==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE SUBSTRATE 01-FEB-00 1EEO . COMPND 2 MOLECULE: PROTEIN TYROSINE PHOSPHATASE 1B; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.SARMIENTO,Y.A.PUIUS,S.W.VETTER,D.S.LAWRENCE,S.C.ALMO,Z.Y.Z . 305 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14143.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 209 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 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 . 27 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 88 28.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.0 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 1 1 2 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 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 2 A E > 0 0 148 0, 0.0 4,-2.3 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 134.3 41.6 11.6 2.5 2 3 A M H > + 0 0 7 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.813 360.0 57.5 -64.5 -31.4 38.6 12.9 4.4 3 4 A E H > S+ 0 0 97 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.901 110.0 44.9 -66.0 -39.3 40.7 15.6 6.2 4 5 A K H > S+ 0 0 144 2,-0.2 4,-2.3 -3,-0.2 -2,-0.2 0.894 114.6 47.8 -70.8 -41.0 41.7 17.0 2.8 5 6 A E H X S+ 0 0 36 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.946 111.4 51.8 -64.3 -45.9 38.2 16.8 1.4 6 7 A F H X S+ 0 0 27 -4,-3.2 4,-3.1 1,-0.2 5,-0.2 0.927 112.3 44.5 -54.7 -49.8 36.8 18.4 4.6 7 8 A E H X S+ 0 0 116 -4,-2.2 4,-3.2 2,-0.2 5,-0.3 0.913 109.8 55.5 -63.8 -42.3 39.3 21.3 4.4 8 9 A Q H X S+ 0 0 131 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.928 115.6 39.0 -55.4 -47.1 38.7 21.8 0.6 9 10 A I H X>S+ 0 0 7 -4,-2.5 5,-2.5 2,-0.2 4,-0.6 0.938 118.3 47.3 -68.9 -48.6 34.9 22.1 1.3 10 11 A D H ><5S+ 0 0 61 -4,-3.1 3,-0.8 -5,-0.2 -2,-0.2 0.905 111.5 49.1 -61.8 -45.8 35.3 24.2 4.5 11 12 A K H 3<5S+ 0 0 167 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.787 112.8 47.8 -67.4 -28.7 37.8 26.7 3.2 12 13 A S H 3<5S- 0 0 73 -4,-1.1 -1,-0.2 -5,-0.3 -2,-0.2 0.505 109.6-122.3 -90.1 -4.0 35.8 27.3 0.0 13 14 A G T <<5 + 0 0 65 -3,-0.8 3,-0.2 -4,-0.6 4,-0.2 0.882 67.5 138.1 64.8 40.4 32.6 27.8 2.0 14 15 A S >< + 0 0 37 -5,-2.5 4,-2.9 -6,-0.2 5,-0.3 0.188 23.6 107.7-103.9 16.4 30.9 25.0 0.1 15 16 A W H > S+ 0 0 26 -6,-0.3 4,-2.5 1,-0.2 5,-0.2 