==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 06-APR-09 3GZ1 . COMPND 2 MOLECULE: CHAPERONE PROTEIN IPGC; . SOURCE 2 ORGANISM_SCIENTIFIC: SHIGELLA FLEXNERI; . AUTHOR M.LUNELLI,R.K.LOKAREDDY,A.ZYCHLINSKY,M.KOLBE . 309 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16233.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 234 75.7 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 . 0 0.0 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 . 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 . 19 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 183 59.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.3 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 1 0 0 1 0 0 0 1 2 3 6 1 2 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 8 A N > 0 0 135 0, 0.0 4,-1.4 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 -22.9 -35.7 3.4 -7.4 2 9 A E H > + 0 0 115 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.744 360.0 51.2 -68.1 -38.6 -38.8 5.6 -7.1 3 10 A S H > S+ 0 0 95 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.828 107.8 54.5 -76.8 -24.6 -39.4 6.2 -3.4 4 11 A I H > S+ 0 0 45 -3,-0.5 4,-2.3 2,-0.2 -2,-0.2 0.929 109.0 51.3 -60.2 -47.6 -35.7 7.3 -2.8 5 12 A S H X S+ 0 0 0 -4,-1.4 4,-1.7 1,-0.2 -2,-0.2 0.894 115.6 39.3 -51.4 -48.3 -36.2 9.8 -5.6 6 13 A T H X S+ 0 0 44 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.751 108.8 59.0 -87.5 -25.6 -39.3 11.2 -4.1 7 14 A A H X S+ 0 0 34 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.961 109.0 48.1 -61.3 -51.3 -38.2 11.0 -0.4 8 15 A V H >X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 3,-0.8 0.949 114.3 44.9 -48.4 -55.6 -35.4 13.3 -1.4 9 16 A I H 3X S+ 0 0 15 -4,-1.7 4,-3.2 1,-0.3 -1,-0.2 0.858 110.4 55.2 -64.2 -38.2 -37.7 15.7 -3.3 10 17 A D H 3< S+ 0 0 98 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.805 107.5 49.5 -60.4 -34.9 -40.2 15.7 -0.5 11 18 A A H XX S+ 0 0 0 -4,-1.7 4,-0.5 -3,-0.8 3,-0.5 0.847 115.3 41.8 -80.6 -34.0 -37.6 16.7 2.0 12 19 A I H >< S+ 0 0 0 -4,-1.8 2,-1.4 1,-0.2 3,-0.9 0.909 106.1 64.8 -73.1 -46.3 -36.3 19.6 -0.1 13 20 A N T 3< S+ 0 0 66 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.1 -0.142 112.7 33.8 -73.1 38.4 -39.9 20.6 -1.0 14 21 A S T <4 S+ 0 0 60 -2,-1.4 -1,-0.3 -3,-0.5 -2,-0.2 0.128 103.2 73.1-157.5 -12.0 -40.6 21.5 2.6 15 22 A G << + 0 0 0 -3,-0.9 2,-1.1 -4,-0.5 -2,-0.2 0.325 63.3 127.2 -86.7 3.6 -37.1 22.7 3.4 16 23 A A - 0 0 75 -4,-0.4 2,-0.9 1,-0.1 -3,-0.0 -0.535 51.6-159.0 -55.0 95.1 -38.2 25.7 1.3 17 24 A T - 0 0 62 -2,-1.1 2,-0.4 1,-0.1 3,-0.2 -0.739 47.3 -45.8 -98.8 91.1 -37.2 28.3 4.1 18 25 A L - 0 0 125 -2,-0.9 -1,-0.1 1,-0.2 -2,-0.1 -0.395 