==== 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 TRANSFERASE 26-JUL-05 2AFZ . COMPND 2 MOLECULE: GLUTAMINYL-PEPTIDE CYCLOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.F.HUANG,Y.L.LIU,W.J.CHENG,T.P.KO,A.H.J.WANG . 646 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26417.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 426 65.9 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 . 40 6.2 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 . 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 . 50 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 175 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 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 4 2 0 2 0 0 2 2 0 2 0 2 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 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 1 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 . 1 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 0 134 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 88.8 -6.6 -32.6 36.6 2 34 A S - 0 0 90 1,-0.1 0, 0.0 2,-0.0 0, 0.0 0.006 360.0-151.7 -47.9 141.6 -8.9 -32.2 33.6 3 35 A A > + 0 0 55 1,-0.2 3,-2.2 2,-0.1 4,-0.4 0.090 59.3 121.5 -99.9 20.9 -7.6 -30.5 30.5 4 36 A W G > + 0 0 16 1,-0.3 3,-1.9 2,-0.2 4,-0.4 0.841 64.0 63.9 -57.7 -33.7 -11.1 -29.3 29.5 5 37 A P G 3 S+ 0 0 29 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.640 99.1 58.0 -65.4 -10.0 -10.1 -25.6 29.5 6 38 A E G X> S+ 0 0 99 -3,-2.2 3,-1.5 1,-0.2 4,-0.5 0.571 79.3 88.6 -92.2 -10.4 -7.7 -26.5 26.6 7 39 A E H X> S+ 0 0 74 -3,-1.9 3,-1.7 -4,-0.4 4,-1.2 0.876 77.8 65.0 -54.5 -37.7 -10.5 -27.8 24.4 8 40 A K H 34 S+ 0 0 31 -4,-0.4 -1,-0.3 1,-0.3 3,-0.2 0.810 93.6 61.7 -56.7 -28.9 -11.1 -24.3 23.0 9 41 A N H <4 S+ 0 0 83 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.746 114.1 32.4 -69.6 -24.4 -7.6 -24.5 21.4 10 42 A Y H << S+ 0 0 163 -3,-1.7 -1,-0.2 -4,-0.5 -2,-0.2 0.428 86.8 127.3-110.5 -5.4 -8.5 -27.5 19.3 11 43 A H < - 0 0 19 -4,-1.2 -3,-0.0 -3,-0.2 310,-0.0 -0.331 39.4-166.3 -59.6 131.9 -12.1 -26.8 18.6 12 44 A Q - 0 0 116 309,-0.1 2,-0.1 -2,-0.0 -2,-0.1 -0.882 19.6-113.2-118.9 151.7 -13.1 -26.8 14.9 13 45 A P - 0 0 24 0, 0.0 2,-0.8 0, 0.0 308,-0.2 -0.435 16.5-129.5 -80.9 159.7 -16.2 -25.5 13.3 14 46 A A - 0 0 41 306,-2.2 310,-0.1 305,-0.2 309,-0.1 -0.928 38.2-136.1-105.2 100.9 -18.8 -27.8 11.6 15 47 A I - 0 0 108 -2,-0.8 2,-0.2 1,-0.1 302,-0.0 -0.352 