==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNOGLOBULIN 08-JUN-94 1WTL . COMPND 2 MOLECULE: BENCE-JONES PROTEIN MCG (LIGHT CHAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.B.HUANG,C.H.CHANG,M.SCHIFFER . 216 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9845.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 142 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 38.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 3 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 0.5 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 . 25 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 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 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 1 3 3 3 0 6 0 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 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 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 D 0 0 128 0, 0.0 2,-0.4 0, 0.0 93,-0.1 0.000 360.0 360.0 360.0 102.8 11.1 38.8 41.7 2 2 A I - 0 0 2 93,-0.4 2,-0.4 91,-0.3 88,-0.2 -0.649 360.0-150.0 -81.1 127.7 12.6 36.5 39.1 3 3 A Q - 0 0 123 -2,-0.4 23,-2.3 94,-0.0 2,-0.4 -0.791 7.6-158.5 -95.0 141.3 12.4 37.8 35.6 4 4 A M E -A 25 0A 5 94,-0.4 2,-0.5 -2,-0.4 96,-0.3 -0.992 2.9-159.8-123.1 121.9 12.2 35.2 32.8 5 5 A T E -A 24 0A 58 19,-3.2 19,-2.2 -2,-0.4 2,-0.4 -0.933 10.9-167.5-105.7 128.3 13.2 36.2 29.3 6 6 A Q E -A 23 0A 18 -2,-0.5 17,-0.2 17,-0.2 94,-0.1 -0.947 11.1-119.2-126.0 140.1 11.9 34.1 26.4 7 7 A S E S+A 22 0A 41 15,-1.8 15,-2.0 -2,-0.4 2,-0.2 -0.986 74.1 14.5-141.8 152.8 12.8 34.0 22.7 8 8 A P - 0 0 47 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 0.677 61.2-153.7 -79.3 176.5 11.9 34.3 20.1 9 9 A S S S+ 0 0 90 1,-0.3 94,-2.6 -2,-0.2 2,-0.3 0.764 82.5 11.8 -83.1 -28.0 8.6 36.2 20.7 10 10 A S E +d 103 0B 81 92,-0.2 2,-0.3 75,-0.0 -1,-0.3 -0.970 65.3 179.8-147.1 157.0 7.2 34.9 17.5 11 11 A L E -d 104 0B 43 92,-1.7 94,-1.1 -2,-0.3 2,-0.4 -0.913 14.8-156.3-149.1 161.7 8.1 32.2 15.0 12 12 A S E +d 105 0B 57 -2,-0.3 2,-0.4 92,-0.2 94,-0.3 -0.906 27.0 175.9-146.7 107.5 6.5 31.0 11.8 13 13 A A E -d 106 0B 7 92,-5.0 94,-1.4 -2,-0.4 2,-0.3 -0.921 31.7-120.9-124.0 