0.932 83.4 47.2 -61.2 -45.1 29.0 23.1 2.8 16 17 A A H > S+ 0 0 70 -3,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.909 115.5 47.0 -62.5 -39.0 25.6 24.3 1.7 17 18 A A H > S+ 0 0 67 -4,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.920 112.7 47.3 -68.6 -43.9 26.4 23.5 -2.0 18 19 A I H X S+ 0 0 43 -4,-2.9 4,-1.8 2,-0.2 -2,-0.2 0.932 115.1 47.1 -62.9 -45.3 27.8 20.0 -1.3 19 20 A Y H X S+ 0 0 11 -4,-2.5 4,-2.2 -5,-0.3 -2,-0.2 0.912 111.0 50.4 -64.5 -42.4 24.8 19.2 0.9 20 21 A Q H X S+ 0 0 108 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.842 107.3 55.5 -65.9 -30.3 22.3 20.5 -1.6 21 22 A D H X S+ 0 0 95 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.915 106.6 50.2 -68.2 -40.4 24.0 18.4 -4.3 22 23 A I H X S+ 0 0 4 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.924 109.9 50.7 -62.6 -43.3 23.5 15.3 -2.2 23 24 A R H < S+ 0 0 89 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.917 111.3 48.7 -58.9 -43.8 19.9 16.2 -1.8 24 25 A H H < S+ 0 0 141 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.873 114.3 44.9 -64.6 -38.3 19.5 16.6 -5.6 25 26 A E H < S+ 0 0 119 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.665 89.5 116.6 -80.7 -17.5 21.3 13.3 -6.3 26 27 A A S < S- 0 0 23 -4,-1.6 228,-0.1 -5,-0.2 224,-0.1 -0.127 73.7 -93.5 -56.4 148.3 19.3 11.3 -3.7 27 28 A S - 0 0 40 223,-0.3 2,-0.5 229,-0.1 -1,-0.1 -0.169 27.6-153.4 -60.5 149.9 17.0 8.5 -4.7 28 29 A D + 0 0 153 229,-0.1 -1,-0.0 226,-0.0 226,-0.0 -0.974 26.5 161.3-128.6 110.5 13.2 9.1 -5.3 29 30 A F - 0 0 79 -2,-0.5 228,-0.1 1,-0.0 226,-0.0 -0.920 41.9 -91.1-128.4 155.6 11.2 5.9 -4.6 30 31 A P - 0 0 57 0, 0.0 22,-2.7 0, 0.0 23,-0.4 -0.300 23.0-169.3 -68.5 150.8 7.4 5.5 -4.0 31 32 A C > + 0 0 15 20,-0.3 4,-1.3 21,-0.1 20,-0.1 -0.401 32.2 146.5-131.3 50.2 5.9 5.5 -0.5 32 33 A R T 4 + 0 0 180 1,-0.2 4,-0.4 2,-0.2 3,-0.2 0.884 69.4 49.2 -58.5 -44.7 2.4 4.4 -1.5 33 34 A V T >4 S+ 0 0 31 1,-0.2 3,-1.5 2,-0.2 -1,-0.2 0.927 108.4 53.8 -64.1 -43.4 1.6 2.4 1.6 34 35 A A T 34 S+ 0 0 2 16,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.821 109.5 50.6 -59.3 -30.6 2.7 5.2 3.9 35 36 A K T 3< S+ 0 0 133 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.453 76.7 121.1 -89.3 -2.7 0.3 7.5 2.1 36 37 A L S X S- 0 0 73 -3,-1.5 3,-2.4 -4,-0.4 4,-0.3 -0.413 72.1-123.5 -61.7 134.5 -2.8 5.3 2.3 37 38 A P G > S+ 0 0 109 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.838 110.0 60.4 -48.4 -37.7 -5.5 7.3 4.1 38 39 A K G 3 S+ 0 0 131 1,-0.3 3,-0.3 2,-0.1 -2,-0.1 0.697 101.6 55.2 -66.1 -16.8 -5.9 4.5 6.7 39 40 A N G X S+ 0 0 0 -3,-2.4 3,-2.1 -6,-0.2 4,-0.4 0.383 74.7 103.8 -96.9 3.2 -2.3 5.0 7.7 40 41 A K G X S+ 0 0 118 -3,-1.6 3,-1.3 -4,-0.3 -1,-0.2 0.878 79.6 51.1 -51.7 -45.0 -2.6 8.8 8.4 41 42 A N G 3 S+ 0 0 99 -3,-0.3 -1,-0.3 -4,-0.3 48,-0.2 0.423 102.3 63.2 -77.4 4.5 -2.6 8.3 12.1 42 43 A R G < S+ 0 0 22 -3,-2.1 25,-0.5 -8,-0.1 2,-0.5 0.435 90.3 77.3-104.4 -1.6 0.6 6.2 11.9 43 44 A N < - 0 0 22 -3,-1.3 3,-0.1 -4,-0.4 6,-0.1 -0.940 57.1-164.9-113.9 126.2 2.8 9.0 10.5 44 45 A R S S+ 0 0 31 -2,-0.5 2,-0.4 1,-0.2 -1,-0.1 0.895 81.2 29.9 -72.8 -40.8 4.2 11.8 12.7 45 46 A Y > - 0 0 12 3,-0.4 3,-1.1 1,-0.1 256,-0.2 -0.963 64.5-145.2-125.3 138.9 5.1 14.0 9.8 46 47 A R T 3 S+ 0 0 92 254,-3.0 255,-0.2 -2,-0.4 -1,-0.1 0.734 102.7 51.6 -70.2 -21.8 3.5 14.3 6.3 47 48 A D T 3 S+ 0 0 21 253,-0.4 2,-0.4 1,-0.1 -1,-0.2 0.224 99.0 68.2-101.8 14.3 6.9 15.0 4.8 48 49 A V < + 0 0 2 -3,-1.1 -3,-0.4 255,-0.0 -1,-0.1 -0.900 61.5 151.6-136.2 106.7 8.8 12.0 6.2 49 50 A S - 0 0 4 -2,-0.4 208,-0.6 -6,-0.1 2,-0.3 -0.955 42.7-113.5-135.0 150.1 7.7 8.6 4.9 50 51 A P - 0 0 0 0, 0.0 -16,-0.4 0, 0.0 206,-0.1 -0.618 36.2-111.3 -84.9 143.7 9.4 5.2 4.4 51 52 A F > - 0 0 3 204,-0.5 4,-1.0 -2,-0.3 3,-0.4 -0.435 23.3-125.2 -66.9 145.9 9.9 3.9 0.8 52 53 A D T >4 S+ 0 0 37 -22,-2.7 3,-0.5 1,-0.2 -1,-0.1 0.899 106.3 57.0 -60.1 -40.3 7.8 0.9 0.0 53 54 A H T 34 S+ 0 0 107 -23,-0.4 -1,-0.2 1,-0.2 -22,-0.1 0.816 118.6 29.0 -65.6 -28.2 10.7 -1.2 -1.0 54 55 A S T 34 S+ 0 0 9 -3,-0.4 16,-2.8 201,-0.1 -1,-0.2 0.348 88.1 126.7-114.2 5.0 12.6 -0.9 2.3 55 56 A R E << -A 69 0A 32 -4,-1.0 2,-0.5 -3,-0.5 14,-0.3 -0.283 62.2-117.3 -67.2 149.6 9.8 -0.4 4.8 56 57 A I E - 0 0 8 12,-2.0 10,-0.5 10,-0.3 2,-0.5 -0.744 28.2-146.6 -84.5 129.2 9.6 -2.7 7.8 57 58 A K E -A 65 0A 117 -2,-0.5 8,-0.2 8,-0.1 2,-0.1 -0.846 8.9-131.1-101.0 131.9 6.4 -4.7 7.9 58 59 A L - 0 0 5 6,-2.6 2,-0.9 -2,-0.5 39,-0.1 -0.496 24.0-120.0 -72.9 149.8 4.7 -5.6 11.1 59 60 A H S S+ 0 0 120 -2,-0.1 2,-0.4 37,-0.1 -1,-0.1 -0.230 78.9 104.5 -87.6 47.4 3.9 -9.3 11.3 60 61 A Q - 0 0 44 -2,-0.9 -2,-0.1 1,-0.1 0, 0.0 -0.985 64.5-145.1-130.2 141.3 0.2 -8.8 11.7 61 62 A E S S+ 0 0 184 -2,-0.4 3,-0.2 1,-0.2 -1,-0.1 0.767 92.1 71.3 -72.4 -26.9 -2.6 -9.2 9.2 62 63 A D S S- 0 0 129 1,-0.2 2,-0.3 2,-0.0 -1,-0.2 0.973 126.1 -27.4 -52.7 -64.8 -4.6 -6.2 10.5 63 64 A N - 0 0 12 2,-0.0 -1,-0.2 -24,-0.0 -2,-0.1 -0.826 54.7-165.4-157.7 111.4 -2.3 -3.5 9.2 64 65 A D + 0 0 45 -2,-0.3 -6,-2.6 -3,-0.2 2,-0.3 0.324 49.4 123.5 -85.2 11.3 1.4 -4.2 8.8 65 66 A Y E +A 57 0A 0 -8,-0.2 2,-0.3 -32,-0.1 -8,-0.1 -0.568 22.9 153.2 -86.2 132.9 2.4 -0.5 8.5 66 67 A I E - 0 0 7 -10,-0.5 2,-1.9 -2,-0.3 -10,-0.3 -0.982 50.8-113.4-145.9 142.4 4.9 1.4 10.6 67 68 A N E S+ 0 0 0 -25,-0.5 17,-1.5 -2,-0.3 2,-0.3 -0.610 77.2 114.2 -79.9 87.0 6.9 4.4 9.6 68 69 A A E - B 0 83A 0 -2,-1.9 -12,-2.0 15,-0.2 2,-0.4 -0.978 47.5-155.7-156.8 144.6 10.3 2.6 9.7 69 70 A S E -AB 55 82A 0 13,-2.7 13,-2.3 -2,-0.3 2,-0.7 -0.954 17.3-130.1-129.9 145.8 12.9 1.7 7.1 70 71 A L E - B 0 81A 51 -16,-2.8 2,-0.9 -2,-0.4 11,-0.2 -0.847 18.8-161.7 -96.3 113.8 15.6 -1.0 6.9 71 72 A I E - B 0 80A 0 9,-3.2 9,-2.1 -2,-0.7 2,-0.8 -0.863 11.3-169.6 -95.8 105.4 18.9 0.6 5.9 72 73 A K E - B 0 79A 114 -2,-0.9 2,-1.1 7,-0.2 7,-0.2 -0.842 8.7-166.7-105.8 103.0 20.9 -2.4 4.7 73 74 A M E >> - B 0 78A 11 5,-2.2 5,-1.6 -2,-0.8 4,-1.0 -0.747 4.9-172.8 -92.8 98.2 24.6 -1.6 4.1 74 75 A E T >45S+ 0 0 161 -2,-1.1 3,-0.6 2,-0.2 -1,-0.2 0.932 79.5 40.8 -56.4 -57.0 25.9 -4.5 2.1 75 76 A E T 345S+ 0 0 93 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.902 117.6 48.1 -63.8 -40.7 29.6 -3.7 2.1 76 77 A A T 345S- 0 0 6 2,-0.2 -1,-0.2 1,-0.0 -2,-0.2 0.650 102.2-136.9 -73.0 -15.1 29.7 -2.6 5.7 77 78 A Q T <<5 + 0 0 137 -4,-1.0 2,-0.3 -3,-0.6 -3,-0.2 0.890 64.0 113.7 58.2 43.4 27.8 -5.7 6.7 78 79 A R E < -B 73 0A 44 -5,-1.6 -5,-2.2 2,-0.0 2,-0.3 -0.999 46.4-162.9-143.7 142.1 25.5 -3.8 9.0 79 80 A S E -B 72 0A 36 -2,-0.3 131,-0.7 -7,-0.2 2,-0.3 -0.925 5.0-171.7-123.9 152.0 21.8 -3.0 9.0 80 81 A Y E -Bc 71 210A 0 -9,-2.1 -9,-3.2 -2,-0.3 2,-0.6 -0.970 18.7-140.0-137.5 150.5 19.9 -0.4 10.9 81 82 A I E -Bc 70 211A 0 129,-2.7 131,-3.5 -2,-0.3 2,-0.5 -0.975 20.1-164.5-111.6 119.6 16.2 0.3 11.2 82 83 A L E +Bc 69 212A 0 -13,-2.3 -13,-2.7 -2,-0.6 2,-0.3 -0.921 18.5 163.4-105.0 129.9 15.4 4.0 11.2 83 84 A T E -Bc 68 213A 2 129,-1.8 