 -68.9 -26.9 10.7 -34.1 10.3 154 210 A T H < 0 0 110 -4,-1.6 -2,-0.2 -5,-0.2 -3,-0.2 0.905 360.0 360.0 -87.9 -68.5 13.2 -36.7 9.0 155 211 A K < 0 0 104 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.1 -0.590 360.0 360.0 -87.4 360.0 16.7 -35.8 10.5 156 !* 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 0.0 157 56 B S 0 0 87 0, 0.0 22,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 152.2 -1.0 -17.3 16.5 158 57 B S > - 0 0 52 1,-0.1 3,-1.6 2,-0.1 23,-0.4 -0.265 360.0-110.6 -64.5 157.1 -1.6 -17.6 12.8 159 58 B P T 3 S+ 0 0 25 0, 0.0 -1,-0.1 0, 0.0 143,-0.1 0.708 114.4 50.8 -64.8 -20.3 1.5 -18.5 10.6 160 59 B G T 3 S+ 0 0 8 51,-0.1 53,-2.3 19,-0.0 52,-2.0 0.304 83.9 109.5 -98.5 6.1 1.6 -15.0 8.9 161 60 B I E < +f 213 0C 33 -3,-1.6 19,-1.8 51,-0.2 20,-0.5 -0.761 38.8 173.9 -99.7 126.0 1.4 -12.7 12.1 162 61 B W E -fG 214 179C 2 51,-2.7 53,-2.8 -2,-0.6 2,-0.4 -0.836 18.0-148.3-122.2 157.3 4.4 -10.7 13.2 163 62 B Q E -fG 215 178C 38 15,-2.6 15,-3.0 -2,-0.3 2,-0.2 -0.997 12.2-139.7-123.6 132.9 5.0 -8.1 16.0 164 63 B L E - G 0 177C 2 51,-3.1 2,-0.3 -2,-0.4 13,-0.2 -0.604 21.3-178.9 -89.2 147.8 7.4 -5.1 15.8 165 64 B D E - G 0 176C 11 11,-2.4 11,-3.1 -2,-0.2 2,-0.5 -0.968 10.3-162.7-144.1 131.9 9.3 -4.3 19.0 166 65 B C E + G 0 175C 26 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.979 15.1 175.0-123.0 126.5 11.8 -1.4 19.3 167 66 B T E - G 0 174C 12 7,-2.5 7,-3.7 -2,-0.5 2,-0.3 -0.895 19.4-136.1-127.3 157.1 14.3 -1.5 22.2 168 67 B H E + G 0 173C 100 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.907 19.2 175.3-118.2 143.4 17.2 0.8 23.1 169 68 B L E > S- G 0 172C 44 3,-2.3 3,-2.1 -2,-0.3 -2,-0.0 -0.937 80.9 -6.5-146.6 121.8 20.7 0.0 24.3 170 69 B E T 3 S- 0 0 132 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.865 125.7 -66.5 72.7 26.1 23.3 2.8 24.8 171 70 B G T 3 S+ 0 0 69 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.785 112.4 123.2 48.7 23.2 20.8 5.1 23.3 172 71 B K E < -G 169 0C 99 -3,-2.1 -3,-2.3 20,-0.0 2,-0.4 -0.823 63.0-121.7-101.4 161.8 21.2 3.1 20.0 173 72 B V E -GH 168 190C 9 17,-1.2 17,-2.6 -2,-0.3 2,-0.5 -0.877 20.9-165.4-112.6 130.9 18.0 1.7 18.6 174 73 B I E -GH 167 189C 6 -7,-3.7 -7,-2.5 -2,-0.4 2,-0.4 -0.968 7.7-159.3-115.7 125.6 17.3 -2.0 17.9 175 74 B L E -GH 166 188C 0 13,-2.9 13,-2.4 -2,-0.5 2,-0.4 -0.876 13.3-173.5-106.2 131.7 14.3 -2.8 15.8 176 75 B V E -GH 165 187C 0 -11,-3.1 -11,-2.4 -2,-0.4 2,-0.5 -0.961 17.3-159.7-125.2 140.2 12.9 -6.4 16.1 177 76 B A E -GH 164 186C 0 9,-2.7 9,-1.9 -2,-0.4 2,-0.5 -0.990 16.2-161.9-115.2 131.4 10.2 -8.3 14.3 178 77 B V E -GH 163 185C 12 -15,-3.0 -15,-2.6 -2,-0.5 2,-0.8 -0.951 19.9-135.8-117.1 130.8 8.9 -11.3 16.1 179 78 B H E >> -G 162 0C 0 5,-2.9 4,-2.9 -2,-0.5 3,-0.5 -0.775 25.5-148.0 -82.8 110.2 7.0 -14.1 14.5 180 79 B V T 