==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-MAY-10 3N8I . COMPND 2 MOLECULE: LOW MOLECULAR WEIGHT PHOSPHOTYROSINE PROTEIN PHOS . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.T.HOMAN,D.BALASUBRAMANIAM,C.V.STAUFFACHER . 154 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8197.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 70.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 13.0 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 . 8 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 51 33.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 0 0 1 0 0 1 0 1 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 2 0 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 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 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 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 4 A A 0 0 139 0, 0.0 2,-0.1 0, 0.0 34,-0.0 0.000 360.0 360.0 360.0 143.3 -1.4 3.1 -32.2 2 5 A T - 0 0 94 34,-0.1 2,-0.3 1,-0.0 34,-0.2 -0.397 360.0-150.9 -69.2 142.9 -0.1 4.1 -28.8 3 6 A K E -a 36 0A 116 32,-2.6 34,-2.6 -2,-0.1 2,-0.3 -0.831 14.0-161.7-110.2 154.7 -2.3 3.2 -25.8 4 7 A S E -a 37 0A 6 -2,-0.3 80,-1.1 32,-0.2 79,-0.5 -0.999 14.6-178.6-147.3 143.6 -2.3 5.3 -22.6 5 8 A V E -ab 38 84A 0 32,-2.4 34,-1.8 -2,-0.3 2,-0.5 -0.997 8.1-163.5-142.4 136.9 -3.3 5.1 -19.0 6 9 A L E -ab 39 85A 0 78,-2.2 80,-2.5 -2,-0.3 2,-0.4 -0.987 11.9-152.2-118.7 121.3 -3.1 7.6 -16.1 7 10 A F E -ab 40 86A 0 32,-2.4 34,-2.1 -2,-0.5 2,-0.4 -0.816 20.1-165.8 -94.3 137.6 -3.5 6.3 -12.5 8 11 A V E +ab 41 87A 0 78,-2.3 80,-0.9 -2,-0.4 2,-0.2 -0.966 21.9 152.8-133.7 134.8 -4.9 8.8 -10.1 9 12 A C E -a 42 0A 4 32,-1.3 34,-1.9 -2,-0.4 35,-0.3 -0.770 56.9 -86.7-137.1-169.4 -5.3 9.3 -6.3 10 13 A L S S+ 0 0 83 32,-0.2 34,-2.1 -2,-0.2 36,-0.2 0.923 118.6 12.2 -69.4 -43.4 -5.6 12.4 -4.1 11 14 A G S S- 0 0 16 31,-0.2 31,-0.2 32,-0.1 36,-0.2 0.619 86.9-130.7-110.1 -18.5 -1.9 13.1 -3.5 12 15 A N S S+ 0 0 0 29,-0.3 30,-0.1 59,-0.1 60,-0.1 0.837 85.2 94.2 61.0 36.4 0.0 11.0 -6.0 13 16 A I S S+ 0 0 16 39,-0.1 40,-2.8 58,-0.1 43,-0.2 0.560 87.8 23.7-120.8 -24.4 2.4 9.7 -3.3 14 17 A C S > S+ 0 0 7 38,-0.2 4,-1.0 42,-0.1 112,-0.0 0.744 125.5 12.3-106.6 -83.9 0.8 6.3 -2.1 15 18 A R H > S+ 0 0 5 1,-0.2 4,-2.5 2,-0.2 3,-0.2 0.928 121.1 52.5 -69.6 -49.2 -1.6 4.3 -4.3 16 19 A S H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.892 107.0 50.7 -66.0 -36.8 -1.2 