==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 20-OCT-10 3PBB . COMPND 2 MOLECULE: GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.F.HUANG,S.S.LIAW,W.L.HUANG,C.Y.CHIA,Y.C.LO,Y.L.CHEN,A.H.J. . 646 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27392.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 432 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 7.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 6.5 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 . 4 0.6 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 0.2 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 . 57 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 169 26.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.5 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 5 1 0 2 0 0 2 2 0 2 0 3 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 2 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 PARALLEL BRIDGES PER LADDER . 4 0 0 2 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 33 A A 0 0 141 0, 0.0 2,-0.3 0, 0.0 197,-0.1 0.000 360.0 360.0 360.0-140.1 -18.2 55.3 32.0 2 34 A S - 0 0 52 195,-0.1 4,-0.1 1,-0.1 0, 0.0 -0.927 360.0-131.2-159.6 168.0 -19.4 53.1 29.1 3 35 A A S > S+ 0 0 76 -2,-0.3 3,-2.0 1,-0.1 4,-0.2 0.807 86.7 77.3-102.7 -39.2 -17.8 50.6 26.8 4 36 A W G > S+ 0 0 26 1,-0.3 3,-2.1 2,-0.2 4,-0.4 0.762 80.3 72.4 -46.9 -32.1 -18.9 51.5 23.2 5 37 A P G > S+ 0 0 8 0, 0.0 3,-0.8 0, 0.0 4,-0.3 0.872 93.9 57.6 -59.7 -26.0 -16.4 54.4 22.9 6 38 A E G <> S+ 0 0 119 -3,-2.0 4,-0.8 1,-0.2 3,-0.4 0.532 78.9 88.0 -79.3 -4.6 -13.6 51.9 22.6 7 39 A E H <> S+ 0 0 74 -3,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.790 77.9 66.4 -65.4 -27.4 -15.0 50.0 19.5 8 40 A K H <4 S+ 0 0 37 -3,-0.8 3,-0.4 -4,-0.4 -1,-0.2 0.920 96.6 56.3 -58.1 -47.4 -13.2 52.5 17.1 9 41 A N H 4 S+ 0 0 101 -3,-0.4 -1,-0.2 -4,-0.3 -2,-0.2 0.835 117.6 32.3 -45.3 -46.1 -9.8 51.1 18.3 10 42 A Y H < S+ 0 0 179 -4,-0.8 -1,-0.2 -3,-0.2 -2,-0.2 0.536 90.5 124.8 -99.4 -3.6 -10.7 47.5 17.4 11 43 A H < - 0 0 16 -4,-1.3 -3,-0.0 -3,-0.4 310,-0.0 -0.218 39.5-169.9 -60.6 140.2 -12.9 48.3 14.4 12 44 A Q - 0 0 110 309,-0.1 -2,-0.1 308,-0.1 -1,-0.0 -0.953 20.9-109.4-133.3 150.0 -11.9 46.6 11.2 13 45 A P - 0 0 29 0, 0.0 2,-0.8 0, 0.0 308,-0.2 -0.239 19.0-123.8 -72.6 163.2 -13.0 47.1 7.6 14 46 A A - 0 0 35 306,-2.4 310,-0.1 305,-0.1 308,-0.1 -0.847 38.7-137.1-106.0 89.1 -15.2 44.8 5.5 15 47 A I - 0 0 114 -2,-0.8 2,-0.2 1,-0.1 302,-0.0 -0.119 14.9-130.6 -47.3 136.8 -12.8 44.4 2.6 16 48 A L - 0 0 30 1,-0.0 2,-0.2 2,-0.0 -1,-0.1 -0.663 15.3-127.8 -96.9 152.9 -14.5 44.5 -0.9 17 49 A N >> - 0 0 105 -2,-0.2 4,-2.3 1,-0.1 3,-1.0 -0.549 31.7 -94.3-102.5 163.9 -14.0 42.0 -3.8 18 50 A S H 3> S+ 0 0 45 1,-0.3 4,-1.2 2,-0.2 5,-0.1 0.718 122.8 50.1 -47.9 -32.2 -13.0 42.5 -7.4 19 51 A S H 3> S+ 0 0 75 2,-0.2 4,-1.6 1,-0.1 -1,-0.3 0.891 111.9 45.2 -76.1 -41.9 -16.6 42.6 -8.6 20 52 A A H <> S+ 0 0 30 -3,-1.0 4,-2.3 1,-0.2 -2,-0.2 0.943 109.1 56.9 -67.4 -47.4 -17.8 45.1 -6.0 21 53 A L H X S+ 0 0 7 -4,-2.3 4,-2.6 1,-0.3 -1,-0.2 0.833 105.8 50.9 -49.3 -41.8 -14.9 47.4 -6.6 22 54 A R H X S+ 0 0 124 -4,-1.2 4,-2.0 -5,-0.3 -1,-0.3 0.889 108.7 52.3 -65.1 -40.4 -15.8 47.5 -10.3 23 55 A Q H X S+ 0 0 115 -4,-1.6 4,-1.3 2,-0.2 -2,-0.2 0.870 111.3 45.7 -66.1 -38.4 -19.3 48.5 -9.3 24 56 A I H >X S+ 0 0 8 -4,-2.3 4,-1.5 2,-0.2 3,-0.6 0.971 112.6 50.4 -61.3 -55.6 -18.1 51.3 -7.1 25 57 A A H 3< S+ 0 0 8 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.820 116.6 42.2 -55.1 -35.6 -15.6 52.6 -9.8 26 58 A E H 3< S+ 0 0 165 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.753 107.9 61.0 -81.9 -27.0 -18.4 52.5 -12.3 27 59 A G H << S+ 0 0 38 -4,-1.3 2,-0.4 -3,-0.6 -2,-0.2 0.707 89.0 78.9 -79.1 -22.8 -21.0 54.0 -9.9 28 60 A T < - 0 0 9 -4,-1.5 2,-0.6 -5,-0.1 110,-0.1 -0.725 68.2-155.1 -85.0 136.4 -19.1 57.3 -9.3 29 61 A S > - 0 0 36 -2,-0.4 4,-2.2 1,-0.1 5,-0.2 -0.909 11.0-168.9-119.2 109.3 -19.5 59.9 -12.1 30 62 A I H > S+ 0 0 23 -2,-0.6 4,-2.5 1,-0.2 -1,-0.1 0.888 89.1 46.7 -63.4 -37.6 -16.7 62.6 -12.6 31 63 A S H > S+ 0 0 69 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.779 109.9 52.6 -84.1 -22.2 -18.6 64.8 -15.0 32 64 A E H >>S+ 0 0 86 2,-0.2 4,-2.9 3,-0.2 5,-0.6 0.914 112.4 46.3 -66.7 -49.1 -21.8 64.8 -13.0 33 65 A M H X>S+ 0 0 0 -4,-2.2 4,-2.8 3,-0.2 5,-2.7 0.967 113.3 51.8 -52.2 -48.5 -19.8 65.9 -10.0 34 66 A W H <>S+ 0 0 39 -4,-2.5 5,-2.7 1,-0.2 -2,-0.2 0.906 119.3 31.8 -57.4 -53.0 -18.1 68.5 -12.2 35 67 A Q H <5S+ 0 0 119 -4,-2.2 -1,-0.2 3,-0.2 -2,-0.2 0.907 131.4 29.4 -73.9 -44.9 -21.3 70.0 -13.6 36 68 A N H <5S+ 0 0 37 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.707 131.5 23.8 -96.5 -23.7 -23.6 69.6 -10.6 37 69 A D T <>4 - 0 0 60 64,-0.3 3,-2.1 1,-0.2 6,-0.4 -0.392 62.3 -69.3 -68.6 156.0 -15.6 84.1 2.2 47 79 A P T 3 S+ 0 0 3 0, 0.0 -1,-0.2 0, 0.0 41,-0.1 -0.204 122.6 10.9 -55.3 134.2 -17.6 84.3 5.5 48 80 A G T 3 S+ 0 0 58 39,-0.2 40,-0.1 1,-0.2 -2,-0.1 0.073 99.3 122.0 82.2 -24.2 -20.5 86.7 5.3 49 81 A S S <> S- 0 0 13 -3,-2.1 4,-1.1 1,-0.1 -1,-0.2 0.009 77.3-109.3 -60.4 171.6 -20.3 87.2 1.5 50 82 A P H > S+ 0 0 116 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.858 120.4 55.6 -64.1 -40.4 -23.2 86.5 -1.0 51 83 A G H > S+ 0 0 9 -7,-0.3 4,-2.8 1,-0.2 5,-0.2 0.819 101.0 58.3 -63.2 -32.9 -21.2 83.4 -2.3 52 84 A S H > S+ 0 0 2 -6,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.955 108.8 43.3 -64.8 -45.4 -21.0 82.0 1.2 53 85 A Y H X S+ 0 0 140 -4,-1.1 4,-2.2 1,-0.2 -2,-0.2 0.922 116.5 50.0 -61.9 -41.0 -24.8 82.0 1.5 54 86 A A H X S+ 0 0 41 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.880 109.9 48.3 -64.6 -38.0 -25.0 80.6 -1.9 55 87 A A H X S+ 0 0 1 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.889 112.0 49.7 -72.5 -38.5 -22.4 77.8 -1.3 56 88 A R H X S+ 0 0 41 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.890 111.4 48.6 -66.1 -39.7 -24.2 76.8 1.9 57 89 A Q H X S+ 0 0 88 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.905 112.8 50.0 -65.5 -46.0 -27.6 76.7 0.1 58 90 A H H X S+ 0 0 28 -4,-2.4 4,-2.6 -5,-0.2 5,-0.2 0.960 110.5 47.3 -56.0 -49.7 -26.0 74.6 -2.7 59 91 A I H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.939 116.2 45.5 -60.9 -42.5 -24.4 72.1 -0.3 60 92 A M H X S+ 0 0 49 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.900 111.9 49.2 -72.0 -40.9 -27.6 71.7 1.6 61 93 A Q H X S+ 0 0 102 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.893 109.9 52.6 -63.9 -40.8 -29.9 71.4 -1.4 62 94 A R H < S+ 0 0 39 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.830 115.1 41.1 -67.0 -31.7 -27.7 68.8 -3.0 63 95 A I H >< S+ 0 0 1 -4,-1.7 3,-2.1 -5,-0.2 -2,-0.2 0.932 109.5 57.7 -76.6 -49.2 -27.8 66.7 0.2 64 96 A Q H 3< S+ 0 0 62 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.1 0.688 99.3 61.7 -54.9 -26.6 -31.5 67.2 1.0 65 97 A R T 3< S+ 0 0 126 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.1 0.598 85.7 98.5 -77.3 -17.4 -32.5 65.7 -2.4 66 98 A L S < S- 0 0 10 -3,-2.1 4,-0.2 -4,-0.2 74,-0.1 -0.306 76.7-126.0 -71.4 162.1 -30.9 62.3 -1.7 67 99 A Q S S+ 0 0 113 2,-0.1 -1,-0.1 270,-0.1 77,-0.0 0.808 82.8 92.3 -74.3 -36.0 -32.8 59.2 -0.5 68 100 A A S S- 0 0 4 71,-0.2 2,-1.8 1,-0.1 79,-0.1 -0.164 92.1-108.0 -63.6 153.5 -30.7 58.5 2.6 69 101 A D + 0 0 43 81,-0.2 27,-0.5 77,-0.2 2,-0.2 -0.436 47.1 178.8 -92.3 