==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-MAY-06 2H4G . COMPND 2 MOLECULE: TYROSINE-PROTEIN PHOSPHATASE NON-RECEPTOR TYPE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.XU,Z.-K.WAN . 297 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13631.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 214 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 4.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 12.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.0 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 . 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 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 29.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 3.0 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 3 1 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 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 . 1 1 1 0 0 1 0 0 1 1 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 2 A E > 0 0 80 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 130.4 69.6 16.2 21.3 2 3 A M H > + 0 0 6 238,-0.2 4,-1.7 1,-0.2 272,-0.1 0.772 360.0 56.7 -72.1 -26.5 66.9 16.9 18.7 3 4 A E H > S+ 0 0 93 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.865 106.9 46.7 -74.9 -37.7 68.5 20.2 17.8 4 5 A K H > S+ 0 0 149 2,-0.2 4,-1.2 1,-0.2 -2,-0.2 0.922 113.7 49.2 -68.9 -43.4 71.9 18.8 16.9 5 6 A E H X S+ 0 0 40 -4,-1.7 4,-1.9 1,-0.2 5,-0.2 0.851 106.9 57.7 -62.8 -36.8 70.2 16.0 14.9 6 7 A F H X S+ 0 0 15 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.947 109.3 42.0 -59.9 -50.4 68.1 18.7 13.1 7 8 A E H X S+ 0 0 124 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.665 111.2 57.8 -72.8 -16.2 71.2 20.6 11.9 8 9 A Q H X S+ 0 0 107 -4,-1.2 4,-1.5 2,-0.2 -1,-0.2 0.842 111.5 40.6 -79.3 -36.2 72.9 17.4 11.0 9 10 A I H <>S+ 0 0 4 -4,-1.9 5,-2.0 -3,-0.2 -2,-0.2 0.804 115.1 53.5 -78.7 -33.1 70.0 16.4 8.6 10 11 A D H ><5S+ 0 0 66 -4,-1.9 3,-0.6 -5,-0.2 -2,-0.2 0.851 110.9 44.5 -70.5 -38.4 69.8 20.0 7.4 11 12 A K H 3<5S+ 0 0 154 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.912 115.8 46.4 -73.4 -43.7 73.4 20.2 6.5 12 13 A S T 3<5S- 0 0 65 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.296 105.2-134.3 -81.5 12.6 73.4 16.8 4.8 13 14 A G T < 5 + 0 0 66 -3,-0.6 -3,-0.2 1,-0.1 3,-0.2 0.802 60.6 132.2 36.8 48.9 70.2 17.7 3.0 14 15 A S >< + 0 0 33 -5,-2.0 4,-1.6 1,-0.1 -1,-0.1 -0.312 10.7 121.7-125.3 54.1 68.5 14.4 3.8 15 16 A W H > S+ 0 0 25 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.864 78.5 57.4 -78.3 -33.6 65.0 15.0 5.1 16 17 A A H > S+ 