==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=16-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 25-JUL-12 4GAJ . COMPND 2 MOLECULE: NEUTRALIZING ANTIBODY AP33 HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR J.A.POTTER,A.OWSIANKA,G.L TAYLOR,A.H.PATEL . 434 5 4 3 1 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19688.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 267 61.5 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 . 174 40.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 5 1.2 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 0.2 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 . 37 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 13 3.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 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 RESIDUES PER ALPHA HELIX . 0 1 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 PARALLEL BRIDGES PER LADDER . 4 2 8 4 3 7 2 1 0 1 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 1 4 1 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 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 0 203 0, 0.0 2,-0.3 0, 0.0 26,-0.0 0.000 360.0 360.0 360.0 58.3 3.8 -3.3 22.7 2 2 H V - 0 0 22 22,-0.0 2,-0.4 25,-0.0 24,-0.2 -0.686 360.0-157.0 -70.8 139.9 1.1 -0.9 23.9 3 3 H Q E -A 25 0A 120 22,-3.0 22,-2.3 -2,-0.3 2,-0.4 -0.983 9.7-165.2-127.4 141.2 1.2 2.1 21.6 4 4 H L E -A 24 0A 13 -2,-0.4 105,-0.4 103,-0.3 2,-0.3 -0.936 4.8-175.1-125.3 145.2 -0.1 5.6 22.4 5 5 H Q E -A 23 0A 116 18,-1.4 18,-2.4 -2,-0.4 2,-0.2 -0.884 13.1-146.4-151.1 120.7 -0.8 8.4 20.0 6 6 H E E +A 22 0A 13 -2,-0.3 2,-0.3 16,-0.2 16,-0.2 -0.538 21.3 173.8 -80.4 139.1 -1.8 12.0 20.6 7 7 H S E +A 21 0A 52 14,-3.0 14,-3.1 -2,-0.2 104,-0.1 -0.995 18.0 105.1-144.4 156.5 -4.0 13.9 18.2 8 8 H G S S- 0 0 35 -2,-0.3 12,-0.1 12,-0.2 104,-0.1 -0.902 70.4 -44.7 159.6 175.7 -5.7 17.3 18.1 9 9 H P - 0 0 81 0, 0.0 191,-0.1 0, 0.0 3,-0.1 -0.362 39.2-147.6 -67.3 149.3 -5.4 20.7 16.5 10 10 H S S S+ 0 0 15 1,-0.1 104,-1.5 103,-0.1 2,-0.4 0.427 80.8 57.5 -94.2 0.5 -1.9 22.1 16.4 11 11 H L E +d 114 0B 36 102,-0.2 2,-0.3 189,-0.1 104,-0.2 -0.974 60.4 175.3-131.7 127.2 -3.1 25.7 16.7 12 12 H V E -d 115 0B 15 102,-3.6 104,-2.4 -2,-0.4 6,-0.1 -0.936 26.5-122.8-128.6 152.3 -5.2 27.3 19.5 13 13 H K > - 0 0 130 -2,-0.3 3,-1.9 102,-0.2 71,-0.3 -0.644 40.6 -91.1 -93.0 