==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 03-FEB-12 2LP7 . COMPND 2 MOLECULE: ENVELOPE GLYCOPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR P.N.REARDON . 177 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14392.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 122 68.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 12.4 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 . 3 1.7 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 . 9 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 65 36.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 1 0 0 1 2 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 3 2 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 G 0 0 76 0, 0.0 124,-0.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-139.8 112.7 6.2 -10.1 2 2 A Y + 0 0 155 122,-0.2 120,-0.0 1,-0.0 0, 0.0 -0.997 360.0 154.4-145.0 139.1 112.5 4.4 -6.7 3 3 A I + 0 0 52 -2,-0.3 2,-0.8 16,-0.0 -1,-0.0 -0.175 13.2 166.7-157.8 51.9 113.9 1.1 -5.4 4 4 A P + 0 0 37 0, 0.0 2,-0.1 0, 0.0 -2,-0.0 -0.639 36.7 100.7 -78.1 107.0 114.3 1.2 -1.6 5 5 A E + 0 0 130 -2,-0.8 57,-0.1 57,-0.1 58,-0.1 -0.445 36.3 166.4 172.4 107.9 114.9 -2.4 -0.4 6 6 A A - 0 0 26 -2,-0.1 2,-0.1 56,-0.1 70,-0.0 -0.906 39.0 -95.1-129.9 157.9 118.2 -4.0 0.5 7 7 A P - 0 0 55 0, 0.0 2,-0.5 0, 0.0 71,-0.4 -0.374 26.2-146.0 -72.1 151.3 119.2 -7.3 2.4 8 8 A R + 0 0 178 69,-0.2 4,-0.1 1,-0.1 68,-0.1 -0.843 52.4 122.1-122.8 92.3 119.9 -7.3 6.1 9 9 A D S S- 0 0 126 -2,-0.5 -1,-0.1 2,-0.2 3,-0.1 0.194 89.0 -94.5-131.8 10.3 122.6 -9.8 7.0 10 10 A G S S+ 0 0 33 1,-0.3 2,-0.1 -3,-0.1 -2,-0.1 0.309 92.8 117.1 90.9 -8.5 125.1 -7.5 8.6 11 11 A Q - 0 0 103 1,-0.0 66,-0.8 65,-0.0 2,-0.4 -0.301 64.9-116.0 -85.4 174.0 127.0 -7.2 5.3 12 12 A A E -A 76 0A 6 64,-0.2 11,-1.0 -3,-0.1 12,-0.4 -0.932 29.8-179.1-116.2 136.8 127.5 -4.1 3.3 13 13 A Y E -AB 75 22A 10 62,-2.4 62,-1.6 -2,-0.4 9,-0.3 -0.964 12.5-145.6-134.6 150.1 126.1 -3.4 -0.2 14 14 A V E - B 0 21A 3 7,-2.8 7,-1.6 -2,-0.3 2,-0.8 -0.645 29.1 -99.1-110.7 169.5 126.4 -0.5 -2.7 15 15 A R E +CB 133 20A 19 118,-1.4 118,-2.4 -2,-0.2 2,-0.4 -0.799 55.3 152.3 -93.1 109.2 124.0 0.9 -5.2 16 16 A K E > -CB 132 19A 64 3,-2.5 3,-2.2 -2,-0.8 116,-0.2 -0.995 67.8 -18.0-140.8 132.3 