==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 01-MAR-13 4JGF . COMPND 2 MOLECULE: GAMMA-CRYSTALLIN D; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.L.JI,L.M.KOHARUDIN,J.W.JUNG,A.M.GRONENBORN . 341 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16004.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 211 61.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 137 40.2 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 . 8 2.3 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 . 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 . 23 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 12 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 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 PARALLEL BRIDGES PER LADDER . 8 0 4 3 13 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 4 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 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 G 0 0 45 0, 0.0 2,-0.3 0, 0.0 39,-0.2 0.000 360.0 360.0 360.0 159.4 5.4 22.9 0.3 2 2 A K E +A 39 0A 60 37,-1.7 37,-1.7 38,-0.1 36,-1.7 -0.959 360.0 169.7-148.9 125.7 2.0 23.6 -1.2 3 3 A I E -AB 37 18A 0 15,-2.5 15,-3.3 -2,-0.3 2,-0.5 -1.000 17.9-157.5-140.0 135.9 -1.4 21.9 -0.4 4 4 A T E -AB 36 17A 12 32,-2.3 32,-2.4 -2,-0.4 2,-0.4 -0.969 15.1-161.2-114.0 118.3 -5.0 22.8 -1.3 5 5 A L E -AB 35 16A 0 11,-3.0 11,-2.2 -2,-0.5 2,-0.3 -0.852 4.9-157.9-104.7 136.5 -7.7 21.4 1.0 6 6 A Y E -AB 34 15A 31 28,-3.4 27,-2.3 -2,-0.4 28,-1.5 -0.882 19.3-140.7-119.6 145.1 -11.3 21.1 -0.1 7 7 A E E S+ 0 0 13 7,-2.4 2,-0.2 -2,-0.3 6,-0.2 0.849 86.8 40.7 -70.7 -37.8 -14.6 20.8 1.9 8 8 A D E > S- B 0 12A 56 4,-1.6 4,-1.2 6,-0.2 3,-0.4 -0.728 94.9 -89.5-112.7 163.7 -16.3 18.3 -0.4 9 9 A R T 4 S+ 0 0 137 -2,-0.2 3,-0.3 1,-0.2 55,-0.2 -0.091 102.1 35.3 -66.9 165.3 -15.1 15.2 -2.2 10 10 A G T 4 S- 0 0 25 53,-3.1 -1,-0.2 23,-0.4 53,-0.1 0.828 133.1 -62.8 57.5 35.0 -13.6 15.1 -5.7 11 11 A F T 4 S+ 0 0 55 -3,-0.4 2,-0.2 51,-0.3 -1,-0.2 0.917 101.9 133.9 62.5 50.2 -11.9 18.5 -5.3 12 12 A Q E < +B 8 0A 127 -4,-1.2 -4,-1.6 -3,-0.3 -5,-0.3 -0.662 34.5 27.4-124.0 173.1 -15.2 20.4 -4.8 13 13 A G E S- 0 0 32 -2,-0.2 2,-0.1 -6,-0.2 0, 0.0 -0.086 105.6 -9.4 69.9-168.9 -16.7 23.1 -2.5 14 14 A R E S- 0 0 114 -8,-0.1 -7,-2.4 1,-0.0 2,-0.3 -0.404 72.7-167.3 -64.8 132.9 -14.9 25.7 -0.6 15 15 A H E -B 6 0A 107 -9,-0.2 2,-0.3 -2,-0.1 -9,-0.2 -0.820 12.5-158.9-122.8 161.8 -11.1 25.2 -0.7 16 16 A Y E -B 5 0A 27 -11,-2.2 -11,-3.0 -2,-0.3 2,-0.5 -0.991 10.0-143.4-147.6 137.8 -8.0 26.6 1.1 17 17 A E E -B 4 0A 69 -2,-0.3 304,-0.5 -13,-0.2 2,-0.4 -0.864 16.6-171.3-110.6 121.3 -4.4 26.8 0.1 18 18 A C E +B 3 0A 0 -15,-3.3 -15,-2.5 -2,-0.5 302,-0.1 -0.895 23.4 170.2-113.3 141.1 -1.5 26.3 2.6 19 19 A S S S+ 0 0 30 300,-0.5 2,-0.3 -2,-0.4 301,-0.1 0.189 77.3 19.7-122.7 9.9 2.2 26.8 2.2 20 20 A S S S- 0 0 7 298,-0.1 -1,-0.1 -17,-0.1 -17,-0.1 -0.946 103.0 -49.1-163.2 176.3 3.0 26.5 5.9 21 21 A D - 0 0 20 -2,-0.3 2,-0.4 59,-0.2 58,-0.2 -0.208 45.1-162.0 -57.9 142.0 1.7 25.2 9.2 22 22 A H B -D 78 0B 26 56,-2.9 56,-2.3 1,-0.1 3,-0.2 -0.976 11.8-169.6-131.7 122.1 -1.9 26.2 10.2 23 23 A T S S+ 0 0 26 -2,-0.4 26,-2.1 1,-0.3 2,-0.3 0.720 81.4 23.0 -81.3 -26.3 -3.1 25.9 13.8 24 24 A N + 0 0 66 24,-0.2 -1,-0.3 25,-0.1 53,-0.2 -0.846 52.3 171.7-148.9 107.6 -6.8 26.4 13.1 25 25 A L >> + 0 0 0 51,-1.6 4,-2.8 -2,-0.3 3,-1.0 0.405 59.9 97.1 -92.4 0.1 -8.5 25.8 9.7 26 26 A Q T 34 S+ 0 0 85 50,-0.4 -1,-0.2 1,-0.3 51,-0.1 0.819 80.6 54.3 -64.3 -32.6 -12.1 26.3 11.0 27 27 A P T 34 S+ 0 0 68 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.773 122.2 29.7 -63.9 -27.0 -12.1 30.0 9.8 28 28 A Y T <4 S+ 0 0 34 -3,-1.0 2,-0.3 1,-0.3 -2,-0.2 0.658 130.5 23.7-107.5 -23.8 -11.2 28.9 6.3 29 29 A L < - 0 0 2 -4,-2.8 -1,-0.3 1,-0.1 46,-0.1 -0.965 49.6-165.1-152.4 123.4 -12.7 25.4 6.0 30 30 A S S S- 0 0 69 -2,-0.3 2,-0.3 1,-0.1 -4,-0.1 0.698 83.0 -6.4 -85.3 -21.0 -15.6 23.8 7.9 31 31 A R - 0 0 88 -6,-0.1 2,-0.3 43,-0.1 43,-0.2 -0.915 64.7-135.0-154.5 177.7 -14.7 20.3 6.8 32 32 A C + 0 0 0 41,-2.7 -25,-0.3 -2,-0.3 -24,-0.1 -0.854 30.5 153.7-149.7 115.9 -12.2 18.5 4.5 33 33 A N + 0 0 21 -27,-2.3 -23,-0.4 -2,-0.3 2,-0.3 0.361 69.3 31.0-120.4 -1.6 -13.0 15.7 2.0 34 34 A S E -A 6 0A 0 -28,-1.5 -28,-3.4 -25,-0.2 2,-0.3 -0.983 58.6-171.3-155.4 154.6 -10.3 16.2 -0.7 35 35 A A E -AC 5 62A 0 27,-2.4 27,-3.4 -2,-0.3 2,-0.6 -0.986 15.1-158.1-150.2 131.5 -6.8 17.4 -1.0 36 36 A R E -AC 4 61A 94 -32,-2.4 -32,-2.3 -2,-0.3 2,-1.0 -0.939 12.6-164.5-107.2 107.0 -4.2 18.2 -3.7 37 