==== 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 16-FEB-03 1NZ7 . COMPND 2 MOLECULE: PROTEIN-TYROSINE PHOSPHATASE, NON-RECEPTOR TYPE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Z.XIN,T.K.OOST,C.ABAD-ZAPATERO,P.J.HAJDUK,Z.PEI, . 282 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13184.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 198 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 14.2 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 . 28 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 28.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.1 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 2 1 0 1 0 0 0 1 1 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 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 0 128 0, 0.0 4,-2.0 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 101.2 25.0 7.8 39.9 2 3 A M H > + 0 0 13 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.797 360.0 59.6 -63.6 -28.2 26.1 10.1 37.1 3 4 A E H > S+ 0 0 55 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.894 105.3 47.2 -67.2 -40.0 28.6 7.5 35.9 4 5 A K H > S+ 0 0 143 -3,-0.3 4,-1.1 1,-0.2 -2,-0.2 0.927 114.0 48.4 -65.2 -43.1 25.8 5.0 35.4 5 6 A E H X S+ 0 0 45 -4,-2.0 4,-1.8 1,-0.2 3,-0.3 0.870 107.6 57.2 -62.5 -37.6 24.0 7.7 33.6 6 7 A F H X S+ 0 0 23 -4,-2.5 4,-2.2 1,-0.2 3,-0.2 0.946 105.0 49.6 -57.7 -51.8 27.2 8.4 31.6 7 8 A E H X S+ 0 0 109 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.720 107.9 54.9 -62.1 -24.5 27.4 4.9 30.3 8 9 A Q H X S+ 0 0 97 -4,-1.1 4,-2.5 -3,-0.3 -1,-0.2 0.887 109.2 45.2 -77.0 -40.9 23.7 5.0 29.2 9 10 A I H <>S+ 0 0 7 -4,-1.8 5,-2.3 -3,-0.2 6,-0.3 0.893 117.7 45.4 -67.6 -40.5 24.2 8.1 27.0 10 11 A D H ><5S+ 0 0 63 -4,-2.2 3,-1.8 3,-0.2 -2,-0.2 0.937 111.0 54.2 -66.2 -48.9 27.4 6.6 25.6 11 12 A K H 3<5S+ 0 0 161 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.2 0.945 119.9 31.3 -47.9 -60.1 25.6 3.2 25.1 12 13 A S T 3<5S- 0 0 77 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.113 105.8-129.4 -89.2 20.5 22.8 4.8 23.1 13 14 A G T < 5 + 0 0 62 -3,-1.8 -3,-0.2 1,-0.2 3,-0.2 0.804 59.0 142.9 30.2 57.3 25.1 7.5 21.7 14 15 A S >< + 0 0 35 -5,-2.3 4,-2.1 1,-0.1 -1,-0.2 -0.105 21.3 114.8-115.1 36.4 22.7 10.2 