124.8 -0.4 -8.7 17 17 A D T 3 S- 0 0 82 114,-1.1 111,-0.2 -2,-0.4 3,-0.1 0.860 123.6 -58.6 40.7 46.4 122.6 -0.9 -11.7 18 18 A G T 3 S+ 0 0 22 109,-0.4 2,-0.3 1,-0.2 -1,-0.3 0.859 120.8 106.8 54.5 36.4 119.6 -0.8 -9.4 19 19 A E E < S-B 16 0A 117 -3,-2.2 -3,-2.5 -5,-0.1 2,-0.7 -0.972 75.8-111.2-143.7 156.8 121.1 -3.7 -7.5 20 20 A W E +B 15 0A 51 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.2 -0.809 37.7 179.9 -93.9 112.8 122.8 -4.4 -4.2 21 21 A V E -B 14 0A 35 -7,-1.6 -7,-2.8 -2,-0.7 5,-0.1 -0.960 38.5-102.8-119.3 127.3 126.5 -5.3 -4.7 22 22 A L E > -B 13 0A 76 -2,-0.5 3,-2.5 -9,-0.3 4,-0.5 -0.202 26.4-142.1 -46.2 117.4 128.9 -6.2 -1.9 23 23 A L T >> S+ 0 0 0 -11,-1.0 3,-2.5 1,-0.3 4,-1.2 0.849 98.0 72.9 -52.6 -36.3 131.0 -3.0 -1.6 24 24 A S H 3>>S+ 0 0 46 -12,-0.4 4,-1.5 1,-0.3 5,-1.3 0.780 87.5 63.4 -51.5 -26.8 133.9 -5.3 -1.0 25 25 A T H <45S+ 0 0 97 -3,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.812 104.9 45.0 -68.0 -28.6 133.7 -6.1 -4.7 26 26 A F H <45S+ 0 0 74 -3,-2.5 -1,-0.2 -4,-0.5 -2,-0.2 0.655 105.2 62.5 -87.4 -17.7 134.5 -2.5 -5.4 27 27 A L H <5S- 0 0 62 -4,-1.2 -2,-0.2 2,-0.0 -1,-0.2 0.856 105.9-125.4 -74.8 -34.8 137.3 -2.5 -2.8 28 28 A G T ><5 + 0 0 28 -4,-1.5 3,-0.7 1,-0.2 5,-0.2 0.735 49.0 163.7 94.9 28.1 139.3 -5.1 -4.7 29 29 A S T 3 < + 0 0 43 -5,-1.3 -1,-0.2 1,-0.2 -2,-0.0 -0.462 56.4 33.9 -79.2 152.0 139.6 -7.5 -1.8 30 30 A S T 3 S+ 0 0 118 -2,-0.1 -1,-0.2 1,-0.0 -5,-0.0 0.627 120.9 52.2 79.4 15.4 140.6 -11.1 -2.4 31 31 A G S < S+ 0 0 46 -3,-0.7 -2,-0.2 0, 0.0 -1,-0.0 0.226 119.1 23.6-162.3 14.6 142.9 -10.0 -5.3 32 32 A N S >> S+ 0 0 86 2,-0.0 4,-1.1 -4,-0.0 3,-0.6 0.285 87.2 99.1-162.6 -5.9 145.1 -7.3 -3.9 33 33 A E H 3> S+ 0 0 111 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.643 75.9 72.8 -64.8 -13.7 145.1 -7.9 -0.2 34 34 A Q H 3> S+ 0 0 136 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.971 97.6 42.1 -66.1 -55.0 148.4 -9.6 -1.0 35 35 A E H <> S+ 0 0 47 -3,-0.6 4,-0.6 1,-0.2 -1,-0.2 0.792 114.8 54.6 -64.0 -24.9 150.3 -6.3 -1.6 36 36 A L H < S+ 0 0 65 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.865 121.3 27.6 -73.3 -39.5 148.4 -4.9 1.5 37 37 A L H X S+ 0 0 88 -4,-2.2 4,-0.7 -3,-0.2 -2,-0.2 0.345 101.6 85.7-104.4 2.5 149.6 -7.8 3.8 38 38 A E H >X S+ 