==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-JAN-07 2OPR . COMPND 2 MOLECULE: REVERSE TRANSCRIPTASE/RIBONUCLEASE H; . SOURCE 2 ORGANISM_SCIENTIFIC: HIV-1 M:B_HXB2R; . AUTHOR J.REN,C.E.NICHOLS,P.P.CHAMBERLAIN,K.L.WEAVER,S.A.SHORT, . 939 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46558.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 607 64.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 39 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 135 14.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.9 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 . 58 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 104 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 242 25.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 0.7 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 2 3 2 0 0 1 0 2 2 2 0 3 2 0 1 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 0 3 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 7 3 7 2 1 3 4 1 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 . 4 1 4 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 2 A I 0 0 221 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -52.9 11.2 -55.2 49.2 2 3 A S - 0 0 56 2,-0.2 204,-0.1 1,-0.1 109,-0.0 -0.859 360.0-113.7-122.9 159.0 10.0 -53.3 46.1 3 4 A P S S+ 0 0 65 0, 0.0 -1,-0.1 0, 0.0 203,-0.1 0.951 83.8 79.9 -52.3 -66.9 10.3 -54.0 42.3 4 5 A I S S- 0 0 22 201,-0.4 -2,-0.2 1,-0.1 152,-0.0 -0.205 76.6-121.7 -61.4 131.3 12.6 -51.3 41.0 5 6 A E - 0 0 175 1,-0.1 2,-0.1 151,-0.1 -1,-0.1 -0.283 34.6-117.2 -61.7 149.2 16.4 -51.3 41.2 6 7 A T - 0 0 26 107,-0.1 107,-0.1 105,-0.0 -1,-0.1 -0.493 20.9-119.6 -88.5 163.3 17.8 -48.3 43.1 7 8 A V - 0 0 24 105,-0.4 2,-0.6 -2,-0.1 107,-0.4 -0.888 31.0-108.8-103.7 136.1 20.1 -45.7 41.4 8 9 A P - 0 0 68 0, 0.0 2,-0.4 0, 0.0 105,-0.0 -0.501 40.5-170.3 -68.0 109.1 23.6 -45.2 42.9 9 10 A V - 0 0 11 -2,-0.6 2,-0.3 105,-0.0 581,-0.0 -0.833 6.0-175.2-108.3 139.8 23.7 -41.8 44.7 10 11 A K - 0 0 149 -2,-0.4 68,-2.0 580,-0.1 2,-0.3 -0.866 26.4-116.8-127.9 157.9 26.8 -40.0 46.0 11 12 A L B -A 77 0A 25 -2,-0.3 66,-0.2 66,-0.2 3,-0.2 -0.654 55.6 -80.1 -89.6 153.5 27.4 -36.8 48.0 12 13 A K > - 0 0 65 64,-2.5 3,-1.1 -2,-0.3 -1,-0.2 -0.190 69.5 -80.1 -49.6 143.2 29.5 -34.2 46.2 13 14 A P T 3 S+ 0 0 134 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 -0.202 114.7 6.1 -51.4 135.7 33.1 -35.2 46.5 14 15 A G T 3 S+ 0 0 89 1,-0.2 -2,-0.1 -3,-0.2 -3,-0.0 -0.069 104.9 108.3 85.6 -37.1 34.6 -34.2 49.9 15 16 A M < - 0 0 86 -3,-1.1 2,-0.3 -2,-0.4 -1,-0.2 -0.181 53.0-148.8 -71.2 168.0 31.3 -33.1 51.4 16 17 A D - 0 0 69 1,-0.1 -4,-0.1 -3,-0.1 -1,-0.1 -0.907 26.6 -64.7-137.8 165.8 29.3 -34.9 54.2 17 18 A G - 0 0 2 -2,-0.3 -1,-0.1 1,-0.1 104,-0.1 0.059 62.8 -82.5 -48.7 151.6 25.8 -35.6 55.5 18 19 A P - 0 0 0 0, 0.0 37,-0.7 0, 0.0 -1,-0.1 -0.065 33.4-171.1 -55.0 153.4 23.5 -32.9 57.0 19 20 A K B +b 55 0B 117 35,-0.3 2,-0.3 2,-0.0 37,-0.1 -0.452 27.0 149.0-145.8 61.1 23.8 -31.9 60.6 20 21 A V - 0 0 49 35,-2.2 2,-0.4 1,-0.0 0, 0.0 -0.724 44.6-117.1-101.7 153.7 