22.6 15 16 A W H > S+ 0 0 20 -6,-0.3 4,-3.0 2,-0.2 5,-0.2 0.896 78.6 49.3 -70.7 -43.0 25.1 13.0 23.7 16 17 A A H > S+ 0 0 64 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.900 111.9 51.3 -62.8 -39.9 24.2 15.4 20.9 17 18 A A H > S+ 0 0 54 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.943 113.3 43.3 -61.4 -51.1 20.5 14.8 21.7 18 19 A I H X S+ 0 0 24 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.912 110.3 55.3 -62.2 -45.4 21.0 15.6 25.4 19 20 A Y H X S+ 0 0 14 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.901 107.7 51.6 -55.0 -41.0 23.2 18.6 24.8 20 21 A Q H X S+ 0 0 86 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.872 102.6 56.7 -65.5 -38.9 20.4 20.0 22.6 21 22 A D H X S+ 0 0 89 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.880 108.5 50.1 -60.1 -35.2 17.8 19.5 25.3 22 23 A I H X S+ 0 0 5 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.919 107.0 52.8 -68.1 -44.9 20.0 21.7 27.5 23 24 A R H < S+ 0 0 138 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.890 112.4 46.2 -57.8 -39.9 20.3 24.4 24.8 24 25 A H H < S+ 0 0 167 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.859 115.1 44.8 -72.1 -36.6 16.5 24.5 24.6 25 26 A E H < S+ 0 0 119 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.651 90.8 115.0 -81.6 -15.5 16.0 24.6 28.4 26 27 A A S < S- 0 0 22 -4,-1.8 228,-0.1 -5,-0.1 224,-0.1 -0.196 74.3 -98.6 -59.2 145.6 18.8 27.2 28.8 27 28 A S - 0 0 36 223,-0.3 2,-0.4 229,-0.1 -1,-0.1 -0.133 28.1-155.6 -62.1 155.1 17.9 30.7 30.1 28 29 A D + 0 0 144 229,-0.1 226,-0.1 226,-0.0 -1,-0.0 -0.875 22.3 163.6-139.2 103.6 17.4 33.7 27.8 29 30 A F - 0 0 78 -2,-0.4 228,-0.1 1,-0.1 226,-0.0 -0.801 41.9 -83.2-118.7 161.6 17.9 37.1 29.3 30 31 A P - 0 0 50 0, 0.0 22,-2.8 0, 0.0 23,-0.5 -0.237 26.6-172.9 -62.3 148.3 18.5 40.6 27.7 31 32 A C > + 0 0 21 20,-0.3 4,-1.5 21,-0.1 20,-0.1 -0.401 32.6 142.6-136.0 49.2 22.0 41.7 26.6 32 33 A R H > + 0 0 180 1,-0.2 4,-0.6 2,-0.2 -1,-0.1 0.894 68.6 50.7 -64.5 -42.1 21.1 45.3 25.8 33 34 A V H >4 S+ 0 0 30 1,-0.2 3,-1.1 2,-0.2 -1,-0.2 0.929 109.4 53.4 -61.8 -42.2 24.2 47.0 27.1 34 35 A A H 34 S+ 0 0 1 16,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.845 107.4 51.1 -58.2 -40.3 26.3 44.6 25.1 35 36 A K H 3< S+ 