34 S+ 0 0 71 -19,-1.8 -1,-0.2 -2,-0.8 -18,-0.1 0.886 86.6 47.9 -60.2 -42.0 4.4 -14.4 17.2 181 80 B A T 34 S+ 0 0 36 -20,-0.5 -1,-0.2 -23,-0.4 -19,-0.1 0.819 125.9 26.3 -69.3 -28.3 3.6 -18.2 17.0 182 81 B S T <4 S- 0 0 3 -3,-0.5 -1,-0.2 2,-0.1 -2,-0.2 0.698 92.5-126.8-105.9 -25.5 7.2 -19.3 17.0 183 82 B G < + 0 0 22 -4,-2.9 111,-0.1 1,-0.3 -3,-0.1 0.433 58.4 148.5 80.2 6.6 9.3 -16.5 18.9 184 83 B Y - 0 0 3 -5,-0.4 -5,-2.9 110,-0.3 2,-0.3 -0.426 27.6-167.1 -67.1 148.4 11.6 -16.4 15.8 185 84 B I E -H 178 0C 0 -7,-0.2 2,-0.3 96,-0.2 -7,-0.2 -0.890 28.0-164.5-134.2 159.3 13.1 -12.9 15.3 186 85 B E E +H 177 0C 9 -9,-1.9 -9,-2.7 -2,-0.3 2,-0.3 -0.966 26.0 175.9-127.3 152.5 14.9 -10.7 12.8 187 86 B A E -H 176 0C 1 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.986 14.1-171.1-153.9 159.0 16.5 -7.5 14.2 188 87 B E E -H 175 0C 21 -13,-2.4 -13,-2.9 -2,-0.3 2,-0.5 -0.990 26.3-121.7-146.8 150.5 18.6 -4.6 13.1 189 88 B V E -H 174 0C 38 -2,-0.3 -15,-0.2 -15,-0.2 3,-0.1 -0.786 37.4-174.0 -86.0 135.0 20.4 -1.6 14.7 190 89 B I E -H 173 0C 10 -17,-2.6 -17,-1.2 -2,-0.5 3,-0.1 -0.912 36.5-120.1-130.0 161.0 19.1 1.6 13.2 191 90 B P S S- 0 0 108 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.930 92.7 -20.4 -70.3 -35.7 20.2 5.1 13.7 192 91 B A S S- 0 0 47 -20,-0.1 2,-1.9 -3,-0.1 5,-0.1 -0.966 74.3 -97.1-164.6 155.0 16.7 6.2 15.0 193 92 B E + 0 0 52 -2,-0.3 2,-0.2 -3,-0.1 28,-0.0 -0.498 60.7 156.9 -83.0 80.3 13.2 4.7 14.7 194 93 B T > - 0 0 63 -2,-1.9 4,-2.5 1,-0.1 5,-0.2 -0.528 56.4-110.1 -95.4 165.6 11.9 6.7 11.8 195 94 B G H > S+ 0 0 19 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.922 120.2 53.1 -55.6 -44.1 9.0 5.8 9.4 196 95 B Q H > S+ 0 0 150 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.906 110.8 44.9 -62.4 -43.4 11.6 5.4 6.6 197 96 B E H > S+ 0 0 53 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.918 115.3 47.5 -69.4 -38.8 13.7 3.0 8.7 198 97 B T H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.913 111.4 51.4 -67.5 -44.2 10.7 1.0 9.8 199 98 B A H X S+ 0 0 10 -4,-3.2 4,-2.3 -5,-0.2 -1,-0.2 0.906 111.2 46.7 -55.5 -48.3 9.3 0.8 6.3 200 99 B Y H X S+ 0 0 30 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.909 110.5 53.2 -60.5 -41.1 12.6 -0.5 4.9 201 100 B F H X S+ 0 0 7 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.924 110.8 47.1 -59.6 -46.9 12.9 -3.0 7.7 202 101 B L H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.895 108.1 54.9 -65.6 -36.4 9.4 -4.3 6.9 203 102 B L H X S+ 0 0 9 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.941 111.4 45.6 -61.9 -42.4 10.1 -4.5 3.2 204 103 B K H X S+ 0 0 19 -4,-2.5 4,-0.8 1,-0.2 3,-0.4 0.942 112.3 49.7 -64.0 -46.2 13.1 -6.7 4.0 205 104 B L H >X S+ 0 0 2 -4,-2.4 4,-1.8 1,-0.2 3,-1.1 0.922 110.8 50.1 -56.6 -47.3 11.2 -8.9 6.4 206 105 B A H 