==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 05-SEP-07 2Z8K . COMPND 2 MOLECULE: GAMMA-GLUTAMYLTRANSPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.WADA,M.IRIE,K.FUKUYAMA . 1080 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36918.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 712 65.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 163 15.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 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 . 52 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 120 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 298 27.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 1.9 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 6 2 4 2 2 4 0 0 8 4 2 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 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 0 PARALLEL BRIDGES PER LADDER . 7 9 8 4 4 4 2 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 . 5 2 0 0 0 4 0 0 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 38 A E 0 0 97 0, 0.0 1029,-0.4 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -31.1 31.4 -5.1 -39.9 2 39 A D - 0 0 46 1,-0.1 1050,-0.1 1050,-0.1 3,-0.1 -0.665 360.0-164.1 -91.5 143.6 29.4 -8.3 -39.2 3 40 A V S S+ 0 0 7 -2,-0.3 2,-0.5 1,-0.2 -1,-0.1 0.763 85.3 49.3 -89.4 -32.0 30.3 -11.7 -40.8 4 41 A F S S- 0 0 34 1070,-0.1 464,-0.4 461,-0.0 -1,-0.2 -0.944 73.9-163.2-115.3 127.3 26.8 -13.1 -39.8 5 42 A H - 0 0 73 -2,-0.5 3,-0.1 1068,-0.5 2,-0.0 -0.913 13.3-132.6-114.8 131.8 23.6 -11.1 -40.5 6 43 A P - 0 0 24 0, 0.0 2,-0.3 0, 0.0 522,-0.2 -0.328 29.8-106.0 -74.7 160.0 20.2 -11.7 -39.0 7 44 A V E -A 527 0A 59 520,-2.9 520,-2.7 -2,-0.0 2,-0.4 -0.645 42.7-144.4 -80.0 144.8 17.1 -11.9 -41.2 8 45 A R E +A 526 0A 123 -2,-0.3 2,-0.3 518,-0.2 532,-0.2 -0.919 27.3 161.4-121.1 145.5 15.1 -8.6 -40.8 9 46 A A E -A 525 0A 7 516,-1.7 516,-2.6 -2,-0.4 4,-0.1 -0.977 28.2-150.0-152.2 153.7 11.4 -7.9 -40.7 10 47 A K S S+ 0 0 157 -2,-0.3 3,-0.1 514,-0.2 -1,-0.1 0.686 89.1 21.7-102.0 -21.2 9.3 -4.9 -39.4 11 48 A Q S S- 0 0 97 1,-0.4 2,-0.3 514,-0.1 351,-0.2 0.804 119.4 -3.7-110.3 -72.4 6.0 -6.6 -38.4 12 49 A G - 0 0 0 348,-0.1 529,-1.7 349,-0.1 -1,-0.4 -0.873 54.1-169.6-127.9 162.1 6.1 -10.4 -37.7 13 50 A M E -GH 358 540B 0 345,-2.5 345,-2.1 -2,-0.3 2,-0.4 -0.997 7.2-166.6-152.7 146.6 8.7 -13.2 -37.8 14 51 A V E -GH 357 539B 0 525,-2.8 525,-2.4 -2,-0.3 2,-0.4 -0.999 3.4-169.4-134.5 136.4 8.8 -17.0 -37.5 15 52 A A E +GH 356 538B 0 341,-2.5 341,-2.2 -2,-0.4 2,-0.3 -0.991 23.4 147.3-127.2 121.1 11.9 -19.1 -37.0 16 53 A S E - H 0 537B 0 521,-2.2 521,-2.3 -2,-0.4 339,-0.1 -0.953 57.8-107.0-148.3 168.0 11.7 -22.9 -37.4 17 54 A V S S+ 0 0 14 -2,-0.3 2,-0.4 337,-0.3 521,-0.1 0.533 101.6 59.8 -73.7 -6.3 13.7 -25.9 -38.6 18 55 A D > - 0 0 9 519,-0.2 4,-2.5 1,-0.1 518,-0.3 -0.977 67.6-148.5-133.2 127.6 11.6 -26.2 -41.7 19 56 A A H > S+ 0 0 32 516,-2.1 4,-2.3 -2,-0.4 5,-0.2 0.914 101.2 48.8 -54.9 -49.2 11.1 -23.8 -44.6 20 57 A T H > S+ 0 0 47 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.933 112.9 47.1 -58.8 -47.7 7.5 -24.9 -45.4 21 58 A A H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.887 110.6 52.9 -61.9 -40.1 6.4 -24.8 -41.7 22 59 A T H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.929 108.8 49.4 -61.4 -43.9 8.0 -21.3 -41.3 23 60 A Q H X S+ 0 0 104 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.833 106.8 55.9 -65.8 -32.0 6.1 -20.0 -44.3 24 61 A V H X S+ 0 0 16 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.934 109.0 47.6 -64.4 -44.2 2.9 -21.5 -42.9 25 62 A G H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.922 111.2 49.8 -62.5 -45.0 3.4 -19.5 -39.7 26 63 A V H X S+ 0 0 8 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.922 108.9 52.3 -61.2 -43.8 4.2 -16.3 -41.6 27 64 A D H X S+ 0 0 79 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.869 107.4 52.6 -61.3 -36.1 1.0 -16.7 -43.7 28 65 A I H <>S+ 0 0 5 -4,-1.8 5,-2.4 2,-0.2 4,-0.4 0.923 110.3 48.0 -64.5 -43.4 -1.0 -17.1 -40.6 29 66 A L H ><5S+ 0 0 1 -4,-2.1 3,-1.6 1,-0.2 -2,-0.2 0.930 110.5 51.4 -61.9 -45.0 0.4 -13.9 -39.2 30 67 A K H 3<5S+ 0 0 126 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.821 105.1 57.1 -61.5 -31.6 -0.3 -12.1 -42.5 31 68 A E T 3<5S- 0 0 124 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.545 129.2 -95.4 -76.9 -8.1 -3.9 -13.3 -42.3 32 69 A G T < 5S+ 0 0 42 -3,-1.6 -3,-0.2 -4,-0.4 -2,-0.1 0.422 77.3 139.3 110.9 -1.7 -4.3 -11.6 -39.0 33 70 A G < - 0 0 1 -5,-2.4 -1,-0.3 -6,-0.2 2,-0.1 -0.372 47.5-122.9 -73.6 156.2 -3.6 -14.4 -36.5 34 71 A N > - 0 0 25 325,-0.1 4,-2.6 326,-0.1 5,-0.2 -0.226 37.3 -83.6 -89.3-175.6 -1.5 -13.6 -33.4 35 72 A A H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.872 129.9 48.8 -56.5 -40.9 1.7 -15.3 -32.2 36 73 A V H > S+ 0 0 7 88,-0.3 4,-2.5 2,-0.2 5,-0.2 0.920 109.7 51.5 -67.3 -42.8 -0.1 -18.2 -30.6 37 74 A D H > S+ 0 0 0 87,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.951 114.8 43.3 -57.6 -49.1 -2.3 -18.8 -33.6 38 75 A A H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.900 111.0 55.0 -63.5 -42.5 0.8 -18.9 -35.8 39 76 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.900 110.3 45.6 -59.1 -42.4 2.7 -21.1 -33.3 40 77 A V H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.911 112.1 51.6 -68.6 -39.8 -0.0 -23.7 -33.3 41 78 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.909 111.7 47.3 -61.9 -41.7 -0.2 -23.6 -37.1 42 79 A V H X S+ 0 0 0 -4,-2.8 4,-2.9 2,-0.2 -1,-0.2 0.901 109.5 54.3 -65.8 -40.9 3.5 -24.1 -37.3 43 80 A G H X S+ 0 0 0 -4,-2.2 4,-1.0 1,-0.2 12,-0.3 0.885 111.4 44.1 -60.9 -41.4 3.3 -27.0 -34.7 44 81 A Y H < S+ 0 0 0 -4,-2.3 4,-0.3 2,-0.2 -1,-0.2 0.879 112.7 52.2 -72.0 -36.6 0.7 -28.8 -36.8 45 82 A A H >X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 3,-1.8 0.933 107.6 51.4 -65.1 -44.3 2.6 -28.2 -40.0 46 83 A L H 3X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.3 8,-0.3 0.796 97.5 67.4 -62.5 -28.1 5.9 -29.6 -38.5 47 84 A A H 3< S+ 0 0 8 -4,-1.0 -1,-0.3 -5,-0.2 9,-0.2 0.680 114.4 31.3 -65.0 -15.1 3.9 -32.7 -37.5 48 85 A V H <4 S+ 0 0 0 -3,-1.8 -2,-0.2 -4,-0.3 -1,-0.2 0.789 127.4 35.7-107.4 -47.2 3.6 -33.3 -41.2 49 86 A T H < S+ 0 0 3 -4,-2.6 -3,-0.2 1,-0.2 -2,-0.2 0.596 123.8 39.9 -87.5 -12.8 6.8 -31.9 -42.7 50 87 A H >X + 0 0 20 -4,-2.2 4,-2.6 -5,-0.3 3,-2.0 -0.451 60.6 162.6-134.6 61.0 9.2 -32.7 -39.9 51 88 A P T 34 + 0 0 6 0, 0.0 324,-0.2 0, 0.0 -1,-0.1 0.642 67.1 78.8 -55.6 -14.4 8.2 -36.2 -38.8 52 89 A Q T 34 S- 0 0 6 322,-0.1 323,-2.7 323,-0.1 324,-0.4 0.858 128.8 -21.5 -61.8 -37.6 11.7 -36.5 -37.1 53 90 A A T <4 S+ 0 0 3 -3,-2.0 300,-0.2 -7,-0.2 319,-0.1 0.488 112.1 97.6-145.7 -34.1 10.5 -34.3 -34.2 54 91 A G < + 0 0 2 -4,-2.6 2,-0.3 -8,-0.3 3,-0.1 -0.468 65.6 159.8 -59.8 143.9 7.4 -32.3 -35.3 55 92 A N - 0 0 6 -12,-0.3 -8,-0.2 1,-0.1 -7,-0.1 -0.993 63.9-160.1-165.8 167.4 4.6 -34.4 -33.9 56 93 A L S S+ 0 0 3 -2,-0.3 58,-0.5 331,-0.3 57,-0.2 0.404 102.7 58.3-122.0 -20.0 1.1 -35.3 -32.8 57 94 A G S S+ 0 0 0 330,-0.3 332,-1.8 -3,-0.1 52,-0.2 0.178 104.4 49.3 -99.8 17.8 2.4 -38.4 -30.9 58 95 A G S S- 0 0 0 330,-0.2 54,-2.0 53,-0.1 55,-1.5 -0.188 73.8-124.7-125.6-141.1 4.9 -36.7 -28.6 59 96 A G E +I 370 0B 0 311,-2.2 311,-3.2 53,-0.2 2,-0.3 -0.943 25.6 152.8-162.3-179.2 4.9 -33.8 -26.2 60 97 A G E -IJ 369 76B 0 16,-1.3 16,-2.3 -2,-0.3 2,-0.3 -0.977 33.4 -82.3 175.1-162.4 6.6 -30.5 -25.3 61 98 A F E -IJ 368 75B 0 307,-2.8 307,-2.4 -2,-0.3 2,-0.4 -0.960 21.4-158.6-137.2 152.3 6.5 -27.1 -23.7 62 99 A M E -IJ 367 74B 0 12,-1.8 12,-2.9 -2,-0.3 2,-0.5 -0.998 3.7-158.6-134.9 134.1 5.5 -23.6 -24.8 63 100 A L E -IJ 366 73B 0 303,-2.7 303,-2.4 -2,-0.4 2,-0.4 -0.965 16.0-171.4-111.8 126.1 6.5 -20.2 -23.3 64 101 A I E +IJ 365 72B 5 8,-2.8 8,-2.8 -2,-0.5 2,-0.4 -0.973 10.6 179.2-122.2 130.5 4.1 -17.4 -24.0 65 102 A R E -IJ 364 71B 20 299,-2.5 299,-2.6 -2,-0.4 6,-0.2 -0.951 19.1-145.1-133.2 114.1 4.7 -13.7 -23.3 66 103 A S > - 0 0 28 4,-2.5 3,-2.4 -2,-0.4 370,-0.1 -0.263 30.7-105.8 -71.5 161.7 2.0 -11.2 -24.3 67 104 A K T 3 S+ 0 0 138 1,-0.3 -1,-0.1 2,-0.1 369,-0.1 0.731 122.3 60.2 -58.8 -22.0 2.7 -7.7 -25.5 68 105 A N T 3 S- 0 0 124 2,-0.1 -1,-0.3 367,-0.0 3,-0.1 0.368 123.2-103.1 -89.5 3.8 1.6 -6.6 -22.0 69 106 A G S < S+ 0 0 23 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.212 70.6 146.2 97.4 -16.8 4.3 -8.6 -20.3 70 107 A N - 0 0 79 -5,-0.1 -4,-2.5 1,-0.0 2,-0.5 -0.397 29.3-168.3 -58.9 117.5 2.2 -11.5 -19.1 71 108 A T E +J 65 0B 21 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.939 13.4 160.9-116.8 129.6 4.5 -14.5 -19.2 72 109 A T E -J 64 0B 11 -8,-2.8 -8,-2.8 -2,-0.5 2,-0.4 -0.945 27.3-135.1-143.8 162.6 3.3 -18.1 -18.8 73 110 A A E -JK 63 238B 0 165,-1.9 165,-2.6 -2,-0.3 2,-0.5 -0.951 8.0-151.5-122.9 141.1 4.3 -21.7 -19.5 74 111 A I E -JK 62 237B 0 -12,-2.9 -12,-1.8 -2,-0.4 2,-0.8 -0.957 8.5-156.6-114.3 120.1 2.3 -24.5 -21.0 75 112 A D E +JK 61 236B 0 161,-3.0 161,-2.9 -2,-0.5 -14,-0.2 -0.853 28.3 155.4 -97.1 107.2 3.3 -28.1 -19.9 76 113 A F E +J 60 0B 0 -16,-2.3 -16,-1.3 -2,-0.8 36,-0.4 -0.245 24.0 146.7-125.0 44.7 2.2 -30.6 -22.5 77 114 A R - 0 0 0 -18,-0.3 -18,-0.1 1,-0.1 33,-0.1 -0.504 57.0 -94.5 -76.0 145.1 4.8 -33.2 -21.6 78 115 A E - 0 0 0 -2,-0.2 2,-0.4 31,-0.1 -1,-0.1 -0.244 32.9-134.8 -63.1 152.1 3.7 -36.8 -21.9 79 116 A M B -M 110 0C 26 31,-1.2 31,-3.0 341,-0.2 341,-0.2 -0.908 23.4-114.2-107.7 134.7 2.3 -38.7 -18.9 80 117 A A - 0 0 1 339,-2.6 338,-1.2 -2,-0.4 29,-0.1 -0.367 46.7 -91.1 -64.1 147.1 3.5 -42.2 -18.2 81 118 A P > - 0 0 2 0, 0.0 3,-2.1 0, 0.0 337,-0.6 -0.202 31.5-113.8 -58.2 153.7 0.7 -44.8 -18.6 82 119 A A T 3 S+ 0 0 44 1,-0.3 143,-0.1 335,-0.2 -2,-0.1 0.791 118.9 53.3 -58.9 -28.2 -1.4 -45.6 -15.5 83 120 A K T 3 S+ 0 0 101 141,-0.2 -1,-0.3 333,-0.1 142,-0.1 0.398 82.2 120.0 -89.0 3.1 0.1 -49.1 -15.7 84 121 A A < - 0 0 2 -3,-2.1 2,-0.3 332,-0.1 3,-0.0 -0.372 46.2-163.0 -66.8 147.0 3.7 -47.9 -15.8 85 122 A T > - 0 0 80 331,-0.2 3,-1.9 1,-0.1 4,-0.2 -0.956 30.6-109.9-134.7 154.0 5.9 -49.1 -12.9 86 123 A R T 3 S+ 0 0 162 -2,-0.3 329,-0.5 1,-0.3 3,-0.3 0.848 117.1 34.7 -46.7 -47.4 9.2 -48.1 -11.4 87 124 A D T > S+ 0 0 72 1,-0.2 3,-1.8 2,-0.1 -1,-0.3 0.138 79.1 119.6-100.1 22.3 11.2 -51.1 -12.6 88 125 A M T < S+ 0 0 25 -3,-1.9 -1,-0.2 1,-0.3 -2,-0.1 0.701 76.4 49.2 -60.6 -20.6 9.4 -51.6 -16.0 89 126 A F