==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-NOV-07 2VG5 . COMPND 2 MOLECULE: REVERSE TRANSCRIPTASE/RIBONUCLEASE H; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR A.SPALLAROSSA,S.CESARINI,A.RANISE,M.PONASSI,T.UNGE, . 952 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45976.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 583 61.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 37 3.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 122 12.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 5 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 53 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 244 25.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 0.9 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 2 1 2 0 1 0 2 2 1 1 3 1 0 1 3 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 0 5 0 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 . 6 4 6 2 3 5 1 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 . 4 2 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 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 P 0 0 76 0, 0.0 2,-0.4 0, 0.0 209,-0.1 0.000 360.0 360.0 360.0-160.7 32.3 3.2 30.5 2 2 A I - 0 0 62 207,-0.0 111,-0.2 141,-0.0 110,-0.1 -0.927 360.0-120.1-136.3 115.1 34.3 6.4 30.0 3 3 A S - 0 0 3 109,-3.5 205,-0.2 -2,-0.4 204,-0.1 -0.174 5.0-140.5 -58.2 136.2 34.2 8.0 26.6 4 4 A P + 0 0 95 0, 0.0 -1,-0.2 0, 0.0 204,-0.1 0.345 63.3 128.9 -73.5 3.7 37.5 8.5 24.7 5 5 A I S S- 0 0 18 202,-0.4 2,-0.1 1,-0.1 153,-0.1 -0.282 70.3-100.8 -56.4 146.9 36.2 11.9 23.6 6 6 A E - 0 0 163 1,-0.1 2,-0.1 152,-0.1 -1,-0.1 -0.379 43.0-111.5 -70.2 151.4 38.6 14.8 24.3 7 7 A T - 0 0 44 108,-0.1 108,-0.1 -3,-0.1 -1,-0.1 -0.458 18.6-114.8 -88.6 159.8 37.8 16.9 27.4 8 8 A V - 0 0 14 106,-0.3 108,-0.5 -2,-0.1 2,-0.2 -0.809 32.2-118.7 -92.7 121.5 36.7 20.5 27.7 9 9 A P - 0 0 79 0, 0.0 2,-0.3 0, 0.0 -1,-0.0 -0.415 38.1-168.5 -56.6 122.9 39.2 22.8 29.3 10 10 A V - 0 0 9 -2,-0.2 2,-0.3 70,-0.0 592,-0.0 -0.785 7.5-172.5-113.1 161.0 37.6 24.2 32.5 11 11 A K - 0 0 153 -2,-0.3 2,-0.1 591,-0.0 108,-0.0 -0.995 23.6-119.8-149.2 151.2 38.6 27.0 34.8 12 12 A L - 0 0 26 -2,-0.3 67,-0.3 1,-0.1 68,-0.2 -0.382 56.5 -76.2 -74.9 167.5 37.7 28.6 38.1 