157.3 7.5 27.4 11.0 14 14 A S > - 0 0 57 -2,-0.4 3,-2.2 92,-0.2 64,-0.3 -0.697 47.6 -95.1 -89.4 141.6 6.6 24.9 8.4 15 15 A V T 3 S+ 0 0 78 -2,-0.3 64,-0.2 92,-0.3 3,-0.1 -0.370 116.1 40.6 -56.9 136.8 5.2 21.7 9.8 16 16 A G T 3 S+ 0 0 39 62,-1.7 -1,-0.2 1,-0.5 63,-0.1 -0.178 90.1 121.0 112.3 -33.4 8.1 19.2 10.1 17 17 A D < - 0 0 79 -3,-2.2 61,-4.4 60,-0.2 -1,-0.5 -0.281 63.7-120.6 -67.2 150.9 10.5 21.9 11.3 18 18 A R - 0 0 160 59,-0.2 2,-0.4 -3,-0.1 58,-0.2 -0.644 26.6-155.0 -86.9 140.2 12.3 21.7 14.6 19 19 A V E - B 0 75A 6 56,-3.3 56,-2.4 -2,-0.3 2,-0.4 -0.982 14.1-178.2-135.7 131.7 11.7 24.5 17.2 20 20 A T E + B 0 74A 70 -2,-0.4 2,-0.3 54,-0.2 54,-0.2 -0.982 6.0 172.3-125.8 127.8 13.9 25.8 20.0 21 21 A I E - B 0 73A 1 52,-1.6 52,-2.9 -2,-0.4 2,-0.3 -0.950 17.8-152.7-130.8 141.7 12.7 28.6 22.3 22 22 A T E -AB 7 72A 34 -15,-2.0 -15,-1.8 -2,-0.3 2,-0.4 -0.868 11.4-153.5-125.8 160.4 14.8 29.5 25.4 23 23 A a E -AB 6 71A 0 48,-2.4 48,-1.4 -2,-0.3 2,-0.5 -0.986 7.8-164.4-132.6 118.7 14.2 31.0 28.8 24 24 A R E -AB 5 70A 91 -19,-2.2 -19,-3.2 -2,-0.4 2,-0.3 -0.896 15.4-143.1-105.4 131.9 16.9 32.8 30.7 25 25 A A E -A 4 0A 12 44,-2.7 -21,-0.2 -2,-0.5 -23,-0.0 -0.638 16.8-128.8 -88.8 145.6 16.3 33.4 34.4 26 26 A S S S+ 0 0 64 -23,-2.3 2,-0.3 -2,-0.3 -22,-0.1 0.336 92.1 0.8 -79.8 12.2 17.3 36.6 36.1 27 27 A Q S S- 0 0 92 -24,-0.2 2,-0.7 42,-0.1 -2,-0.2 -0.994 102.5 -51.3-178.1 177.7 19.0 34.3 38.6 28 28 A D + 0 0 98 -2,-0.3 41,-0.2 1,-0.2 3,-0.1 -0.638 48.0 159.8 -73.3 112.9 19.8 30.7 39.7 29 29 A I > - 0 0 0 39,-3.0 3,-2.4 -2,-0.7 2,-0.3 0.161 35.9-146.1-115.2 15.3 16.5 28.7 39.7 30 30 A T T 3 - 0 0 59 1,-0.3 38,-1.6 38,-0.2 -1,-0.4 -0.478 69.0 -34.0 58.7-116.8 18.2 25.2 39.5 31 31 A N T 3 S+ 0 0 54 -2,-0.3 2,-1.6 36,-0.2 -1,-0.3 0.087 96.7 125.4-121.5 21.6 15.7 23.3 37.5 32 32 A Y < + 0 0 92 -3,-2.4 59,-2.3 18,-0.2 60,-0.5 -0.584 35.4 129.9 -86.5 80.1 12.3 24.7 38.6 33 33 A V E -E 90 0B 0 -2,-1.6 18,-2.1 57,-0.3 2,-0.3 -0.994 40.8-159.4-133.2 129.3 10.9 25.7 35.2 34 34 A N E -E 89 0B 0 55,-2.9 55,-1.7 -2,-0.4 2,-0.5 -0.803 8.0-153.1-100.2 145.4 7.4 24.8 33.9 35 35 A W E -EF 88 48B 0 13,-3.6 12,-2.8 -2,-0.3 13,-1.3 -0.998 