0 0 125 -4,-1.5 -1,-0.2 -3,-0.1 -2,-0.2 0.491 79.0 119.1 -81.6 -4.9 24.5 45.3 21.8 36 37 A L S X< S- 0 0 79 -3,-1.1 3,-1.8 -4,-0.6 4,-0.2 -0.355 72.7-121.9 -62.1 141.6 24.8 49.1 22.0 37 38 A P G > S+ 0 0 113 0, 0.0 3,-2.1 0, 0.0 4,-0.3 0.868 109.7 62.5 -51.4 -44.1 26.8 50.6 19.0 38 39 A K G 3 S+ 0 0 118 1,-0.3 3,-0.2 2,-0.1 -2,-0.1 0.721 104.5 50.2 -57.7 -20.6 29.4 52.2 21.2 39 40 A N G X S+ 0 0 0 -3,-1.8 3,-2.4 -6,-0.2 4,-0.4 0.387 74.7 107.6-101.2 4.4 30.3 48.7 22.4 40 41 A K G X S+ 0 0 142 -3,-2.1 3,-1.2 1,-0.3 -1,-0.2 0.886 82.9 46.3 -46.8 -49.8 30.7 47.1 19.0 41 42 A N G 3 S+ 0 0 95 -4,-0.3 -1,-0.3 1,-0.2 48,-0.2 0.436 100.1 69.3 -77.7 1.0 34.5 46.9 19.3 42 43 A R G < S+ 0 0 25 -3,-2.4 25,-0.6 -8,-0.1 2,-0.4 0.472 89.8 74.4 -96.5 0.2 34.4 45.6 22.9 43 44 A N < - 0 0 25 -3,-1.2 3,-0.1 -4,-0.4 6,-0.1 -0.927 58.9-162.5-116.7 137.2 33.0 42.2 21.8 44 45 A R S S+ 0 0 52 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.815 82.0 35.9 -83.1 -34.8 35.0 39.5 20.0 45 46 A Y > - 0 0 77 3,-0.4 3,-1.0 1,-0.1 -1,-0.2 -0.972 67.0-144.9-125.2 138.7 32.0 37.6 18.7 46 47 A R T 3 S+ 0 0 192 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.0 0.886 103.3 46.7 -65.4 -39.2 28.7 39.0 17.5 47 48 A D T 3 S+ 0 0 117 1,-0.1 2,-0.5 -3,-0.1 -1,-0.2 0.273 97.9 77.1 -89.4 10.8 26.8 36.0 18.9 48 49 A V < + 0 0 10 -3,-1.0 -3,-0.4 2,-0.0 -4,-0.2 -0.855 58.4 152.9-126.6 100.6 28.4 35.9 22.4 49 50 A S - 0 0 5 -2,-0.5 208,-0.6 -6,-0.1 2,-0.4 -0.871 43.2-112.2-127.1 157.7 27.2 38.6 24.9 50 51 A P - 0 0 0 0, 0.0 -16,-0.4 0, 0.0 5,-0.1 -0.723 37.0-114.5 -87.3 130.7 26.8 39.0 28.6 51 52 A F >> - 0 0 1 -2,-0.4 3,-0.8 204,-0.4 4,-0.6 -0.381 22.5-130.3 -60.0 142.8 23.3 39.2 30.0 52 53 A D G >4 S+ 0 0 31 -22,-2.8 3,-1.1 1,-0.2 -1,-0.1 0.912 104.0 63.0 -62.2 -41.3 22.8 42.7 31.4 53 54 A H G 34 S+ 0 0 105 -23,-0.5 -1,-0.2 1,-0.3 -22,-0.1 0.734 118.3 24.3 -57.5 -25.2 21.4 41.3 34.7 54 55 A S G <4 S+ 0 0 10 -3,-0.8 16,-2.7 201,-0.1 -1,-0.3 0.230 90.9 129.0-126.3 13.5 24.7 39.5 35.5 55 56 A R E << -A 69 0A 27 -3,-1.1 2,-0.4 -4,-0.6 14,-0.3 -0.290 60.4-113.9 -71.8 155.8 27.3 41.6 33.6 56 57 A I E - 0 0 10 12,-2.5 2,-0.5 10,-0.4 10,-0.5 -0.765 28.4-147.2 -89.4 132.0 30.5 42.9 35.2 57 58 A K E -A 65 0A 108 -2,-0.4 2,-0.2 8,-0.1 