T 3 S+ 0 0 2 -3,-0.3 8,-2.7 308,-0.2 2,-0.3 0.370 87.7 104.8-101.9 6.5 12.6 -51.1 -18.0 90 127 A L B < -N 96 0D 27 -3,-1.8 2,-0.1 6,-0.2 -3,-0.0 -0.645 64.6-134.3 -88.1 142.2 14.7 -53.5 -16.0 91 128 A D > - 0 0 61 4,-2.4 3,-2.3 -2,-0.3 -1,-0.1 -0.241 43.7 -81.4 -82.5-179.4 15.6 -57.0 -17.4 92 129 A D T 3 S+ 0 0 165 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 0.722 132.7 53.6 -56.6 -21.6 15.4 -60.1 -15.4 93 130 A Q T 3 S- 0 0 158 2,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.524 120.8-105.9 -91.0 -7.6 18.8 -59.3 -13.8 94 131 A G S < S+ 0 0 17 -3,-2.3 -2,-0.1 1,-0.3 -5,-0.1 0.585 78.7 128.6 94.4 11.2 17.8 -55.8 -12.7 95 132 A N - 0 0 92 1,-0.1 -4,-2.4 303,-0.0 -1,-0.3 -0.854 66.2-103.7-104.3 134.2 19.7 -54.0 -15.4 96 133 A P B -N 90 0D 40 0, 0.0 2,-0.7 0, 0.0 -6,-0.2 -0.215 26.6-147.7 -54.1 139.8 18.0 -51.3 -17.6 97 134 A D >> - 0 0 52 -8,-2.7 4,-1.2 1,-0.1 3,-0.9 -0.927 5.6-163.7-113.3 103.3 17.2 -52.5 -21.1 98 135 A S H 3> S+ 0 0 79 -2,-0.7 4,-1.0 1,-0.3 5,-0.3 0.731 87.0 65.6 -60.1 -23.3 17.5 -49.5 -23.5 99 136 A K H 3>>S+ 0 0 97 1,-0.2 4,-2.6 2,-0.2 5,-1.4 0.919 100.8 50.2 -64.4 -41.6 15.6 -51.4 -26.1 100 137 A K H <45S+ 0 0 47 -3,-0.9 -2,-0.2 1,-0.2 -1,-0.2 0.868 115.8 40.2 -65.0 -38.1 12.5 -51.4 -23.9 101 138 A S H <5S+ 0 0 3 -4,-1.2 292,-0.6 -12,-0.2 -1,-0.2 0.499 128.1 29.8 -91.4 -3.3 12.6 -47.6 -23.2 102 139 A L H <5S+ 0 0 27 -4,-1.0 -3,-0.2 -3,-0.4 -2,-0.2 0.689 131.1 17.2-124.5 -32.8 13.6 -46.6 -26.8 103 140 A T T <5S+ 0 0 60 -4,-2.6 -3,-0.2 -5,-0.3 2,-0.1 0.555 101.4 82.6-122.7 -9.8 12.3 -49.0 -29.4 104 141 A S S > S+ 0 0 18 116,-0.4 3,-0.8 1,-0.3 119,-0.5 0.646 117.9 69.0 -68.6 -12.9 5.9 -50.1 -27.4 106 143 A L G 3 S+ 0 0 34 1,-0.2 -1,-0.3 -6,-0.2 -5,-0.1 0.614 82.2 75.6 -79.1 -11.4 6.7 -49.6 -23.7 107 144 A A G < S+ 0 0 0 -3,-1.7 285,-2.3 -8,-0.1 286,-0.4 0.619 78.1 96.5 -75.4 -12.3 8.8 -46.6 -24.6 108 145 A S < - 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0 0 18 -4,-1.4 -90,-0.1 -5,-0.7 -4,-0.0 -0.288 57.3-152.8 -96.2-175.5 -5.2 -17.5 -29.5 126 163 A T + 0 0 99 -92,-0.1 -1,-0.1 -2,-0.1 -4,-0.1 0.491 67.9 78.1-132.3 -16.4 -7.8 -15.9 -31.7 127 164 A M S S- 0 0 27 1,-0.1 2,-0.1 -6,-0.1 -2,-0.1 -0.678 81.1-107.4-100.9 153.2 -8.4 -18.4 -34.5 128 165 A P >> - 0 0 62 0, 0.0 4,-1.3 0, 0.0 3,-0.9 -0.421 32.6-112.4 -74.1 153.0 -10.4 -21.7 -34.4 129 166 A L H 3> S+ 0 0 18 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.868 115.2 60.7 -53.1 -40.7 -8.5 -25.0 -34.4 130 167 A N H 3> S+ 0 0 78 68,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.873 103.2 51.6 -56.7 -38.7 -9.8 -25.8 -37.9 131 168 A K H <4 S+ 0 0 93 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.883 112.4 42.9 -67.4 -41.3 -8.2 -22.7 -39.4 132 169 A V H < S+ 0 0 1 -4,-1.3 4,-0.3 1,-0.2 -1,-0.2 0.670 115.1 50.3 -81.5 -14.7 -4.7 -23.4 -37.9 133 170 A V H >X S+ 0 0 0 -4,-1.6 4,-2.5 -5,-0.2 3,-0.5 0.758 89.8 82.2 -90.3 -27.9 -4.8 -27.1 -38.8 134 171 A Q H 3X S+ 0 0 65 -4,-1.6 4,-2.4 -5,-0.2 5,-0.2 0.842 86.8 53.3 -46.2 -48.1 -5.8 -26.6 -42.4 135 172 A P H 3> S+ 0 0 36 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.937 112.8 44.4 -56.5 -45.5 -2.3 -25.9 -43.7 136 173 A A H <> S+ 0 0 0 -3,-0.5 4,-2.2 -4,-0.3 -2,-0.2 0.902 110.1 56.5 -64.1 -42.2 -0.9 -29.1 -42.2 137 174 A F H X S+ 0 0 20 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.918 107.9 47.1 -56.2 -47.1 -4.0 -31.0 -43.4 138 175 A K H X>S+ 0 0 88 -4,-2.4 4,-3.1 1,-0.2 