54.0-119.3 109.0 -42.3 -38.9 31.8 3.8 19 26 A K - 0 0 139 -2,-0.4 2,-2.8 1,-0.1 -1,-0.2 0.408 49.4-124.1 61.8 6.9 -38.8 33.1 0.1 20 27 A D S S+ 0 0 50 -3,-0.2 2,-1.2 1,-0.2 39,-0.2 -0.070 83.8 112.1 61.0 -35.7 -36.8 35.7 2.1 21 28 A I S > S- 0 0 15 -2,-2.8 3,-2.4 1,-0.1 -1,-0.2 0.202 71.0-138.3 -66.6 19.4 -39.0 38.8 1.0 22 29 A N T 3 - 0 0 105 -2,-1.2 -1,-0.1 1,-0.3 -3,-0.1 0.772 60.9 -63.3 23.9 77.8 -40.5 39.4 4.5 23 30 A A T 3 S+ 0 0 108 1,-0.2 -1,-0.3 2,-0.0 -2,-0.1 0.647 96.2 138.4 14.4 45.2 -44.1 40.2 3.3 24 31 A I < - 0 0 34 -3,-2.4 5,-0.3 2,-0.0 -1,-0.2 -0.694 64.1-112.6-106.7 78.5 -42.9 43.3 1.4 25 32 A P >> - 0 0 96 0, 0.0 3,-1.6 0, 0.0 4,-0.6 0.442 19.0-110.4 -30.5 122.2 -45.0 42.7 -1.7 26 33 A D H >> S+ 0 0 89 1,-0.2 3,-2.8 2,-0.2 4,-1.0 0.658 104.5 53.1 0.5 -98.8 -43.7 41.7 -5.1 27 34 A D H 3> S+ 0 0 117 1,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.558 105.4 62.1 -47.9 -10.5 -44.1 44.7 -7.7 28 35 A M H <> S+ 0 0 82 -3,-1.6 4,-2.0 2,-0.2 3,-0.3 0.870 99.6 51.7 -71.1 -49.5 -42.3 46.9 -5.1 29 36 A M H S+ 0 0 35 -4,-4.0 5,-2.8 2,-0.2 -1,-0.2 0.904 113.4 48.5 -64.2 -43.0 -28.3 53.0 -12.0 40 47 A Y H ><5S+ 0 0 8 -4,-2.8 3,-2.5 -5,-0.3 -2,-0.2 0.968 111.2 46.5 -62.6 -55.3 -26.3 50.1 -13.5 41 48 A N H 3<5S+ 0 0 84 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.754 112.4 53.6 -63.7 -20.7 -27.0 51.0 -17.1 42 49 A K T 3<5S- 0 0 135 -4,-1.0 -1,-0.3 -5,-0.3 -2,-0.2 0.495 116.3-115.0 -86.3 -7.2 -26.1 54.6 -16.3 43 50 A G T < 5S+ 0 0 52 -3,-2.5 2,-1.5 -4,-0.2 3,-0.2 0.661 72.5 135.9 73.2 15.9 -22.8 53.6 -14.7 44 51 A R >< + 0 0 110 -5,-2.8 4,-2.3 -6,-0.2 -1,-0.2 -0.651 25.3 166.5 -88.3 78.7 -23.8 54.7 -11.2 45 52 A I H > + 0 0 39 -2,-1.5 4,-3.1 2,-0.2 -1,-0.2 0.865 62.9 60.0 -68.7 -37.7 -22.2 51.5 -9.9 46 53 A E H > S+ 0 0 148 1,-0.2 4,-1.7 -3,-0.2 -1,-0.2 0.945 112.6 39.2 -61.5 -43.2 -22.1 52.5 -6.2 47 54 A E H > S+ 0 0 52 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.901 115.0 51.0 -67.1 -48.2 -25.9 52.9 -6.1 48 55 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.892 108.4 54.4 -57.6 -40.1 -26.6 50.0 -8.3 49 56 A E H X S+ 0 0 33 -4,-3.1 4,-2.3 1,-0.2 5,-0.2 0.924 109.3 47.8 -58.5 -44.8 -24.3 47.9 -6.0 50 57 A V H X S+ 0 0 91 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.899 112.8 48.6 -61.2 -45.6 -26.4 49.0 -2.9 51 58 A F H X S+ 0 0 57 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.949 113.2 45.4 -63.6 -45.9 -29.7 48.2 -4.6 52 59 A F H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.890 113.7 49.5 -67.8 -37.4 -28.7 44.8 -5.7 53 60 A R H X S+ 0 0 113 -4,-2.3 4,-1.8 -5,-0.3 -1,-0.2 0.935 111.4 50.1 -66.2 -34.6 -27.2 43.9 -2.4 54 61 A F H X S+ 0 0 87 