==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-FEB-03 1NWL . COMPND 2 MOLECULE: PROTEIN-TYROSINE PHOSPHATASE, NON-RECEPTOR TYPE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.A.ERLANSON,R.S.MCDOWELL,M.M.HE,M.RANDAL,R.L.SIMMONS, . 283 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13419.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 201 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 13.8 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 . 30 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 29.3 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 1 0 0 0 1 0 1 1 2 0 0 0 0 0 2 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 1 0 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 1 A M > 0 0 44 0, 0.0 4,-1.1 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 154.8 35.5 49.2 58.7 2 2 A E H > + 0 0 125 1,-0.2 4,-1.1 2,-0.2 5,-0.1 0.615 360.0 60.8 -74.8 -14.3 37.9 51.8 57.2 3 3 A M H > S+ 0 0 16 2,-0.2 4,-2.0 1,-0.1 -1,-0.2 0.849 103.6 50.7 -74.6 -37.3 39.5 49.2 54.9 4 4 A E H > S+ 0 0 48 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.800 108.9 51.0 -69.1 -32.6 36.1 48.5 53.2 5 5 A K H X S+ 0 0 113 -4,-1.1 4,-1.3 2,-0.2 -1,-0.2 0.833 111.2 47.7 -73.9 -34.9 35.6 52.3 52.7 6 6 A E H X S+ 0 0 49 -4,-1.1 4,-1.9 2,-0.2 -2,-0.2 0.852 112.6 51.1 -67.9 -37.9 39.1 52.4 51.1 7 7 A F H X S+ 0 0 17 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.925 110.0 47.8 -62.6 -48.9 38.1 49.3 49.0 8 8 A E H X S+ 0 0 111 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.786 109.2 56.1 -64.4 -30.0 34.8 51.0 47.9 9 9 A Q H X S+ 0 0 140 -4,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.935 109.9 42.3 -66.9 -50.1 36.8 54.1 47.0 10 10 A I H X>S+ 0 0 7 -4,-1.9 5,-1.6 1,-0.2 4,-1.1 0.843 115.2 53.2 -65.8 -34.4 39.2 52.3 44.6 11 11 A D H <5S+ 0 0 67 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.922 110.7 44.3 -65.2 -47.8 36.3 50.3 43.2 12 12 A K H <5S+ 0 0 194 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.824 120.3 41.4 -67.6 -34.3 34.1 53.4 42.4 13 13 A S H <5S- 0 0 78 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.572 102.0-135.5 -89.8 -12.4 37.1 55.2 40.9 14 14 A G T <5 + 0 0 61 -4,-1.1 3,-0.3 -5,-0.2 -3,-0.2 0.883 57.7 137.6 60.0 44.8 38.4 52.1 39.1 15 15 A S >< + 0 0 36 -5,-1.6 4,-2.4 1,-0.2 5,-0.2 -0.036 20.3 119.3-111.8 29.8 42.1 52.7 40.1 16 16 A W H > S+ 0 0 26 -6,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.871 78.6 48.9 -62.6 -39.9 43.1 49.1 41.0 17 17 A A H > S+ 0 0 68 -3,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.848 111.8 49.7 -67.1 -36.5 45.8 49.0 38.3 18 18 A A H > S+ 0 0 53 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.888 111.6 47.4 -70.3 -41.3 47.2 52.4 39.5 19 19 A I H X S+ 0 0 33 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.894 112.6 49.8 -65.5 -42.0 47.3 51.3 43.2 20 20 A Y H X S+ 0 0 11 