==== 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 14-DEC-11 3V3X . COMPND 2 MOLECULE: IMMUNOGLOBULIN G-BINDING PROTEIN G; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS SP. 'GROUP G'; . AUTHOR T.F.CUNNINGHAM,M.S.MCGOFF,I.SENGUPTA,C.P.JARONIEC,W.S.HORNE, . 224 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13251.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 79.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 10.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 67 29.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.8 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 . 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 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 50 22.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 3.6 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 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 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 0 PARALLEL BRIDGES PER LADDER . 0 1 0 0 4 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 1 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 M 0 0 113 0, 0.0 133,-3.0 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 143.2 15.5 55.8 51.6 2 2 A Q E -A 133 0A 102 131,-0.2 2,-0.3 133,-0.1 131,-0.2 -0.784 360.0-171.3 -91.6 131.7 12.7 53.3 51.8 3 3 A Y E -A 132 0A 11 129,-3.0 129,-2.3 -2,-0.4 2,-0.3 -0.916 8.4-146.1-120.6 150.3 13.4 49.9 50.2 4 4 A K E -Ab 131 165A 20 160,-2.6 162,-3.1 -2,-0.3 2,-0.4 -0.868 5.1-160.5-115.0 149.2 11.0 47.0 49.6 5 5 A L E -Ab 130 166A 0 125,-2.8 125,-2.3 -2,-0.3 2,-0.5 -0.993 5.8-165.1-124.9 126.4 11.4 43.3 49.6 6 6 A I E -Ab 129 167A 36 160,-2.7 162,-2.5 -2,-0.4 2,-0.5 -0.945 8.7-151.7-105.8 133.3 8.9 41.0 48.0 7 7 A L E +Ab 128 168A 11 121,-2.9 120,-3.0 -2,-0.5 121,-1.4 -0.908 22.8 179.4-105.2 126.6 9.0 37.3 48.8 8 8 A C E -Ab 126 169A 25 160,-2.7 162,-2.8 -2,-0.5 2,-0.2 -0.870 13.0-166.2-128.4 151.5 7.8 35.1 46.0 9 9 A G E -A 125 0A 5 116,-2.0 116,-2.7 -2,-0.3 2,-0.4 -0.757 22.3-114.3-127.9 178.4 7.4 31.4 45.4 10 10 A K E -A 124 0A 152 -2,-0.2 2,-0.3 114,-0.2 114,-0.2 -0.884 26.5-166.0-116.8 146.7 6.7 29.2 42.4 11 11 A T E -A 123 0A 66 112,-2.6 112,-2.9 -2,-0.4 2,-0.6 -0.967 22.5-119.5-135.3 147.9 3.6 27.1 41.9 12 12 A L E +A 122 0A 114 -2,-0.3 110,-0.2 110,-0.2 3,-0.1 -0.786 30.6 171.3 -88.0 118.7 2.6 24.3 39.5 13 13 A K E - 0 0 125 108,-3.2 2,-0.3 -2,-0.6 109,-0.2 0.835 57.8 -38.2 -90.5 -38.4 -0.3 25.2 37.2 14 14 A G E -A 121 0A 23 107,-1.8 107,-2.6 2,-0.0 -1,-0.3 -0.986 42.1-135.5-177.3 169.4 -0.3 22.3 34.9 15 15 A E E +A 120 0A 118 -2,-0.3 2,-0.3 105,-0.2 105,-0.2 -0.984 23.5 161.8-153.5 136.8 1.4 19.7 32.8 16 16 A T E -A 119 0A 49 103,-2.3 103,-2.8 -2,-0.3 2,-0.3 -0.942 19.2-149.1-147.7 163.8 0.9 18.4 29.3 17 17 A T E -A 118 0A 61 -2,-0.3 2,-0.3 101,-0.2 101,-0.2 -0.876 