5.8 -7.8 17 20 A P H > S+ 0 0 1 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.876 111.9 49.8 -66.9 -30.8 2.6 5.6 -8.1 18 21 A I H X S+ 0 0 1 -4,-1.0 4,-2.9 -3,-0.2 5,-0.2 0.947 111.2 47.9 -68.1 -47.4 2.4 1.9 -7.1 19 22 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.922 112.8 49.5 -56.5 -45.5 -0.3 1.2 -9.7 20 23 A E H X S+ 0 0 9 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.925 113.2 46.0 -59.2 -46.6 1.8 3.1 -12.3 21 24 A A H X S+ 0 0 3 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.897 112.5 49.9 -67.2 -42.3 4.9 1.1 -11.4 22 25 A V H X S+ 0 0 3 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.942 113.7 46.1 -59.8 -48.1 3.1 -2.2 -11.4 23 26 A F H X S+ 0 0 0 -4,-2.7 4,-2.4 -5,-0.2 5,-0.2 0.913 110.5 52.1 -64.8 -42.4 1.6 -1.5 -14.8 24 27 A R H X S+ 0 0 90 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.895 109.3 50.8 -61.5 -40.4 4.8 -0.3 -16.3 25 28 A K H X S+ 0 0 59 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.928 108.7 52.4 -60.8 -44.7 6.5 -3.5 -15.1 26 29 A L H X S+ 0 0 30 -4,-2.2 4,-1.0 1,-0.2 -2,-0.2 0.927 113.4 41.9 -59.4 -46.7 3.8 -5.7 -16.7 27 30 A V H <>S+ 0 0 1 -4,-2.4 5,-2.4 2,-0.2 6,-0.5 0.869 114.2 52.0 -70.7 -32.9 4.1 -4.0 -20.1 28 31 A T H ><5S+ 0 0 69 -4,-2.3 3,-1.7 -5,-0.2 -2,-0.2 0.921 106.3 54.4 -66.6 -42.8 7.9 -4.0 -20.0 29 32 A D H 3<5S+ 0 0 96 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.768 109.1 49.1 -59.3 -29.6 7.9 -7.7 -19.2 30 33 A Q T 3<5S- 0 0 119 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.188 115.5-114.5 -99.7 15.7 5.8 -8.3 -22.3 31 34 A N T < 5S+ 0 0 153 -3,-1.7 -3,-0.2 1,-0.1 3,-0.2 0.597 91.0 103.5 68.4 15.8 8.1 -6.3 -24.6 32 35 A I > < + 0 0 49 -5,-2.4 3,-1.4 -6,-0.2 4,-0.3 0.109 30.1 113.4-120.4 20.6 5.4 -3.6 -25.2 33 36 A S G > S+ 0 0 47 -6,-0.5 3,-1.8 1,-0.3 -1,-0.1 0.881 76.5 61.0 -57.7 -37.1 6.4 -0.7 -23.0 34 37 A E G 3 S+ 0 0 169 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.683 100.1 55.7 -65.6 -17.3 7.0 1.3 -26.2 35 38 A N G < S+ 0 0 85 -3,-1.4 -32,-2.6 -8,-0.1 2,-0.4 0.458 103.1 68.4 -91.3 -3.4 3.4 0.9 -27.2 36 39 A W E < -a 3 0A 32 -3,-1.8 2,-0.6 -4,-0.3 -32,-0.2 -0.954 60.5-155.9-123.4 136.9 2.1 2.4 -23.9 37 40 A R E -a 4 0A 102 -34,-2.6 -32,-2.4 -2,-0.4 2,-0.4 -0.958 28.0-177.7-101.6 119.8 2.2 5.8 -22.3 38 41 A V E +a 5 0A 14 -2,-0.6 2,-0.3 -34,-0.2 -32,-0.2 -0.970 12.3 143.0-125.1 132.7 1.9 5.2 -18.5 39 42 A D E -a 6 0A 33 -34,-1.8 -32,-2.4 -2,-0.4 2,-0.3 -0.942 30.7-141.7-154.4 173.6 1.7 7.9 -15.8 40 43 A S E +a 7 0A 0 -2,-0.3 2,-0.3 -34,-0.2 -32,-0.2 -0.979 20.2 171.8-142.0 155.8 0.2 8.8 -12.5 41 44 A A E -a 8 0A 0 -34,-2.1 -32,-1.3 -2,-0.3 2,-0.3 -0.965 26.3-110.0-157.4 169.5 -1.1 12.1 -11.1 42 45 A A E -ac 9 73A 2 30,-2.5 32,-3.3 -2,-0.3 -32,-0.2 -0.775 8.4-144.7-106.6 149.1 -3.0 13.7 -8.2 43 46 A T S S+ 0 0 2 -34,-1.9 2,-0.2 -2,-0.3 -33,-0.2 0.827 90.4 41.5 -76.0 -29.9 -6.5 15.3 -8.0 44 47 A S S S- 0 0 19 -34,-2.1 3,-0.2 -35,-0.3 -2,-0.2 -0.546 78.4-126.4-110.2 177.1 -5.1 17.8 -5.5 45 48 A G S > S+ 0 0 38 -2,-0.2 3,-0.9 1,-0.1 -34,-0.1 0.295 73.6 106.9-106.6 11.5 -1.9 19.9 -5.1 46 49 A Y T 3 S+ 0 0 197 1,-0.2 -1,-0.1 -36,-0.2 -35,-0.1 0.762 88.9 30.8 -62.9 -29.5 -0.8 19.0 -1.6 47 50 A E T > S+ 0 0 49 -3,-0.2 3,-2.5 -36,-0.2 24,-0.3 0.255 77.3 152.8-117.1 11.7 2.1 16.8 -2.5 48 51 A I T < S+ 0 0 95 -3,-0.9 24,-0.2 1,-0.3 -3,-0.1 -0.171 72.9 16.3 -52.6 129.4 3.4 18.3 -5.8 49 52 A G T 3 S+ 0 0 45 22,-2.5 -1,-0.3 1,-0.3 23,-0.1 0.216 97.3 126.1 94.8 -12.4 7.1 17.6 -6.2 50 53 A N < - 0 0 69 -3,-2.5 21,-2.7 20,-0.1 -1,-0.3 -0.504 58.5-124.0 -85.1 146.8 7.3 14.9 -3.6 51 54 A P - 0 0 89 0, 0.0 19,-0.1 0, 0.0 3,-0.1 -0.304 51.0 -71.4 -71.5 168.0 8.7 11.4 -4.1 52 55 A P - 0 0 11 0, 0.0 -38,-0.2 0, 0.0 -39,-0.1 -0.205 66.9 -76.7 -58.1 153.0 6.4 8.4 -3.3 53 56 A D >> - 0 0 23 -40,-2.8 4,-2.2 1,-0.1 3,-0.6 -0.254 42.6-126.6 -46.5 130.6 5.6 7.6 0.3 54 57 A Y H 3> S+ 0 0 172 1,-0.3 4,-2.0 2,-0.2 -1,-0.1 0.810 109.7 56.8 -57.9 -31.7 8.7 5.9 1.8 55 58 A R H 3> S+ 0 0 68 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.867 107.9 47.4 -66.3 -37.7 6.5 3.0 2.9 56 59 A G H <> S+ 0 0 1 -3,-0.6 4,-2.6 2,-0.2 -2,-0.2 0.893 110.3 51.8 -68.2 -41.3 5.3 2.4 -0.7 57 60 A Q H X S+ 0 0 46 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.891 109.2 51.1 -59.8 -40.8 8.9 2.7 -2.0 58 61 A S H X S+ 0 0 40 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.931 109.9 49.6 -62.3 -45.5 9.9 0.0 0.6 59 62 A C H X S+ 0 0 4 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.930 111.0 49.0 -59.6 -47.5 7.1 -2.2 -0.5 60 63 A M H <>S+ 0 0 1 -4,-2.6 5,-2.2 1,-0.2 4,-0.4 0.876 108.4 53.5 -60.7 -41.6 8.0 -1.9 -4.2 61 64 A K H ><5S+ 0 0 139 -4,-2.2 3,-1.6 1,-0.2 -1,-0.2 0.934 105.6 54.4 -55.7 -48.0 11.7 -2.6 -3.5 62 65 A R H 3<5S+ 0 0 154 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.838 113.0 43.5 -56.4 -35.3 10.7 -5.9 -1.7 63 66 A H T 3<5S- 0 0 54 