0 0 50 -4,-1.5 4,-2.9 2,-0.2 3,-1.5 0.937 84.0 55.8 -69.6 -47.7 152.9 -8.6 1.9 39 39 A L H 3X S+ 0 0 58 -4,-0.6 4,-2.9 1,-0.3 5,-0.2 0.866 102.4 58.8 -53.6 -35.2 155.0 -6.0 3.7 40 40 A D H 3> S+ 0 0 67 -4,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.839 112.7 39.5 -62.1 -32.6 153.9 -7.6 6.9 41 41 A K H XX S+ 0 0 126 -3,-1.5 4,-1.0 -4,-0.7 3,-0.6 0.929 118.9 42.8 -82.2 -51.6 155.5 -10.8 5.7 42 42 A W H 3X S+ 0 0 136 -4,-2.9 4,-2.4 1,-0.2 5,-0.3 0.867 107.1 63.4 -64.0 -34.9 158.6 -9.4 4.0 43 43 A A H 3X S+ 0 0 41 -4,-2.9 4,-3.6 -5,-0.4 -1,-0.2 0.858 95.4 61.6 -55.7 -37.3 159.1 -7.1 7.0 44 44 A S H X S+ 0 0 92 -4,-1.0 4,-2.4 2,-0.2 3,-0.7 0.956 118.0 46.8 -62.5 -49.6 162.6 -11.3 7.2 46 46 A W H 3< S+ 0 0 179 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.898 111.5 52.9 -58.3 -40.0 164.0 -7.8 6.9 47 47 A N H 3< S+ 0 0 106 -4,-3.6 3,-0.4 -5,-0.3 -1,-0.3 0.764 112.0 45.2 -66.9 -26.3 163.3 -7.4 10.6 48 48 A W H X< S+ 0 0 147 -4,-1.4 3,-1.6 -3,-0.7 -2,-0.2 0.789 99.1 68.3 -87.5 -29.7 165.2 -10.6 11.4 49 49 A F T >X S+ 0 0 121 -4,-2.4 3,-1.0 1,-0.3 4,-0.6 0.383 73.3 95.4 -70.5 8.4 168.2 -9.7 9.1 50 50 A N H 3> + 0 0 34 -3,-0.4 4,-2.1 1,-0.2 5,-0.4 0.709 62.2 80.3 -70.5 -19.5 168.9 -7.0 11.6 51 51 A I H <> S+ 0 0 73 -3,-1.6 4,-1.4 1,-0.3 -1,-0.2 0.868 97.5 42.1 -55.4 -35.8 171.3 -9.4 13.2 52 52 A T H <> S+ 0 0 39 -3,-1.0 4,-1.6 2,-0.2 -1,-0.3 0.704 107.3 64.6 -82.6 -21.6 173.8 -8.5 10.5 53 53 A N H X S+ 0 0 86 -4,-0.6 4,-0.9 -3,-0.2 -2,-0.2 0.971 111.9 30.6 -65.8 -55.0 172.8 -4.8 10.8 54 54 A W H X S+ 0 0 148 -4,-2.1 4,-3.1 2,-0.2 3,-0.3 0.924 115.7 59.0 -71.2 -45.5 174.1 -4.3 14.4 55 55 A L H X S+ 0 0 100 -4,-1.4 4,-0.9 -5,-0.4 -2,-0.2 0.945 108.8 44.7 -47.6 -56.8 176.9 -6.9 14.2 56 56 A W H < S+ 0 0 170 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.801 113.4 54.7 -58.6 -28.3 178.5 -5.0 11.3 57 57 A Y H < S+ 0 0 201 -4,-0.9 -2,-0.2 -3,-0.3 -1,-0.2 0.969 122.5 24.2 -69.7 -55.1 177.9 -1.8 13.3 58 58 A I H < 0 0 133 -4,-3.1 -2,-0.2 0, 0.0 -1,-0.2 0.220 360.0 360.0 -94.7 13.2 179.7 -2.9 16.4 59 59 A K < 0 0 202 -4,-0.9 -3,-0.1 -5,-0.3 -4,-0.0 -0.146 360.0 360.0 -40.5 360.0 181.8 -5.4 14.5 60 !