0 0 64 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.920 109.1 45.3 -58.9 -46.2 63.5 13.0 2.3 17 18 A A H > S+ 0 0 52 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.910 113.4 48.9 -65.5 -45.0 65.6 10.0 3.3 18 19 A I H X S+ 0 0 27 -4,-1.6 4,-1.3 1,-0.2 -2,-0.2 0.927 113.8 47.2 -61.2 -44.7 64.8 10.4 7.0 19 20 A Y H X S+ 0 0 9 -4,-2.9 4,-1.9 1,-0.2 3,-0.2 0.904 110.8 50.8 -64.4 -43.1 61.1 10.7 6.3 20 21 A Q H X S+ 0 0 89 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.819 104.7 58.2 -65.6 -30.8 61.0 7.7 3.9 21 22 A D H X S+ 0 0 85 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.883 106.1 49.1 -65.9 -35.7 62.8 5.6 6.6 22 23 A I H X S+ 0 0 4 -4,-1.3 4,-1.5 -3,-0.2 -2,-0.2 0.899 110.4 51.0 -68.8 -38.7 59.9 6.3 8.9 23 24 A R H < S+ 0 0 127 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.884 110.8 48.8 -65.1 -38.0 57.5 5.3 6.2 24 25 A H H < S+ 0 0 160 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.849 117.3 40.6 -70.0 -35.2 59.3 2.1 5.6 25 26 A E H < S+ 0 0 121 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.589 88.4 120.8 -89.3 -13.9 59.4 1.2 9.4 26 27 A A S < S- 0 0 23 -4,-1.5 224,-0.1 -5,-0.1 228,-0.1 -0.136 71.7 -95.0 -55.4 147.7 55.9 2.4 10.2 27 28 A S - 0 0 39 223,-0.3 2,-0.4 229,-0.1 -1,-0.1 -0.163 31.8-155.6 -60.2 154.7 53.4 -0.1 11.6 28 29 A D + 0 0 150 229,-0.1 226,-0.1 226,-0.0 -1,-0.0 -0.917 21.2 163.8-139.7 107.4 51.0 -2.0 9.3 29 30 A F - 0 0 82 -2,-0.4 2,-0.1 1,-0.0 228,-0.1 -0.865 41.9 -90.0-122.7 158.0 47.7 -3.3 10.8 30 31 A P - 0 0 89 0, 0.0 22,-2.5 0, 0.0 23,-0.4 -0.385 22.4-166.8 -70.2 144.3 44.5 -4.6 9.2 31 32 A C > + 0 0 18 20,-0.3 4,-1.4 1,-0.1 3,-0.1 -0.340 34.0 147.4-121.1 43.7 41.7 -2.1 8.4 32 33 A R T 4 + 0 0 165 1,-0.2 3,-0.4 2,-0.2 4,-0.1 0.882 68.3 46.9 -48.7 -52.4 39.2 -4.8 7.8 33 34 A V T >4 S+ 0 0 20 1,-0.2 3,-1.6 2,-0.2 -1,-0.2 0.901 109.2 54.3 -61.0 -42.5 36.1 -3.0 9.1 34 35 A A T 34 S+ 0 0 1 16,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.792 107.7 52.5 -61.9 -28.4 36.9 0.2 7.2 35 36 A K T 3< S+ 0 0 121 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.320 78.8 123.6 -91.9 6.2 37.1 -1.8 4.0 36 37 A L S X S- 0 0 49 -3,-1.6 3,-2.6 -4,-0.1 4,-0.2 -0.476 71.8-121.8 -68.2 137.0 33.6 -3.4 4.4 37 38 A P G > S+ 0 0 116 0, 0.0 3,-1.5 0, 0.0 4,-0.3 0.835 111.1 59.1 -48.1 -37.7 31.4 -2.7 1.4 38 39 A K G 3 S+ 0 0 125 1,-0.3 3,-0.2 2,-0.1 -2,-0.1 0.643 104.1 51.5 -70.4 -12.7 28.8 -1.1 3.6 39 40 A N G X S+ 0 0 0 -3,-2.6 3,-1.6 -6,-0.2 4,-0.3 0.211 74.4 106.9-106.9 14.7 31.3 1.5 4.8 40 41 A K G X S+ 0 0 174 -3,-1.5 3,-1.1 1,-0.3 -1,-0.2 