20.9 -29.7 61.4 21 22 A K - 0 0 182 -2,-0.3 2,-0.5 36,-0.1 -2,-0.0 -0.725 26.3-118.0 -91.1 133.6 19.1 -29.3 64.7 22 23 A Q - 0 0 37 -2,-0.4 3,-0.1 35,-0.1 37,-0.1 -0.588 32.9-123.5 -73.3 116.5 15.4 -30.3 65.1 23 24 A W - 0 0 154 -2,-0.5 2,-0.3 35,-0.2 35,-0.1 0.017 29.2-100.7 -52.0 163.1 13.3 -27.3 66.1 24 25 A P - 0 0 114 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.705 45.9-161.7 -87.5 146.4 11.3 -27.5 69.3 25 26 A L - 0 0 26 102,-0.4 102,-0.1 -2,-0.3 34,-0.0 -0.956 20.5 -98.7-132.1 150.9 7.6 -28.3 68.5 26 27 A T > - 0 0 75 -2,-0.3 4,-2.2 1,-0.1 3,-0.3 -0.135 38.6-109.2 -60.5 159.2 4.3 -28.0 70.3 27 28 A E H > S+ 0 0 122 1,-0.2 4,-1.3 2,-0.2 -1,-0.1 0.767 119.6 48.4 -62.3 -26.9 2.8 -31.1 72.0 28 29 A E H > S+ 0 0 119 2,-0.2 4,-1.3 1,-0.1 -1,-0.2 0.733 109.3 50.5 -87.2 -23.6 0.1 -31.2 69.3 29 30 A K H > S+ 0 0 60 -3,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.875 110.4 51.6 -77.1 -38.0 2.4 -30.9 66.4 30 31 A I H X S+ 0 0 13 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.920 108.3 50.1 -62.4 -47.5 4.6 -33.7 67.8 31 32 A K H X S+ 0 0 145 -4,-1.3 4,-2.3 1,-0.2 -1,-0.2 0.912 108.3 53.8 -58.0 -45.2 1.6 -36.1 68.2 32 33 A A H X S+ 0 0 9 -4,-1.3 4,-1.8 1,-0.2 -1,-0.2 0.918 113.7 41.8 -55.2 -47.7 0.5 -35.4 64.6 33 34 A L H X S+ 0 0 0 -4,-1.9 4,-3.3 2,-0.2 5,-0.3 0.900 109.0 57.8 -67.6 -45.2 4.0 -36.3 63.3 34 35 A V H X S+ 0 0 55 -4,-2.9 4,-0.7 1,-0.2 -1,-0.2 0.913 110.4 45.9 -51.4 -44.1 4.4 -39.3 65.6 35 36 A E H X S+ 0 0 125 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.876 113.4 47.4 -68.1 -41.6 1.3 -40.7 64.0 36 37 A I H X S+ 0 0 36 -4,-1.8 4,-3.0 1,-0.2 5,-0.3 0.916 110.8 51.6 -66.3 -44.8 2.3 -39.9 60.4 37 38 A C H X S+ 0 0 0 -4,-3.3 4,-1.4 1,-0.2 -1,-0.2 0.693 106.7 55.3 -67.1 -17.8 5.7 -41.4 60.9 38 39 A T H X S+ 0 0 65 -4,-0.7 4,-2.9 -5,-0.3 -1,-0.2 0.923 111.0 43.1 -79.0 -45.3 4.1 -44.5 62.3 39 40 A E H X S+ 0 0 89 -4,-1.6 4,-2.9 2,-0.2 5,-0.4 0.975 115.1 48.6 -61.1 -58.2 1.9 -45.0 59.2 40 41 A M H X>S+ 0 0 14 -4,-3.0 5,-1.4 1,-0.3 4,-1.0 0.927 111.2 52.1 -49.1 -46.5 4.8 -44.2 56.9 41 42 A E H ><5S+ 0 0 56 -4,-1.4 3,-1.0 -5,-0.3 -1,-0.3 0.952 111.8 46.3 -54.0 -51.4 6.9 -46.7 58.9 42 43 A K H 3<5S+ 0 0 158 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.982 109.1 51.9 -52.2 -66.9 4.2 -49.2 58.4 43 44 A E H 3<5S- 0 0 115 -4,-2.9 -1,-0.3 1,-0.2 -2,-0.2 0.616 117.2-118.5 -48.0 -13.7 3.7 -48.6 54.7 44 45 A G T <<5S+ 0 0 39 -3,-1.0 -3,-0.2 -4,-1.0 -1,-0.2 0.436 81.3 119.8 89.6 0.3 7.5 -49.1 54.6 45 46 A K S + 0 0 3 -2,-0.9 4,-3.1 75,-0.3 5,-0.3 0.427 38.6 118.5 -90.3 -0.4 16.4 -31.1 52.8 71 78 A R H > S+ 0 0 155 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.754 83.1 42.8 -36.1 -38.5 17.9 -27.8 51.6 72 79 A E H > S+ 0 0 52 -3,-0.4 4,-1.3 2,-0.2 -1,-0.3 0.919 112.1 51.2 -76.8 -48.1 21.2 -28.8 53.3 73 80 A L H >> S+ 0 0 0 -3,-0.3 3,-1.5 -4,-0.2 4,-0.8 0.968 111.4 50.3 -51.8 -53.1 21.1 -32.3 52.2 74 81 A N H >< S+ 0 0 37 -4,-3.1 3,-2.1 1,-0.3 -1,-0.2 0.919 102.9 57.5 -50.7 -52.6 20.6 -31.0 48.7 75 82 A K H 3< S+ 0 0 130 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.784 