3< S+ 0 0 1 -4,-2.5 5,-0.3 1,-0.3 -1,-0.2 0.748 105.8 55.1 -73.9 -17.9 8.4 -9.5 4.0 207 106 B G H 3< S+ 0 0 1 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.706 115.5 41.2 -78.0 -15.8 10.7 -10.5 1.1 208 107 B R H << S+ 0 0 8 -3,-1.1 -2,-0.2 -4,-0.8 -1,-0.1 0.689 124.6 20.7-102.9 -28.8 12.2 -13.2 3.4 209 108 B W S < S- 0 0 6 -4,-1.8 2,-1.7 -5,-0.1 -1,-0.2 -0.961 89.9 -95.5-141.3 156.2 9.1 -14.6 5.1 210 109 B P - 0 0 58 0, 0.0 2,-0.8 0, 0.0 -4,-0.1 -0.529 46.6-172.3 -82.1 92.4 5.4 -14.6 4.3 211 110 B V + 0 0 10 -2,-1.7 -50,-0.2 -5,-0.3 3,-0.1 -0.665 17.4 162.8 -93.5 104.8 4.3 -11.6 6.4 212 111 B K + 0 0 126 -52,-2.0 25,-3.1 -2,-0.8 2,-0.4 0.847 66.1 12.5 -87.5 -40.7 0.6 -11.3 6.4 213 112 B T E -fi 161 237C 6 -53,-2.3 -51,-2.7 23,-0.2 2,-0.4 -0.998 60.5-161.2-137.3 141.4 -0.0 -9.0 9.3 214 113 B V E -fi 162 238C 1 23,-2.5 25,-2.3 -2,-0.4 2,-0.7 -0.989 12.1-148.3-121.8 129.3 2.2 -6.9 11.4 215 114 B H E -fi 163 239C 43 -53,-2.8 -51,-3.1 -2,-0.4 26,-0.2 -0.802 31.9-134.2 -86.2 113.0 1.3 -5.5 14.8 216 115 B T - 0 0 1 23,-2.6 3,-0.1 -2,-0.7 6,-0.0 -0.360 3.9-128.9 -77.1 155.8 3.2 -2.2 14.8 217 116 B D S S+ 0 0 40 1,-0.1 2,-0.3 23,-0.1 -51,-0.1 0.686 80.5 1.1 -84.1 -18.7 5.2 -1.3 17.8 218 117 B N S > S- 0 0 57 -53,-0.1 4,-1.8 1,-0.0 5,-0.1 -0.959 74.4 -99.8-161.3 172.7 3.8 2.3 18.4 219 118 B G H > S+ 0 0 47 -2,-0.3 4,-2.2 2,-0.2 5,-0.1 0.759 115.2 61.2 -74.9 -25.1 1.3 4.8 17.1 220 119 B S H > S+ 0 0 96 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.961 110.0 41.0 -66.5 -50.6 3.9 6.8 15.1 221 120 B N H 4 S+ 0 0 4 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.857 114.3 53.5 -66.2 -33.0 4.7 3.7 13.0 222 121 B F H < S+ 0 0 70 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.894 116.6 38.7 -63.9 -41.0 1.0 2.8 12.7 223 122 B T H < S+ 0 0 94 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.814 88.0 112.6 -74.2 -38.3 0.3 6.3 11.5 224 123 B S X - 0 0 23 -4,-2.4 4,-2.8 1,-0.2 5,-0.1 -0.090 56.5-152.1 -48.5 125.9 3.3 6.9 9.2 225 124 B T H > S+ 0 0 111 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.795 98.5 57.6 -70.1 -24.8 2.5 7.1 5.5 226 125 B T H > S+ 0 0 51 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.935 110.2 43.3 -69.3 -43.2 6.0 5.7 4.7 227 126 B V H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.936 114.2 50.2 -66.9 -39.4 5.2 2.6 6.8 228 127 B K H X S+ 0 0 86 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.894 108.9 52.8 -65.7 -35.9 1.7 2.3 5.4 229 128 B A H X S+ 0 0 52 -4,-2.3 4,-3.1 1,-0.2 -1,-0.2 0.904 110.6 46.7 -64.8 -40.2 3.2 2.6 1.8 230 129 B A H X S+ 0 0 14 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.909 112.2 50.6 -68.8 -39.5 5.7 -0.3 2.5 231 130 B C H X>S+ 0 0 4 -4,-2.4 5,-2.9 2,-0.2 4,-0.5 0.936 112.3 46.9 -65.4 -41.5 2.9 -2.4 4.0 232 131 B W H ><5S+ 0 0 