0.926 82.9 46.2 -58.3 -44.1 32.4 2.6 1.4 41 42 A N G 3 S+ 0 0 100 -4,-0.3 -1,-0.3 1,-0.2 48,-0.2 0.268 100.8 67.7 -84.2 12.6 30.6 5.9 1.7 42 43 A R G < S+ 0 0 24 -3,-1.6 25,-0.6 -8,-0.2 2,-0.4 0.375 89.1 77.9-108.0 2.1 31.8 6.5 5.2 43 44 A N < - 0 0 25 -3,-1.1 3,-0.1 -4,-0.3 6,-0.1 -0.945 57.7-165.7-115.9 129.4 35.4 7.0 4.0 44 45 A R S S+ 0 0 48 -2,-0.4 2,-0.5 1,-0.2 -1,-0.1 0.875 83.7 36.6 -77.5 -39.3 36.6 10.2 2.3 45 46 A Y > - 0 0 76 3,-0.4 3,-1.4 1,-0.1 -1,-0.2 -0.965 67.2-150.1-122.0 126.8 39.8 8.6 1.0 46 47 A R T 3 S+ 0 0 187 -2,-0.5 -1,-0.1 1,-0.3 -2,-0.0 0.864 101.1 46.5 -58.4 -38.4 40.1 5.1 -0.3 47 48 A D T 3 S+ 0 0 118 1,-0.1 2,-0.5 2,-0.0 -1,-0.3 0.331 101.1 73.3 -89.7 6.3 43.7 4.9 0.8 48 49 A V < + 0 0 17 -3,-1.4 -3,-0.4 2,-0.0 -4,-0.2 -0.894 60.8 149.2-126.5 103.4 43.2 6.3 4.3 49 50 A S - 0 0 3 -2,-0.5 208,-0.5 -6,-0.1 2,-0.2 -0.932 45.2-107.5-133.7 155.7 41.5 4.1 6.8 50 51 A P - 0 0 0 0, 0.0 -16,-0.4 0, 0.0 206,-0.1 -0.572 37.8-113.7 -80.5 140.9 41.6 3.5 10.6 51 52 A F > - 0 0 0 204,-0.4 4,-0.8 -2,-0.2 3,-0.4 -0.443 23.9-124.4 -68.1 149.7 43.2 0.3 11.9 52 53 A D T 4 S+ 0 0 37 -22,-2.5 3,-0.5 1,-0.2 -1,-0.1 0.884 106.7 57.8 -64.4 -37.3 40.7 -2.1 13.5 53 54 A H T 4 S+ 0 0 103 -23,-0.4 -1,-0.2 1,-0.2 -22,-0.1 0.813 118.7 27.5 -66.0 -29.7 42.6 -2.2 16.8 54 55 A S T 4 S+ 0 0 9 -3,-0.4 16,-3.0 201,-0.1 -1,-0.2 0.315 89.7 125.2-115.2 8.8 42.5 1.5 17.4 55 56 A R B < -A 69 0A 29 -4,-0.8 2,-0.6 -3,-0.5 14,-0.2 -0.318 64.1-114.9 -70.0 151.7 39.4 2.6 15.6 56 57 A I - 0 0 9 12,-2.1 2,-0.5 10,-0.4 10,-0.3 -0.776 28.6-146.8 -88.8 122.0 36.6 4.6 17.4 57 58 A K - 0 0 118 -2,-0.6 8,-0.2 8,-0.1 2,-0.2 -0.787 9.5-131.7 -94.5 128.1 33.4 2.6 17.6 58 59 A L - 0 0 4 6,-2.5 2,-1.8 -2,-0.5 39,-0.1 -0.518 25.4-118.3 -72.1 143.5 30.1 4.4 17.6 59 60 A H S S+ 0 0 129 -2,-0.2 2,-0.3 37,-0.1 -1,-0.1 -0.428 77.6 102.5 -84.1 63.3 27.8 3.3 20.4 60 61 A Q - 0 0 55 -2,-1.8 -2,-0.1 1,-0.1 0, 0.0 -0.979 66.2-138.6-143.2 156.1 25.1 2.0 18.1 61 62 A E S S+ 0 0 199 -2,-0.3 3,-0.2 2,-0.1 -1,-0.1 0.846 93.9 63.8 -82.9 -36.6 23.9 -1.4 16.9 62 63 A D S S- 0 0 129 1,-0.2 2,-0.4 2,-0.0 -1,-0.1 0.973 126.8 -21.5 -50.4 -75.5 23.1 -0.5 13.3 63 64 A N - 0 0 13 2,-0.1 -1,-0.2 1,-0.0 -2,-0.1 -0.960 54.8-170.1-143.4 119.4 26.6 0.4 12.1 64 65 A D + 0 0 52 -2,-0.4 -6,-2.5 -3,-0.2 2,-0.3 0.226 47.6 122.0 -96.0 15.6 29.4 1.4 14.5 65 66 A Y + 0 0 0 -8,-0.2 2,-0.3 -32,-0.1 -8,-0.1 -0.580 23.3 152.3 -89.8 142.2 31.9 2.6 11.9 66 67 A I - 0 0 10 -10,-0.3 2,-2.0 -2,-0.3 -10,-0.4 -0.946 50.7-110.6-158.8 138.3 33.5 6.0 11.6 67 68 A N S S+ 0 0 1 -25,-0.6 