==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 11-DEC-09 3L1F . COMPND 2 MOLECULE: ALPHA-CRYSTALLIN A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR A.LAGANOWSKY,M.R.SAWAYA,D.CASCIO,D.EISENBERG . 97 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7674.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 54 55.7 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 . 39 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 . 2 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 2.1 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 . 7 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 9.3 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+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 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 . 1 0 0 2 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 62 A S 0 0 91 0, 0.0 2,-0.3 0, 0.0 13,-0.2 0.000 360.0 360.0 360.0 126.9 20.8 -12.4 6.7 2 63 A E E -A 13 0A 81 11,-2.5 11,-3.3 2,-0.0 2,-0.5 -0.958 360.0-164.8-140.9 132.8 23.1 -12.1 3.7 3 64 A V E -A 12 0A 64 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -0.982 11.4-176.6-118.9 122.7 22.9 -9.2 1.2 4 65 A R E -A 11 0A 148 7,-3.0 7,-3.1 -2,-0.5 2,-0.4 -0.945 5.9-178.5-123.2 138.3 24.7 -9.6 -2.1 5 66 A S E +A 10 0A 67 -2,-0.4 5,-0.2 5,-0.2 2,-0.2 -0.954 9.9 159.4-142.4 118.0 25.1 -7.2 -4.9 6 67 A D - 0 0 73 3,-2.5 78,-0.0 -2,-0.4 -2,-0.0 -0.627 58.1 -84.6-123.4-174.0 26.8 -7.7 -8.3 7 68 A R S S+ 0 0 137 -2,-0.2 77,-0.1 1,-0.2 3,-0.1 0.783 126.5 41.9 -64.0 -25.2 26.7 -6.0 -11.7 8 69 A D S S- 0 0 101 1,-0.2 76,-2.6 75,-0.1 2,-0.3 0.805 121.2 -4.8 -91.5 -35.3 23.7 -8.2 -12.6 9 70 A K E - B 0 83A 105 74,-0.3 -3,-2.5 54,-0.1 2,-0.4 -0.971 48.7-126.8-158.1 165.2 21.5 -8.2 -9.6 10 71 A F E -AB 5 82A 8 72,-2.7 72,-2.0 -2,-0.3 2,-0.4 -0.994 32.2-176.8-120.8 128.3 20.7 -7.3 -5.9 11 72 A V E -AB 4 81A 12 -7,-3.1 -7,-3.0 -2,-0.4 2,-0.5 -0.991 15.5-165.7-133.6 131.7 19.7 -10.2 -3.6 12 73 A I E -AB 3 80A 1 68,-3.1 68,-2.6 -2,-0.4 2,-0.5 -0.968 6.4-169.0-109.7 126.9 18.7 -10.3 0.1 13 74 A F E +AB 2 79A 70 -11,-3.3 -11,-2.5 -2,-0.5 2,-0.4 -0.980 11.3 177.9-110.8 127.6 18.7 -13.7 1.8 14 75 A L