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.364 109.3-118.0 -96.3 3.2 8.8 -6.9 -4.8 64 67 A G T < 5 + 0 0 50 -3,-1.6 -3,-0.2 -4,-0.4 -2,-0.1 0.796 62.2 148.0 63.4 29.5 11.3 -6.0 -7.5 65 68 A I < - 0 0 17 -5,-2.2 -1,-0.2 -6,-0.1 2,-0.1 -0.880 49.2-127.7 -96.8 114.8 9.0 -3.4 -9.1 66 69 A P + 0 0 94 0, 0.0 2,-0.3 0, 0.0 -41,-0.2 -0.434 36.7 172.8 -59.7 127.8 10.9 -0.5 -10.6 67 70 A M + 0 0 23 -2,-0.1 2,-0.3 -43,-0.1 -49,-0.1 -0.967 13.6 153.7-141.8 126.1 9.3 2.8 -9.3 68 71 A S + 0 0 117 -2,-0.3 2,-0.3 -51,-0.1 0, 0.0 -0.843 22.3 150.8-151.6 113.9 10.7 6.3 -9.8 69 72 A H - 0 0 25 -2,-0.3 2,-0.5 -56,-0.0 -2,-0.0 -0.993 37.7-150.5-152.6 148.3 8.2 9.3 -9.6 70 73 A V - 0 0 97 -2,-0.3 -20,-0.1 -19,-0.1 -22,-0.1 -0.994 41.0-113.0-117.5 123.5 7.7 13.0 -8.8 71 74 A A + 0 0 2 -21,-2.7 -22,-2.5 -2,-0.5 2,-0.3 -0.279 43.2 173.4 -61.2 136.9 4.2 13.8 -7.7 72 75 A R - 0 0 57 -24,-0.2 -30,-2.5 -32,-0.1 2,-0.3 -0.975 30.4-113.4-141.1 155.0 2.2 16.0 -10.0 73 76 A Q B -c 42 0A 75 -2,-0.3 -30,-0.2 -32,-0.2 -28,-0.1 -0.653 38.4-103.4 -87.4 142.9 -1.3 17.3 -10.3 74 77 A I - 0 0 12 -32,-3.3 2,-0.3 -2,-0.3 -1,-0.1 -0.280 40.4-151.0 -55.4 149.2 -3.7 16.2 -13.1 75 78 A T >> - 0 0 61 1,-0.1 4,-0.7 -34,-0.0 3,-0.6 -0.801 28.2-109.5-121.5 166.8 -4.1 18.8 -15.8 76 79 A K H >> S+ 0 0 142 -2,-0.3 3,-0.8 1,-0.2 4,-0.7 0.861 118.5 60.7 -62.0 -33.7 -6.9 19.6 -18.3 77 80 A E H >> S+ 0 0 137 1,-0.2 4,-1.8 2,-0.2 3,-0.9 0.827 91.1 66.9 -62.7 -34.1 -4.7 18.2 -21.0 78 81 A D H <> S+ 0 0 5 -3,-0.6 4,-2.2 1,-0.3 -1,-0.2 0.840 96.0 55.7 -59.1 -33.4 -4.7 14.8 -19.4 79 82 A F H << S+ 0 0 4 -3,-0.8 29,-2.0 -4,-0.7 28,-1.8 0.802 111.8 43.6 -68.6 -28.8 -8.4 14.4 -20.1 80 83 A A H << S+ 0 0 38 -3,-0.9 -2,-0.2 -4,-0.7 -1,-0.2 0.774 120.7 38.3 -82.8 -29.0 -7.7 15.0 -23.8 81 84 A T H < S+ 0 0 41 -4,-1.8 2,-0.3 26,-0.1 -2,-0.2 0.770 96.8 77.9-102.6 -28.1 -4.7 12.8 -24.2 82 85 A F < - 0 0 0 -4,-2.2 -77,-0.1 -5,-0.2 3,-0.1 -0.638 57.1-154.0 -88.4 141.9 -5.2 9.7 -22.0 83 86 A D S S+ 0 0 47 -79,-0.5 26,-2.2 -2,-0.3 2,-0.4 0.860 84.4 21.1 -75.7 -37.1 -7.4 6.7 -23.1 84 87 A Y E -bd 5 109A 46 -80,-1.1 -78,-2.2 24,-0.2 2,-0.5 -0.994 56.7-165.9-135.0 138.5 -8.1 5.7 -19.5 85 88 A I E -bd 6 110A 0 24,-2.8 26,-2.4 -2,-0.4 2,-0.6 -0.990 18.9-168.9-119.3 114.0 -7.9 7.4 -16.2 86 89 A L E -bd 7 111A 0 -80,-2.5 -78,-2.3 -2,-0.5 26,-0.2 -0.930 6.4-174.0-112.9 120.4 -8.0 4.8 -13.5 87 90 A C E -bd 8 112A 0 24,-2.6 26,-3.2 -2,-0.6 27,-0.5 -0.540 