8,-0.2 -0.882 9.2-131.9-105.6 127.1 30.6 46.7 35.3 58 59 A L - 0 0 4 6,-2.9 2,-2.6 -2,-0.5 39,-0.1 -0.553 27.1-118.6 -71.2 135.9 33.9 48.6 35.0 59 60 A H S S+ 0 0 130 -2,-0.2 2,-0.3 37,-0.1 -1,-0.1 -0.325 78.3 106.6 -75.8 61.5 34.1 51.2 37.8 60 61 A Q - 0 0 56 -2,-2.6 -2,-0.1 1,-0.1 0, 0.0 -0.992 66.7-140.2-139.7 146.6 34.3 54.2 35.4 61 62 A E S S+ 0 0 200 -2,-0.3 3,-0.2 2,-0.1 -1,-0.1 0.754 93.5 64.6 -76.0 -26.3 31.8 56.8 34.4 62 63 A D S S- 0 0 133 1,-0.3 2,-0.5 2,-0.0 -1,-0.0 0.938 124.5 -20.1 -60.8 -97.1 32.7 56.8 30.7 63 64 A N - 0 0 10 1,-0.1 -1,-0.3 2,-0.1 -2,-0.1 -0.978 58.3-172.0-118.8 117.6 31.8 53.4 29.3 64 65 A D + 0 0 39 -2,-0.5 -6,-2.9 -3,-0.2 2,-0.3 0.291 44.3 124.5 -93.1 12.5 31.5 50.7 32.0 65 66 A Y E +A 57 0A 0 -8,-0.2 2,-0.3 -32,-0.1 -8,-0.1 -0.527 22.4 153.4 -84.7 137.6 31.1 47.8 29.6 66 67 A I E - 0 0 9 -10,-0.5 2,-2.0 -2,-0.3 -10,-0.4 -0.949 50.1-113.2-154.2 134.2 33.2 44.7 29.3 67 68 A N E S+ 0 0 0 -25,-0.6 17,-1.6 -2,-0.3 2,-0.3 -0.509 76.0 112.0 -73.5 83.6 32.1 41.4 27.9 68 69 A A E - B 0 83A 0 -2,-2.0 -12,-2.5 15,-0.2 2,-0.3 -0.977 47.7-154.5-156.0 142.7 32.1 39.4 31.2 69 70 A S E -AB 55 82A 0 13,-2.6 13,-2.3 -2,-0.3 2,-0.7 -0.885 17.5-128.2-121.6 150.9 29.5 37.8 33.4 70 71 A L E - B 0 81A 49 -16,-2.7 2,-0.8 -2,-0.3 11,-0.2 -0.877 20.4-159.7 -97.7 117.0 29.5 37.0 37.2 71 72 A I E - B 0 80A 1 9,-3.8 9,-2.3 -2,-0.7 2,-0.6 -0.878 9.6-168.2 -98.8 111.3 28.5 33.4 37.7 72 73 A K E - B 0 79A 108 -2,-0.8 2,-1.1 7,-0.2 7,-0.2 -0.885 11.1-166.7-105.8 114.5 27.3 33.0 41.3 73 74 A M E >> - B 0 78A 12 5,-2.7 4,-1.5 -2,-0.6 5,-1.4 -0.774 7.6-172.6-101.5 89.4 26.8 29.5 42.6 74 75 A E T 45S+ 0 0 174 -2,-1.1 -1,-0.2 1,-0.2 3,-0.1 0.875 79.6 41.9 -46.0 -56.3 24.8 30.1 45.7 75 76 A E T 45S+ 0 0 93 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.870 118.4 44.7 -65.6 -40.1 24.8 26.6 47.2 76 77 A A T 45S- 0 0 6 2,-0.2 -1,-0.2 160,-0.0 -2,-0.2 0.657 102.3-137.1 -78.0 -14.3 28.4 25.9 46.3 77 78 A Q T <5 + 0 0 141 -4,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.987 61.0 126.5 52.3 60.5 29.3 29.3 47.7 78 79 A R E < -B 73 0A 32 -5,-1.4 -5,-2.7 126,-0.1 2,-0.4 -0.987 41.4-164.4-148.2 134.8 31.6 29.8 44.7 79 80 A S E -B 72 0A 41 -2,-0.3 131,-0.9 124,-0.3 2,-0.3 -0.964 