12.3-171.0-127.2 167.7 2.7 16.5 26.6 18 18 A T E -A 117 0A 36 99,-2.2 99,-2.5 -2,-0.3 2,-0.5 -0.983 24.5-119.3-152.8 158.1 2.5 16.6 22.8 19 19 A E E +A 116 0A 137 -2,-0.3 2,-0.3 97,-0.2 97,-0.2 -0.888 43.4 156.4-100.1 129.6 3.9 14.7 19.8 20 20 A A - 0 0 11 95,-2.4 3,-0.1 -2,-0.5 -2,-0.1 -0.979 49.9-121.9-150.0 154.3 6.0 16.7 17.5 21 21 A V S S- 0 0 127 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.799 93.2 -4.3 -70.8 -30.4 8.8 16.0 14.9 22 22 A D S > S- 0 0 63 93,-0.1 4,-2.3 1,-0.1 3,-0.2 -0.962 77.2 -94.7-155.9 176.7 11.3 18.1 16.7 23 23 A A H > S+ 0 0 6 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.884 118.4 56.1 -69.3 -37.6 11.8 20.5 19.7 24 24 A A H > S+ 0 0 39 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.887 109.6 45.1 -57.2 -42.1 11.2 23.6 17.6 25 25 A T H > S+ 0 0 59 -3,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.941 111.6 52.1 -71.6 -42.9 7.8 22.4 16.4 26 26 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.892 107.1 55.0 -57.1 -40.1 6.8 21.4 19.9 27 27 A E H X S+ 0 0 26 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.904 107.1 48.6 -62.1 -44.9 7.8 24.9 21.2 28 28 A C H X S+ 0 0 88 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.931 112.4 49.0 -61.7 -42.6 5.5 26.5 18.7 29 29 A V H X S+ 0 0 59 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.941 114.6 44.9 -59.4 -45.1 2.6 24.2 19.7 30 30 A F H X S+ 0 0 4 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.859 110.1 54.0 -73.4 -37.0 3.2 24.9 23.4 31 31 A K H X S+ 0 0 71 -4,-2.8 4,-1.6 1,-0.2 5,-0.2 0.916 109.9 48.9 -63.3 -38.7 3.6 28.7 22.9 32 32 A Q H X S+ 0 0 115 -4,-2.2 4,-2.3 2,-0.2 5,-0.5 0.920 112.3 47.5 -62.0 -47.7 0.2 28.7 21.1 33 33 A Y H < S+ 0 0 118 -4,-2.1 4,-0.3 1,-0.2 -2,-0.2 0.915 119.5 39.5 -60.5 -47.1 -1.4 26.6 24.0 34 34 A A H <>S+ 0 0 2 -4,-2.9 5,-1.0 -5,-0.1 -1,-0.2 0.605 123.8 38.8 -72.3 -23.0 0.1 28.9 26.6 35 35 A N H ><5S+ 0 0 51 -4,-1.6 3,-1.6 -3,-0.2 -3,-0.2 0.661 101.8 59.6-115.1 -23.7 -0.4 32.3 24.7 36 36 A D T 3<5S+ 0 0 115 -4,-2.3 -3,-0.1 1,-0.3 -2,-0.1 0.739 102.9 64.5 -64.8 -24.5 -3.8 32.2 22.9 37 37 A N T 3 5S- 0 0 116 -5,-0.5 -1,-0.3 -4,-0.3 -2,-0.1 0.012 122.5-122.9 -82.3 23.8 -4.4 31.7 26.6 38 38 A G T < 5S+ 0 0 68 -3,-1.6 2,-0.7 1,-0.1 -3,-0.2 0.337 71.8 120.3 65.8 7.2 -3.0 35.3 26.7 39 39 A V < - 0 0 54 -5,-1.0 2,-0.4 17,-0.0 -1,-0.1 -0.823 42.6-164.5-119.3 90.1 -0.1 34.9 29.1 40 40 A D + 0 0 137 -2,-0.7 2,-0.2 -5,-0.1 -5,-0.0 -0.665 31.0 155.9 -71.8 133.4 3.4 35.7 27.7 41 41 A G - 0 0 10 -2,-0.4 2,-0.6 15,-0.1 15,-0.2 -0.576 44.0 -64.2-146.4-169.7 6.0 34.2 30.1 42 42 A E E -C 55 0A 55 13,-2.6 13,-2.0 -2,-0.2 2,-0.3 -0.883 47.7-153.8-101.6 122.2 9.5 32.9 30.7 43 43 A W E +C 54 0A 7 -2,-0.6 2,-0.3 11,-0.2 11,-0.2 -0.687 15.6 178.8 -98.7 141.9 10.5 29.8 28.8 44 44 A T E -C 53 0A 47 9,-2.4 9,-1.6 -2,-0.3 2,-0.3 -0.955 