==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN/SIGNALING PROTEIN 15-AUG-09 3IOZ . COMPND 2 MOLECULE: PROTEIN NEF; . SOURCE 2 ORGANISM_SCIENTIFIC: SIMIAN IMMUNODEFICIENCY VIRUS; . AUTHOR W.M.KIM,A.B.SIGALOV,L.J.STERN . 125 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7473.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 74 59.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 11 8.8 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 . 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 . 5 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 32 25.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 3.2 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 1 0 0 1 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 3 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 107 A P 0 0 157 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 133.4 -38.4 -17.7 1.5 2 108 A L + 0 0 133 44,-0.1 2,-0.2 45,-0.0 44,-0.2 -0.221 360.0 158.7 -66.9 158.8 -35.5 -19.5 3.3 3 109 A R E -a 46 0A 96 42,-0.7 44,-2.6 3,-0.0 2,-0.2 -0.830 39.1-114.3-179.3 136.7 -31.9 -19.3 2.1 4 110 A T E -a 47 0A 78 -2,-0.2 2,-0.2 42,-0.2 5,-0.1 -0.519 50.9 -90.8 -76.8 149.4 -28.4 -19.7 3.4 5 111 A M - 0 0 23 42,-0.6 2,-0.2 -2,-0.2 -1,-0.1 -0.401 48.6-176.9 -65.7 129.8 -26.2 -16.6 3.3 6 112 A S > - 0 0 66 -2,-0.2 4,-2.9 1,-0.1 5,-0.3 -0.609 38.6 -98.3-113.9-180.0 -24.2 -16.1 0.1 7 113 A Y H > S+ 0 0 107 2,-0.2 4,-3.7 -2,-0.2 5,-0.2 0.996 123.2 42.0 -63.9 -66.9 -21.7 -13.4 -0.8 8 114 A K H > S+ 0 0 148 2,-0.2 4,-2.1 1,-0.2 5,-0.3 0.822 117.3 55.8 -49.5 -30.9 -23.9 -11.1 -2.9 9 115 A L H > S+ 0 0 21 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 1.000 112.6 34.9 -63.5 -72.6 -26.4 -11.8 -0.1 10 116 A A H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 58,-0.3 0.867 119.7 56.1 -49.5 -41.6 -24.3 -10.7 2.9 11 117 A I H X S+ 0 0 19 -4,-3.7 4,-1.2 -5,-0.3 3,-0.3 0.989 108.6 40.7 -55.4 -72.8 -22.7 -8.0 0.7 12 118 A D H X S+ 0 0 88 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.821 116.9 54.5 -47.2 -35.8 -25.8 -6.2 -0.4 13 119 A M H X S+ 0 0 18 -4,-2.3 4,-1.8 -5,-0.3 5,-0.3 0.955 96.5 61.9 -64.2 -53.1 -27.1 -6.6 3.2 14 120 A S H X S+ 0 0 0 -4,-2.8 4,-1.4 -3,-0.3 -1,-0.2 0.829 111.7 39.9 -43.0 -41.7 -24.1 -5.0 4.9 15 121 A H H X S+ 0 0 56 -4,-1.2 4,-3.9 2,-0.2 5,-0.4 0.918 105.1 64.2 -77.0 -46.0 -24.9 -1.8 3.1 16 