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.868 108.9 52.4 -64.6 -38.1 49.0 48.0 42.2 21 21 A Q H X S+ 0 0 96 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.856 104.8 56.4 -64.7 -37.9 51.5 49.9 40.1 22 22 A D H X S+ 0 0 83 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.915 109.8 44.5 -59.2 -46.3 52.3 52.1 43.1 23 23 A I H X S+ 0 0 2 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.924 111.7 53.7 -62.7 -46.3 53.1 49.0 45.2 24 24 A R H < S+ 0 0 122 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.864 112.6 43.9 -55.9 -41.2 55.2 47.6 42.3 25 25 A H H < S+ 0 0 162 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.863 116.6 45.6 -72.5 -39.3 57.2 50.8 42.1 26 26 A E H < S+ 0 0 119 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.698 89.4 118.6 -75.8 -20.8 57.7 51.1 45.9 27 27 A A S < S- 0 0 21 -4,-1.9 224,-0.1 -5,-0.1 225,-0.1 -0.071 71.7 -98.5 -56.4 144.9 58.6 47.4 46.2 28 28 A S - 0 0 32 223,-0.3 2,-0.4 229,-0.1 -1,-0.1 -0.191 28.7-153.4 -62.3 150.1 62.0 46.4 47.6 29 29 A D + 0 0 132 229,-0.1 226,-0.1 226,-0.0 -1,-0.0 -0.979 22.7 162.5-130.1 119.1 64.8 45.4 45.3 30 30 A F - 0 0 83 -2,-0.4 228,-0.1 2,-0.0 2,-0.0 -0.925 41.2 -89.2-133.6 155.0 67.5 43.0 46.6 31 31 A P - 0 0 58 0, 0.0 22,-2.4 0, 0.0 23,-0.4 -0.334 23.8-170.1 -66.0 146.3 70.2 40.9 44.9 32 32 A S > + 0 0 22 20,-0.3 4,-1.5 21,-0.1 20,-0.1 -0.460 31.6 145.9-128.3 55.7 69.5 37.2 43.9 33 33 A R H > + 0 0 180 1,-0.2 4,-0.9 2,-0.2 3,-0.2 0.904 69.0 49.1 -65.3 -47.0 73.1 36.2 43.1 34 34 A V H >4 S+ 0 0 32 1,-0.2 3,-0.6 2,-0.2 -1,-0.2 0.888 110.3 52.9 -61.8 -40.5 72.9 32.6 44.2 35 35 A A H 34 S+ 0 0 2 16,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.857 108.6 49.6 -61.1 -38.3 69.7 32.0 42.2 36 36 A K H 3< S+ 0 0 133 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.590 81.1 120.5 -83.0 -12.5 71.2 33.4 39.0 37 37 A L S X< S- 0 0 77 -4,-0.9 3,-1.9 -3,-0.6 4,-0.1 -0.273 71.4-125.4 -52.3 133.9 74.4 31.2 39.3 38 38 A P G > S+ 0 0 114 0, 0.0 3,-1.3 0, 0.0 4,-0.2 0.781 107.6 59.3 -59.8 -32.2 74.6 28.9 36.2 39 39 A K G 3 S+ 0 0 123 1,-0.2 3,-0.2 2,-0.1 -2,-0.1 0.651 104.3 53.0 -70.0 -15.2 74.8 25.7 38.2 40 40 A N G X S+ 0 0 0 -3,-1.9 3,-1.3 -6,-0.2 4,-0.3 0.251 76.4 103.5-102.4 9.8 71.4 26.5 39.7 41 41 A K G X S+ 0 0 168 -3,-1.3 3,-1.1 1,-0.3 -1,-0.2 0.877 81.0 49.0 -59.6 -42.1 69.6 27.1 36.3 42 42 A N G 3 S+ 0 0 89 -4,-0.2 -1,-0.3 -3,-0.2 48,-0.2 0.384 102.5 64.4 -82.2 3.4 67.8 23.7 36.5 43 43 A R G < S+ 0 0 32 -3,-1.3 25,-0.5 -8,-0.1 2,-0.4 0.416 92.6 77.1-101.5 -3.5 66.7 24.4 40.0 44 44 A N < - 0 0 29 -3,-1.1 3,-0.1 -4,-0.3 6,-0.1 -0.885 56.4-165.7-112.5 142.5 64.5 27.4 38.9 45 45 A R S S+ 0 0 51 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.863 79.0 28.8 -89.1 -44.5 61.2 27.3 37.2 46 46 A Y > - 0 0 81 3,-0.4 3,-0.8 171,-0.1 -1,-0.2 -0.953 65.0-141.4-124.0 142.9 61.0 30.9 36.0 47 47 A C T 3 S+ 0 0 106 