8.2-125.1 -69.4 132.9 -19.0 -25.9 8.3 16 48 A L - 0 0 19 -2,-0.1 -1,-0.1 300,-0.1 2,-0.1 -0.536 21.7-134.1 -76.7 138.5 -22.4 -25.3 6.7 17 49 A N > - 0 0 109 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.288 36.1 -88.2 -82.0 176.1 -23.0 -26.4 3.1 18 50 A S H > S+ 0 0 44 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.884 126.4 52.3 -53.2 -45.5 -24.6 -24.3 0.4 19 51 A S H > S+ 0 0 73 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.927 111.8 46.2 -59.2 -42.9 -28.1 -25.4 1.2 20 52 A A H > S+ 0 0 24 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.897 110.3 53.5 -67.7 -37.3 -27.7 -24.5 4.9 21 53 A L H X S+ 0 0 6 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.927 108.7 49.2 -64.3 -41.6 -26.1 -21.2 4.1 22 54 A R H X S+ 0 0 118 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.921 109.4 53.6 -63.7 -37.5 -29.1 -20.3 1.9 23 55 A Q H X S+ 0 0 107 -4,-2.1 4,-1.3 -5,-0.2 -2,-0.2 0.927 109.9 46.2 -62.7 -42.5 -31.3 -21.4 4.8 24 56 A I H X S+ 0 0 8 -4,-2.5 4,-0.5 2,-0.2 3,-0.4 0.936 110.8 52.1 -66.4 -43.9 -29.6 -19.0 7.2 25 57 A A H >< S+ 0 0 4 -4,-2.6 3,-0.8 1,-0.2 -1,-0.2 0.918 114.0 44.3 -56.9 -43.2 -29.6 -16.1 4.8 26 58 A E H 3< S+ 0 0 155 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.724 106.0 63.8 -74.8 -19.0 -33.4 -16.6 4.3 27 59 A G H 3< S+ 0 0 36 -4,-1.3 2,-0.4 -3,-0.4 -1,-0.2 0.447 89.0 71.5 -88.5 -2.2 -34.0 -17.0 8.0 28 60 A T << - 0 0 11 -3,-0.8 2,-0.5 -4,-0.5 110,-0.1 -0.907 65.2-155.8-113.0 147.4 -33.0 -13.6 9.3 29 61 A S > - 0 0 33 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.926 11.5-169.0-128.3 109.7 -35.1 -10.5 8.7 30 62 A I H > S+ 0 0 18 -2,-0.5 4,-2.5 1,-0.2 -1,-0.1 0.866 92.1 51.9 -65.9 -34.5 -33.5 -7.1 8.8 31 63 A S H > S+ 0 0 73 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.886 110.0 48.9 -70.0 -35.2 -36.9 -5.3 8.7 32 64 A E H > S+ 0 0 85 2,-0.2 4,-2.8 1,-0.2 5,-0.5 0.927 113.2 47.6 -66.9 -44.5 -38.2 -7.4 11.6 33 65 A M H X>S+ 0 0 0 -4,-2.4 5,-2.7 3,-0.2 4,-2.3 0.934 110.3 54.0 -60.3 -44.5 -35.0 -6.6 13.6 34 66 A W H <>S+ 0 0 32 -4,-2.5 5,-2.5 3,-0.2 -2,-0.2 0.935 117.9 32.9 -56.2 -50.7 -35.3 -2.9 12.7 35 67 A Q H <5S+ 0 0 113 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.935 130.1 31.2 -75.4 -43.3 -38.8 -2.6 14.0 36 68 A N H <5S+ 0 0 39 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.766 131.9 20.1 -92.0 -28.0 -38.8 -5.0 16.9 37 69 A D T <5S+ 0 0 1 -4,-2.3 4,-0.2 -5,-0.5 -3,-0.2 0.761 126.0 38.2-110.8 -38.2 -35.3 -5.1 18.3 38 70 A L T >>4 - 0 0 59 64,-0.3 3,-2.2 1,-0.2 6,-0.4 -0.354 61.9 -67.6 -69.7 157.2 -26.7 6.3 29.8 47 79 A P T 3 S+ 0 0 4 0, 0.0 -1,-0.2 0, 0.0 41,-0.1 -0.158 121.4 12.2 -50.9 132.8 -26.2 4.5 33.1 48 80 A G T 3 S+ 0 0 27 1,-0.3 -2,-0.1 -3,-0.1 40,-0.1 0.278 98.9 125.4 85.9 -11.2 -28.8 5.1 35.8 49 81 A S S X> S- 0 0 9 -3,-2.2 4,-1.7 1,-0.1 3,-0.5 -0.313 76.0-113.1 -79.3 163.5 -31.2 6.9 33.3 50 82 A P H 3> S+ 0 0 113 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.869 119.9 57.6 -62.0 -32.1 -34.8 6.0 32.7 51 83 A G H 3> S+ 0 0 11 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.816 99.8 56.9 -67.7 -30.5 -33.7 4.9 29.2 52 84 A S H <> S+ 0 0 2 -3,-0.5 4,-2.5 -6,-0.4 -1,-0.2 0.947 108.6 47.0 -64.8 -45.5 -31.2 2.5 30.7 53 85 A Y H X S+ 0 0 134 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.929 113.6 48.1 -61.0 -44.8 -34.0 0.8 32.6 54 86 A A H X S+ 0 0 47 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.900 111.5 49.5 -63.9 -40.3 -36.2 0.7 29.5 55 87 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.918 110.9 50.1 -64.5 -42.8 -33.4 -0.7 27.3 56 88 A R H X S+ 0 0 37 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.919 111.6 47.8 -62.5 -42.8 -32.7 -3.4 29.9 57 89 A Q H X S+ 0 0 56 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.902 111.9 51.0 -65.3 -38.8 -36.4 -4.4 30.0 58 90 A H H X S+ 0 0 20 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.943 110.9 46.8 -62.3 -49.9 -36.6 -4.4 26.3 59 91 A I H X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.950 115.0 46.8 -60.2 -45.9 -33.6 -6.7 25.9 60 92 A M H X S+ 0 0 27 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.921 112.3 49.6 -63.7 -43.2 -34.9 -9.0 28.6 61 93 A Q H X S+ 0 0 113 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.895 108.9 52.0 -63.0 -41.3 -38.4 -9.2 27.2 62 94 A R H < S+ 0 0 36 -4,-2.5 4,-0.2 -5,-0.2 -1,-0.2 0.839 114.2 43.0 -66.2 -31.4 -37.1 -10.0 23.7 63 95 A I H >< S+ 0 0 2 -4,-1.6 3,-1.7 -5,-0.2 7,-0.2 0.925 109.7 58.0 -78.9 -40.5 -35.0 -12.8 25.0 64 96 A Q H 3< S+ 0 0 125 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.777 98.2 59.4 -58.7 -32.9 -37.8 -14.1 27.3 65 97 A R T 3< S+ 0 0 149 -4,-1.6 -1,-0.3 -5,-0.1 -2,-0.1 0.610 87.7 99.5 -74.0 -10.1 -40.3 -14.6 24.5 66 98 A L S < S- 0 0 21 -3,-1.7 4,-0.1 -4,-0.2 74,-0.1 -0.344 75.3-130.5 -78.8 158.7 -38.0 -17.0 22.7 67 99 A Q S S+ 0 0 137 