131,-0.7 -2,-0.5 -15,-0.2 -0.913 37.6-100.1-141.7 163.0 12.0 5.0 12.4 84 85 A Q - 0 0 5 -17,-1.5 132,-0.3 -2,-0.3 131,-0.2 -0.277 56.0 -81.1 -76.0 168.0 10.1 8.1 13.6 85 86 A G - 0 0 0 130,-2.8 -1,-0.1 34,-0.3 -41,-0.1 -0.606 64.0-101.3 -69.4 127.9 9.6 8.8 17.3 86 87 A P - 0 0 2 0, 0.0 35,-2.5 0, 0.0 5,-0.1 -0.141 32.5-133.6 -53.0 146.1 6.6 6.7 18.2 87 88 A L >> - 0 0 25 33,-0.2 3,-2.1 -45,-0.1 4,-0.7 -0.560 32.7 -97.1 -93.9 162.4 3.2 8.4 18.4 88 89 A P T 34 S+ 0 0 112 0, 0.0 3,-0.4 0, 0.0 4,-0.2 0.846 127.5 42.3 -49.3 -34.7 0.8 7.7 21.3 89 90 A N T 34 S+ 0 0 65 -48,-0.2 4,-0.2 1,-0.2 -48,-0.0 0.437 112.6 52.3 -94.3 -0.2 -1.0 5.1 19.2 90 91 A T T <> S+ 0 0 6 -3,-2.1 4,-2.5 2,-0.1 -1,-0.2 0.275 75.5 97.7-116.9 10.9 2.0 3.5 17.6 91 92 A C H X S+ 0 0 10 -4,-0.7 4,-1.9 -3,-0.4 5,-0.2 0.875 87.3 48.9 -65.2 -36.5 4.0 2.6 20.7 92 93 A G H > S+ 0 0 4 2,-0.2 4,-2.1 -4,-0.2 -1,-0.2 0.904 111.1 50.2 -68.4 -39.4 2.7 -0.9 20.6 93 94 A H H > S+ 0 0 12 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.898 107.6 55.2 -63.5 -41.5 3.6 -1.1 16.9 94 95 A F H X S+ 0 0 2 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.933 111.9 41.0 -58.9 -48.7 7.1 0.1 17.8 95 96 A W H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.838 109.9 58.9 -71.5 -29.7 7.8 -2.6 20.3 96 97 A E H X S+ 0 0 16 -4,-2.1 4,-3.0 2,-0.2 -1,-0.2 0.923 108.2 47.5 -61.1 -42.7 6.1 -5.2 18.1 97 98 A M H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 6,-0.3 0.933 108.9 52.6 -62.5 -47.2 8.8 -4.3 15.5 98 99 A V H <>S+ 0 0 0 -4,-2.1 5,-1.7 2,-0.2 4,-0.4 0.916 114.6 43.8 -55.5 -43.2 11.6 -4.5 18.0 99 100 A W H ><5S+ 0 0 23 -4,-2.5 3,-1.4 1,-0.2 -2,-0.2 0.970 115.8 44.8 -66.0 -56.1 10.4 -7.9 19.0 100 101 A E H 3<5S+ 0 0 36 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.825 114.8 48.4 -59.7 -34.5 9.8 -9.3 15.5 101 102 A Q T 3<5S- 0 0 45 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.453 106.0-127.4 -88.4 0.2 13.1 -7.9 14.1 102 103 A K T < 5 + 0 0 129 -3,-1.4 106,-3.0 -4,-0.4 -3,-0.2 0.773 42.5 175.9 60.1 31.9 15.0 -9.3 17.0 103 104 A S < - 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0 0 84 1,-0.1 3,-2.1 2,-0.0 -1,-0.3 -0.892 69.7-170.2-118.7 99.6 42.8 1.9 1.8 240 241 A P G > S+ 0 0 33 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.761 84.0 68.4 -59.4 -23.8 40.6 