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.772 104.6 46.5 -68.1 -29.2 63.8 33.3 35.0 48 48 A D T 3 S+ 0 0 134 1,-0.1 2,-0.5 2,-0.0 -1,-0.2 0.304 97.2 76.8-100.7 6.9 62.0 36.3 36.6 49 49 A V < + 0 0 14 -3,-0.8 -3,-0.4 2,-0.0 -4,-0.2 -0.814 61.5 154.1-119.6 90.4 61.0 34.6 39.9 50 50 A S - 0 0 12 -2,-0.5 208,-0.6 -6,-0.1 2,-0.4 -0.884 42.6-119.4-118.7 147.0 64.1 34.4 42.2 51 51 A P - 0 0 0 0, 0.0 -16,-0.4 0, 0.0 206,-0.1 -0.689 35.8-113.7 -77.9 134.1 64.6 34.3 45.9 52 52 A F > - 0 0 0 204,-0.5 4,-0.6 -2,-0.4 3,-0.3 -0.353 21.6-124.7 -59.1 146.6 66.6 37.2 47.4 53 53 A D T >4 S+ 0 0 36 -22,-2.4 3,-0.6 1,-0.2 -1,-0.1 0.885 106.9 55.3 -61.1 -40.9 70.0 36.1 48.8 54 54 A H T 34 S+ 0 0 108 -23,-0.4 -1,-0.2 1,-0.2 -22,-0.1 0.781 118.3 30.9 -68.5 -28.9 69.3 37.5 52.3 55 55 A S T 34 S+ 0 0 9 -3,-0.3 16,-3.3 201,-0.2 -1,-0.2 0.285 89.6 124.6-114.0 7.8 66.0 35.6 52.9 56 56 A R E << -A 70 0A 30 -4,-0.6 2,-0.4 -3,-0.6 14,-0.2 -0.389 62.1-119.2 -72.2 145.0 66.6 32.4 50.9 57 57 A I E - 0 0 8 12,-2.1 10,-0.5 10,-0.3 2,-0.5 -0.711 26.4-147.4 -81.6 132.0 66.3 29.0 52.6 58 58 A K E -A 66 0A 119 -2,-0.4 2,-0.2 8,-0.1 8,-0.2 -0.875 8.3-132.4-102.3 131.9 69.5 27.0 52.6 59 59 A L - 0 0 5 6,-2.2 2,-1.5 -2,-0.5 39,-0.1 -0.572 25.6-117.2 -74.5 145.5 69.6 23.2 52.3 60 60 A H S S+ 0 0 134 -2,-0.2 2,-0.4 37,-0.1 -1,-0.1 -0.312 79.7 106.6 -85.1 53.9 71.8 21.6 54.9 61 61 A Q - 0 0 53 -2,-1.5 -2,-0.1 1,-0.1 0, 0.0 -0.999 63.8-144.7-132.6 137.7 74.2 20.0 52.3 62 62 A E S S+ 0 0 204 -2,-0.4 3,-0.2 1,-0.1 -1,-0.1 0.681 92.7 63.7 -74.3 -20.0 77.7 21.2 51.5 63 63 A D S S- 0 0 135 1,-0.3 2,-0.4 2,-0.0 -1,-0.1 0.996 124.9 -13.3 -66.6 -78.7 77.4 20.4 47.8 64 64 A N - 0 0 11 1,-0.1 -1,-0.3 2,-0.1 -2,-0.1 -0.956 56.8-174.9-132.2 113.8 74.6 22.7 46.6 65 65 A D + 0 0 45 -2,-0.4 -6,-2.2 -3,-0.2 2,-0.3 0.285 45.0 125.3 -89.1 10.8 72.5 24.5 49.2 66 66 A Y E +A 58 0A 0 -8,-0.2 2,-0.3 -32,-0.1 -8,-0.1 -0.561 21.5 151.4 -87.4 132.9 70.2 26.1 46.7 67 67 A I E - 0 0 10 -10,-0.5 2,-1.9 -2,-0.3 -10,-0.3 -0.969 51.1-113.9-144.3 142.1 66.4 25.9 46.6 68 68 A N E S+ 0 0 0 -25,-0.5 17,-1.4 -2,-0.3 2,-0.3 -0.575 75.3 118.3 -74.0 82.7 64.0 28.5 45.1 69 69 A A E - B 0 84A 0 -2,-1.9 -12,-2.1 15,-0.2 2,-0.4 -0.986 45.9-156.5-152.6 141.1 62.4 29.4 48.5 70 70 A S E -AB 56 83A 0 13,-2.7 13,-2.4 -2,-0.3 2,-0.7 -0.957 15.5-134.4-124.4 136.7 62.2 32.5 50.7 71 71 A L E - B 0 82A 53 -16,-3.3 2,-0.8 -2,-0.4 11,-0.2 -0.810 18.0-162.2 -86.8 114.3 61.6 32.9 54.4 72 72 A I E - B 0 81A 0 9,-3.7 9,-2.2 -2,-0.7 2,-0.7 -0.887 8.0-168.3 -97.5 109.5 59.0 35.6 55.0 73 73 A K E - B 0 80A 126 -2,-0.8 2,-1.0 7,-0.2 7,-0.2 -0.871 7.1-164.9-106.0 106.4 59.4 36.7 58.7 74 74 A M E >> - B 0 79A 13 5,-3.0 5,-1.8 -2,-0.7 4,-1.0 -0.801 5.3-172.2 -94.6 100.0 56.5 38.8 59.9 75 75 A E T >45S+ 0 0 182 -2,-1.0 3,-0.6 2,-0.2 -1,-0.2 0.940 79.4 40.1 -56.4 -60.4 57.8 40.4 63.2 76 76 A E T 345S+ 0 0 87 