==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 10-NOV-06 2NV3 . COMPND 2 MOLECULE: GAG POLYPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR J.S.SAAD,E.LOELIGER,P.LUNCSFORD,M.LIRIANO,J.TAI,A.KIM, . 131 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10829.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 101 77.1 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 . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 7 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 18.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 62 47.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 2 0 0 0 0 1 0 1 0 0 0 2 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 . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 G 0 0 115 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-152.2 9.6 13.2 -5.5 2 3 A A + 0 0 114 1,-0.2 2,-0.5 2,-0.0 0, 0.0 0.449 360.0 66.6 -84.7 -1.0 13.4 13.6 -5.9 3 4 A R + 0 0 228 2,-0.0 2,-0.2 0, 0.0 -1,-0.2 -0.840 66.6 158.2-125.4 94.2 13.9 12.5 -2.3 4 5 A A + 0 0 73 -2,-0.5 -2,-0.0 -3,-0.1 47,-0.0 -0.649 21.4 172.5-110.8 169.0 13.0 8.9 -1.6 5 6 A S + 0 0 113 -2,-0.2 -1,-0.0 46,-0.1 3,-0.0 0.032 62.0 77.3-167.7 38.4 14.0 6.5 1.1 6 7 A V S S- 0 0 56 46,-0.1 5,-0.1 0, 0.0 -2,-0.0 0.716 102.8 -83.9-117.3 -56.4 11.8 3.4 0.8 7 8 A A - 0 0 50 3,-0.1 -3,-0.1 4,-0.0 0, 0.0 -0.105 32.4-152.1-179.6 -67.0 13.1 1.3 -2.1 8 9 A S S S+ 0 0 119 1,-0.1 -4,-0.0 -3,-0.0 0, 0.0 0.985 90.6 12.8 68.6 60.7 12.0 2.2 -5.6 9 10 A G S > S+ 0 0 47 0, 0.0 4,-0.8 0, 0.0 -1,-0.1 -0.182 121.3 59.6 138.8 -45.0 12.2 -1.2 -7.3 10 11 A G H >> S+ 0 0 49 2,-0.2 4,-1.2 1,-0.1 3,-1.0 0.975 106.8 41.6 -77.9 -61.1 12.7 -3.7 -4.5 11 12 A E H 3> S+ 0 0 46 1,-0.3 4,-3.2 2,-0.2 5,-0.2 0.845 106.2 68.2 -55.3 -35.1 9.5 -3.2 -2.4 12 13 A L H 3> S+ 0 0 70 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.901 98.3 50.2 -51.4 -45.4 7.6 -2.9 -5.6 13 14 A D H << S+ 0 0 119 -3,-1.0 -1,-0.2 -4,-0.8 -2,-0.2 0.896 112.8 46.3 -61.3 -41.7 8.3 -6.6 -6.3 14 15 A K H >X S+ 0 0 96 -4,-1.2 3,-1.3 2,-0.2 4,-1.1 0.897 106.4 59.4 -68.3 -41.5 7.1 -7.6 -2.8 15 16 A W H >< S+ 0 0 13 -4,-3.2 3,-1.2 1,-0.3 13,-0.5 0.941 108.6 42.9 -52.0 -53.9 4.0 -5.4 -3.1 16 17 A E T 3< S+ 0 0 79 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.515 106.7 67.5 -71.8 -3.4 2.7 -7.3 -6.1 17 18 A K T <4 S+ 0 0 113 -3,-1.3 2,-0.3 -5,-0.2 -1,-0.2 0.734 81.2 89.3 -87.0 -25.5 3.7 -10.4 -4.3 18 19 A I S << S- 0 0 7 -3,-1.2 10,-2.0 -4,-1.1 2,-0.2 -0.558 77.1-130.3 -76.8 134.4 1.1 -10.0 -1.6 19 20 A R B -A 27 0A 110 75,-0.4 77,-1.7 -2,-0.3 8,-0.3 -0.568 2.6-140.3 -85.2 147.9 -2.3 -11.6 -2.3 20 21 A L S S+ 0 0 36 6,-2.6 7,-0.2 -2,-0.2 -1,-0.1 0.803 88.1 35.2 -75.1 -30.1 -5.5 -9.7 -1.9 21 22 A R S S- 0 0 139 5,-0.7 3,-0.1 75,-0.1 75,-0.1 -0.833 78.5-124.0-123.7 161.8 -7.3 -12.7 -0.4 22 23 A P S S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.900 112.9 16.0 -69.8 -42.8 -6.2 -15.6 1.9 23 24 A G S S+ 0 0 77 -3,-0.0 2,-0.1 -4,-0.0 72,-0.0 0.056 111.6 97.2-120.1 24.2 -7.3 -18.3 -0.5 24 25 A G - 0 0 20 2,-0.1 -5,-0.0 -3,-0.1 0, 0.0 -0.244 69.7-131.3-100.4-169.2 -7.6 -16.3 -3.7 25 26 A K S S+ 0 0 178 -2,-0.1 2,-0.1 2,-0.1 -1,-0.1 0.412 70.3 107.8-122.1 -6.6 -5.4 -15.7 -6.7 26 27 A K - 0 0 130 -7,-0.1 -6,-2.6 1,-0.0 -5,-0.7 -0.447 48.6-168.1 -75.4 147.8 -5.7 -11.9 -6.8 27 28 A Q B -A 19 0A 77 -8,-0.3 -8,-0.2 -7,-0.2 2,-0.2 -0.717 27.4 -82.1-127.9 178.3 -2.7 -9.7 -5.8 28 29 A Y + 0 0 5 -10,-2.0 2,-0.3 -13,-0.5 -10,-0.1 -0.590 45.8 179.4 -85.5 145.5 -1.9 -6.1 -5.0 29 30 A K >> - 0 0 108 -2,-0.2 3,-2.1 1,-0.1 4,-0.9 -0.904 46.6 -93.2-140.0 167.5 -1.2 -3.6 -7.7 30 31 A L H 3> S+ 0 0 96 1,-0.3 4,-1.8 -2,-0.3 5,-0.5 0.878 116.4 73.1 -47.4 -43.3 -0.4 0.1 -8.2 31 32 A K H 3> S+ 0 0 174 1,-0.3 4,-1.7 2,-0.2 -1,-0.3 0.840 97.5 49.7 -40.3 -41.3 -4.1 0.8 -8.6 32 33 A H H <> S+ 0 0 45 -3,-2.1 4,-2.0 2,-0.2 -1,-0.3 0.927 114.2 42.7 -68.3 -46.5 -4.4 0.2 -4.9 33 34 A I H X S+ 0 0 58 -4,-0.9 4,-3.4 -3,-0.4 3,-0.4 0.994 115.6 45.6 -63.1 -65.6 -1.6 2.6 -3.9 34 35 A V H X S+ 0 0 91 -4,-1.8 4,-2.3 1,-0.3 5,-0.2 0.883 115.3 49.7 -43.1 -48.2 -2.4 5.4 -6.2 35 36 A W H X S+ 0 0 88 -4,-1.7 4,-2.3 -5,-0.5 -1,-0.3 0.904 114.3 44.7 -60.1 -43.1 -6.1 5.1 -5.2 36 37 A A H X S+ 0 0 2 -4,-2.0 4,-2.7 -3,-0.4 -2,-0.2 0.948 111.1 51.8 -66.7 -50.4 -5.1 5.1 -1.5 37 38 A S H X S+ 0 0 36 -4,-3.4 4,-1.5 1,-0.2 -2,-0.2 0.895 113.1 46.9 -53.5 -43.4 -2.6 