37 A V E +AC 3 60A 2 23,-2.5 23,-2.4 -2,-0.6 -34,-0.2 -0.814 11.2 176.5 -89.9 101.2 -0.7 18.0 -2.3 38 38 A D E - 0 0 96 -36,-1.7 2,-0.3 -2,-1.0 -1,-0.2 0.872 66.0 -14.3 -75.1 -39.4 1.3 19.8 -5.0 39 39 A S E S+A 2 0A 43 -37,-1.7 -37,-1.7 -3,-0.1 -1,-0.3 -0.978 101.5 40.5-156.2 167.2 4.6 19.6 -3.0 40 40 A G S S- 0 0 19 -2,-0.3 2,-0.5 -39,-0.2 -38,-0.1 0.167 79.0 -84.8 77.9 160.7 6.0 18.9 0.4 41 41 A C - 0 0 4 40,-0.5 40,-2.5 17,-0.1 2,-0.2 -0.915 50.3-165.8-104.1 131.1 5.0 16.2 2.9 42 42 A W E -EF 57 80B 0 15,-3.0 15,-2.7 -2,-0.5 2,-0.4 -0.733 20.2-151.8-121.0 161.3 2.1 17.1 5.2 43 43 A M E -EF 56 79B 0 36,-1.8 36,-1.9 -2,-0.2 2,-0.3 -0.953 16.5-159.7-135.2 112.2 0.4 16.0 8.3 44 44 A L E -EF 55 78B 0 11,-2.7 11,-2.6 -2,-0.4 2,-0.4 -0.700 6.1-153.6 -95.7 146.4 -3.3 16.7 8.8 45 45 A Y E -EF 54 77B 3 32,-2.9 31,-2.8 -2,-0.3 32,-1.1 -0.957 19.1-140.7-126.8 139.6 -5.0 16.7 12.2 46 46 A E E S+ 0 0 49 7,-2.4 6,-0.2 -2,-0.4 -1,-0.1 0.827 90.4 34.1 -60.9 -38.4 -8.7 16.1 13.2 47 47 A Q E > S-E 51 0B 64 4,-2.1 4,-0.8 6,-0.2 3,-0.4 -0.771 95.6 -89.9-118.5 162.1 -8.6 18.8 15.9 48 48 A P T >4 S+ 0 0 19 0, 0.0 3,-0.6 0, 0.0 29,-0.2 -0.171 103.6 39.0 -64.0 165.4 -6.9 22.2 16.1 49 49 A N T 34 S- 0 0 49 -26,-2.1 146,-0.1 27,-0.3 -26,-0.1 0.788 130.6 -69.9 62.9 32.3 -3.5 22.7 17.7 50 50 A Y T 34 S+ 0 0 17 -3,-0.4 2,-0.2 -27,-0.2 -1,-0.2 0.863 102.1 127.1 56.1 42.2 -2.1 19.4 16.1 51 51 A S E << +E 47 0B 53 -4,-0.8 -4,-2.1 -3,-0.6 -1,-0.2 -0.707 38.3 38.4-121.8 173.9 -4.3 17.2 18.3 52 52 A G E S- 0 0 39 -2,-0.2 2,-0.1 -6,-0.2 0, 0.0 -0.386 108.1 -5.7 78.4-162.6 -6.8 14.4 17.7 53 53 A L E S- 0 0 40 -2,-0.1 -7,-2.4 -8,-0.1 2,-0.3 -0.369 71.3-144.3 -68.1 141.1 -6.3 11.8 15.0 54 54 A Q E -EG 45 142B 17 88,-0.5 88,-0.6 -9,-0.2 2,-0.4 -0.852 14.1-171.0-111.6 143.0 -3.3 12.3 12.7 55 55 A Y E -E 44 0B 7 -11,-2.6 -11,-2.7 -2,-0.3 2,-0.5 -0.999 13.9-142.2-136.3 135.1 -2.9 11.6 9.0 56 56 A F E -E 43 0B 33 -2,-0.4 2,-0.4 -13,-0.2 -13,-0.2 -0.830 19.6-176.7-101.8 125.5 0.2 11.7 6.8 57 57 A L E -E 42 0B 0 -15,-2.7 -15,-3.0 -2,-0.5 2,-0.2 -0.965 3.4-176.1-123.0 138.9 -0.0 13.0 3.2 58 58 A R - 0 0 164 -2,-0.4 -21,-0.3 -17,-0.2 -17,-0.1 -0.706 49.5 -45.4-121.6 176.0 2.6 13.1 0.5 59 59 A R S S+ 0 0 182 -2,-0.2 2,-0.2 -23,-0.1 -21,-0.2 -0.041 