73,-0.1 -1,-0.1 2,-0.1 77,-0.1 0.854 78.1 96.1 -75.3 -38.6 -38.4 -20.8 22.9 68 100 A A S S- 0 0 6 71,-0.2 2,-2.1 1,-0.2 79,-0.1 -0.154 90.8-105.0 -56.0 151.1 -34.7 -21.6 23.7 69 101 A D + 0 0 80 77,-0.2 27,-0.5 78,-0.1 -1,-0.2 -0.306 51.3 174.3 -79.3 55.7 -34.0 -22.1 27.4 70 102 A W - 0 0 26 -2,-2.1 2,-0.6 -7,-0.2 25,-0.2 -0.398 21.1-151.2 -67.2 136.4 -32.2 -18.7 28.1 71 103 A V E -A 94 0A 58 23,-2.3 23,-2.6 -2,-0.1 2,-0.4 -0.949 14.8-154.7-110.4 115.6 -31.4 -18.0 31.7 72 104 A L E +A 93 0A 37 -2,-0.6 2,-0.4 21,-0.2 21,-0.2 -0.744 14.9 178.1 -94.9 136.0 -31.3 -14.3 32.3 73 105 A E E -A 92 0A 106 19,-2.6 19,-2.8 -2,-0.4 2,-0.6 -1.000 19.9-149.0-135.7 138.5 -29.3 -12.6 35.1 74 106 A I E -A 91 0A 63 -2,-0.4 2,-0.9 17,-0.2 17,-0.2 -0.948 12.3-156.7-107.2 118.6 -29.0 -8.9 35.9 75 107 A D E -A 90 0A 8 15,-2.6 15,-2.8 -2,-0.6 2,-0.4 -0.834 18.6-176.9 -99.2 96.9 -25.6 -8.2 37.4 76 108 A T E +A 89 0A 57 -2,-0.9 2,-0.3 13,-0.3 13,-0.2 -0.823 10.8 150.5-104.0 134.7 -26.0 -5.0 39.4 77 109 A F E -A 88 0A 4 11,-2.4 11,-2.6 -2,-0.4 2,-0.3 -0.961 37.4-112.8-154.1 167.5 -23.2 -3.3 41.2 78 110 A L E +A 87 0A 12 435,-2.3 2,-0.3 -2,-0.3 9,-0.2 -0.772 29.5 174.6-106.2 151.1 -21.8 0.0 42.4 79 111 A S E -A 86 0A 27 7,-2.1 7,-2.5 -2,-0.3 2,-0.2 -0.987 34.7-109.4-150.8 152.0 -18.8 1.9 41.2 80 112 A Q + 0 0 111 -2,-0.3 5,-0.2 5,-0.2 442,-0.0 -0.528 44.1 173.6 -75.0 146.4 -17.1 5.2 41.9 81 113 A T > - 0 0 9 -2,-0.2 3,-2.2 3,-0.1 93,-0.1 -0.872 52.0 -88.3-144.4 175.1 -17.5 7.6 38.9 82 114 A P T 3 S+ 0 0 60 0, 0.0 3,-0.1 0, 0.0 92,-0.0 0.711 131.6 49.1 -62.3 -16.5 -16.6 11.3 38.2 83 115 A Y T 3 S- 0 0 132 1,-0.5 2,-0.1 0, 0.0 -3,-0.0 0.123 123.3-100.2-107.7 18.6 -20.1 12.0 39.6 84 116 A G S < S- 0 0 27 -3,-2.2 -1,-0.5 2,-0.0 -3,-0.1 -0.379 73.6 -11.5 94.1-174.9 -19.7 9.9 42.7 85 117 A Y + 0 0 127 -5,-0.2 2,-0.3 437,-0.2 -5,-0.2 -0.348 69.8 172.9 -62.8 134.0 -21.0 6.4 43.4 86 118 A R E -A 79 0A 55 -7,-2.5 -7,-2.1 -2,-0.1 2,-0.4 -0.951 28.8-117.4-139.1 161.9 -23.5 5.0 40.9 87 119 A S E -A 78 0A 25 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.797 27.3-175.1-102.8 141.8 -25.3 1.8 40.1 88 120 A F E -A 77 0A 1 -11,-2.6 -11,-2.4 -2,-0.4 2,-0.4 -0.929 10.2-154.2-132.4 155.4 -24.8 -0.2 36.9 89 121 A S E -A 76 0A 9 -2,-0.3 -13,-0.3 -13,-0.2 2,-0.2 -0.891 2.2-163.1-139.8 106.6 -26.5 -3.4 35.6 90 122 A N E -A 75 0A 0 -15,-2.8 -15,-2.6 -2,-0.4 2,-0.5 -0.549 16.8-139.9 -79.7 152.1 -25.0 -5.8 