25.0-128.7-114.9 177.6 -8.6 5.9 -9.9 88 91 A M S S+ 0 0 0 -80,-0.9 36,-2.1 24,-0.2 2,-0.3 0.845 73.0 7.1 -98.2 -39.9 -8.6 4.3 -6.4 89 92 A D S > S- 0 0 24 34,-0.2 4,-2.0 1,-0.0 5,-0.1 -0.836 76.7 -90.9-143.2 176.6 -11.7 5.2 -4.5 90 93 A E H > S+ 0 0 104 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.837 120.3 56.2 -62.4 -36.4 -15.1 6.9 -4.7 91 94 A S H > S+ 0 0 91 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.932 109.0 47.6 -59.5 -46.0 -13.8 10.3 -3.6 92 95 A N H > S+ 0 0 4 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.897 111.2 51.2 -60.8 -43.5 -11.3 10.2 -6.5 93 96 A L H X S+ 0 0 30 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.928 109.6 48.9 -64.7 -42.1 -14.1 9.3 -8.9 94 97 A R H X S+ 0 0 208 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.904 114.3 46.6 -62.5 -41.6 -16.3 12.1 -7.8 95 98 A D H X S+ 0 0 26 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.923 113.0 48.5 -67.6 -46.7 -13.5 14.6 -8.1 96 99 A L H X S+ 0 0 0 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.885 109.8 51.6 -63.0 -39.6 -12.4 13.3 -11.5 97 100 A N H X S+ 0 0 66 -4,-2.5 4,-1.2 -5,-0.2 -1,-0.2 0.922 109.5 51.3 -65.6 -38.4 -15.9 13.4 -12.9 98 101 A R H >< S+ 0 0 147 -4,-1.9 3,-0.6 -5,-0.2 -2,-0.2 0.946 112.8 45.4 -58.2 -49.7 -16.2 17.0 -11.7 99 102 A K H >< S+ 0 0 41 -4,-2.5 3,-2.1 1,-0.2 -2,-0.2 0.900 106.5 59.5 -61.4 -41.5 -13.0 17.9 -13.5 100 103 A S H >< S+ 0 0 17 -4,-2.7 3,-0.8 1,-0.3 -1,-0.2 0.766 100.3 56.5 -61.1 -27.3 -14.0 16.1 -16.6 101 104 A N T << S+ 0 0 133 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.396 99.0 62.0 -87.1 4.7 -17.1 18.3 -17.0 102 105 A Q T < S+ 0 0 136 -3,-2.1 2,-0.3 -4,-0.1 -1,-0.2 0.216 94.3 72.9-111.2 9.5 -14.9 21.4 -17.0 103 106 A V S < S- 0 0 31 -3,-0.8 3,-0.1 1,-0.1 -26,-0.0 -0.898 71.8-139.4-120.7 155.3 -13.0 20.5 -20.2 104 107 A K S S+ 0 0 196 -2,-0.3 2,-0.6 1,-0.2 -1,-0.1 0.872 92.2 43.9 -79.7 -38.2 -14.2 20.5 -23.8 105 108 A T + 0 0 76 -29,-0.1 2,-0.6 2,-0.0 -1,-0.2 -0.919 59.0 171.9-116.3 108.8 -12.5 17.3 -24.9 106 109 A C + 0 0 54 -2,-0.6 -26,-0.2 1,-0.2 -27,-0.1 -0.850 11.4 157.5-115.4 90.4 -12.7 14.3 -22.6 107 110 A K + 0 0 106 -28,-1.8 -27,-0.2 -2,-0.6 -1,-0.2 0.840 48.3 98.6 -71.6 -37.7 -11.2 11.4 -24.5 108 111 A A - 0 0 9 -29,-2.0 2,-0.5 -3,-0.2 -24,-0.2 -0.210 68.9-139.6 -63.0 136.9 -10.4 9.5 -21.3 109 112 A K E -d 84 0A 89 -26,-2.2 -24,-2.8 45,-0.1 2,-0.6 -0.862 23.1-148.3 -86.7 125.1 -12.7 6.8 -19.9 110 113 