79.3 -32.1 60.1 5.6 70 102 A W - 0 0 14 -2,-1.8 2,-0.6 -7,-0.2 270,-0.5 -0.538 19.3-150.0 -80.9 128.3 -29.6 63.0 6.2 71 103 A V E -A 94 0A 5 23,-2.6 23,-2.5 -2,-0.2 2,-0.3 -0.944 15.4-154.7 -99.6 117.0 -30.3 65.2 9.1 72 104 A L E +A 93 0A 29 -2,-0.6 2,-0.4 268,-0.4 21,-0.2 -0.693 16.4 174.9 -92.6 133.3 -28.9 68.7 8.3 73 105 A E E -A 92 0A 59 19,-2.7 19,-3.4 -2,-0.3 2,-0.5 -0.990 19.9-148.7-133.4 142.6 -27.9 71.1 11.1 74 106 A I E -A 91 0A 62 -2,-0.4 2,-1.0 17,-0.2 17,-0.2 -0.960 5.2-154.7-105.3 126.0 -26.2 74.6 10.7 75 107 A D E +A 90 0A 6 15,-3.0 15,-2.6 -2,-0.5 2,-0.4 -0.873 26.8 178.4 -97.3 92.7 -23.9 75.5 13.6 76 108 A T E +A 89 0A 76 -2,-1.0 2,-0.3 13,-0.3 13,-0.2 -0.827 8.9 148.7 -99.1 135.5 -24.2 79.3 13.3 77 109 A F E -A 88 0A 23 11,-2.6 11,-3.2 -2,-0.4 2,-0.4 -0.977 41.3-110.2-156.2 168.7 -22.3 81.6 15.7 78 110 A L E +A 87 0A 111 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.856 32.8 177.0-105.6 134.1 -20.6 85.0 16.0 79 111 A S E -A 86 0A 25 7,-2.5 7,-2.5 -2,-0.4 2,-0.3 -0.999 34.2-105.9-139.4 149.0 -16.9 85.4 16.5 80 112 A Q E +A 85 0A 111 -2,-0.3 5,-0.2 5,-0.3 -2,-0.0 -0.554 42.5 176.5 -66.2 121.8 -14.4 88.3 16.8 81 113 A T E > -A 84 0A 6 3,-1.5 3,-1.6 -2,-0.3 93,-0.1 -0.751 49.3 -97.5-113.2 171.7 -12.3 88.7 13.6 82 114 A P T 3 S+ 0 0 66 0, 0.0 3,-0.1 0, 0.0 92,-0.0 0.720 129.0 50.8 -57.7 -17.8 -9.6 91.4 12.7 83 115 A Y T 3 S- 0 0 133 1,-0.5 2,-0.0 0, 0.0 -3,-0.0 -0.132 127.2 -85.3-111.1 38.3 -12.5 93.0 10.9 84 116 A G E < S-A 81 0A 32 -3,-1.6 -3,-1.5 2,-0.1 -1,-0.5 -0.169 72.5 -30.2 88.5 175.6 -15.0 92.9 13.8 85 117 A Y E S-A 80 0A 157 -5,-0.2 2,-0.3 -3,-0.1 -5,-0.3 -0.422 71.4-175.6 -70.2 133.1 -17.5 90.4 15.1 86 118 A R E -A 79 0A 75 -7,-2.5 -7,-2.5 -2,-0.1 2,-0.5 -0.954 25.7-110.0-133.5 161.8 -18.7 88.2 12.2 87 119 A S E -A 78 0A 54 -2,-0.3 2,-0.4 -9,-0.2 -39,-0.2 -0.751 31.2-178.6 -95.2 131.3 -21.2 85.4 11.5 88 120 A F E -A 77 0A 0 -11,-3.2 -11,-2.6 -2,-0.5 2,-0.4 -0.952 8.5-163.3-127.8 149.6 -20.0 81.9 10.7 89 121 A S E -A 76 0A 7 -2,-0.4 2,-0.3 -13,-0.2 -13,-0.3 -0.843 2.0-163.8-141.0 101.6 -22.0 78.8 9.8 90 122 A N E -A 75 0A 0 -15,-2.6 -15,-3.0 -2,-0.4 2,-0.5 -0.612 17.5-140.5 -78.5 141.5 -20.8 75.2 9.9 91 123 A I E -AB 74 160A 0 69,-2.5 69,-2.7 -2,-0.3 2,-0.4 -0.905 17.4-170.2-106.7 125.1 -22.9 72.7 8.0 92 124 A I E -AB 73 159A 13 -19,-3.4 -19,-2.7 -2,-0.5 2,-0.4 -0.947 4.5-172.4-118.6 137.5 -23.3 69.3 9.6 93 125 A S E +AB 72 158A 0 65,-2.5 65,-3.0 -2,-0.4 