33.1 91 123 A I E -AB 74 160A 0 69,-2.5 69,-3.0 -17,-0.2 2,-0.5 -0.965 18.8-174.0-114.8 126.6 -27.4 -8.2 31.4 92 124 A I E -AB 73 159A 9 -19,-2.8 -19,-2.6 -2,-0.5 2,-0.5 -0.983 5.3-173.6-124.0 130.3 -26.3 -11.8 30.9 93 125 A S E -AB 72 158A 0 65,-2.9 65,-3.1 -2,-0.5 2,-0.4 -0.977 14.1-177.0-124.6 117.7 -28.3 -14.3 28.9 94 126 A T E -AB 71 157A 6 -23,-2.6 -23,-2.3 -2,-0.5 2,-0.5 -0.942 23.8-153.4-127.2 135.7 -27.0 -17.9 29.0 95 127 A L S S+ 0 0 3 61,-2.8 -25,-0.1 -2,-0.4 4,-0.1 -0.860 88.5 2.5 -96.4 134.8 -28.0 -21.2 27.5 96 128 A N S > S- 0 0 47 -27,-0.5 3,-1.9 -2,-0.5 -1,-0.2 0.970 71.9-164.8 55.1 66.4 -26.9 -24.2 29.6 97 129 A P T 3 S+ 0 0 63 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.763 85.7 49.2 -52.0 -33.2 -25.4 -22.4 32.6 98 130 A T T 3 S+ 0 0 99 94,-0.1 -2,-0.1 93,-0.1 -3,-0.0 0.571 80.4 113.7 -88.2 -7.3 -23.7 -25.5 33.9 99 131 A A S < S- 0 0 5 -3,-1.9 55,-0.1 1,-0.1 56,-0.1 -0.362 71.2-132.3 -58.2 142.4 -22.1 -26.4 30.5 100 132 A K S S+ 0 0 48 53,-0.2 2,-0.4 1,-0.1 54,-0.2 0.859 83.2 43.9 -68.7 -36.2 -18.4 -26.0 31.0 101 133 A R E -c 154 0A 8 52,-2.2 54,-2.3 103,-0.1 2,-0.4 -0.880 61.1-178.4-116.4 141.7 -17.7 -24.0 27.9 102 134 A H E -cd 155 204A 11 101,-2.5 103,-2.1 -2,-0.4 104,-0.7 -1.000 25.0-140.1-137.3 140.6 -19.6 -21.1 26.2 103 135 A L E -cd 156 206A 0 52,-2.6 54,-2.2 -2,-0.4 2,-0.5 -0.824 35.4-149.8 -85.1 135.3 -19.0 -19.1 23.1 104 136 A V E -cd 157 207A 0 102,-2.5 104,-3.3 -2,-0.5 2,-0.4 -0.957 18.7-170.9-122.1 124.3 -19.8 -15.6 24.2 105 137 A L E +cd 158 208A 0 52,-2.5 54,-2.2 -2,-0.5 2,-0.3 -0.904 23.1 168.1-105.1 139.1 -21.3 -12.7 22.0 106 138 A A E +cd 159 209A 0 102,-2.5 104,-2.9 -2,-0.4 2,-0.3 -0.976 19.8 161.1-150.2 162.7 -21.3 -9.3 23.6 107 139 A C E -c 160 0A 0 52,-1.6 54,-2.9 -2,-0.3 2,-0.4 -0.915 42.6 -96.7-162.1 175.4 -21.8 -5.6 23.2 108 140 A H E -c 161 0A 0 102,-0.4 24,-0.2 -2,-0.3 54,-0.2 -0.883 23.0-167.6-104.0 142.9 -22.5 -2.6 25.5 109 141 A Y + 0 0 0 52,-2.8 53,-0.2 -2,-0.4 -1,-0.1 0.535 58.6 94.2-105.7 -6.6 -26.1 -1.4 25.8 110 142 A D - 0 0 0 51,-0.9 2,-0.4 -55,-0.0 -64,-0.3 -0.411 67.0-139.0 -76.2 161.0 -25.5 2.0 27.6 111 143 A S - 0 0 0 -66,-0.8 17,-0.1 -2,-0.1 2,-0.1 -0.916 31.0 -93.0-118.1 150.8 -25.2 5.1 25.5 112 144 A K - 0 0 12 15,-0.4 2,-0.3 -2,-0.4 -66,-0.1 -0.372 43.3-111.1 -65.9 135.3 -22.7 7.8 26.1 113 145 A Y + 0 0 79 53,-0.4 2,-0.3 -2,-0.1 -1,-0.1 -0.500 46.8 158.6 -70.6 127.3 -23.9 10.6 28.4 114 