==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/TOXIN 11-JUL-01 1JK7 . COMPND 2 MOLECULE: SERINE/THREONINE PROTEIN PHOSPHATASE PP1-GAMMA . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.T.MAYNES,K.S.BATEMAN,M.M.CHERNEY,A.K.DAS,M.N.JAMES . 294 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13165.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 197 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 26 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 16 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 27.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 0 1 1 1 1 2 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 4 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 PARALLEL BRIDGES PER LADDER . 0 0 1 3 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 6 A K 0 0 267 0, 0.0 2,-0.3 0, 0.0 31,-0.0 0.000 360.0 360.0 360.0 -55.5 56.6 28.5 15.7 2 7 A L - 0 0 46 30,-0.1 2,-1.3 1,-0.1 3,-0.2 -0.627 360.0-140.4 -82.5 131.3 57.7 32.0 16.7 3 8 A N > + 0 0 90 -2,-0.3 4,-1.9 1,-0.2 3,-0.3 -0.680 28.0 171.9 -92.0 83.9 55.1 34.7 17.1 4 9 A I H > S+ 0 0 21 -2,-1.3 4,-2.6 1,-0.2 5,-0.2 0.870 73.6 54.9 -61.0 -41.0 56.9 37.6 15.5 5 10 A D H > S+ 0 0 95 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.851 109.8 47.2 -64.2 -33.8 53.9 40.0 15.6 6 11 A S H > S+ 0 0 40 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.880 111.5 51.1 -73.3 -39.8 53.4 39.5 19.3 7 12 A I H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.954 113.4 44.0 -61.2 -51.3 57.1 40.0 20.0 8 13 A I H X S+ 0 0 17 -4,-2.6 4,-3.1 1,-0.2 5,-0.3 0.916 111.7 55.0 -60.0 -43.6 57.2 43.3 18.0 9 14 A Q H X S+ 0 0 106 -4,-2.0 4,-1.3 -5,-0.2 -1,-0.2 0.920 111.1 43.9 -57.0 -47.0 53.9 44.3 19.7 10 15 A R H < S+ 0 0 58 -4,-2.5 4,-0.4 2,-0.2 -1,-0.2 0.879 114.1 50.2 -67.9 -37.1 55.4 43.9 23.1 11 16 A L H >< S+ 0 0 0 -4,-2.5 3,-0.7 1,-0.2 -2,-0.2 0.910 116.4 40.8 -67.1 -41.7 58.7 45.6 22.1 12 17 A L H >< S+ 0 0 21 -4,-3.1 3,-2.5 1,-0.2 -1,-0.2 0.665 92.8 87.0 -80.2 -16.6 56.9 48.6 20.7 13 18 A E T 3< S+ 0 0 125 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.735 80.2 64.7 -54.8 -23.2 54.4 48.6 23.5 14 19 A V T X + 0 0 5 -3,-0.7 3,-1.6 -4,-0.4 2,-0.3 0.380 67.8 122.7 -85.0 5.6 56.8 50.8 25.5 15 20 A R T < S+ 0 0 112 -3,-2.5 3,-0.1 1,-0.3 -3,-0.0 -0.539 84.8 17.3 -65.3 127.4 56.6 53.7 23.0 16 21 A G T 3 S+ 0 0 85 1,-0.4 -1,-0.3 -2,-0.3 -2,-0.1 0.110 99.6 117.7 97.0 -24.2 55.5 56.6 25.3 17 22 A S S < S- 0 0 35 -3,-1.6 -1,-0.4 1,-0.2 3,-0.1 -0.237 85.6 -74.2 -69.1 167.6 56.5 54.8 28.5 18 23 A K > - 0 0 175 1,-0.1 3,-1.7 -3,-0.1 -1,-0.2 -0.494 63.8 -97.4 -67.0 125.9 59.2 56.5 30.6 19 24 