3.7 4.3 241 242 A S G 3 S+ 0 0 48 1,-0.3 -7,-0.1 -3,-0.1 -3,-0.0 0.532 83.5 74.3 -74.1 -3.9 41.0 6.9 2.3 242 243 A S G < S+ 0 0 55 -3,-2.1 2,-0.5 -8,-0.1 -1,-0.3 0.554 70.0 107.0 -83.4 -9.5 38.9 5.3 -0.4 243 244 A V < - 0 0 8 -3,-1.5 2,-0.7 -4,-0.2 3,-0.1 -0.609 56.5-161.0 -74.2 122.8 35.7 5.8 1.7 244 245 A D > - 0 0 51 -2,-0.5 4,-2.1 1,-0.1 3,-0.4 -0.901 4.1-162.9-107.5 102.8 33.6 8.6 0.2 245 246 A I H > S+ 0 0 0 -2,-0.7 4,-2.2 1,-0.2 5,-0.2 0.815 89.5 56.4 -56.8 -32.5 31.2 9.8 2.9 246 247 A K H > S+ 0 0 48 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.916 109.3 46.0 -66.9 -41.3 29.0 11.5 0.3 247 248 A K H > S+ 0 0 146 -3,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.857 110.2 53.3 -69.4 -35.4 28.6 8.3 -1.6 248 249 A V H X S+ 0 0 11 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.926 110.0 48.8 -64.1 -43.1 27.9 6.3 1.7 249 250 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.911 110.1 50.6 -63.5 -42.5 25.2 8.8 2.5 250 251 A L H < S+ 0 0 37 -4,-2.2 -223,-0.3 2,-0.2 4,-0.3 0.891 109.2 52.3 -62.8 -36.9 23.7 8.5 -1.0 251 252 A E H >< S+ 0 0 64 -4,-2.1 3,-1.6 1,-0.2 4,-0.4 0.940 109.9 48.3 -63.8 -44.2 23.7 4.7 -0.6 252 253 A M H >X S+ 0 0 0 -4,-2.4 3,-2.0 1,-0.3 4,-0.9 0.883 104.0 60.7 -62.9 -37.4 21.8 5.1 2.7 253 254 A R T 3< S+ 0 0 12 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.508 87.0 73.5 -69.8 -3.4 19.3 7.4 1.2 254 255 A K T <4 S+ 0 0 87 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.726 105.8 39.9 -76.6 -18.7 18.4 4.6 -1.3 255 256 A F T <4 S+ 0 0 37 -3,-2.0 -204,-0.5 -4,-0.4 2,-0.3 0.674 128.7 12.4-102.6 -24.7 16.6 3.1 1.8 256 257 A R S >< S- 0 0 0 -4,-0.9 3,-0.7 -206,-0.1 -1,-0.3 -0.934 79.2-113.4-156.1 134.4 15.1 6.1 3.6 257 258 A M T 3 S+ 0 0 51 -208,-0.6 -3,-0.1 -2,-0.3 -229,-0.1 -0.240 85.6 12.4 -69.3 152.9 14.6 9.7 2.5 258 259 A G T 3 + 0 0 13 1,-0.2 -1,-0.2 -5,-0.1 -36,-0.1 0.573 67.9 176.9 63.1 19.3 16.2 12.8 3.9 259 260 A L < + 0 0 1 -3,-0.7 -40,-0.2 -10,-0.1 -1,-0.2 -0.376 67.3 23.5 -59.4 127.3 19.0 11.2 6.0 260 261 A I S S- 0 0 0 -42,-2.4 -41,-0.2 -41,-0.2 -40,-0.1 0.775 74.9-156.3 76.9 110.2 21.1 14.2 7.4 261 262 A Q + 0 0 10 -79,-0.1 2,-0.3 1,-0.0 -42,-0.1 0.546 62.6 35.3 -96.9 -10.0 18.9 17.3 7.5 262 263 A T S > S- 0 0 32 -43,-0.1 4,-1.8 1,-0.1 3,-0.2 -0.970 73.9-117.7-142.7 158.9 