==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 12-AUG-09 3INU . COMPND 2 MOLECULE: KZ52 ANTIBODY FRAGMENT HEAVY CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.E.LEE,M.L.FUSCO,D.M.ABELSON,A.J.HESSELL,D.R.BURTON,E.O.SAP . 885 4 8 8 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38057.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 598 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 353 39.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 . 103 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 79 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 23 2.6 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 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 0 RESIDUES PER ALPHA HELIX . 0 0 2 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 0 PARALLEL BRIDGES PER LADDER . 9 10 11 4 9 16 3 0 3 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 . 0 0 10 0 2 4 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 0 207 0, 0.0 2,-0.7 0, 0.0 26,-0.1 0.000 360.0 360.0 360.0 -51.1 -66.7 75.1 -156.4 2 2 H V + 0 0 66 24,-0.1 2,-0.3 22,-0.1 24,-0.2 -0.838 360.0 124.7 -96.4 112.4 -70.1 73.5 -156.1 3 3 H Q E -A 25 0A 79 22,-2.7 22,-2.4 -2,-0.7 2,-0.5 -0.961 56.2-118.1-161.8 170.9 -70.4 71.8 -152.7 4 4 H L E -A 24 0A 7 111,-0.4 2,-0.7 -2,-0.3 113,-0.7 -0.968 20.9-157.4-126.5 114.3 -71.9 71.1 -149.3 5 5 H L E -A 23 0A 87 18,-3.4 18,-2.8 -2,-0.5 2,-0.3 -0.843 16.6-159.5 -98.7 117.0 -70.0 71.8 -146.1 6 6 H E E +A 22 0A 17 -2,-0.7 2,-0.3 16,-0.2 16,-0.2 -0.674 14.3 172.5 -97.5 144.2 -71.3 69.8 -143.2 7 7 H S E +A 21 0A 63 14,-2.9 14,-2.3 -2,-0.3 2,-0.2 -0.948 36.9 51.3-141.8 169.8 -70.9 70.4 -139.5 8 8 H G + 0 0 45 -2,-0.3 12,-0.2 12,-0.2 112,-0.2 -0.564 55.1 104.7 100.7-171.4 -72.2 68.9 -136.3 9 9 H G + 0 0 23 10,-0.3 2,-0.3 -2,-0.2 112,-0.2 -0.315 27.6 121.2 91.7-175.7 -72.3 65.3 -135.2 10 10 H G E -d 121 0B 19 110,-2.2 112,-2.4 -2,-0.1 2,-0.3 -0.810 64.5 -11.5 117.6-159.5 -70.2 63.4 -132.7 11 11 H L E +d 122 0B 43 -2,-0.3 2,-0.3 110,-0.2 112,-0.2 -0.573 59.2 168.1 -84.6 139.7 -70.9 61.4 -129.6 12 12 H V E -d 123 0B 14 110,-2.6 112,-2.5 -2,-0.3 3,-0.1 -0.994 32.5-113.2-150.4 147.4 -74.3 61.5 -127.9 13 13 H K > - 0 0 116 -2,-0.3 3,-2.9 110,-0.2 73,-0.3 -0.458 46.6 -87.5 -78.4 150.7 -76.0 59.5 -125.1 14 14 H P T 3 S+ 0 0 74 0, 0.0 73,-0.2 0, 0.0 -1,-0.1 -0.343 121.8 23.0 -52.0 136.5 -79.0 57.3 -125.8 15 15 H G T 3 S+ 0 0 54 71,-3.2 70,-0.7 1,-0.3 