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.054 109.9 37.1 -43.3 138.8 62.5 55.9 28.8 20 25 A G T 3 S+ 0 0 27 1,-0.3 2,-0.2 -3,-0.1 -2,-0.1 0.240 77.0 141.7 99.9 -13.6 64.5 53.0 30.3 21 26 A K < - 0 0 123 -3,-1.7 -1,-0.3 -7,-0.1 2,-0.1 -0.452 48.0-128.0 -64.6 130.2 61.4 50.8 30.9 22 27 A N - 0 0 85 -2,-0.2 2,-0.5 -3,-0.1 -1,-0.1 -0.370 13.5-152.4 -82.2 158.4 62.3 47.2 30.1 23 28 A V - 0 0 15 -2,-0.1 2,-0.9 2,-0.0 -12,-0.1 -0.982 14.9-160.2-127.1 111.9 60.6 44.7 27.8 24 29 A Q - 0 0 103 -2,-0.5 3,-0.1 -14,-0.1 -2,-0.0 -0.772 9.8-171.1-102.5 91.9 61.3 41.2 29.1 25 30 A L - 0 0 5 -2,-0.9 2,-0.2 1,-0.1 -2,-0.0 -0.253 34.6 -91.8 -71.9 166.4 60.7 38.7 26.3 26 31 A Q > - 0 0 110 1,-0.1 4,-2.0 4,-0.0 3,-0.5 -0.537 31.1-119.0 -80.0 148.3 60.8 35.0 27.1 27 32 A E H > S+ 0 0 85 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.900 114.4 54.9 -52.6 -44.0 64.1 33.2 26.6 28 33 A N H > S+ 0 0 100 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.865 106.4 51.4 -60.0 -37.2 62.6 30.9 24.0 29 34 A E H > S+ 0 0 17 -3,-0.5 4,-2.0 2,-0.2 -1,-0.2 0.921 111.0 46.2 -67.9 -44.5 61.5 33.9 21.9 30 35 A I H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.943 112.0 51.0 -63.6 -46.4 64.9 35.6 22.0 31 36 A R H X S+ 0 0 100 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.899 110.3 51.5 -56.8 -39.4 66.6 32.3 21.1 32 37 A G H X S+ 0 0 19 -4,-2.0 4,-2.6 -5,-0.2 5,-0.3 0.862 105.2 53.9 -65.9 -37.6 64.1 32.0 18.2 33 38 A L H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 5,-0.3 0.919 112.0 46.6 -62.9 -41.2 64.9 35.5 16.9 34 39 A C H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.957 115.4 43.1 -64.4 -53.4 68.6 34.6 16.8 35 40 A L H X S+ 0 0 86 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.890 117.7 45.4 -62.1 -42.6 68.1 31.2 15.1 36 41 A K H X S+ 0 0 81 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.930 115.1 45.5 -69.3 -46.1 65.6 32.5 12.6 37 42 A S H X S+ 0 0 0 -4,-2.2 4,-3.2 -5,-0.3 5,-0.2 0.908 108.9 58.2 -63.6 -39.2 67.5 35.7 11.7 38 43 A R H X S+ 0 0 75 -4,-2.5 4,-2.5 -5,-0.3 -1,-0.2 0.919 104.9 50.6 -53.6 -47.2 70.7 33.6 11.4 39 44 A E H X S+ 0 0 122 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.912 112.2 47.3 -57.2 -46.1 69.0 31.5 8.8 40 45 A I H X S+ 0 0 12 -4,-1.8 4,-1.3 2,-0.2 3,-0.2 0.922 109.8 51.5 -64.3 -46.4 68.0 34.6 6.9 41 46 A F H >< S+ 0 0 2 -4,-3.2 3,-0.7 1,-0.2 -2,-0.2 0.936 111.5 47.9 -57.5 -47.1 71.4 36.2 7.1 42 47 A L H 3< S+ 0 0 66 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.784 108.2 56.0 -64.7 -27.4 73.0 33.1 5.7 43 48 A S H 3< S+ 0 0 91 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.731 104.1 62.3 -77.5 -23.8 70.5 