5.6-177.5-125.7 144.1 31.7 32.7 42.2 80 81 A Y E -Bc 71 210A 0 -9,-2.3 -9,-3.8 -2,-0.4 2,-0.6 -0.987 20.1-142.6-136.7 146.2 33.5 32.9 38.9 81 82 A I E -Bc 70 211A 0 129,-3.0 131,-2.9 -2,-0.3 2,-0.5 -0.953 20.2-162.1-106.9 117.7 33.8 35.7 36.3 82 83 A L E +Bc 69 212A 0 -13,-2.3 -13,-2.6 -2,-0.6 2,-0.3 -0.884 18.8 165.0-102.2 133.2 33.6 34.4 32.8 83 84 A T E -Bc 68 213A 2 129,-2.1 131,-0.6 -2,-0.5 -15,-0.2 -0.980 36.7-100.4-147.4 156.0 34.9 36.6 30.1 84 85 A Q - 0 0 5 -17,-1.6 132,-0.2 -2,-0.3 131,-0.1 -0.344 55.7 -83.0 -72.3 155.1 36.0 36.6 26.4 85 86 A G - 0 0 0 130,-2.6 -1,-0.1 34,-0.2 130,-0.1 -0.430 62.4-101.5 -59.3 118.4 39.7 36.6 25.5 86 87 A P - 0 0 2 0, 0.0 35,-1.9 0, 0.0 -1,-0.1 0.009 35.2-133.1 -45.1 150.9 40.7 40.2 25.7 87 88 A L >> - 0 0 18 33,-0.1 3,-1.7 -45,-0.1 4,-0.7 -0.574 31.6 -94.7-100.0 165.1 40.9 42.1 22.4 88 89 A P T 34 S+ 0 0 116 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.838 128.5 38.2 -48.1 -35.8 43.8 44.4 21.3 89 90 A N T 34 S+ 0 0 73 -48,-0.2 4,-0.2 1,-0.2 3,-0.1 0.487 112.4 55.2 -97.3 -4.0 41.7 47.3 22.6 90 91 A T T <> S+ 0 0 8 -3,-1.7 4,-2.4 1,-0.1 -1,-0.2 0.301 72.5 100.0-112.1 12.0 40.2 45.8 25.8 91 92 A C H X S+ 0 0 12 -4,-0.7 4,-2.1 -3,-0.3 5,-0.1 0.837 85.8 48.6 -64.7 -33.9 43.3 44.6 27.6 92 93 A G H > S+ 0 0 2 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.820 111.4 50.3 -73.9 -31.8 43.3 47.6 29.9 93 94 A H H > S+ 0 0 13 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.882 108.5 54.7 -69.6 -39.9 39.6 47.0 30.6 94 95 A F H X S+ 0 0 2 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.947 112.7 39.8 -60.2 -50.1 40.5 43.4 31.3 95 96 A W H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.795 110.5 59.2 -72.8 -25.2 43.0 44.2 33.9 96 97 A E H X S+ 0 0 15 -4,-1.7 4,-3.2 2,-0.2 -1,-0.2 0.899 106.7 49.0 -66.4 -38.9 40.9 47.0 35.3 97 98 A M H X S+ 0 0 0 -4,-2.1 4,-3.5 2,-0.2 5,-0.3 0.944 108.4 52.4 -63.6 -48.9 38.2 44.4 36.0 98 99 A V H <>S+ 0 0 0 -4,-1.9 5,-2.1 1,-0.2 4,-0.4 0.888 114.9 42.7 -54.7 -41.7 40.7 42.1 37.7 99 100 A W H ><5S+ 0 0 21 -4,-2.1 3,-1.1 3,-0.2 -2,-0.2 0.961 116.1 46.8 -69.7 -52.1 41.8 45.0 40.0 100 101 A E H 3<5S+ 0 0 37 -4,-3.2 -2,-0.2 1,-0.3 -3,-0.2 0.866 115.3 45.5 -59.8 -38.6 38.3 46.3 40.6 101 102 A Q T 3<5S- 0 0 47 -4,-3.5 -1,-0.3 -5,-0.2 -2,-0.2 0.537 106.8-128.0 -83.4 -4.5 36.9 42.8 41.4 102 103 A K T < 5 - 0 0 127 -3,-1.1 106,-2.7 -4,-0.4 -3,-0.2 0.871 40.8-179.5 61.3 38.9 39.9 42.0 43.6 103 104 A S < - 0 0 4 -5,-2.1 -1,-0.2 -6,-0.2 107,-0.1 -0.401 23.5-164.1 -71.2 148.4 40.6 38.8 41.7 104 105 A R + 0 0 52 104,-0.5 67,-2.4 98,-0.4 2,-0.3 0.753 69.9 32.0-100.3 -36.6 43.5 36.7 42.9 105 106 A G E -d 171 0A 0 97,-0.4 106,-2.0 65,-0.2 2,-0.4 -0.850 56.4-153.6-128.5 161.2 43.8 34.4 39.8 106 107 A V E -de 172 211A 0 65,-2.4 67,-3.2 -2,-0.3 2,-0.6 -1.000 15.0-156.6-128.9 127.4 43.3 34.4 36.1 107 108 A V E -de 173 212A 0 104,-3.4 106,-2.3 -2,-0.4 2,-0.5 -0.929 8.5-173.3-112.6 118.9 42.5 31.1 34.3 108 109 A M E +de 174 213A 0 65,-2.9 67,-3.1 -2,-0.6 106,-0.2 -0.945 9.9 179.8-112.5 125.3 43.3 30.8 30.6 109 110 A L + 0 0 0 104,-2.1 2,-0.3 -2,-0.5 105,-0.1 0.063 63.0 48.2-112.0 24.5 42.2 27.7 28.8 110 111 A N S S- 0 0 3 103,-0.2 2,-0.3 104,-0.2 65,-0.1 -0.855 77.7-106.7-148.3-178.9 43.5 28.5 25.3 111 112 A R - 0 0 81 -2,-0.3 8,-0.2 1,-0.1 3,-0.1 -0.869 32.4-114.3-115.7 151.2 46.5 29.7 23.4 112 113 A V S S+ 0 0 33 -2,-0.3 7,-3.1 1,-0.2 8,-1.2 0.882 107.8 31.3 -50.9 -40.7 47.0 33.2 21.9 113 114 A M E S+I 118 0B 97 5,-0.2 2,-0.3 6,-0.2 5,-0.2 -0.980 70.4 164.0-125.0 131.2 47.0 31.5 18.5 114 115 A E E > +I 117 0B 4 3,-2.3 3,-1.9 -2,-0.4 -4,-0.0 -0.995 68.8 9.0-142.3 143.5 45.2 28.3 17.5 115 116 A K T 3 S- 0 0 108 -2,-0.3 -1,-0.1 1,-0.3 3,-0.1 0.848 131.1 -61.6 56.1 33.4 44.3 26.8 14.1 116 117 A G T 3 S+ 0 0 66 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.536 118.6 89.8 73.3 6.6 46.6 29.4 12.6 117 118 A S E < S-I 114 0B 56 -3,-1.9 -3,-2.3 0, 0.0 2,-0.3 -0.893 83.8 -89.6-133.2 163.9 44.6 32.4 13.8 118 119 A L E +I 113 0B 114 -2,-0.3 -5,-0.2 -5,-0.2 3,-0.1 -0.561 36.8 168.8 -75.2 131.7 44.3 34.7 16.9 119 120 A K S S+ 0 0 39 -7,-3.1 2,-0.3 1,-0.5 -34,-0.2 0.446 71.3 3.5-116.2 -9.9 42.0 33.5 19.6 120 121 A C S S- 0 0 2 -8,-1.2 -1,-0.5 -36,-0.1 -33,-0.1 -0.944 78.7-103.1-171.0 153.3 43.1 36.0 22.2 121 122 A A - 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0 0 83 1,-0.2 3,-2.8 3,-0.0 -1,-0.2 -0.733 64.4-179.5-110.3 83.0 24.8 12.3 49.2 240 241 A P G > S+ 0 0 31 0, 0.0 3,-1.2 0, 0.0 -1,-0.2 0.770 81.1 