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.922 112.7 46.1 -69.2 -44.7 -30.3 45.0 -0.7 55 62 A L H X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.850 111.4 51.9 -63.9 -38.1 -32.4 42.9 -3.1 56 63 A C H < S+ 0 0 7 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.755 108.5 52.3 -69.4 -27.0 -30.1 39.9 -2.6 57 64 A I H < S+ 0 0 125 -4,-1.8 3,-0.4 -5,-0.2 -2,-0.2 0.946 112.9 44.6 -72.2 -43.1 -30.5 40.2 1.1 58 65 A Y H < S+ 0 0 61 -4,-1.9 -2,-0.2 1,-0.2 -36,-0.2 0.765 134.1 11.5 -68.7 -29.4 -34.2 40.3 0.7 59 66 A D >< + 0 0 21 -4,-2.0 3,-1.8 -39,-0.2 -1,-0.2 -0.527 60.6 176.8-154.4 83.1 -34.5 37.4 -1.7 60 67 A F T 3 S+ 0 0 29 -3,-0.4 -4,-0.1 1,-0.3 6,-0.1 0.641 78.6 63.6 -60.6 -19.1 -31.3 35.4 -2.2 61 68 A Y T 3 S+ 0 0 67 -42,-0.1 2,-0.8 4,-0.0 -1,-0.3 0.477 72.6 103.0 -88.2 -3.2 -33.1 33.0 -4.5 62 69 A N X> - 0 0 36 -3,-1.8 4,-1.8 1,-0.2 3,-0.5 -0.749 59.2-155.8 -90.5 117.0 -33.9 35.4 -7.3 63 70 A V H 3> S+ 0 0 40 -2,-0.8 4,-3.3 1,-0.2 5,-0.2 0.804 90.1 58.3 -61.2 -35.2 -31.5 34.8 -10.1 64 71 A D H 3> S+ 0 0 42 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.919 107.1 48.1 -63.0 -39.5 -31.8 38.4 -11.6 65 72 A Y H <> S+ 0 0 11 -3,-0.5 4,-2.5 2,-0.2 5,-0.2 0.942 114.5 44.8 -61.5 -53.4 -30.7 39.9 -8.3 66 73 A I H X S+ 0 0 0 -4,-1.8 4,-3.2 1,-0.2 5,-0.2 0.899 113.6 51.2 -58.4 -43.4 -27.8 37.5 -8.0 67 74 A M H X S+ 0 0 39 -4,-3.3 4,-2.1 2,-0.2 -1,-0.2 0.872 110.2 49.0 -66.3 -39.3 -26.9 38.2 -11.7 68 75 A G H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.937 114.6 44.2 -63.1 -45.2 -27.1 42.0 -11.1 69 76 A L H X S+ 0 0 11 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.938 112.8 51.6 -67.8 -45.3 -24.8 41.8 -8.1 70 77 A A H X S+ 0 0 0 -4,-3.2 4,-2.3 -5,-0.2 -1,-0.2 0.909 109.1 53.1 -55.2 -38.1 -22.4 39.4 -9.8 71 78 A A H X S+ 0 0 1 -4,-2.1 4,-3.0 1,-0.2 -2,-0.2 0.921 107.5 49.6 -70.6 -40.3 -22.3 41.8 -12.8 72 79 A I H X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.919 109.8 49.5 -58.2 -47.3 -21.3 44.7 -10.5 73 80 A Y H <>S+ 0 0 11 -4,-2.5 5,-2.9 2,-0.2 4,-0.2 0.920 111.3 52.6 -62.4 -34.8 -18.5 42.7 -8.9 74 81 A Q H ><5S+ 0 0 13 -4,-2.3 3,-2.0 1,-0.2 -2,-0.2 0.975 109.0 47.2 -61.7 -53.5 -17.4 41.8 -12.4 75 82 A I H 3<5S+ 0 0 45 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.729 112.6 51.5 -56.2 -27.4 -17.3 45.4 -13.5 76 83 A K T 3<5S- 0 0 82 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.388 114.1-118.7 -93.4 1.3 -15.4 46.2 -10.2 77 84 A E T < 5S+ 0 0 145 -3,-2.0 2,-1.5 -4,-0.2 -3,-0.2 0.762 71.9 137.7 61.5 27.0 -12.9 43.5 -10.9 78 85 A Q >< + 0 0 50 -5,-2.9 4,-2.1 -6,-0.2 -1,-0.2 -0.667 26.6 165.9 -93.6 74.4 -13.8 41.7 -7.8 79 86 A F H > + 0 0 35 -2,-1.5 4,-2.6 2,-0.2 -1,-0.2 0.805 63.1 53.0 -72.1 -34.7 -13.6 38.6 -9.9 80 87 A Q H > S+ 0 0 90 -3,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.951 112.6 46.4 -62.2 -53.4 -13.6 35.9 -7.2 81 88 A Q H > S+ 0 0 89 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.875 112.8 50.5 -51.9 -41.9 -16.8 37.4 -5.7 82 89 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.971 112.1 46.7 -61.7 -49.0 -18.4 37.7 -9.2 83 90 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.916 108.6 56.5 -67.0 -34.7 -17.6 34.0 -10.0 84 91 A D H X S+ 0 0 22 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.936 111.8 42.1 -60.9 -44.8 -18.9 33.0 -6.5 85 92 A L H X S+ 0 0 18 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.849 109.7 57.2 -67.7 -39.5 -22.3 34.6 -7.3 86 93 A Y H X S+ 0 0 1 -4,-2.7 4,-2.8 2,-0.2 -1,-0.2 0.875 105.5 51.3 -60.9 -38.4 -22.3 33.2 -10.8 87 94 A A H X S+ 0 0 12 -4,-2.4 4,-2.2 -5,-0.3 -2,-0.2 0.933 111.1 48.7 -62.6 -40.7 -22.0 29.7 -9.4 88 95 A V H X S+ 0 0 0 -4,-1.6 4,-1.8 2,-0.2 -2,-0.2 0.933 111.0 49.2 -58.3 -48.7 -24.9 30.5 -7.1 89 96 A A H X S+ 0 0 1 -4,-2.9 4,-2.4 1,-0.2 3,-0.3 0.922 110.4 52.7 -59.7 -43.8 -27.0 31.9 -10.1 90 97 A F H < S+ 0 0 5 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.937 110.7 45.6 -53.4 -46.2 -26.1 28.7 -12.0 91 98 A A H < S+ 0 0 11 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.727 122.7 37.7 -73.0 -25.1 -27.3 26.5 -9.0 92 99 A L H < S+ 0 0 39 -4,-1.8 -1,-0.2 -3,-0.3 -2,-0.2 0.805 116.1 48.5 -78.4 -37.3 -30.5 28.6 -8.7 93 100 A G S < S- 0 0 18 -4,-2.4 3,-0.4 -5,-0.2 2,-0.4 -0.048 77.7-168.6-117.8 28.0 -31.3 29.3 -12.2 94 101 A K + 0 0 39 1,-0.2 3,-0.1 -4,-0.2 -4,-0.1 -0.062 63.9 37.0 -65.5 96.8 -31.1 26.1 -13.9 95 102 A N S S+ 0 0 114 1,-0.4 -1,-0.2 -2,-0.4 -2,-0.1 -0.412 88.0 89.7-175.6 -83.8 -31.1 26.2 -17.6 96 103 A D - 0 0 78 -3,-0.4 -1,-0.4 1,-0.1 4,-0.1 0.243 51.4-161.9 -36.1 135.8 -29.2 29.4 -18.7 97 104 A Y > + 0 0 13 1,-0.1 4,-2.0 2,-0.1 3,-0.4 0.355 66.1 101.8-104.1 1.6 -25.4 29.2 -19.4 98 105 A T H > S+ 0 0 29 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.924 79.5 51.2 -47.5 -52.3 -24.8 32.9 -19.1 99 106 A P H > S+ 0 0 6 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.834 110.3 52.1 -63.2 -26.1 -23.4 32.7 -15.5 100 107 A V H > S+ 0 0 5 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.878 109.0 48.5 -74.0 -36.2 -21.1 29.9 -16.8 101 108 A F H X S+ 0 0 5 -4,-2.0 4,-2.1 2,-0.2 -3,-0.2 0.968 113.1 47.6 -66.3 -47.0 -19.8 32.2 -19.7 102 109 A H H X S+ 0 0 11 -4,-2.9 4,-2.6 1,-0.3 -2,-0.2 0.851 106.6 57.5 -65.4 -29.9 -19.3 35.0 -17.3 103 110 A T H X S+ 0 0 21 -4,-1.7 4,-3.6 -5,-0.3 5,-0.3 0.941 103.3 53.8 -66.5 -40.4 -17.5 32.7 -14.9 104 111 A G