32.9 2.9 44 49 A Q S << S- 0 0 21 -4,-1.3 4,-0.1 -3,-0.7 0, 0.0 -0.641 100.9 -83.8-100.6 161.1 71.3 36.4 1.7 45 50 A P - 0 0 83 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 -0.168 23.4-132.7 -60.1 154.6 74.6 37.6 0.3 46 51 A I S S+ 0 0 8 1,-0.3 110,-2.0 136,-0.2 111,-1.7 0.677 107.2 51.0 -80.1 -18.5 77.4 38.7 2.6 47 52 A L E S-a 157 0A 1 109,-0.2 -1,-0.3 108,-0.2 111,-0.3 -0.914 92.5-149.2-119.6 98.1 77.7 41.8 0.3 48 53 A L E -a 158 0A 5 109,-2.8 111,-2.7 -2,-0.6 2,-0.6 -0.388 9.2-154.3 -72.9 143.9 74.2 43.2 -0.0 49 54 A E E +a 159 0A 132 109,-0.2 2,-0.2 -2,-0.1 111,-0.2 -0.934 28.3 172.3-120.4 103.0 73.0 44.9 -3.1 50 55 A L E -a 160 0A 17 109,-1.9 111,-3.1 -2,-0.6 2,-0.4 -0.653 22.5-141.7-110.9 166.8 70.2 47.3 -2.2 51 56 A E - 0 0 153 109,-0.2 231,-0.1 -2,-0.2 109,-0.1 -0.969 31.5 -84.8-130.5 144.0 68.2 50.0 -3.9 52 57 A A S S+ 0 0 16 -2,-0.4 229,-0.2 229,-0.1 2,-0.1 -0.319 87.5 83.7 -71.6 163.9 66.9 53.4 -2.6 53 58 A P S S+ 0 0 54 0, 0.0 2,-0.3 0, 0.0 228,-0.2 0.497 76.9 143.2 -66.2 144.4 64.6 54.7 -1.1 54 59 A L E -F 280 0B 7 226,-1.7 226,-3.0 -2,-0.1 2,-0.5 -0.992 47.2-141.3-158.0 148.7 66.4 53.7 2.0 55 60 A K E -Fg 279 82B 32 26,-2.1 28,-2.2 -2,-0.3 2,-0.5 -0.959 22.3-159.6-111.8 128.8 67.2 55.0 5.5 56 61 A I E -Fg 278 83B 0 222,-2.9 222,-2.7 -2,-0.5 2,-0.3 -0.946 8.4-171.2-115.6 130.8 70.7 54.3 6.8 57 62 A C E -Fg 277 84B 0 26,-2.2 28,-2.0 -2,-0.5 220,-0.1 -0.887 7.5-152.4-121.9 152.3 71.6 54.3 10.5 58 63 A G - 0 0 0 218,-0.7 204,-0.3 -2,-0.3 28,-0.2 -0.135 56.4 -15.5-101.4-159.7 74.9 54.2 12.4 59 64 A D B +j 262 0C 2 202,-0.7 204,-1.1 1,-0.1 -1,-0.3 -0.005 47.7 174.1 -43.2 134.7 75.8 52.9 15.9 60 65 A I > - 0 0 1 27,-2.3 3,-1.7 26,-0.3 28,-0.2 0.676 13.2-168.5-113.1 -36.6 72.9 52.4 18.3 61 66 A H T 3 - 0 0 2 26,-2.9 31,-0.8 1,-0.3 28,-0.3 0.871 69.1 -55.0 43.6 55.3 74.8 50.8 21.2 62 67 A G T 3 S+ 0 0 1 26,-2.4 32,-2.0 1,-0.2 2,-1.9 0.567 92.3 139.3 62.8 11.8 71.8 49.6 23.2 63 68 A Q X> + 0 0 25 -3,-1.7 4,-1.6 1,-0.2 3,-0.9 -0.562 26.1 174.8 -87.5 74.4 70.1 53.0 23.4 64 69 A Y H 3> S+ 0 0 0 -2,-1.9 4,-2.2 1,-0.3 -1,-0.2 0.813 70.4 51.6 -51.9 -43.9 66.7 51.5 22.8 65 70 A Y H 3> S+ 0 0 32 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.805 109.4 52.0 -69.8 -24.2 64.5 54.6 23.2 66 71 A D H <> S+ 0 0 30 -3,-0.9 4,-2.1 2,-0.2 -1,-0.2 0.831 106.6 53.4 -77.1 -31.6 66.7 56.4 20.7 67 72 A L H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.922 108.9 50.0 -65.6 -41.8 66.2 53.5 18.3 68 73 A L H X S+ 0 0 9 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.908 108.2 52.3 -62.2 -41.2 62.5 54.0 18.8 69 74 A R H X S+ 0 0 57 -4,-1.9 4,-2.6 1,-0.2 5,-0.2 0.894 105.4 55.8 -61.7 -39.4 62.9 57.8 18.1 70 75 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.3 0.920 111.3 42.6 -58.1 -45.8 64.7 56.9 14.9 71 76 A F H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.843 111.9 55.2 -69.0 -34.5 61.8 54.8 13.7 72 77 A E H < S+ 0 0 140 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.896 117.0 36.6 -64.2 -39.7 59.4 57.5 14.9 73 78 A Y H < S+ 0 0 130 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.801 127.5 34.7 -84.9 -31.0 61.2 60.1 12.8 74 79 A G H < S- 0 0 6 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.643 119.9 -94.7 -98.4 -16.8 62.0 57.9 9.8 75 80 A G < - 0 0 4 -4,-2.5 5,-0.4 -5,-0.3 -3,-0.2 0.338 37.2 -93.9 106.0 123.1 58.9 55.7 9.8 76 81 A F > - 0 0 38 -4,-0.1 3,-2.5 3,-0.1 4,-0.1 -0.399 68.1 -56.2 -68.6 139.8 58.3 52.3 11.4 77 82 A P T 3 S+ 0 0 13 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.220 123.8 22.7 -52.8 144.1 58.9 49.3 9.1 78 83 A P T 3 S+ 0 0 70 0, 0.0 -2,-0.1 0, 0.0 3,-0.1 -0.884 109.2 76.8 -94.1 25.0 57.7 48.6 6.6 79 84 A E S < S+ 0 0 153 -3,-2.5 2,-0.3 1,-0.1 -3,-0.1 0.857 112.5 16.1 -57.8 -36.7 56.9 52.3 6.0 80 85 A S S S- 0 0 24 -5,-0.4 2,-0.3 -4,-0.1 -1,-0.1 -0.967 83.8-115.7-137.2 151.3 60.5 52.9 5.1 81 86 A N - 0 0 47 -2,-0.3 -26,-2.1 -28,-0.2 2,-0.3 -0.649 36.0-156.7 -85.8 145.2 63.4 50.5 4.1 82 87 A Y E -gh 55 113B 0 30,-1.7 32,-2.3 -2,-0.3 2,-0.4 -0.942 23.1-176.3-130.8 151.1 66.3 50.4 6.5 83 88 A L E -gh 56 114B 0 -28,-2.2 -26,-2.2 -2,-0.3 2,-0.3 -0.959 13.4-165.6-140.2 115.6 70.0 49.5 6.6 84 89 A F E -gh 57 115B 0 30,-2.2 32,-1.8 -2,-0.4 -26,-0.2 -0.813 13.9-146.8-101.8 147.9 71.9 49.6 9.9 85 90 A L - 0 0 0 -28,-2.0 157,-0.2 -2,-0.3 2,-0.2 0.306 48.5 -96.9 -99.7 9.3 75.7 49.6 9.9 86 91 A G S S+ 0 0 0 -28,-0.2 -26,-0.3 -29,-0.1 -1,-0.3 -0.535 81.2 105.9 110.8-177.4 76.3 47.7 13.1 87 92 A D + 0 0 3 -28,-0.2 -26,-2.9 -2,-0.2 -27,-2.3 0.959 36.7 153.8 59.0 60.1 77.1 48.3 16.8 88 93 A Y + 0 0 0 -28,-0.2 -26,-2.4 -29,-0.2 2,-0.2 0.707 56.9 45.8 -85.7 -26.3 73.7 47.4 18.1 89 94 A V S S+ 0 0 0 -28,-0.3 -28,-0.2 -27,-0.1 -29,-0.1 -0.617 77.8 51.2-117.9 176.6 74.9 46.4 21.6 90 95 A D S S+ 0 0 0 -2,-0.2 2,-2.8 2,-0.1 40,-0.2 0.250 89.2 38.4 79.1 155.7 77.3 47.4 24.4 91 96 A R S S+ 0 0 106 38,-2.7 -29,-0.1 1,-0.1 -1,-0.1 -0.253 97.4 86.0 70.7 -54.5 77.6 50.8 26.3 92 97 A G S S- 0 0 17 -2,-2.8 3,-0.3 -31,-0.8 -29,-0.2 -0.106 83.5-119.5 -70.9 174.7 73.9 51.5 26.4 93 98 A K S S+ 0 0 165 -31,-0.2 3,-0.2 1,-0.2 -30,-0.1 0.589 102.4 43.4 -91.3 -15.4 71.4 50.2 29.0 94 99 A Q > + 0 0 8 -32,-2.0 4,-2.0 -33,-0.2 -1,-0.2 -0.366 54.9 141.7-132.8 60.9 69.2 48.2 26.7 95 100 A S H > S+ 0 0 0 -3,-0.3 4,-3.1 1,-0.2 5,-0.3 0.896 