66.5 -53.6 -25.4 27.5 13.1 46.6 241 242 A S G 3 S+ 0 0 61 1,-0.3 -7,-0.0 -3,-0.1 -2,-0.0 0.379 84.4 76.8 -77.0 8.0 25.6 11.0 44.1 242 243 A S G < + 0 0 46 -3,-2.8 2,-0.8 -9,-0.1 -1,-0.3 0.252 66.2 111.4 -99.2 11.2 22.8 13.6 44.3 243 244 A V < - 0 0 8 -3,-1.2 2,-0.8 -4,-0.0 -241,-0.1 -0.769 50.9-164.1 -92.0 111.0 24.8 16.0 42.1 244 245 A D > - 0 0 59 -2,-0.8 4,-2.6 1,-0.2 3,-0.3 -0.819 5.0-165.8 -98.0 106.0 23.1 16.5 38.7 245 246 A I H > S+ 0 0 0 -2,-0.8 4,-3.0 1,-0.2 5,-0.2 0.851 88.2 55.1 -57.7 -38.3 25.5 18.1 36.3 246 247 A K H > S+ 0 0 53 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.909 110.7 47.6 -62.7 -39.2 22.8 19.0 33.8 247 248 A K H > S+ 0 0 106 -3,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.937 112.6 47.9 -66.5 -46.1 21.0 20.8 36.5 248 249 A V H X S+ 0 0 7 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.891 110.0 52.8 -63.6 -37.4 24.1 22.6 37.6 249 250 A L H X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.901 108.8 49.5 -64.8 -39.3 25.0 23.6 34.1 250 251 A L H < S+ 0 0 36 -4,-2.0 -223,-0.3 2,-0.2 -1,-0.2 0.852 106.9 55.7 -67.6 -34.3 21.5 25.1 33.6 251 252 A E H >< S+ 0 0 66 -4,-1.9 3,-1.1 1,-0.2 -1,-0.2 0.910 109.3 47.1 -63.7 -41.4 21.9 27.0 36.9 252 253 A M H >X S+ 0 0 0 -4,-1.9 3,-2.3 1,-0.2 4,-1.1 0.872 102.2 63.8 -67.7 -36.0 25.1 28.5 35.5 253 254 A R T 3< S+ 0 0 10 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.454 87.2 71.1 -70.4 2.3 23.5 29.3 32.2 254 255 A K T <4 S+ 0 0 87 -3,-1.1 -1,-0.3 -4,-0.2 -2,-0.2 0.622 106.4 40.0 -85.5 -17.2 21.2 31.7 34.0 255 256 A F T <4 S+ 0 0 34 -3,-2.3 -204,-0.4 1,-0.3 2,-0.3 0.691 129.3 10.1-104.0 -27.6 24.3 33.9 34.4 256 257 A R S >< S- 0 0 0 -4,-1.1 3,-0.7 -206,-0.1 -1,-0.3 -0.955 79.2-109.5-156.6 137.7 26.0 33.5 31.0 257 258 A M T 3 S+ 0 0 51 -208,-0.6 -3,-0.1 -2,-0.3 -229,-0.1 -0.271 86.7 5.7 -69.2 150.6 24.9 32.1 27.7 258 259 A G T 3 + 0 0 11 1,-0.2 2,-0.3 -5,-0.1 -1,-0.2 0.662 65.7 176.3 53.3 28.9 26.3 28.9 26.1 259 260 A L S < S+ 0 0 2 -3,-0.7 -40,-0.3 -10,-0.1 -1,-0.2 -0.521 74.8 25.1 -62.8 123.1 28.5 27.6 28.9 260 261 A I S S- 0 0 0 -42,-2.2 -41,-0.2 -2,-0.3 -1,-0.1 0.888 78.3-161.0 79.7 92.1 29.7 24.3 27.3 261 262 A Q + 0 0 88 2,-0.0 2,-0.3 4,-0.0 -42,-0.1 0.578 60.2 33.0 -81.6 -15.3 29.3 24.7 