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.869 119.1 45.7 -62.8 -41.3 54.7 42.1 64.5 77 77 A A T 345S- 0 0 4 2,-0.1 -1,-0.2 160,-0.0 -2,-0.2 0.615 102.6-133.4 -77.5 -13.2 52.3 39.3 63.6 78 78 A Q T <<5 + 0 0 145 -4,-1.0 2,-0.4 -3,-0.6 -3,-0.2 0.914 62.1 128.3 58.4 46.6 54.7 36.7 65.0 79 79 A R E < -B 74 0A 32 -5,-1.8 -5,-3.0 126,-0.0 2,-0.4 -0.994 40.9-165.0-136.9 139.4 54.3 34.5 61.9 80 80 A S E -B 73 0A 40 -2,-0.4 131,-0.8 124,-0.2 2,-0.3 -0.955 6.6-176.6-123.5 143.2 56.8 33.0 59.4 81 81 A Y E -Bc 72 211A 0 -9,-2.2 -9,-3.7 -2,-0.4 2,-0.6 -0.996 19.7-145.9-135.2 142.8 56.2 31.5 56.0 82 82 A I E -Bc 71 212A 0 129,-3.2 131,-3.6 -2,-0.3 2,-0.5 -0.957 19.0-165.2-101.1 118.9 58.4 29.7 53.4 83 83 A L E +Bc 70 213A 0 -13,-2.4 -13,-2.7 -2,-0.6 2,-0.3 -0.931 19.6 161.5-103.4 126.4 57.2 30.6 49.9 84 84 A T E -Bc 69 214A 2 129,-2.5 131,-0.6 -2,-0.5 -15,-0.2 -0.866 39.3 -96.5-136.6 167.5 58.6 28.4 47.2 85 85 A Q - 0 0 6 -17,-1.4 132,-0.2 -2,-0.3 131,-0.2 -0.500 54.1 -86.9 -77.7 155.2 58.0 27.4 43.6 86 86 A G - 0 0 0 130,-1.6 -1,-0.1 129,-0.5 130,-0.0 -0.520 65.6 -97.4 -56.0 124.6 56.0 24.2 42.8 87 87 A P - 0 0 1 0, 0.0 35,-1.9 0, 0.0 -1,-0.1 -0.081 34.4-132.8 -53.1 148.2 58.8 21.6 42.8 88 88 A L >> - 0 0 31 33,-0.1 3,-1.8 -45,-0.1 4,-0.9 -0.646 30.3-101.7 -96.0 158.0 60.5 20.5 39.6 89 89 A P T 34 S+ 0 0 100 0, 0.0 3,-0.3 0, 0.0 4,-0.2 0.828 127.4 44.0 -45.6 -36.1 61.1 16.9 38.6 90 90 A N T 34 S+ 0 0 108 -48,-0.2 4,-0.2 1,-0.2 3,-0.1 0.560 114.6 47.8 -87.4 -12.5 64.7 17.5 39.7 91 91 A T T <> S+ 0 0 7 -3,-1.8 4,-2.6 2,-0.1 -1,-0.2 0.306 75.7 100.8-114.1 8.9 64.0 19.4 42.9 92 92 A V H X S+ 0 0 25 -4,-0.9 4,-1.6 -3,-0.3 5,-0.1 0.875 88.0 47.2 -59.9 -39.4 61.3 17.1 44.5 93 93 A G H > S+ 0 0 0 2,-0.2 4,-1.8 -4,-0.2 -1,-0.2 0.874 111.3 51.1 -68.7 -38.9 64.0 15.7 46.9 94 94 A H H > S+ 0 0 16 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.910 106.7 55.8 -60.9 -44.5 65.3 19.2 47.7 95 95 A F H X S+ 0 0 2 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.899 111.1 41.6 -55.8 -47.7 61.7 20.3 48.5 96 96 A W H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.795 109.4 59.4 -76.2 -27.9 61.2 17.6 51.1 97 97 A E H X S+ 0 0 16 -4,-1.8 4,-3.1 2,-0.2 5,-0.2 0.920 107.6 47.1 -59.9 -45.4 64.7 18.1 52.4 98 98 A M H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 6,-0.3 0.927 109.4 52.7 -62.4 -47.4 63.7 21.7 53.2 99 99 A V H <>S+ 0 0 0 -4,-2.0 5,-1.7 1,-0.2 4,-0.4 0.911 115.3 43.0 -53.2 -44.4 60.4 20.5 54.8 100 100 A W H ><5S+ 0 0 20 -4,-2.3 3,-1.0 3,-0.2 -2,-0.2 0.958 117.0 43.4 -67.3 -52.9 62.4 18.2 57.0 101 101 A E H 3<5S+ 0 0 35 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.810 114.7 49.3 -67.1 -32.4 65.3 20.6 57.9 102 102 A Q T 3<5S- 0 0 47 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.495 107.1-126.9 -85.9 -4.2 63.0 23.6 58.5 103 103 A K T < 5 + 0 0 130 -3,-1.0 106,-2.3 -4,-0.4 -3,-0.2 0.799 43.4 177.3 63.2 32.5 60.8 