145.2 -6.4 30.8 20.2 14 14 H P T 3 S+ 0 0 50 0, 0.0 71,-0.2 0, 0.0 -1,-0.1 -0.151 111.8 19.4 -50.7 147.5 -5.6 32.7 23.4 15 15 H S T 3 S+ 0 0 86 69,-3.9 68,-0.5 1,-0.2 70,-0.1 0.407 103.8 110.7 72.2 -6.8 -8.3 32.2 26.1 16 16 H Q S < S- 0 0 99 -3,-1.9 68,-2.1 68,-0.2 2,-0.4 -0.395 74.9 -95.5 -91.8 179.5 -9.8 29.1 24.4 17 17 H T - 0 0 64 65,-0.2 2,-0.5 66,-0.2 65,-0.2 -0.795 28.9-147.1 -94.5 130.8 -9.8 25.4 25.4 18 18 H L E - B 0 81A 1 63,-2.9 63,-2.2 -2,-0.4 2,-0.5 -0.909 17.5-167.7 -95.5 128.4 -7.1 23.1 24.0 19 19 H S E + B 0 80A 59 -2,-0.5 2,-0.3 61,-0.2 61,-0.2 -0.974 9.4 173.7-123.8 129.6 -8.4 19.6 23.5 20 20 H L E - B 0 79A 2 59,-2.3 59,-2.6 -2,-0.5 2,-0.4 -0.964 14.6-150.6-135.1 154.7 -6.2 16.6 22.8 21 21 H T E -AB 7 78A 32 -14,-3.1 -14,-3.0 -2,-0.3 2,-0.5 -0.937 2.4-157.6-127.7 143.4 -6.8 13.0 22.4 22 22 H a E -AB 6 77A 0 55,-3.3 55,-1.9 -2,-0.4 2,-0.4 -0.962 10.9-158.7-123.0 114.5 -4.6 9.9 23.1 23 23 H S E -AB 5 76A 39 -18,-2.4 -18,-1.4 -2,-0.5 2,-0.4 -0.762 7.6-156.4 -94.1 135.1 -5.5 6.6 21.3 24 24 H V E +A 4 0A 10 51,-2.3 2,-0.3 -2,-0.4 -20,-0.2 -0.922 12.9 178.8-116.5 134.5 -4.2 3.5 22.9 25 25 H T E +A 3 0A 84 -22,-2.3 -22,-3.0 -2,-0.4 50,-0.0 -0.994 58.6 48.2-138.3 137.0 -3.7 0.2 20.9 26 26 H G 0 0 58 -2,-0.3 -1,-0.1 -24,-0.2 -22,-0.0 0.676 360.0 360.0 101.0 28.2 -2.3 -3.1 22.3 27 27 H D 0 0 131 -3,-0.1 -2,-0.1 -24,-0.1 -25,-0.0 0.239 360.0 360.0 137.5 360.0 -4.4 -3.6 25.5 28 ! 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 29 30 H T 0 0 123 0, 0.0 3,-0.1 0, 0.0 23,-0.0 0.000 360.0 360.0 360.0 10.6 -8.8 -0.5 33.5 30 31 H S - 0 0 78 1,-0.1 2,-0.1 21,-0.0 22,-0.1 0.818 360.0 -23.9-101.8 -56.6 -5.2 -1.7 34.3 31 32 H G S S- 0 0 7 20,-0.1 21,-1.1 67,-0.1 2,-0.5 -0.281 79.3 -41.3-137.9-145.7 -3.1 1.5 35.2 32 33 H Y E -EF 51 97C 4 65,-2.6 65,-2.5 19,-0.2 2,-0.6 -0.884 38.1-157.4-108.9 121.6 -2.4 5.3 35.1 33 34 H W E -EF 50 96C 24 17,-2.0 17,-1.0 -2,-0.5 2,-0.3 -0.844 22.4-166.3-106.4 117.4 -2.9 7.3 31.9 34 35 H N E -EF 49 95C 0 61,-3.5 61,-1.9 -2,-0.6 2,-0.4 -0.687 25.3-154.2-118.1 157.6 -0.9 10.5 31.8 35 36 H W E +EF 48 94C 0 13,-2.5 12,-2.0 -2,-0.3 13,-1.5 -0.972 22.8 167.1-120.7 140.2 -0.3 13.8 30.1 36 37 H I E -EF 46 93C 0 57,-2.2 57,-3.6 -2,-0.4 2,-0.3 -0.962 14.1-156.5-145.2 151.0 3.0 15.6 30.1 37 38 H R E -EF 45 92C 8 8,-2.2 8,-3.0 -2,-0.3 2,-0.5 -0.963 10.3-146.7-135.5 157.8 4.4 18.5 28.1 38 