146 A F - 0 0 63 -2,-0.3 8,-0.2 8,-0.1 2,-0.1 -0.984 42.1-118.6-144.0 137.2 -24.3 14.0 26.7 115 147 A S - 0 0 76 -2,-0.3 7,-0.1 1,-0.1 0, 0.0 -0.459 53.9 -84.7 -70.2 151.1 -26.4 16.9 27.8 116 148 A H - 0 0 109 -2,-0.1 2,-0.5 5,-0.1 5,-0.2 -0.357 49.2-158.0 -58.8 137.2 -29.1 17.7 25.2 117 149 A W B > -F 120 0B 147 3,-1.9 3,-1.5 1,-0.1 -1,-0.1 -0.935 65.6 -23.9-126.7 112.2 -27.7 20.0 22.6 118 150 A N T 3 S- 0 0 110 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.928 124.2 -54.9 55.8 45.2 -29.9 22.1 20.4 119 151 A N T 3 S+ 0 0 165 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.548 111.6 122.7 67.1 9.0 -32.8 19.7 21.0 120 152 A R B < -F 117 0B 89 -3,-1.5 -3,-1.9 2,-0.0 2,-0.4 -0.784 45.8-157.3-101.3 149.4 -30.8 16.7 19.8 121 153 A V - 0 0 53 -2,-0.3 2,-0.5 -5,-0.2 -5,-0.1 -0.977 19.9-119.7-125.6 138.8 -30.2 13.7 22.0 122 154 A F + 0 0 3 -2,-0.4 -77,-0.3 -8,-0.2 -8,-0.1 -0.647 35.6 165.6 -81.1 121.0 -27.3 11.1 21.6 123 155 A V - 0 0 24 -2,-0.5 -80,-0.3 174,-0.4 6,-0.2 0.375 37.4-136.3-115.0 3.0 -28.6 7.6 20.9 124 156 A G > - 0 0 0 170,-0.2 5,-2.1 1,-0.1 6,-0.3 0.896 26.6-178.3 43.3 62.5 -25.5 5.8 19.8 125 157 A A T >S+ 0 0 0 172,-2.3 5,-2.4 1,-0.2 3,-0.2 0.917 85.9 24.6 -59.1 -48.0 -27.1 4.0 16.9 126 158 A T T 5S+ 0 0 2 1,-0.2 87,-1.2 3,-0.2 86,-0.6 0.668 112.0 83.5 -87.6 -11.1 -23.9 2.1 15.8 127 159 A D T 5S- 0 0 1 85,-0.2 -15,-0.4 1,-0.2 -1,-0.2 -0.688 127.7 -54.7-130.6 77.4 -22.6 2.5 19.4 128 160 A S T >5S+ 0 0 0 -2,-0.4 4,-2.3 -3,-0.2 -1,-0.2 -0.715 118.0 94.5-133.8 47.6 -24.0 0.2 20.2 129 161 A A H > S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.921 111.4 51.1 -54.2 -40.4 -24.9 -4.5 17.9 132 164 A C H X S+ 0 0 0 -4,-2.3 4,-2.2 -24,-0.2 -2,-0.2 0.951 111.9 46.4 -58.8 -48.5 -27.6 -5.1 20.6 133 165 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.834 108.9 55.4 -64.2 -34.5 -30.2 -5.6 18.0 134 166 A M H X S+ 0 0 3 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.884 108.3 48.2 -65.0 -39.3 -27.9 -7.9 16.0 135 167 A M H X S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.923 113.4 47.5 -67.2 -40.6 -27.5 -10.2 19.1 136 168 A L H X S+ 0 0 3 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.912 112.8 48.4 -67.0 -40.5 -31.3 -10.2 19.7 137 169 A E H X S+ 0 0 0 -4,-2.6 4,-3.6 2,-0.2 5,-0.2 0.870 109.9 52.6 -67.8 -35.1 -32.0 -10.9 16.0 138 170 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.928 109.6 49.0 -64.5 -44.5 -29.4 -13.8 16.1 139 171 A A H < S+ 0 0 0 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.907 117.0 42.5 -62.9 -39.9 -31.2 -15.2 19.2 140 172 A R H >< S+ 0 0 69 -4,-2.3 3,-1.4 2,-0.2 4,-0.3 0.962 115.1 47.2 -71.5 -50.5 -34.5 -15.0 17.4 141 173 A A H 3< S+ 0 0 26 -4,-3.6 3,-0.3 1,-0.3 -2,-0.2 0.854 120.5 38.3 -61.2 -34.0 -33.4 -16.2 14.0 142 174 A L T 3X S+ 0 0 4 -4,-2.4 4,-2.9 -5,-0.2 5,-0.3 0.289 83.1 114.7 -99.3 11.4 -31.5 -19.2 15.4 143 175 A D H <> S+ 0 0 14 -3,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.877 74.4 49.5 -52.0 -47.6 -34.1 -20.0 18.1 144 176 A K H > S+ 0 0 180 -4,-0.3 4,-0.8 -3,-0.3 -1,-0.2 0.927 115.6 43.9 -60.2 -43.5 -35.2 -23.3 16.8 145 177 A K H >4 S+ 0 0 64 -3,-0.2 3,-0.7 1,-0.2 4,-0.3 0.898 113.6 50.2 -67.3 -39.6 -31.6 -24.5 16.5 146 178 A L H >< S+ 0 0 2 -4,-2.9 3,-1.9 1,-0.2 4,-0.3 0.844 99.9 65.4 -67.6 -32.3 -30.6 -23.1 19.9 147 179 A L H >< S+ 0 0 56 -4,-2.4 3,-1.7 -5,-0.3 -1,-0.2 0.825 90.8 66.8 -58.3 -30.7 -33.6 -24.9 21.4 148 180 A S T << S+ 0 0 84 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.681 86.6 68.1 -66.3 -16.8 -31.9 -28.2 20.5 149 181 A L T < 0 0 38 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.622 360.0 360.0 -76.1 -12.4 -29.1 -27.4 23.0 150 182 A K < 0 0 161 -3,-1.7 -1,-0.2 -4,-0.3 -2,-0.2 0.972 360.0 360.0 -65.4 360.0 -31.6 -27.9 25.9 151 ! 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 0 145 0, 0.0 2,-2.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 75.3 -19.0 -31.0 23.1 153 190 A D + 0 0 64 -51,-0.0 -52,-2.2 -54,-0.0 2,-0.4 -0.403 360.0 126.2 -77.6 66.5 -20.1 -29.5 26.5 154 191 A L E + c 0 101A 13 -2,-2.6 -52,-0.2 -54,-0.2 2,-0.2 -0.984 28.4 155.9-134.6 131.0 -20.4 -26.2 24.8 155 192 A S E - 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0 0 5 1,-0.1 -53,-0.4 2,-0.1 4,-0.2 -0.503 15.8-137.7 -72.5 148.5 -16.8 7.2 30.1 167 204 A F S S+ 0 0 13 2,-0.2 -1,-0.1 -2,-0.1 3,-0.1 0.808 98.3 11.9 -74.9 -31.5 -19.1 9.7 31.8 168 205 A L S S- 0 0 89 1,-0.3 2,-0.3 6,-0.1 -2,-0.1 0.332 130.8 -38.3-108.1-120.0 -16.5 12.4 30.8 169 206 A H S S- 0 0 155 1,-0.1 -1,-0.3 -4,-0.1 -2,-0.2 -0.858 85.7 -73.1-107.0 151.8 -13.8 11.6 28.3 170 207 A W + 0 0 131 -2,-0.3 5,-0.2 -4,-0.2 -1,-0.1 -0.035 63.3 151.2 -44.7 137.9 -12.1 8.2 28.4 171 208 A S - 0 0 33 3,-1.2 3,-0.3 -3,-0.0 -3,-0.1 -0.944 57.5 -98.0-158.2 162.7 -9.7 7.5 31.2 172 209 A P S S+ 0 0 78 0, 0.0 3,-0.2 0, 0.0 -2,-0.1 0.792 123.4 36.4 -57.1 -34.2 -8.7 4.3 33.0 173 210 A Q S S+ 0 0 141 1,-0.2 2,-0.6 -3,-0.0 -3,-0.1 0.603 113.7 60.1 -95.6 -15.2 -11.1 4.8 36.0 174 211 A D S S+ 0 0 6 -3,-0.3 -3,-1.2 -5,-0.1 2,-0.2 -0.768 99.5 43.4-118.1 84.8 -13.9 6.4 33.9 175 212 A S S S+ 0 0 4 -2,-0.6 -10,-0.2 -3,-0.2 -11,-0.2 -0.788 89.3 42.4 161.2 164.9 -14.9 3.7 31.3 176 213 A L > + 0 0 6 -12,-2.4 4,-2.4 -2,-0.2 5,-0.4 0.792 60.5 155.8 48.0 38.7 -15.6 0.0 31.1 177 214 A Y H > S+ 0 0 2 -14,-2.5 4,-1.8 -12,-0.2 -14,-0.2 0.945 70.5 40.9 -59.4 -50.3 -17.5 -0.1 34.3 178 215 A G H > S+ 0 0 0 -16,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.893 117.9 45.3 -67.8 -42.4 -19.6 -3.2 33.5 179 216 A S H > S+ 0 0 0 -17,-0.3 4,-2.8 2,-0.2 5,-0.3 0.892 111.0 51.4 -72.4 -37.8 -16.9 -5.2 31.9 180 217 A R H X S+ 0 0 85 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.942 115.6 44.8 -64.1 -41.1 -14.2 -4.5 34.5 181 218 A H H X S+ 0 0 40 -4,-1.8 4,-2.2 -5,-0.4 -2,-0.2 0.945 116.2 43.6 -66.9 -48.1 -16.7 -5.6 37.1 182 219 A L H X S+ 0 0 8 -4,-2.7 4,-3.1 2,-0.2 5,-0.3 0.879 111.1 53.7 -68.3 -37.2 -18.0 -8.7 35.3 183 220 A A H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.927 111.9 46.3 -61.2 -42.2 -14.5 -9.9 34.2 184 221 A A H X S+ 0 0 38 -4,-1.7 4,-1.0 -5,-0.3 -2,-0.2 0.910 113.3 49.2 -66.5 -41.2 -13.4 -9.7 37.8 185 222 A K H < S+ 0 0 91 -4,-2.2 3,-0.5 1,-0.2 -2,-0.2 0.930 113.5 45.3 -64.1 -45.4 -16.5 -11.5 39.0 186 223 A M H >< S+ 0 0 10 -4,-3.1 3,-1.4 1,-0.2 14,-1.3 0.881 108.6 56.8 -66.8 -36.4 -16.2 -14.3 36.4 187 224 A A H 3< S+ 0 0 32 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.760 112.2 43.1 -65.2 -26.3 -12.5 -14.7 37.2 188 225 A S T 3< S+ 0 0 31 -4,-1.0 215,-2.3 -3,-0.5 -1,-0.3 0.228 95.6 91.2-106.0 15.5 -13.4 -15.3 40.8 189 226 A T S < S- 0 0 36 -3,-1.4 11,-1.7 213,-0.2 12,-0.2 -0.929 77.2-125.6-113.0 116.2 -16.3 -17.6 40.3 190 227 A P B -G 199 0C 13 0, 0.0 9,-0.3 0, 0.0 4,-0.1 -0.311 32.2-131.9 -59.2 143.1 -15.6 -21.4 40.1 191 228 A H S S+ 0 0 14 7,-2.2 6,-0.1 2,-0.1 7,-0.1 -0.981 80.1 27.2-152.6 134.5 -16.9 -23.1 37.0 192 229 A P S > S- 0 0 31 0, 0.0 3,-2.4 0, 0.0 6,-0.2 0.674 113.9 -85.2 -71.4 171.6 -18.5 -25.5 36.5 193 230 A P T 3 S+ 0 0 95 0, 0.0 -2,-0.1 0, 0.0 -4,-0.0 -0.185 117.7 19.6 -44.8 130.6 -20.3 -25.5 39.9 194 231 A G T 3 S+ 0 0 76 1,-0.3 218,-0.1 -4,-0.1 -3,-0.1 0.346 87.2 151.5 88.2 -5.4 -18.1 -27.2 42.5 195 232 A A < - 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