122 A F H < S+ 0 0 49 -4,-1.9 4,-0.2 1,-0.2 -2,-0.2 0.811 108.9 44.0 -45.3 -34.5 -28.7 -2.0 3.5 17 123 A I H ><>S+ 0 0 6 -4,-1.8 5,-1.7 2,-0.2 3,-0.5 0.890 113.4 47.4 -81.1 -44.2 -28.1 -1.7 7.2 18 124 A K H ><5S+ 0 0 100 -4,-1.4 3,-2.2 -5,-0.3 -2,-0.2 0.912 108.7 55.8 -62.0 -42.7 -25.5 1.0 7.1 19 125 A E T 3<5S+ 0 0 149 -4,-3.9 -1,-0.3 1,-0.3 -2,-0.2 0.716 107.1 52.1 -60.9 -21.1 -27.8 2.9 4.7 20 126 A K T < 5S- 0 0 109 -3,-0.5 -1,-0.3 -5,-0.4 -2,-0.2 0.012 120.0-112.4-102.8 25.8 -30.4 2.5 7.5 21 127 A G T < 5 + 0 0 46 -3,-2.2 2,-0.4 1,-0.2 -3,-0.2 0.889 65.8 154.5 44.7 51.9 -28.0 4.0 10.1 22 128 A G < - 0 0 0 -5,-1.7 2,-1.9 1,-0.1 -1,-0.2 -0.860 51.7 -7.1-114.4 145.7 -27.7 0.6 11.9 23 129 A L S > S+ 0 0 3 101,-1.1 3,-3.6 -2,-0.4 66,-0.4 -0.156 80.7 135.9 77.1 -44.5 -25.0 -0.9 14.1 24 130 A E T 3 S- 0 0 83 -2,-1.9 66,-0.2 1,-0.3 -1,-0.2 -0.129 88.3 -9.9 -46.9 107.1 -22.4 1.8 13.6 25 131 A G T 3 S+ 0 0 45 64,-2.9 -1,-0.3 1,-0.3 2,-0.2 0.500 98.6 143.1 83.2 4.6 -21.0 2.5 17.0 26 132 A I < - 0 0 15 -3,-3.6 63,-2.1 63,-0.1 -1,-0.3 -0.578 54.1-109.9 -82.1 141.3 -23.6 0.4 18.8 27 133 A Y B -B 88 0B 146 -2,-0.2 2,-0.3 61,-0.2 61,-0.2 -0.400 31.8-128.6 -76.6 145.3 -22.5 -1.6 21.8 28 134 A Y + 0 0 62 59,-3.0 59,-0.3 -2,-0.1 2,-0.3 -0.689 28.6 167.3-101.5 143.9 -22.3 -5.4 21.6 29 135 A S > - 0 0 25 -2,-0.3 4,-2.6 1,-0.0 51,-0.1 -0.981 46.5-118.5-147.8 144.7 -23.7 -8.2 23.8 30 136 A A H > S+ 0 0 36 49,-1.7 4,-1.0 -2,-0.3 50,-0.1 0.715 121.8 52.5 -54.0 -19.8 -24.0 -11.9 23.2 31 137 A R H > S+ 0 0 95 2,-0.2 4,-1.6 48,-0.2 -1,-0.3 0.919 107.3 47.7 -78.0 -50.5 -27.7 -11.1 23.6 32 138 A R H > S+ 0 0 65 1,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.780 104.3 65.4 -61.3 -27.5 -27.7 -8.4 21.0 33 139 A H H >X S+ 0 0 30 -4,-2.6 4,-2.1 1,-0.2 3,-0.9 0.978 104.7 41.0 -56.9 -58.6 -25.8 -10.8 18.8 34 140 A R H 3X S+ 0 0 177 -4,-1.0 4,-1.7 1,-0.3 -1,-0.2 0.806 106.4 66.3 -61.7 -28.8 -28.7 -13.2 18.5 35 141 A I H 3X S+ 0 0 11 -4,-1.6 4,-1.4 2,-0.2 -1,-0.3 0.891 106.3 42.2 -58.2 -39.2 -30.9 -10.1 18.2 36 142 A L H S+ 0 0 22 -4,-1.4 4,-2.6 -3,-0.4 5,-0.6 0.923 105.7 51.2 -49.5 -46.9 -33.7 -9.7 12.2 40 146 A L H X5S+ 0 0 2 -4,-1.6 6,-1.5 1,-0.2 4,-1.5 0.843 112.8 45.8 -60.0 -35.7 -32.2 -11.3 9.1 41 147 A E H X5S+ 0 0 91 -4,-0.7 4,-0.6 -3,-0.5 -2,-0.2 0.897 117.9 39.6 -77.9 -41.9 -34.4 -14.4 9.5 42 148 A K H <5S+ 0 0 95 -4,-2.8 -2,-0.2 2,-0.1 -3,-0.2 0.819 131.7 26.9 -76.1 -31.7 -37.7 -12.6 10.2 43 149 A E H <5S+ 0 0 89 -4,-2.6 -3,-0.2 -5,-0.4 -2,-0.2 0.769 140.4 17.7-103.0 -32.9 -37.2 -9.8 7.6 44 150 A E H < -a 4 0A 56 -44,-2.6 2,-0.9 -2,-0.5 3,-0.7 -0.497 21.8-144.6 -63.2 110.7 -30.2 -18.7 7.7 48 154 A P T 3 S+ 0 0 35 0, 0.0 -1,-0.2 0, 0.0 -11,-0.1 0.032 75.6 105.8 -72.6 29.5 -28.3 -17.4 10.7 49 155 A D T 3 S+ 0 0 106 -2,-0.9 -2,-0.1 1,-0.2 -45,-0.0 0.468 72.3 68.0 -80.2 -2.2 -25.6 -20.0 10.4 50 156 A W < + 0 0 7 -3,-0.7 2,-0.5 -13,-0.1 13,-0.2 0.914 68.2 93.2 -86.2 -49.5 -23.5 -17.2 9.1 51 157 A Q + 0 0 14 11,-0.1 2,-0.3 -18,-0.1 -1,-0.0 -0.319 52.8 127.4 -63.2 106.9 -22.8 -14.8 12.0 52 158 A D - 0 0 80 -2,-0.5 11,-2.6 12,-0.0 12,-0.3 -0.967 31.5-168.0-153.2 159.8 -19.5 -15.8 13.6 53 159 A Y B -E 62 0C 24 9,-0.3 2,-0.3 -2,-0.3 3,-0.0 -0.817 31.9 -79.9-142.3 179.5 -16.3 -14.1 14.5 54 160 A T - 0 0 5 7,-1.5 9,-0.0 -2,-0.2 47,-0.0 -0.695 34.9-129.5 -85.9 139.8 -12.7 -14.5 15.6 55 161 A S + 0 0 62 -2,-0.3 -1,-0.1 1,-0.2 28,-0.1 0.936 59.1 154.6 -51.7 -50.0 -12.1 -15.2 19.3 56 162 A G - 0 0 10 1,-0.1 -1,-0.2 -3,-0.0 2,-0.2 -0.883 53.5-138.7 113.4-146.6 -9.5 -12.4 19.5 57 163 A P S S+ 0 0 56 0, 0.0 -1,-0.1 0, 0.0 2,-0.0 0.432 86.8 22.1 -75.9-143.6 -8.5 -10.7 21.5 58 164 A G S S+ 0 0 30 -2,-0.2 2,-0.1 25,-0.1 25,-0.1 -0.358 123.9 8.3 62.4-142.2 -8.1 -7.2 20.1 59 165 A I S S- 0 0 50 13,-0.1 2,-0.6 -3,-0.1 13,-0.2 -0.432 74.3-139.4 -70.1 141.8 -10.3 -6.6 17.1 60 166 A R B -C 71 0B 14 11,-3.0 11,-2.3 -2,-0.1 -5,-0.1 -0.916 17.9-162.7-106.7 122.7 -12.9 -9.3 16.2 61 167 A Y - 0 0 11 -2,-0.6 -7,-1.5 9,-0.2 9,-0.1 -0.790 23.8-102.3-108.9 148.4 -13.4 -10.1 12.6 62 168 A P B -E 53 0C 11 0, 0.0 39,-0.3 0, 0.0 -9,-0.3 -0.383 11.7-147.2 -67.8 137.8 -16.3 -11.9 10.9 63 169 A K S S+ 0 0 66 -11,-2.6 2,-0.3 -13,-0.2 -10,-0.2 0.068 86.9 75.8 -90.1 22.6 -16.0 -15.6 9.8 64 170 A T S > S- 0 0 30 -12,-0.3 3,-1.8 3,-0.1 -1,-0.2 -0.797 81.1-142.4-134.6 92.2 -18.3 -14.8 6.9 65 171 A F T 3 S+ 0 0 71 -2,-0.3 31,-0.1 1,-0.2 -55,-0.1 -0.093 86.0 45.8 -52.3 151.8 -16.5 -12.9 4.2 66 172 A G T 3 S+ 0 0 0 29,-1.1 2,-0.4 1,-0.4 -1,-0.2 -0.017 83.5 118.7 96.4 -27.9 -18.7 -10.3 2.4 67 173 A W < - 0 0 3 -3,-1.8 -1,-0.4 28,-0.1 -56,-0.1 -0.586 50.1-163.4 -71.5 128.1 -19.8 -9.1 5.9 68 174 A L + 0 0 3 -2,-0.4 24,-1.9 -58,-0.3 2,-0.4 -0.122 54.7 92.8-112.1 36.2 -18.7 -5.5 6.3 69 175 A W E - D 0 91B 