39 H K E -EF 44 91C 21 53,-2.0 53,-2.1 -2,-0.3 6,-0.2 -0.989 24.4-133.3-121.2 120.4 7.8 19.9 27.0 39 40 H F > - 0 0 49 4,-2.9 3,-2.7 -2,-0.5 51,-0.2 -0.195 30.8-102.1 -69.8 162.6 8.1 23.7 26.7 40 41 H P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 50,-0.1 0.810 126.0 55.9 -60.7 -25.9 9.8 25.3 23.7 41 42 H G T 3 S- 0 0 56 2,-0.1 -2,-0.1 1,-0.0 0, 0.0 0.254 123.2-107.7 -87.4 8.8 12.9 25.8 25.8 42 43 H N S < S+ 0 0 93 -3,-2.7 2,-0.1 1,-0.3 48,-0.0 0.155 71.5 136.3 94.3 -12.5 12.9 22.1 26.6 43 44 H K - 0 0 125 -5,-0.1 -4,-2.9 1,-0.1 2,-0.4 -0.397 45.7-136.3 -67.7 141.5 11.7 21.8 30.2 44 45 H L E -E 38 0C 14 271,-0.3 270,-0.5 -6,-0.2 2,-0.4 -0.849 16.7-167.4-100.3 140.8 9.2 19.0 31.0 45 46 H E E -E 37 0C 44 -8,-3.0 -8,-2.2 -2,-0.4 2,-0.5 -0.985 20.6-129.1-127.3 134.1 6.1 19.5 33.2 46 47 H Y E -E 36 0C 0 266,-0.5 -10,-0.2 -2,-0.4 13,-0.1 -0.690 25.2-179.5 -82.4 123.5 3.9 16.7 34.5 47 48 H M E - 0 0 0 -12,-2.0 12,-2.1 -2,-0.5 2,-0.3 0.942 40.8 -87.6 -93.3 -57.0 0.2 17.5 33.8 48 49 H G E -EG 35 58C 0 -13,-1.5 -13,-2.5 10,-0.2 -1,-0.3 -0.978 28.5-119.8 172.7-178.6 -1.9 14.7 35.2 49 50 H Y E -EG 34 57C 1 8,-2.1 8,-1.3 -2,-0.3 2,-0.4 -0.858 7.6-144.4-130.8 174.2 -3.5 11.3 35.0 50 51 H I E -EG 33 56C 11 -17,-1.0 -17,-2.0 -2,-0.3 6,-0.2 -0.926 33.7-144.3-129.9 122.9 -6.8 9.5 35.1 51 52 H S E > -E 32 0C 1 4,-3.1 3,-1.8 -2,-0.4 -19,-0.2 -0.261 30.9 -93.4 -72.4 168.8 -6.3 6.1 36.7 52 53 H Y T 3 S+ 0 0 69 -21,-1.1 -20,-0.1 1,-0.3 -1,-0.1 0.731 125.0 59.5 -48.4 -27.4 -8.0 2.8 35.8 53 54 H S T 3 S- 0 0 76 2,-0.1 -1,-0.3 -22,-0.1 3,-0.1 0.605 119.7-105.7 -86.8 -8.6 -10.6 3.7 38.5 54 55 H G S < S+ 0 0 33 -3,-1.8 -2,-0.1 1,-0.4 2,-0.1 0.160 78.9 135.7 99.0 -13.0 -11.7 7.0 37.0 55 56 H S - 0 0 48 -5,-0.1 -4,-3.1 1,-0.1 -1,-0.4 -0.374 40.4-151.2 -69.1 144.5 -9.8 8.9 39.6 56 57 H T E -G 50 0C 47 -6,-0.2 2,-0.4 -3,-0.1 377,-0.3 -0.830 15.8-168.3-117.4 155.7 -7.7 11.9 38.6 57 58 H Y E -G 49 0C 0 -8,-1.3 -8,-2.1 -2,-0.3 2,-0.4 -0.962 14.8-175.5-142.3 124.3 -4.6 13.6 39.8 58 59 H Y E -G 48 0C 22 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.949 35.7-102.8-119.8 139.4 -3.6 17.0 38.4 59 60 H N >> - 0 0 11 -12,-2.1 3,-2.7 -2,-0.4 4,-1.3 -0.446 33.4-131.6 -52.2 119.1 -0.5 19.2 39.0 60 61 H L T 34 S+ 0 0 86 1,-0.3 4,-0.3 -2,-0.3 -1,-0.2 0.707 103.9 70.1 -54.0 -19.5 -1.8 21.9 41.4 61 62 H S T 34 S+ 0 0 68 