==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-MAY-06 2CMC . COMPND 2 MOLECULE: TYROSINE-PROTEIN PHOSPHATASE NON-RECEPTOR TYPE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.J.ALA,L.GONNEVILLE,M.C.HILLMAN,M.BECKER-PASHA,M.WEI, . 285 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13417.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 203 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.1 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 . 2 0.7 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 . 27 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 28.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.8 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 0 0 1 0 1 1 0 1 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 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 0 PARALLEL BRIDGES PER LADDER . 0 2 0 1 0 1 0 0 2 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 . 1 0 0 0 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 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 H >> 0 0 134 0, 0.0 4,-1.6 0, 0.0 3,-0.8 0.000 360.0 360.0 360.0 171.1 47.1 13.2 42.5 2 -3 A H H 3> + 0 0 166 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.708 360.0 57.4 -52.8 -28.5 49.8 13.5 39.8 3 -2 A H H 3> S+ 0 0 111 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.917 105.5 50.3 -71.2 -41.2 48.7 10.3 38.0 4 -1 A H H <> S+ 0 0 25 -3,-0.8 4,-2.4 2,-0.2 -2,-0.2 0.921 115.1 43.3 -60.3 -46.1 45.2 11.8 37.4 5 0 A H H X S+ 0 0 48 -4,-1.6 4,-3.0 2,-0.2 5,-0.2 0.893 111.8 54.1 -67.0 -41.5 46.6 15.0 36.0 6 1 A H H X S+ 0 0 103 -4,-2.2 4,-2.6 -5,-0.2 5,-0.3 0.946 111.0 45.3 -57.7 -48.8 49.2 13.1 34.0 7 2 A E H X S+ 0 0 75 -4,-2.8 4,-2.8 1,-0.2 5,-0.2 0.929 113.3 51.1 -59.5 -47.6 46.4 11.1 32.4 8 3 A M H X S+ 0 0 14 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.906 113.3 44.3 -54.8 -48.5 44.3 14.2 31.8 9 4 A E H X S+ 0 0 72 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.910 114.8 46.8 -66.7 -44.6 47.2 16.1 30.2 10 5 A K H X S+ 0 0 103 -4,-2.6 4,-3.2 -5,-0.2 5,-0.2 0.938 112.0 51.6 -62.8 -47.0 48.3 13.2 27.9 11 6 A E H X S+ 0 0 99 -4,-2.8 4,-2.5 -5,-0.3 5,-0.3 0.968 111.7 46.3 -54.0 -56.0 44.8 12.5 26.9 12 7 A F H X S+ 0 0 20 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.912 113.8 49.5 -52.6 -47.2 44.2 16.2 25.9 13 8 A E H X S+ 0 0 109 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.883 109.7 51.4 -60.6 -40.6 47.6 16.2 24.1 14 9 A Q H X S+ 0 0 85 -4,-3.2 4,-1.6 2,-0.2 -2,-0.2 0.926 113.3 43.8 -63.1 -46.6 46.7 13.0 22.2 15 10 A I H <>S+ 0 0 20 -4,-2.5 5,-2.8 -5,-0.2 6,-0.4 0.890 117.4 47.4 -65.6 -39.5 43.3 14.4 21.1 16 11 A D H ><5S+ 0 0 51 -4,-2.6 3,-2.1 -5,-0.3 -2,-0.2 0.967 109.9 48.3 -69.9 -53.7 44.9 17.7 20.2 17 12 A K H 3<5S+ 0 0 170 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.856 117.0 44.5 -56.9 -35.9 48.0 16.5 18.2 18 13 A S T 3<5S- 0 0 69 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.434 107.1-130.7 -87.2 2.3 45.7 14.2 16.2 19 14 A G T < 5 + 0 0 52 -3,-2.1 3,-0.3 1,-0.1 -3,-0.2 0.951 53.0 152.3 48.8 57.0 43.2 16.9 15.8 20 15 A S >< + 0 0 43 -5,-2.8 4,-1.8 1,-0.2 5,-0.2 0.386 38.4 95.8-100.1 5.7 40.4 14.7 16.9 21 16 A W H > S+ 0 0 17 -6,-0.4 4,-2.8 1,-0.2 5,-0.3 0.886 77.0 61.1 -61.5 -39.8 38.0 17.3 18.3 22 17 A A H > S+ 0 0 68 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.903 108.2 41.9 -53.2 -50.5 36.0 17.6 15.1 23 18 A A H > S+ 0 0 57 2,-0.2 4,-2.6 -4,-0.2 5,-0.2 0.909 113.8 50.4 -66.2 -46.1 34.8 14.0 15.1 24 19 A I H X S+ 0 0 50 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.953 114.2 46.5 -55.2 -49.9 34.1 13.9 18.9 25 20 A Y H X S+ 0 0 21 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.867 109.5 54.6 -60.7 -39.9 32.1 17.0 18.4 26 21 A Q H X S+ 0 0 85 -4,-2.1 4,-3.0 -5,-0.3 -1,-0.2 0.890 106.7 50.2 -62.7 -40.3 30.4 15.5 15.4 27 22 A D H X S+ 0 0 73 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.904 109.6 52.2 -65.4 -38.8 29.3 12.4 17.4 28 23 A I H X S+ 0 0 0 -4,-1.9 4,-1.0 -5,-0.2 -2,-0.2 0.935 113.2 43.5 -60.3 -48.9 27.9 14.7 20.1 29 24 A R H >< S+ 0 0 135 -4,-2.3 3,-0.9 1,-0.2 -2,-0.2 0.959 115.0 49.1 -62.7 -49.9 25.9 16.7 17.6 30 25 A H H 3< S+ 0 0 150 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.741 118.1 40.9 -62.6 -23.0 24.7 13.6 15.8 31 26 A E H 3< S+ 0 0 97 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.452 83.8 125.1-103.6 -3.5 23.7 11.9 19.1 32 27 A A << - 0 0 31 -4,-1.0 2,-0.1 -3,-0.9 224,-0.1 -0.232 63.8-111.1 -58.4 145.8 22.1 15.0 20.8 33 28 A S - 0 0 37 223,-0.3 2,-0.5 1,-0.0 -1,-0.1 -0.373 22.8-146.2 -79.0 157.4 18.5 14.4 22.0 34 29 A D + 0 0 140 -2,-0.1 226,-0.1 229,-0.1 -1,-0.0 -0.973 20.4 171.9-129.6 120.5 15.5 16.1 20.5 35 30 A F - 0 0 72 -2,-0.5 2,-0.1 1,-0.1 228,-0.1 -0.790 39.0 -86.0-120.3 163.2 12.5 17.1 22.5 36 31 A P - 0 0 59 0, 0.0 22,-3.1 0, 0.0 23,-0.4 -0.389 24.8-169.7 -72.2 149.6 9.4 19.2 21.5 37 32 A C > + 0 0 20 20,-0.3 4,-1.7 21,-0.1 5,-0.1 -0.384 32.0 145.7-130.2 47.3 9.3 23.0 21.8 38 33 A R T 4 S+ 0 0 180 2,-0.2 4,-0.4 1,-0.2 3,-0.4 0.932 72.2 45.9 -55.6 -52.4 5.6 23.5 21.2 39 34 A V T >4 S+ 0 0 30 1,-0.2 3,-2.6 2,-0.2 6,-0.2 0.954 109.0 56.3 -57.8 -50.4 5.2 26.5 23.6 40 35 A A T 34 S+ 0 0 2 16,-0.3 -1,-0.2 1,-0.3 -2,-0.2 0.846 108.8 48.3 -48.8 -38.5 8.3 28.2 22.1 41 36 A K T 3< S+ 0 0 116 -4,-1.7 -1,-0.3 -3,-0.4 -2,-0.2 0.416 81.1 122.7 -85.6 0.8 6.8 28.0 18.6 42 37 A L S X S- 0 0 62 -3,-2.6 3,-2.2 -4,-0.4 4,-0.2 -0.423 72.2-121.8 -63.4 134.9 3.4 29.4 19.7 43 38 A P G > S+ 0 0 105 0, 0.0 3,-2.2 0, 0.0 4,-0.3 0.872 111.0 59.0 -45.3 -47.5 2.6 32.4 17.6 44 39 A K G 3 S+ 0 0 131 1,-0.3 3,-0.3 2,-0.1 -2,-0.1 0.742 102.5 55.7 -56.8 -23.5 2.2 34.7 20.7 45 40 A N G X S+ 0 0 0 -3,-2.2 3,-1.5 -6,-0.2 4,-0.4 0.335 76.3 103.7 -92.5 5.4 5.8 33.8 21.6 46 41 A K G X S+ 0 0 156 -3,-2.2 3,-1.2 1,-0.3 -1,-0.2 0.920 83.6 41.4 -53.8 -54.2 7.3 34.9 18.3 47 42 A N G 3 S+ 0 0 96 -3,-0.3 -1,-0.3 -4,-0.3 48,-0.2 0.286 105.7 66.7 -83.4 15.4 8.8 38.2 19.5 48 43 A R G < S+ 0 0 25 -3,-1.5 2,-0.5 -8,-0.1 25,-0.4 0.419 90.9 74.8-105.9 -5.8 10.0 36.6 22.7 49 44 A N < - 0 0 23 -3,-1.2 3,-0.1 -4,-0.4 6,-0.1 -0.933 62.4-160.9-112.6 128.6 12.5 34.4 20.8 50 45 A R S S+ 0 0 40 -2,-0.5 2,-0.4 1,-0.2 -1,-0.1 0.853 82.7 23.1 -72.6 -37.3 15.7 35.9 19.3 51 46 A Y > - 0 0 66 3,-0.4 3,-0.7 171,-0.1 -1,-0.2 -0.988 63.3-144.8-133.5 141.5 16.2 33.1 16.8 52 47 A R T 3 S+ 0 0 211 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.721 102.6 55.3 -77.1 -17.9 13.7 30.6 15.3 53 48 A D T 3 S+ 0 0 122 1,-0.2 2,-0.5 -3,-0.0 -1,-0.2 0.523 99.1 66.6 -92.3 -2.6 16.3 27.9 15.4 54 49 A V < + 0 0 6 -3,-0.7 -3,-0.4 2,-0.0 -1,-0.2 -0.925 64.3 150.7-121.2 105.5 17.1 28.2 19.1 55 50 A S - 0 0 4 -2,-0.5 208,-0.5 -6,-0.1 2,-0.3 -0.938 44.0-114.2-132.2 154.5 14.2 27.2 21.4 56 51 A P - 0 0 1 0, 0.0 -16,-0.3 0, 0.0 206,-0.1 -0.658 37.6-110.8 -86.7 146.0 13.9 25.7 24.8 57 52 A F > - 0 0 0 204,-0.5 4,-0.9 -2,-0.3 3,-0.4 -0.417 25.0-122.7 -68.0 152.6 12.4 22.2 25.1 58 53 A D T >4 S+ 0 0 34 -22,-3.1 3,-0.8 1,-0.2 -1,-0.1 0.933 106.2 57.3 -61.7 -46.6 9.0 22.2 26.8 59 54 A H T 34 S+ 0 0 106 -23,-0.4 -1,-0.2 1,-0.2 -22,-0.1 0.755 118.7 28.1 -59.9 -28.0 10.0 19.8 29.5 60 55 A S T 34 S+ 0 0 9 -3,-0.4 16,-2.8 201,-0.1 -1,-0.2 0.370 87.7 124.5-117.2 5.1 12.8 21.9 30.9 61 56 A R E << -A 75 0A 28 -4,-0.9 2,-0.5 -3,-0.8 14,-0.3 -0.207 64.4-113.3 -63.6 158.0 11.7 25.5 30.0 62 57 A I E - 0 0 7 12,-2.4 10,-0.6 10,-0.3 2,-0.5 -0.800 28.1-146.8 -92.8 131.8 11.5 28.0 32.8 63 58 A K E -A 71 0A 117 -2,-0.5 8,-0.2 8,-0.1 2,-0.1 -0.873 11.3-129.3-103.9 128.3 7.9 29.3 33.5 64 59 A L - 0 0 3 6,-2.1 6,-0.1 -2,-0.5 39,-0.1 -0.493 20.7-127.2 -68.7 142.3 7.3 32.8 34.6 65 60 A H S S+ 0 0 130 -2,-0.1 -1,-0.1 37,-0.1 5,-0.1 0.515 79.2 106.5 -71.8 -2.0 5.1 32.8 37.7 66 61 A Q - 0 0 35 3,-0.1 4,-0.1 1,-0.1 -2,-0.0 -0.300 67.7-141.8 -74.1 162.9 2.8 35.2 35.9 67 62 A E S S+ 0 0 178 2,-0.1 3,-0.2 1,-0.1 -1,-0.1 