23.6 262 263 A T S > S- 0 0 57 -43,-0.1 4,-2.1 1,-0.1 5,-0.1 -0.922 74.5-114.2-141.1 168.3 29.3 21.1 22.3 263 264 A A H > S+ 0 0 19 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.832 118.0 56.2 -67.8 -33.1 28.2 17.6 23.1 264 265 A D H > S+ 0 0 91 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.953 108.1 46.6 -63.0 -49.5 31.9 16.7 23.3 265 266 A Q H > S+ 0 0 21 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.888 112.4 50.8 -59.3 -40.7 32.5 19.3 25.9 266 267 A L H X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.919 111.5 47.1 -64.1 -43.2 29.5 18.1 27.8 267 268 A R H X S+ 0 0 85 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.930 111.0 53.2 -63.1 -43.6 30.7 14.5 27.7 268 269 A F H X S+ 0 0 2 -4,-3.0 4,-3.0 1,-0.2 -1,-0.2 0.857 102.8 56.8 -59.4 -38.1 34.1 15.7 28.8 269 270 A S H X S+ 0 0 0 -4,-2.1 4,-3.0 2,-0.2 -1,-0.2 0.903 106.5 50.8 -61.1 -41.2 32.6 17.5 31.8 270 271 A Y H X S+ 0 0 0 -4,-1.5 4,-3.4 2,-0.2 5,-0.3 0.959 110.7 47.8 -60.1 -51.7 31.1 14.2 32.9 271 272 A L H X S+ 0 0 32 -4,-2.2 4,-3.3 1,-0.2 5,-0.4 0.928 112.9 50.0 -54.8 -47.2 34.5 12.5 32.6 272 273 A A H X S+ 0 0 0 -4,-3.0 4,-2.3 2,-0.2 -2,-0.2 0.940 116.0 39.9 -58.0 -51.7 36.2 15.3 34.5 273 274 A V H X S+ 0 0 0 -4,-3.0 4,-1.6 2,-0.2 -2,-0.2 0.952 119.6 46.4 -64.0 -48.9 33.7 15.2 37.4 274 275 A I H X S+ 0 0 16 -4,-3.4 4,-1.4 -5,-0.2 3,-0.4 0.935 117.8 40.9 -57.8 -52.7 33.4 11.4 37.4 275 276 A E H < S+ 0 0 100 -4,-3.3 4,-0.4 -5,-0.3 -1,-0.2 0.882 115.5 54.1 -64.3 -37.6 37.2 10.8 37.3 276 277 A G H X S+ 0 0 1 -4,-2.3 4,-2.8 -5,-0.4 3,-0.3 0.753 102.9 57.3 -68.6 -25.0 37.6 13.7 39.7 277 278 A A H X S+ 0 0 16 -4,-1.6 4,-2.0 -3,-0.4 5,-0.2 0.904 94.8 61.0 -73.7 -44.6 35.2 12.2 42.2 278 279 A K H < S+ 0 0 125 -4,-1.4 -1,-0.2 1,-0.2 4,-0.2 0.701 119.0 34.1 -56.4 -15.5 37.1 8.9 42.6 279 280 A F H >4 S+ 0 0 151 -4,-0.4 3,-0.9 -3,-0.3 -2,-0.2 0.836 115.9 47.8-105.4 -51.9 39.8 11.2 43.8 280 281 A I H 3< S+ 0 0 25 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.2 0.630 102.9 69.3 -67.8 -12.5 38.3 14.1 45.6 281 282 A M T 3< 0 0 102 -4,-2.0 -1,-0.2 -5,-0.2 -3,-0.1 0.862 360.0 360.0 -74.1 -35.7 36.1 11.6 47.5 282 283 A G < 0 0 108 -3,-0.9 -2,-0.1 -5,-0.2 -3,-0.1 0.660 360.0 360.0 128.7 360.0 39.1 10.2 49.5