72,-0.1 0.235 104.7 117.5 87.8 -14.0 -82.0 59.5 -125.5 16 16 H G < - 0 0 22 -3,-2.9 70,-2.6 70,-0.3 2,-0.3 -0.037 56.2-130.5 -76.4-174.7 -79.8 62.5 -126.2 17 17 H S - 0 0 64 67,-0.2 2,-0.3 68,-0.2 67,-0.2 -0.944 18.5-176.5-144.4 162.7 -80.1 64.9 -129.1 18 18 H L E - B 0 83A 34 65,-2.3 65,-3.0 -2,-0.3 2,-0.5 -0.984 16.7-139.4-159.5 144.3 -77.9 66.5 -131.7 19 19 H R E - B 0 82A 123 -2,-0.3 -10,-0.3 63,-0.2 2,-0.3 -0.965 14.2-162.8-120.5 122.4 -78.2 69.0 -134.5 20 20 H L E - B 0 81A 0 61,-3.0 61,-2.4 -2,-0.5 2,-0.3 -0.737 8.8-172.1 -95.8 147.8 -76.6 68.6 -137.9 21 21 H S E -AB 7 80A 29 -14,-2.3 -14,-2.9 -2,-0.3 2,-0.4 -0.992 9.6-164.4-139.4 154.1 -76.1 71.5 -140.4 22 22 H a E -AB 6 79A 3 57,-2.5 57,-2.5 -2,-0.3 2,-0.5 -0.998 5.1-158.6-136.0 133.7 -75.0 71.8 -144.0 23 23 H A E -AB 5 78A 42 -18,-2.8 -18,-3.4 -2,-0.4 2,-0.4 -0.960 12.2-146.6-114.9 128.2 -73.9 75.0 -145.8 24 24 H A E -A 4 0A 15 53,-2.5 2,-0.3 -2,-0.5 -20,-0.2 -0.749 17.0-179.9 -91.6 138.1 -74.0 75.1 -149.6 25 25 H S E +A 3 0A 45 -22,-2.4 -22,-2.7 -2,-0.4 3,-0.1 -0.987 63.7 33.5-129.8 148.5 -71.5 77.1 -151.6 26 26 H G S S+ 0 0 53 -2,-0.3 2,-0.3 -24,-0.2 -24,-0.1 0.484 117.7 41.0 90.4 2.2 -71.3 77.4 -155.4 27 27 H F S S- 0 0 26 -24,-0.1 2,-0.6 -26,-0.1 -1,-0.2 -0.964 85.9 -98.6-166.6 175.4 -75.1 77.3 -155.8 28 28 H T > - 0 0 70 -2,-0.3 3,-1.9 1,-0.1 4,-0.3 -0.904 16.0-149.8-115.5 116.5 -78.3 78.5 -154.3 29 29 H L G > S+ 0 0 2 -2,-0.6 3,-2.3 1,-0.3 -1,-0.1 0.821 88.6 76.7 -47.5 -40.3 -80.4 76.2 -152.0 30 30 H I G 3 S+ 0 0 71 1,-0.3 -1,-0.3 44,-0.3 23,-0.1 0.773 91.6 53.8 -46.9 -33.4 -83.6 77.8 -153.1 31 31 H N G < S+ 0 0 108 -3,-1.9 2,-0.3 43,-0.1 -1,-0.3 0.646 102.9 60.1 -81.6 -14.6 -83.6 75.9 -156.4 32 32 H Y S < S- 0 0 44 -3,-2.3 2,-0.4 -4,-0.3 68,-0.1 -0.814 75.9-118.4-122.7 155.4 -83.2 72.3 -155.2 33 33 H R - 0 0 28 67,-0.3 66,-2.5 66,-0.3 2,-0.4 -0.750 39.3-143.3 -84.3 134.2 -85.0 69.8 -153.0 34 34 H M E -EF 51 98B 1 17,-2.8 17,-2.8 -2,-0.4 2,-0.3 -0.819 20.2-179.3-111.5 141.7 -82.7 68.8 -150.1 35 35 H N E -EF 50 97B 1 62,-2.8 62,-2.5 -2,-0.4 2,-0.4 -0.846 22.7-140.5-130.9 166.3 -82.2 65.5 -148.4 36 36 H W E -EF 49 96B 0 13,-2.2 12,-2.5 -2,-0.3 13,-1.7 -0.994 20.9-176.4-121.7 136.7 -80.3 63.7 -145.7 37 37 H V E -EF 47 95B 0 58,-2.6 58,-3.8 -2,-0.4 2,-0.3 -0.986 7.8-156.4-130.8 141.8 -79.0 60.2 -146.2 38 38 H R E -EF 46 94B 11 8,-2.7 8,-2.8 -2,-0.4 2,-0.4 -0.854 9.3-168.2-119.8 156.6 -77.2 58.0 -143.6 39 39 H Q E -EF 45 93B 22 