8.0 -1.8 38 39 A R H >X S+ 0 0 189 -4,-2.3 4,-0.9 -5,-0.3 3,-0.6 0.980 110.4 49.6 -63.4 -59.1 -5.3 10.1 -3.5 39 40 A E H >X S+ 0 0 26 -4,-2.3 3,-1.7 1,-0.3 4,-1.5 0.903 108.1 55.5 -46.3 -49.5 -8.1 9.4 -1.1 40 41 A L H 3<>S+ 0 0 1 -4,-2.7 5,-2.9 1,-0.3 3,-0.4 0.896 98.2 61.8 -52.1 -44.1 -5.8 10.2 1.8 41 42 A E H <<5S+ 0 0 136 -4,-1.5 3,-0.5 -3,-0.6 -1,-0.3 0.784 107.3 46.0 -54.0 -27.6 -5.2 13.6 0.2 42 43 A R H <<5S+ 0 0 215 -3,-1.7 -1,-0.3 -4,-0.9 -2,-0.2 0.774 104.1 60.7 -85.9 -29.7 -8.9 14.2 0.7 43 44 A F T <5S- 0 0 93 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.015 123.8-101.1 -86.8 29.0 -9.0 12.9 4.2 44 45 A A T 5S+ 0 0 99 -3,-0.5 2,-0.5 1,-0.2 -3,-0.2 0.773 89.6 125.8 57.7 26.1 -6.5 15.7 5.2 45 46 A V < - 0 0 5 -5,-2.9 -2,-0.2 -6,-0.2 -1,-0.2 -0.955 62.3-127.0-121.9 115.5 -3.8 13.0 5.1 46 47 A N > - 0 0 116 -2,-0.5 3,-1.4 1,-0.1 4,-0.2 -0.269 13.8-132.1 -58.6 139.3 -0.7 13.5 3.0 47 48 A P G > S+ 0 0 46 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.562 102.3 71.2 -69.7 -7.8 -0.0 10.6 0.5 48 49 A G G >> S+ 0 0 38 1,-0.2 3,-2.3 2,-0.1 4,-0.6 0.671 75.4 79.1 -82.4 -17.6 3.6 10.7 1.7 49 50 A L G X4 S+ 0 0 56 -3,-1.4 3,-0.6 1,-0.3 7,-0.6 0.789 86.7 60.6 -59.8 -27.6 2.7 9.2 5.1 50 51 A L G <4 S+ 0 0 16 -3,-0.5 -1,-0.3 -4,-0.2 -2,-0.1 0.499 88.5 76.0 -78.1 -3.4 2.5 5.8 3.4 51 52 A E G <4 S+ 0 0 80 -3,-2.3 2,-0.4 1,-0.2 -1,-0.2 0.882 98.1 41.6 -74.1 -40.0 6.2 6.3 2.5 52 53 A T S XX S- 0 0 72 -3,-0.6 4,-1.5 -4,-0.6 3,-1.1 -0.927 79.2-132.1-114.4 133.8 7.4 5.5 6.0 53 54 A S H 3> S+ 0 0 19 -2,-0.4 4,-1.6 1,-0.3 -1,-0.1 0.845 109.8 59.7 -46.9 -38.0 6.0 2.7 8.2 54 55 A E H 3> S+ 0 0 162 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.907 100.9 53.7 -59.1 -43.8 5.8 5.3 11.0 55 56 A G H X> S+ 0 0 5 -3,-1.1 4,-1.6 1,-0.2 3,-0.8 0.914 103.8 55.2 -58.1 -45.5 3.4 7.5 8.9 56 57 A C H 3X S+ 0 0 0 -4,-1.5 4,-3.2 -7,-0.6 5,-0.5 0.911 97.4 64.0 -54.4 -46.2 1.0 4.6 8.3 57 58 A R H 3X S+ 0 0 162 -4,-1.6 4,-1.8 1,-0.3 -1,-0.3 0.864 105.4 46.1 -46.0 -41.8 0.7 4.1 12.1 58 59 A Q H X S+ 0 0 1 -4,-1.6 4,-2.2 2,-0.2 3,-0.8 0.981 116.1 44.0 -66.7 -59.0 -3.2 7.0 9.3 60 61 A L H 3X S+ 0 0 10 -4,-3.2 4,-1.9 1,-0.3 -3,-0.2 0.904 111.7 55.4 -53.2 -45.0 -4.3 3.5 10.3 61 62 A G H 3< S+ 0 0 35 -4,-1.8 -1,-0.3 -5,-0.5 -2,-0.2 0.825 108.1 49.8 -58.9 -32.2 -4.8 4.6 13.9 62 63 A Q H << S+ 0 0 123 -4,-1.1 -2,-0.2 -3,-0.8 -1,-0.2 0.943 117.2 37.1 -72.2 -50.1 -7.1 7.4 12.7 63 64 A L H >X S+ 0 0 14 -4,-2.2 4,-1.1 1,-0.2 3,-0.8 0.634 102.3 81.1 -76.6 -13.9 -9.3 5.2 10.5 64 65 A Q G >< S+ 0 0 110 -4,-1.9 3,-1.4 -5,-0.3 4,-0.2 0.974 96.3 38.7 -54.2 -62.0 -9.0 2.4 13.1 65 66 A P G 34 S+ 0 0 97 0, 0.0 4,-0.3 0, 0.0 -1,-0.3 0.465 118.7 53.3 -69.8 0.0 -11.7 3.9 15.4 66 67 A S G <> S+ 0 0 41 -3,-0.8 4,-2.9 2,-0.1 -2,-0.2 0.500 77.3 92.3-110.3 -11.1 -13.6 4.8 12.3 67 68 A L T << S+ 0 0 54 -3,-1.4 -3,-0.1 -4,-1.1 -1,-0.1 0.673 93.2 46.7 -57.7 -15.3 -13.6 1.4 10.7 68 69 A Q T 4 S+ 0 0 184 -4,-0.2 -1,-0.2 -5,-0.1 -2,-0.1 0.860 121.7 31.0 -93.1 -45.7 -16.9 1.0 12.5 69 70 A T T 4 S+ 0 0 120 -4,-0.3 -2,-0.2 5,-0.0 -3,-0.1 0.940 105.3 81.6 -78.6 -51.6 -18.6 4.2 11.6 70 71 A G S < S- 0 0 26 -4,-2.9 -7,-0.0 -7,-0.1 0, 0.0 0.020 82.9-112.5 -50.8 162.8 -17.0 4.8 8.2 71 72 A S > - 0 0 84 1,-0.1 4,-1.0 4,-0.0 3,-0.4 0.045 46.8 -72.9 -84.1-163.2 -18.5 3.1 5.2 72 73 A E H > S+ 0 0 166 1,-0.2 4,-1.1 2,-0.2 -2,-0.1 0.703 127.7 68.1 -67.3 -19.0 -16.9 0.4 3.0 73 74 A E H >> S+ 0 0 100 1,-0.2 4,-1.4 2,-0.2 3,-0.6 0.933 99.0 46.4 -66.0 -47.4 -14.6 3.1 1.6 74 75 A L H 3> S+ 0 0 16 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.812 108.7 57.5 -65.0 -30.2 -12.7 3.5 4.9 75 76 A R H 3X S+ 0 0 149 -4,-1.0 4,-1.6 1,-0.2 -1,-0.2 0.780 102.6 55.1 -71.0 -27.2 -12.5 -0.3 5.2 76 77 A S H X S+ 0 0 12 -4,-1.8 4,-1.5 2,-0.2 3,-1.0 0.997 117.0 47.0 -63.0 -67.5 -4.4 -1.6 2.1 81 82 A I H 3X S+ 0 0 2 -4,-2.6 4,-1.7 1,-0.3 -1,-0.2 0.834 109.9 58.5 -43.5 -38.1 -2.4 0.8 4.3 82 83 A A H 3X S+ 0 0 0 -4,-2.7 4,-1.2 -5,-0.4 -1,-0.3 0.925 104.8 49.1 -59.9 -47.0 -2.3 -2.0 6.8 83 84 A V H XX S+ 0 0 0 -4,-1.6 3,-1.6 -3,-1.0 4,-1.4 0.981 107.4 51.6 -56.7 -63.0 -0.5 -4.4 4.4 84 85 A L H 3X S+ 0 0 30 -4,-1.5 4,-2.9 1,-0.3 -1,-0.2 0.855 102.0 64.3 -42.4 -42.4 2.2 -1.9 3.3 85 86 A Y H 3X S+ 0 0 43 -4,-1.7 4,-1.7 -5,-0.3 -1,-0.3 0.903 101.4 49.0 -49.7 -46.9 2.9 -1.4 7.0 86 87 A C H <<>S+ 0 0 0 -3,-1.6 5,-2.5 -4,-1.2 -1,-0.2 0.917 111.4 48.9 -60.7 -45.2 