0.680 89.5 68.1 -95.9 -26.1 -0.6 34.2 34.6 68 63 A D S S- 0 0 122 1,-0.2 2,-0.2 2,-0.0 -1,-0.1 0.961 125.8 -21.5 -60.7 -60.9 -0.6 36.3 31.4 69 64 A N - 0 0 21 2,-0.0 -1,-0.2 -24,-0.0 -3,-0.1 -0.682 56.1-170.3-159.4 98.7 2.2 34.5 29.4 70 65 A D + 0 0 41 -3,-0.2 -6,-2.1 -2,-0.2 2,-0.4 0.213 48.8 123.0 -77.8 16.2 4.7 32.4 31.4 71 66 A Y E +A 63 0A 0 -8,-0.2 2,-0.3 -32,-0.1 -8,-0.1 -0.679 24.0 151.3 -89.8 128.8 6.9 32.0 28.4 72 67 A I E - 0 0 8 -10,-0.6 2,-1.6 -2,-0.4 -10,-0.3 -0.967 51.6-111.5-144.9 151.7 10.6 32.9 28.3 73 68 A N E S+ 0 0 0 -25,-0.4 17,-1.6 -2,-0.3 2,-0.3 -0.626 76.9 112.8 -87.9 78.2 13.4 31.4 26.3 74 69 A A E - B 0 89A 0 -2,-1.6 -12,-2.4 15,-0.2 2,-0.3 -0.985 48.1-155.6-148.2 141.5 15.3 29.9 29.2 75 70 A S E -AB 61 88A 0 13,-2.3 13,-2.2 -2,-0.3 2,-0.7 -0.892 17.2-125.5-122.6 150.8 15.9 26.3 30.1 76 71 A L E - B 0 87A 58 -16,-2.8 2,-0.7 -2,-0.3 11,-0.2 -0.844 21.3-165.7 -99.1 111.6 16.7 24.5 33.4 77 72 A I E - B 0 86A 0 9,-2.8 9,-2.2 -2,-0.7 2,-0.6 -0.854 8.8-172.2 -95.4 117.9 19.8 22.4 33.2 78 73 A K E - B 0 85A 95 -2,-0.7 2,-0.8 7,-0.2 7,-0.2 -0.929 10.4-172.1-118.4 115.5 19.9 20.1 36.2 79 74 A M E >> - B 0 84A 15 5,-2.3 5,-1.7 -2,-0.6 4,-0.9 -0.871 1.9-174.5-107.3 102.4 23.0 18.1 36.9 80 75 A E T >45S+ 0 0 120 -2,-0.8 3,-0.6 2,-0.2 -1,-0.2 0.951 80.5 46.5 -60.5 -56.3 22.3 15.6 39.7 81 76 A E T 345S+ 0 0 82 1,-0.3 -1,-0.2 2,-0.1 -2,-0.1 0.939 118.0 43.0 -56.1 -47.5 25.8 14.1 40.2 82 77 A A T 345S- 0 0 10 2,-0.1 -1,-0.3 1,-0.0 -2,-0.2 0.659 103.9-137.1 -71.9 -15.7 27.5 17.5 40.2 83 78 A Q T <<5 + 0 0 145 -4,-0.9 2,-0.3 -3,-0.6 -3,-0.2 0.926 61.7 115.0 58.8 46.7 24.7 18.8 42.4 84 79 A R E < -B 79 0A 42 -5,-1.7 -5,-2.3 2,-0.0 2,-0.4 -0.997 45.7-161.8-146.2 142.5 24.3 22.1 40.5 85 80 A S E -B 78 0A 34 -2,-0.3 131,-0.7 -7,-0.2 2,-0.3 -0.944 9.3-172.3-121.7 146.5 21.5 23.6 38.4 86 81 A Y E -Bc 77 216A 0 -9,-2.2 -9,-2.8 -2,-0.4 2,-0.5 -0.984 19.2-139.3-137.0 148.2 21.9 26.4 35.9 87 82 A I E -Bc 76 217A 0 129,-2.8 131,-3.2 -2,-0.3 2,-0.5 -0.923 19.4-162.8-104.3 128.7 19.4 28.5 33.9 88 83 A L E +Bc 75 218A 0 -13,-2.2 -13,-2.3 -2,-0.5 2,-0.3 -0.960 19.0 166.1-114.4 124.1 20.6 29.1 30.4 89 84 A T E -Bc 74 219A 3 129,-2.6 131,-0.8 -2,-0.5 -15,-0.2 -0.865 35.6-103.2-134.6 168.0 18.8 31.9 28.5 90 85 A Q - 0 0 6 -17,-1.6 132,-0.2 -2,-0.3 131,-0.2 -0.367 54.5 -82.8 -81.0 169.3 19.1 34.0 25.4 91 86 A G - 0 0 0 130,-2.2 -1,-0.1 34,-0.2 36,-0.1 -0.622 62.9 -99.1 -71.7 127.2 20.3 37.6 25.6 92 87 A P - 0 0 2 0, 0.0 35,-2.5 0, 0.0 -1,-0.1 -0.082 31.8-134.6 -49.2 145.2 17.2 39.6 26.5 93 88 A L > - 0 0 24 33,-0.2 3,-2.0 -45,-0.1 4,-0.4 -0.568 35.0 -98.5 -91.8 162.0 15.3 