E - B 0 78A 21 64,-2.6 64,-3.2 -2,-0.5 2,-0.6 -0.974 27.7-133.7-136.1 120.9 16.9 -13.7 5.2 15 76 A D E + B 0 77A 69 -2,-0.4 62,-0.2 62,-0.2 3,-0.1 -0.618 35.7 159.2 -71.3 114.6 16.4 -16.6 7.5 16 77 A V > + 0 0 4 60,-3.3 3,-2.3 -2,-0.6 61,-0.1 -0.233 11.9 148.3-128.3 43.9 12.8 -16.4 8.7 17 78 A K T 3 + 0 0 132 1,-0.3 -1,-0.1 58,-0.1 60,-0.1 0.686 68.3 56.3 -59.0 -22.4 12.4 -20.1 9.7 18 79 A H T 3 S+ 0 0 96 58,-0.1 2,-0.4 -3,-0.1 -1,-0.3 0.289 97.8 82.8 -89.7 10.5 9.9 -19.3 12.5 19 80 A F < - 0 0 30 -3,-2.3 -3,-0.1 57,-0.1 20,-0.1 -0.908 67.5-140.4-121.9 142.9 7.5 -17.5 10.1 20 81 A S > - 0 0 44 -2,-0.4 3,-1.7 18,-0.1 4,-0.3 -0.567 35.1-107.9 -89.4 160.7 4.8 -18.7 7.7 21 82 A P G > S+ 0 0 85 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.884 121.0 56.4 -57.2 -36.2 4.4 -17.0 4.3 22 83 A E G 3 S+ 0 0 155 1,-0.3 -3,-0.0 15,-0.0 15,-0.0 0.601 98.8 62.6 -70.7 -10.6 1.2 -15.3 5.6 23 84 A D G < S+ 0 0 38 -3,-1.7 15,-1.4 14,-0.1 2,-0.3 0.521 93.6 81.5 -87.9 -7.9 3.1 -13.8 8.4 24 85 A L E < -D 37 0B 27 -3,-1.4 2,-0.4 -4,-0.3 13,-0.2 -0.778 51.4-174.9-109.1 143.3 5.4 -11.8 6.2 25 86 A T E -D 36 0B 71 11,-2.4 11,-2.4 -2,-0.3 2,-0.4 -0.993 4.0-167.9-130.3 145.5 5.1 -8.5 4.3 26 87 A V E +D 35 0B 53 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.992 12.7 170.3-133.0 125.6 7.5 -6.9 1.9 27 88 A K E -D 34 0B 128 7,-2.3 7,-3.4 -2,-0.4 2,-0.5 -0.970 23.7-147.5-133.9 146.8 7.2 -3.3 0.7 28 89 A V E +D 33 0B 47 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.976 32.0 155.2-114.0 124.3 9.5 -1.0 -1.3 29 90 A Q E > -D 32 0B 112 3,-2.3 3,-1.4 -2,-0.5 -2,-0.1 -0.978 61.4 -6.4-151.5 133.8 9.3 2.6 -0.4 30 91 A E T 3 S- 0 0 148 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.862 128.0 -52.6 48.9 43.7 11.6 5.6 -0.7 31 92 A D T 3 S+ 0 0 76 1,-0.2 28,-2.6 27,-0.1 2,-0.4 0.703 116.5 109.5 69.1 23.3 14.5 3.4 -1.9 32 93 A F E < -DE 29 58B 70 -3,-1.4 -3,-2.3 26,-0.2 2,-0.5 -0.969 63.6-137.4-124.8 144.3 14.2 1.0 1.0 33 94 A V E -DE 28 57B 0 24,-3.1 24,-2.5 -2,-0.4 2,-0.6 -0.899 23.0-160.5 -92.6 128.4 13.0 -2.6 1.2 34 95 A E E -DE 27 56B 26 -7,-3.4 -7,-2.3 -2,-0.5 2,-0.5 -0.948 9.5-176.3-117.6 112.5 10.8 -3.0 4.3 35 96 A I E +DE 26 