==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-OCT-09 3A88 . COMPND 2 MOLECULE: CATIONIC TRYPSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR J.YAMANE,M.YAO,I.TANAKA . 223 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9233.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 135 60.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 70 31.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 14 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 3 1 3 5 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 1 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 19 A I 0 0 2 0, 0.0 2,-0.5 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 124.0 -8.0 -8.7 14.5 2 20 A V B +A 171 0A 8 169,-3.2 169,-1.9 1,-0.2 123,-0.1 -0.876 360.0 6.0-101.2 132.1 -10.3 -9.4 17.5 3 21 A G S S+ 0 0 47 121,-0.6 -1,-0.2 -2,-0.5 169,-0.1 0.739 103.4 117.8 73.6 23.5 -12.0 -6.6 19.4 4 22 A G - 0 0 36 -3,-0.3 2,-0.3 167,-0.1 134,-0.2 0.015 57.7-110.6-101.0-153.7 -10.8 -3.9 17.0 5 23 A Y E -B 137 0B 97 132,-2.5 132,-2.8 -3,-0.1 2,-0.5 -0.945 34.7 -86.4-142.4 159.4 -12.5 -1.5 14.7 6 24 A T E -B 136 0B 74 -2,-0.3 130,-0.2 130,-0.2 129,-0.1 -0.608 36.8-151.7 -68.0 119.9 -13.0 -0.9 11.0 7 25 A a - 0 0 17 128,-2.1 -1,-0.2 -2,-0.5 129,-0.1 0.884 35.5-115.3 -60.8 -42.6 -9.9 1.1 9.9 8 26 A G > - 0 0 26 127,-0.5 3,-1.9 -3,-0.1 4,-0.3 0.038 46.5 -56.3 102.2 138.1 -11.5 3.0 7.1 9 27 A A T 3 S- 0 0 55 1,-0.3 44,-0.1 2,-0.1 43,-0.1 -0.232 118.1 -11.7 -54.5 124.6 -10.5 2.6 3.4 10 28 A N T 3 S+ 0 0 26 42,-0.4 -1,-0.3 2,-0.1 43,-0.1 0.654 91.5 125.7 60.3 23.6 -6.8 3.3 2.7 11 29 A T S < S+ 0 0 84 -3,-1.9 -2,-0.1 1,-0.2 -1,-0.1 0.545 75.2 50.4 -82.8 -9.4 -6.3 4.9 6.2 12 30 A V S > S+ 0 0 7 -4,-0.3 3,-2.0 87,-0.1 -1,-0.2 -0.708 74.0 175.1-124.9 73.7 -3.4 2.4 6.7 13 31 A P T 3 S+ 0 0 31 0, 0.0 88,-1.6 0, 0.0 38,-0.3 0.600 72.8 55.1 -70.6 -12.0 -1.5 3.1 3.4 14 32 A Y T 3 S+ 0 0 19 86,-0.2 15,-2.4 88,-0.1 2,-0.4 0.485 81.6 111.3 -91.6 -8.9 1.5 0.8 4.1 15 33 A Q E < -J 28 0C 5 -3,-2.0 37,-0.4 13,-0.2 36,-0.4 -0.554 48.4-173.2 -71.0 123.0 -0.7 -2.2 4.8 16 34 A V E -J 27 0C 0 11,-2.7 11,-1.0 -2,-0.4 2,-0.5 -0.835 19.1-141.4-113.8 155.0 -0.4 -4.9 2.2 17 35 A S E -JK 26 49C 1 32,-2.3 32,-2.9 -2,-0.3 2,-0.6 -0.971 15.0-142.9-108.7 128.2 -2.2 -8.2 1.5 18 36 A L E -JK 25 48C 0 7,-3.3 6,-2.5 -2,-0.5 7,-1.0 -0.851 24.1-166.1 -90.6 126.8 -0.1 -11.1 0.4 19 37 A N E +JK 23 47C 18 28,-2.8 28,-2.6 -2,-0.6 4,-0.2 -0.946 31.6 166.6-123.2 129.2 -2.2 -13.1 -2.1 20 38 A S S S- 0 0 30 2,-2.2 3,-0.1 -2,-0.4 26,-0.1 -0.288 97.7 -46.9-127.7 46.0 -1.6 -16.6 -3.5 21 39 A G S S+ 0 0 71 26,-0.1 2,-0.3 1,-0.0 -2,-0.1 0.186 140.6 28.2 101.6 -11.0 -5.1 -17.0 -5.1 22 40 A Y S S- 0 0 131 -4,-0.0 -2,-2.2 0, 0.0 2,-0.2 -0.937 103.3 -80.0-168.2 153.5 -6.5 -15.7 -1.7 23 41 A H E +J 19 0C 35 -2,-0.3 -4,-0.2 -4,-0.2 3,-0.1 -0.509 52.6 157.3 -59.7 132.5 -5.3 -13.4 1.1 24 42 A F E + 0 0 34 -6,-2.5 2,-0.3 1,-0.4 151,-0.2 0.521 57.9 7.0-133.0 -14.5 -3.0 -15.4 3.4 25 43 A b E -J 18 0C 7 -7,-1.0 -7,-3.3 151,-0.1 -1,-0.4 -0.980 61.8-122.1-161.0 156.3 -0.8 -12.8 5.2 26 44 A G E +J 17 0C 0 151,-2.9 12,-0.4 -2,-0.3 2,-0.3 -0.392 27.9 177.7 -88.5 177.2 -0.3 -9.1 5.9 27 45 A G E -J 16 0C 0 -11,-1.0 -11,-2.7 -2,-0.1 2,-0.4 -0.947 24.8-118.9-167.9 171.1 2.9 -7.2 5.2 28 46 A S E -JL 15 36C 0 8,-2.6 8,-2.9 -2,-0.3 2,-0.5 -0.988 19.8-131.0-128.2 128.0 4.2 -3.6 5.4 29 47 A L E + L 0 35C 1 -15,-2.4 74,-2.3 -2,-0.4 6,-0.2 -0.660 27.4 173.9 -75.7 123.5 5.4 -1.5 2.4 30 48 A I E - 0 0 18 4,-2.5 2,-0.3 -2,-0.5 5,-0.2 0.592 66.2 -9.9-111.6 -15.9 8.8 -0.0 3.4 31 49 A N E > S- L 0 34C 49 3,-1.3 3,-0.7 70,-0.1 -1,-0.3 -0.927 89.5 -75.8-160.8-176.5 9.8 1.5 0.0 32 50 A S T 3 S+ 0 0 41 -2,-0.3 62,-3.4 1,-0.2 60,-0.1 0.713 128.8 28.1 -59.8 -20.6 8.5 1.5 -3.6 33 51 A Q T 3 S+ 0 0 75 60,-0.2 57,-2.9 1,-0.1 2,-0.4 0.427 110.3 68.9-119.3 -4.1 10.0 -2.0 -4.2 34 52 A W E < -LM 31 89C 0 -3,-0.7 -4,-2.5 55,-0.2 -3,-1.3 -0.971 47.1-170.0-134.6 140.3 10.1 -3.8 -0.8 35 53 A V E -LM 29 88C 0 53,-2.6 53,-2.6 -2,-0.4 2,-0.4 -0.953 14.6-145.9-122.0 140.0 7.7 -5.3 1.7 36 54 A V E +LM 28 87C 0 -8,-2.9 -8,-2.6 -2,-0.4 2,-0.2 -0.915 33.8 149.9-103.0 132.5 8.4 -6.6 5.2 37 55 A S E - M 0 86C 0 49,-2.8 49,-2.2 -2,-0.4 2,-0.3 -0.761 49.2 -71.3-140.8-170.7 6.4 -9.6 6.4 38 56 A A > - 0 0 0 -12,-0.4 3,-1.5 47,-0.3 47,-0.3 -0.694 32.2-131.5 -87.4 142.6 6.8 -12.6 8.8 39 57 A A G > S+ 0 0 2 -2,-0.3 3,-2.2 1,-0.3 -1,-0.1 0.834 108.2 65.4 -57.1 -34.4 9.1 -15.5 7.7 40 58 A H G 3 S+ 0 0 62 1,-0.3 -1,-0.3 41,-0.1 137,-0.0 0.625 93.1 63.6 -68.2 -8.4 6.3 -17.9 8.6 41 59 A b G < S+ 0 0 4 -3,-1.5 -1,-0.3 -15,-0.0 -2,-0.2 0.399 77.0 131.8 -87.2 -2.1 4.4 -16.3 5.7 42 60 A Y < + 0 0 133 -3,-2.2 2,-0.3 -4,-0.1 -3,-0.0 -0.273 20.9 133.8 -57.6 133.9 6.9 -17.5 3.2 43 61 A K - 0 0 56 3,-0.0 3,-0.3 0, 0.0 2,-0.1 -0.936 50.9-103.5-164.1 165.3 5.6 -19.3 0.1 44 62 A S S S+ 0 0 97 -2,-0.3 25,-0.0 1,-0.2 0, 0.0 -0.489 94.5 40.0 -87.0 163.3 6.3 -19.1 -3.6 45 63 A G S S+ 0 0 67 1,-0.2 2,-0.4 -2,-0.1 -1,-0.2 0.897 75.0 171.1 69.8 43.5 4.0 -17.4 -6.1 46 64 A I - 0 0 10 -3,-0.3 21,-2.6 21,-0.1 2,-0.5 -0.719 20.2-164.3 -87.3 134.3 3.2 -14.4 -4.0 47 65 A Q E -KN 19 66C 50 -28,-2.6 -28,-2.8 -2,-0.4 2,-0.5 -0.986 16.7-140.2-111.0 127.9 1.3 -11.4 -5.5 48 66 A V E -KN 18 65C 0 17,-2.8 17,-2.7 -2,-0.5 2,-0.6 -0.765 12.8-158.3 -88.7 127.1 1.5 -8.3 -3.3 49 67 A R E -KN 17 64C 51 -32,-2.9 -32,-2.3 -2,-0.5 3,-0.3 -0.933 13.4-178.2-113.2 113.0 -1.8 -6.3 -3.1 50 68 A L E + N 0 63C 2 13,-3.0 13,-2.1 -2,-0.6 -34,-0.1 -0.684 61.1 30.9-104.1 159.7 -1.4 -2.7 -2.2 51 69 A G S S+ 0 0 6 -36,-0.4 10,-0.3 -38,-0.3 2,-0.3 0.695 84.3 156.9 67.7 21.2 -4.1 -0.0 -1.7 52 70 A E + 0 0 9 -37,-0.4 -42,-0.4 -3,-0.3 -1,-0.2 -0.569 20.8 150.0 -81.5 139.7 -6.6 -2.7 -0.5 53 71 A D S S+ 0 0 15 1,-0.4 2,-0.7 4,-0.3 -1,-0.1 0.357 80.6 