54,-2.4 54,-3.5 -2,-0.3 6,-0.2 -0.956 16.7-142.7-145.8 120.0 -74.8 55.1 -143.8 40 40 H A > - 0 0 17 4,-0.6 3,-3.0 -2,-0.4 52,-0.2 -0.637 45.2 -78.2 -86.9 143.8 -74.0 53.0 -140.8 41 41 H P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.115 117.7 2.3 -44.1 109.5 -70.5 51.8 -140.3 42 42 H G T 3 S+ 0 0 87 1,-0.3 2,-0.2 -3,-0.1 -2,-0.0 0.448 116.6 88.2 96.3 2.5 -70.1 48.8 -142.6 43 43 H K S < S- 0 0 141 -3,-3.0 -1,-0.3 1,-0.2 290,-0.0 -0.509 73.8 -78.1-127.4-168.3 -73.5 48.9 -144.3 44 44 H G - 0 0 28 -2,-0.2 -4,-0.6 1,-0.1 2,-0.4 0.171 52.0 -78.6 -83.6-163.2 -75.5 50.4 -147.1 45 45 H L E -E 39 0B 14 287,-0.4 286,-0.5 -6,-0.2 2,-0.5 -0.840 37.0-168.2-108.6 139.1 -77.2 53.7 -147.7 46 46 H E E -E 38 0B 73 -8,-2.8 -8,-2.7 -2,-0.4 2,-0.1 -0.961 20.6-131.4-132.4 116.0 -80.5 54.8 -146.2 47 47 H W E +E 37 0B 17 282,-0.5 -10,-0.2 -2,-0.5 3,-0.1 -0.429 27.9 176.7 -62.1 135.2 -82.5 57.8 -147.2 48 48 H V E - 0 0 0 -12,-2.5 13,-2.5 1,-0.3 2,-0.3 0.775 50.4 -18.9-110.9 -45.2 -83.5 59.7 -144.0 49 49 H S E -EG 36 60B 0 -13,-1.7 -13,-2.2 11,-0.2 2,-0.3 -0.998 45.7-154.7-166.9 156.6 -85.4 62.8 -145.0 50 50 H S E -EG 35 59B 9 9,-2.2 9,-2.2 -2,-0.3 2,-0.4 -0.994 2.2-167.3-143.1 151.8 -86.2 65.4 -147.6 51 51 H I E -EG 34 58B 1 -17,-2.8 -17,-2.8 -2,-0.3 7,-0.2 -0.969 18.8-135.2-143.3 118.0 -87.3 69.0 -147.8 52 52 H S > - 0 0 0 5,-2.5 3,-2.4 -2,-0.4 -19,-0.1 -0.280 38.7 -95.2 -67.3 159.9 -88.7 70.8 -150.8 53 52AH S T 3 S+ 0 0 37 1,-0.3 21,-0.2 2,-0.1 -21,-0.1 0.787 125.1 38.7 -45.9 -41.6 -87.4 74.3 -151.6 54 53 H S T 3 S- 0 0 73 20,-0.0 -1,-0.3 3,-0.0 -2,-0.1 0.388 109.2-117.5 -92.8 0.9 -90.3 76.1 -149.9 55 54 H S S < S+ 0 0 53 -3,-2.4 3,-0.1 2,-0.2 -2,-0.1 0.662 83.5 122.4 65.4 18.2 -90.4 73.7 -147.0 56 55 H S + 0 0 80 1,-0.2 2,-0.4 -5,-0.0 -3,-0.1 0.660 69.8 41.6 -84.4 -16.1 -93.9 73.0 -148.2 57 56 H Y S S+ 0 0 103 -5,-0.1 -5,-2.5 2,-0.0 2,-0.4 -0.948 70.2 169.4-137.2 113.6 -93.3 69.2 -148.6 58 57 H I E -G 51 0B 60 -2,-0.4 2,-0.3 -7,-0.2 -7,-0.2 -0.965 6.6-176.8-129.2 133.8 -91.3 67.4 -146.0 59 58 H H E -G 50 0B 107 -9,-2.2 -9,-2.2 -2,-0.4 2,-0.3 -0.977 6.5-164.5-136.2 153.5 -90.8 63.6 -145.7 60 59 H Y E -G 49 0B 57 -2,-0.3 -11,-0.2 -11,-0.2 2,-0.1 -0.945 27.5-108.8-132.4 151.7 -89.1 61.2 -143.3 61 60 H A >> - 0 0 10 -13,-2.5 3,-1.5 -2,-0.3 4,-0.6 -0.451 37.8-113.2 -70.3 154.2 -88.0 57.6 -143.4 62 61 H D G >4 S+ 0 0 128 1,-0.3 3,-1.2 2,-0.2 -1,-0.1 0.899 112.9 59.5 -55.0 -44.5 -90.1 55.3 -141.1 63 62 H S