191 -4,-2.6 3,-1.3 -5,-0.2 -2,-0.2 0.958 113.3 48.7 -61.2 -44.7 0.8 -1.7 0.9 233 132 B W H 3<5S+ 0 0 47 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.928 116.3 41.7 -63.1 -42.1 3.7 -2.6 -1.4 234 133 B A H 3<5S- 0 0 7 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.361 112.5-115.4 -89.9 6.6 4.6 -5.8 0.4 235 134 B G T <<5 + 0 0 60 -3,-1.3 2,-0.5 -4,-0.5 -3,-0.2 0.872 62.9 151.1 66.0 33.9 0.9 -6.9 0.9 236 135 B I < - 0 0 12 -5,-2.9 2,-0.6 -6,-0.2 -1,-0.2 -0.889 46.1-131.9-100.0 136.0 1.1 -6.7 4.7 237 136 B K E -i 213 0C 128 -25,-3.1 -23,-2.5 -2,-0.5 2,-0.3 -0.744 24.2-141.8 -82.2 121.6 -2.0 -5.9 6.8 238 137 B Q E +i 214 0C 33 -2,-0.6 2,-0.3 -25,-0.2 -23,-0.2 -0.598 27.9 172.2 -85.1 132.2 -1.0 -3.2 9.2 239 138 B E E -i 215 0C 56 -25,-2.3 -23,-2.6 -2,-0.3 -26,-0.0 -0.947 34.7-101.2-134.2 160.4 -2.4 -3.5 12.6 240 139 B D - 0 0 48 -2,-0.3 -23,-0.1 -25,-0.2 -21,-0.0 -0.212 22.9-135.5 -69.9 174.4 -2.0 -1.8 15.9 241 140 B G + 0 0 27 -26,-0.2 -1,-0.1 -78,-0.1 -26,-0.1 -0.040 46.0 151.8-121.2 31.5 0.1 -3.6 18.6 242 141 B I - 0 0 91 1,-0.1 2,-2.2 2,-0.0 3,-0.2 -0.448 51.3-125.2 -66.3 127.9 -2.3 -2.9 21.6 243 142 B P + 0 0 57 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 -0.497 40.6 166.6 -81.3 77.5 -1.8 -5.7 24.1 244 143 B Y S S+ 0 0 179 -2,-2.2 3,-0.1 1,-0.2 -2,-0.0 0.809 80.4 51.8 -54.3 -28.9 -5.4 -6.9 24.3 245 144 B N S > S- 0 0 89 -3,-0.2 3,-2.1 1,-0.1 4,-0.4 -0.960 86.7-154.4-108.3 112.9 -3.9 -9.8 26.0 246 145 B P T >> S+ 0 0 79 0, 0.0 3,-1.0 0, 0.0 4,-0.8 0.740 86.4 74.5 -69.4 -19.9 -1.7 -8.2 28.7 247 146 B Q H 3> S+ 0 0 144 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.756 83.5 71.7 -63.8 -18.8 0.7 -11.2 28.8 248 147 B S H <> S+ 0 0 57 -3,-2.1 4,-2.3 1,-0.2 5,-0.3 0.884 90.9 56.1 -56.7 -44.5 2.0 -9.8 25.5 249 148 B Q H <> S+ 0 0 127 -3,-1.0 4,-2.6 -4,-0.4 -1,-0.2 0.915 110.8 45.7 -55.2 -46.1 3.7 -6.8 27.2 250 149 B G H X S+ 0 0 27 -4,-0.8 4,-2.4 2,-0.2 -1,-0.2 0.849 108.8 53.2 -69.9 -37.6 5.6 -9.2 29.4 251 150 B V H X S+ 0 0 101 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.930 113.0 45.0 -66.6 -40.2 6.7 -11.7 26.7 252 151 B I H X S+ 0 0 35 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.928 111.8 52.5 -71.8 -43.3 8.2 -8.8 24.7 253 152 B E H X S+ 0 0 128 -4,-2.6 4,-2.4 -5,-0.3 -1,-0.2 0.934 110.8 47.4 -52.2 -49.5 9.9 -7.3 27.8 254 153 B S H X S+ 0 0 67 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.878 109.9 51.9 -63.4 -42.4 11.5 -10.6 28.6 255 154 B M H X S+ 0 0 14 -4,-2.1 4,-3.3 -5,-0.2 5,-0.2 0.942 110.0 50.5 -60.9 -41.3 12.7 -11.1 25.0 256 155 B N H X S+ 0 0 22 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.915 111.3 47.6 -65.0 -42.7 14.3 -7.6 25.1 257 156 B K H X S+ 0 0 125 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.933 112.9 48.3 -60.4 -36.6 16.0 -8.4 