* 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 61 1 B G 0 0 86 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 39.3 110.8 -2.9 3.2 62 2 B Y - 0 0 172 -57,-0.1 -57,-0.1 -56,-0.0 -56,-0.1 -0.902 360.0 -96.2-149.2 175.3 112.7 0.3 2.6 63 3 B I - 0 0 4 -2,-0.3 60,-0.1 1,-0.1 16,-0.1 -0.787 30.7-124.2-100.1 142.3 115.9 2.2 3.5 64 4 B P - 0 0 52 0, 0.0 -1,-0.1 0, 0.0 15,-0.1 0.941 42.6-111.6 -44.8 -75.5 116.0 4.9 6.4 65 5 B E - 0 0 75 57,-0.1 73,-0.1 2,-0.0 57,-0.1 0.039 37.7-123.6 162.4 -29.6 117.4 7.9 4.4 66 6 B A - 0 0 9 71,-0.0 70,-0.1 72,-0.0 2,-0.0 0.406 34.0 -80.0 74.5 144.6 120.8 8.4 5.9 67 7 B P - 0 0 34 0, 0.0 2,-0.5 0, 0.0 71,-0.3 -0.310 32.2-135.3 -75.5 162.6 122.0 11.8 7.4 68 8 B R + 0 0 174 69,-0.1 4,-0.1 1,-0.1 68,-0.0 -0.879 58.6 118.0-123.1 96.5 123.1 14.8 5.4 69 9 B D S S- 0 0 129 -2,-0.5 -1,-0.1 2,-0.3 3,-0.1 0.201 94.9 -84.3-140.5 10.6 126.3 16.5 6.8 70 10 B G S S+ 0 0 46 1,-0.4 2,-0.1 -3,-0.1 -2,-0.1 0.254 98.8 112.3 99.7 -9.6 128.7 16.0 3.9 71 11 B Q - 0 0 95 65,-0.0 66,-0.9 1,-0.0 -1,-0.4 -0.334 59.8-130.2 -87.8 174.4 129.6 12.5 5.0 72 12 B A E -E 136 0B 5 64,-0.2 2,-0.3 -3,-0.1 11,-0.3 -0.929 19.3-174.1-128.4 152.2 128.8 9.2 3.2 73 13 B Y E -E 135 0B 17 62,-2.1 62,-1.5 -2,-0.3 9,-0.2 -0.975 11.4-143.3-143.2 154.6 127.3 5.9 4.3 74 14 B V E - D 0 81A 4 7,-2.1 7,-1.2 -2,-0.3 2,-0.9 -0.560 36.2 -87.1-111.2 176.6 126.6 2.5 2.7 75 15 B R E +AD 13 80A 7 -62,-1.6 -62,-2.4 -2,-0.2 2,-0.3 -0.773 62.8 146.0 -90.9 108.3 123.8 0.0 3.0 76 16 B K E > -AD 12 79A 53 3,-1.7 3,-2.6 -2,-0.9 -64,-0.2 -0.993 69.1 -17.0-145.4 135.7 124.4 -2.2 6.0 77 17 B D T 3 S- 0 0 94 -66,-0.8 -69,-0.2 -2,-0.3 3,-0.1 0.823 121.3 -63.3 38.3 41.6 122.1 -3.9 8.5 78 18 B G T 3 S+ 0 0 34 -71,-0.4 2,-0.3 1,-0.2 -1,-0.3 0.884 119.0 100.9 54.6 40.1 119.4 -1.4 7.3 79 19 B E E < S-D 76 0A 103 -3,-2.6 -3,-1.7 -5,-0.1 2,-0.5 -0.980 81.1 -95.5-150.8 160.7 121.6 1.4 8.6 80 20 B W E +D 75 0A 110 -2,-0.3 2,-0.5 -5,-0.1 -5,-0.1 -0.692 41.8 179.9 -83.2 121.1 124.0 4.1 7.5 81 21 B V E -D 74 0A 28 -7,-1.2 -7,-2.1 -2,-0.5 -2,-0.0 -0.965 35.0-112.8-129.3 116.8 127.6 3.0 7.8 82 22 B L > - 0 0 69 -2,-0.5 3,-2.4 -9,-0.2 4,-0.3 -0.200 20.6-145.9 -46.5 115.1 130.5 5.2 6.8 83 23 B L T >> S+ 0 0 0 1,-0.3 3,-3.5 -11,-0.3 4,-1.1 0.820 92.6 79.8 -55.0 -32.4 132.1 3.4 3.9 84 24 B S H 3> S+ 0 0 43 1,-0.3 4,-1.5 -12,-0.3 -1,-0.3 0.767 81.8 66.1 -48.1 -26.0 135.4 4.6 5.2 85 25 B T H <4 S+ 0 0 97 -3,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.773 103.6 44.7 -67.6 -25.2 135.2 1.7 7.6 86 26 B F H <4 S+ 0 0 57 -3,-3.5 -1,-0.2 -4,-0.3 -2,-0.2 0.635 104.7 62.8 -92.3 -16.9 135.4 -0.7 4.6 87 27 B L H < S- 0 0 49 -4,-1.1 -2,-0.2 -3,-0.1 -3,-0.1 0.874 109.2-118.5 -74.5 -37.1 138.3 1.3 3.0 88 28 B G < + 0 0 30 -4,-1.5 -3,-0.1 1,-0.1 -2,-0.1 0.778 60.1 140.2 95.9 93.4 140.6 0.6 5.9 89 29 B S + 0 0 65 -5,-0.2 2,-0.1 -4,-0.1 -1,-0.1 -0.243 44.1 86.9-160.1 56.4 141.9 3.7 7.8 90 30 B S S S- 0 0 94 -5,-0.1 -1,-0.1 0, 0.0 -2,-0.0 -0.527 108.7 -19.2-162.9 86.5 141.9 2.9 11.5 91 31 B G S S+ 0 0 59 -2,-0.1 -2,-0.0 -3,-0.1 4,-0.0 0.770 135.1 56.4 84.5 28.9 144.9 1.3 13.0 92 32 B N S >> S+ 0 0 96 2,-0.0 4,-1.1 -4,-0.0 3,-0.7 0.317 71.0 91.7-161.3 -14.5 146.3 -0.0 9.7 93 33 B E H 3> S+ 0 0 67 1,-0.3 4,-2.1 2,-0.2 5,-0.1 0.657 79.7 73.6 -64.2 -13.4 146.6 3.1 7.5 94 34 B Q H 3> S+ 0 0 133 2,-0.2 4,-1.4 1,-0.2 3,-0.3 0.967 96.1 42.9 -65.6 -54.3 150.1 3.0 9.0 95 35 B E H <> S+ 0 0 60 -3,-0.7 4,-0.6 1,-0.2 -1,-0.2 0.801 114.5 54.5 -63.9 -25.0 151.3 0.1 6.9 96 36 B L H < S+ 0 0 54 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.853 121.4 27.7 -73.4 -38.1 149.5 1.7 4.0 97 37 B L H X S+ 0 0 82 -4,-2.1 4,-0.6 -3,-0.3 -2,-0.2 0.316 99.9 88.5-106.1 3.9 151.4 5.0 4.4 98 38 B E H >X S+ 0 0 52 -4,-1.4 4,-2.5 1,-0.2 3,-1.8 0.928 80.6 58.5 -68.9 -46.4 154.5 3.6 5.9 99 39 B L H 3X S+ 0 0 55 -4,-0.6 4,-2.3 1,-0.3 -1,-0.2 0.850 100.0 60.5 -52.9 -32.8 156.3 3.0 2.7 100 40 B D H 34 S+ 0 0 84 2,-0.2 4,-0.4 1,-0.2 -1,-0.3 0.837 112.2 38.2 -62.7 -32.7 155.9 6.7 2.0 101 41 B K H XX S+ 0 0 144 -3,-1.8 3,-1.4 -4,-0.6 4,-0.8 0.946 117.5 45.0 -82.8 -56.8 157.9 7.4 5.1 102 42 B W H 3X S+ 0 0 129 -4,-2.5 4,-2.3 1,-0.3 3,-0.4 0.851 104.8 66.3 -57.1 -33.9 160.6 4.6 5.0 103 43 B A H 3X S+ 0 0 28 -4,-2.3 4,-3.8 -5,-0.4 -1,-0.3 0.847 91.0 64.8 -54.9 -36.2 161.0 5.5 1.3 104 44 B S H <> S+ 0 0 67 -3,-1.4 4,-1.3 -4,-0.4 -1,-0.2 0.947 106.4 39.8 -54.8 -52.4 162.4 8.8 2.4 105 45 B L H >X S+ 0 0 109 -4,-0.8 4,-3.3 -3,-0.4 3,-0.7 0.956 117.2 49.2 -63.0 -49.2 165.4 7.3 4.0 106 46 B W H 3< S+ 0 0 173 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.917 112.2 49.5 -55.4 -42.9 165.9 4.7 1.3 107 47 B N H 