76.5 58.7 -63.1 -39.4 71.1 46.2 24.2 96 101 A L H > S+ 0 0 3 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.951 108.3 41.0 -57.3 -54.3 68.6 43.4 24.5 97 102 A E H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.921 116.7 53.1 -60.1 -41.7 65.5 45.4 23.5 98 103 A T H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.971 113.2 38.9 -57.6 -60.0 67.6 47.0 20.8 99 104 A I H X S+ 0 0 1 -4,-3.1 4,-2.8 1,-0.2 5,-0.2 0.853 114.9 54.2 -63.7 -35.0 68.9 43.9 19.1 100 105 A C H X S+ 0 0 2 -4,-2.4 4,-2.7 -5,-0.3 -1,-0.2 0.915 108.8 47.4 -66.7 -41.4 65.6 42.0 19.5 101 106 A L H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.922 114.6 47.8 -65.4 -41.3 63.6 44.7 17.8 102 107 A L H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.2 -2,-0.2 0.937 114.4 44.6 -64.6 -46.9 66.1 44.8 15.0 103 108 A L H X S+ 0 0 1 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.897 110.9 56.1 -64.3 -37.8 66.2 41.0 14.6 104 109 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 -5,-0.2 -1,-0.2 0.914 109.3 45.2 -59.9 -44.0 62.4 40.9 14.8 105 110 A Y H X S+ 0 0 5 -4,-2.2 4,-3.2 2,-0.2 -1,-0.2 0.842 108.5 56.9 -69.5 -32.9 62.1 43.4 11.9 106 111 A K H < S+ 0 0 2 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.908 112.6 41.7 -62.7 -41.7 64.7 41.5 9.9 107 112 A I H < S+ 0 0 21 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.888 118.1 46.6 -71.6 -40.5 62.6 38.3 10.2 108 113 A K H < S+ 0 0 75 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.851 130.6 20.0 -70.9 -37.9 59.4 40.2 9.6 109 114 A Y S >X S+ 0 0 55 -4,-3.2 3,-1.8 -5,-0.1 4,-1.0 -0.480 70.3 164.4-133.5 64.1 60.6 42.2 6.5 110 115 A P T 34 S+ 0 0 41 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.704 79.7 44.8 -53.2 -26.6 63.7 40.3 5.2 111 116 A E T 34 S+ 0 0 131 1,-0.1 3,-0.1 3,-0.0 -5,-0.1 0.466 120.9 37.0 -99.9 -2.9 63.7 42.1 1.9 112 117 A N T <4 S+ 0 0 65 -3,-1.8 -30,-1.7 -7,-0.2 2,-0.4 0.268 110.2 60.6-129.8 7.4 63.1 45.7 3.3 113 118 A F E < +h 82 0B 0 -4,-1.0 2,-0.3 -32,-0.2 -30,-0.2 -0.982 61.3 178.7-141.0 124.7 65.2 45.6 6.5 114 119 A F E -h 83 0B 13 -32,-2.3 -30,-2.2 -2,-0.4 2,-0.4 -0.970 12.1-166.5-134.5 147.9 68.9 45.0 6.6 115 120 A L E -h 84 0B 1 -2,-0.3 2,-0.2 -32,-0.2 -30,-0.2 -0.996 7.3-158.8-132.7 129.8 71.6 44.8 9.3 116 121 A L - 0 0 0 -32,-1.8 2,-0.4 -2,-0.4 40,-0.2 -0.634 29.9-101.2-101.0 164.9 75.4 44.8 8.9 117 122 A R - 0 0 1 38,-2.0 51,-0.4 -2,-0.2 2,-0.2 -0.689 35.0-167.8 -88.2 134.8 78.0 43.6 11.4 118 123 A G > - 0 0 0 -2,-0.4 3,-1.4 50,-0.1 -32,-0.1 -0.591 41.1 -98.9-109.5 177.0 79.9 46.1 13.5 119 124 A N T 3 S+ 0 0 3 81,-0.5 3,-0.4 1,-0.3 6,-0.2 0.721 123.3 62.0 -71.3 -16.9 82.9 45.4 15.7 120 125 