13 13 A K > - 0 0 68 65,-2.1 3,-1.3 66,-0.5 -1,-0.1 -0.387 54.1 -96.4 -68.7 149.0 36.6 32.3 38.1 14 14 A P T 3 S+ 0 0 140 0, 0.0 2,-0.6 0, 0.0 -2,-0.1 0.775 116.7 31.7 -31.8 -64.7 39.4 34.9 37.7 15 15 A G T 3 S+ 0 0 75 2,-0.0 2,-0.3 0, 0.0 -2,-0.1 -0.366 105.4 86.1-102.4 55.7 40.0 35.7 41.4 16 16 A M < - 0 0 91 -3,-1.3 2,-0.3 -2,-0.6 -4,-0.1 -0.967 54.3-146.6-150.1 161.5 39.2 32.5 43.2 17 17 A D - 0 0 61 -2,-0.3 -4,-0.1 1,-0.3 3,-0.1 -0.781 42.6 -70.3-124.3 168.3 40.7 29.1 44.3 18 18 A G - 0 0 1 -2,-0.3 -1,-0.3 1,-0.1 2,-0.2 0.104 63.0 -85.2 -49.9 170.6 39.3 25.6 44.6 19 19 A P - 0 0 0 0, 0.0 38,-1.3 0, 0.0 -1,-0.1 -0.550 38.4-179.9 -84.7 150.0 36.9 24.8 47.4 20 20 A K B +a 57 0A 122 36,-0.2 2,-0.3 -2,-0.2 38,-0.2 -0.147 19.6 152.0-142.8 41.5 38.0 23.8 50.9 21 21 A V - 0 0 40 36,-1.1 2,-0.0 1,-0.1 53,-0.0 -0.608 45.8-116.2 -78.3 133.7 35.0 23.2 53.0 22 22 A K - 0 0 139 -2,-0.3 2,-0.5 1,-0.1 -1,-0.1 -0.275 27.1-107.0 -70.9 156.4 35.6 20.7 55.9 23 23 A Q - 0 0 21 36,-0.1 -1,-0.1 35,-0.1 104,-0.0 -0.719 24.2-142.0 -89.9 124.7 33.8 17.3 56.1 24 24 A W - 0 0 183 -2,-0.5 36,-0.1 36,-0.1 108,-0.0 -0.777 31.8-107.7 -91.5 110.5 31.1 16.9 58.7 25 25 A P - 0 0 59 0, 0.0 2,-0.2 0, 0.0 107,-0.1 0.149 37.5-154.2 -36.1 138.7 31.2 13.4 60.3 26 26 A L - 0 0 36 105,-0.3 2,-0.0 103,-0.3 35,-0.0 -0.534 24.4 -77.7-111.6 179.5 28.4 11.1 59.3 27 27 A T > - 0 0 62 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.299 45.8-101.7 -77.6 162.2 26.7 8.1 60.9 28 28 A E H > S+ 0 0 120 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.904 119.9 41.7 -47.3 -54.7 28.2 4.6 61.0 29 29 A E H > S+ 0 0 102 2,-0.2 4,-3.6 1,-0.2 -1,-0.2 0.880 110.3 55.5 -68.6 -40.2 26.1 3.1 58.2 30 30 A K H > S+ 0 0 68 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.902 108.4 50.6 -57.8 -41.9 26.3 6.2 55.9 31 31 A I H X S+ 0 0 20 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.953 112.4 46.8 -54.8 -50.6 30.1 5.7 56.2 32 32 A K H X S+ 0 0 132 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.897 110.5 52.2 -60.6 -42.5 29.6 2.1 55.3 33 33 A A H X S+ 0 0 4 -4,-3.6 4,-2.3 1,-0.2 -1,-0.2 0.902 110.9 47.9 -61.1 -42.8 27.3 3.0 52.4 34 34 A L H X S+ 0 0 0 -4,-2.4 4,-3.4 2,-0.2 5,-0.3 0.947 107.0 54.1 -63.9 -51.9 29.9 5.5 