55B 0 20,-2.8 20,-2.6 -2,-0.6 2,-0.4 -0.942 3.4 179.1-114.7 128.4 10.4 -6.6 5.5 36 97 A H E -DE 25 54B 55 -11,-2.4 -11,-2.4 -2,-0.5 2,-0.3 -0.964 5.4-179.7-128.5 145.5 8.1 -7.4 8.4 37 98 A G E +DE 24 53B 0 16,-2.1 16,-2.3 -2,-0.4 2,-0.3 -0.999 5.5 173.4-141.8 142.6 7.1 -10.6 10.1 38 99 A K E + E 0 52B 100 -15,-1.4 2,-0.4 -2,-0.3 14,-0.2 -0.934 5.0 178.4-148.2 124.5 4.8 -11.5 13.0 39 100 A H E - E 0 51B 40 12,-2.8 12,-2.6 -2,-0.3 2,-0.4 -0.990 8.1-164.3-130.5 126.5 3.9 -15.0 14.1 40 101 A N E - E 0 50B 86 -2,-0.4 2,-0.4 10,-0.2 10,-0.2 -0.892 7.3-174.2-112.4 139.3 1.8 -15.9 17.1 41 102 A E E - E 0 49B 76 8,-2.8 8,-2.5 -2,-0.4 2,-0.1 -0.992 21.7-129.9-137.4 127.9 1.6 -19.4 18.6 42 103 A R E - E 0 48B 193 -2,-0.4 6,-0.3 6,-0.2 2,-0.2 -0.472 28.8-159.4 -70.8 144.3 -0.6 -20.8 21.3 43 104 A Q > - 0 0 61 4,-3.0 3,-0.7 -2,-0.1 2,-0.1 -0.643 28.8 -79.8-113.7 175.6 1.2 -22.7 24.1 44 105 A D G > S+ 0 0 143 1,-0.2 3,-1.1 -2,-0.2 -1,-0.1 -0.429 113.6 30.1 -68.6 152.2 0.2 -25.3 26.7 45 106 A D G 3 S- 0 0 164 1,-0.2 -1,-0.2 -2,-0.1 3,-0.1 0.802 133.6 -67.4 67.2 30.5 -1.5 -23.9 29.7 46 107 A H G < S+ 0 0 172 -3,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.633 98.6 134.5 65.6 16.7 -3.1 -21.0 27.9 47 108 A G < - 0 0 31 -3,-1.1 -4,-3.0 -4,-0.0 2,-0.3 -0.379 34.9-164.4 -78.8 168.5 0.2 -19.3 27.2 48 109 A Y E -E 42 0B 168 -6,-0.3 2,-0.4 -2,-0.1 -6,-0.2 -0.984 10.3-147.1-150.1 159.8 1.2 -17.8 23.9 49 110 A I E -E 41 0B 62 -8,-2.5 -8,-2.8 -2,-0.3 2,-0.4 -0.985 6.1-164.4-123.4 137.1 4.3 -16.6 22.1 50 111 A S E -E 40 0B 51 -2,-0.4 2,-0.4 -10,-0.2 -10,-0.2 -0.993 3.5-169.6-117.1 130.4 4.6 -13.8 19.6 51 112 A R E +E 39 0B 79 -12,-2.6 -12,-2.8 -2,-0.4 2,-0.3 -0.973 17.2 168.0-114.0 134.6 7.8 -13.6 17.5 52 113 A E E +E 38 0B 107 -2,-0.4 2,-0.3 -14,-0.2 -14,-0.2 -0.997 8.9 169.8-148.9 144.5 8.2 -10.4 15.4 53 114 A F E -E 37 0B 45 -16,-2.3 -16,-2.1 -2,-0.3 2,-0.4 -0.991 16.8-157.0-148.3 160.1 10.8 -8.5 13.4 54 115 A H E -E 36 0B 96 -2,-0.3 2,-0.4 -18,-0.2 -18,-0.2 -0.993 9.7-174.4-129.4 144.7 11.4 -5.7 11.0 55 116 A R E -E 35 0B 105 -20,-2.6 -20,-2.8 -2,-0.4 2,-0.5 -0.949 3.5-168.7-137.0 120.6 14.3 -5.4 8.6 56 117 A R E -E 34 0B 143 -2,-0.4 