==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 06-JUL-12 4FZ8 . COMPND 2 MOLECULE: FAB HEAVY CHAIN OF HUMAN ANTI-HIV-1 ENV ANTIBODY . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR X.WU,W.D.TOLBERT,M.PAZGIER . 437 3 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20170.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 266 60.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 149 34.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 51 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.1 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 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 RESIDUES PER ALPHA HELIX . 0 0 1 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 PARALLEL BRIDGES PER LADDER . 6 8 8 4 3 3 1 0 1 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 . 2 2 4 1 0 2 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 H E 0 0 196 0, 0.0 2,-0.9 0, 0.0 24,-0.0 0.000 360.0 360.0 360.0 130.9 5.4 -21.6 -19.0 2 2 H V + 0 0 76 24,-0.1 2,-0.3 22,-0.0 24,-0.3 -0.807 360.0 160.6 -74.5 106.9 2.3 -23.0 -20.7 3 3 H Q E -A 25 0A 89 22,-2.6 22,-2.3 -2,-0.9 2,-0.4 -0.988 37.7-159.5-147.1 155.1 -0.2 -20.3 -19.6 4 4 H L E -A 24 0A 5 -2,-0.3 2,-0.5 117,-0.2 119,-0.4 -0.993 13.9-162.2-129.3 131.7 -3.6 -18.7 -20.2 5 5 H V E -A 23 0A 46 18,-2.8 18,-2.5 -2,-0.4 2,-0.1 -0.962 5.8-153.5-123.2 121.8 -4.5 -15.3 -19.0 6 6 H E E +A 22 0A 4 -2,-0.5 2,-0.3 118,-0.3 16,-0.2 -0.311 22.7 176.2 -71.2 167.7 -8.0 -13.9 -18.7 7 7 H S + 0 0 52 14,-1.3 2,-0.6 -2,-0.1 118,-0.0 -0.932 40.7 51.8-159.0-176.4 -8.4 -10.0 -18.9 8 8 H G + 0 0 58 -2,-0.3 118,-0.2 12,-0.2 12,-0.1 -0.724 60.4 131.7 79.8-118.1 -11.1 -7.3 -18.9 9 9 H G + 0 0 6 -2,-0.6 118,-0.3 116,-0.2 10,-0.1 -0.381 21.5 126.2 71.4-147.4 -13.3 -8.0 -15.9 10 10 H G E -d 127 0B 36 116,-2.1 118,-0.7 -2,-0.1 2,-0.2 0.156 64.5 -66.0 82.3 159.7 -14.1 -5.0 -13.7 11 11 H L E +d 128 0B 66 116,-0.2 2,-0.3 118,-0.1 118,-0.2 -0.531 50.9 161.4 -85.1 149.4 -17.4 -3.6 -12.5 12 12 H V E -d 129 0B 42 116,-1.6 118,-0.5 -2,-0.2 4,-0.2 -0.916 42.3 -95.8-161.7 152.0 -19.9 -2.0 -14.8 13 13 H K > - 0 0 115 -2,-0.3 3,-0.5 116,-0.2 73,-0.2 -0.011 55.6 -72.0 -71.4 169.7 -23.6 -1.3 -14.2 14 14 H P T 3 S+ 0 0 73 0, 0.0 73,-0.3 0, 0.0 72,-0.2 -0.207 124.3 29.5 -59.3 162.2 -26.5 -3.7 -15.2 15 15 H G T 3 S+ 0 0 57 71,-4.7 72,-0.1 70,-0.2 -2,-0.1 0.862 102.1 136.2 49.2 37.8 -27.2 -3.7 -19.0 16 16 H G < - 0 0 12 -3,-0.5 70,-1.6 70,-0.4 69,-0.4 -0.170 48.6-124.8 -98.8-165.0 -23.5 -2.9 -19.2 17 17 H S + 0 0 68 68,-0.2 2,-0.3 67,-0.1 67,-0.2 -0.988 24.3 170.3-150.6 150.8 -20.8 -4.2 -21.5 18 18 H L E -J 83 0C 32 65,-2.4 65,-3.5 -2,-0.3 2,-0.5 -0.961 21.6-148.7-160.3 141.8 -17.5 -5.9 -21.2 19 19 H