17,-1.8 -2,-0.3 2,-0.3 -0.537 76.8 112.7 -76.4 84.8 36.9 6.9 10.0 68 69 A A E - B 0 83A 0 -2,-2.0 -12,-2.1 15,-0.2 2,-0.4 -0.976 47.9-154.8-155.6 141.6 38.6 7.9 13.3 69 70 A S E -AB 55 82A 0 13,-2.7 13,-2.1 -2,-0.3 2,-0.8 -0.935 17.0-131.7-122.8 143.3 41.5 6.5 15.4 70 71 A L E - B 0 81A 40 -16,-3.0 2,-1.1 -2,-0.4 11,-0.2 -0.833 18.3-159.5 -94.6 108.7 42.3 6.8 19.1 71 72 A I E - B 0 80A 0 9,-3.0 9,-1.5 -2,-0.8 2,-1.0 -0.772 12.3-171.5 -88.0 99.1 45.9 7.8 19.4 72 73 A K E - B 0 79A 118 -2,-1.1 2,-1.2 7,-0.2 7,-0.2 -0.768 8.5-164.0 -99.6 96.8 46.7 6.7 22.9 73 74 A M E >> - B 0 78A 11 5,-1.7 4,-1.8 -2,-1.0 5,-1.0 -0.664 6.4-172.8 -81.1 100.1 50.1 7.9 24.0 74 75 A E T 45S+ 0 0 160 -2,-1.2 -1,-0.2 2,-0.2 5,-0.0 0.925 79.1 39.7 -58.3 -56.1 50.8 5.8 27.1 75 76 A E T 45S+ 0 0 127 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.923 120.0 45.0 -63.2 -47.1 54.1 7.4 28.3 76 77 A A T 45S- 0 0 3 2,-0.1 -1,-0.2 1,-0.1 -2,-0.2 0.784 100.7-141.1 -67.6 -28.8 53.0 10.9 27.6 77 78 A Q T <5 + 0 0 145 -4,-1.8 2,-0.3 1,-0.3 -3,-0.2 0.808 60.6 111.1 70.1 33.8 49.6 10.2 29.1 78 79 A R E < -B 73 0A 46 -5,-1.0 -5,-1.7 2,-0.0 2,-0.3 -0.968 48.4-157.3-133.8 148.7 47.5 12.2 26.6 79 80 A S E -B 72 0A 32 -2,-0.3 131,-0.9 -7,-0.2 2,-0.3 -0.917 7.1-173.9-126.3 154.5 45.1 10.9 23.9 80 81 A Y E -Bc 71 210A 0 -9,-1.5 -9,-3.0 -2,-0.3 2,-0.7 -0.975 21.2-137.1-142.3 151.1 43.8 12.4 20.7 81 82 A I E -Bc 70 211A 0 129,-2.5 131,-3.1 -2,-0.3 2,-0.6 -0.949 20.3-160.0-112.8 109.9 41.2 11.2 18.3 82 83 A L E +Bc 69 212A 0 -13,-2.1 -13,-2.7 -2,-0.7 2,-0.3 -0.819 23.9 168.6 -94.1 122.8 42.4 11.7 14.8 83 84 A T E -B 68 0A 3 129,-2.2 131,-0.3 -2,-0.6 -15,-0.2 -0.964 38.3 -92.4-137.5 142.2 39.6 11.7 12.3 84 85 A Q - 0 0 7 -17,-1.8 132,-0.2 -2,-0.3 131,-0.2 -0.254 48.6-106.3 -23.4 122.5 38.5 12.4 8.8 85 86 A G - 0 0 0 130,-1.0 -41,-0.1 34,-0.2 -1,-0.1 -0.566 62.6 -94.5 -43.4 133.1 37.1 15.7 8.2 86 87 A P - 0 0 2 0, 0.0 35,-2.6 0, 0.0 -1,-0.1 -0.194 31.3-133.9 -86.4 157.0 33.5 14.7 7.9 87 88 A L >> - 0 0 24 33,-0.2 3,-1.4 -45,-0.1 4,-0.7 -0.529 35.2 -99.5 -99.7 166.6 31.3 13.8 4.9 88 89 A P T 34 S+ 0 0 115 0, 0.0 3,-0.3 0, 0.0 4,-0.2 0.857 125.5 41.4 -53.4 -34.4 27.8 15.1 4.2 89 90 A N T 34 S+ 0 0 69 -48,-0.2 4,-0.2 1,-0.2 3,-0.1 0.469 112.6 52.9 -93.4 -4.4 26.4 11.7 5.5 90 91 A T T <> S+ 0 0 6 -3,-1.4 4,-2.9 2,-0.1 -1,-0.2 0.347 72.4 98.8-114.6 8.0 28.8 11.3 8.5 91 92 A C H X S+ 0 0 11 -4,-0.7 4,-2.0 -3,-0.3 5,-0.2 0.873 87.2 51.2 -61.6 -35.5 28.3 14.7 10.3 92 93 A G H > S+ 0 0 3 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.911 110.4 48.2 -66.5 -41.9 25.9 13.0 12.7 93 94 A H H > S+ 0 0 13 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.914 108.3 57.0 -62.4 -43.2 28.4 10.2 13.4 94 95 A F H X S+ 0 0 2 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.922 112.0 38.9 -55.2 -50.3 31.1 12.8 14.0 95 96 A W H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.764 110.7 60.2 -74.9 -22.5 29.1 14.5 16.7 96 97 A E H X S+ 0 0 14 -4,-1.8 4,-3.1 2,-0.2 5,-0.2 0.937 107.7 46.4 -66.4 -44.0 27.9 11.2 18.1 97 98 A M H X S+ 0 0 0 -4,-2.6 4,-3.2 1,-0.2 6,-0.3 0.931 109.2 53.8 -61.7 -47.3 31.6 10.3 18.6 98 99 A V H <>S+ 0 0 1 -4,-2.0 5,-1.6 1,-0.2 4,-0.4 0.884 114.5 42.6 -56.2 -39.1 32.3 13.7 20.2 99 100 A W H ><5S+ 0 0 28 -4,-2.0 3,-1.1 3,-0.2 -2,-0.2 0.970 116.3 44.9 -72.6 -53.6 29.5 13.1 22.6 100 101 A E H 3<5S+ 0 0 37 -4,-3.1 -2,-0.2 1,-0.3 -3,-0.2 0.868 115.7 47.0 -59.7 -37.8 30.2 9.4 23.4 101 102 A Q T 3<5S- 0 0 46 -4,-3.2 -1,-0.3 -5,-0.2 -2,-0.2 0.563 106.4-129.1 -81.7 -7.9 33.9 10.0 23.8 102 103 A K T < 5 + 0 0 130 -3,-1.1 106,-2.7 -4,-0.4 -3,-0.2 0.810 42.5 172.6 65.2 34.8 33.3 13.0 26.0 103 104 A S < - 0 0 4 -5,-1.6 -1,-0.2 -6,-0.3 107,-0.1 -0.399 24.1-168.4 -73.5 149.8 35.6 15.4 24.1 104 105 A R + 0 0 49 104,-0.5 67,-2.9 98,-0.4 2,-0.3 0.581 68.7 44.4-110.7 -18.1 35.6 19.1 25.0 105 106 A G E -d 171 0A 0 97,-0.3 106,-2.3 65,-0.2 2,-0.4 -0.961 54.7-163.9-134.1 149.8 37.6 20.4 22.0 106 107 A V E -de 172 211A 0 65,-2.4 67,-3.0 -2,-0.3 2,-0.7 -0.998 12.1-158.1-128.3 124.3 37.7 19.9 18.2 107 108 A V E -de 173 212A 0 104,-3.0 106,-2.5 -2,-0.4 2,-0.6 -0.896 6.0-167.3-109.1 107.3 40.7 21.1 16.4 108 109 A M E +de 174 213A 0 65,-2.2 67,-3.1 -2,-0.7 106,-0.2 -0.838 9.6 178.8 -98.9 120.7 40.1 21.8 12.7 109 110 A L + 0 0 0 104,-2.5 2,-0.2 -2,-0.6 69,-0.2 0.320 59.7 56.5-106.8 5.1 43.3 22.2 10.7 110 111 A N S S- 0 0 1 103,-0.4 2,-0.3 104,-0.2 65,-0.1 -0.748 77.5-113.1-129.7 175.8 41.8 22.7 7.2 111 112 A R - 0 0 118 -2,-0.2 8,-0.3 67,-0.2 3,-0.1 -0.798 31.7-116.1-107.6 152.9 39.4 24.9 5.4 112 113 A V S S+ 0 0 31 -2,-0.3 7,-1.2 1,-0.2 8,-1.0 0.911 107.0 38.0 -56.3 -41.3 36.1 23.6 4.1 113 114 A M E S+I 118 0B 95 5,-0.2 2,-0.4 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9 40,-0.2 4,-2.0 41,-0.2 5,-0.1 0.967 127.0 13.6 -72.5 -82.4 49.0 15.0 7.4 220 221 A R H > S+ 0 0 9 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.888 129.6 55.8 -60.9 -42.0 48.3 18.2 9.3 221 222 A S H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.882 109.0 47.2 -59.2 -40.2 46.6 16.4 12.1 222 223 A G H > S+ 0 0 0 -4,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.898 109.9 