41.3 23.7 94 89 A P T 3 S+ 0 0 89 0, 0.0 3,-0.5 0, 0.0 4,-0.2 0.855 127.5 45.8 -53.0 -32.0 14.3 44.9 24.3 95 90 A N T 3 S+ 0 0 79 -48,-0.2 4,-0.2 1,-0.2 3,-0.1 0.424 109.4 54.6 -90.5 -0.9 10.8 43.5 25.2 96 91 A T S <> S+ 0 0 7 -3,-2.0 4,-2.6 2,-0.1 -1,-0.2 0.223 73.2 97.8-118.3 17.0 11.9 40.6 27.4 97 92 A C H > S+ 0 0 12 -3,-0.5 4,-2.2 -4,-0.4 5,-0.2 0.865 85.9 50.7 -70.5 -35.9 14.1 42.5 30.0 98 93 A G H > S+ 0 0 4 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.959 111.4 48.3 -63.7 -50.0 11.2 42.6 32.5 99 94 A H H > S+ 0 0 16 -4,-0.2 4,-3.1 2,-0.2 5,-0.2 0.940 108.2 55.5 -53.0 -51.8 10.7 38.8 32.0 100 95 A F H X S+ 0 0 2 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.928 113.5 40.0 -50.5 -50.8 14.5 38.2 32.4 101 96 A W H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.850 111.7 56.9 -70.3 -31.8 14.5 40.0 35.8 102 97 A E H X S+ 0 0 14 -4,-3.0 4,-3.2 2,-0.2 5,-0.2 0.960 108.5 48.0 -61.0 -46.5 11.2 38.5 36.8 103 98 A M H X S+ 0 0 0 -4,-3.1 4,-2.6 1,-0.2 6,-0.3 0.901 110.0 51.6 -59.4 -42.8 12.7 35.0 36.2 104 99 A V H <>S+ 0 0 0 -4,-2.0 5,-1.7 -5,-0.2 4,-0.4 0.914 114.2 44.2 -60.2 -43.6 15.8 36.0 38.3 105 100 A W H ><5S+ 0 0 28 -4,-2.5 3,-1.3 1,-0.2 -2,-0.2 0.967 116.2 44.9 -66.2 -54.0 13.5 37.1 41.1 106 101 A E H 3<5S+ 0 0 42 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.801 114.7 47.9 -61.6 -32.5 11.2 34.1 41.0 107 102 A Q T 3<5S- 0 0 44 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.472 107.0-128.8 -87.2 -1.4 14.1 31.6 40.7 108 103 A K T < 5 + 0 0 130 -3,-1.3 106,-2.6 -4,-0.4 -3,-0.2 0.741 42.4 175.8 61.3 27.6 15.8 33.3 43.6 109 104 A S B < -i 214 0B 4 -5,-1.7 -1,-0.2 -6,-0.3 107,-0.1 -0.308 25.5-168.2 -63.6 146.5 19.1 33.6 41.6 110 105 A R S S+ 0 0 49 104,-0.5 67,-2.7 98,-0.4 2,-0.4 0.628 70.3 43.7-103.9 -28.4 21.9 35.5 43.3 111 106 A G E -d 177 0A 0 97,-0.4 106,-2.4 103,-0.2 2,-0.4 -0.930 53.5-164.3-130.4 150.6 24.1 35.7 40.1 112 107 A V E -de 178 217A 0 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0.613 98.4-125.3 -98.1 -18.3 21.5 32.5 21.9 223 218 A G S S+ 0 0 0 -133,-0.1 -133,-0.1 -149,-0.0 -5,-0.1 0.785 89.4 76.5 78.7 27.2 22.3 30.8 25.3 224 219 A I S > S+ 0 0 10 40,-0.1 42,-2.8 3,-0.1 4,-0.6 0.605 85.8 44.6-133.3 -42.2 23.8 27.6 23.9 225 220 A G H > S+ 0 0 8 40,-0.3 4,-2.0 41,-0.2 41,-0.2 0.999 128.4 17.5 -72.3 -72.0 27.4 28.1 22.5 226 221 A R H > S+ 0 0 11 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.900 128.8 53.0 -68.3 -43.2 29.3 30.1 25.1 227 222 A S H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.893 111.2 47.5 -60.4 -39.8 26.7 29.4 27.8 228 223 A G H X S+ 0 0 0 -4,-0.6 4,-2.4 2,-0.2 5,-0.2 0.896 