A H T 3 S+ 0 0 18 1,-0.2 -1,-0.3 5,-0.1 6,-0.2 0.540 85.6 73.5 -83.7 -6.3 80.6 45.2 18.6 121 126 A E S < S+ 0 0 0 -3,-1.4 2,-0.4 30,-0.1 -1,-0.2 -0.209 80.9 97.9 -95.9 41.5 78.9 42.2 17.1 122 127 A C S >> S- 0 0 7 -3,-0.4 4,-2.5 1,-0.1 3,-1.2 -0.999 77.7-132.8-129.8 129.9 82.0 40.2 18.0 123 128 A A H 3> S+ 0 0 28 -2,-0.4 4,-1.1 1,-0.3 5,-0.2 0.874 104.2 56.7 -49.2 -48.4 82.2 38.1 21.1 124 129 A S H 34 S+ 0 0 86 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.808 115.8 38.6 -57.7 -29.6 85.5 39.4 22.3 125 130 A I H X> S+ 0 0 20 -3,-1.2 4,-1.9 -6,-0.2 3,-1.1 0.929 116.0 45.0 -87.6 -53.0 84.1 42.9 22.3 126 131 A N H 3< S+ 0 0 0 -4,-2.5 6,-2.3 1,-0.3 7,-0.2 0.527 104.2 68.3 -73.2 -0.0 80.6 42.6 23.5 127 132 A R T 3< S+ 0 0 120 -4,-1.1 -1,-0.3 -5,-0.3 6,-0.2 0.843 111.8 29.8 -81.1 -33.5 81.9 40.4 26.3 128 133 A I T <4 S+ 0 0 107 -3,-1.1 -2,-0.2 -4,-0.4 -3,-0.1 0.743 114.2 56.4 -97.2 -30.2 83.7 43.3 27.9 129 134 A Y S < S- 0 0 92 -4,-1.9 -38,-2.7 -9,-0.1 -1,-0.1 0.203 120.1 -73.3 -97.3 18.7 81.6 46.4 27.0 130 135 A G S > S+ 0 0 19 -40,-0.2 4,-2.4 -4,-0.2 5,-0.2 -0.108 105.9 90.1 130.1 -44.6 78.2 45.6 28.4 131 136 A F H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.906 93.3 48.4 -57.4 -46.4 76.2 43.1 26.4 132 137 A Y H > S+ 0 0 57 -6,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.953 113.2 49.0 -58.2 -49.2 77.5 40.0 28.3 133 138 A D H > S+ 0 0 91 -7,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.863 110.3 50.6 -59.0 -38.5 76.8 41.8 31.6 134 139 A E H X S+ 0 0 7 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.919 113.2 45.6 -67.1 -41.6 73.2 42.7 30.4 135 140 A C H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.905 111.4 52.8 -66.0 -42.5 72.6 39.1 29.4 136 141 A K H < S+ 0 0 129 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.878 115.3 41.2 -60.9 -40.2 74.1 37.7 32.6 137 142 A R H < S+ 0 0 161 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.922 127.0 28.7 -76.0 -45.9 71.8 40.0 34.7 138 143 A R H < S- 0 0 29 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.733 139.1 -11.2 -90.5 -26.1 68.5 39.6 32.7 139 144 A Y S < S- 0 0 37 -4,-2.7 2,-0.3 -5,-0.3 -4,-0.1 0.014 93.5 -76.6-136.4-112.9 68.8 36.2 31.2 140 145 A N > - 0 0 49 -2,-0.1 4,-1.2 1,-0.1 3,-0.4 -0.969 30.4-101.6-157.8 169.2 72.0 34.0 31.1 141 146 A I H > S+ 0 0 40 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.791 114.4 64.1 -67.7 -30.4 75.3 33.5 29.4 142 147 A K H > S+ 0 0 149 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.898 103.8 48.7 -60.4 -38.2 74.1 30.6 27.3 143 148 A L H > S+ 0 0 3 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.862 107.6 54.6 -69.1 -35.8 