==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 14-JUL-04 1U0Q . COMPND 2 MOLECULE: IMMUNOGLOBULIN HEAVY CHAIN VARIABLE DOMAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: LAMA GLAMA; . AUTHOR C.CAMBILLAU,S.SPINELLI,A.DESMYTER,T.VERRIPS . 250 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12875.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 160 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 88 35.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.6 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 . 2 0.8 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 . 16 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 27 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 10 4.0 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+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 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 . 2 0 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 0 PARALLEL BRIDGES PER LADDER . 0 2 4 2 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 A X 0 0 175 0, 0.0 2,-0.3 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 152.4 16.8 -7.4 36.4 2 2 A V + 0 0 16 22,-0.1 2,-0.4 26,-0.1 24,-0.0 -0.596 360.0 175.0 -77.8 132.2 17.0 -4.8 39.2 3 3 A Q - 0 0 136 -2,-0.3 22,-0.8 111,-0.1 2,-0.4 -0.984 8.6-167.0-141.1 127.2 20.3 -3.1 39.6 4 4 A L E -A 24 0A 12 111,-0.4 113,-0.4 -2,-0.4 2,-0.4 -0.919 5.5-178.2-117.8 142.7 21.1 -0.3 42.0 5 5 A Q E -A 23 0A 96 18,-1.7 18,-2.6 -2,-0.4 2,-0.2 -0.957 10.7-154.6-143.4 122.1 24.1 2.0 42.1 6 6 A E E +A 22 0A 4 -2,-0.4 2,-0.3 16,-0.2 16,-0.2 -0.563 19.5 167.3 -91.6 157.9 24.9 4.8 44.6 7 7 A S E +A 21 0A 61 14,-1.9 14,-2.5 -2,-0.2 112,-0.1 -0.971 39.9 72.8-159.9 166.2 27.1 7.8 43.9 8 8 A G + 0 0 38 -2,-0.3 11,-0.2 1,-0.3 111,-0.0 0.291 58.9 143.2 106.5 -10.5 28.0 11.2 45.3 9 9 A G + 0 0 31 12,-0.1 2,-0.3 85,-0.1 -1,-0.3 -0.141 17.9 122.9 -61.1 159.1 30.1 10.1 48.3 10 10 A G E -e 121 0B 34 110,-0.8 112,-2.7 109,-0.1 2,-0.5 -0.985 61.9 -54.5 171.9-172.8 33.1 12.0 49.3 11 11 A L E -e 122 0B 131 -2,-0.3 2,-0.3 110,-0.2 112,-0.2 -0.825 54.7-179.4 -94.8 126.2 35.0 13.9 52.1 12 12 A V E -e 123 0B 19 110,-3.5 112,-2.8 -2,-0.5 2,-0.3 -0.941 28.4-114.5-129.8 150.0 32.9 16.7 53.6 13 13 A Q E > -e 124 0B 116 -2,-0.3 3,-2.5 110,-0.2 73,-0.2 -0.602 44.8 -97.4 -80.6 138.2 33.5 19.3 56.3 14 14 A A T 3 S+ 0 0 22 110,-2.7 73,-0.2 -2,-0.3 -1,-0.1 -0.259 