28.3 258 157 B E H X S+ 0 0 55 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.939 111.5 51.0 -71.6 -45.5 17.2 -11.8 26.9 259 158 B L H X S+ 0 0 8 -4,-3.3 4,-2.4 1,-0.2 -1,-0.2 0.937 110.9 47.5 -57.9 -43.4 18.5 -10.1 23.8 260 159 B K H X S+ 0 0 72 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.861 108.7 54.7 -70.1 -28.1 20.4 -7.5 25.7 261 160 B K H X S+ 0 0 137 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.894 109.6 47.1 -70.2 -38.2 21.9 -10.2 27.9 262 161 B I H X S+ 0 0 10 -4,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.909 108.5 55.4 -66.9 -42.1 23.2 -12.0 24.8 263 162 B I H >< S+ 0 0 14 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.937 109.0 48.5 -55.9 -44.9 24.5 -8.8 23.5 264 163 B G H >< S+ 0 0 17 -4,-2.1 3,-1.4 1,-0.2 -1,-0.2 0.901 105.2 56.9 -59.3 -38.3 26.5 -8.4 26.7 265 164 B Q H 3< S+ 0 0 110 -4,-1.9 -1,-0.2 1,-0.2 3,-0.2 0.624 106.5 51.5 -68.8 -19.6 27.8 -11.9 26.6 266 165 B V T XX S+ 0 0 4 -4,-1.1 3,-2.2 -3,-0.8 4,-1.8 0.272 75.7 106.7-101.0 18.1 29.4 -11.2 23.1 267 166 B R T <4 S+ 0 0 203 -3,-1.4 -1,-0.1 1,-0.3 -2,-0.1 0.703 75.9 55.8 -68.9 -25.8 31.2 -7.9 24.0 268 167 B D T 34 S+ 0 0 135 -3,-0.2 -1,-0.3 -4,-0.2 3,-0.1 0.414 116.9 39.5 -79.9 -2.3 34.6 -9.6 24.0 269 168 B Q T <4 S+ 0 0 85 -3,-2.2 2,-0.5 1,-0.2 -2,-0.2 0.676 103.4 58.7-120.3 -36.1 33.8 -10.6 20.3 270 169 B A < - 0 0 16 -4,-1.8 -1,-0.2 1,-0.2 -4,-0.0 -0.942 51.6-165.9-106.6 127.8 32.0 -7.9 18.4 271 170 B E S S+ 0 0 177 -2,-0.5 2,-0.3 -3,-0.1 -1,-0.2 0.896 79.3 47.0 -73.8 -39.1 33.6 -4.5 17.9 272 171 B H S >> S- 0 0 105 1,-0.1 4,-1.6 0, 0.0 3,-0.6 -0.766 80.7-128.3-107.9 145.6 30.3 -2.9 16.7 273 172 B L H 3> S+ 0 0 23 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.845 106.8 64.7 -58.2 -39.4 26.8 -3.2 18.2 274 173 B K H 3> S+ 0 0 95 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.899 103.4 47.6 -57.4 -36.5 25.4 -4.2 14.9 275 174 B T H <> S+ 0 0 35 -3,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.941 110.7 50.9 -65.9 -40.6 27.5 -7.5 14.9 276 175 B A H X S+ 0 0 6 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.875 107.6 53.0 -63.1 -40.0 26.5 -8.2 18.5 277 176 B V H X S+ 0 0 3 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.916 110.2 47.8 -63.8 -40.2 22.7 -7.8 17.6 278 177 B Q H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.852 110.3 51.4 -73.9 -28.8 23.1 -10.3 14.7 279 178 B M H X S+ 0 0 13 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.904 111.2 50.5 -68.2 -37.2 25.0 -12.8 17.0 280 179 B A H X S+ 0 0 1 -4,-2.3 4,-3.0 2,-0.2 -2,-0.2 0.917 108.2 50.5 -65.1 -43.6 22.0 -12.3 19.5 281 180 B V H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -96,-0.2 0.931 112.2 49.2 -56.0 -46.9 19.5 -13.0 16.7 282 181 B F H X S+ 0 0 29 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.959 