21.3 20.2 7.4 263 264 A A H > S+ 0 0 24 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.874 116.4 54.3 -61.2 -36.7 24.7 21.2 6.0 264 265 A D H > S+ 0 0 82 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.834 104.1 53.6 -70.0 -30.1 26.1 21.4 9.5 265 266 A Q H > S+ 0 0 0 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.910 110.7 47.7 -68.7 -37.6 25.0 17.9 10.3 266 267 A L H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.951 111.8 49.6 -64.9 -46.4 26.9 16.8 7.2 267 268 A R H X S+ 0 0 70 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.921 110.8 50.6 -57.2 -44.0 29.9 18.8 8.2 268 269 A F H X S+ 0 0 11 -4,-2.7 4,-3.0 1,-0.2 -1,-0.2 0.888 104.1 58.0 -62.5 -39.1 29.7 17.3 11.7 269 270 A S H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.910 105.7 50.3 -58.5 -41.5 29.6 13.8 10.2 270 271 A Y H X S+ 0 0 0 -4,-1.8 4,-2.9 2,-0.2 5,-0.2 0.954 111.9 47.2 -60.0 -49.6 32.9 14.5 8.5 271 272 A L H X S+ 0 0 49 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.894 111.6 51.0 -59.9 -41.3 34.4 15.7 11.8 272 273 A A H X S+ 0 0 0 -4,-3.0 4,-2.5 2,-0.2 -1,-0.2 0.895 113.8 43.7 -64.2 -40.6 33.1 12.6 13.7 273 274 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.910 112.3 52.0 -72.8 -40.0 34.5 10.2 11.1 274 275 A I H X S+ 0 0 22 -4,-2.9 4,-0.7 -5,-0.2 -2,-0.2 0.936 115.6 42.0 -60.4 -46.2 37.8 12.0 10.9 275 276 A E H >< S+ 0 0 43 -4,-2.4 3,-1.0 -5,-0.2 4,-0.5 0.923 114.2 50.4 -68.0 -45.1 38.2 11.9 14.7 276 277 A G H >X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.3 3,-1.5 0.838 100.2 65.5 -63.2 -31.0 36.9 8.3 15.0 277 278 A A H 3X S+ 0 0 15 -4,-2.3 4,-2.9 1,-0.3 -1,-0.3 0.802 87.7 68.8 -61.8 -28.1 39.3 7.2 12.3 278 279 A K H << S+ 0 0 103 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 0.820 104.5 43.3 -60.3 -28.9 42.2 8.0 14.6 279 280 A F H X4 S+ 0 0 43 -3,-1.5 3,-1.1 -4,-0.5 -1,-0.2 0.877 112.2 50.8 -82.0 -42.3 41.0 5.1 16.8 280 281 A I H 3< S+ 0 0 21 -4,-1.6 2,-0.2 1,-0.3 -2,-0.2 0.881 104.8 58.8 -62.3 -38.9 40.5 2.7 13.9 281 282 A M T 3< S- 0 0 119 -4,-2.9 -1,-0.3 1,-0.3 2,-0.1 -0.002 127.2 -92.3 -81.3 32.3 44.0 3.4 12.5 282 283 A G S < S+ 0 0 36 -3,-1.1 -1,-0.3 -2,-0.2 0, 0.0 -0.428 93.5 107.9 85.7-168.5 45.4 2.2 15.8 283 284 A D > - 0 0 99 1,-0.1 3,-1.3 -2,-0.1 4,-0.2 0.992 40.9-178.9 58.5 61.4 46.1 4.6 18.6 