H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.956 107.0 51.5 -55.4 -45.3 -15.0 31.9 -17.8 105 112 A Q H X S+ 0 0 16 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.960 113.2 45.9 -54.2 -47.9 -14.5 35.6 -18.1 106 113 A C H X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.907 110.1 50.4 -61.6 -46.4 -13.8 35.7 -14.4 107 114 A Q H <>S+ 0 0 21 -4,-3.6 5,-2.5 2,-0.2 -1,-0.2 0.879 106.8 57.1 -62.0 -38.2 -11.5 32.7 -14.2 108 115 A L H ><5S+ 0 0 47 -4,-2.8 3,-1.5 -5,-0.3 -1,-0.2 0.960 110.4 44.2 -50.7 -50.3 -9.5 34.3 -17.1 109 116 A R H 3<5S+ 0 0 149 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.653 106.1 61.0 -72.8 -14.7 -9.0 37.3 -15.0 110 117 A L T 3<5S- 0 0 54 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.211 119.2-106.9 -94.9 19.2 -8.2 35.2 -11.9 111 118 A K T < 5S+ 0 0 187 -3,-1.5 -3,-0.2 -5,-0.1 -2,-0.2 0.894 89.0 116.5 58.3 40.5 -5.1 33.6 -13.8 112 119 A A >< + 0 0 15 -5,-2.5 4,-2.5 -4,-0.2 3,-0.3 -0.498 25.9 160.8-134.6 69.9 -6.8 30.3 -14.3 113 120 A P H > S+ 0 0 64 0, 0.0 4,-4.1 0, 0.0 5,-0.2 0.839 74.4 62.3 -61.7 -33.1 -7.2 29.9 -18.1 114 121 A L H > S+ 0 0 112 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.951 108.8 39.4 -52.0 -54.0 -7.6 26.1 -17.6 115 122 A K H > S+ 0 0 115 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.923 115.5 53.9 -61.0 -45.1 -10.8 26.7 -15.6 116 123 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 5,-0.2 0.930 105.9 52.7 -54.7 -47.9 -11.7 29.5 -18.0 117 124 A K H X S+ 0 0 75 -4,-4.1 4,-2.7 1,-0.2 -1,-0.2 0.950 107.7 51.1 -52.3 -53.7 -11.3 27.1 -20.9 118 125 A E H X S+ 0 0 75 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.872 108.0 53.5 -53.3 -41.5 -13.7 24.5 -19.3 119 126 A C H X S+ 0 0 17 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.970 110.9 43.7 -55.9 -55.3 -16.4 27.2 -18.8 120 127 A F H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.892 112.9 52.8 -65.2 -38.8 -16.4 28.3 -22.4 121 128 A E H X S+ 0 0 62 -4,-2.7 4,-2.8 -5,-0.2 5,-0.2 0.969 108.6 50.5 -58.7 -50.2 -16.4 24.7 -23.6 122 129 A L H X S+ 0 0 23 -4,-2.9 4,-2.9 1,-0.2 5,-0.4 0.905 109.9 50.2 -48.2 -50.0 -19.4 23.9 -21.3 123 130 A V H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 -1,-0.2 0.913 110.2 51.7 -55.3 -44.1 -21.3 26.9 -22.8 124 131 A I H < S+ 0 0 43 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.940 114.4 40.9 -62.9 -47.5 -20.4 25.6 -26.2 125 132 A Q H < S+ 0 0 128 -4,-2.8 -2,-0.2 1,-0.1 -1,-0.2 0.925 130.1 25.6 -65.6 -38.1 -21.8 22.1 -25.5 126 133 A H H < S+ 0 0 49 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.698 93.7 95.8-108.0 -21.5 -24.8 23.2 -23.6 127 134 A S < - 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