115.0 31.0 -53.6 139.9 31.3 19.0 59.4 15 15 A G T 3 S+ 0 0 30 71,-2.3 70,-0.5 1,-0.3 -1,-0.3 0.247 102.7 114.3 91.2 -12.4 28.4 21.4 59.1 16 16 A G < - 0 0 22 -3,-2.5 70,-2.4 69,-0.2 -1,-0.3 -0.130 60.6-122.4 -83.9-177.6 28.4 20.9 55.4 17 17 A S + 0 0 64 68,-0.2 2,-0.3 67,-0.2 67,-0.2 -0.900 22.6 178.3-127.1 156.4 25.9 19.4 53.0 18 18 A L E - B 0 83A 39 65,-1.8 65,-2.6 -2,-0.3 2,-0.5 -0.976 16.6-146.8-156.3 141.5 26.1 16.6 50.4 19 19 A R E - B 0 82A 142 -2,-0.3 63,-0.2 63,-0.2 2,-0.2 -0.959 14.1-163.0-118.2 122.6 23.6 14.9 48.1 20 20 A L E - B 0 81A 0 61,-2.7 61,-2.1 -2,-0.5 2,-0.3 -0.647 6.6-150.4 -97.6 157.6 23.8 11.2 47.3 21 21 A S E -AB 7 80A 27 -14,-2.5 -14,-1.9 -2,-0.2 2,-0.4 -0.949 9.6-161.5-129.6 151.3 22.1 9.6 44.3 22 22 A a E -AB 6 79A 0 57,-2.0 57,-2.4 -2,-0.3 2,-0.4 -0.963 15.2-161.7-132.7 109.9 20.8 6.0 43.8 23 23 A A E -AB 5 78A 45 -18,-2.6 -18,-1.7 -2,-0.4 2,-0.3 -0.774 9.3-172.6 -96.8 138.5 20.3 5.2 40.1 24 24 A A E -A 4 0A 14 53,-2.2 -20,-0.2 -2,-0.4 2,-0.2 -0.882 24.0-102.7-128.5 161.9 18.0 2.2 39.1 25 25 A S S > S- 0 0 43 -22,-0.8 3,-2.4 -2,-0.3 4,-0.2 -0.473 71.2 -36.8 -83.8 152.0 17.2 0.4 35.9 26 26 A G T 3 S- 0 0 58 1,-0.3 3,-0.3 -2,-0.2 -2,-0.1 0.020 121.5 -20.4 39.5-126.2 14.0 0.8 33.9 27 27 A R T >> S+ 0 0 176 1,-0.2 3,-2.0 2,-0.1 4,-1.1 -0.017 92.5 127.0-102.5 29.3 10.9 1.4 36.0 28 28 A T H X> S+ 0 0 11 -3,-2.4 4,-2.5 1,-0.3 3,-0.8 0.908 75.6 48.9 -50.1 -48.5 12.4 -0.1 39.2 29 29 A F H 34 S+ 0 0 1 47,-0.4 -1,-0.3 -3,-0.3 -2,-0.1 0.465 105.4 59.1 -74.4 -2.1 11.4 3.1 41.1 30 30 A S H <4 S+ 0 0 47 -3,-2.0 -1,-0.2 3,-0.1 -2,-0.2 0.666 118.9 27.0 -97.3 -19.9 7.9 3.1 39.7 31 31 A T H << S+ 0 0 76 -4,-1.1 2,-0.3 -3,-0.8 -2,-0.2 0.634 117.6 59.4-113.6 -21.3 7.1 -0.4 41.1 32 32 A Y S < S- 0 0 40 -4,-2.5 68,-0.2 -5,-0.3 2,-0.2 -0.795 73.2-130.7-109.6 155.1 9.4 -0.6 44.2 33 33 A A E -F 99 0B 3 66,-3.1 66,-1.6 -2,-0.3 2,-0.4 -0.578 27.7-131.3 -93.5 163.1 9.7 1.6 47.3 34 34 A V E -FG 98 51B 0 17,-2.4 17,-3.4 64,-0.2 2,-0.3 -0.958 21.4-176.6-127.3 136.8 13.2 2.8 48.3 35 35 A G E -FG 97 50B 0 62,-2.9 62,-2.2 -2,-0.4 2,-0.4 -0.919 14.7-144.8-127.1 152.9 15.0 2.9 51.5 36 36 A W E +FG 96 49B 0 13,-3.2 12,-2.7 -2,-0.3 13,-1.7 -0.958 20.7 175.1-117.3 137.7 18.4 4.3 52.6 37 37 A F E -FG 95 47B 3 58,-2.8 58,-2.9 -2,-0.4 2,-0.3 -0.854 9.6-158.7-130.8 166.0 20.6 2.6 55.2 38 38 A R E -FG 94 46B 8 8,-2.3 8,-2.8 -2,-0.3 2,-0.5 -0.996 10.8-152.3-149.7 