110.9 51.1 -68.2 -40.1 27.1 25.7 27.1 229 224 A T H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.939 111.1 47.6 -62.2 -48.6 30.9 26.0 27.2 230 225 A F H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.940 115.9 44.7 -56.1 -50.5 30.9 27.8 30.5 231 226 A C H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 5,-0.2 0.837 109.9 52.9 -69.6 -33.6 28.5 25.3 32.1 232 227 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.916 110.6 48.7 -67.2 -40.3 30.2 22.2 30.8 233 228 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.936 113.0 47.1 -64.0 -45.3 33.6 23.4 32.2 234 229 A D H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.973 114.1 46.4 -59.5 -57.0 32.1 24.2 35.7 235 230 A T H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.902 111.7 51.1 -54.2 -46.5 30.2 20.9 35.9 236 231 A C H X S+ 0 0 3 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.927 109.6 49.3 -61.8 -41.6 33.2 18.8 34.8 237 232 A L H X S+ 0 0 13 -4,-2.3 4,-0.8 2,-0.2 -1,-0.2 0.817 110.8 53.3 -64.1 -28.9 35.4 20.5 37.4 238 233 A L H >X S+ 0 0 24 -4,-1.8 4,-1.9 2,-0.2 3,-0.9 0.943 109.2 46.1 -69.4 -49.7 32.7 19.7 39.9 239 234 A L H 3X S+ 0 0 7 -4,-2.8 4,-2.2 1,-0.3 -2,-0.2 0.861 108.6 57.6 -62.5 -33.7 32.6 16.1 39.0 240 235 A M H 3< S+ 0 0 23 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.752 110.9 42.9 -68.3 -22.7 36.4 16.0 39.2 241 236 A D H << S+ 0 0 146 -3,-0.9 -2,-0.2 -4,-0.8 -1,-0.2 0.757 116.7 46.0 -92.4 -26.7 36.2 17.2 42.8 242 237 A K H < S+ 0 0 105 -4,-1.9 -2,-0.2 -5,-0.1 2,-0.2 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-0.895 76.3-117.3-163.0 128.9 18.7 22.6 26.1 263 258 A M T 3 S+ 0 0 47 -208,-0.5 -3,-0.1 -2,-0.3 -229,-0.1 -0.254 87.7 20.3 -63.8 148.2 19.6 22.2 22.4 264 259 A G T 3 + 0 0 11 1,-0.2 -1,-0.2 -5,-0.1 -36,-0.1 0.493 67.0 173.5 75.2 7.1 23.0 23.3 20.9 265 260 A L < + 0 0 1 -3,-0.8 -40,-0.3 -10,-0.1 -1,-0.2 -0.289 68.9 16.1 -53.4 119.5 25.1 23.4 24.1 266 261 A I S S- 0 0 0 -42,-2.8 -41,-0.2 -41,-0.2 -40,-0.1 0.788 73.0-156.5 76.7 109.1 28.7 24.1 22.7 267 262 A Q + 0 0 61 -79,-0.1 2,-0.3 1,-0.1 -42,-0.1 0.584 63.9 34.7 -95.9 -10.2 28.6 25.4 19.2 268 263 A T S >> S- 0 0 31 -43,-0.1 4,-1.5 -80,-0.1 3,-0.5 -0.984 72.5-120.2-143.3 155.5 32.1 24.5 17.7 269 264 A A H 3> S+ 0 0 25 -2,-0.3 4,-2.4 1,-0.3 5,-0.1 0.815 116.8 57.0 -62.8 -29.3 34.7 21.8 18.1 270 265 A D H 3> S+ 0 0 87 1,-0.2 4,-2.9 2,-0.2 -1,-0.3 0.854 103.9 52.1 -70.2 -32.3 37.1 24.5 19.3 271 266 A Q H <> S+ 0 0 1 -3,-0.5 4,-2.0 2,-0.2 -2,-0.2 0.824 109.8 49.6 -70.9 -31.7 34.7 25.4 22.1 272 267 A L H X S+ 0 0 0 -4,-1.5 4,-1.8 2,-0.2 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