3< S+ 0 0 105 -4,-3.8 3,-0.4 -5,-0.2 -1,-0.3 0.741 114.2 45.7 -67.5 -24.6 165.6 7.6 -1.3 108 48 B W H X< S+ 0 0 166 -4,-1.3 3,-1.9 -3,-0.7 -2,-0.2 0.846 96.5 70.8 -86.9 -37.1 168.1 9.5 0.7 109 49 B F T >X S+ 0 0 121 -4,-3.3 3,-1.0 1,-0.3 4,-0.6 0.421 70.8 97.2 -60.6 7.0 170.6 6.6 1.2 110 50 B N H 3> + 0 0 45 -3,-0.4 4,-2.5 1,-0.2 5,-0.4 0.684 62.0 80.9 -69.6 -15.1 171.2 7.1 -2.6 111 51 B I H <> S+ 0 0 83 -3,-1.9 4,-2.1 1,-0.3 -1,-0.2 0.908 95.3 43.0 -56.4 -42.2 174.2 9.1 -1.4 112 52 B T H <> S+ 0 0 49 -3,-1.0 4,-1.6 2,-0.2 -1,-0.3 0.738 108.8 61.8 -75.6 -23.0 176.0 5.8 -0.9 113 53 B N H X S+ 0 0 91 -4,-0.6 4,-0.9 2,-0.2 -2,-0.2 0.971 113.8 30.6 -67.0 -54.4 174.6 4.6 -4.2 114 54 B W H X S+ 0 0 148 -4,-2.5 4,-3.2 2,-0.2 5,-0.3 0.906 115.0 60.5 -71.7 -43.1 176.2 7.2 -6.4 115 55 B L H X S+ 0 0 91 -4,-2.1 4,-0.9 -5,-0.4 -3,-0.2 0.953 109.0 42.7 -48.6 -57.7 179.3 7.7 -4.3 116 56 B W H < S+ 0 0 202 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.792 113.9 55.7 -59.4 -27.8 180.3 4.1 -4.7 117 57 B Y H < S+ 0 0 191 -4,-0.9 -2,-0.2 1,-0.2 -1,-0.2 0.970 123.0 22.6 -69.3 -55.2 179.4 4.4 -8.4 118 58 B I H < 0 0 133 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.232 360.0 360.0 -95.8 12.5 181.7 7.4 -9.1 119 59 B K < 0 0 226 -4,-0.9 -1,-0.3 -5,-0.3 -2,-0.1 -0.287 360.0 360.0 49.2 360.0 183.9 6.5 -6.1 120 !* 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 0.0 121 1 C G 0 0 61 0, 0.0 2,-0.3 0, 0.0 -58,-0.0 0.000 360.0 360.0 360.0 -43.9 111.9 8.4 4.7 122 2 C Y - 0 0 149 -57,-0.1 -57,-0.1 -60,-0.1 -60,-0.0 -0.978 360.0-146.3-154.6 161.2 113.5 7.5 1.4 123 3 C I - 0 0 18 -2,-0.3 2,-0.1 -60,-0.1 -60,-0.1 -0.936 31.6 -96.3-131.5 154.6 115.8 9.0 -1.3 124 4 C P - 0 0 67 0, 0.0 -122,-0.2 0, 0.0 2,-0.0 -0.451 38.5-131.4 -71.3 140.1 116.0 8.7 -5.1 125 5 C E - 0 0 16 -124,-0.6 15,-0.1 -2,-0.1 -110,-0.0 -0.141 24.6-101.5 -80.3-178.1 118.5 6.1 -6.5 126 6 C A - 0 0 13 1,-0.2 -108,-0.1 7,-0.1 -1,-0.1 -0.495 44.6 -77.7-100.4 173.2 121.0 6.8 -9.3 127 7 C P - 0 0 70 0, 0.0 2,-0.5 0, 0.0 -109,-0.4 0.010 39.9-120.1 -60.8 175.2 120.9 5.8 -13.0 128 8 C R + 0 0 110 -111,-0.2 4,-0.1 1,-0.1 -112,-0.0 -0.870 63.1 121.7-126.0 96.6 121.7 2.3 -14.3 129 9 C D S S- 0 0 137 -2,-0.5 -1,-0.1 2,-0.2 3,-0.1 0.186 93.9 -82.3-136.5 11.3 124.6 2.1 -16.7 130 10 C G S S+ 0 0 32 1,-0.4 2,-0.1 -3,-0.1 -2,-0.1 0.263 97.5 116.9 101.9 -8.8 126.9 -0.3 -14.8 131 11 C Q - 0 0 100 -115,-0.0 -114,-1.1 1,-0.0 -1,-0.4 -0.353 54.8-136.8 -85.5 170.5 128.3 2.3 -12.6 132 12 C A E -C 16 0A 3 -116,-0.2 2,-0.3 -3,-0.1 11,-0.3 -0.930 17.2-175.4-129.6 153.5 127.9 2.5 -8.8 133 13 C Y E -C 15 0A 34 -118,-2.4 -118,-1.4 -2,-0.3 9,-0.2 -0.972 11.7-142.8-145.4 157.1 127.2 5.3 -6.3 134 14 C V E - F 0 141B 3 7,-1.7 7,-1.1 -2,-0.3 2,-0.9 -0.591 35.2 -88.3-113.9 176.8 127.0 5.7 -2.5 135 15 C R E +EF 73 140B 3 -62,-1.5 -62,-2.1 -2,-0.2 2,-0.3 -0.786 62.0 145.6 -92.3 107.9 124.7 7.7 -0.2 136 16 C K E > -EF 72 139B 63 3,-1.7 3,-2.7 -2,-0.9 -64,-0.2 -0.995 69.5 -16.3-144.9 136.6 126.2 11.2 0.3 137 17 C D T 3 S- 0 0 62 -66,-0.9 -69,-0.1 -2,-0.3 3,-0.1 0.810 121.3 -64.2 38.5 38.8 124.6 14.6 0.7 138 18 C G T 3 S+ 0 0 33 -71,-0.3 2,-0.3 1,-0.2 -1,-0.3 0.891 118.4 100.6 56.2 40.5 121.4 13.0 -0.6 139 19 C E E < S-F 136 0B 88 -3,-2.7 -3,-1.7 -5,-0.1 2,-0.5 -0.983 80.8 -94.7-151.6 159.8 123.1 12.4 -3.9 140 20 C W E -F 135 0B 111 -2,-0.3 2,-0.4 -5,-0.1 -5,-0.1 -0.654 40.9-179.5 -81.2 125.7 124.8 9.7 -5.9 141 21 C V E -F 134 0B 27 -7,-1.1 -7,-1.7 -2,-0.5 5,-0.1 -0.947 32.9-116.4-133.3 113.6 128.6 9.7 -5.6 142 22 C L >> - 0 0 64 -2,-0.4 3,-2.2 -9,-0.2 4,-0.5 -0.194 19.2-142.1 -46.4 119.0 130.8 7.2 -7.3 143 23 C L H >> S+ 0 0 2 1,-0.3 3,-2.5 -11,-0.3 4,-1.5 0.855 97.5 73.3 -54.0 -37.0 132.4 5.2 -4.6 144 24 C S H 3> S+ 0 0 56 1,-0.3 4,-0.6 -12,-0.2 -1,-0.3 0.805 89.2 60.6 -49.8 -29.0 135.6 5.2 -6.7 145 25 C T H <4 S+ 0 0 92 -3,-2.2 -1,-0.3 1,-0.2 3,-0.2 0.814 104.4 48.7 -68.2 -28.7 135.9 8.9 -5.7 146 26 C F H << S+ 0 0 60 -3,-2.5 -2,-0.2 -4,-0.5 -1,-0.2 0.759 103.6 59.1 -81.6 -25.4 136.1 7.7 -2.1 147 27 C L H < S- 0 0 51 -4,-1.5 2,-0.5 1,-0.1 -1,-0.2 0.628 109.3-126.9 -76.8 -11.2 138.7 5.1 -2.9 148 28 C G < - 0 0 31 -4,-0.6 3,-0.4 -5,-0.3 -1,-0.1 -0.328 26.2-148.5 96.9 -49.7 140.9 8.0 -4.2 149 29 C S S S- 0 0 39 -2,-0.5 -1,-0.2 1,-0.2 -5,-0.0 0.905 79.4 -1.7 45.5 102.2 141.5 6.5 -7.6 150 30 C S S S+ 0 0 81 -3,-0.1 -1,-0.2 1,-0.1 4,-0.2 0.091 117.4 88.8 79.2 -24.8 145.0 7.6 -8.8 151 31 C G S S- 0 0 48 -3,-0.4 -2,-0.1 1,-0.1 -1,-0.1 0.540 118.3 -5.2 -79.4 -6.9 145.2 9.6 -5.6 152 32 C N S >> S+ 0 0 89 -5,-0.0 4,-1.2 2,-0.0 3,-0.5 0.313 107.8 96.8-162.1 -8.1 146.7 6.6 -3.8 153 33 C E H 3> S+ 0 0 86 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.649 77.7 72.8 -64.8 -13.5 146.5 3.8 -6.3 154 34 C Q H 3> S+ 0 0 114 -4,-0.2 4,-1.6 2,-0.2 3,-0.4 0.973 97.6 41.8 -66.2 -55.5 150.1 4.8 -7.0 155 35 C E H <> S+ 0 0 44 -3,-0.5 4,-0.6 1,-0.2 -1,-0.2 0.787 114.3 55.5 -64.2 -23.7 151.4 3.4 -3.8 156 36 C L H < S+ 0 0 75 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.850 121.5 26.6 -73.6 -37.4 149.2 0.4 -4.4 157 37 C L H X S+ 0 0 97 -4,-1.9 4,-0.7 -3,-0.4 -2,-0.2 0.343 102.2 84.9-107.5 2.4 150.7 -0.3 -7.8 158 38 C E H >X S+ 0 0 55 -4,-1.6 4,-2.9 2,-0.2 3,-1.4 0.942 85.8 54.0 -70.4 -48.6 154.2 1.2 -7.3 159 39 C L H 3X S+ 0 0 68 -4,-0.6 4,-3.2 1,-0.3 5,-0.3 0.866 102.4 60.4 -54.4 -35.4 155.7 -1.9 -5.7 160 40 C D H 3> S+ 0 0 84 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.841 112.5 38.5 -60.4 -32.7 154.6 -3.8 -8.8 161 41 C K H < S+ 0 0 107 -4,-3.5 3,-0.6 -5,-0.3 -1,-0.2 0.835 113.1 43.0 -66.4 -34.3 163.5 -8.5 -9.3 168 48 C W H >< S+ 0 0 163 -4,-1.9 3,-0.8 -5,-0.2 -1,-0.2 0.597 101.6 70.2 -87.6 -11.5 165.7 -8.2 -12.4 169 49 C F T >< + 0 0 97 -4,-1.3 3,-1.1 1,-0.2 4,-0.5 0.330 69.1 96.4 -86.4 8.9 168.6 -6.9 -10.3 170 50 C N T <> + 0 0 31 -3,-0.6 4,-2.2 1,-0.3 5,-0.4 0.628 59.4 86.6 -70.5 -13.3 169.0 -10.3 -8.8 171 51 C I H <> S+ 0 0 87 -3,-0.8 4,-1.2 1,-0.3 -1,-0.3 0.882 94.0 41.6 -55.1 -38.0 171.6 -10.8 -11.4 172 52 C T H <> S+ 0 0 29 -3,-1.1 4,-1.4 2,-0.2 -1,-0.3 0.704 107.5 64.5 -81.2 -21.4 174.1 -9.3 -9.0 173 53 C N H > S+ 0 0 70 -4,-0.5 4,-0.8 -3,-0.2 -2,-0.2 0.970 110.6 33.7 -65.7 -54.1 172.5 -11.2 -6.1 174 54 C W H X S+ 0 0 145 -4,-2.2 4,-3.5 1,-0.2 5,-0.4 0.822 106.8 72.7 -71.1 -31.2 173.5 -14.6 -7.4 175 55 C L H X S+ 0 0 93 -4,-1.2 4,-0.9 -5,-0.4 -1,-0.2 0.943 101.2 42.8 -46.8 -56.6 176.7 -13.3 -8.9 176 56 C W H < S+ 0 0 180 -4,-1.4 -1,-0.3 2,-0.2 -2,-0.2 0.807 114.7 53.6 -60.6 -29.7 178.2 -12.9 -5.4 177 57 C Y H < S+ 0 0 200 -4,-0.8 -2,-0.2 1,-0.2 -1,-0.2 0.970 123.0 24.8 -69.5 -55.6 176.7 -16.3 -4.5 178 58 C I H < 0 0 130 -4,-3.5 -2,-0.2 1,-0.2 -1,-0.2 0.295 360.0 360.0 -91.8 8.9 178.3 -18.2 -7.4 179 59 C K < 0 0 222 -4,-0.9 -1,-0.2 -5,-0.4 -2,-0.1 -0.291 360.0 360.0 50.9 360.0 181.1 -15.7 -7.6