2,-0.4 -0.972 12.6 178.7-132.9 112.7 -24.9 66.3 7.8 94 126 A T E -AB 71 157A 2 -23,-2.5 -23,-2.6 -2,-0.4 2,-0.4 -0.955 23.9-155.4-128.7 130.1 -25.6 63.2 9.8 95 127 A L S S+ 0 0 4 61,-2.8 61,-0.2 -2,-0.4 -25,-0.1 -0.844 91.6 2.2 -89.4 140.7 -27.2 59.8 9.1 96 128 A N S > S- 0 0 52 -27,-0.5 3,-2.1 -2,-0.4 -1,-0.2 0.942 74.8-171.6 47.6 66.1 -28.6 58.2 12.3 97 129 A P T 3 S+ 0 0 34 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.727 87.7 54.0 -61.8 -24.3 -27.7 61.2 14.5 98 130 A T T 3 S+ 0 0 34 94,-0.1 2,-0.3 93,-0.1 -2,-0.1 0.623 82.0 117.7 -88.0 -1.3 -28.7 59.1 17.5 99 131 A A < - 0 0 2 -3,-2.1 56,-0.2 1,-0.2 55,-0.1 -0.355 68.3-137.4 -66.2 113.4 -26.2 56.5 16.2 100 132 A K S S+ 0 0 63 -2,-0.3 2,-0.4 54,-0.1 54,-0.2 0.783 83.6 38.2 -34.0 -48.5 -23.5 56.2 19.0 101 133 A R E -c 154 0A 5 52,-2.3 54,-3.1 103,-0.1 2,-0.4 -0.905 65.9-178.1-117.7 140.1 -20.6 56.1 16.5 102 134 A H E -cd 155 204A 11 101,-2.6 103,-1.4 -2,-0.4 104,-0.8 -0.987 27.2-137.1-134.9 134.6 -19.9 58.0 13.2 103 135 A L E -cd 156 206A 0 52,-2.9 54,-2.8 -2,-0.4 2,-0.6 -0.716 35.2-149.2 -70.6 132.3 -17.2 58.0 10.6 104 136 A V E -cd 157 207A 0 102,-2.8 104,-3.0 -2,-0.4 2,-0.4 -0.946 16.5-170.3-116.8 117.9 -16.8 61.7 10.0 105 137 A L E +cd 158 208A 0 52,-3.0 54,-2.4 -2,-0.6 2,-0.3 -0.927 21.9 175.2 -98.7 136.7 -15.8 63.1 6.6 106 138 A A E +cd 159 209A 0 102,-3.1 104,-3.0 -2,-0.4 2,-0.3 -0.926 20.2 154.4-146.0 158.4 -14.9 66.8 6.6 107 139 A C E -c 160 0A 0 52,-1.6 54,-3.5 -2,-0.3 2,-0.4 -0.927 41.6-100.7-165.0 175.2 -13.7 69.8 4.6 108 140 A H E -c 161 0A 1 102,-0.3 24,-0.2 -2,-0.3 54,-0.2 -0.911 19.5-166.8-110.6 142.7 -14.1 73.6 4.7 109 141 A Y + 0 0 0 52,-3.2 53,-0.2 -2,-0.4 -1,-0.1 0.551 58.3 93.6-105.5 -9.8 -16.4 75.4 2.4 110 142 A D - 0 0 0 51,-0.8 2,-0.3 -55,-0.0 -64,-0.3 -0.422 65.4-138.7 -71.6 155.7 -15.3 79.0 2.8 111 143 A S - 0 0 1 -66,-0.6 2,-0.2 -2,-0.1 17,-0.1 -0.873 23.4-101.3-113.6 154.1 -12.8 80.5 0.5 112 144 A K - 0 0 26 15,-0.4 2,-0.4 -2,-0.3 -66,-0.1 -0.533 37.2-118.9 -67.0 133.8 -9.9 82.8 1.5 113 145 A Y + 0 0 92 53,-0.3 2,-0.3 -2,-0.2 -1,-0.1 -0.658 37.9 170.1 -72.9 126.9 -10.5 86.5 0.8 114 146 A F - 0 0 52 -2,-0.4 8,-0.3 8,-0.1 2,-0.0 -0.975 38.8-113.0-127.5 145.6 -8.0 88.1 -1.7 115 147 A S - 0 0 47 -2,-0.3 2,-2.3 1,-0.1 5,-0.1 -0.351 48.9 -90.6 -74.4 164.8 -8.6 91.5 -3.1 116 148 A H > - 0 0 94 3,-0.1 3,-1.6 5,-0.1 4,-0.2 -0.289 53.0-172.8 -87.5 64.8 -9.3 91.3 -6.8 117 149 A W G > S+ 0 0 177 -2,-2.3 