4.0 -5.0 7.3 87 88 A V H ><5S+ 0 0 20 -4,-1.4 3,-1.5 1,-0.2 -2,-0.2 0.898 108.1 54.3 -62.1 -41.9 6.2 -4.7 4.2 88 89 A H H 3<5S+ 0 0 33 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.848 107.6 49.6 -62.4 -36.0 7.8 -1.5 5.6 89 90 A Q T 3<5S- 0 0 106 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.325 125.1-104.4 -85.2 8.0 8.7 -3.3 8.9 90 91 A R T < 5 + 0 0 228 -3,-1.5 2,-0.5 1,-0.2 -3,-0.2 0.931 69.1 153.7 70.9 47.4 10.2 -6.1 6.9 91 92 A I < - 0 0 16 -5,-2.5 2,-0.9 -6,-0.1 -1,-0.2 -0.941 39.8-142.6-114.3 122.9 7.4 -8.5 7.4 92 93 A D - 0 0 135 -2,-0.5 2,-0.2 -5,-0.0 -5,-0.0 -0.723 25.1-169.5 -85.9 105.1 6.6 -11.3 4.9 93 94 A V - 0 0 13 -2,-0.9 3,-0.1 1,-0.1 -74,-0.1 -0.542 23.1-153.2 -92.7 159.9 2.8 -11.7 4.8 94 95 A K S S- 0 0 145 1,-0.4 -75,-0.4 -2,-0.2 2,-0.3 0.684 75.4 -12.9-102.0 -26.1 0.9 -14.4 3.0 95 96 A D S > S- 0 0 12 -77,-0.1 4,-2.0 -75,-0.1 -1,-0.4 -0.980 79.6 -82.8-167.7 164.7 -2.3 -12.5 2.3 96 97 A T H > S+ 0 0 16 -77,-1.7 4,-1.7 -2,-0.3 5,-0.1 0.843 130.1 49.0 -42.4 -40.6 -4.2 -9.3 3.1 97 98 A K H > S+ 0 0 109 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.949 104.1 56.5 -66.9 -50.5 -5.4 -11.0 6.2 98 99 A E H > S+ 0 0 49 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.842 107.2 52.8 -50.0 -36.3 -2.0 -12.2 7.3 99 100 A A H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.964 109.2 45.6 -65.3 -54.3 -0.9 -8.6 7.3 100 101 A L H X S+ 0 0 52 -4,-1.7 4,-1.0 1,-0.2 -2,-0.2 0.934 115.5 47.4 -55.0 -50.2 -3.7 -7.3 9.5 101 102 A D H >X S+ 0 0 61 -4,-2.7 4,-2.4 1,-0.2 3,-0.8 0.920 109.6 54.1 -58.3 -46.4 -3.3 -10.1 12.0 102 103 A K H 3X S+ 0 0 93 -4,-2.3 4,-3.1 -5,-0.3 5,-0.3 0.944 102.8 55.2 -53.5 -53.7 0.5 -9.6 12.0 103 104 A I H 3X S+ 0 0 30 -4,-2.5 4,-1.0 2,-0.2 -1,-0.3 0.787 114.8 43.9 -51.3 -28.6 0.2 -5.9 12.9 104 105 A E H XX S+ 0 0 114 -4,-1.0 4,-1.5 -3,-0.8 3,-0.6 0.971 115.1 41.0 -80.5 -69.3 -1.9 -7.1 15.9 105 106 A E H 3X S+ 0 0 117 -4,-2.4 4,-0.8 1,-0.2 -2,-0.2 0.817 112.7 61.4 -48.9 -33.1 0.0 -10.1 17.3 106 107 A E H >X S+ 0 0 63 -4,-3.1 3,-1.5 -5,-0.4 4,-0.6 0.954 101.4 48.5 -60.1 -52.7 3.2 -8.0 16.6 107 108 A Q H XX S+ 0 0 116 -4,-1.0 4,-1.2 -3,-0.6 3,-0.8 0.791 97.9 73.1 -58.8 -28.1 2.1 -5.2 19.0 