6.1-167.8-126.1 156.3 13.0 27.1 29.4 45 45 A Y E -CD 52 186A 3 141,-2.2 141,-1.8 -2,-0.3 2,-0.6 -0.967 4.5-168.7-144.7 129.1 13.8 24.0 27.3 46 46 A D E >> -CD 51 185A 74 5,-2.5 5,-1.8 -2,-0.3 4,-0.6 -0.955 4.6-165.7-116.4 109.9 15.8 21.1 28.5 47 47 A D T >45S+ 0 0 46 137,-0.7 3,-0.6 -2,-0.6 -1,-0.1 0.844 83.2 64.9 -69.5 -30.2 16.7 18.8 25.6 48 48 A A T 345S+ 0 0 90 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 0.877 118.9 25.6 -59.7 -38.0 17.9 15.8 27.8 49 49 A T T 345S- 0 0 82 -3,-0.4 -1,-0.3 2,-0.2 -2,-0.2 0.326 102.9-127.0-108.1 4.1 14.3 15.5 29.2 50 50 A K T <<5 + 0 0 51 -3,-0.6 68,-2.7 -4,-0.6 2,-0.5 0.867 62.8 144.2 50.2 43.2 12.4 17.0 26.2 51 51 A T E < -Ce 46 118A 14 -5,-1.8 -5,-2.5 66,-0.2 2,-0.4 -0.950 36.7-167.9-123.7 128.6 10.8 19.3 28.6 52 52 A F E -Ce 45 119A 0 66,-3.3 68,-2.8 -2,-0.5 2,-0.4 -0.829 6.7-163.2 -99.3 146.3 9.7 22.9 28.3 53 53 A T E -Ce 44 120A 31 -9,-1.6 -9,-2.4 -2,-0.4 2,-0.4 -0.984 2.4-167.4-124.9 145.6 8.6 25.0 31.2 54 54 A V E -Ce 43 121A 0 66,-2.2 68,-3.4 -2,-0.4 2,-0.6 -0.999 4.7-162.6-127.7 128.8 6.7 28.3 31.0 55 55 A T E Ce 42 122A 25 -13,-2.0 -13,-2.6 -2,-0.4 68,-0.2 -0.975 360.0 360.0-113.4 114.8 6.4 30.6 34.0 56 56 A E 0 0 52 66,-2.4 68,-0.3 -2,-0.6 -15,-0.1 -0.476 360.0 360.0-128.6 360.0 3.6 33.0 33.4 57 !* 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 58 1 B M 0 0 103 0, 0.0 133,-2.6 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 158.7 15.0 43.3 32.4 59 2 B Q E -F 190 0A 46 131,-0.2 2,-0.4 133,-0.1 131,-0.2 -0.789 360.0-171.0 -91.2 129.7 14.4 39.7 31.1 60 3 B Y E -F 189 0A 4 129,-3.0 129,-2.3 -2,-0.5 2,-0.3 -0.931 8.3-146.8-118.0 149.5 16.9 38.2 28.7 61 4 B K E -Fg 188 222A 62 160,-2.6 162,-3.0 -2,-0.4 2,-0.4 -0.849 4.8-160.9-116.1 143.1 16.6 35.0 26.7 62 5 B L E -Fg 187 223A 0 125,-2.8 125,-2.4 -2,-0.3 2,-0.4 -0.989 5.6-170.6-120.3 125.7 19.1 32.5 25.7 63 6 B I E -Fg 186 224A 50 160,-2.8 162,-2.1 -2,-0.4 2,-0.5 -0.939 10.1-154.1-107.3 130.6 18.5 30.0 22.9 64 7 B L E -Fg 185 225A 12 121,-3.0 120,-2.9 -2,-0.4 121,-1.3 -0.933 21.8-171.7-102.3 125.0 21.0 27.2 22.3 65 8 B C E -Fg 183 226A 15 160,-3.2 162,-2.7 -2,-0.5 2,-0.3 -0.922 13.4-158.9-124.5 141.5 20.8 26.1 18.6 66 9 B G E -F 182 0A 4 116,-2.3 116,-2.2 -2,-0.4 2,-0.3 -0.703 17.5-126.8-113.1 168.9 22.3 23.2 16.7 67 10 B K E -F 181 0A 143 -2,-0.3 2,-0.3 114,-0.2 114,-0.3 -0.872 20.7-158.3-113.7 147.8 22.9 22.9 12.9 68 11 B T E -F 180 0A 43 112,-2.1 112,-1.8 -2,-0.3 2,-0.7 -0.936 18.7-125.6-127.6 150.1 21.7 19.9 10.9 69 12 B L E +F 179 0A 118 -2,-0.3 110,-0.2 110,-0.2 3,-0.1 -0.870 31.8 168.0 -90.4 115.8 22.8 18.5 7.5 70 13 B K E - 0 0 123 108,-3.0 2,-0.3 -2,-0.7 109,-0.2 0.582 61.6 -26.4-104.9 -12.6 19.8 18.3 5.3 71 14 B G E -F 178 0A 21 107,-1.6 107,-3.1 2,-0.0 -1,-0.4 -0.942 46.7-151.9 171.6 162.8 21.5 17.6 1.9 72 15 B E E +F 177 0A 134 -2,-0.3 