51.0 35 35 A V H X S+ 0 0 63 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.857 111.8 47.5 -53.0 -38.1 32.8 3.1 51.2 36 36 A E H X S+ 0 0 104 -4,-1.7 4,-2.0 -5,-0.2 3,-0.2 0.974 114.3 43.8 -65.7 -56.9 30.8 0.6 49.2 37 37 A I H X S+ 0 0 40 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.887 113.7 51.8 -57.2 -42.6 29.7 3.0 46.5 38 38 A C H X S+ 0 0 0 -4,-3.4 4,-2.0 1,-0.2 -1,-0.2 0.839 107.8 51.0 -67.1 -35.5 33.1 4.6 46.2 39 39 A T H X S+ 0 0 74 -4,-1.4 4,-1.8 -5,-0.3 -1,-0.2 0.907 111.2 49.6 -67.6 -38.6 34.9 1.2 45.7 40 40 A E H X S+ 0 0 108 -4,-2.0 4,-1.2 2,-0.2 3,-0.4 0.974 114.5 42.0 -63.9 -55.5 32.4 0.3 43.0 41 41 A M H X>S+ 0 0 12 -4,-2.6 5,-1.4 1,-0.2 4,-1.3 0.880 110.1 61.2 -55.8 -39.7 32.8 3.6 41.1 42 42 A E H <5S+ 0 0 63 -4,-2.0 3,-0.5 1,-0.3 -1,-0.2 0.892 102.3 49.1 -58.9 -42.3 36.6 3.4 41.7 43 43 A K H <5S+ 0 0 139 -4,-1.8 -1,-0.3 -3,-0.4 -2,-0.2 0.787 110.8 52.1 -66.4 -27.8 36.8 0.1 39.8 44 44 A E H <5S- 0 0 92 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.668 116.8-114.3 -83.9 -17.2 34.9 1.7 36.9 45 45 A G T <5S+ 0 0 24 -4,-1.3 -3,-0.2 -3,-0.5 -2,-0.1 0.259 81.7 122.5 103.9 -8.4 37.3 4.7 36.8 46 46 A K S - 0 0 34 -2,-0.3 3,-0.6 1,-0.1 -1,-0.0 -0.231 46.7 -92.7 -66.5 161.7 47.5 11.8 48.3 52 52 A P T 3 S+ 0 0 118 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.343 108.6 93.0 -63.2 11.1 47.1 14.3 51.1 53 53 A E T 3 + 0 0 134 2,-0.1 -3,-0.0 1,-0.0 0, 0.0 0.997 55.4 87.7 -63.1 -74.0 48.4 16.9 48.6 54 54 A N < - 0 0 28 -3,-0.6 -4,-0.1 1,-0.2 -1,-0.0 0.029 60.1-166.3 -32.5 101.2 45.1 18.2 47.2 55 55 A P + 0 0 76 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.467 61.2 97.3 -72.0 -0.8 44.3 20.9 49.7 56 56 A Y + 0 0 33 65,-0.2 2,-0.3 -36,-0.0 -36,-0.2 -0.661 44.9 160.5 -96.7 144.4 40.8 20.9 48.3 57 57 A N B -a 20 0A 13 -38,-1.3 -36,-1.1 -2,-0.3 68,-0.3 -0.940 18.1-164.9-159.1 140.3 37.8 19.1 49.6 58 58 A T - 0 0 2 66,-1.2 68,-0.4 -2,-0.3 -35,-0.1 -0.996 38.8 -96.5-128.0 135.4 34.0 19.3 49.2 59 59 A P - 0 0 21 0, 0.0 12,-0.6 0, 0.0 2,-0.3 -0.056 38.9-166.5 -51.8 145.1 31.5 17.7 51.6 60 60 A V E +D 70 0C 3 66,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.964 12.2 162.2-131.8 151.0 30.1 14.3 50.7 61 61 A F E -D 69 0C 74 8,-2.4 8,-3.0 -2,-0.3 2,-0.3 -0.970 24.6-125.9-159.7 171.8 27.1 12.4 52.1 62 62 A A E -D 68 0C 1 -2,-0.3 2,-0.3 6,-0.3 6,-0.2 -0.920 14.0-166.3-130.5 151.5 24.7 9.5 51.5 63 63 A I E D 67 0C 87 4,-2.1 4,-2.1 -2,-0.3 -2,-0.0 -0.996 360.0 360.0-140.4 140.5 20.9 9.1 51.5 64 64 A K 0 0 193 -2,-0.3 -1,-0.1 2,-0.2 3,-0.0 0.335 360.0 360.0 -96.3 360.0 18.5 6.1 51.4 65 ! 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 66 71 A W 0 0 132 0, 0.0 2,-0.3 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 120.0 21.8 3.9 49.3 67 72 A R E -D 63 0C 165 -4,-2.1 -4,-2.1 -3,-0.0 2,-0.6 -0.934 360.0-114.2-132.9 161.7 23.2 6.6 47.0 68 73 A K E -D 62 0C 24 -2,-0.3 2,-0.5 -6,-0.2 -6,-0.3 -0.836 23.7-169.5-103.3 119.6 26.0 9.1 47.2 69 74 A L E -D 61 0C 73 -8,-3.0 -8,-2.4 -2,-0.6 2,-0.6 -0.925 2.4-166.2-107.0 122.8 25.2 12.9 47.2 70 75 A V E -D 60 0C 20 -2,-0.5 2,-0.4 -10,-0.2 77,-0.3 -0.921 15.6-140.9-110.7 109.8 28.1 15.3 46.8 71 76 A D + 0 0 28 -2,-0.6 4,-0.1 -12,-0.6 3,-0.1 -0.541 23.0 176.2 -68.5 124.1 27.3 18.9 47.6 72 77 A F > + 0 0 7 -2,-0.4 4,-3.6 75,-0.2 5,-0.2 0.161 35.6 123.5-118.1 16.9 29.1 21.2 45.1 73 78 A R H > S+ 0 0 173 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.896 81.1 42.1 -44.0 -52.9 27.8 24.6 46.1 74 79 A E H > S+ 0 0 73 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.915 115.1 47.2 -67.8 -46.9 31.3 26.0 46.7 75 80 A L H > S+ 0 0 0 2,-0.2 4,-1.4 3,-0.2 -1,-0.2 0.946 116.2 49.2 -57.5 -45.0 33.0 24.4 43.7 76 81 A N H >< S+ 0 0 37 -4,-3.6 3,-2.2 2,-0.2 -2,-0.2 0.989 110.9 45.0 -54.7 -69.2 30.0 25.7 41.7 77 82 A K H 3< S+ 0 0 118 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.810 121.5 44.0 -44.9 -31.0 30.1 29.3 43.0 78 83 A R H 3< S+ 0 0 66 -4,-2.0 -65,-2.1 -5,-0.3 -1,-0.3 0.598 101.7 74.6 -93.0 -15.6 33.8 29.1 42.4 79 84 A T S << S- 0 0 0 -3,-2.2 -66,-0.5 -4,-1.4 2,-0.3 0.839 86.3-104.0 -67.5-109.7 33.8 27.4 39.0 80 85 A Q - 0 0 25 -68,-0.2 2,-0.4 -4,-0.1 -1,-0.2 -0.895 28.1 -79.1-163.1-171.3 32.8 29.5 36.0 81 86 A D - 0 0 59 -2,-0.3 2,-0.3 521,-0.1 524,-0.1 -0.888 39.2-165.8-109.4 140.2 30.1 30.3 33.5 82 87 A F - 0 0 24 -2,-0.4 2,-0.2 522,-0.1 520,-0.2 -0.773 40.1 -73.8-117.0 166.1 29.4 28.1 30.5 83 88 A W - 0 0 43 518,-2.3 522,-0.1 -2,-0.3 523,-0.0 -0.446 67.9 -97.1 -57.5 121.5 27.4 28.6 27.3 84 89 A E - 0 0 90 520,-0.3 -1,-0.1 -2,-0.2 3,-0.1 -0.087 32.1-167.8 -44.1 132.2 23.7 28.3 28.4 85 90 A V S S+ 0 0 64 1,-0.1 2,-1.1 -3,-0.1 3,-0.3 0.724 76.9 77.1 -88.8 -28.7 22.2 24.9 27.9 86 91 A Q + 0 0 151 1,-0.2 -1,-0.1 3,-0.0 -2,-0.1 -0.696 57.6 122.9 -86.1 95.8 18.7 26.3 28.6 87 92 A L S S- 0 0 90 -2,-1.1 2,-0.2 1,-0.2 -1,-0.2 0.714 70.9 -26.5-123.9 -44.5 17.9 28.1 25.3 88 93 A G - 0 0 33 -3,-0.3 -1,-0.2 598,-0.1 0, 0.0 -0.836 44.7-133.2 178.0 137.3 14.7 26.8 23.7 89 94 A I - 0 0 64 -2,-0.2 598,-0.1 -3,-0.1 597,-0.1 -0.890 33.9-118.2-104.8 118.0 12.5 23.8 23.6 90 95 A P - 0 0 6 0, 0.0 596,-0.1 0, 0.0 595,-0.1 -0.189 27.1-127.4 -49.8 142.9 11.4 22.7 20.1 91 96 A H > - 0 0 20 1,-0.1 3,-1.9 286,-0.1 4,-0.4 -0.831 11.1-130.1 -91.7 137.7 7.6 22.9 19.8 92 97 A P G > S+ 0 0 1 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.804 105.1 66.3 -53.9 -31.4 6.0 19.6 18.5 93 98 A A G 3 S+ 0 0 0 1,-0.3 221,-0.1 220,-0.1 252,-0.1 0.656 96.0 56.7 -69.7 -14.9 4.1 21.6 15.9 94 99 A G G < S+ 0 0 1 -3,-1.9 -1,-0.3 219,-0.1 2,-0.1 0.562 85.3 109.6 -89.3 -10.0 7.4 22.5 14.2 95 100 A L < - 0 0 50 -3,-1.5 219,-2.1 -4,-0.4 2,-0.3 -0.415 69.0-127.7 -71.9 135.9 8.3 18.8 13.8 96 101 A K - 0 0 61 217,-0.2 219,-0.1 -2,-0.1 -1,-0.1 -0.620 38.1 -99.1 -74.0 141.9 8.3 17.2 10.3 97 102 A K - 0 0 128 217,-0.4 2,-0.3 -2,-0.3 135,-0.2 -0.314 43.6-158.8 -60.6 144.3 6.3 13.9 10.2 98 103 A K - 0 0 41 133,-2.6 89,-0.2 1,-0.1 3,-0.1 -0.901 22.7-144.3-128.2 159.4 8.3 10.7 10.5 99 104 A K S S+ 0 0 135 87,-1.6 2,-0.4 -2,-0.3 88,-0.2 0.902 88.3 20.5 -88.4 -47.6 7.8 7.1 9.6 100 105 A S E -E 186 0D 16 86,-2.7 86,-1.3 89,-0.1 2,-0.4 -0.991 66.6-174.4-127.2 131.8 9.6 5.4 12.5 101 106 A V E +E 185 0D 31 -2,-0.4 2,-0.3 84,-0.2 84,-0.2 -0.983 8.1 166.8-127.4 137.9 10.5 6.9 15.9 102 107 A T E -E 184 0D 10 82,-2.5 82,-3.1 -2,-0.4 2,-0.5 -0.992 21.4-142.7-148.3 147.6 12.5 5.4 18.7 103 108 A V E -E 183 0D 6 115,-1.0 2,-0.4 -2,-0.3 80,-0.2 -0.960 11.6-171.9-122.6 125.2 14.1 6.8 21.9 104 109 A L E -E 182 0D 0 78,-2.9 78,-3.5 -2,-0.5 2,-0.4 -0.942 8.2-156.9-111.7 133.5 17.4 5.8 23.5 105 110 A D E -E 181 0D 61 -2,-0.4 2,-0.5 76,-0.3 76,-0.3 -0.891 18.2-125.4-107.8 142.2 18.5 6.9 26.9 106 111 A V > - 0 0 