114.1 42.2 -50.7 -26.8 23.4 -28.6 48.9 76 83 A R H << S+ 0 0 51 -3,-1.5 -64,-2.5 -4,-1.3 2,-0.3 0.497 93.9 105.0 -99.5 -5.6 25.5 -31.7 49.6 77 84 A T B << S-A 11 0A 0 -3,-2.1 -66,-0.2 -4,-0.8 3,-0.1 -0.608 77.9-104.4 -84.7 136.0 23.9 -34.0 47.0 78 85 A Q - 0 0 24 -68,-2.0 2,-0.2 -2,-0.3 -1,-0.1 0.041 42.0 -99.9 -47.4 157.5 25.7 -34.9 43.8 79 86 A D - 0 0 76 511,-0.1 2,-0.2 -68,-0.1 -1,-0.1 -0.548 41.7-158.5 -80.9 152.9 24.5 -33.2 40.6 80 87 A F - 0 0 23 -2,-0.2 2,-1.2 512,-0.1 510,-0.2 -0.628 34.8 -80.8-120.8-179.8 22.2 -35.2 38.4 81 88 A W - 0 0 77 508,-1.9 3,-0.1 -2,-0.2 512,-0.1 -0.761 64.4-117.3 -86.3 100.2 21.2 -35.1 34.8 82 89 A E - 0 0 151 -2,-1.2 2,-0.6 510,-0.2 -1,-0.1 0.024 15.3-114.4 -46.1 137.2 18.6 -32.4 35.0 83 90 A V - 0 0 48 1,-0.1 -1,-0.1 2,-0.1 68,-0.1 -0.620 47.3-102.3 -73.9 112.0 14.9 -33.0 34.2 84 91 A Q - 0 0 123 -2,-0.6 -1,-0.1 1,-0.2 -3,-0.0 -0.029 30.1-168.4 -42.1 126.1 14.3 -30.9 31.0 85 92 A L S S+ 0 0 137 2,-0.1 2,-0.9 -3,-0.0 -1,-0.2 0.414 71.4 91.5 -94.1 -5.2 12.4 -27.6 31.8 86 93 A G + 0 0 26 3,-0.0 3,-0.1 583,-0.0 -2,-0.1 -0.832 64.7 174.2 -90.2 110.1 11.9 -27.4 28.1 87 94 A I - 0 0 46 -2,-0.9 582,-0.2 1,-0.1 583,-0.1 -0.823 36.3 -65.8-122.2 161.6 8.6 -29.1 27.5 88 95 A P - 0 0 3 0, 0.0 -1,-0.1 0, 0.0 581,-0.1 0.028 41.0-144.8 -40.8 138.5 6.2 -29.6 24.6 89 96 A H > - 0 0 36 1,-0.1 3,-3.6 286,-0.1 4,-0.2 -0.954 21.1-123.0-111.2 123.5 4.5 -26.6 23.1 90 97 A P G > S+ 0 0 0 0, 0.0 3,-3.2 0, 0.0 222,-0.3 0.814 107.7 65.9 -26.5 -59.5 1.0 -27.2 21.9 91 98 A A G 3 S+ 0 0 0 1,-0.3 252,-0.1 251,-0.2 251,-0.1 0.665 101.6 50.1 -42.8 -24.4 1.8 -26.1 18.3 92 99 A G G < S+ 0 0 4 -3,-3.6 -1,-0.3 219,-0.1 2,-0.2 0.155 92.9 103.0-104.1 18.5 4.1 -29.1 18.0 93 100 A L < - 0 0 41 -3,-3.2 219,-3.6 -4,-0.2 2,-0.3 -0.564 65.6-119.1 -99.4 167.3 1.6 -31.8 19.1 94 101 A E - 0 0 82 217,-0.2 2,-0.3 -2,-0.2 219,-0.1 -0.748 25.0-107.7-107.5 151.2 -0.4 -34.3 17.3 95 102 A K - 0 0 123 217,-0.4 2,-0.4 -2,-0.3 135,-0.2 -0.554 38.5-166.8 -74.8 132.5 -4.1 -34.8 17.0 96 103 A K - 0 0 33 133,-2.4 89,-0.2 -2,-0.3 3,-0.1 -0.927 30.6-137.3-122.6 148.3 -5.3 -37.8 19.0 97 104 A K S S+ 0 0 126 87,-1.6 2,-0.3 -2,-0.4 88,-0.2 0.826 95.7 5.1 -71.2 -25.3 -8.6 -39.6 18.9 98 105 A S E -G 184 0E 25 86,-2.0 86,-2.0 131,-0.1 2,-0.3 -0.991 62.2-166.2-154.0 156.5 -8.2 -39.7 22.6 99 106 A V E -G 183 0E 40 -2,-0.3 84,-0.3 84,-0.2 2,-0.2 -0.900 9.8-172.0-151.4 117.5 -6.0 -38.5 25.4 100 107 A T E -G 182 0E 26 82,-4.5 82,-1.3 -2,-0.3 2,-0.4 -0.575 11.2-147.7-106.8 171.5 -5.8 -39.6 29.0 101 108 A V E -G 181 0E 2 115,-0.3 2,-0.7 80,-0.2 80,-0.2 -0.982 4.7-161.7-139.7 126.2 -4.0 -38.5 32.1 102 109 A L - 0 0 0 78,-1.6 2,-0.9 -2,-0.4 79,-0.0 -0.849 9.6-151.4-114.3 101.1 -2.8 -40.6 35.0 103 110 A D + 0 0 60 -2,-0.7 3,-0.3 76,-0.2 76,-0.2 -0.548 17.4 176.4 -73.8 108.0 -2.1 -38.9 38.2 104 111 A V > + 0 0 3 -2,-0.9 3,-3.0 74,-0.9 4,-0.4 -0.109 23.8 146.1 -99.9 31.8 0.6 -41.0 39.8 105 112 A G G > S+ 0 0 30 73,-0.3 3,-1.2 1,-0.3 4,-0.3 0.820 70.5 48.2 -35.9 -53.2 0.9 -38.5 42.7 106 113 A D G 3 S+ 0 0 105 -3,-0.3 