2,-0.3 105,-0.2 105,-0.2 -0.951 23.9 153.7-153.8 133.5 24.6 17.9 -0.1 73 16 B T E -F 176 0A 40 103,-2.6 103,-2.9 -2,-0.3 2,-0.3 -0.906 25.2-134.4-155.9-179.3 25.2 18.1 -3.9 74 17 B T E -F 175 0A 68 -2,-0.3 2,-0.3 101,-0.2 101,-0.2 -0.916 12.5-172.5-143.7 153.1 27.4 19.3 -6.7 75 18 B T E -F 174 0A 32 99,-1.9 99,-2.5 -2,-0.3 2,-0.5 -0.985 21.4-132.3-148.7 155.5 27.1 21.0 -10.1 76 19 B E E +F 173 0A 134 -2,-0.3 2,-0.3 97,-0.2 97,-0.2 -0.967 41.1 156.7-108.2 123.5 29.3 21.9 -13.0 77 20 B A - 0 0 8 95,-2.4 3,-0.1 -2,-0.5 -2,-0.1 -0.979 52.4-118.4-148.9 159.8 28.9 25.5 -14.2 78 21 B V S S- 0 0 115 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.784 94.0 -4.3 -69.6 -33.1 30.7 28.2 -16.0 79 22 B D S > S- 0 0 69 93,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.971 75.0 -96.5-157.5 174.3 30.8 30.5 -13.0 80 23 B A H > S+ 0 0 25 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.889 117.5 55.6 -69.9 -35.6 29.6 31.0 -9.4 81 24 B A H > S+ 0 0 67 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.905 109.8 46.1 -62.0 -40.4 26.6 33.1 -10.4 82 25 B T H > S+ 0 0 57 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.909 110.4 53.3 -66.2 -46.1 25.3 30.4 -12.7 83 26 B A H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.913 106.6 54.5 -56.1 -39.5 25.9 27.7 -10.0 84 27 B E H X S+ 0 0 63 -4,-2.8 4,-2.8 2,-0.2 -1,-0.2 0.914 108.1 47.3 -61.1 -46.1 23.9 29.8 -7.6 85 28 B C H X S+ 0 0 91 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.931 113.6 48.5 -61.3 -41.5 20.9 29.9 -9.9 86 29 B V H X S+ 0 0 62 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.925 113.4 46.8 -60.4 -47.4 21.2 26.1 -10.5 87 30 B F H X S+ 0 0 3 -4,-2.7 4,-3.0 1,-0.2 -2,-0.2 0.870 107.8 56.7 -68.9 -33.8 21.5 25.5 -6.7 88 31 B K H X S+ 0 0 88 -4,-2.8 4,-2.8 -5,-0.2 -1,-0.2 0.915 107.9 49.0 -61.9 -39.2 18.5 27.8 -6.0 89 32 B Q H X S+ 0 0 107 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.927 111.0 48.3 -63.9 -46.9 16.4 25.6 -8.4 90 33 B Y H X S+ 0 0 83 -4,-2.2 4,-1.5 2,-0.2 6,-0.2 0.929 112.6 48.9 -59.7 -46.9 17.6 22.4 -6.7 91 34 B A H ><>S+ 0 0 0 -4,-3.0 5,-2.4 1,-0.2 3,-0.5 0.954 112.8 48.1 -54.3 -49.6 16.7 23.9 -3.2 92 35 B N H ><5S+ 0 0 96 -4,-2.8 3,-0.9 1,-0.3 -1,-0.2 0.783 107.8 54.5 -67.2 -28.2 13.3 25.1 -4.4 93 36 B D H 3<5S+ 0 0 110 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.827 110.5 47.0 -72.2 -30.0 12.6 21.6 -6.0 94 37 B N T <<5S- 0 0 95 -4,-1.5 -1,-0.2 -3,-0.5 -2,-0.2 0.023 117.7-112.0 -98.5 24.3 13.3 20.0 -2.6 95 38 B G T < 5S+ 0 0 59 -3,-0.9 2,-0.7 1,-0.2 -3,-0.2 0.550 71.6 140.4 52.9 17.0 11.1 22.6 -0.7 96 39 B V < + 0 0 13 -5,-2.4 2,-0.4 -6,-0.2 -1,-0.2 -0.794 21.9 171.1 -93.7 109.8 14.2 24.1 1.0 97 40 B D + 0 0 114 -2,-0.7 2,-0.3 -3,-0.1 14,-0.0 -0.950 24.6 106.9-112.1 138.6 14.0 28.0 1.3 98 41 B G - 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