1 74,-3.2 3,-0.8 -2,-0.4 105,-0.2 -0.731 23.0-131.2 -86.4 125.9 22.2 7.1 27.9 107 112 A G T 3 S- 0 0 27 103,-1.6 103,-0.3 -2,-0.5 5,-0.1 -0.500 84.7 -7.4 -73.6 144.2 23.1 5.2 31.1 108 113 A D T 3> S+ 0 0 110 -2,-0.2 4,-1.2 1,-0.1 -1,-0.3 0.832 82.7 179.2 33.9 51.1 25.2 7.0 33.6 109 114 A A T X4 S+ 0 0 2 -3,-0.8 3,-1.5 1,-0.2 4,-0.3 0.911 72.9 41.6 -44.0 -65.2 25.6 9.8 31.1 110 115 A Y G >4 S+ 0 0 38 1,-0.3 3,-2.0 2,-0.2 34,-0.9 0.905 114.6 50.6 -52.7 -50.5 27.7 12.2 33.2 111 116 A F G 34 S+ 0 0 27 1,-0.3 -1,-0.3 32,-0.2 -2,-0.2 0.637 103.1 64.0 -65.8 -11.8 29.8 9.4 34.6 112 117 A S G << S+ 0 0 2 -3,-1.5 -109,-3.5 -4,-1.2 -1,-0.3 0.523 93.9 74.4 -86.6 -6.4 30.4 8.3 31.0 113 118 A V S < S- 0 0 3 -3,-2.0 31,-2.1 -4,-0.3 42,-0.1 -0.929 82.2-118.5-119.7 132.1 32.2 11.5 30.1 114 119 A P B -G 143 0E 13 0, 0.0 2,-0.4 0, 0.0 -106,-0.3 -0.147 20.3-137.2 -62.5 153.1 35.7 12.6 31.1 115 120 A L - 0 0 1 27,-1.9 5,-0.2 -108,-0.1 -108,-0.1 -0.914 38.5 -86.7-111.7 139.8 36.5 15.6 33.2 116 121 A D >> - 0 0 19 -108,-0.5 3,-1.6 -2,-0.4 4,-0.9 -0.183 36.3-136.9 -44.2 126.1 39.3 18.0 32.3 117 122 A E H >> S+ 0 0 110 1,-0.3 3,-1.3 2,-0.2 4,-0.6 0.921 101.7 56.5 -54.5 -48.4 42.4 16.6 34.0 118 123 A D H 34 S+ 0 0 105 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.575 112.0 45.3 -63.7 -8.2 43.7 20.0 35.2 119 124 A F H X4 S+ 0 0 2 -3,-1.6 3,-1.6 2,-0.1 4,-0.3 0.572 86.6 87.3-109.8 -15.0 40.3 20.4 37.0 120 125 A R H X< S+ 0 0 54 -3,-1.3 3,-1.7 -4,-0.9 21,-0.6 0.838 79.9 65.1 -58.5 -33.8 40.0 16.9 38.6 121 126 A K G >< S+ 0 0 72 -4,-0.6 3,-0.9 1,-0.3 -1,-0.3 0.764 93.1 61.2 -61.1 -26.8 41.9 18.0 41.7 122 127 A Y G < S+ 0 0 45 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.598 95.7 61.0 -77.3 -13.0 39.2 20.5 42.7 123 128 A T G < S+ 0 0 0 -3,-1.7 -1,-0.2 -4,-0.3 -65,-0.2 0.492 73.4 136.6 -92.2 -3.8 36.6 17.8 43.0 124 129 A A < + 0 0 0 -3,-0.9 -66,-1.2 -4,-0.3 2,-0.3 -0.124 28.9 177.1 -48.4 129.4 38.5 16.0 45.8 125 130 A F E -C 139 0B 0 14,-3.5 14,-2.5 -68,-0.3 2,-0.4 -0.929 21.0-122.7-135.4 162.9 36.2 14.9 48.6 126 131 A T E -C 138 0B 25 -68,-0.4 -66,-0.3 -2,-0.3 12,-0.2 -0.876 1.4-146.5-115.6 136.0 36.7 12.9 51.9 127 132 A I E -C 137 0B 5 10,-2.2 10,-1.1 -2,-0.4 -66,-0.0 -0.883 35.5-133.3 -92.0 