A I E +d 85 0A 27 -2,-0.5 2,-0.3 -26,-0.2 -24,-0.2 -0.888 32.3 148.2-105.7 119.9 -12.7 7.4 -16.1 111 114 A E E -d 86 0A 19 -26,-2.4 -24,-2.6 -2,-0.6 2,-0.4 -0.949 51.2 -95.1-145.4 159.8 -13.1 4.3 -14.0 112 115 A L E > -d 87 0A 13 -2,-0.3 3,-1.4 -26,-0.2 -24,-0.2 -0.663 28.4-140.4 -74.4 131.5 -12.1 2.7 -10.6 113 116 A L G > S+ 0 0 0 -26,-3.2 3,-2.0 -2,-0.4 4,-0.2 0.889 102.5 62.6 -56.5 -37.9 -9.0 0.5 -11.0 114 117 A G G > S+ 0 0 3 8,-0.5 3,-1.4 -27,-0.5 -1,-0.3 0.620 81.5 78.6 -67.6 -13.6 -10.7 -2.0 -8.7 115 118 A S G < S+ 0 0 36 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.611 92.5 55.4 -66.8 -12.2 -13.5 -2.5 -11.2 116 119 A Y G < S+ 0 0 12 -3,-2.0 -1,-0.2 -4,-0.2 -2,-0.2 0.504 78.2 119.7 -95.0 -7.0 -11.0 -4.7 -13.0 117 120 A D X - 0 0 1 -3,-1.4 3,-1.6 1,-0.2 28,-0.1 -0.445 51.1-158.4 -66.9 117.9 -10.2 -7.0 -10.0 118 121 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.2 0, 0.0 27,-0.0 0.734 99.1 56.3 -62.8 -23.4 -11.1 -10.7 -10.7 119 122 A Q T 3 S- 0 0 123 2,-0.1 3,-0.1 22,-0.1 -2,-0.1 0.307 114.3-125.5 -90.3 3.2 -11.3 -11.1 -6.9 120 123 A K < + 0 0 163 -3,-1.6 2,-1.0 1,-0.2 -5,-0.1 0.701 55.5 150.8 65.4 31.8 -13.9 -8.3 -6.9 121 124 A Q - 0 0 108 1,-0.2 -1,-0.2 -7,-0.1 -4,-0.2 -0.786 22.9-173.6 -94.1 96.0 -12.4 -5.8 -4.4 122 125 A L + 0 0 82 -2,-1.0 -8,-0.5 -3,-0.1 2,-0.4 0.829 59.9 55.8 -65.5 -39.8 -13.8 -2.6 -5.9 123 126 A I - 0 0 39 -9,-0.1 2,-0.9 -10,-0.1 -34,-0.2 -0.820 64.6-151.3-103.6 131.7 -12.0 -0.0 -3.7 124 127 A I - 0 0 0 -36,-2.1 -109,-0.1 -2,-0.4 -11,-0.1 -0.886 35.8-135.8 -95.4 101.0 -8.3 0.2 -3.3 125 128 A E - 0 0 130 -2,-0.9 13,-0.1 1,-0.1 -36,-0.0 -0.277 17.3-101.4 -69.0 144.0 -8.3 1.7 0.2 126 129 A D - 0 0 80 1,-0.1 3,-0.4 -112,-0.0 -1,-0.1 -0.492 29.2-167.6 -64.1 120.0 -6.0 4.6 1.2 127 130 A P > + 0 0 3 0, 0.0 3,-2.1 0, 0.0 8,-0.1 0.377 57.8 107.5 -90.1 4.5 -3.0 3.2 3.1 128 131 A Y T 3 S+ 0 0 93 1,-0.3 7,-0.0 6,-0.1 -2,-0.0 0.865 89.8 32.5 -50.4 -45.9 -1.8 6.7 4.3 129 132 A Y T 3 S+ 0 0 214 -3,-0.4 -1,-0.3 2,-0.0 2,-0.1 0.215 113.0 83.3 -96.8 13.1 -3.0 6.0 7.9 130 133 A G S < S- 0 0 25 -3,-2.1 2,-0.2 1,-0.1 -4,-0.0 -0.063 75.2-109.6 -98.7-159.4 -2.2 2.3 7.7 131 134 A N >> - 0 0 89 -2,-0.1 4,-1.4 -76,-0.0 3,-1.1 -0.575 46.2 -73.8-125.1-172.6 0.9 0.2 8.1 132 135 A D H 3> S+ 0 0 103 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.835 127.3 59.1 -55.4 -36.4 3.3 -1.8 6.0 133 136 A S H 3> S+ 0 0 68 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.814 