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.461 116.8 22.4 -76.3 0.7 -0.2 24.6 39.1 62 63 H L T X> S+ 0 0 4 -3,-2.7 3,-2.6 -15,-0.1 4,-0.8 0.440 86.1 114.0-137.6 -11.3 -3.0 23.7 36.6 63 64 H R T 3< S+ 0 0 134 -4,-1.3 -3,-0.1 1,-0.3 -2,-0.1 0.649 77.5 55.8 -46.8 -24.5 -5.7 22.2 38.8 64 65 H S T 34 S+ 0 0 115 -4,-0.3 -1,-0.3 1,-0.2 -4,-0.1 0.771 118.0 30.3 -78.3 -26.7 -8.1 25.1 38.0 65 66 H R T <4 S+ 0 0 50 -3,-2.6 17,-2.3 17,-0.1 2,-0.3 0.287 102.0 94.1-112.2 3.5 -7.9 24.8 34.2 66 67 H I E < +C 81 0A 14 -4,-0.8 2,-0.3 15,-0.2 15,-0.2 -0.778 37.5 170.5-115.1 150.3 -7.3 21.1 33.6 67 68 H S E -C 80 0A 33 13,-2.1 13,-2.1 -2,-0.3 2,-0.5 -0.937 6.9-173.8-153.4 126.4 -9.5 18.1 32.9 68 69 H I E +C 79 0A 2 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.988 16.1 164.6-123.4 129.8 -8.5 14.6 31.9 69 70 H T E -C 78 0A 66 9,-1.8 9,-3.4 -2,-0.5 2,-0.3 -0.844 17.6-150.4-134.4 168.2 -11.2 12.1 31.0 70 71 H R E -C 77 0A 72 -2,-0.3 2,-0.4 7,-0.3 7,-0.2 -0.967 14.1-152.8-136.8 158.3 -11.3 8.6 29.3 71 72 H D E > > -C 76 0A 56 5,-2.6 3,-1.8 -2,-0.3 5,-1.6 -0.897 15.1-163.6-127.0 101.6 -13.7 6.6 27.2 72 73 H T T 3 5S+ 0 0 78 -2,-0.4 5,-0.1 1,-0.3 -1,-0.0 0.361 84.4 54.7 -72.4 7.3 -12.7 3.0 27.9 73 74 H S T 3 5S+ 0 0 94 3,-0.1 -1,-0.3 1,-0.1 -3,-0.0 0.288 108.5 43.5-127.7 2.7 -14.5 1.7 24.9 74 75 H K T < 5S- 0 0 129 -3,-1.8 -50,-0.2 2,-0.2 -2,-0.2 0.165 108.8-129.5-105.5 4.8 -13.0 3.8 22.3 75 76 H N T 5 + 0 0 87 -4,-0.4 -51,-2.3 1,-0.2 2,-0.3 0.957 68.1 122.4 51.2 53.4 -9.8 3.0 24.1 76 77 H Q E < -BC 23 71A 51 -5,-1.6 -5,-2.6 -53,-0.2 2,-0.3 -0.966 46.0-160.6-142.9 151.5 -9.0 6.7 24.2 77 78 H Y E -BC 22 70A 4 -55,-1.9 -55,-3.3 -2,-0.3 2,-0.4 -0.976 12.6-141.9-143.1 165.9 -8.4 9.4 26.7 78 79 H Y E -BC 21 69A 51 -9,-3.4 -9,-1.8 -2,-0.3 2,-0.4 -0.918 10.6-157.0-137.7 138.5 -8.5 13.1 26.7 79 80 H L E -BC 20 68A 2 -59,-2.6 -59,-2.3 -2,-0.4 2,-0.4 -0.924 12.5-177.5-112.5 138.2 -6.9 16.4 27.9 80 81 H Q E -BC 19 67A 81 -13,-2.1 -13,-2.1 -2,-0.4 2,-0.5 -0.990 1.0-179.3-134.8 124.7 -8.8 19.6 28.1 81 82 H L E -BC 18 66A 0 -63,-2.2 -63,-2.9 -2,-0.4 3,-0.3 -0.979 14.6-154.2-130.7 113.0 -7.0 22.7 29.2 82 82AH N + 0 0 51 -17,-2.3 -65,-0.2 -2,-0.5 -66,-0.2 -0.323 63.6 17.8 -79.7 164.7 -9.1 25.9 29.5 83 82BH S S S- 0 0 75 -68,-0.5 -1,-0.2 1,-0.1 -66,-0.2 0.827 81.1-167.5 47.5 53.7 -8.2 29.6 29.2 84 82CH V - 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