112.5 35.2 9.8 53.3 128 133 A P - 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0 0 20 1,-0.1 -35,-0.0 2,-0.0 -2,-0.0 -0.033 69.9-129.1 -53.8 161.0 24.1 49.5 6.6 938 1409 B T S S+ 0 0 12 -205,-0.2 2,-0.3 -238,-0.0 -314,-0.2 0.504 86.0 61.6 -93.4 -9.6 27.0 47.7 8.3 939 1410 B W - 0 0 9 -316,-0.1 -3,-0.1 -314,-0.1 -314,-0.1 -0.747 68.7-143.5-113.0 165.9 26.4 49.4 11.7 940 1411 B I - 0 0 22 -2,-0.3 2,-0.2 -239,-0.2 -25,-0.1 -0.994 14.0-145.5-131.3 125.4 23.5 49.4 14.2 941 1412 B P - 0 0 0 0, 0.0 2,-0.4 0, 0.0 -24,-0.1 -0.491 29.8 -97.7 -84.0 157.0 22.5 52.4 16.3 942 1413 B E - 0 0 44 -26,-0.4 -24,-2.8 -2,-0.2 2,-0.2 -0.616 52.4-179.6 -69.2 128.3 21.1 52.4 19.8 943 1414 B W E -l 918 0T 36 -2,-0.4 2,-0.3 -26,-0.3 -24,-0.2 -0.570 17.8-172.4-123.5-169.6 17.4 52.6 19.7 944 1415 B E E -l 919 0T 88 -26,-0.7 -24,-2.6 -2,-0.2 2,-0.3 -0.888 24.1-115.3 177.3 143.7 14.4 52.7 22.0 945 1416 B F E +l 920 0T 51 -2,-0.3 2,-0.2 -26,-0.2 -22,-0.1 -0.769 39.6 150.2-109.6 142.4 10.6 52.7 21.6 946 1417 B V - 0 0 42 -26,-1.7 2,-0.5 -2,-0.3 -24,-0.1 -0.827 41.5 -97.3-153.3-174.5 8.1 55.4 22.5 947 1418 B N - 0 0 104 -2,-0.2 -545,-0.1 -26,-0.1 -27,-0.0 -0.952 33.7-123.1-129.5 112.8 4.8 57.1 21.8 948 1419 B T - 0 0 7 -2,-0.5 -547,-0.1 -547,-0.1 -85,-0.0 -0.339 28.8-125.1 -58.3 106.0 4.6 60.2 19.6 949 1420 B P >> - 0 0 50 0, 0.0 3,-1.5 0, 0.0 4,-1.1 -0.427 25.0-124.4 -50.7 113.5 2.9 62.9 21.8 950 1421 B P H 3> S+ 0 0 18 0, 0.0 4,-0.7 0, 0.0 -2,-0.1 0.754 106.8 47.9 -32.2 -52.5 -0.1 63.9 19.6 951 1422 B L H >> S+ 0 0 5 2,-0.2 4,-1.8 1,-0.2 3,-0.8 0.859 104.0 60.9 -66.0 -38.4 0.8 67.6 19.5 952 1423 B V H X> S+ 0 0 9 -3,-1.5 3,-1.2 1,-0.3 4,-0.9 0.979 97.5 57.0 -50.8 -65.2 4.5 67.0 18.7 953 1424 B K H 3< S+ 0 0 50 -4,-1.1 3,-0.3 1,-0.3 -1,-0.3 0.773 111.1 47.3 -32.1 -37.0 3.7 65.3 15.4 954 1425 B L H X< S+ 0 0 80 -3,-0.8 3,-1.5 -4,-0.7 -1,-0.3 0.849 102.5 57.8 -84.4 -36.8 1.8 68.4 14.5 955 1426 B W H << S+ 0 0 10 -4,-1.8 -1,-0.2 -3,-1.2 -2,-0.2 0.510 108.6 50.1 -75.2 -2.2 4.3 71.1 15.5 956 1427 B Y T 3< 0 0 25 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.2 0.187 360.0 360.0-119.9 13.8 6.9 69.5 13.1 957 1428 B Q < 0 0 120 -3,-1.5 -2,-0.1 -5,-0.2 -3,-0.1 0.940 360.0 360.0 -68.6 360.0 4.7 69.3 10.0