152.5 24.1 3.3 56.4 39 39 A Q E -F 93 0B 81 54,-2.3 54,-2.2 -2,-0.3 6,-0.2 -0.939 15.0-160.9-129.0 109.4 27.0 1.5 58.2 40 40 A A > - 0 0 9 -2,-0.5 3,-2.0 4,-0.4 52,-0.2 -0.470 48.0 -64.9 -82.9 159.8 29.3 3.6 60.3 41 41 A P T 3 S- 0 0 103 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.182 119.5 -6.3 -48.3 121.4 32.8 2.3 61.2 42 42 A G T 3 S+ 0 0 91 1,-0.2 2,-0.2 -3,-0.1 -2,-0.0 0.282 112.1 108.2 77.0 -11.1 32.5 -0.8 63.4 43 43 A K S < S- 0 0 98 -3,-2.0 -1,-0.2 1,-0.1 2,-0.2 -0.532 74.1 -98.6 -99.8 166.2 28.7 -0.6 63.7 44 44 A E - 0 0 171 -2,-0.2 -4,-0.4 1,-0.1 -1,-0.1 -0.499 50.3 -91.4 -78.5 149.2 25.8 -2.6 62.3 45 45 A R - 0 0 96 -2,-0.2 2,-0.3 -6,-0.2 -6,-0.2 -0.353 52.3-168.0 -61.7 137.7 24.0 -1.3 59.3 46 46 A E E -G 38 0B 70 -8,-2.8 -8,-2.3 -3,-0.1 62,-0.1 -0.940 24.5 -95.2-134.6 155.2 21.0 0.9 60.2 47 47 A F E +G 37 0B 23 -2,-0.3 -10,-0.2 60,-0.3 3,-0.1 -0.332 35.8 168.6 -65.8 140.8 17.9 2.5 58.7 48 48 A V E - 0 0 0 -12,-2.7 13,-2.6 1,-0.4 2,-0.3 0.675 58.7 -23.3-119.3 -51.8 18.2 6.1 57.6 49 49 A G E -GH 36 60B 0 -13,-1.7 -13,-3.2 11,-0.2 -1,-0.4 -0.995 46.6-141.5-163.1 162.9 15.1 6.8 55.5 50 50 A Y E -GH 35 59B 19 9,-2.5 9,-1.9 -2,-0.3 2,-0.5 -0.981 5.6-162.1-133.9 142.7 12.3 5.5 53.4 51 51 A F E -GH 34 58B 14 -17,-3.4 -17,-2.4 -2,-0.4 2,-0.6 -0.959 11.0-151.0-128.1 111.8 10.6 6.8 50.3 52 52 A G > - 0 0 0 5,-2.6 4,-1.5 -2,-0.5 5,-0.2 -0.725 3.5-158.0 -82.1 122.6 7.2 5.4 49.3 53 52AA T T 4 S+ 0 0 35 -2,-0.6 -1,-0.1 1,-0.2 -20,-0.1 0.633 81.9 69.6 -76.7 -13.1 6.9 5.6 45.5 54 53 A R T 4 S- 0 0 85 1,-0.1 -1,-0.2 3,-0.1 -22,-0.0 0.984 124.9 -0.4 -68.5 -58.4 3.1 5.5 45.6 55 54 A G T 4 S- 0 0 62 2,-0.1 -2,-0.2 -3,-0.0 -1,-0.1 0.488 96.8-113.8-111.4 -6.5 2.4 8.9 47.1 56 55 A G < + 0 0 35 -4,-1.5 2,-0.2 1,-0.2 -3,-0.1 0.653 59.9 154.7 83.7 15.2 5.9 10.2 47.6 57 56 A R - 0 0 107 -5,-0.2 -5,-2.6 -6,-0.1 2,-0.3 -0.484 27.3-152.4 -76.9 147.7 5.8 10.2 51.4 58 57 A T E -H 51 0B 49 -7,-0.2 2,-0.4 -2,-0.2 -7,-0.2 -0.909 9.9-163.9-123.7 150.9 9.0 10.0 53.3 59 58 A Y E -H 50 0B 97 -9,-1.9 -9,-2.5 -2,-0.3 2,-0.4 -0.994 11.3-160.8-132.4 138.2 10.0 8.6 56.7 60 59 A Y E -H 49 0B 37 -2,-0.4 -11,-0.2 -11,-0.2 5,-0.1 -0.940 21.8-114.4-127.5 145.1 13.2 9.3 58.6 61 60 A A >> - 0 0 19 -13,-2.6 4,-2.0 -2,-0.4 3,-1.8 -0.395 36.2-114.9 -67.0 149.1 15.1 7.8 61.5 62 61 A D T 34 S+ 0 0 144 1,-0.3 -1,-0.1 2,-0.2 -14,-0.1 0.800 112.5 68.2 -57.1 -29.2 15.3 10.0 64.6 63 62 A S