284 285 A S T 3 + 0 0 65 1,-0.3 4,-0.4 2,-0.1 3,-0.4 0.275 63.0 90.3 -76.8 13.1 43.2 3.3 20.7 285 286 A S T >> S+ 0 0 63 1,-0.2 4,-1.1 2,-0.2 3,-0.6 0.706 70.5 71.1 -80.3 -21.5 44.2 5.9 23.3 286 287 A V H <> S+ 0 0 6 -3,-1.3 4,-2.4 1,-0.2 5,-0.2 0.803 86.4 66.8 -64.0 -28.8 41.9 8.4 21.7 287 288 A Q H 3> S+ 0 0 45 -3,-0.4 4,-1.5 1,-0.2 -1,-0.2 0.879 102.4 45.1 -59.7 -39.4 38.9 6.4 23.0 288 289 A D H <> S+ 0 0 110 -3,-0.6 4,-2.1 -4,-0.4 -1,-0.2 0.784 110.3 57.2 -74.7 -26.9 39.9 7.3 26.6 289 290 A Q H X S+ 0 0 100 -4,-1.1 4,-3.2 2,-0.2 -2,-0.2 0.896 105.7 47.2 -70.1 -42.2 40.3 10.9 25.4 290 291 A W H X S+ 0 0 2 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.912 110.5 55.2 -64.2 -41.1 36.8 11.2 24.1 291 292 A K H X>S+ 0 0 93 -4,-1.5 4,-0.7 -5,-0.2 5,-0.7 0.938 113.8 39.3 -54.3 -51.6 35.6 9.7 27.4 292 293 A E H ><5S+ 0 0 138 -4,-2.1 3,-0.8 1,-0.2 -2,-0.2 0.914 116.3 51.0 -67.0 -43.7 37.4 12.4 29.3 293 294 A L H 3<5S+ 0 0 105 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.749 102.1 61.4 -66.6 -25.6 36.5 15.1 26.9 294 295 A S H 3<5S- 0 0 11 -4,-2.3 3,-0.2 -106,-0.2 -1,-0.2 0.762 89.0-150.2 -73.2 -25.2 32.8 14.2 27.0 295 296 A H T <<5 - 0 0 131 -3,-0.8 2,-2.0 -4,-0.7 -3,-0.1 0.892 14.6-164.8 55.8 41.9 32.6 14.9 30.7 296 297 A E < 0 0 23 -5,-0.7 -1,-0.2 -146,-0.1 -2,-0.1 -0.364 360.0 360.0 -63.4 82.2 29.9 12.3 31.0 297 298 A D 0 0 152 -2,-2.0 -148,-0.1 -3,-0.2 -146,-0.0 -0.014 360.0 360.0 45.1 360.0 28.6 13.3 34.5 298 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 299 1 B L 0 0 147 0, 0.0 2,-0.5 0, 0.0 -254,-0.1 0.000 360.0 360.0 360.0 140.1 -0.9 18.8 9.0 300 2 B E - 0 0 126 -256,-0.1 -254,-3.0 2,-0.0 2,-0.4 -0.855 360.0-171.3-104.5 132.4 2.4 18.4 10.7 301 3 B F - 0 0 98 -2,-0.5 4,-0.1 -256,-0.2 -256,-0.1 -0.965 17.2-161.6-123.3 139.1 5.7 18.8 8.8 302 4 B X S S+ 0 0 14 -2,-0.4 -1,-0.1 2,-0.1 -86,-0.1 0.858 72.1 66.8 -83.9 -39.9 9.2 18.1 10.0 303 5 B M S S- 0 0 55 1,-0.1 2,-0.5 2,-0.0 -2,-0.1 -0.274 86.3-106.2 -83.5 168.1 11.2 20.2 7.5 304 6 B D + 0 0 122 1,-0.1 -1,-0.1 -2,-0.1 -2,-0.1 -0.829 33.0 169.8 -98.6 128.8 11.3 23.9 7.1 305 7 B Y 0 0 146 -2,-0.5 -1,-0.1 -4,-0.1 -2,-0.0 0.196 360.0 360.0-119.1 11.9 9.5 25.5 4.2 306 8 B E 0 0 217 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.816 360.0 360.0 -92.6 360.0 9.9 29.2 5.3