2,-0.4 -22,-0.2 -22,-0.2 -0.918 10.5-177.0-104.1 129.6 14.9 -2.3 6.5 57 118 A Y E -E 33 0B 9 -24,-2.5 -24,-3.1 -2,-0.5 2,-0.3 -0.979 28.1-117.9-124.7 141.3 17.5 -2.5 3.7 58 119 A R E -E 32 0B 143 -2,-0.4 -26,-0.2 -26,-0.2 -27,-0.1 -0.595 26.7-142.8 -72.4 135.6 18.7 0.2 1.3 59 120 A L - 0 0 0 -28,-2.6 -1,-0.0 -2,-0.3 -49,-0.0 -0.890 22.6-113.7-100.9 125.2 17.9 -0.7 -2.3 60 121 A P > - 0 0 30 0, 0.0 3,-1.8 0, 0.0 -29,-0.1 -0.264 23.2-121.4 -56.8 145.5 20.6 0.4 -4.8 61 122 A S T 3 S+ 0 0 105 1,-0.3 -30,-0.0 3,-0.0 -2,-0.0 0.669 108.2 57.1 -66.0 -19.1 19.5 3.1 -7.1 62 123 A N T 3 S+ 0 0 67 2,-0.1 23,-2.8 22,-0.0 2,-0.3 0.390 77.0 112.0 -96.8 4.5 20.1 0.9 -10.2 63 124 A V B < S-F 84 0C 6 -3,-1.8 2,-0.9 21,-0.2 21,-0.2 -0.611 76.1-118.2 -74.9 136.1 17.8 -1.9 -9.2 64 125 A D > - 0 0 52 19,-2.8 3,-1.9 -2,-0.3 -1,-0.1 -0.650 24.2-166.4 -77.7 105.7 14.8 -2.2 -11.5 65 126 A Q T 3 S+ 0 0 85 -2,-0.9 3,-0.4 1,-0.3 -1,-0.2 0.549 84.7 62.8 -76.6 -3.9 11.9 -1.7 -9.1 66 127 A S T 3 S+ 0 0 118 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.1 0.449 104.3 48.1 -91.7 -4.1 9.5 -3.0 -11.8 67 128 A A S < S+ 0 0 42 -3,-1.9 2,-0.3 16,-0.2 -1,-0.2 -0.169 77.5 139.4-130.3 38.6 11.1 -6.4 -11.8 68 129 A L - 0 0 51 -3,-0.4 2,-0.3 14,-0.2 14,-0.2 -0.619 26.2-175.4 -85.6 144.5 11.4 -7.2 -8.1 69 130 A S E -C 81 0A 66 12,-2.5 12,-2.6 -2,-0.3 2,-0.3 -0.967 8.4-174.9-136.3 156.8 10.6 -10.7 -6.8 70 131 A C E +C 80 0A 56 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.985 7.8 169.0-151.6 137.5 10.4 -12.4 -3.4 71 132 A S E -C 79 0A 78 8,-2.2 8,-2.9 -2,-0.3 2,-0.5 -0.981 25.5-135.9-147.9 157.8 9.9 -16.0 -2.4 72 133 A L E -C 78 0A 50 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.978 22.9-140.2-118.9 124.2 10.1 -18.1 0.8 73 134 A S > - 0 0 43 4,-2.8 3,-2.0 -2,-0.5 -2,-0.0 -0.345 26.4-108.7 -79.4 161.8 11.8 -21.5 0.6 74 135 A A T 3 S+ 0 0 119 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.800 119.6 56.4 -58.9 -29.8 10.5 -24.6 2.4 75 136 A D T 3 S- 0 0 125 2,-0.1 -1,-0.3 1,-0.0 -58,-0.1 0.314 126.0 -98.4 -90.3 8.6 13.4 -24.4 4.8 76 137 A G S < S+ 0 0 9 -3,-2.0 -60,-3.3 1,-0.3 2,-0.5 0.647 74.0 141.2 92.3 17.3 12.5 -20.9 5.8 77 138 A