==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN/IMMUNE SYSTEM 24-DEC-03 1RZJ . COMPND 2 MOLECULE: ENVELOPE GLYCOPROTEIN GP120; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS 1; . AUTHOR C.C.HUANG,M.VENTURI,S.MAJEED,M.J.MOORE,S.PHOGAT,M.-Y.ZHANG, . 929 5 13 11 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41944.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 626 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 2.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 322 34.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.6 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 . 123 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 73 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 55 5.9 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+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 0 1 0 0 1 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 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 PARALLEL BRIDGES PER LADDER . 8 8 13 9 9 8 1 3 1 2 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 2 8 2 0 3 0 1 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 83 G E 0 0 168 0, 0.0 99,-1.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 144.5 17.2 -44.4 87.1 2 84 G V E -A 99 0A 102 97,-0.2 2,-0.2 98,-0.1 97,-0.2 -0.991 360.0-173.0-150.3 146.9 20.7 -45.8 86.7 3 85 G V E -A 98 0A 81 95,-1.7 95,-1.7 -2,-0.3 2,-0.2 -0.735 24.3-135.3-148.2 95.2 22.3 -48.8 85.1 4 86 G L E -A 97 0A 131 -2,-0.2 2,-0.4 93,-0.2 93,-0.2 -0.286 24.7-158.4 -52.6 111.8 26.0 -49.6 85.6 5 87 G V E -A 96 0A 54 91,-1.4 2,-1.1 -2,-0.2 91,-0.6 -0.818 10.7-138.5 -98.9 132.5 27.3 -50.5 82.2 6 88 G N E +A 95 0A 165 -2,-0.4 2,-0.3 89,-0.1 89,-0.1 -0.740 62.8 78.7 -94.8 95.1 30.5 -52.5 81.9 7 89 G V E S- 0 0 78 -2,-1.1 2,-0.7 87,-0.6 89,-0.4 -0.962 80.5 -82.4-179.1 168.9 32.6 -51.0 79.0 8 90 G T E - 0 0 103 -2,-0.3 2,-0.3 87,-0.1 86,-0.2 -0.799 43.9-179.4 -95.0 111.9 34.9 -48.2 78.0 9 91 G E E -A 93 0A 46 84,-2.1 84,-3.9 -2,-0.7 2,-0.5 -0.786 19.1-133.9-109.1 152.5 33.2 -45.0 77.0 10 92 G N E -A 92 0A 100 -2,-0.3 2,-0.2 82,-0.3 80,-0.1 -0.908 21.1-171.1-112.5 131.6 34.8 -41.8 75.8 11 93 G F E +A 91 0A 6 80,-2.4 80,-1.5 -2,-0.5 2,-0.1 -0.686 15.0 178.5-114.4 167.5 34.0 -38.3 77.0 12 94 G N > - 0 0 60 288,-0.3 3,-1.5 -2,-0.2 78,-0.2 -0.517 7.6-173.5-171.4 94.4 34.8 -34.7 76.0 13 95 G M G > S+ 0 0 0 1,-0.3 3,-0.5 285,-0.2 284,-0.1 0.519 