21.4 60.8 104 104 A S B < -i 209 0B 2 -5,-1.7 -1,-0.2 -6,-0.3 107,-0.1 -0.355 23.5-171.6 -65.9 145.2 57.7 22.4 58.8 105 105 A R + 0 0 57 104,-0.5 67,-3.1 98,-0.4 2,-0.4 0.692 68.1 45.4-104.6 -34.3 54.4 20.8 59.8 106 106 A G E -d 172 0A 0 97,-0.5 106,-2.3 103,-0.2 2,-0.4 -0.890 55.5-162.8-120.2 143.5 52.2 22.0 56.9 107 107 A V E -de 173 212A 0 65,-3.0 67,-3.6 -2,-0.4 2,-0.5 -0.997 14.4-159.4-117.6 125.8 52.5 22.2 53.2 108 108 A V E -de 174 213A 0 104,-3.5 106,-2.4 -2,-0.4 2,-0.5 -0.938 7.0-172.1-110.5 119.5 50.1 24.6 51.4 109 109 A M E +de 175 214A 0 65,-3.3 67,-2.9 -2,-0.5 106,-0.2 -0.955 10.6 178.1-115.2 122.8 49.5 24.0 47.7 110 110 A L + 0 0 0 104,-2.2 2,-0.3 -2,-0.5 105,-0.2 0.191 60.9 59.8-112.9 15.4 47.4 26.6 45.9 111 111 A N S S- 0 0 1 103,-0.3 2,-0.3 104,-0.2 65,-0.1 -0.887 77.5-114.0-134.0 165.1 47.5 25.1 42.4 112 112 A R - 0 0 65 -2,-0.3 8,-0.3 67,-0.1 3,-0.1 -0.708 31.7-116.5 -92.9 154.4 46.6 21.9 40.5 113 113 A V S S+ 0 0 30 -2,-0.3 7,-2.4 1,-0.2 8,-1.1 0.885 108.6 34.1 -57.5 -39.1 49.3 19.7 39.1 114 114 A M E S+J 119 0C 103 5,-0.2 2,-0.3 6,-0.2 5,-0.2 -0.982 71.7 164.8-119.3 128.6 47.8 20.5 35.7 115 115 A E E > S+J 118 0C 9 3,-2.1 3,-1.8 -2,-0.5 -4,-0.0 -0.995 70.4 3.4-138.8 138.2 46.2 23.9 34.8 116 116 A K T 3 S- 0 0 111 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.839 129.0 -62.8 56.4 35.6 45.4 25.2 31.4 117 117 A G T 3 S+ 0 0 63 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.526 116.3 103.2 69.8 8.1 46.5 21.9 29.9 118 118 A S E < S-J 115 0C 64 -3,-1.8 -3,-2.1 0, 0.0 2,-0.6 -0.892 79.2-105.7-122.0 153.1 50.1 22.4 31.1 119 119 A L E +J 114 0C 124 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.1 -0.660 36.4 170.7 -78.4 115.5 52.1 20.9 34.0 120 120 A K + 0 0 50 -7,-2.4 2,-0.3 -2,-0.6 -34,-0.2 0.560 66.6 20.1 -96.1 -12.7 52.5 23.5 36.7 121 121 A C S S- 0 0 6 -8,-1.1 -1,-0.2 -36,-0.0 2,-0.2 -0.995 76.2-110.6-160.7 141.5 54.0 21.2 39.2 122 122 A A - 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0 0 2 -3,-0.2 -67,-0.1 -27,-0.1 5,-0.1 -0.555 65.8-112.0 -64.9 125.2 41.4 28.3 42.1 180 180 A P - 0 0 43 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.243 11.5-123.4 -63.8 147.8 40.2 29.2 38.6 181 181 A D S S+ 0 0 58 1,-0.1 2,-0.4 -3,-0.0 -2,-0.0 0.885 100.6 38.1 -54.5 -43.2 42.5 28.8 35.6 182 182 A F S S- 0 0 162 2,-0.1 -1,-0.1 0, 0.0 2,-0.1 -0.941 118.1 -23.3-116.7 133.2 42.0 32.5 34.7 183 183 A G S S- 0 0 47 -2,-0.4 83,-0.0 -4,-0.1 80,-0.0 -0.315 90.6 -48.2 76.0-153.3 41.7 35.4 37.2 184 184 A V - 0 0 27 1,-0.1 -2,-0.1 -5,-0.1 82,-0.1 -0.726 62.9 -82.0-116.5 164.6 40.7 35.2 40.8 185 185 A P - 0 0 17 0, 0.0 -1,-0.1 0, 0.0 -6,-0.1 -0.359 32.4-132.1 -62.9 148.4 37.8 33.5 42.7 186 186 A E S S+ 0 0 203 1,-0.2 -2,-0.0 2,-0.0 0, 0.0 0.896 93.7 31.5 -69.5 -42.7 34.4 35.4 42.7 187 187 A S > - 0 0 69 1,-0.1 3,-0.5 86,-0.0 4,-0.4 -0.958 66.7-149.8-118.5 136.2 33.9 34.9 46.5 188 188 A P T 