3,-0.3 1,-0.2 -1,-0.3 0.592 90.9 86.7 -68.8 -11.4 1.7 -41.2 45.4 107 114 A A G X S+ 0 0 0 -3,-3.0 3,-2.2 101,-0.3 -1,-0.2 0.765 70.8 73.5 -60.9 -30.7 4.3 -42.7 43.0 108 115 A Y G X S+ 0 0 22 -3,-1.2 3,-1.3 -4,-0.4 34,-0.5 0.965 103.0 39.4 -45.4 -63.9 7.0 -40.4 44.3 109 116 A F G 3 S+ 0 0 41 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.2 0.294 100.8 80.5 -70.5 8.7 7.2 -42.4 47.5 110 117 A S G < S+ 0 0 31 -3,-2.2 -1,-0.3 2,-0.1 -2,-0.2 0.348 76.9 86.1 -97.9 5.0 6.8 -45.6 45.5 111 118 A V S < S- 0 0 5 -3,-1.3 31,-1.5 -4,-0.2 42,-0.1 -0.920 80.0-118.4-115.0 129.2 10.4 -45.7 44.5 112 119 A P B -I 141 0F 18 0, 0.0 2,-0.4 0, 0.0 -105,-0.4 -0.308 23.7-136.7 -62.9 139.7 13.3 -47.2 46.4 113 120 A L - 0 0 4 27,-3.6 5,-0.2 -107,-0.1 2,-0.1 -0.833 39.8 -87.1 -99.5 133.3 16.1 -44.9 47.5 114 121 A D >> - 0 0 19 -107,-0.4 3,-4.4 -2,-0.4 4,-0.9 -0.143 39.3-145.4 -40.3 98.4 19.7 -46.1 47.1 115 122 A E H >> S+ 0 0 97 1,-0.3 3,-0.7 2,-0.2 4,-0.6 0.821 98.1 66.2 -39.1 -38.4 19.9 -47.9 50.5 116 123 A D H 34 S+ 0 0 111 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.731 108.1 38.9 -58.2 -21.7 23.5 -46.8 50.5 117 124 A F H X4 S+ 0 0 2 -3,-4.4 3,-1.5 1,-0.1 4,-0.4 0.574 87.8 90.9-107.1 -14.6 22.3 -43.2 50.8 118 125 A R H X< S+ 0 0 36 -4,-0.9 3,-2.3 -3,-0.7 21,-0.5 0.853 73.0 72.7 -50.9 -42.7 19.3 -43.4 53.1 119 126 A K G >< S+ 0 0 85 -4,-0.6 3,-1.7 1,-0.3 -1,-0.3 0.860 91.3 60.2 -42.1 -40.7 21.4 -42.8 56.2 120 127 A Y G < S+ 0 0 31 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.790 93.9 62.2 -61.7 -29.4 21.6 -39.2 55.0 121 128 A T G < S+ 0 0 0 -3,-2.3 -1,-0.3 -4,-0.4 -2,-0.2 0.497 73.4 138.1 -77.3 -3.3 17.9 -38.7 55.2 122 129 A A < + 0 0 0 -3,-1.7 -66,-0.6 -4,-0.4 16,-0.3 -0.135 24.8 165.2 -47.2 130.4 17.8 -39.3 58.9 123 130 A F E -dE 56 137C 0 14,-2.5 14,-2.0 -68,-0.3 2,-0.4 -0.809 24.6-125.8-138.0 179.3 15.6 -36.9 60.7 124 131 A T E - E 0 136C 17 -68,-0.9 -66,-0.4 -2,-0.3 12,-0.2 -0.946 6.2-138.4-147.6 128.0 14.0 -36.7 64.2 125 132 A I E - E 0 135C 0 10,-2.8 10,-1.8 -2,-0.4 -95,-0.0 -0.638 37.8-135.2 -74.7 119.2 10.5 -36.2 65.8 126 133 A P - 0 0 17 0, 0.0 9,-0.4 0, 0.0 2,-0.3 0.307 13.8-129.7 -60.2-165.1 11.0 -33.8 68.7 127 134 A S - 0 0 40 1,-0.1 -102,-0.4 7,-0.1 3,-0.1 -0.961 19.3-129.1-147.6 160.3 9.6 -34.1 72.2 128 135 A I S S+ 0 0 116 -2,-0.3 2,-1.3 1,-0.2 -1,-0.1 0.870 106.7 72.8 -73.8 -36.8 7.7 -32.0 74.7 129 136 A N S S- 0 0 82 1,-0.2 -1,-0.2 -3,-0.1 0, 0.0 -0.648 80.3-154.1 -80.5 88.3 10.5 -33.1 77.0 130 137 A N S S+ 0 0 161 -2,-1.3 -1,-0.2 1,-0.2 -2,-0.0 0.695 94.9 47.5 -33.7 -24.8 13.4 -31.0 75.6 131 138 A E S S+ 0 0 153 2,-0.1 -1,-0.2 -3,-0.0 3,-0.2 0.958 83.6 95.9 -84.8 -68.1 15.4 -33.9 77.1 132 139 A T S S- 0 0 57 1,-0.2 2,-0.3 -6,-0.0 -5,-0.0 0.262 87.3 -85.4 -32.4 149.9 13.9 -37.3 76.1 133 140 A P - 0 0 120 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.475 49.2-126.7 -63.7 117.1 15.3 -39.3 73.1 134 141 A G - 0 0 30 -2,-0.3 2,-0.8 -3,-0.2 -7,-0.1 -0.194 27.0 -97.0 -64.6 159.1 13.7 -38.1 69.9 135 142 A I E - 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0 0 1 -2,-0.2 -1,-0.1 1,-0.1 105,-0.1 -0.246 52.6 -94.5 -66.6 152.2 33.4 -33.5 33.3 556 19 B P - 0 0 0 0, 0.0 38,-2.0 0, 0.0 -1,-0.1 -0.344 32.7-174.5 -64.7 145.3 31.8 -31.6 30.4 557 20 B K B +y 594 0N 91 36,-0.3 2,-0.3 -3,-0.1 38,-0.2 -0.475 22.9 161.2-139.0 59.3 28.2 -30.7 30.9 558 21 B V - 0 0 44 36,-2.1 2,-0.1 1,-0.1 0, 0.0 -0.636 38.4-113.2 -89.9 142.6 27.4 -29.2 27.5 559 22 B K - 0 0 138 -2,-0.3 2,-0.4 1,-0.1 -1,-0.1 -0.431 23.4-122.3 -76.0 144.6 23.9 -28.7 26.2 560 23 B Q - 0 0 34 -2,-0.1 -1,-0.1 36,-0.1 3,-0.1 -0.679 26.2-136.9 -82.1 129.9 22.6 -30.6 23.2 561 24 B W - 0 0 40 -2,-0.4 36,-0.2 36,-0.2 -1,-0.0 -0.603 32.1 -89.1 -88.4 154.6 21.4 -28.4 20.4 562 25 B P - 0 0 54 0, 0.0 2,-0.3 0, 0.0 -188,-0.1 -0.213 46.6-154.0 -58.3 150.5 18.1 -29.2 18.6 563 26 B L - 0 0 8 -190,-0.3 104,-0.1 -189,-0.1 5,-0.1 -0.961 22.7 -95.1-133.8 149.9 18.3 -31.4 15.6 564 27 B T > - 0 0 25 -2,-0.3 4,-2.5 1,-0.1 -186,-0.2 -0.286 39.8-118.7 -58.6 139.4 16.4 -32.1 12.4 565 28 B E H > S+ 0 0 65 -188,-3.2 4,-2.7 1,-0.2 3,-0.3 0.949 115.6 56.3 -43.3 -53.6 14.0 -34.9 12.9 566 29 B E H > S+ 0 0 99 -189,-0.4 4,-1.8 1,-0.3 -1,-0.2 0.896 106.2 47.9 -45.8 -56.4 15.8 -36.7 10.2 567 30 B K H > S+ 0 0 2 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.887 110.7 52.9 -54.1 -43.2 19.2 -36.4 12.0 568 31 B I H X S+ 0 0 12 -4,-2.5 4,-1.9 -3,-0.3 -1,-0.2 0.945 105.3 53.2 -60.3 -48.1 17.6 -37.6 15.2 569 32 B K H X S+ 0 0 136 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.882 110.3 49.4 -52.7 -41.7 16.1 -40.7 13.6 570 33 B A H X S+ 0 0 9 -4,-1.8 4,-3.7 -5,-0.2 5,-0.2 0.928 106.6 53.1 -63.9 -50.1 19.6 -41.6 12.2 571 34 B L H X S+ 0 0 0 -4,-2.2 4,-3.4 1,-0.2 -1,-0.2 0.829 110.6 49.0 -56.0 -35.8 21.4 -41.2 15.6 572 35 B V H X S+ 0 0 51 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.938 112.1 46.7 -69.9 -48.7 19.0 -43.5 17.2 573 36 B E H X S+ 0 0 151 -4,-2.1 4,-2.0 2,-0.2 3,-0.5 0.980 118.6 43.9 -54.1 -57.0 19.3 -46.2 14.4 574 37 B I H X S+ 0 0 39 -4,-3.7 4,-2.2 1,-0.2 -2,-0.2 0.936 112.1 51.9 -52.5 -54.9 23.1 -45.7 14.7 575 38 B C H X S+ 0 0 0 -4,-3.4 4,-1.7 1,-0.2 -1,-0.2 0.777 107.2 52.0 -58.1 -30.3 23.1 -45.7 18.5 576 39 B T H X S+ 0 0 47 -4,-2.3 4,-2.8 -3,-0.5 -1,-0.2 0.910 107.6 53.4 -73.0 -38.8 21.1 -49.0 18.8 577 40 B E H X S+ 0 0 99 -4,-2.0 4,-2.9 -5,-0.2 -2,-0.2 0.971 111.0 45.3 -54.8 -56.2 23.5 -50.7 16.4 578 41 B M H <>S+ 0 0 22 -4,-2.2 5,-3.0 1,-0.2 6,-0.8 0.857 111.6 52.3 -56.9 -39.0 26.5 -49.6 18.6 579 42 B E H ><5S+ 0 0 59 -4,-1.7 3,-1.9 3,-0.2 -1,-0.2 0.932 108.3 51.4 -66.3 -41.6 24.7 -50.7 21.7 580 43 B K H 3<5S+ 0 0 160 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.985 110.8 47.5 -53.8 -59.5 24.0 -54.1 20.2 581 44 B E T 3<5S- 0 0 97 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.282 118.7-116.9 -67.6 13.8 27.7 -54.4 19.4 582 45 B G T < 5S+ 0 0 39 -3,-1.9 -3,-0.2 -5,-0.2 -1,-0.1 0.631 80.0 125.9 59.4 18.9 28.4 -53.3 22.9 583 46 B K S - 0 0 20 -2,-0.3 3,-1.1 1,-0.1 -1,-0.0 -0.283 30.0-117.5 -77.8 160.9 21.6 -43.6 34.5 589 52 B P T 3 S+ 0 0 15 0, 0.0 -508,-1.9 0, 0.0 -1,-0.1 0.592 106.0 81.2 -72.9 -16.0 20.6 -40.1 35.6 590 53 B E T 3 S+ 0 0 52 -510,-0.2 -580,-0.1 1,-0.1 -511,-0.1 0.543 77.9 84.3 -69.6 -5.0 23.3 -40.2 38.3 591 54 B N < + 0 0 12 -3,-1.1 -511,-0.1 1,-0.1 -1,-0.1 -0.880 57.5 176.4-100.8 104.7 25.5 -39.3 35.4 592 55 B P + 0 0 14 0, 0.0 -510,-0.2 0, 0.0 -1,-0.1 0.549 44.6 100.9 -84.9 -10.7 25.3 -35.4 35.0 593 56 B Y + 0 0 22 65,-0.1 2,-0.3 -36,-0.1 -36,-0.3 -0.251 46.0 177.5 -74.6 164.7 27.9 -34.9 32.2 594 57 B N B -y 557 0N 0 -38,-2.0 -36,-2.1 65,-0.1 68,-0.3 -0.972 17.9-166.0-165.6 152.3 27.0 -34.4 28.5 595 58 B T B -a 662 0O 2 66,-0.6 68,-0.8 -2,-0.3 19,-0.1 -0.977 34.1-107.3-138.0 144.7 28.6 -33.8 25.2 596 59 B P - 0 0 4 0, 0.0 17,-1.7 0, 0.0 2,-0.3 -0.433 36.2-173.7 -74.5 153.8 26.8 -32.6 22.0 597 60 B V E +C 612 0P 0 66,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.952 8.9 160.4-140.7 157.2 26.3 -35.1 19.2 598 61 B F E -C 611 0P 0 13,-3.1 13,-3.6 -2,-0.3 2,-0.4 -0.965 30.8-102.6-165.0 178.8 25.0 -34.8 15.7 599 62 B A E -C 610 0P 0 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.946 28.0-179.5-124.0 137.9 24.8 -36.4 12.3 600 63 B I E -C 609 0P 3 9,-2.7 9,-3.7 -2,-0.4 320,-0.1 -0.809 26.3-149.0-129.1 166.6 26.5 -35.7 9.0 601 64 B K - 0 0 67 318,-0.4 4,-0.3 -2,-0.3 3,-0.2 -0.572 34.0-170.4-132.2 66.3 26.7 -36.9 5.4 602 65 B K > - 0 0 61 318,-0.2 3,-1.4 1,-0.2 318,-0.1 0.147 50.2 -11.9 -53.8 174.3 30.3 -36.1 4.4 603 66 B K T 3 S- 0 0 148 1,-0.2 -1,-0.2 2,-0.0 317,-0.0 0.311 126.4 -25.1 -16.7 100.6 31.8 -36.4 0.9 604 67 B D T 3 S+ 0 0 162 -3,-0.2 2,-0.4 1,-0.1 -1,-0.2 0.581 91.7 142.3 66.3 26.9 29.3 -38.2 -1.4 605 68 B S < - 0 0 34 -3,-1.4 -1,-0.1 -4,-0.3 -2,-0.0 -0.801 48.7-159.7-120.1 149.0 27.1 -40.5 0.8 606 69 B T S S+ 0 0 135 -2,-0.4 2,-0.3 2,-0.1 -1,-0.1 0.130 82.6 71.9 -89.0 17.0 23.4 -41.8 1.1 607 70 B K S S- 0 0 143 -7,-0.0 2,-0.3 2,-0.0 -2,-0.1 -0.969 80.9-117.4-135.9 149.7 24.1 -42.7 4.7 608 71 B W - 0 0 62 -2,-0.3 2,-0.4 -7,-0.1 -7,-0.2 -0.650 18.1-149.9 -90.0 144.0 24.5 -40.6 7.9 609 72 B R E -C 600 0P 36 -9,-3.7 -9,-2.7 -2,-0.3 2,-0.4 -0.911 19.2-123.8-112.5 136.5 27.7 -40.5 10.1 610 73 B K E -C 599 0P 11 -2,-0.4 2,-0.4 -11,-0.2 -11,-0.2 -0.622 29.3-168.9 -80.0 133.2 27.5 -39.9 13.8 611 74 B L E -C 598 0P 5 -13,-3.6 -13,-3.1 -2,-0.4 2,-0.4 -0.986 7.0-163.6-128.8 134.2 29.6 -37.0 15.0 612 75 B V E -C 597 0P 9 -2,-0.4 2,-1.5 -15,-0.2 -15,-0.2 -0.967 15.9-141.8-122.2 126.7 30.4 -36.0 18.5 613 76 B D + 0 0 15 -17,-1.7 3,-0.5 -2,-0.4 4,-0.2 -0.585 31.3 162.3 -86.6 79.3 31.8 -32.6 19.7 614 77 B F > + 0 0 4 -2,-1.5 4,-4.4 1,-0.2 5,-0.3 0.271 32.9 121.2 -82.1 12.5 34.4 -33.6 22.4 615 78 B R H > S+ 0 0 33 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.881 79.2 41.4 -42.7 -51.1 36.0 -30.2 22.2 616 79 B E H > S+ 0 0 62 -3,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.934 116.6 47.6 -62.6 -51.0 35.4 -29.6 25.9 617 80 B L H >> S+ 0 0 0 -4,-0.2 4,-1.4 1,-0.2 3,-0.6 0.959 110.1 54.5 -54.7 -52.6 36.2 -33.1 27.0 618 81 B N H >< S+ 0 0 30 -4,-4.4 3,-1.4 1,-0.3 -1,-0.2 0.935 105.5 52.1 -47.0 -54.7 39.3 -32.9 24.9 619 82 B K H 3< S+ 0 0 98 