85.5 65.1 -69.1 -9.0 33.2 -31.8 78.0 14 96 G W G 3 S+ 0 0 36 1,-0.3 -1,-0.3 114,-0.1 115,-0.0 0.466 112.5 33.6 -94.1 -2.3 34.7 -29.3 75.5 15 97 G K G < S+ 0 0 178 -3,-1.5 2,-0.7 4,-0.0 -1,-0.3 -0.430 82.0 145.5-146.3 58.3 32.5 -30.7 72.8 16 98 G N X> - 0 0 9 -3,-0.5 3,-2.1 1,-0.2 4,-0.8 -0.881 38.4-156.4-108.0 104.5 29.4 -31.7 74.7 17 99 G D H 3> S+ 0 0 100 -2,-0.7 4,-1.4 1,-0.3 3,-0.2 0.793 91.5 65.1 -43.5 -39.0 26.3 -31.2 72.6 18 100 G M H 3> S+ 0 0 17 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.827 93.6 61.4 -57.8 -35.2 24.2 -30.9 75.8 19 101 G V H <> S+ 0 0 0 -3,-2.1 4,-3.6 2,-0.2 -1,-0.2 0.956 103.0 47.4 -57.8 -53.7 26.0 -27.7 76.8 20 102 G E H X S+ 0 0 76 -4,-0.8 4,-2.4 1,-0.2 -1,-0.2 0.861 110.9 55.9 -57.1 -32.5 24.8 -25.8 73.7 21 103 G Q H X S+ 0 0 95 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.967 110.3 41.9 -64.0 -51.2 21.4 -27.2 74.6 22 104 G M H X S+ 0 0 0 -4,-2.8 4,-3.6 1,-0.2 5,-0.3 0.950 111.1 58.5 -60.1 -47.1 21.5 -25.8 78.0 23 105 G H H X S+ 0 0 5 -4,-3.6 4,-2.3 1,-0.3 -1,-0.2 0.900 111.1 39.6 -49.6 -48.9 23.0 -22.6 76.7 24 106 G E H X S+ 0 0 113 -4,-2.4 4,-1.0 2,-0.2 -1,-0.3 0.817 115.0 54.2 -74.1 -27.5 20.1 -22.0 74.4 25 107 G D H X S+ 0 0 64 -4,-2.1 4,-1.7 -5,-0.2 3,-0.5 0.961 111.1 43.7 -69.8 -48.6 17.6 -23.1 77.0 26 108 G I H >X S+ 0 0 1 -4,-3.6 4,-2.4 1,-0.3 3,-0.6 0.959 106.5 59.1 -62.1 -49.6 18.8 -20.8 79.6 27 109 G I H 3X S+ 0 0 18 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.3 0.848 110.4 47.4 -47.7 -31.6 19.1 -17.8 77.2 28 110 G S H 3X S+ 0 0 70 -4,-1.0 4,-1.5 -3,-0.5 -1,-0.3 0.828 105.1 55.0 -79.2 -34.2 15.4 -18.5 76.8 29 111 G L H << S+ 0 0 52 -4,-1.7 4,-0.5 -3,-0.6 -2,-0.2 0.820 113.1 47.2 -66.9 -27.6 14.5 -18.8 80.5 30 112 G W H >X S+ 0 0 6 -4,-2.4 4,-1.6 -5,-0.2 3,-1.4 0.971 105.4 54.9 -73.9 -59.4 16.1 -15.4 80.8 31 113 G D H 3< S+ 0 0 72 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.764 114.0 41.7 -47.1 -34.8 14.4 -13.7 77.9 32 114 G Q T 3< S+ 0 0 134 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.668 125.7 37.8 -89.0 -15.6 10.9 -14.5 79.2 33 115 G S T <4 S+ 0 0 34 -3,-1.4 2,-1.1 -4,-0.5 -2,-0.2 0.912 113.9 40.3 -96.7 -72.7 12.0 -13.7 82.7 34 116 G L S < S- 0 0 10 -4,-1.6 -1,-0.2 -5,-0.1 27,-0.1 -0.713 73.0-174.5 -87.0 97.4 14.3 -10.7 83.0 35 117 G K - 0 0 79 -2,-1.1 27,-0.1 25,-0.3 2,-0.1 -0.802 13.6-138.5 -99.2 130.3 13.0 -8.1 80.5 36 118 G P - 0 0 10 0, 0.0 21,-0.3 0, 0.0 213,-0.2 -0.329 