29.9-116.8 -82.4 -9.6 -2.1 1.7 54 72 A N S > S- 0 0 28 80,-0.2 3,-1.3 1,-0.2 -1,-0.4 -0.666 73.1-160.2 -75.6 112.8 -12.2 -4.8 0.8 55 73 A I T 3 S+ 0 0 29 78,-2.3 -1,-0.2 -2,-0.7 79,-0.1 0.586 88.2 52.3 -74.3 -5.3 -10.0 -7.7 -0.3 56 74 A N T 3 S+ 0 0 122 77,-0.1 2,-0.4 1,-0.1 -1,-0.2 0.334 105.9 56.3-107.9 3.6 -12.9 -9.3 -2.2 57 75 A V S < S- 0 0 76 -3,-1.3 2,-0.8 76,-0.1 -4,-0.3 -0.999 77.9-127.8-138.5 131.9 -13.9 -6.2 -4.3 58 76 A V + 0 0 116 -2,-0.4 -3,-0.1 1,-0.2 -6,-0.0 -0.738 34.1 173.1 -79.5 114.1 -11.9 -4.1 -6.7 59 77 A E - 0 0 99 -2,-0.8 -1,-0.2 -5,-0.2 -7,-0.0 0.530 50.4 -96.5-108.2 -12.0 -12.6 -0.6 -5.3 60 78 A G S S+ 0 0 61 -9,-0.0 -8,-0.1 0, 0.0 -2,-0.1 0.295 105.2 72.7 121.9 -11.5 -10.2 1.6 -7.4 61 79 A N + 0 0 65 -10,-0.3 -9,-0.1 38,-0.0 2,-0.1 0.337 66.7 123.4-116.0 7.7 -7.0 2.2 -5.5 62 80 A E - 0 0 34 -13,-0.0 2,-0.4 -11,-0.0 -11,-0.2 -0.310 38.4-168.6 -68.1 146.5 -5.4 -1.3 -5.8 63 81 A Q E -N 50 0C 39 -13,-2.1 -13,-3.0 2,-0.1 2,-0.6 -0.963 7.4-164.1-127.8 120.9 -2.0 -2.1 -7.2 64 82 A F E +N 49 0C 77 -2,-0.4 2,-0.4 -15,-0.2 -15,-0.2 -0.926 16.5 170.1-102.8 119.6 -1.4 -5.8 -7.7 65 83 A I E -N 48 0C 14 -17,-2.7 -17,-2.8 -2,-0.6 -2,-0.1 -0.990 29.3-126.9-135.6 123.5 2.4 -6.5 -8.2 66 84 A S E -N 47 0C 52 -2,-0.4 25,-2.9 -19,-0.3 26,-0.3 -0.347 28.9-111.1 -64.5 146.4 4.0 -10.0 -8.3 67 85 A A E -O 90 0C 16 -21,-2.6 23,-0.3 23,-0.2 3,-0.1 -0.591 23.0-167.8 -74.4 135.9 6.9 -10.7 -6.0 68 86 A S E S- 0 0 60 21,-3.0 2,-0.3 1,-0.4 22,-0.2 0.711 71.8 -2.1 -92.8 -27.8 10.3 -11.2 -7.8 69 87 A K E -O 89 0C 85 20,-1.2 20,-2.8 2,-0.0 2,-0.4 -0.981 56.2-150.5-160.7 151.8 12.1 -12.6 -4.8 70 88 A S E -O 88 0C 41 -2,-0.3 2,-0.4 18,-0.2 18,-0.2 -0.952 7.8-164.1-122.2 143.2 11.6 -13.4 -1.2 71 89 A I E -O 87 0C 36 16,-2.9 16,-2.6 -2,-0.4 2,-0.3 -0.918 6.2-159.3-130.2 105.1 14.4 -13.4 1.5 72 90 A V E -O 86 0C 48 -2,-0.4 14,-0.2 14,-0.2 12,-0.1 -0.596 42.4 -88.0 -76.5 142.7 13.7 -15.2 4.7 73 91 A H > - 0 0 23 12,-2.4 3,-1.8 -2,-0.3 -1,-0.1 -0.227 35.2-123.8 -50.5 136.9 15.9 -14.0 7.6 74 92 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.799 109.8 41.6 -56.1 -27.9 19.1 -16.1 7.6 75 93 A S T 3 S+ 0 0 72 8,-0.1 2,-0.1 2,-0.1 -2,-0.1 0.197 78.9 142.3-108.9 15.7 18.5 -17.2 11.3 76 94 A Y < - 0 0 56 -3,-1.8 2,-0.5 9,-0.1 7,-0.2 -0.369 32.0-164.3 -59.7 129.0 14.7 -17.8 11.1 77 95 A N > - 0 0 64 5,-2.1 4,-2.2 1,-0.1 5,-0.5 -0.973 7.7-163.0-116.5 112.5 13.7 -20.9 13.2 78 96 A S T 4 S+ 0 0 80 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.679 87.1 56.0 -72.2 -17.5 10.3 -22.1 12.3 79 97 A N T 4 S+ 0 0 151 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.908 123.5 21.6 -77.9 -45.2 10.0 -24.1 15.5 80 98 A T T 4 S- 0 0 73 2,-0.1 -2,-0.2 -3,-0.0 -1,-0.1 0.600 97.2-131.5 -95.3 -16.1 10.6 -21.3 18.0 81 99 A L >< + 0 0 33 -4,-2.2 3,-0.8 1,-0.3 2,-0.2 0.606 49.0 160.0 65.2 17.8 9.6 -18.5 15.5 82 100 A N T 3 + 0 0 38 -5,-0.5 -5,-2.1 1,-0.2 -1,-0.3 -0.509 66.9 16.0 -65.4 137.2 12.8 -16.7 16.5 83 101 A N T 3 S+ 0 0 18 -7,-0.2 2,-2.0 1,-0.2 -1,-0.2 0.909 80.0 180.0 61.9 47.8 13.8 -14.1 13.8 84 102 A D < + 0 0 1 -3,-0.8 2,-0.3 75,-0.2 123,-0.2 -0.499 35.8 114.3 -82.1 75.1 10.3 -14.3 12.2 85 103 A I + 0 0 0 -2,-2.0 -12,-2.4 -47,-0.3 2,-0.3 -0.997 36.4 177.2-148.7 144.3 10.9 -11.7 9.4 86 104 A M E -MO 37 72C 0 -49,-2.2 -49,-2.8 -2,-0.3 2,-0.4 -0.991 19.0-140.7-148.7 143.8 11.1 -11.8 5.7 87 105 A L E -MO 36 71C 0 -16,-2.6 -16,-2.9 -2,-0.3 2,-0.4 -0.882 13.7-163.7-105.5 140.9 11.6 -9.3 2.9 88 106 A I E -MO 35 70C 0 -53,-2.6 -53,-2.6 -2,-0.4 2,-0.4 -0.994 7.2-150.6-125.2 124.7 9.7 -9.5 -0.4 89 107 A K E -MO 34 69C 41 -20,-2.8 -21,-3.0 -2,-0.4 -20,-1.2 -0.823 16.1-130.7 -95.4 135.8 10.8 -7.5 -3.5 90 108 A L E - O 0 67C 2 -57,-2.9 -23,-0.2 -2,-0.4 -24,-0.1 -0.603 11.7-130.1 -81.8 141.2 8.2 -6.4 -6.0 91 109 A K S S+ 0 0 135 -25,-2.9 2,-0.3 -2,-0.3 -1,-0.1 0.785 96.8 17.7 -59.4 -30.3 8.7 -7.1 -9.8 92 110 A S S S- 0 0 66 -26,-0.3 2,-0.2 -60,-0.1 -1,-0.1 -0.968 96.9 -93.3-139.3 153.8 8.0 -3.4 -10.4 93 111 A A - 0 0 54 -2,-0.3 -60,-0.2 1,-0.1 -61,-0.1 -0.483 41.2-118.1 -70.3 135.3 8.0 -0.3 -8.2 94 112 A A - 0 0 7 -62,-3.4 2,-0.8 -2,-0.2 -1,-0.1 -0.380 25.3-115.4 -62.3 145.0 4.7 0.6 -6.6 95 113 A S - 0 0 79 -2,-0.1 2,-0.4 6,-0.0 -1,-0.1 -0.801 35.9-141.3 -83.6 112.6 3.3 4.0 -7.5 96 114 A L + 0 0 77 -2,-0.8 2,-0.2 3,-0.1 5,-0.2 -0.653 39.1 136.8 -87.4 132.6 3.4 5.9 -4.2 97 115 A N - 0 0 77 3,-2.6 3,-0.3 -2,-0.4 0, 0.0 -0.736 69.4 -66.3-151.3-169.6 0.6 8.3 -3.3 98 116 A S S S+ 0 0 91 1,-0.2 3,-0.1 -2,-0.2 -2,-0.0 0.827 133.2 39.5 -62.6 -29.9 -1.7 9.2 -0.3 99 117 A R S S+ 0 0 115 1,-0.2 2,-0.4 -87,-0.1 -48,-0.2 0.580 119.4 45.3 -99.9 -14.5 -3.3 5.8 -0.3 100 118 A V S S+ 0 0 0 -3,-0.3 -3,-2.6 -50,-0.1 2,-0.3 -0.955 79.4 146.5-130.3 109.2 -0.2 3.7 -1.0 101 119 A A - 0 0 27 -88,-1.6 -72,-0.3 -2,-0.4 2,-0.1 -0.985 44.5-112.5-146.0 148.6 2.7 4.8 1.1 102 120 A S - 0 0 56 -2,-0.3 2,-0.4 -72,-0.1 -72,-0.3 -0.437 26.6-131.5 -77.2 158.8 5.8 3.3 2.7 103 121 A I - 0 0 17 -74,-2.3 83,-0.1 -89,-0.2 -75,-0.0 -0.937 26.0-111.3-110.5 136.5 6.2 3.2 6.5 104 122 A S B -c 186 0B 67 81,-0.6 83,-2.7 -2,-0.4 -73,-0.1 -0.321 25.1-125.6 -65.1 141.7 9.4 4.4 8.2 105 123 A L - 0 0 29 81,-0.2 83,-0.1 -75,-0.1 -1,-0.1 -0.578 36.5 -99.4 -78.7 150.9 11.7 1.9 9.8 106 124 A P - 0 0 4 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.348 20.5-161.4 -69.0 154.3 12.6 2.6 13.5 107 125 A T S S+ 0 0 136 1,-0.4 2,-0.3 2,-0.0 -2,-0.0 0.527 84.2 16.2-105.9 -15.6 15.9 4.2 14.4 108 126 A S S S- 0 0 80 0, 0.0 -1,-0.4 0, 0.0 102,-0.1 -0.976 92.4 -93.0-146.4 163.3 15.5 3.0 18.0 109 127 A c - 0 0 56 -2,-0.3 2,-0.2 -3,-0.1 79,-0.0 -0.300 40.2-115.5 -72.8 153.4 13.4 0.4 19.7 110 128 A A - 0 0 28 78,-0.1 2,-0.3 1,-0.0 -1,-0.1 -0.513 27.3-126.8 -86.1 157.5 10.0 1.2 21.3 111 129 A S > - 0 0 84 -2,-0.2 3,-2.1 1,-0.1 31,-0.3 -0.741 31.6 -85.3-103.6 156.2 9.4 1.0 25.1 112 130 A A T 3 S+ 0 0 60 -2,-0.3 31,-0.2 1,-0.2 3,-0.1 -0.293 116.1 35.2 -50.3 136.4 6.7 -0.8 27.1 113 131 A G T 3 S+ 0 0 58 29,-2.8 -1,-0.2 1,-0.4 2,-0.2 0.135 81.6 130.9 97.5 -18.2 3.7 1.5 27.3 114 132 A T < - 0 0 40 -3,-2.1 28,-2.2 27,-0.1 -1,-0.4 -0.489 59.2-124.4 -64.9 134.6 4.0 3.0 23.8 115 133 A Q E -D 141 0B 119 26,-0.2 69,-0.5 -2,-0.2 2,-0.3 -0.667 33.8-176.1 -82.7 139.3 0.7 2.9 21.9 116 134 A d E -DE 140 183B 2 24,-2.5 24,-2.5 -2,-0.3 2,-0.5 -0.905 25.3-126.7-132.8 160.0 0.7 1.1 18.6 117 135 A L E -DE 139 182B 37 65,-3.0 65,-2.4 -2,-0.3 2,-0.4 -0.944 23.9-171.9-110.4 121.9 -1.6 0.4 15.7 118 136 A I E +DE 138 181B 0 20,-3.0 20,-2.2 -2,-0.5 2,-0.3 -0.912 12.5 176.6-113.4 138.2 -2.0 -3.2 14.6 119 137 A S E +D 137 0B 0 61,-1.2 2,-0.3 -2,-0.4 18,-0.2 -0.962 11.0 116.9-145.1 156.5 -3.9 -4.0 11.5 120 138 A G E -D 136 0B 1 16,-2.2 16,-2.0 -2,-0.3 56,-0.2 -0.936 59.4 -96.5 165.0 176.9 -5.0 -6.8 9.2 121 139 A W S S+ 0 0 2 54,-0.5 55,-0.2 -2,-0.3 3,-0.1 -0.013 73.9 127.6-105.6 22.2 -7.7 -9.0 7.6 122 140 A G - 0 0 0 1,-0.2 53,-0.3 9,-0.1 52,-0.1 -0.067 69.8 -52.3 -75.4 178.3 -7.4 -11.9 10.1 123 141 A N - 0 0 9 51,-2.9 8,-0.2 8,-0.2 -1,-0.2 -0.177 40.0-161.2 -50.8 139.9 -10.0 -13.7 12.2 124 142 A T + 0 0 42 6,-2.5 -121,-0.6 -3,-0.1 2,-0.4 0.387 66.1 80.7-106.0 -0.9 -12.2 -11.4 14.3 125 143 A K - 0 0 105 5,-0.3 5,-0.1 3,-0.2 -123,-0.1 -0.872 56.8-161.6-111.4 141.6 -13.5 -14.0 16.7 126 144 A S S S+ 0 0 57 -2,-0.4 71,-0.4 72,-0.1 -1,-0.1 0.692 96.3 25.3 -90.2 -22.9 -11.6 -15.3 19.7 127 145 A S S S+ 0 0 123 69,-0.1 -2,-0.1 71,-0.0 71,-0.0 0.840 129.7 17.4-102.9 -61.3 -13.7 -18.4 20.0 128 146 A G S S- 0 0 41 -4,-0.0 2,-0.4 1,-0.0 -3,-0.2 0.303 87.8 -87.3 -90.9-142.1 -15.2 -19.2 16.5 129 147 A T + 0 0 99 -5,-0.1 2,-0.3 -6,-0.1 -3,-0.1 -0.962 43.9 150.4-145.7 120.4 -14.2 -18.0 13.0 130 148 A S - 0 0 50 -2,-0.4 -6,-2.5 -5,-0.1 -5,-0.3 -0.904 24.0-156.9-150.7 121.1 -15.2 -15.0 11.0 131 149 A Y - 0 0 100 -2,-0.3 -8,-0.2 -8,-0.2 -9,-0.1 -0.876 15.5-139.5-103.4 125.2 -13.0 -13.3 8.4 132 150 A P - 0 0 18 0, 0.0 -77,-0.1 0, 0.0 4,-0.1 -0.352 5.8-149.2 -79.3 159.7 -13.6 -9.7 7.5 133 151 A D S S+ 0 0 73 -79,-0.1 -78,-2.3 -2,-0.1 2,-0.2 0.797 80.8 59.0 -93.9 -34.3 -13.5 -8.3 4.0 134 152 A V S S- 0 0 36 -80,-0.2 -80,-0.2 1,-0.1 2,-0.1 -0.569 100.8 -85.5 -96.9 160.2 -12.3 -4.8 5.0 135 153 A L - 0 0 5 -2,-0.2 -128,-2.1 -129,-0.1 -127,-0.5 -0.373 42.1-152.7 -70.6 133.0 -9.2 -3.9 7.0 136 154 A K E -BD 6 120B 47 -16,-2.0 -16,-2.2 -130,-0.2 2,-0.3 -0.770 7.8-160.1-107.3 152.5 -9.4 -4.0 10.8 137 155 A a E -BD 5 119B 2 -132,-2.8 -132,-2.5 -2,-0.3 2,-0.3 -0.920 8.4-170.4-131.6 151.2 -7.4 -2.0 13.3 138 156 A L E - D 0 118B 5 -20,-2.2 -20,-3.0 -2,-0.3 2,-0.5 -0.973 15.3-146.8-143.8 127.9 -6.5 -2.3 16.9 139 157 A K E + D 0 117B 103 -2,-0.3 -22,-0.2 -22,-0.2 -24,-0.0 -0.865 35.8 162.7 -90.8 126.7 -4.8 0.3 19.2 140 158 A A E - D 0 116B 