0 22,-0.2 2,-0.3 26,-0.1 22,-0.2 -0.992 49.9-171.4-132.0 127.6 -19.0 -5.1 10.1 70 176 A K E - D 0 90B 36 20,-2.7 20,-0.7 -2,-0.4 2,-0.6 -0.896 24.1-122.5-119.9 147.5 -16.2 -5.6 12.6 71 177 A L E -CD 60 89B 4 -11,-2.3 -11,-3.0 -2,-0.3 18,-0.2 -0.775 32.2-175.9 -89.4 120.0 -16.1 -5.6 16.4 72 178 A V E - D 0 88B 37 16,-2.2 16,-1.0 -2,-0.6 -13,-0.1 -0.968 19.5-130.0-124.3 123.6 -13.7 -3.1 17.9 73 179 A P 0 0 39 0, 0.0 14,-0.2 0, 0.0 -14,-0.0 -0.148 360.0 360.0 -61.5 161.0 -12.9 -2.6 21.6 74 180 A V 0 0 130 12,-0.2 13,-0.1 13,-0.0 -2,-0.0 -0.228 360.0 360.0-115.6 360.0 -13.1 0.8 23.3 75 ! 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 76 200 A T 0 0 174 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-169.1 -20.2 -7.1 34.3 77 201 A S > - 0 0 72 4,-0.0 3,-0.5 1,-0.0 4,-0.0 -0.715 360.0-110.2-128.3 178.9 -22.9 -9.3 32.8 78 202 A Q T 3 S+ 0 0 187 -2,-0.2 -1,-0.0 1,-0.2 0, 0.0 0.415 120.8 54.7 -94.5 -0.5 -23.2 -12.9 31.6 79 203 A W T 3 S+ 0 0 138 2,-0.0 -49,-1.7 -49,-0.0 -1,-0.2 0.117 91.4 122.0-104.3 13.7 -23.5 -11.8 28.0 80 204 A D S < S- 0 0 77 -3,-0.5 -50,-0.2 -51,-0.1 6,-0.1 0.203 72.9 -73.9 -64.6-169.7 -20.2 -10.0 28.7 81 205 A D > - 0 0 22 4,-0.2 3,-3.1 1,-0.1 -1,-0.1 -0.826 21.7-143.4-104.5 126.4 -16.9 -10.5 26.8 82 206 A P T 3 S+ 0 0 123 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.662 109.4 46.7 -53.0 -21.7 -14.7 -13.7 27.1 83 207 A W T 3 S- 0 0 120 2,-0.2 -25,-0.1 -28,-0.1 3,-0.1 0.178 113.1-121.2-106.1 13.6 -11.7 -11.4 26.8 84 208 A G S < S+ 0 0 62 -3,-3.1 2,-0.2 1,-0.2 -4,-0.0 0.631 73.3 127.3 58.7 13.5 -13.1 -8.9 29.2 85 209 A E - 0 0 62 -27,-0.1 2,-0.3 -12,-0.0 -1,-0.2 -0.588 62.4-116.7 -96.6 161.2 -13.0 -6.3 26.5 86 210 A V - 0 0 71 -2,-0.2 2,-0.4 -3,-0.1 -12,-0.2 -0.715 30.8-162.2 -91.7 149.6 -15.8 -4.0 25.3 87 211 A L + 0 0 8 -59,-0.3 -59,-3.0 -2,-0.3 2,-0.3 -0.998 12.5 176.1-138.9 138.1 -17.0 -4.4 21.7 88 212 A A E -BD 27 72B 10 -16,-1.0 -16,-2.2 -2,-0.4 -61,-0.2 -0.994 33.2-105.1-140.3 145.7 -18.9 -2.2 19.3 89 213 A W E + D 0 71B 2 -63,-2.1 -64,-2.9 -66,-0.4 2,-0.3 -0.317 38.3 172.6 -71.1 150.3 -19.9 -2.5 15.6 90 214 A K E - D 0 70B 108 -20,-0.7 -20,-2.7 -66,-0.2 2,-0.1 -0.949 29.7-115.6-160.5 136.9 -18.2 -0.5 12.9 91 215 A F E + D 0 69B 38 -2,-0.3 -22,-0.2 -22,-0.2 -76,-0.0 -0.445 32.0 170.6 -78.7 146.8 -18.4 -0.6 9.1 92 216 A D > - 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