3> S+ 0 0 5 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.462 75.8 100.3 -78.9 -1.3 36.8 34.7 49.0 189 189 A A H 3> S+ 0 0 58 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.867 83.4 42.8 -52.8 -47.8 34.6 32.4 51.2 190 190 A S H <> S+ 0 0 44 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.903 114.7 49.7 -67.5 -44.9 36.3 29.2 50.1 191 191 A F H > S+ 0 0 0 -4,-0.4 4,-2.4 2,-0.2 -2,-0.2 0.918 112.7 47.3 -60.0 -47.1 39.8 30.6 50.3 192 192 A L H X S+ 0 0 9 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.900 111.2 50.6 -63.0 -43.6 39.2 32.0 53.8 193 193 A N H X S+ 0 0 53 -4,-2.1 4,-1.7 -5,-0.3 -1,-0.2 0.871 109.8 51.3 -61.4 -38.6 37.7 28.7 55.0 194 194 A F H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.921 109.2 51.1 -60.5 -47.4 40.8 26.9 53.6 195 195 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 3,-0.3 0.940 108.5 50.7 -53.5 -52.3 43.0 29.4 55.5 196 196 A F H X S+ 0 0 23 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.841 107.8 54.5 -57.7 -35.6 41.1 28.7 58.8 197 197 A K H X S+ 0 0 63 -4,-1.7 4,-0.7 2,-0.2 -1,-0.2 0.866 109.1 46.4 -66.6 -39.6 41.5 24.9 58.2 198 198 A V H ><>S+ 0 0 0 -4,-1.8 5,-1.1 -3,-0.3 3,-0.8 0.924 114.0 49.8 -65.4 -45.8 45.3 25.4 57.9 199 199 A R H ><5S+ 0 0 49 -4,-2.7 3,-2.0 1,-0.2 5,-0.3 0.941 106.2 55.5 -53.7 -53.2 45.3 27.6 61.0 200 200 A E H 3<5S+ 0 0 145 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.655 99.9 61.3 -58.3 -21.7 43.2 25.0 63.0 201 201 A S T <<5S- 0 0 29 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.542 109.9-117.0 -84.7 -10.2 45.8 22.2 62.3 202 202 A G T X 5S+ 0 0 12 -3,-2.0 3,-1.1 -4,-0.3 -3,-0.1 0.500 79.2 125.8 83.9 5.9 48.6 24.0 64.1 203 203 A S T 3 S+ 0 0 9 40,-0.1 42,-1.8 3,-0.1 4,-0.7 0.539 82.0 50.3-138.4 -40.4 54.3 34.5 44.6 220 220 A G H > S+ 0 0 7 40,-0.2 4,-1.3 2,-0.2 41,-0.3 0.999 127.4 12.3 -74.1 -75.9 50.8 35.1 43.2 221 221 A R H > S+ 0 0 32 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.825 128.6 59.3 -71.7 -33.2 48.3 33.0 45.0 222 222 A S H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.885 103.5 51.4 -60.9 -41.6 51.0 32.2 47.7 223 223 A G H X S+ 0 0 1 -4,-0.7 4,-2.7 1,-0.2 -1,-0.2 0.898 107.8 52.8 -61.0 -43.1 51.3 35.9 48.4 224 224 A T H X S+ 0 0 0 -4,-1.3 4,-2.5 2,-0.2 5,-0.3 0.899 107.5 51.4 -59.2 -45.3 47.5 36.2 48.8 225 225 A F H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.936 116.0 39.5 -58.2 -50.7 47.5 33.3 51.4 226 226 A C H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.866 115.4 52.1 -70.4 -38.7 50.2 34.9 53.5 227 227 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 -5,-0.2 5,-0.2 0.921 111.8 45.4 -63.9 -47.1 49.0 38.5 53.2 228 228 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 -5,-0.2 5,-0.2 0.944 113.6 49.4 -61.7 -50.2 45.4 37.6 54.2 229 229 A D H X S+ 0 0 0 -4,-2.0 4,-2.0 -5,-0.3 -2,-0.2 0.888 114.2 44.7 -56.9 -44.8 46.5 35.5 57.2 230 230 A T