0 -24,-2.5 -24,-2.5 -2,-0.5 2,-0.2 -0.998 34.0-121.7-148.0 143.4 -2.6 -1.5 21.7 141 159 A P E - D 0 115B 36 0, 0.0 23,-2.3 0, 0.0 2,-0.2 -0.561 30.5-111.6 -82.4 145.8 0.3 -0.8 24.1 142 160 A I B -F 163 0B 10 -28,-2.2 -29,-2.8 -31,-0.3 21,-0.3 -0.574 38.2-135.9 -66.2 137.6 3.6 -2.6 24.1 143 161 A L - 0 0 27 19,-2.9 19,-0.4 -2,-0.2 -29,-0.1 -0.647 24.6 -90.4 -96.5 156.3 3.9 -4.7 27.2 144 162 A S > - 0 0 46 -2,-0.2 4,-2.2 1,-0.1 5,-0.1 -0.314 31.4-122.0 -61.3 147.5 6.9 -5.0 29.5 145 163 A D H > S+ 0 0 85 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.867 112.8 55.9 -58.1 -35.7 9.4 -7.8 28.6 146 164 A S H > S+ 0 0 84 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.921 109.2 44.2 -66.3 -42.4 8.9 -9.3 32.1 147 165 A S H > S+ 0 0 28 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.863 113.5 52.8 -69.6 -32.7 5.1 -9.6 31.7 148 166 A e H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.956 111.4 44.8 -64.0 -51.0 5.7 -11.0 28.2 149 167 A K H < S+ 0 0 119 -4,-2.8 6,-0.2 1,-0.2 -2,-0.2 0.859 112.0 53.3 -63.2 -36.8 8.1 -13.6 29.5 150 168 A S H < S+ 0 0 95 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.861 109.0 49.7 -64.6 -36.2 5.7 -14.4 32.4 151 169 A A H < S+ 0 0 13 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.842 126.0 26.4 -69.1 -36.2 2.8 -14.9 29.9 152 170 A Y S >X S- 0 0 0 -4,-1.8 3,-1.9 -5,-0.1 4,-0.7 -0.592 85.2-157.5-131.3 70.6 4.9 -17.3 27.8 153 171 A P T 34 S+ 0 0 90 0, 0.0 -3,-0.1 0, 0.0 -4,-0.0 -0.185 77.2 4.0 -53.8 134.8 7.6 -18.9 29.9 154 172 A G T 34 S+ 0 0 93 2,-0.1 -4,-0.1 1,-0.1 -5,-0.1 0.511 117.4 80.1 72.8 9.6 10.6 -20.2 27.9 155 173 A Q T <4 + 0 0 87 -3,-1.9 2,-0.7 -6,-0.2 -1,-0.1 0.563 61.3 91.1-123.1 -17.8 9.4 -18.8 24.6 156 174 A I < - 0 0 19 -4,-0.7 2,-0.1 -7,-0.1 -2,-0.1 -0.791 52.9-174.0 -93.6 115.1 10.1 -15.1 24.4 157 175 A T > - 0 0 43 -2,-0.7 3,-1.7 1,-0.1 -2,-0.0 -0.440 44.6 -96.2 -95.7 175.4 13.5 -14.2 22.9 158 176 A S T 3 S+ 0 0 92 1,-0.3 53,-0.1 -2,-0.1 -1,-0.1 0.551 123.0 62.7 -66.9 -7.4 15.2 -10.8 22.6 159 177 A N T 3 S+ 0 0 24 48,-0.0 49,-2.6 51,-0.0 2,-0.3 0.176 98.4 68.3-102.3 14.6 13.7 -10.6 19.0 160 178 A M E < - G 0 207B 4 -3,-1.7 2,-0.3 47,-0.2 47,-0.2 -0.961 54.0-176.9-132.1 148.9 10.1 -10.7 20.3 161 179 A F E - G 0 206B 9 45,-2.2 45,-3.3 -2,-0.3 2,-0.4 -0.978 21.5-126.7-138.1 159.6 7.8 -8.4 22.2 162 180 A e E + G 0 205B 0 -19,-0.4 -19,-2.9 -2,-0.3 2,-0.3 -0.799 25.3 177.4 -99.7 144.8 4.3 -8.6 23.5 163 181 A A E +FG 142 204B 0 41,-1.9 41,-1.2 -2,-0.4 2,-0.4 -0.993 38.1 46.2-141.3 148.7 1.6 -6.1 22.8 164 182 A G S S- 0 0 2 -23,-2.3 2,-0.4 -2,-0.3 7,-0.1 -0.980 86.6 -37.5 132.7-139.2 -2.1 -6.0 23.8 165 183 A Y > - 0 0 48 5,-0.6 3,-2.0 -2,-0.4 5,-0.3 -0.975 26.8-153.2-141.3 116.6 -4.2 -6.6 26.9 166 184 A L T 3 S+ 0 0 55 -2,-0.4 35,-3.1 1,-0.3 36,-0.2 0.749 97.3 65.8 -63.2 -21.4 -3.6 -9.2 29.5 167 185 A E T 3 S- 0 0 134 33,-0.2 -1,-0.3 1,-0.2 33,-0.2 0.673 104.0-136.0 -71.8 -16.9 -7.3 -9.1 30.3 168 186 A G S < S+ 0 0 14 -3,-2.0 31,-0.2 31,-0.3 -1,-0.2 -0.219 70.4 99.5 86.8 177.2 -8.1 -10.6 26.8 169 187 A G S S+ 0 0 40 29,-2.4 2,-0.4 28,-0.1 30,-0.1 0.122 78.6 69.5 94.0 -21.5 -10.7 -9.5 24.2 170 188 A K + 0 0 77 -5,-0.3 -5,-0.6 29,-0.1 2,-0.3 -0.957 64.9 111.3-136.2 116.5 -8.4 -7.4 22.0 171 189 A D B -A 2 0A 5 -169,-1.9 -169,-3.2 -2,-0.4 2,-0.2 -0.973 61.6 -94.6-166.7 164.0 -5.6 -9.0 19.9 172 190 A S - 0 0 8 -2,-0.3 26,-0.3 -171,-0.2 2,-0.3 -0.448 48.2-177.3 -79.6 172.4 -4.4 -9.9 16.4 173 191 A f > - 0 0 12 -2,-0.2 3,-2.4 24,-0.1 4,-0.4 -0.873 35.2 -33.2-156.8-178.3 -5.2 -13.4 15.1 174 192 A Q T 3 S+ 0 0 134 1,-0.3 -51,-2.9 -2,-0.3 -149,-0.1 -0.255 124.7 29.4 -46.8 133.3 -4.8 -16.0 12.3 175 193 A G T 3 S+ 0 0 11 -53,-0.3 -54,-0.5 -151,-0.2 -1,-0.3 0.148 102.1 81.7 93.9 -19.7 -4.7 -14.2 9.0 176 194 A D X + 0 0 0 -3,-2.4 3,-2.2 -56,-0.2 15,-0.3 0.592 64.1 131.2 -85.1 -15.2 -3.1 -11.0 10.5 177 195 A S T 3 S+ 0 0 21 -4,-0.4 -151,-2.9 1,-0.3 15,-0.2 -0.041 70.5 16.7 -41.2 133.0 0.3 -12.8 10.4 178 196 A G T 3 S+ 0 0 0 13,-2.8 -1,-0.3 1,-0.3 -150,-0.2 0.255 97.9 127.4 87.6 -11.7 3.1 -10.7 8.8 179 197 A G < - 0 0 0 -3,-2.2 12,-2.3 1,-0.1 -1,-0.3 -0.124 60.2 -79.3 -77.0 174.1 1.2 -7.5 9.2 180 198 A P E - H 0 190B 0 0, 0.0 -61,-1.2 0, 0.0 2,-0.4 -0.397 21.4-168.3 -83.1 150.5 2.3 -4.2 10.8 181 199 A V E -EH 118 189B 0 8,-1.8 8,-2.0 -63,-0.2 7,-1.8 -0.967 25.6-172.0-124.6 110.0 2.6 -2.9 14.4 182 200 A V E -EH 117 187B 14 -65,-2.4 -65,-3.0 -2,-0.4 2,-0.4 -0.921 8.4-177.0-115.1 128.0 3.2 0.8 13.9 183 201 A d E > S-EH 116 186B 3 3,-2.6 3,-1.5 -2,-0.5 -67,-0.2 -0.991 71.7 -15.8-131.6 122.9 4.1 3.0 16.9 184 202 A S T 3 S- 0 0 107 -69,-0.5 -1,-0.1 -2,-0.4 3,-0.1 0.877 130.2 -51.2 47.8 43.9 4.6 6.8 16.6 185 203 A G T 3 S+ 0 0 40 1,-0.2 -81,-0.6 -3,-0.1 2,-0.4 0.581 117.2 107.9 77.2 13.1 4.9 6.4 12.8 186 204 A K E < S-cH 104 183B 74 -3,-1.5 -3,-2.6 -83,-0.1 2,-1.1 -0.953 74.7-118.6-122.3 142.8 7.6 3.7 12.9 187 205 A L E + H 0 182B 0 -83,-2.7 -5,-0.2 -2,-0.4 3,-0.1 -0.651 45.8 157.9 -77.3 100.2 7.2 -0.0 12.0 188 206 A Q E + 0 0 15 -7,-1.8 21,-1.7 -2,-1.1 22,-0.5 0.687 55.8 26.4 -97.2 -20.4 8.2 -1.6 15.4 189 207 A G E -IH 208 181B 0 -8,-2.0 -8,-1.8 19,-0.2 2,-0.4 -0.937 53.0-149.1-143.7 161.6 6.5 -5.0 15.1 190 208 A I E -IH 207 180B 0 17,-0.7 17,-2.2 -2,-0.3 2,-0.3 -0.997 41.2-105.1-128.6 135.4 5.3 -7.8 12.7 191 209 A V E +I 206 0B 6 -12,-2.3 -13,-2.8 -2,-0.4 15,-0.2 -0.453 58.1 152.7 -60.9 118.1 2.3 -10.0 13.7 192 210 A S E - 0 0 6 13,-1.6 2,-0.3 1,-0.3 14,-0.2 0.779 45.1 -38.5-119.2 -64.7 4.1 -13.3 14.6 193 211 A W E +I 205 0B 47 12,-2.2 12,-3.1 -19,-0.0 -1,-0.3 -0.939 41.5 167.6-159.2 175.9 2.3 -15.6 17.1 194 212 A G - 0 0 31 -2,-0.3 2,-0.8 10,-0.2 10,-0.1 -0.914 47.9 -86.9 179.2 169.8 0.3 -16.1 20.2 195 213 A S S S- 0 0 62 8,-0.3 4,-0.4 -2,-0.3 -2,-0.0 -0.843 94.2 -44.8 -94.5 107.8 -1.7 -18.8 22.1 196 214 A