5,-0.5 0.890 110.2 53.0 -62.8 -40.5 -3.3 -29.9 -47.0 139 176 A L H X5S+ 0 0 29 -4,-1.9 4,-1.0 -5,-0.2 -1,-0.2 0.865 113.2 43.7 -63.3 -36.6 0.4 -30.9 -46.7 140 177 A A H <5S+ 0 0 0 -4,-2.2 47,-2.4 2,-0.2 51,-0.2 0.902 119.2 42.6 -74.9 -41.9 -0.5 -34.3 -45.5 141 178 A R H <5S+ 0 0 114 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.937 127.6 27.4 -70.4 -49.8 -3.2 -34.8 -48.1 142 179 A D H <5S- 0 0 97 -4,-3.1 -3,-0.2 -5,-0.2 -1,-0.2 0.639 105.2-138.9 -89.5 -17.4 -1.5 -33.4 -51.2 143 180 A G << - 0 0 16 -4,-1.0 2,-0.3 -5,-0.5 43,-0.2 -0.014 7.0-119.9 83.6 170.2 2.1 -34.2 -50.1 144 181 A F E -O 185 0E 25 41,-1.2 41,-2.8 -4,-0.1 2,-0.3 -0.966 31.2 -89.4-147.4 159.2 5.3 -32.2 -50.2 145 182 A I E -O 184 0E 117 -2,-0.3 2,-0.4 39,-0.2 39,-0.2 -0.550 40.8-119.2 -75.9 133.6 8.8 -32.8 -51.8 146 183 A V - 0 0 1 37,-3.2 36,-2.6 34,-0.3 37,-0.1 -0.586 36.0-161.1 -73.0 125.0 11.3 -34.6 -49.7 147 184 A N > - 0 0 38 -2,-0.4 4,-2.4 34,-0.2 5,-0.2 -0.241 34.7 -87.2 -96.9-172.9 14.3 -32.3 -49.1 148 185 A D H > S+ 0 0 28 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.921 123.6 52.3 -62.7 -45.2 17.9 -32.9 -48.0 149 186 A A H > S+ 0 0 18 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.948 115.6 38.8 -57.0 -52.8 17.1 -32.7 -44.3 150 187 A L H > S+ 0 0 2 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.912 116.0 51.4 -66.9 -43.5 14.3 -35.2 -44.4 151 188 A A H X S+ 0 0 10 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.940 112.2 47.8 -58.8 -47.0 16.0 -37.5 -46.9 152 189 A D H X S+ 0 0 58 -4,-2.9 4,-2.5 -5,-0.2 5,-0.3 0.913 113.1 47.0 -60.9 -45.1 19.2 -37.6 -44.7 153 190 A D H X>S+ 0 0 37 -4,-2.3 5,-2.8 -5,-0.2 4,-1.3 0.881 110.1 52.4 -66.6 -37.6 17.3 -38.3 -41.5 154 191 A L H <>S+ 0 0 0 -4,-2.6 5,-1.0 3,-0.2 -1,-0.2 0.923 114.9 42.7 -62.6 -42.7 15.2 -41.0 -43.1 155 192 A K H <5S+ 0 0 117 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.874 125.0 32.9 -71.4 -40.5 18.3 -42.8 -44.3 156 193 A T H <5S+ 0 0 83 -4,-2.5 4,-0.3 -5,-0.2 -3,-0.2 0.975 137.7 11.6 -82.0 -65.0 20.4 -42.3 -41.1 157 194 A Y T ><5S+ 0 0 74 -4,-1.3 3,-1.1 -5,-0.3 4,-0.5 0.871 124.7 57.9 -83.9 -40.5 18.0 -42.4 -38.2 158 195 A G G >>< S+ 0 0 0 -4,-2.0 3,-1.5 1,-0.3 7,-0.5 0.884 98.4 50.6 -53.3 -47.8 10.8 -47.2 -39.5 163 200 A P G 3 S+ 0 0 32 0, 0.0 -1,-0.3 0, 0.0 -4,-0.1 0.619 98.2 70.8 -70.2 -5.9 11.2 -50.3 -41.7 164 201 A N G < S+ 0 0 114 -3,-1.5 2,-0.4 1,-0.1 -2,-0.2 0.455 93.3 60.5 -87.1 -0.9 10.7 -52.5 -38.7 165 202 A H S <> S- 0 0 41 -3,-1.5 4,-3.0 -4,-0.2 5,-0.3 -0.991 76.6-141.0-130.9 123.4 7.0 -51.6 -38.4 166 203 A E H > S+ 0 0 185 -2,-0.4 4,-2.0 1,-0.2 -1,-0.1 0.884 100.8 44.8 -49.1 -51.6 4.5 -52.3 -41.2 167 204 A N H > S+ 0 0 24 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.875 115.9 47.3 -65.8 -35.4 2.5 -49.1 -40.9 168 205 A S H >> S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 3,-0.9 0.927 111.6 50.4 -69.6 -45.1 5.5 -46.9 -40.6 169 206 A K H 3X S+ 0 0 96 -4,-3.0 4,-2.0 -7,-0.5 -2,-0.2 0.871 103.3 60.2 -60.8 -37.7 7.3 -48.6 -43.5 170 207 A A H 3< S+ 0 0 86 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.761 114.9 35.4 -62.5 -24.7 4.2 -48.1 -45.7 171 208 A I H << S+ 0 0 29 -3,-0.9 -2,-0.2 -4,-0.7 15,-0.2 0.877 128.0 28.0 -96.3 -46.4 4.5 -44.4 -45.3 172 209 A F H < S+ 0 0 1 -4,-2.5 7,-1.9 -10,-0.1 2,-0.3 0.572 108.0 71.0 -98.0 -10.7 8.2 -43.5 -45.1 173 210 A W E < -P 178 0F 30 -4,-2.0 2,-0.3 -5,-0.3 -19,-0.0 -0.781 55.0-175.3-107.8 153.0 9.8 -46.3 -47.2 174 211 A K E > -P 177 0F 90 3,-3.5 3,-2.1 -2,-0.3 -4,-0.0 -0.971 68.2 -7.5-149.4 129.6 9.5 -46.7 -51.0 175 212 A E T 3 S- 0 0 169 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.873 129.2 -55.9 53.1 39.0 10.8 -49.5 -53.2 176 213 A G T 3 S+ 0 0 50 1,-0.2 -1,-0.3 -7,-0.1 -3,-0.0 0.525 124.3 88.6 73.7 7.2 12.6 -51.0 -50.2 177 214 A E E < S-P 174 0F 100 -3,-2.1 -3,-3.5 3,-0.0 -1,-0.2 -0.894 87.7 -90.9-132.2 160.4 14.5 -47.8 -49.5 178 215 A P E -P 173 0F 5 0, 0.0 -5,-0.2 0, 0.0 -23,-0.1 -0.392 63.2 -83.6 -66.7 153.0 13.9 -44.7 -47.4 179 216 A L - 0 0 9 -7,-1.9 2,-0.2 1,-0.1 -24,-0.1 -0.304 54.2-136.3 -55.7 140.4 12.2 -41.9 -49.5 180 217 A K > - 0 0 79 1,-0.1 3,-2.3 -3,-0.1 -34,-0.3 -0.579 27.6 -78.6-101.2 163.5 14.8 -40.0 -51.4 181 218 A K T 3 S+ 0 0 99 1,-0.3 -34,-0.2 -2,-0.2 -1,-0.1 -0.361 121.0 29.1 -57.6 131.4 15.4 -36.3 -52.0 182 219 A G T 3 S+ 0 0 49 -36,-2.6 -1,-0.3 1,-0.4 -35,-0.1 0.084 93.3 117.6 103.1 -24.7 13.0 -35.3 -54.7 183 220 A D < - 0 0 37 -3,-2.3 -37,-3.2 -37,-0.1 2,-0.5 -0.265 67.2-117.1 -69.8 164.5 10.3 -37.9 -53.9 184 221 A T E -O 145 0E 81 -39,-0.2 2,-0.7 -3,-0.1 -39,-0.2 -0.921 18.8-151.3-109.1 128.3 6.9 -36.8 -52.8 185 222 A L E +O 144 0E 1 -41,-2.8 -41,-1.2 -2,-0.5 2,-0.4 -0.878 16.4 179.7-103.0 109.8 5.7 -37.7 -49.3 186 223 A V - 0 0 71 -2,-0.7 2,-0.4 -43,-0.2 -45,-0.2 -0.910 9.9-168.3-107.4 135.1 2.0 -38.0 -49.0 187 224 A Q > + 0 0 5 -47,-2.4 4,-2.1 -2,-0.4 5,-0.1 -0.691 14.5 167.2-126.7 78.6 0.5 -39.0 -45.6 188 225 A A H > S+ 0 0 65 -2,-0.4 4,-1.9 2,-0.2 -1,-0.1 0.855 77.4 49.4 -60.2 -41.5 -3.2 -39.9 -46.2 189 226 A N H > S+ 0 0 51 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.926 112.2 48.0 -67.1 -42.9 -3.8 -41.5 -42.8 190 227 A L H > S+ 0 0 4 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.867 108.5 56.4 -63.9 -34.5 -2.2 -38.5 -41.0 191 228 A A H X S+ 0 0 5 -4,-2.1 4,-2.5 -51,-0.2 -1,-0.2 0.900 106.3 49.5 -63.2 -41.1 -4.4 -36.3 -43.2 192 229 A K H X S+ 0 0 113 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.926 110.5 50.1 -63.5 -44.2 -7.5 -38.1 -42.0 193 230 A S H X S+ 0 0 5 -4,-2.1 4,-1.8 191,-0.3 -2,-0.2 0.918 112.2 47.7 -60.4 -42.8 -6.4 -37.7 -38.4 194 231 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.901 110.5 51.6 -65.3 -40.6 -5.8 -34.0 -38.9 195 232 A E H X S+ 0 0 90 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.880 110.3 48.5 -64.1 -39.2 -9.2 -33.5 -40.6 196 233 A M H X S+ 0 0 35 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.852 111.3 49.3 -70.7 -35.4 -11.0 -35.2 -37.7 197 234 A I H X S+ 0 0 0 -4,-1.8 4,-2.4 -5,-0.2 -2,-0.2 0.919 110.6 51.3 -68.4 -42.1 -9.2 -33.1 -35.1 198 235 A A H < S+ 0 0 20 -4,-2.4 -68,-0.3 1,-0.2 -2,-0.2 0.891 119.2 36.4 -61.1 -39.7 -10.1 -30.0 -37.1 199 236 A E H < S+ 0 0 146 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.868 130.9 26.6 -82.9 -39.3 -13.7 -31.0 -37.2 200 237 A N H < S- 0 0 80 -4,-3.1 3,-0.4 1,-0.2 -3,-0.2 0.520 102.2-129.1-104.0 -7.1 -14.2 -32.6 -33.8 201 238 A G >< - 0 0 16 -4,-2.4 3,-2.0 -5,-0.3 4,-0.4 -0.255 52.0 -40.2 87.8-178.6 -11.6 -30.8 -31.7 202 239 A P T >> S+ 0 0 35 0, 0.0 4,-1.7 0, 0.0 3,-1.0 0.711 124.2 75.6 -57.8 -22.7 -8.8 -32.3 -29.5 203 240 A D H 3>>S+ 0 0 97 -3,-0.4 4,-3.0 1,-0.3 5,-1.6 0.776 82.9 69.0 -61.7 -24.3 -11.3 -34.9 -28.1 204 241 A E H <45S+ 0 0 14 -3,-2.0 7,-1.1 3,-0.2 6,-0.9 0.904 105.4 40.2 -59.2 -40.5 -10.8 -36.7 -31.4 205 242 A F H <45S+ 0 0 0 -3,-1.0 -2,-0.2 -4,-0.4 -1,-0.2 0.913 125.2 34.3 -74.5 -45.2 -7.2 -37.4 -30.3 206 243 A Y H <5S+ 0 0 16 -4,-1.7 -2,-0.2 1,-0.1 -3,-0.2 0.637 140.2 8.6 -89.2 -15.5 -7.9 -38.2 -26.7 207 244 A K T <5S+ 0 0 126 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.1 0.487 114.9 68.8-139.7 -13.3 -11.3 -39.9 -26.9 208 245 A G S > S+ 0 0 58 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.849 131.8 53.2 -56.6 -40.3 -10.9 -42.6 -33.4 210 247 A I H > S+ 0 0 1 -6,-0.9 4,-2.3 2,-0.2 -1,-0.2 0.929 107.0 52.0 -63.2 -44.4 -7.3 -41.6 -33.0 211 248 A A H > S+ 0 0 0 -7,-1.1 4,-2.8 1,-0.2 -1,-0.2 0.908 109.6 50.5 -57.3 -42.4 -7.4 -42.6 -29.3 212 249 A E H X S+ 0 0 75 -4,-1.9 4,-2.5 1,-0.2 -1,-0.2 0.908 109.5 50.6 -62.0 -43.2 -8.8 -46.0 -30.4 213 250 A Q H X S+ 0 0 40 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.857 112.6 46.1 -64.7 -36.7 -6.0 -46.4 -32.9 214 251 A I H X S+ 0 0 2 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.942 112.9 49.3 -71.3 -46.6 -3.4 -45.6 -30.3 215 252 A A H X S+ 0 0 14 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.894 113.2 47.0 -59.3 -42.0 -4.9 -47.9 -27.7 216 253 A Q H X S+ 0 0 95 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.907 107.9 55.0 -67.6 -42.5 -5.2 -50.8 -30.2 217 254 A E H X S+ 0 0 22 -4,-1.9 4,-0.6 -5,-0.2 6,-0.2 0.910 115.4 41.3 -55.9 -42.2 -1.6 -50.3 -31.5 218 255 A M H ><>S+ 0 0 1 -4,-2.1 5,-3.2 7,-0.2 3,-0.9 0.937 112.4 52.0 -71.1 -49.9 -0.5 -50.7 -27.8 219 256 A Q H ><5S+ 0 0 146 -4,-2.9 3,-0.6 1,-0.2 -2,-0.2 0.848 111.1 48.3 -57.6 -37.5 -2.9 -53.5 -26.8 220 257 A K H 3<5S+ 0 0 138 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.666 118.7 38.7 -79.2 -16.6 -1.8 -55.7 -29.8 221 258 A N T <<5S- 0 0 86 -3,-0.9 -116,-0.4 -4,-0.6 -1,-0.2 0.098 118.6 -92.4-124.6 25.2 1.9 -55.2 -29.2 222 259 A G T < 5S+ 0 0 51 -3,-0.6 -3,-0.2 -4,-0.3 -4,-0.1 0.686 77.1 143.9 76.1 18.0 2.5 -55.2 -25.4 223 260 A G < - 0 0 13 -5,-3.2 -1,-0.2 -6,-0.2 -117,-0.2 -0.341 44.9-144.4 -83.5 171.1 2.1 -51.5 -25.0 224 261 A L + 0 0 37 -119,-0.5 -141,-0.2 -116,-0.2 2,-0.2 0.672 58.3 112.3-111.4 -22.6 0.5 -49.8 -22.0 225 262 A I - 0 0 2 -120,-0.3 -6,-0.2 -117,-0.1 -7,-0.2 -0.368 46.2-179.2 -60.1 121.7 -1.3 -46.7 -23.3 226 263 A T > - 0 0 37 -2,-0.2 4,-2.1 -8,-0.1 5,-0.2 -0.632 44.4-101.8-115.5 173.9 -5.0 -47.2 -22.9 227 264 A K H > S+ 0 0 95 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.841 123.7 56.5 -65.9 -31.3 -8.1 -45.2 -23.6 228 265 A E H > S+ 0 0 155 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.909 105.9 51.4 -65.1 -40.6 -8.4 -44.3 -19.9 229 266 A D H > S+ 0 0 6 1,-0.2 4,-1.0 2,-0.2 3,-0.3 0.950 112.0 45.6 -58.6 -51.2 -4.8 -42.9 -20.2 230 267 A L H < S+ 0 0 0 -4,-2.1 3,-0.5 1,-0.2 -2,-0.2 0.891 112.8 49.6 -61.7 -40.4 -5.7 -40.8 -23.2 231 268 A A H < S+ 0 0 50 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.769 112.2 49.5 -70.8 -24.1 -9.0 -39.6 -21.6 232 269 A A H < S+ 0 0 61 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.590 85.9 110.5 -91.0 -11.9 -7.1 -38.6 -18.4 233 270 A Y < + 0 0 17 -4,-1.0 2,-0.3 -3,-0.5 -155,-0.1 -0.285 41.9 174.5 -64.8 148.8 -4.3 -36.7 -20.1 234 271 A K - 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0 0 0 174,-0.4 7,-1.6 -2,-0.2 8,-0.5 -0.420 44.3-150.3 -74.5 137.7 10.2 -23.8 -18.4 254 291 A P > - 0 0 7 0, 0.0 3,-2.3 0, 0.0 5,-0.2 -0.395 48.7 -26.9 -93.9 174.2 9.6 -25.0 -14.8 255 292 A P T 3 S+ 0 0 9 0, 0.0 51,-0.1 0, 0.0 3,-0.1 -0.301 120.8 54.3 -53.8 146.6 9.4 -28.6 -13.6 