3,-1.6 1,-0.3 -3,-0.0 -0.182 70.7 0.5 -57.7 139.0 -5.7 91.6 -8.2 118 150 A N G 3 S- 0 0 145 1,-0.2 -1,-0.3 3,-0.0 3,-0.1 0.778 129.2 -65.4 51.5 29.4 -5.5 91.9 -12.0 119 151 A N G < S+ 0 0 158 -3,-1.6 2,-0.3 1,-0.2 -1,-0.2 0.773 106.9 121.9 68.9 27.9 -9.3 91.7 -12.2 120 152 A R < - 0 0 101 -3,-1.6 2,-0.4 -4,-0.2 -1,-0.2 -0.822 51.2-142.4-124.2 161.1 -9.5 88.1 -10.9 121 153 A V - 0 0 54 -2,-0.3 2,-0.5 174,-0.1 -6,-0.1 -0.952 21.4-117.9-127.2 136.5 -11.3 86.6 -8.0 122 154 A F + 0 0 1 -2,-0.4 -8,-0.1 -8,-0.3 173,-0.1 -0.687 32.7 171.4 -81.3 123.4 -10.0 83.7 -5.7 123 155 A V - 0 0 24 -2,-0.5 -80,-0.3 174,-0.4 6,-0.2 0.369 36.0-135.5-112.2 0.9 -12.4 80.7 -6.0 124 156 A G > + 0 0 0 170,-0.2 5,-2.4 -12,-0.1 6,-0.2 0.924 30.8 177.7 47.1 61.8 -10.2 78.2 -4.0 125 157 A A T >S+ 0 0 0 172,-2.2 5,-2.5 1,-0.2 3,-0.2 0.971 84.6 21.9 -66.9 -56.0 -10.7 75.3 -6.5 126 158 A T T 5S+ 0 0 2 1,-0.2 87,-1.2 3,-0.2 86,-0.8 0.724 114.2 83.4 -71.4 -18.4 -8.4 72.8 -4.6 127 159 A D T 5S- 0 0 2 1,-0.2 -15,-0.4 85,-0.2 -1,-0.2 -0.724 127.9 -55.3-128.0 76.0 -9.0 74.9 -1.5 128 160 A S T >5S+ 0 0 0 -2,-0.5 4,-2.4 -3,-0.2 -1,-0.2 -0.701 117.5 94.3-125.7 48.0 -11.6 73.5 -0.9 129 161 A A H > S+ 0 0 0 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.898 111.3 50.3 -48.9 -43.0 -13.1 68.4 -1.5 132 164 A C H X S+ 0 0 0 -4,-2.4 4,-2.0 -24,-0.2 3,-0.4 0.957 111.7 46.8 -58.5 -50.1 -16.7 69.7 -1.0 133 165 A A H X S+ 0 0 0 -4,-2.6 4,-3.4 1,-0.2 5,-0.2 0.876 108.9 56.6 -58.7 -39.0 -17.8 68.3 -4.4 134 166 A M H X S+ 0 0 3 -4,-2.8 4,-2.0 2,-0.2 -1,-0.2 0.839 107.9 47.6 -56.4 -39.5 -16.1 65.0 -3.5 135 167 A M H X S+ 0 0 0 -4,-1.5 4,-2.0 -3,-0.4 -2,-0.2 0.895 114.4 45.4 -71.3 -38.7 -18.1 64.8 -0.4 136 168 A L H X S+ 0 0 5 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.906 113.6 49.1 -74.1 -41.6 -21.4 65.6 -2.2 137 169 A E H X S+ 0 0 0 -4,-3.4 4,-2.8 2,-0.2 5,-0.3 0.889 109.8 53.8 -62.6 -39.5 -20.5 63.1 -5.1 138 170 A L H X S+ 0 0 0 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.918 109.1 47.6 -56.2 -49.5 -19.7 60.5 -2.4 139 171 A A H < S+ 0 0 0 -4,-2.0 4,-0.3 2,-0.2 -2,-0.2 0.850 116.6 44.5 -59.4 -37.7 -23.2 61.1 -0.9 140 172 A R H >< S+ 0 0 72 -4,-2.0 3,-2.5 2,-0.2 4,-0.4 0.994 116.3 43.2 -68.7 -69.5 -24.8 60.8 -4.4 141 173 A A H 3< S+ 0 0 23 -4,-2.8 3,-0.3 1,-0.3 4,-0.2 0.780 121.8 40.5 -47.7 -36.6 -22.8 57.7 -5.6 142 174 A L T >X S+ 0 0 4 -4,-2.3 4,-2.5 -5,-0.3 3,-0.6 0.412 85.0 104.8 -93.6 -1.1 -23.2 55.9 -2.3 143 175 A D H <> S+ 0 0 14 -3,-2.5 4,-1.5 -4,-0.3 -1,-0.2 0.817 75.3 53.7 -54.3 -41.6 -26.8 56.9 -1.7 144 176 A K H 34 S+ 0 0 170 -4,-0.4 4,-0.4 -3,-0.3 -1,-0.3 0.906 115.2 41.6 -62.3 -40.3 -28.4 53.5 -2.6 145 177 A K H X4 S+ 0 0 64 -3,-0.6 3,-1.1 1,-0.2 -2,-0.2 0.854 106.5 59.8 -80.7 -35.1 -26.2 51.8 -0.2 146 178 A L H >< S+ 0 0 2 -4,-2.5 3,-2.0 1,-0.2 -1,-0.2 0.773 89.7 76.5 -61.3 -28.0 -26.4 54.4 2.6 147 179 A L G >< S+ 0 0 51 -4,-1.5 3,-2.3 1,-0.3 -1,-0.2 0.825 77.7 73.3 -40.4 -46.1 -30.2 53.7 2.6 148 180 A S G < S+ 0 0 70 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.742 74.3 78.4 -46.3 -31.1 -29.5 50.5 4.4 149 181 A L G < 0 0 32 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.456 360.0 360.0 -69.6 0.2 -28.8 52.6 7.6 150 182 A K < 0 0 188 -3,-2.3 -81,-0.2 -4,-0.1 -1,-0.2 -0.702 360.0 360.0 118.6 360.0 -32.6 52.6 7.7 151 ! 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 0.0 152 189 A P 0 0 125 0, 0.0 2,-2.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 141.9 -22.3 48.0 15.3 153 190 A D + 0 0 71 -51,-0.0 -52,-2.3 2,-0.0 2,-0.4 -0.535 360.0 135.1 -82.5 69.7 -24.3 51.2 16.0 154 191 A L E + c 0 101A 16 -2,-2.0 -52,-0.2 -54,-0.2 2,-0.1 -0.976 22.8 153.2-133.2 131.2 -22.1 53.1 13.5 155 192 A S E - c 0 102A 1 -54,-3.1 -52,-2.9 -2,-0.4 2,-0.4 -0.454 36.0 -77.8-137.7-152.5 -23.0 55.5 10.8 156 193 A L E - c 0 103A 0 -54,-0.2 -61,-2.8 -61,-0.2 2,-0.4 -0.958 28.3-178.2-130.4 134.0 -21.8 58.5 8.6 157 194 A Q E -Bc 94 104A 21 -54,-2.8 -52,-3.0 -2,-0.4 2,-0.4 -0.991 9.6-158.9-130.7 142.2 -21.4 62.2 9.1 158 195 A L E -Bc 93 105A 0 -65,-3.0 -65,-2.5 -2,-0.4 2,-0.4 -0.933 8.7-168.9-114.4 135.4 -20.3 65.0 6.8 159 196 A I E -Bc 92 106A 0 -54,-2.4 -52,-1.6 -2,-0.4 2,-0.6 -0.997 8.9-170.5-126.6 126.8 -19.0 68.3 8.1 160 197 A F E -Bc 91 107A 0 -69,-2.7 -69,-2.5 -2,-0.4 -52,-0.3 -0.956 22.7-149.5-111.8 106.9 -18.4 71.4 6.0 161 198 A F E - c 0 108A 0 -54,-3.5 -52,-3.2 -2,-0.6 -51,-0.8 -0.511 2.7-147.4 -83.7 140.0 -16.5 73.9 8.1 162 199 A D S S+ 0 0 1 -54,-0.2 16,-1.3 -2,-0.2 17,-0.3 -0.713 74.8 21.0 -90.4 159.5 -16.9 77.6 7.7 163 200 A G + 0 0 0 -2,-0.3 14,-4.0 14,-0.2 -1,-0.2 0.785 64.5 145.0 51.5 42.7 -14.0 80.1 8.4 164 201 A E + 0 0 8 12,-0.3 12,-3.6 -3,-0.3 -1,-0.1 0.945 56.8 76.7 -67.2 -46.0 -11.1 77.7 8.1 165 202 A E S S- 0 0 6 10,-0.2 12,-0.2 11,-0.1 2,-0.2 -0.274 85.8-112.4 -73.1 145.9 -9.1 80.6 6.5 166 203 A A - 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