G 34 S+ 0 0 51 1,-0.3 -1,-0.3 27,-0.0 -15,-0.0 0.587 111.6 40.2 -62.5 -11.0 -87.2 54.6 -138.7 64 63 H V G X> S+ 0 0 0 -3,-1.5 3,-1.5 -16,-0.1 4,-1.1 0.505 80.6 133.9-119.8 -7.5 -86.9 58.2 -137.9 65 64 H K T << S+ 0 0 120 -3,-1.2 4,-0.1 -4,-0.6 -3,-0.0 -0.185 73.5 10.8 -66.6 135.1 -90.4 59.5 -137.6 66 65 H G T 34 S+ 0 0 82 2,-0.4 -1,-0.2 1,-0.0 -2,-0.0 -0.080 122.0 64.9 97.8 -29.4 -91.3 61.7 -134.7 67 66 H R T <4 S+ 0 0 18 -3,-1.5 17,-2.7 1,-0.1 2,-0.4 0.664 90.7 62.2-102.5 -20.4 -87.7 62.1 -133.6 68 67 H F E < -C 83 0A 4 -4,-1.1 2,-0.5 15,-0.2 -2,-0.4 -0.908 56.0-166.9-115.9 136.7 -86.1 64.0 -136.5 69 68 H T E -C 82 0A 73 13,-2.6 13,-3.0 -2,-0.4 2,-0.3 -0.964 6.4-162.1-123.3 116.7 -86.9 67.5 -137.8 70 69 H I E +C 81 0A 4 -2,-0.5 2,-0.3 11,-0.2 11,-0.2 -0.689 17.3 168.9 -92.0 146.8 -85.5 68.7 -141.1 71 70 H S E -C 80 0A 44 9,-2.0 9,-3.5 -2,-0.3 2,-0.3 -0.975 17.6-148.7-156.6 169.3 -85.5 72.3 -141.9 72 71 H R E -C 79 0A 23 -2,-0.3 2,-0.3 7,-0.3 7,-0.2 -0.958 9.6-161.9-146.1 142.8 -84.0 74.7 -144.4 73 72 H D E >>> +C 78 0A 63 5,-3.5 5,-1.6 -2,-0.3 3,-0.7 -0.663 9.7 178.4-133.7 84.0 -82.8 78.3 -144.6 74 73 H N G >45S+ 0 0 38 -2,-0.3 3,-1.2 1,-0.3 -44,-0.3 0.851 81.8 58.2 -53.1 -43.4 -82.6 79.5 -148.2 75 74 H A G 345S+ 0 0 88 1,-0.3 -1,-0.3 2,-0.1 -2,-0.0 0.926 117.0 34.5 -50.2 -47.8 -81.5 83.0 -147.3 76 75 H E G <45S- 0 0 131 -3,-0.7 -1,-0.3 2,-0.1 -2,-0.2 0.364 108.4-125.1 -88.8 4.0 -78.4 81.4 -145.5 77 76 H N T <<5 + 0 0 26 -3,-1.2 -53,-2.5 -4,-0.6 2,-0.3 0.939 65.8 137.6 46.5 53.7 -78.1 78.6 -148.1 78 77 H S E < -BC 23 73A 14 -5,-1.6 -5,-3.5 -55,-0.2 2,-0.4 -0.933 43.4-159.3-133.3 153.1 -78.3 76.1 -145.2 79 78 H L E -BC 22 72A 3 -57,-2.5 -57,-2.5 -2,-0.3 2,-0.3 -0.983 14.1-164.0-130.2 140.2 -80.0 72.9 -144.3 80 79 H Y E -BC 21 71A 46 -9,-3.5 -9,-2.0 -2,-0.4 2,-0.4 -0.921 15.7-166.1-127.3 151.2 -80.6 71.4 -140.8 81 80 H L E -BC 20 70A 0 -61,-2.4 -61,-3.0 -2,-0.3 2,-0.7 -0.946 10.2-162.9-131.3 114.2 -81.4 68.1 -139.2 82 81 H Q E -BC 19 69A 48 -13,-3.0 -13,-2.6 -2,-0.4 2,-0.6 -0.881 11.5-165.5 -96.4 114.2 -82.5 68.3 -135.6 83 82 H M E +BC 18 68A 0 -65,-3.0 -65,-2.3 -2,-0.7 2,-0.3 -0.893 9.8 177.6-108.6 117.6 -82.2 64.8 -134.1 84 82AH N + 0 0 67 -17,-2.7 -67,-0.2 -2,-0.6 -68,-0.2 -0.763 59.0 18.4-112.2 161.6 -84.0 64.0 -130.7 85 82BH S S S- 0 0 64 -70,-0.7 -1,-0.2 -2,-0.3 -69,-0.2 0.928 84.3-159.6 51.6 54.5 -84.3 60.9 -128.6 86 82CH L - 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