108 109 A N H 3X S+ 0 0 83 -4,-1.5 4,-1.6 1,-0.3 -1,-0.3 0.852 87.8 61.9 -55.3 -36.1 1.3 -7.9 21.6 109 110 A K H < S+ 0 0 152 -4,-1.2 3,-1.5 1,-0.2 -1,-0.2 0.899 107.7 51.1 -58.5 -42.5 2.9 -5.5 26.0 112 113 A K H 3< S+ 0 0 163 -4,-1.6 3,-0.5 1,-0.3 -1,-0.2 0.801 112.1 47.8 -65.6 -29.0 4.9 -8.5 27.1 113 114 A K T 3< S+ 0 0 192 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 -0.027 108.5 57.2-101.3 29.1 8.0 -6.3 27.2 114 115 A A <> + 0 0 24 -3,-1.5 4,-2.9 -5,-0.1 5,-0.3 -0.052 55.8 129.3-148.2 35.6 6.3 -3.5 29.1 115 116 A Q H > S+ 0 0 168 -3,-0.5 4,-0.9 1,-0.2 -2,-0.1 0.798 85.7 41.0 -63.4 -28.8 5.0 -5.2 32.3 116 117 A Q H > S+ 0 0 148 2,-0.2 4,-1.2 3,-0.1 -1,-0.2 0.846 115.3 48.9 -86.6 -38.9 6.6 -2.4 34.3 117 118 A A H > S+ 0 0 52 2,-0.2 4,-1.3 1,-0.2 -2,-0.2 0.904 112.6 48.1 -67.3 -42.7 5.6 0.4 32.0 118 119 A A H < S+ 0 0 47 -4,-2.9 3,-0.3 1,-0.2 -1,-0.2 0.909 108.7 53.4 -64.6 -43.5 2.0 -0.7 31.8 119 120 A A H < S+ 0 0 79 -4,-0.9 3,-0.3 -5,-0.3 -1,-0.2 0.817 105.1 56.4 -61.4 -31.1 1.8 -1.1 35.6 120 121 A D H < S+ 0 0 124 -4,-1.2 2,-0.8 1,-0.3 -1,-0.2 0.859 108.6 48.2 -69.1 -36.4 3.0 2.5 35.9 121 122 A T S < S+ 0 0 106 -4,-1.3 2,-0.3 -3,-0.3 -1,-0.3 -0.755 93.9 87.3-109.2 85.2 0.2 3.8 33.8 122 123 A G + 0 0 55 -2,-0.8 2,-0.3 -3,-0.3 -4,-0.0 -0.890 40.5 178.6-176.1 144.1 -3.0 2.3 35.1 123 124 A N - 0 0 134 -2,-0.3 2,-0.8 2,-0.0 -2,-0.0 -0.953 32.0-113.3-147.5 164.7 -5.8 2.8 37.7 124 125 A N - 0 0 143 -2,-0.3 2,-0.8 2,-0.0 -2,-0.0 -0.858 28.1-168.9-107.1 101.2 -9.0 1.2 38.9 125 126 A S - 0 0 92 -2,-0.8 2,-1.0 1,-0.0 -2,-0.0 -0.792 7.5-156.9 -93.4 107.1 -12.0 3.4 38.2 126 127 A Q - 0 0 174 -2,-0.8 -2,-0.0 1,-0.0 -1,-0.0 -0.720 15.2-161.4 -87.0 100.4 -15.1 2.1 40.0 127 128 A V - 0 0 128 -2,-1.0 2,-0.1 1,-0.1 -1,-0.0 0.046 27.2 -81.6 -68.3-176.3 -18.1 3.4 38.1 128 129 A S - 0 0 116 1,-0.0 -1,-0.1 2,-0.0 0, 0.0 -0.430 33.1-171.8 -87.7 164.5 -21.6 3.7 39.5 129 130 A Q + 0 0 188 -2,-0.1 2,-0.1 2,-0.0 -1,-0.0 -0.414 22.5 152.8-157.6 71.7 -24.2 0.8 39.7 130 131 A N 0 0 148 1,-0.1 -2,-0.0 0, 0.0 0, 0.0 -0.315 360.0 360.0 -94.9-179.2 -27.7 1.9 40.7 131 132 A Y 0 0 264 -2,-0.1 -1,-0.1 0, 0.0 -2,-0.0 -0.718 360.0 360.0 -84.8 360.0 -31.1 0.4 40.0