102.4 53.9 -63.3 -31.3 0.7 -4.6 5.6 134 137 A D H <> S+ 0 0 65 -3,-1.1 4,-2.2 2,-0.2 -1,-0.2 0.870 106.5 50.9 -72.1 -35.9 -1.8 -2.1 4.1 135 138 A F H X S+ 0 0 0 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.898 108.7 52.7 -65.2 -38.4 0.8 -1.1 1.5 136 139 A E H X S+ 0 0 45 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.903 107.8 50.7 -62.7 -41.8 1.2 -4.8 0.7 137 140 A T H X S+ 0 0 77 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.928 110.3 50.2 -59.4 -45.6 -2.6 -5.2 0.3 138 141 A V H X S+ 0 0 3 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.938 110.5 49.8 -57.7 -49.5 -2.5 -2.2 -2.1 139 142 A Y H X S+ 0 0 25 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.934 111.2 48.5 -53.5 -51.5 0.4 -3.8 -4.1 140 143 A Q H X S+ 0 0 76 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.885 112.2 48.6 -61.8 -38.5 -1.4 -7.1 -4.4 141 144 A Q H X S+ 0 0 11 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.913 109.3 53.1 -65.6 -43.0 -4.6 -5.4 -5.6 142 145 A C H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 5,-0.3 0.920 106.9 52.5 -60.3 -42.8 -2.8 -3.4 -8.1 143 146 A V H X S+ 0 0 12 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.953 112.7 44.3 -56.5 -51.7 -1.2 -6.5 -9.6 144 147 A R H X S+ 0 0 45 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.920 119.1 41.9 -59.7 -45.8 -4.6 -8.2 -10.0 145 148 A C H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.909 114.4 49.6 -72.4 -43.1 -6.3 -5.1 -11.4 146 149 A C H X S+ 0 0 0 -4,-3.2 4,-2.5 -5,-0.2 -1,-0.2 0.890 110.5 51.0 -64.1 -41.4 -3.4 -4.1 -13.7 147 150 A R H X S+ 0 0 142 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.931 113.2 45.6 -58.0 -46.9 -3.1 -7.6 -15.2 148 151 A A H X S+ 0 0 14 -4,-1.7 4,-2.3 -5,-0.2 -2,-0.2 0.886 112.3 50.3 -67.1 -41.4 -6.8 -7.7 -15.9 149 152 A F H < S+ 0 0 3 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.920 110.4 49.6 -62.6 -43.5 -6.9 -4.2 -17.4 150 153 A L H < S+ 0 0 33 -4,-2.5 3,-0.2 1,-0.2 -2,-0.2 0.898 111.3 51.4 -60.7 -40.1 -3.9 -5.1 -19.7 151 154 A E H < S- 0 0 164 -4,-2.1 2,-0.3 1,-0.2 -2,-0.2 0.934 133.1 -9.1 -61.3 -50.5 -5.8 -8.2 -20.7 152 155 A K < - 0 0 168 -4,-2.3 -1,-0.2 -5,-0.1 2,-0.2 -0.841 66.5-148.9-160.2 111.5 -9.1 -6.5 -21.7 153 156 A A 0 0 38 -2,-0.3 -4,-0.1 -3,-0.2 -3,-0.0 -0.503 360.0 360.0 -82.3 150.2 -10.1 -2.9 -21.1 154 157 A H 0 0 110 -2,-0.2 -1,-0.1 -45,-0.0 -45,-0.1 -0.384 360.0 360.0 -71.1 360.0 -13.8 -2.0 -20.5