17.9-129.2 -79.3 161.3 14.9 -4.8 79.8 37 119 G a S S- 0 0 6 211,-3.2 20,-0.8 1,-0.4 2,-0.3 0.625 99.6 -5.2 -81.1 -15.4 13.4 -1.3 79.4 38 120 G V E -DE 56 248B 1 210,-1.0 210,-2.6 18,-0.2 -1,-0.4 -0.851 64.8-162.8-176.3 139.2 15.5 -1.4 76.3 39 121 G K E -DE 55 247B 20 16,-1.4 16,-2.0 -2,-0.3 2,-0.5 -0.979 7.4-156.0-131.1 143.7 18.1 -3.6 74.5 40 122 G L E -DE 54 246B 24 206,-2.7 206,-2.8 -2,-0.4 14,-0.2 -0.984 10.7-178.6-123.8 125.0 20.5 -2.7 71.8 41 123 G T E -D 53 0B 20 12,-2.3 12,-2.0 -2,-0.5 204,-0.2 -0.984 27.5-117.9-125.9 132.0 22.0 -5.3 69.4 42 124 G P + 0 0 32 0, 0.0 10,-0.1 0, 0.0 11,-0.1 -0.020 27.3 179.9 -58.2 168.9 24.5 -4.5 66.6 43 125 G L + 0 0 66 8,-0.3 8,-1.8 9,-0.1 2,-0.8 -0.259 13.6 160.6-174.5 74.1 23.7 -5.1 62.9 44 126 G b + 0 0 6 323,-0.6 2,-3.3 6,-0.2 6,-0.1 -0.493 12.1 179.7-101.1 62.6 26.4 -4.2 60.4 45 127 G V - 0 0 99 -2,-0.8 2,-0.6 6,-0.1 3,-0.1 -0.314 60.7 -88.1 -62.7 72.5 25.1 -6.3 57.4 46 128 G G S S+ 0 0 53 -2,-3.3 -1,-0.1 1,-0.1 -3,-0.1 -0.435 94.8 116.3 58.9-107.6 28.0 -5.1 55.2 47 129 G A S S- 0 0 91 -2,-0.6 -1,-0.1 3,-0.1 3,-0.1 0.089 84.9 -73.8 41.6-158.3 26.4 -1.9 53.8 48 194 G G S S+ 0 0 78 -3,-0.1 -2,-0.1 0, 0.0 -1,-0.0 0.884 106.0 13.9 -92.4 -78.0 28.1 1.3 54.7 49 195 G S S S- 0 0 107 1,-0.1 2,-0.4 -4,-0.1 0, 0.0 -0.019 88.7 -94.4 -84.4-166.9 27.4 2.3 58.4 50 196 G b - 0 0 58 -6,-0.1 2,-0.3 -3,-0.1 -6,-0.2 -0.966 26.3-145.9-119.1 130.3 25.9 0.0 61.1 51 197 G N - 0 0 111 -8,-1.8 2,-0.5 -2,-0.4 -8,-0.3 -0.687 13.9-145.4 -90.0 145.6 22.2 -0.1 61.9 52 198 G T - 0 0 71 -2,-0.3 2,-0.5 -10,-0.1 -9,-0.1 -0.952 5.6-141.1-118.8 116.5 21.4 -0.7 65.5 53 199 G S E -D 41 0B 50 -12,-2.0 -12,-2.3 -2,-0.5 2,-0.4 -0.619 26.4-174.3 -75.1 121.7 18.3 -2.8 66.4 54 200 G V E -D 40 0B 68 -2,-0.5 2,-0.4 -14,-0.2 -14,-0.2 -0.977 11.2-167.3-125.8 130.3 16.7 -1.2 69.4 55 201 G I E -D 39 0B 70 -16,-2.0 -16,-1.4 -2,-0.4 2,-0.5 -0.954 4.0-166.2-117.2 132.3 13.7 -2.5 71.4 56 202 G T E +D 38 0B 44 -2,-0.4 2,-0.3 -18,-0.2 -18,-0.2 -0.980 30.3 156.4-115.7 120.0 11.8 -0.4 74.0 57 203 G Q - 0 0 51 -20,-0.8 -2,-0.0 -2,-0.5 -22,-0.0 -0.919 47.2 -63.6-145.1 170.1 9.5 -2.6 76.1 58 204 G A - 0 0 61 -2,-0.3 -1,-0.1 1,-0.1 -20,-0.0 -0.168 42.2-161.6 -47.3 144.4 7.6 -3.3 79.3 59 205 G a - 0 0 20 524,-0.1 191,-0.3 -22,-0.1 -22,-0.1 -0.102 11.4-177.3-129.8 37.3 10.1 -3.4 82.2 60 206 G P - 0 0 92 0, 0.0 2,-0.8 0, 0.0 -25,-0.3 0.026 31.8-116.6 -40.6 133.3 8.3 -5.2 85.2 61 