R E -J 82 0C 133 -2,-0.3 2,-0.5 63,-0.2 63,-0.2 -0.845 16.0-161.2-119.3 99.8 -15.1 -7.6 -23.4 20 20 H L E -J 81 0C 0 61,-1.5 61,-2.7 -2,-0.5 -12,-0.2 -0.599 8.6-165.4 -77.6 120.8 -13.1 -10.3 -21.7 21 21 H S - 0 0 32 -2,-0.5 -14,-1.3 59,-0.3 2,-0.2 -0.449 4.2-164.2 -89.1 174.0 -10.0 -11.2 -23.6 22 22 H a E -A 6 0A 0 -16,-0.2 57,-0.6 -2,-0.2 2,-0.3 -0.714 6.7-159.9-161.8 114.6 -8.0 -14.3 -22.8 23 23 H A E -AB 5 78A 39 -18,-2.5 -18,-2.8 -2,-0.2 2,-0.4 -0.697 3.2-157.9-103.0 152.6 -4.5 -14.7 -24.1 24 24 H A E +A 4 0A 7 53,-1.6 2,-0.3 -2,-0.3 -20,-0.2 -0.987 16.8 160.0-136.2 136.0 -2.5 -17.9 -24.6 25 25 H S E +A 3 0A 61 -22,-2.3 -22,-2.6 -2,-0.4 3,-0.1 -0.974 52.8 50.5-142.7 151.8 1.2 -18.8 -24.8 26 26 H G S S+ 0 0 50 1,-0.3 2,-0.2 -2,-0.3 -24,-0.1 0.488 103.9 39.3 106.4 5.2 3.2 -22.0 -24.3 27 27 H F S S- 0 0 34 -24,-0.1 2,-1.1 -25,-0.0 -1,-0.3 -0.891 99.0 -72.9-161.4-177.9 1.3 -24.4 -26.5 28 28 H T > - 0 0 86 -2,-0.2 3,-3.3 1,-0.2 4,-0.2 -0.746 36.8-170.3 -97.8 92.5 -0.5 -24.6 -29.9 29 29 H F G > S+ 0 0 0 -2,-1.1 3,-2.8 1,-0.3 -1,-0.2 0.913 85.4 62.8 -37.0 -60.3 -3.8 -22.7 -29.4 30 30 H S G 3 S+ 0 0 55 44,-0.4 -1,-0.3 1,-0.3 23,-0.1 0.610 92.8 64.9 -46.9 -19.1 -5.0 -23.9 -32.8 31 31 H S G < S+ 0 0 76 -3,-3.3 2,-0.3 22,-0.1 -1,-0.3 0.469 102.0 57.4 -82.6 -0.3 -4.8 -27.5 -31.4 32 32 H Y S < S- 0 0 55 -3,-2.8 68,-0.2 -4,-0.2 2,-0.1 -0.970 71.6-127.8-139.9 144.9 -7.6 -26.9 -28.8 33 33 H S E -E 99 0B 0 66,-2.2 66,-1.1 -2,-0.3 2,-0.3 -0.322 35.0-136.9 -71.5 162.0 -11.2 -25.8 -28.3 34 34 H M E -EF 98 51B 0 17,-1.9 17,-1.1 64,-0.2 2,-0.4 -0.933 16.3-164.4-129.8 160.5 -11.6 -23.0 -25.8 35 35 H N E -EF 97 50B 2 62,-0.7 62,-1.8 -2,-0.3 2,-0.3 -0.992 13.4-149.0-147.4 125.6 -14.2 -22.6 -23.0 36 36 H W E +E 96 0B 0 13,-1.0 12,-2.4 -2,-0.4 2,-0.3 -0.727 24.0 179.6 -85.4 152.1 -15.4 -19.8 -20.8 37 37 H V E -EF 95 47B 0 58,-1.1 58,-2.8 -2,-0.3 2,-0.3 -0.969 10.1-150.5-153.6 136.7 -16.6 -20.8 -17.4 38 38 H R E -EF 94 46B 7 8,-2.8 8,-2.6 -2,-0.3 2,-0.4 -0.804 12.3-166.8-116.3 153.0 -18.0 -18.9 -14.4 39 39 H Q E -E 93 0B 27 54,-1.2 54,-0.6 -2,-0.3 6,-0.1 -0.877 16.5-150.5-129.3 105.5 -18.1 -19.0 -10.7 40 40 H A > - 0 0 26 4,-0.5 3,-1.3 -2,-0.4 52,-0.2 -0.473 45.3 -89.1 -61.5 133.5 -20.5 -16.7 -9.0 41 41 H P T 3 S+ 0 0 89 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.281 116.4 11.5 -40.6 131.0 -19.1 -15.9 -5.6 42 42 H G T 3 S+ 0 0 89 1,-0.2 -2,-0.1 -3,-0.1 0, 0.0 -0.108 115.6 94.9 84.8 -34.5 -20.5 -18.5 -3.2 43 43 H R S < S- 0 0 197 -3,-1.3 -1,-0.2 -2,-0.2 2,-0.1 -0.122 73.4-103.0 -88.0 177.9 -21.8 -20.7 -6.1 44 44 H G - 0 0 27 1,-0.1 -4,-0.5 -3,-0.1 -1,-0.1 -0.445 52.3 -61.8 -95.9 179.9 -20.4 -23.7 -8.1 45 45 H L - 0 0 7 -2,-0.1 2,-0.4 -6,-0.1 281,-0.2 -0.326 46.6-174.7 -73.6 133.3 -18.9 -24.0 -11.6 46 46 H E E -F 38 0B 63 -8,-2.6 -8,-2.8 279,-0.1 15,-0.1 -0.962 21.0-133.5-130.5 107.3 -21.1 -23.1 -14.5 47 47 H W E -F 37 0B 21 -2,-0.4 -10,-0.3 -10,-0.2 3,-0.1 -0.160 25.3-179.5 -49.5 148.6 -19.8 -23.6 -18.1 48 48 H V E - 0 0 0 -12,-2.4 13,-0.3 1,-0.5 2,-0.2 0.532 48.4 -12.1-117.2 -88.9 -20.4 -20.6 -20.5 49 49 H S E - 0 0 0 11,-0.2 -13,-1.0 -13,-0.1 -1,-0.5 -0.674 49.8-162.7-113.7 165.4 -19.3 -20.9 -24.1 50 50 H S E +FG 35 59B 0 9,-1.7 9,-0.8 -2,-0.2 2,-0.3 -0.925 8.6 175.0-138.2 172.9 -17.3 -23.1 -26.2 51 51 H I E -F 34 0B 0 -17,-1.1 -17,-1.9 -2,-0.3 2,-0.1 -0.930 23.2-123.8-168.0 153.1 -15.7 -22.8 -29.6 52 52 H S > - 0 0 0 4,-0.4 3,-0.9 -2,-0.3 -19,-0.1 -0.429 30.7-102.5-100.7-178.9 -13.3 -25.0 -31.7 53 52AH N T 3 S+ 0 0 44 1,-0.3 21,-0.2 2,-0.2 -22,-0.1 0.873 124.7 56.4 -71.0 -41.4 -9.9 -24.4 -33.2 54 53 H T T 3 S- 0 0 105 2,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.309 122.8-114.6 -70.2 11.4 -11.4 -23.8 -36.6 55 54 H S S < S+ 0 0 52 -3,-0.9 2,-0.3 1,-0.2 -2,-0.2 0.892 77.4 120.6 56.7 44.8 -13.4 -21.2 -34.7 56 55 H T + 0 0 51 1,-0.2 -4,-0.4 0, 0.0 -1,-0.2 -0.995 37.2 46.4-144.5 149.5 -16.7 -23.0 -35.2 57 56 H Y - 0 0 44 -2,-0.3 2,-0.6 1,-0.2 -1,-0.2 0.876 64.9-164.8 83.4 57.7 -19.5 -24.7 -33.2 58 57 H I - 0 0 66 -3,-0.1 2,-0.3 -7,-0.1 -7,-0.2 -0.623 5.8-169.9 -80.8 115.1 -20.0 -21.9 -30.7 59 58 H Y B -G 50 0B 44 -9,-0.8 -9,-1.7 -2,-0.6 2,-0.3 -0.747 3.4-173.4-101.4 156.9 -22.1 -23.2 -27.8 60 59 H Y - 0 0 46 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.982 27.6-107.8-148.3 150.2 -23.6 -21.1 -25.1 61 60 H A >> - 0 0 12 -13,-0.3 3,-3.0 -2,-0.3 4,-2.8 -0.630 28.6-124.3 -81.7 143.9 -25.4 -21.5 -21.8 62 61 H D T 34 S+ 0 0 115 1,-0.3 -1,-0.1 -2,-0.3 -14,-0.0 0.826 115.5 59.9 -50.6 -32.1 -29.1 -20.7 -21.8 63 62 H S T 34 S+ 0 0 44 1,-0.2 -1,-0.3 -15,-0.1 -15,-0.0 0.625 119.3 27.6 -72.7 -11.2 -28.3 -18.3 -19.0 64 63 H V T X> S+ 0 0 0 -3,-3.0 3,-1.5 -16,-0.1 4,-1.2 0.646 86.1 119.6-126.9 -30.6 -26.0 -16.5 -21.4 65 64 H E T 3< S+ 0 0 103 -4,-2.8 4,-0.1 1,-0.2 -6,-0.0 0.021 79.0 22.6 -43.3 152.0 -27.2 -17.0 -25.0 66 65 H G T 34 S+ 0 0 89 2,-0.3 -1,-0.2 1,-0.1 3,-0.1 0.539 121.9 58.4 63.7 6.8 -28.1 -13.8 -26.9 67 66 H R T <4 S+ 0 0 21 -3,-1.5 17,-2.1 1,-0.3 2,-0.3 0.559 94.9 59.1-132.0 -26.2 -25.9 -11.7 -24.7 68 67 H F E < -K 83 0C 5 -4,-1.2 2,-0.5 15,-0.2 -2,-0.3 -0.837 60.3-156.9-114.3 149.8 -22.3 -13.1 -24.9 69 68 H T E -K 82 0C 66 13,-1.9 13,-2.2 -2,-0.3 2,-0.6 -0.832 5.2-153.4-134.6 93.9 -20.2 -13.5 -28.0 70 69 H L E +K 81 0C 5 -2,-0.5 11,-0.2 11,-0.2 2,-0.2 -0.536 24.6 173.4 -72.5 110.3 -17.3 -16.0 -28.1 71 70 H S - 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