17.8-165.7-120.7 129.8 6.9 24.9 30.1 36 36 A F E -EF 87 46B 0 51,-3.5 51,-1.8 -2,-0.5 2,-0.5 -0.855 18.8-149.7-119.1 155.2 3.2 25.6 29.1 37 37 A Q E -EF 86 45B 11 8,-3.0 8,-3.3 -2,-0.3 2,-0.5 -0.987 14.7-169.8-117.7 124.2 1.3 25.3 25.9 38 38 A Q E -EF 85 44B 15 47,-2.3 47,-2.7 -2,-0.5 5,-0.1 -0.985 8.8-156.9-117.1 109.4 -1.5 27.8 25.7 39 39 A R > - 0 0 76 4,-0.6 3,-2.3 -2,-0.5 2,-0.4 -0.500 40.5 -79.0 -83.5 159.8 -3.9 27.1 22.7 40 40 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.435 118.6 2.4 -62.6 116.4 -5.9 29.9 21.3 41 41 A G T 3 S+ 0 0 90 -2,-0.4 2,-0.3 1,-0.3 -2,-0.0 0.600 116.3 95.6 81.5 13.8 -8.9 30.4 23.6 42 42 A Q S < S- 0 0 108 -3,-2.3 -1,-0.3 1,-0.1 3,-0.1 -0.757 77.1 -95.8-125.3 173.8 -7.8 27.8 26.1 43 43 A A - 0 0 22 -2,-0.3 -4,-0.6 1,-0.2 166,-0.1 -0.352 52.2 -80.9 -84.4 160.1 -5.8 27.8 29.4 44 44 A P E -F 38 0B 9 0, 0.0 2,-0.4 0, 0.0 163,-0.4 -0.401 46.1-153.1 -63.5 137.5 -2.1 27.2 29.7 45 45 A K E -F 37 0B 95 -8,-3.3 -8,-3.0 161,-0.1 2,-0.3 -0.972 18.3-117.8-114.7 130.9 -1.4 23.4 29.7 46 46 A V E +F 36 0B 12 -2,-0.4 -10,-0.2 -10,-0.2 3,-0.1 -0.578 40.6 162.8 -67.2 124.3 1.7 22.0 31.5 47 47 A L E + 0 0 0 -12,-2.8 8,-2.0 1,-0.4 2,-0.4 0.692 69.3 13.3-108.2 -57.9 4.0 20.3 28.9 48 48 A I E +FG 35 54B 0 -13,-1.3 -13,-3.6 6,-0.2 -1,-0.4 -0.980 62.3 175.0-126.8 141.5 7.2 20.1 30.9 49 49 A Y E > + G 0 53B 60 4,-2.5 4,-2.2 -2,-0.4 3,-0.5 -0.732 68.5 40.4-129.9 174.2 8.0 20.6 34.6 50 50 A G T 4 S- 0 0 7 1,-0.3 2,-1.7 -2,-0.2 -18,-0.2 0.822 123.4 -83.6 49.6 30.6 11.2 20.2 36.6 51 51 A A T 4 S+ 0 0 0 -18,-2.1 -1,-0.3 1,-0.2 21,-0.2 -0.103 124.8 25.6 69.5 -33.0 12.8 21.8 33.4 52 52 A S T 4 S+ 0 0 60 -2,-1.7 2,-0.6 -3,-0.5 12,-0.5 0.410 87.0 112.4-134.5 -6.4 13.0 18.5 31.6 53 53 A I E < -G 49 0B 77 -4,-2.2 -4,-2.5 10,-0.1 2,-0.1 -0.719 59.0-136.3 -83.4 120.8 10.3 16.2 32.9 54 54 A L E -G 48 0B 51 -2,-0.6 -6,-0.2 -6,-0.2 2,-0.2 -0.407 20.7-119.5 -74.1 142.8 7.6 15.4 30.4 55 55 A E > - 0 0 26 -8,-2.0 3,-2.4 -2,-0.1 -1,-0.1 -0.503 41.3 -78.0 -83.0 154.3 4.0 15.4 31.6 56 56 A T T 3 S+ 0 0 123 1,-0.3 -1,-0.1 -2,-0.2 0, 0.0 -0.281 117.0 7.1 -59.8 127.4 1.7 12.5 31.4 57 57 A G T 3 S+ 0 0 77 