G S S- 0 0 54 -2,-0.8 2,-0.4 2,-0.1 -69,-0.1 -0.328 92.4 -72.0 60.3-153.8 -5.2 -18.6 20.5 197 215 A f S S- 0 0 15 -71,-0.4 -24,-0.1 -24,-0.1 -28,-0.1 -0.996 101.3 -3.4-139.7 135.3 -6.4 -15.0 20.1 198 216 A A S S+ 0 0 8 -2,-0.4 -29,-2.4 -26,-0.3 2,-0.2 0.721 86.3 155.4 61.8 24.3 -7.6 -12.4 22.6 199 217 A Q B > -P 202 0D 86 3,-0.5 3,-1.8 -4,-0.4 -31,-0.3 -0.558 53.7 -92.3 -81.1 147.6 -7.2 -15.0 25.4 200 218 A K T 3 S+ 0 0 150 1,-0.3 -33,-0.2 -33,-0.2 -34,-0.1 -0.349 109.5 3.5 -58.5 130.9 -6.7 -13.8 29.0 201 219 A N T 3 S+ 0 0 80 -35,-3.1 -1,-0.3 -36,-0.2 -35,-0.1 0.621 109.8 98.2 67.4 15.0 -2.9 -13.6 29.9 202 220 A K B < +P 199 0D 59 -3,-1.8 -3,-0.5 -37,-0.3 -4,-0.3 -0.629 53.9 177.1-131.2 73.6 -2.0 -14.6 26.3 203 221 A P - 0 0 3 0, 0.0 -8,-0.3 0, 0.0 -39,-0.2 -0.203 40.1 -80.8 -72.7 168.2 -1.2 -11.3 24.5 204 222 A G E -G 163 0B 0 -41,-1.2 -41,-1.9 -10,-0.1 2,-0.4 -0.398 39.3-140.5 -66.7 145.1 0.1 -11.1 20.9 205 223 A V E -GI 162 193B 1 -12,-3.1 -12,-2.2 -43,-0.2 -13,-1.6 -0.941 21.4-168.4-112.1 135.0 3.7 -11.8 20.2 206 224 A Y E -GI 161 191B 0 -45,-3.3 -45,-2.2 -2,-0.4 2,-0.2 -0.922 28.1-107.0-128.6 142.9 5.5 -9.6 17.6 207 225 A T E -GI 160 190B 3 -17,-2.2 2,-1.3 -2,-0.4 -17,-0.7 -0.517 37.2-123.7 -67.0 131.9 8.8 -9.6 15.8 208 226 A K E > - I 0 189B 43 -49,-2.6 3,-1.6 -2,-0.2 4,-0.3 -0.629 29.1-172.9 -84.7 90.3 11.0 -6.8 17.2 209 227 A V G > S+ 0 0 0 -21,-1.7 3,-2.5 -2,-1.3 4,-0.4 0.793 74.1 69.9 -60.0 -33.8 11.7 -4.9 14.0 210 228 A c G > S+ 0 0 20 -22,-0.5 3,-0.8 1,-0.3 4,-0.3 0.818 93.6 59.9 -58.4 -29.6 14.3 -2.5 15.5 211 229 A N G < S+ 0 0 68 -3,-1.6 -1,-0.3 1,-0.2 4,-0.2 0.677 107.6 46.0 -64.2 -18.1 16.7 -5.5 15.8 212 230 A Y G <> S+ 0 0 6 -3,-2.5 4,-3.0 -4,-0.3 -1,-0.2 0.341 76.5 101.8-112.6 1.5 16.6 -6.0 12.0 213 231 A V H <> S+ 0 0 23 -3,-0.8 4,-2.8 -4,-0.4 5,-0.2 0.900 84.6 50.0 -59.6 -43.1 17.0 -2.5 10.6 214 232 A S H > S+ 0 0 98 -4,-0.3 4,-2.4 2,-0.2 5,-0.2 0.932 114.1 45.4 -58.1 -48.9 20.7 -3.1 9.8 215 233 A W H > S+ 0 0 31 -4,-0.2 4,-2.4 2,-0.2 5,-0.2 0.907 113.2 50.4 -63.0 -43.2 19.9 -6.4 8.0 216 234 A I H X S+ 0 0 0 -4,-3.0 4,-2.8 2,-0.2 5,-0.2 0.946 112.5 46.3 -60.0 -50.4 16.9 -4.9 6.1 217 235 A K H X S+ 0 0 128 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.920 115.9 43.6 -62.1 -44.2 19.0 -1.9 4.9 218 236 A Q H X S+ 0 0 111 -4,-2.4 4,-0.8 -5,-0.2 -1,-0.2 0.871 113.4 52.2 -72.7 -33.5 22.0 -3.9 3.7 219 237 A T H >< S+ 0 0 8 -4,-2.4 3,-1.0 -5,-0.2 4,-0.4 0.947 111.8 45.6 -64.8 -48.6 19.7 -6.6 2.1 220 238 A I H >< S+ 0 0 37 -4,-2.8 3,-1.2 1,-0.2 -2,-0.2 0.903 107.3 60.1 -58.1 -41.1 17.8 -3.9 0.2 221 239 A A H 3< S+ 0 0 82 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.702 114.7 33.8 -63.8 -20.7 21.1 -2.3 -0.8 222 240 A S T << 0 0 97 -3,-1.0 -1,-0.2 -4,-0.8 -2,-0.2 0.224 360.0 360.0-119.7 13.1 22.4 -5.5 -2.6 223 241 A N < 0 0 73 -3,-1.2 -4,-0.0 -4,-0.4 -3,-0.0 -0.715 360.0 360.0-137.0 360.0 19.2 -7.0 -4.0