M E -B 15 0A 54 -62,-0.2 -4,-2.8 -61,-0.1 2,-0.5 -0.822 38.3-150.5 -95.0 125.6 14.8 -18.7 3.7 78 139 A L E -BC 14 72A 8 -64,-3.2 -64,-2.6 -2,-0.5 2,-0.5 -0.817 11.5-167.1 -91.7 128.9 13.4 -15.5 2.3 79 140 A T E -BC 13 71A 36 -8,-2.9 -8,-2.2 -2,-0.5 2,-0.4 -0.981 7.5-179.9-117.7 123.9 14.9 -14.4 -1.0 80 141 A F E +BC 12 70A 6 -68,-2.6 -68,-3.1 -2,-0.5 2,-0.3 -0.979 16.7 164.0-117.7 131.4 14.3 -10.9 -2.3 81 142 A S E -BC 11 69A 29 -12,-2.6 -12,-2.5 -2,-0.4 -70,-0.2 -0.991 21.2-179.0-147.4 158.1 15.9 -9.9 -5.6 82 143 A G E -B 10 0A 3 -72,-2.0 -72,-2.7 -2,-0.3 -14,-0.2 -0.986 28.9-117.7-149.9 148.4 15.9 -7.5 -8.5 83 144 A P E -B 9 0A 55 0, 0.0 -19,-2.8 0, 0.0 2,-0.4 -0.493 30.9-118.4 -78.2 154.9 18.0 -7.2 -11.6 84 145 A K B -F 63 0C 40 -76,-2.6 -21,-0.2 -21,-0.2 -23,-0.0 -0.750 21.6-126.1 -91.1 142.5 20.1 -4.1 -12.2 85 146 A I - 0 0 88 -23,-2.8 2,-0.2 -2,-0.4 -76,-0.0 -0.766 27.5-116.6 -86.2 129.2 19.5 -1.9 -15.2 86 147 A P - 0 0 118 0, 0.0 -1,-0.0 0, 0.0 -78,-0.0 -0.455 20.5-162.6 -65.0 133.3 22.5 -1.3 -17.4 87 148 A S - 0 0 113 -2,-0.2 -2,-0.0 0, 0.0 0, 0.0 0.601 40.9-111.9 -95.1 -14.7 23.5 2.4 -17.5 88 149 A G 0 0 76 1,-0.0 0, 0.0 0, 0.0 0, 0.0 0.434 360.0 360.0 97.0 0.7 25.6 2.2 -20.6 89 150 A V 0 0 179 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 0.505 360.0 360.0-135.2 360.0 28.9 2.8 -18.9 90 ! 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 91 156 A E 0 0 246 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 152.8 36.9 -5.8 -14.6 92 157 A R - 0 0 152 -85,-0.0 2,-0.1 2,-0.0 0, 0.0 -0.988 360.0-127.5-129.0 123.7 34.2 -8.3 -15.3 93 158 A A - 0 0 96 -2,-0.4 0, 0.0 1,-0.0 0, 0.0 -0.450 18.0-155.4 -69.6 139.4 33.9 -11.7 -13.6 94 159 A I - 0 0 137 -2,-0.1 -1,-0.0 2,-0.0 -2,-0.0 -0.978 22.0-119.2-114.9 123.2 33.7 -14.7 -15.9 95 160 A P - 0 0 117 0, 0.0 2,-0.6 0, 0.0 0, 0.0 -0.302 17.8-144.1 -60.6 141.7 32.1 -17.8 -14.4 96 161 A V - 0 0 101 2,-0.0 2,-0.3 0, 0.0 -2,-0.0 -0.949 14.4-149.8-108.0 113.9 34.2 -21.0 -14.2 97 162 A S 0 0 119 -2,-0.6 0, 0.0 0, 0.0 0, 0.0 -0.667 360.0 360.0 -85.9 137.1 32.2 -24.1 -14.9 98 163 A R 0 0 280 -2,-0.3 -2,-0.0 0, 0.0 0, 0.0 -0.919 360.0 360.0-135.4 360.0 33.2 -27.3 -13.2