113.1 43.8 -56.5 -52.9 21.4 -16.2 15.8 283 182 B I H X S+ 0 0 57 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.916 115.1 51.1 -66.4 -42.2 21.6 -17.5 19.4 284 183 B H H < S+ 0 0 24 -4,-3.0 10,-0.5 1,-0.2 3,-0.4 0.925 112.5 44.7 -56.4 -47.1 17.9 -16.6 20.0 285 184 B N H < S+ 0 0 3 -4,-2.5 10,-2.3 1,-0.2 11,-0.4 0.765 118.2 42.6 -75.8 -21.2 16.7 -18.4 16.9 286 185 B H H < S+ 0 0 75 -4,-1.8 -1,-0.2 -5,-0.2 2,-0.2 0.542 83.5 116.3 -98.5 -9.8 18.8 -21.5 17.4 287 186 B K < - 0 0 134 -4,-1.2 7,-0.5 -3,-0.4 2,-0.3 -0.407 65.9-130.7 -65.6 127.9 18.2 -21.9 21.2 288 187 B R B J 293 0D 158 -2,-0.2 5,-0.2 5,-0.2 4,-0.1 -0.647 360.0 360.0 -80.4 130.4 16.4 -25.2 22.0 289 188 B K 0 0 184 3,-2.1 3,-0.3 -2,-0.3 -1,-0.1 -0.789 360.0 360.0 -96.5 360.0 13.4 -24.4 24.3 290 ! 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 0.0 291 193 B G 0 0 74 0, 0.0 2,-0.2 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 105.8 12.9 -29.3 22.5 292 194 B Y - 0 0 121 -3,-0.3 -3,-2.1 -4,-0.1 2,-0.2 -0.584 360.0-125.8 -90.4 155.1 12.6 -27.3 19.2 293 195 B S B > -J 288 0D 10 -5,-0.2 4,-2.2 -2,-0.2 -5,-0.2 -0.526 28.2-107.3 -92.9 167.2 14.2 -23.9 18.5 294 196 B A H > S+ 0 0 2 -7,-0.5 4,-2.6 -10,-0.5 -110,-0.3 0.878 122.1 55.2 -57.6 -40.3 12.3 -20.8 17.3 295 197 B G H > S+ 0 0 19 -10,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.880 109.2 46.6 -61.3 -42.6 13.9 -21.3 13.8 296 198 B E H > S+ 0 0 35 -11,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.921 112.1 51.1 -62.9 -40.4 12.6 -24.9 13.7 297 199 B R H X S+ 0 0 69 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.889 107.9 50.3 -71.1 -42.2 9.1 -23.8 14.9 298 200 B I H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.943 113.0 45.9 -65.1 -40.4 8.6 -21.1 12.4 299 201 B V H X S+ 0 0 5 -4,-1.7 4,-2.9 -5,-0.2 -2,-0.2 0.938 115.4 48.1 -62.4 -46.9 9.6 -23.3 9.4 300 202 B D H X S+ 0 0 58 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.914 113.6 48.6 -55.4 -47.4 7.3 -26.1 10.9 301 203 B I H X S+ 0 0 45 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.952 115.0 41.1 -64.2 -49.7 4.5 -23.6 11.3 302 204 B I H X S+ 0 0 7 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.914 114.5 52.3 -69.6 -35.1 4.7 -22.1 7.9 303 205 B A H X S+ 0 0 6 -4,-2.9 4,-2.2 -5,-0.3 -2,-0.2 0.915 107.4 52.3 -67.1 -40.8 5.2 -25.5 6.1 304 206 B T H < S+ 0 0 93 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.931 109.8 51.5 -56.0 -40.9 2.1 -27.0 7.9 305 207 B D H < S+ 0 0 109 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.879 107.7 50.7 -63.8 -40.7 0.3 -24.0 6.5 306 208 B I H < 0 0 45 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.909 360.0 360.0 -64.1 -44.1 1.5 -24.5 2.9 307 209 B Q < 0 0 132 -4,-2.2 0, 0.0 -5,-0.1 0, 0.0 -0.396 360.0 360.0 -71.4 360.0 0.4 -28.2 3.0