H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.935 112.4 50.5 -68.2 -48.2 48.9 38.2 58.5 231 231 A C H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.900 112.9 46.9 -54.8 -45.0 46.4 41.1 58.1 232 232 A L H X S+ 0 0 3 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.889 111.7 50.5 -67.1 -41.2 43.7 39.1 59.9 233 233 A L H X S+ 0 0 36 -4,-2.0 4,-1.2 -5,-0.2 3,-0.4 0.890 109.7 51.3 -60.8 -41.9 46.1 38.2 62.7 234 234 A L H X S+ 0 0 7 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.856 104.5 55.9 -66.1 -37.5 47.2 41.8 63.1 235 235 A M H < S+ 0 0 17 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.764 109.9 47.7 -64.6 -26.7 43.6 43.0 63.4 236 236 A D H < S+ 0 0 102 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.754 118.3 40.7 -79.7 -29.2 43.2 40.6 66.3 237 237 A K H < S+ 0 0 108 -4,-1.2 -2,-0.2 -5,-0.1 -3,-0.2 0.878 98.4 82.0 -89.6 -44.7 46.4 41.8 67.9 238 238 A R S < S- 0 0 74 -4,-3.0 2,-0.7 -5,-0.1 6,-0.1 -0.268 77.0-122.5 -71.5 144.9 46.4 45.6 67.5 239 239 A K S S+ 0 0 207 1,-0.2 -1,-0.1 2,-0.1 4,-0.1 -0.829 106.6 27.5 -73.0 119.5 44.6 48.2 69.5 240 240 A D S > S- 0 0 99 -2,-0.7 3,-1.8 -5,-0.1 -1,-0.2 0.929 71.5-159.6 81.2 80.9 42.7 49.7 66.6 241 241 A P G > S+ 0 0 50 0, 0.0 3,-1.2 0, 0.0 -5,-0.1 0.711 88.7 70.8 -57.1 -23.4 42.1 47.0 64.0 242 242 A S G 3 S+ 0 0 68 1,-0.2 -2,-0.1 -7,-0.1 -7,-0.1 0.622 81.9 72.8 -69.8 -15.9 41.5 49.8 61.5 243 243 A S G < + 0 0 45 -3,-1.8 2,-0.7 -8,-0.1 -1,-0.2 0.557 68.8 109.7 -76.0 -9.4 45.2 50.7 61.6 244 244 A V < - 0 0 7 -3,-1.2 2,-0.7 -4,-0.1 3,-0.1 -0.595 53.6-164.9 -73.7 109.4 46.0 47.6 59.6 245 245 A D > - 0 0 39 -2,-0.7 4,-2.2 1,-0.2 3,-0.2 -0.882 9.4-161.8 -99.8 110.0 47.2 48.8 56.1 246 246 A I H > S+ 0 0 1 -2,-0.7 4,-2.7 1,-0.2 -1,-0.2 0.864 92.4 52.9 -58.2 -40.6 47.2 45.9 53.7 247 247 A K H > S+ 0 0 44 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.875 110.0 49.0 -62.2 -38.9 49.5 47.8 51.3 248 248 A K H > S+ 0 0 142 -3,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.876 111.8 48.1 -68.8 -39.6 51.9 48.4 54.1 249 249 A V H X S+ 0 0 9 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.916 111.2 51.2 -66.1 -44.1 51.9 44.7 55.1 250 250 A L H X S+ 0 0 1 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.915 109.2 49.7 -58.7 -46.4 52.4 43.7 51.5 251 251 A L H < S+ 0 0 33 -4,-2.1 4,-0.4 2,-0.2 -223,-0.3 0.835 109.8 51.9 -63.7 -33.8 55.4 46.0 51.1 252 252 A E H >< S+ 0 0 67 -4,-1.5 3,-0.8 1,-0.2 -1,-0.2 0.885 111.9 46.4 -66.7 -40.6 56.9 44.5 54.3 253 253 A M H >X S+ 0 0 0 -4,-2.2 3,-2.0 1,-0.2 4,-1.1 0.858 102.7 64.5 -66.9 -37.2 56.4 41.0 52.8 254 254 A R T 3< S+ 0 0 14 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.610 87.4 71.4 -64.6 -13.8 57.9 42.1 49.5 255 255 A K T <4 S+ 0 0 81 -3,-0.8 -1,-0.3 -4,-0.4 -2,-0.2 0.679 104.8 39.7 -70.5 -19.7 61.2 42.7 51.3 256 256 A F T <4 S+ 0 0 37 -3,-2.0 -204,-0.5 1,-0.3 2,-0.3 0.702 128.2 