207 G K + 0 0 66 -27,-0.1 2,-0.3 188,-0.0 144,-0.0 -0.657 58.4 136.6 -79.5 109.4 10.3 -5.5 88.4 62 208 G V - 0 0 77 -2,-0.8 2,-0.3 143,-0.2 -29,-0.0 -0.888 43.3-122.5-144.2 172.1 10.9 -9.2 89.1 63 209 G S - 0 0 39 -2,-0.3 2,-0.8 142,-0.0 140,-0.0 -0.853 23.0-113.1-122.1 158.8 13.7 -11.5 90.2 64 210 G F + 0 0 35 -2,-0.3 140,-0.2 1,-0.1 141,-0.2 -0.812 44.1 155.3 -94.3 107.2 15.3 -14.6 88.7 65 211 G E - 0 0 153 -2,-0.8 -1,-0.1 139,-0.1 2,-0.0 -0.604 23.2-172.4-130.6 67.5 14.4 -17.6 90.8 66 212 G P - 0 0 42 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.321 22.0-124.4 -66.0 143.8 14.7 -20.5 88.4 67 213 G I - 0 0 132 1,-0.1 38,-0.1 39,-0.1 -2,-0.0 -0.630 42.4 -89.0 -85.6 145.5 13.7 -24.0 89.4 68 214 G P - 0 0 62 0, 0.0 2,-0.4 0, 0.0 38,-0.2 -0.204 45.7-140.3 -52.9 145.8 16.4 -26.6 89.0 69 215 G I B -G 105 0C 33 36,-2.2 36,-2.1 34,-0.1 2,-0.5 -0.943 11.2-159.1-118.8 134.2 16.3 -28.2 85.6 70 216 G H - 0 0 115 -2,-0.4 2,-0.6 34,-0.2 34,-0.1 -0.918 10.7-147.2-108.7 133.3 16.9 -31.9 84.8 71 217 G Y - 0 0 44 -2,-0.5 31,-2.1 32,-0.3 2,-0.2 -0.895 19.2-175.4-104.2 117.8 17.9 -32.8 81.3 72 218 G c B -H 101 0D 64 -2,-0.6 29,-0.2 29,-0.3 28,-0.1 -0.524 40.9 -65.5-102.2 173.9 16.6 -36.2 80.1 73 219 G A - 0 0 36 27,-1.1 2,-0.3 -2,-0.2 -1,-0.1 -0.318 48.6-130.0 -61.7 134.2 17.3 -38.0 76.8 74 220 G P > - 0 0 70 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.665 50.1 -69.8 -85.4 143.4 16.0 -36.4 73.6 75 221 G A T 3 S+ 0 0 104 -2,-0.3 3,-0.1 1,-0.3 0, 0.0 0.017 124.9 18.5 -34.8 117.0 14.0 -38.6 71.3 76 222 G G T 3 S+ 0 0 38 1,-0.3 229,-1.3 -3,-0.1 -1,-0.3 0.439 114.4 74.0 98.3 0.4 16.4 -41.1 69.8 77 223 G F E < -B 304 0A 82 -3,-2.0 -1,-0.3 227,-0.3 2,-0.3 -0.686 59.0-142.5-132.4-173.7 19.2 -40.9 72.3 78 224 G A E -B 303 0A 12 225,-1.7 225,-3.1 -2,-0.2 2,-0.6 -0.969 21.8-114.9-149.8 157.8 20.3 -41.8 75.8 79 225 G I E -BC 302 99A 4 20,-0.8 20,-2.7 -2,-0.3 2,-0.4 -0.876 24.7-165.3-107.0 120.9 22.4 -40.2 78.5 80 226 G L E -BC 301 98A 16 221,-2.4 221,-1.0 -2,-0.6 2,-0.4 -0.795 5.7-159.5-101.0 142.4 25.7 -41.7 79.7 81 227 G K E -BC 300 97A 56 16,-2.9 16,-1.7 -2,-0.4 2,-1.1 -0.965 19.3-134.0-125.4 140.0 27.4 -40.7 82.9 82 228 G d E - C 0 96A 3 217,-1.7 14,-0.2 -2,-0.4 5,-0.1 -0.766 20.0-170.2 -90.7 97.4 31.0 -41.0 84.0 83 229 G N + 0 0 45 12,-1.5 -1,-0.2 -2,-1.1 13,-0.2 0.645 45.7 122.3 -62.9 -16.2 30.5 -42.4 87.5 84 230 G N - 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