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.861 112.9 45.1 -51.8 -38.0 40.4 -29.7 26.7 620 83 B R H << S+ 0 0 55 -4,-1.8 -70,-3.7 -3,-0.6 -1,-0.3 0.579 90.3 103.2 -85.1 -10.2 39.9 -31.4 30.1 621 84 B T B << S-X 549 0M 0 -3,-1.4 -72,-0.2 -4,-1.4 -74,-0.0 -0.527 80.6-108.9 -74.7 137.2 41.7 -34.6 29.1 622 85 B Q - 0 0 55 -74,-2.0 2,-0.2 -2,-0.2 -1,-0.1 0.017 36.7-108.0 -53.8 171.9 45.2 -35.0 30.5 623 86 B D 0 0 114 1,-0.1 -1,-0.1 -74,-0.1 64,-0.0 -0.478 360.0 360.0 -99.2 177.3 48.1 -34.7 28.0 624 87 B F 0 0 135 -2,-0.2 -1,-0.1 66,-0.0 -2,-0.0 0.425 360.0 360.0-137.4 360.0 50.3 -37.6 26.8 625 ! 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 0.0 626 94 B I 0 0 108 0, 0.0 88,-0.1 0, 0.0 67,-0.0 0.000 360.0 360.0 360.0 133.0 54.5 -38.3 17.1 627 95 B P - 0 0 116 0, 0.0 270,-0.1 0, 0.0 0, 0.0 -0.031 360.0 -81.2 -64.5 172.2 56.0 -34.9 16.0 628 96 B H - 0 0 51 268,-0.1 2,-1.4 1,-0.1 85,-0.0 -0.599 36.8-124.2 -81.0 136.6 55.0 -33.2 12.7 629 97 B P > - 0 0 33 0, 0.0 3,-3.7 0, 0.0 4,-0.5 -0.650 18.5-153.8 -82.2 89.1 56.8 -34.4 9.6 630 98 B A T 3 S+ 0 0 62 -2,-1.4 4,-0.3 1,-0.3 3,-0.1 0.622 91.4 56.1 -36.9 -19.8 58.3 -31.1 8.3 631 99 B G T > S+ 0 0 28 1,-0.2 3,-1.5 2,-0.2 -1,-0.3 0.719 79.1 84.8 -92.0 -20.9 58.2 -32.6 4.9 632 100 B L G X S+ 0 0 0 -3,-3.7 3,-1.4 1,-0.3 -1,-0.2 0.894 91.4 53.2 -45.8 -44.4 54.5 -33.5 4.7 633 101 B E G 3 S+ 0 0 64 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.2 0.832 103.5 59.7 -59.6 -32.6 53.9 -29.9 3.6 634 102 B K G < S+ 0 0 147 -3,-1.5 -1,-0.3 -4,-0.3 2,-0.3 0.158 80.4 111.8 -86.0 17.6 56.5 -30.3 0.8 635 103 B K S < S- 0 0 39 -3,-1.4 115,-0.4 -4,-0.1 3,-0.1 -0.654 71.8-125.9 -96.2 152.0 54.9 -33.2 -1.1 636 104 B K S S+ 0 0 123 -2,-0.3 2,-0.3 1,-0.2 88,-0.2 0.696 92.1 7.2 -64.7 -20.1 53.4 -33.0 -4.6 637 105 B S - 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0 0 67 184,-2.7 3,-0.1 -2,-0.4 62,-0.0 -0.978 9.9-140.8-124.3 134.2 49.1 -5.9 -6.0 759 246 B L - 0 0 10 -2,-0.4 14,-0.0 1,-0.1 57,-0.0 -0.548 34.4 -90.8 -88.2 157.8 48.3 -2.3 -6.2 760 247 B P - 0 0 39 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.187 34.0-152.5 -61.7 158.3 46.0 -0.8 -8.8 761 248 B E + 0 0 151 -3,-0.1 2,-0.3 3,-0.0 3,-0.1 -0.998 19.9 179.8-134.8 132.0 47.5 0.4 -12.1 762 249 B K - 0 0 99 -2,-0.4 3,-0.1 1,-0.2 0, 0.0 -0.984 40.6-137.2-143.2 153.4 45.7 3.2 -14.0 763 250 B D S S+ 0 0 173 -2,-0.3 2,-0.3 1,-0.3 -1,-0.2 0.990 101.4 1.2 -59.2 -62.0 45.9 5.3 -17.1 764 251 B S S S- 0 0 69 -3,-0.1 2,-0.3 43,-0.1 -1,-0.3 -0.924 77.3-138.2-127.5 148.7 44.9 8.3 -15.2 765 252 B W E -I 806 0T 18 41,-0.8 41,-2.6 -2,-0.3 2,-0.2 -0.850 8.4-148.1-112.6 148.4 44.2 8.7 -11.4 766 253 B T E > -I 805 0T 27 -2,-0.3 4,-2.7 39,-0.2 39,-0.2 -0.654 33.1-106.6-105.0 167.4 41.5 10.6 -9.6 767 254 B V H > S+ 0 0 3 37,-1.5 4,-3.1 34,-0.4 5,-0.2 0.933 124.6 48.0 -53.6 -48.7 41.7 12.2 -6.2 768 255 B N H > S+ 0 0 0 34,-1.7 4,-3.3 2,-0.2 5,-0.3 0.938 107.1 54.5 -58.2 -52.3 39.5 9.4 -4.9 769 256 B D H > S+ 0 0 31 33,-0.3 4,-2.9 1,-0.2 -1,-0.2 0.925 113.2 44.1 -47.1 -49.2 41.6 6.8 -6.6 770 257 B I H X S+ 0 0 1 -4,-2.7 4,-3.1 2,-0.2 -1,-0.2 0.905 110.2 53.5 -68.2 -40.9 44.6 8.2 -4.8 771 258 B Q H X S+ 0 0 1 -4,-3.1 4,-2.2 2,-0.2 -2,-0.2 0.938 113.4 43.7 -59.6 -46.9 42.9 8.6 -1.5 772 259 B K H X S+ 0 0 77 -4,-3.3 4,-2.2 2,-0.2 3,-0.2 0.968 112.7 52.0 -62.9 -49.3 41.9 5.0 -1.5 773 260 B L H X S+ 0 0 6 -4,-2.9 4,-2.4 -5,-0.3 -2,-0.2 0.912 111.9 48.3 -50.5 -46.2 45.3 4.0 -2.7 774 261 B V H X S+ 0 0 0 -4,-3.1 4,-2.7 2,-0.2 -1,-0.2 0.834 107.0 53.3 -63.6 -40.1 46.8 6.0 0.2 775 262 B G H X S+ 0 0 2 -4,-2.2 4,-2.1 -3,-0.2 -1,-0.2 0.915 111.5 48.3 -63.7 -40.7 44.6 4.6 2.9 776 263 B K H X S+ 0 0 26 -4,-2.2 4,-3.2 2,-0.2 -2,-0.2 0.967 114.5 42.8 -62.0 -57.0 45.6 1.1 1.8 777 264 B L H X S+ 0 0 0 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.942 111.2 55.1 -55.3 -53.2 49.3 1.7 1.7 778 265 B N H >< S+ 0 0 40 -4,-2.7 3,-1.0 2,-0.2 -1,-0.2 0.927 112.0 44.2 -46.6 -51.7 49.3 3.7 4.9 779 266 B W H >< S+ 0 0 31 -4,-2.1 3,-2.6 1,-0.3 4,-0.2 0.991 108.3 58.5 -57.9 -57.8 47.6 0.7 6.6 780 267 B A H >X S+ 0 0 0 -4,-3.2 4,-2.1 1,-0.3 3,-2.0 0.666 86.9 78.3 -44.3 -22.3 50.0 -1.7 4.9 781 268 B S T << S+ 0 0 40 -4,-1.3 -1,-0.3 -3,-1.0 -2,-0.2 0.505 77.1 71.8 -71.0 -1.3 52.9 0.2 6.5 782 269 B Q T <4 S+ 0 0 101 -3,-2.6 -1,-0.3 1,-0.1 -2,-0.2 0.554 111.8 31.3 -84.6 -9.2 52.1 -1.7 9.7 783 270 B I T <4 S+ 0 0 18 -3,-2.0 -2,-0.2 1,-0.3 -1,-0.1 0.650 131.5 33.4-112.7 -36.5 53.5 -4.7 7.9 784 271 B Y >< - 0 0 33 -4,-2.1 3,-0.8 1,-0.1 -1,-0.3 -0.951 59.3-173.0-127.5 108.1 56.1 -2.9 5.7 785 272 B P T 3 S+ 0 0 111 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.609 84.3 67.9 -74.6 -11.7 57.7 0.2 7.2 786 273 B G T 3 S+ 0 0 34 33,-0.1 2,-0.2 -3,-0.1 -5,-0.1 0.715 74.6 104.9 -79.4 -21.4 59.3 0.9 3.9 787 274 B I < - 0 0 10 -3,-0.8 2,-0.4 -7,-0.1 29,-0.1 -0.422 55.9-170.0 -60.9 128.9 56.0 1.7 2.3 788 275 B K + 0 0 132 27,-0.2 4,-0.2 -2,-0.2 31,-0.1 -0.979 30.2 177.8-133.1 140.3 55.7 5.5 1.9 789 276 B V > + 0 0 18 -2,-0.4 4,-2.7 2,-0.1 5,-0.2 0.227 51.1 112.4-117.6 9.1 52.8 7.9 1.0 790 277 B R H > S+ 0 0 151 1,-0.2 4,-0.9 2,-0.2 3,-0.1 0.951 82.8 37.6 -47.1 -70.2 54.6 11.2 1.3 791 278 B Q H >> S+ 0 0 30 1,-0.2 4,-1.3 2,-0.2 3,-1.1 0.897 116.4 52.4 -50.4 -51.2 54.6 12.2 -2.4 792 279 B L H >> S+ 0 0 1 1,-0.3 3,-0.8 2,-0.2 4,-0.6 0.934 106.6 53.0 -53.8 -49.4 51.1 10.8 -3.1 793 280 B C H 3< S+ 0 0 7 -4,-2.7 -257,-0.5 1,-0.3 -1,-0.3 0.660 101.9 61.5 -62.3 -17.3 49.6 12.7 -0.2 794 281 B K H X< S+ 0 0 71 -3,-1.1 3,-1.8 -4,-0.9 -1,-0.3 0.878 95.8 57.5 -77.1 -36.9 51.0 15.9 -1.5 795 282 B L H << S+ 0 0 24 -4,-1.3 -1,-0.2 -3,-0.8 -2,-0.2 0.700 98.7 67.8 -62.7 -18.2 49.1 15.6 -4.7 796 283 B L T 3< S+ 0 0 8 -4,-0.6 -1,-0.3 -26,-0.1 4,-0.2 0.312 73.5 118.4 -88.6 9.8 46.1 15.6 -2.4 797 284 B R < + 0 0 104 -3,-1.8 2,-0.2 -261,-0.2 -262,-0.1 -0.461 57.5 30.1 -81.6 151.8 46.3 19.1 -1.2 798 285 B G S S- 0 0 30 -2,-0.1 2,-0.4 1,-0.1 -259,-0.1 -0.462 101.0 -75.5 96.6-175.0 43.6 21.7 -1.8 799 286 B T + 0 0 38 -2,-0.2 -344,-0.2 -347,-0.1 2,-0.1 -0.690 61.6 168.8-124.9 80.3 40.0 20.7 -2.0 800 287 B K - 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