71.7 33.1 25.6 144 149 A W H X S+ 0 0 5 -4,-1.2 4,-2.0 1,-0.2 -2,-0.2 0.907 107.3 50.5 -63.3 -40.7 74.7 35.5 25.1 145 150 A K H X S+ 0 0 114 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.863 106.3 55.6 -65.4 -34.0 76.5 32.7 23.3 146 151 A T H X S+ 0 0 12 -4,-1.6 4,-1.3 1,-0.2 -1,-0.2 0.894 106.0 50.9 -64.9 -38.9 73.4 32.2 21.2 147 152 A F H X S+ 0 0 0 -4,-1.9 4,-3.2 1,-0.2 3,-0.3 0.912 105.9 56.6 -63.2 -42.0 73.6 35.8 20.2 148 153 A T H X S+ 0 0 16 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.901 104.5 51.0 -56.6 -43.2 77.2 35.4 19.3 149 154 A D H < S+ 0 0 91 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.831 112.2 48.2 -64.9 -31.2 76.4 32.6 16.9 150 155 A C H >< S+ 0 0 0 -4,-1.3 3,-2.1 -3,-0.3 4,-0.3 0.955 110.3 50.3 -71.5 -51.5 73.8 34.9 15.3 151 156 A F H >< S+ 0 0 1 -4,-3.2 3,-1.5 1,-0.3 -2,-0.2 0.827 99.3 66.3 -56.1 -34.9 76.2 37.8 15.0 152 157 A N T 3< S+ 0 0 18 -4,-2.1 36,-1.5 1,-0.3 -1,-0.3 0.630 102.4 49.4 -64.4 -10.9 78.9 35.6 13.4 153 158 A C T < S+ 0 0 0 -3,-2.1 -1,-0.3 34,-0.2 -2,-0.2 0.424 80.7 121.2-107.6 -1.0 76.5 35.3 10.4 154 159 A L < - 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0 0 0 28,-0.8 -1,-0.2 29,-0.2 32,-0.2 -0.937 47.2 -20.3-179.4-156.7 86.3 51.2 6.5 171 176 A L - 0 0 4 -2,-0.3 49,-0.2 30,-0.1 31,-0.1 -0.096 44.6-146.4 -73.4 172.1 88.8 50.1 3.8 172 177 A S > - 0 0 4 3,-0.1 3,-1.3 47,-0.1 23,-0.1 -0.989 23.5-128.2-140.3 144.6 91.6 47.6 4.0 173 178 A P T 3 S+ 0 0 55 0, 0.0 -1,-0.1 0, 0.0 22,-0.0 0.681 114.4 55.2 -68.5 -8.9 95.0 47.5 2.3 174 179 A D T 3 S+ 0 0 80 2,-0.0 2,-0.9 21,-0.0 21,-0.1 0.580 81.4 103.0 -93.9 -14.0 94.0 44.0 1.3 175 180 A L < + 0 0 19 -3,-1.3 -3,-0.1 1,-0.2 3,-0.1 -0.621 29.5 141.8 -78.8 104.7 90.7 45.1 -0.4 176 181 A Q + 0 0 123 -2,-0.9 2,-0.3 1,-0.3 -1,-0.2 0.666 67.5 15.7-111.7 -30.8 91.3 45.0 -4.2 177 182 A S >> - 0 0 39 1,-0.1 3,-1.1 57,-0.0 4,-0.5 -0.986 67.2-120.5-146.0 156.9 87.9 43.7 -5.4 178 183 A M H >> S+ 0 0 17 -2,-0.3 4,-2.1 1,-0.3 3,-1.1 0.798 108.8 70.4 -64.4 -29.4 84.4 43.2 -4.2 179 184 A E H 3> S+ 0 0 92 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.817 88.4 63.3 -58.8 -30.3 84.8 39.5 -4.9 180 185 A Q H <4 S+ 0 0 43 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.854 106.9 43.7 -62.8 -34.1 87.1 39.3 -2.0 181 186 A I H X< S+ 0 0 0 -3,-1.1 3,-1.9 -4,-0.5 -2,-0.2 0.921 110.2 53.8 -76.6 -44.7 84.3 40.3 0.2 182 187 A R H 3< S+ 0 0 88 -4,-2.1 -136,-0.2 1,-0.3 -2,-0.2 0.833 104.8 57.4 -58.4 -32.2 81.7 38.0 -1.4 183 188 A R T 3< S+ 0 0 161 -4,-2.0 2,-0.3 -5,-0.2 -1,-0.3 0.484 76.5 117.0 -79.5 -2.9 84.1 35.1 -0.8 184 189 A I < - 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