1,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.486 91.9 141.0 77.7 12.9 0.4 12.0 28.0 58 58 A V < - 0 0 16 -3,-2.4 -1,-0.3 -11,-0.1 -4,-0.1 -0.657 58.8-105.7 -87.6 134.1 2.6 14.7 26.4 59 59 A P > - 0 0 49 0, 0.0 3,-1.0 0, 0.0 -4,-0.1 -0.210 22.3-129.5 -56.8 143.6 4.0 13.9 22.9 60 60 A S T 3 S+ 0 0 107 1,-0.2 -2,-0.0 -6,-0.1 -6,-0.0 0.479 97.3 82.8 -80.3 -3.4 7.6 13.1 22.9 61 61 A R T 3 S+ 0 0 55 16,-0.1 15,-2.4 14,-0.1 2,-0.5 0.617 83.0 81.2 -73.9 -9.1 8.5 15.6 20.1 62 62 A F E < +C 75 0A 3 -3,-1.0 2,-0.3 13,-0.2 13,-0.2 -0.846 62.3 168.0 -96.0 122.5 8.5 18.0 23.1 63 63 A S E -C 74 0A 45 11,-2.9 11,-3.5 -2,-0.5 2,-0.4 -0.979 19.5-154.0-139.6 150.6 11.6 18.1 25.2 64 64 A G E +C 73 0A 11 -12,-0.5 2,-0.3 -2,-0.3 9,-0.2 -0.955 17.0 164.7-126.6 139.0 13.1 20.4 27.9 65 65 A S E +C 72 0A 61 7,-2.9 7,-4.0 -2,-0.4 2,-0.2 -0.957 23.3 89.2-144.8 165.1 16.6 21.0 29.0 66 66 A G E -C 71 0A 34 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.395 35.0-158.5 125.0 161.3 18.5 23.5 31.1 67 67 A S E > +C 70 0A 82 3,-0.7 2,-1.1 -2,-0.2 3,-0.8 -0.889 68.9 17.2-160.1 146.9 19.6 23.9 34.8 68 68 A G T 3 S- 0 0 13 -38,-1.6 -39,-3.0 -2,-0.3 -38,-0.2 -0.614 129.6 -27.2 90.1-102.5 20.5 27.1 36.5 69 69 A T T 3 S+ 0 0 57 -2,-1.1 -44,-2.7 -41,-0.2 2,-0.4 0.657 118.9 71.7-125.7 -25.2 19.4 30.1 34.5 70 70 A D E < +BC 24 67A 86 -3,-0.8 -3,-0.7 -46,-0.2 2,-0.4 -0.833 56.5 175.4-100.0 130.1 19.3 29.0 30.8 71 71 A F E -BC 23 66A 0 -48,-1.4 -48,-2.4 -2,-0.4 2,-0.4 -0.978 13.1-156.6-139.1 150.5 16.5 26.6 29.6 72 72 A T E -BC 22 65A 34 -7,-4.0 -7,-2.9 -2,-0.4 2,-0.4 -0.965 1.8-161.6-128.5 146.1 15.6 25.3 26.3 73 73 A F E -BC 21 64A 0 -52,-2.9 -52,-1.6 -2,-0.4 2,-0.4 -0.998 14.6-164.6-125.8 125.0 12.3 23.9 25.0 74 74 A T E -BC 20 63A 11 -11,-3.5 -11,-2.9 -2,-0.4 2,-0.5 -0.948 20.7-170.6-125.2 137.2 12.2 21.8 21.9 75 75 A I E -BC 19 62A 0 -56,-2.4 -56,-3.3 -2,-0.4 3,-0.3 -0.987 17.3-156.7-110.8 116.0 9.5 20.6 19.5 76 76 A S S S+ 0 0 51 -15,-2.4 2,-0.3 -2,-0.5 -1,-0.1 0.844 81.2 8.3 -69.2 -39.3 11.2 18.0 17.2 77 77 A S S S- 0 0 44 -59,-0.1 -1,-0.3 -3,-0.1 -59,-0.2 -0.870 85.2-124.3-146.7 105.1 8.8 18.4 14.3 78 78 A L - 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