13.8-106.3 -27.7 61.5 38.9 51.6 257 257 A R S >< S- 0 0 0 -4,-1.1 3,-0.6 -206,-0.1 -1,-0.3 -0.972 75.9-118.5-152.7 139.6 60.3 37.7 48.3 258 258 A M T 3 S+ 0 0 75 -208,-0.6 -3,-0.1 -2,-0.3 -229,-0.1 -0.334 83.9 14.9 -73.7 151.8 59.6 39.4 44.9 259 259 A G T 3 + 0 0 11 1,-0.2 2,-0.3 -5,-0.1 -1,-0.2 0.565 65.9 169.3 68.8 15.4 56.3 39.6 43.1 260 260 A L S < S+ 0 0 0 -3,-0.6 -40,-0.2 -10,-0.1 -1,-0.2 -0.490 71.6 26.1 -60.7 125.0 53.9 38.6 45.9 261 261 A I S S- 0 0 0 -42,-1.8 -41,-0.2 -41,-0.3 -40,-0.1 0.780 76.1-162.2 71.9 108.0 50.5 39.5 44.4 262 262 A Q + 0 0 75 1,-0.1 2,-0.3 -42,-0.0 -42,-0.1 0.699 62.2 30.9 -97.6 -24.4 50.9 39.3 40.6 263 263 A T S > S- 0 0 65 -43,-0.1 4,-1.6 1,-0.1 3,-0.3 -0.900 75.2-115.6-132.6 162.8 47.9 41.3 39.3 264 264 A A H > S+ 0 0 23 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.808 118.9 56.6 -61.6 -32.6 45.6 44.2 40.3 265 265 A D H > S+ 0 0 77 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.792 103.9 52.3 -70.4 -30.5 42.8 41.6 40.5 266 266 A Q H > S+ 0 0 19 -3,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.856 109.4 49.6 -71.5 -36.9 44.8 39.5 43.0 267 267 A L H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.931 110.4 49.6 -64.5 -47.7 45.3 42.6 45.1 268 268 A R H X S+ 0 0 75 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.910 110.9 50.5 -56.8 -45.0 41.5 43.4 45.0 269 269 A F H X S+ 0 0 3 -4,-1.9 4,-2.9 2,-0.2 -1,-0.2 0.884 107.0 54.3 -59.0 -42.1 40.9 39.8 46.0 270 270 A S H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.924 108.6 48.6 -58.5 -47.9 43.3 40.1 48.9 271 271 A Y H X S+ 0 0 0 -4,-2.3 4,-3.3 2,-0.2 -2,-0.2 0.960 113.1 47.3 -52.3 -56.5 41.3 43.2 50.1 272 272 A L H X S+ 0 0 34 -4,-2.4 4,-2.9 1,-0.2 5,-0.3 0.866 111.0 52.5 -54.8 -42.6 38.1 41.3 49.8 273 273 A A H X S+ 0 0 0 -4,-2.9 4,-2.1 2,-0.2 -1,-0.2 0.917 113.6 42.1 -60.7 -46.4 39.6 38.3 51.6 274 274 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.935 116.0 49.2 -67.3 -46.7 40.7 40.4 54.5 275 275 A I H X S+ 0 0 1 -4,-3.3 4,-1.7 1,-0.2 -2,-0.2 0.933 117.8 39.2 -57.1 -51.2 37.5 42.4 54.7 276 276 A E H X S+ 0 0 78 -4,-2.9 4,-0.5 -5,-0.2 -1,-0.2 0.830 114.8 54.3 -69.8 -34.2 35.3 39.2 54.6 277 277 A G H X S+ 0 0 0 -4,-2.1 4,-0.7 -5,-0.3 3,-0.4 0.836 107.8 49.4 -68.0 -35.5 37.7 37.4 56.9 278 278 A A H >X S+ 0 0 5 -4,-2.3 4,-2.8 1,-0.2 3,-1.0 0.896 105.0 58.4 -68.3 -41.3 37.5 40.1 59.5 279 279 A K H 3< S+ 0 0 63 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.622 100.2 58.7 -64.2 -16.1 33.6 40.1 59.3 280 280 A F H 3< S+ 0 0 144 -4,-0.5 -1,-0.3 -3,-0.4 -2,-0.2 0.771 115.6 33.2 -80.9 -29.4 33.8 36.4 60.3 281 281 A I H << S+ 0 0 79 -3,-1.0 -2,-0.2 -4,-0.7 -3,-0.1 0.723 125.6 41.4 -97.2 -28.1 35.6 37.2 63.5 282 282 A M < 0 0 104 -4,-2.8 -3,-0.2 -5,-0.1 -2,-0.1 0.157 360.0 360.0-105.5 16.6 33.9 40.6 64.2 283 283 A G 0 0 94 -5,-0.2 -4,-0.1 -4,-0.1 -1,-0.0 -0.110 360.0 360.0 68.7 360.0 30.4 39.6 63.2