T 34 S+ 0 0 52 1,-0.2 -1,-0.3 4,-0.0 -15,-0.1 0.742 119.1 16.7 -63.2 -24.4 19.1 10.3 64.1 64 63 A V T X> S+ 0 0 0 -3,-1.8 4,-2.1 -16,-0.2 3,-2.1 0.494 84.8 134.5-128.2 -6.7 18.6 12.3 60.9 65 64 A K B 3< S+c 68 0A 141 -4,-2.0 4,-0.1 1,-0.3 -16,-0.0 -0.202 80.8 16.4 -51.0 127.7 15.1 13.6 60.8 66 65 A G T 34 S+ 0 0 71 2,-0.6 -1,-0.3 1,-0.1 3,-0.1 -0.104 124.9 58.4 99.2 -35.0 15.1 17.2 59.8 67 66 A R T <4 S+ 0 0 39 -3,-2.1 17,-1.7 1,-0.1 2,-0.4 0.769 101.7 52.3 -95.6 -33.0 18.6 17.2 58.4 68 67 A F E < +cD 65 83A 0 -4,-2.1 -2,-0.6 15,-0.2 2,-0.3 -0.871 63.1 179.7-108.7 140.3 18.3 14.5 55.8 69 68 A T E - D 0 82A 66 13,-2.2 13,-3.4 -2,-0.4 2,-0.4 -0.992 14.2-146.9-140.1 148.9 15.6 14.4 53.0 70 69 A I E + D 0 81A 11 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.906 23.2 159.3-118.3 142.8 14.8 12.0 50.2 71 70 A A E - D 0 80A 49 9,-1.4 9,-2.7 -2,-0.4 2,-0.3 -0.885 27.9-129.2-148.2 176.5 13.4 12.8 46.7 72 71 A I E - D 0 79A 37 -2,-0.3 7,-0.2 7,-0.3 -2,-0.0 -0.988 26.1-113.7-136.0 144.3 13.1 11.4 43.2 73 72 A D > - 0 0 32 5,-2.4 3,-0.9 -2,-0.3 5,-0.1 -0.197 34.6-100.9 -72.4 168.0 13.9 13.0 39.8 74 73 A N T 3 S+ 0 0 169 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.861 123.3 48.3 -56.3 -41.4 11.4 13.9 37.1 75 74 A A T 3 S- 0 0 69 1,-0.0 -1,-0.3 3,-0.0 -2,-0.0 0.637 104.8-131.6 -75.9 -15.0 12.2 10.8 35.1 76 75 A K S < S+ 0 0 97 -3,-0.9 -47,-0.4 2,-0.2 -2,-0.1 0.836 77.8 110.8 65.6 36.8 12.0 8.6 38.2 77 76 A N S S+ 0 0 67 1,-0.2 -53,-2.2 -49,-0.1 2,-0.4 0.426 72.9 48.6-113.4 -7.9 15.3 6.8 37.4 78 77 A T E -B 23 0A 27 -55,-0.2 -5,-2.4 -5,-0.1 2,-0.4 -0.997 60.3-163.3-141.2 133.7 17.2 8.4 40.4 79 78 A V E -BD 22 72A 0 -57,-2.4 -57,-2.0 -2,-0.4 2,-0.3 -0.932 18.6-149.5-113.6 137.9 16.4 8.8 44.1 80 79 A Y E -BD 21 71A 70 -9,-2.7 -9,-1.4 -2,-0.4 2,-0.5 -0.798 14.5-157.6-111.9 151.7 18.4 11.3 46.1 81 80 A L E -BD 20 70A 0 -61,-2.1 -61,-2.7 -2,-0.3 2,-0.4 -0.937 19.2-161.9-124.0 103.3 19.4 11.5 49.8 82 81 A Q E -BD 19 69A 37 -13,-3.4 -13,-2.2 -2,-0.5 2,-0.5 -0.748 2.7-161.9 -89.0 131.7 20.1 15.1 50.6 83 82 A M E +BD 18 68A 0 -65,-2.6 -65,-1.8 -2,-0.4 2,-0.3 -0.963 9.8 179.2-117.9 127.9 22.2 15.7 53.8 84 82AA N + 0 0 68 -17,-1.7 -67,-0.2 -2,-0.5 -68,-0.1 -0.858 64.3 13.7-120.5 157.9 22.3 19.1 55.6 85 82BA S S S- 0 0 48 -70,-0.5 -1,-0.2 -2,-0.3 -68,-0.2 0.889 84.9-152.8 43.7 57.1 24.2 20.1 58.7 86 82CA L - 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