52.6 -68.2 -40.5 49.6 14.2 12.7 223 224 A T H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.875 110.3 49.0 -62.2 -39.3 52.0 17.2 12.6 224 225 A F H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.923 113.8 44.6 -68.2 -45.3 49.8 18.9 15.3 225 226 A C H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.867 109.8 54.9 -69.0 -37.1 49.7 15.8 17.6 226 227 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.960 109.1 47.3 -61.5 -49.9 53.4 15.0 17.2 227 228 A A H X S+ 0 0 0 -4,-1.7 4,-1.9 -5,-0.2 -1,-0.2 0.907 114.5 47.9 -57.8 -43.3 54.5 18.5 18.3 228 229 A D H X S+ 0 0 0 -4,-1.8 4,-2.9 2,-0.2 5,-0.2 0.967 112.8 45.5 -63.4 -54.8 52.1 18.4 21.3 229 230 A T H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.890 112.7 52.2 -56.4 -42.4 53.1 15.0 22.5 230 231 A C H X S+ 0 0 0 -4,-2.6 4,-1.9 -5,-0.3 -1,-0.2 0.889 111.8 45.6 -63.0 -39.6 56.8 15.8 22.2 231 232 A L H X S+ 0 0 0 -4,-1.9 4,-1.7 -5,-0.2 -2,-0.2 0.931 112.9 50.2 -69.6 -43.9 56.4 19.0 24.2 232 233 A L H X S+ 0 0 20 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.859 109.5 52.8 -62.2 -35.4 54.3 17.3 26.9 233 234 A L H X S+ 0 0 5 -4,-2.3 4,-1.4 -5,-0.2 5,-0.2 0.981 113.4 39.7 -65.3 -56.3 57.0 14.5 27.1 234 235 A M H X>S+ 0 0 0 -4,-1.9 4,-1.5 1,-0.2 5,-1.3 0.768 114.1 58.3 -64.5 -22.4 59.9 16.8 27.7 235 236 A D H <5S+ 0 0 42 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.921 102.7 51.3 -72.2 -41.6 57.6 18.9 29.9 236 237 A K H <5S+ 0 0 102 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.798 124.4 29.4 -63.3 -31.1 56.9 15.9 32.2 237 238 A R H <5S- 0 0 93 -4,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.547 96.5-135.6-105.2 -11.5 60.6 15.3 32.6 238 239 A K T <5S+ 0 0 117 -4,-1.5 -3,-0.2 -5,-0.2 -4,-0.1 0.920 72.3 117.3 52.2 43.5 61.8 18.9 32.1 239 240 A D > < - 0 0 70 -5,-1.3 3,-1.8 -6,-0.1 -1,-0.1 -0.732 46.2-174.0-144.9 90.4 64.4 17.3 29.9 240 241 A P G > S+ 0 0 28 0, 0.0 3,-1.2 0, 0.0 -238,-0.2 0.823 84.6 60.9 -51.9 -37.8 64.4 18.3 26.2 241 242 A S G 3 S+ 0 0 67 1,-0.3 -7,-0.0 -240,-0.1 -2,-0.0 0.625 89.9 69.4 -69.0 -14.7 67.2 15.8 25.4 242 243 A S G < S+ 0 0 42 -3,-1.8 2,-0.6 -8,-0.1 -1,-0.3 0.245 81.1 94.7 -89.3 14.5 65.1 12.8 26.5 243 244 A V < - 0 0 8 -3,-1.2 2,-0.8 -9,-0.0 -241,-0.1 -0.925 53.3-168.2-114.1 118.1 62.7 13.2 23.6 244 245 A D > - 0 0 61 -2,-0.6 4,-2.3 1,-0.2 5,-0.2 -0.879 5.3-166.8-102.4 103.6 63.2 11.2 20.3 245 246 A I H > S+ 0 0 1 -2,-0.8 4,-2.2 1,-0.2 -1,-0.2 0.893 85.7 46.9 -57.6 -47.8 60.8 12.8 17.8 246 247 A K H > S+ 0 0 60 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.909 112.7 50.9 -63.4 -40.3 61.0 10.0 15.2 247 248 A K H > S+ 0 0 142 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.894 110.3 49.5 -64.0 -39.0 60.5 7.4 17.8 248 249 A V H X S+ 0 0 14 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.874 109.9 51.5 -67.6 -36.8 57.5 9.3 19.1 249 250 A L H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.868 107.9 52.6 -67.5 -37.3 56.1 9.5 15.6 250 251 A L H < S+ 0 0 37 -4,-2.2 -223,-0.3 1,-0.3 4,-0.3 0.901 107.6 51.8 -68.2 -38.5 56.5 5.8 15.0 251 252 A E H >< S+ 0 0 55 -4,-1.7 3,-0.7 1,-0.2 4,-0.3 0.781 106.8 51.6 -61.6 -42.7 54.7 5.1 18.1 252 253 A M H >X S+ 0 0 0 -4,-1.1 3,-1.5 1,-0.2 4,-0.8 0.842 101.7 62.5 -67.2 -32.6 51.8 7.3 17.0 253 254 A R T 3< S+ 0 0 10 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.476 86.6 73.1 -75.1 -0.4 51.7 5.4 13.7 254 255 A K T <4 S+ 0 0 85 -3,-0.7 -1,-0.3 -4,-0.3 -2,-0.2 0.702 104.8 39.9 -80.6 -20.0 50.9 2.3 15.6 255 256 A F T <4 S+ 0 0 37 -3,-1.5 -204,-0.4 1,-0.3 2,-0.3 0.639 130.7 9.3-102.9 -19.8 47.4 3.8 16.1 256 257 A R S >< S- 0 0 1 -4,-0.8 3,-0.6 -206,-0.1 -1,-0.3 -0.906 77.4-117.5-163.3 134.7 46.8 5.4 12.7 257 258 A M T 3 S+ 0 0 52 -208,-0.5 -3,-0.1 -2,-0.3 -229,-0.1 -0.200 85.5 20.2 -68.8 157.8 48.6 5.2 9.4 258 259 A G T 3 + 0 0 13 1,-0.2 2,-0.3 -5,-0.1 -1,-0.2 0.622 69.3 177.8 73.0 16.5 50.3 7.9 7.4 259 260 A L < + 0 0 0 -3,-0.6 -1,-0.2 -10,-0.1 -40,-0.2 -0.408 66.8 13.4 -61.8 116.9 50.8 10.4 10.3 260 261 A I S S- 0 0 0 -42,-3.3 -41,-0.2 -2,-0.3 -40,-0.1 0.547 74.8-153.6 70.0 131.7 52.6 13.3 8.8 261 262 A Q + 0 0 61 1,-0.1 2,-0.3 -79,-0.1 -42,-0.1 0.575 61.9 35.7-127.9 -23.2 52.7 13.2 5.1 262 263 A T S > S- 0 0 36 -80,-0.1 4,-1.4 -43,-0.1 3,-0.2 -0.933 74.6-116.0-133.6 163.5 55.7 15.1 3.7 263 264 A A H > S+ 0 0 22 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.788 114.3 58.3 -67.5 -26.9 59.4 15.5 4.8 264 265 A D H > S+ 0 0 81 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.883 102.4 51.2 -72.6 -35.8 58.8 19.2 5.3 265 266 A Q H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.866 111.0 50.3 -66.0 -35.0 56.0 18.7 7.8 266 267 A L H X S+ 0 0 0 -4,-1.4 4,-1.6 2,-0.2 -2,-0.2 0.897 110.8 48.6 -67.0 -41.3 58.4 16.4 9.7 267 268 A R H X S+ 0 0 65 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.872 110.5 51.2 -65.3 -38.5 61.0 19.1 9.5 268 269 A F H X S+ 0 0 11 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.884 103.1 59.0 -67.6 -37.9 58.5 21.6 10.8 269 270 A S H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.939 107.3 46.9 -54.3 -48.9 57.6 19.4 13.7 270 271 A Y H X S+ 0 0 0 -4,-1.6 4,-3.2 1,-0.2 -1,-0.2 