96.5 59.8 -48.0 136.5 2.6 14.5 -3.1 60 60 A G E S-C 37 0A 29 -23,-2.4 -23,-2.5 -3,-0.1 2,-0.4 -0.746 84.9 -58.4 130.9-179.4 -0.4 13.6 -5.2 61 61 A D E -C 36 0A 95 -2,-0.2 2,-0.6 -25,-0.2 -25,-0.2 -0.815 30.1-162.5-107.9 134.8 -4.2 14.0 -5.3 62 62 A Y E -C 35 0A 30 -27,-3.4 -27,-2.4 -2,-0.4 -51,-0.3 -0.906 6.1-177.6-117.9 102.4 -6.7 12.7 -2.6 63 63 A A S S+ 0 0 18 -2,-0.6 -53,-3.1 -29,-0.2 2,-0.3 0.670 72.1 17.6 -73.6 -20.1 -10.2 12.6 -4.0 64 64 A D S > S- 0 0 26 -55,-0.2 3,-2.0 -54,-0.1 4,-0.4 -0.983 80.6-110.3-150.8 155.3 -11.8 11.5 -0.7 65 65 A H T 3 >S+ 0 0 32 -2,-0.3 5,-2.4 1,-0.3 3,-0.4 0.665 113.4 66.0 -65.1 -17.7 -10.8 11.5 3.0 66 66 A Q T > 5S+ 0 0 112 3,-0.2 3,-1.4 1,-0.2 -1,-0.3 0.687 87.5 71.0 -72.3 -19.5 -10.5 7.7 3.0 67 67 A Q T < 5S+ 0 0 107 -3,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.806 102.1 41.3 -70.5 -31.3 -7.5 8.1 0.6 68 68 A W T 3 5S- 0 0 5 -3,-0.4 -1,-0.3 -4,-0.4 -12,-0.2 0.098 126.3-105.7 -95.1 20.4 -5.4 9.5 3.4 69 69 A M T < 5 + 0 0 96 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.861 60.3 174.1 59.9 41.0 -6.9 6.8 5.7 70 70 A G < - 0 0 8 -5,-2.4 -1,-0.2 1,-0.1 3,-0.1 -0.579 34.3-155.5 -81.6 137.2 -9.1 9.4 7.4 71 71 A L S S+ 0 0 134 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.623 81.7 3.0 -84.1 -15.1 -11.7 8.2 10.0 72 72 A S S S- 0 0 36 2,-0.2 -1,-0.1 -7,-0.2 0, 0.0 -0.954 76.4-102.9-155.6 174.2 -13.7 11.4 9.3 73 73 A D S S+ 0 0 57 -2,-0.3 -41,-2.7 -3,-0.1 2,-0.7 0.215 79.3 121.9 -86.8 14.0 -13.8 14.6 7.2 74 74 A S + 0 0 11 -43,-0.2 2,-0.3 -41,-0.1 -2,-0.2 -0.717 25.0 156.5 -82.7 116.8 -12.5 16.6 10.1 75 75 A V + 0 0 3 -2,-0.7 -29,-0.3 -46,-0.1 -28,-0.1 -0.917 2.5 155.6-135.7 112.1 -9.3 18.4 9.4 76 76 A R + 0 0 81 -31,-2.8 -51,-1.6 -2,-0.3 -50,-0.4 0.328 64.9 21.9-125.0 2.3 -8.8 21.4 11.7 77 77 A S E - F 0 45B 0 -32,-1.1 -32,-2.9 -53,-0.2 2,-0.3 -0.942 62.3-169.7-161.7 155.8 -5.0 21.9 11.7 78 78 A C E -DF 22 44B 0 -56,-2.3 -56,-2.9 -2,-0.3 2,-0.4 -0.995 7.2-153.1-151.2 151.6 -2.1 20.9 9.4 79 79 A R E - F 0 43B 22 -36,-1.9 -36,-1.8 -2,-0.3 2,-0.8 -0.991 15.1-140.1-133.9 125.8 1.7 20.9 9.4 80 80 A L E - F 0 42B 39 -2,-0.4 -38,-0.2 -38,-0.2 -59,-0.2 -0.795 34.9-132.0 -78.5 113.3 4.2 21.1 6.6 81 81 A I - 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