0.930 112.5 50.4 -54.3 -52.1 61.2 19.5 14.9 271 272 A L H X S+ 0 0 51 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.864 112.4 45.9 -55.2 -46.1 61.3 23.2 14.4 272 273 A A H X S+ 0 0 0 -4,-2.9 4,-3.2 2,-0.2 -1,-0.2 0.899 114.6 46.6 -68.6 -43.5 58.1 23.7 16.4 273 274 A V H X S+ 0 0 0 -4,-2.6 4,-1.8 -5,-0.2 -2,-0.2 0.926 112.9 50.2 -64.5 -45.4 59.1 21.4 19.2 274 275 A I H X S+ 0 0 29 -4,-3.2 4,-0.5 -5,-0.2 -2,-0.2 0.927 115.6 42.7 -59.2 -45.5 62.6 23.0 19.4 275 276 A E H >< S+ 0 0 44 -4,-2.2 3,-1.3 1,-0.2 4,-0.5 0.940 113.7 51.7 -66.8 -45.5 61.0 26.5 19.6 276 277 A G H >X S+ 0 0 0 -4,-3.2 4,-1.8 1,-0.3 3,-0.7 0.747 94.2 72.1 -63.3 -24.8 58.3 25.3 22.0 277 278 A A H 3X S+ 0 0 13 -4,-1.8 4,-2.6 1,-0.2 -1,-0.3 0.804 85.3 68.1 -61.7 -28.5 60.9 23.8 24.4 278 279 A K H <<>S+ 0 0 100 -3,-1.3 5,-2.4 -4,-0.5 -1,-0.2 0.913 104.6 41.8 -56.5 -45.3 62.0 27.4 25.3 279 280 A F H X45S+ 0 0 48 -3,-0.7 3,-2.3 -4,-0.5 -2,-0.2 0.962 113.5 51.7 -65.8 -54.0 58.7 27.9 27.1 280 281 A I H 3<5S+ 0 0 10 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.844 106.2 55.8 -50.0 -38.5 58.6 24.4 28.6 281 282 A M T 3<5S- 0 0 92 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.323 132.6 -88.3 -92.3 7.5 62.1 25.0 30.0 282 283 A G T < 5S+ 0 0 58 -3,-2.3 2,-1.4 1,-0.2 -3,-0.2 0.347 88.5 125.0 119.1 1.7 60.9 28.1 31.7 283 284 A D > < + 0 0 64 -5,-2.4 3,-1.1 -6,-0.2 4,-0.3 -0.676 29.1 173.3 -83.6 84.6 61.2 31.1 29.4 284 285 A S T >> + 0 0 76 -2,-1.4 3,-1.2 1,-0.2 4,-0.5 0.720 63.5 75.8 -67.7 -22.7 57.6 32.2 29.6 285 286 A S H >> S+ 0 0 61 1,-0.2 4,-1.2 2,-0.2 3,-0.5 0.739 78.4 72.1 -63.2 -25.3 58.2 35.4 27.6 286 287 A V H <> S+ 0 0 4 -3,-1.1 4,-2.5 1,-0.2 -1,-0.2 0.829 87.8 65.7 -59.7 -31.1 58.4 33.5 24.2 287 288 A Q H <> S+ 0 0 42 -3,-1.2 4,-1.5 -4,-0.3 -1,-0.2 0.919 102.4 45.0 -56.7 -46.6 54.6 32.9 24.4 288 289 A D H S+ 0 0 92 -4,-1.5 4,-1.1 -5,-0.2 5,-0.8 0.882 112.5 45.4 -67.3 -40.8 51.6 36.0 19.6 292 293 A E H ><5S+ 0 0 139 -4,-1.6 3,-1.2 1,-0.2 -2,-0.2 0.989 115.1 47.6 -62.8 -59.2 53.4 39.1 18.3 293 294 A L H 3<5S+ 0 0 100 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.728 107.9 56.2 -52.4 -31.4 55.0 37.2 15.5 294 295 A S H 3<5S- 0 0 7 -4,-1.8 -1,-0.2 -106,-0.2 -2,-0.2 0.771 90.6-146.5 -77.6 -26.2 51.8 35.5 14.5 295 296 A H T <<5 + 0 0 133 -3,-1.2 -3,-0.1 -4,-1.1 -2,-0.1 0.905 31.4 167.1 61.1 46.0 49.9 38.7 13.9 296 297 A E < 0 0 4 -5,-0.8 -146,-1.7 -146,-0.1 -144,-0.2 0.663 360.0 360.0 -65.9 -15.5 46.5 37.2 15.1 297 298 A D 0 0 156 -148,-0.2 -148,-0.1 -147,-0.1 -149,-0.0 -0.807 360.0 360.0 -91.5 360.0 45.0 40.7 15.3