256 293 A P T 3 S+ 0 0 0 0, 0.0 167,-2.2 0, 0.0 2,-0.4 -0.956 118.2 59.4 -63.7 6.7 8.6 -31.1 -15.3 257 294 A S B < -q 423 0G 0 -3,-2.3 4,-0.3 165,-0.2 167,-0.2 -0.824 64.5-161.7-102.6 148.7 11.4 -29.5 -17.2 258 295 A S S > S+ 0 0 0 165,-2.7 4,-2.2 -2,-0.4 5,-0.3 0.475 72.5 91.7-100.1 -7.6 14.8 -28.9 -15.6 259 296 A G H > S+ 0 0 0 166,-0.4 4,-2.4 164,-0.3 5,-0.3 0.928 83.5 43.8 -53.7 -60.0 15.7 -26.3 -18.2 260 297 A G H > S+ 0 0 0 -7,-1.6 4,-2.4 165,-0.3 5,-0.3 0.929 114.4 50.3 -55.3 -48.8 14.6 -23.1 -16.6 261 298 A I H > S+ 0 0 0 -8,-0.5 4,-2.6 -4,-0.3 -1,-0.2 0.924 115.5 40.2 -58.7 -47.6 16.0 -24.0 -13.2 262 299 A H H X S+ 0 0 1 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.823 112.7 53.8 -76.4 -28.0 19.5 -24.9 -14.4 263 300 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.943 115.3 41.9 -67.8 -44.0 19.7 -22.1 -16.9 264 301 A V H X S+ 0 0 4 -4,-2.4 4,-2.7 -5,-0.3 -2,-0.2 0.923 114.2 52.0 -66.8 -43.4 18.9 -19.6 -14.2 265 302 A Q H X S+ 0 0 0 -4,-2.6 4,-2.0 -5,-0.3 -2,-0.2 0.951 112.8 44.3 -57.7 -50.9 21.2 -21.4 -11.7 266 303 A I H X S+ 0 0 2 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.907 112.4 51.4 -63.2 -41.4 24.1 -21.3 -14.0 267 304 A L H X S+ 0 0 3 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.913 107.7 54.4 -61.7 -39.1 23.5 -17.7 -15.0 268 305 A N H < S+ 0 0 4 -4,-2.7 4,-0.4 2,-0.2 -1,-0.2 0.908 110.8 45.7 -59.2 -41.7 23.4 -16.9 -11.3 269 306 A I H >< S+ 0 0 0 -4,-2.0 3,-1.7 1,-0.2 -2,-0.2 0.959 113.0 49.0 -65.4 -51.3 26.8 -18.5 -10.9 270 307 A L H >< S+ 0 0 0 -4,-3.0 3,-2.5 1,-0.3 5,-0.4 0.767 94.2 74.7 -60.5 -28.0 28.3 -16.8 -14.0 271 308 A E T 3< S+ 0 0 52 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.758 86.7 64.8 -58.4 -23.1 27.0 -13.4 -12.8 272 309 A N T < S+ 0 0 68 -3,-1.7 2,-0.3 -4,-0.4 -1,-0.3 0.489 98.1 66.2 -78.6 -3.7 29.9 -13.5 -10.2 273 310 A F S < S- 0 0 34 -3,-2.5 2,-1.9 -4,-0.1 3,-0.2 -0.874 89.0-117.6-119.5 151.5 32.4 -13.4 -13.0 274 311 A D >> + 0 0 71 -2,-0.3 4,-1.4 1,-0.2 3,-0.6 -0.553 42.6 169.2 -85.5 73.4 33.2 -10.6 -15.6 275 312 A M H 3> S+ 0 0 0 -2,-1.9 4,-2.6 -5,-0.4 -1,-0.2 0.874 71.4 57.8 -54.0 -43.6 32.3 -12.8 -18.6 276 313 A K H 34 S+ 0 0 142 1,-0.2 -1,-0.2 -3,-0.2 4,-0.1 0.876 103.9 54.9 -56.2 -38.2 32.4 -9.8 -21.0 277 314 A K H <4 S+ 0 0 147 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.902 109.2 45.2 -62.4 -44.7 36.0 -9.3 -20.0 278 315 A Y H < S- 0 0 56 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.929 102.6-156.7 -66.9 -45.7 37.1 -12.8 -20.8 279 316 A G >< - 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0 0 18 -4,-1.4 -90,-0.1 -5,-0.8 -4,-0.0 -0.199 57.5-152.0 -92.5-172.1 30.2 -22.4 -75.2 668 163 C T + 0 0 100 -92,-0.1 -1,-0.1 2,-0.1 -4,-0.1 0.467 68.1 80.1-134.5 -18.3 27.4 -24.0 -77.2 669 164 C M S S- 0 0 36 1,-0.1 2,-0.1 -6,-0.1 -2,-0.1 -0.661 80.3-109.1 -98.2 151.7 24.6 -21.5 -77.2 670 165 C P >> - 0 0 71 0, 0.0 4,-1.2 0, 0.0 3,-1.0 -0.418 32.5-112.5 -74.0 152.1 24.1 -18.3 -79.3 671 166 C L H 3> S+ 0 0 20 1,-0.2 4,-1.5 2,-0.2 3,-0.4 0.873 113.2 60.9 -53.6 -42.2 24.6 -15.0 -77.6 672 167 C N H 3> S+ 0 0 60 68,-0.4 4,-1.4 1,-0.2 -1,-0.2 0.850 103.8 51.5 -57.6 -32.9 20.9 -14.0 -77.9 673 168 C K H <4 S+ 0 0 118 -3,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.853 111.7 43.7 -73.8 -35.3 19.9 -17.0 -75.8 674 169 C V H < S+ 0 0 0 -4,-1.2 4,-0.3 -3,-0.4 -1,-0.2 0.632 115.8 49.5 -84.8 -12.9 22.2 -16.3 -72.9 675 170 C V H X S+ 0 0 0 -4,-1.5 4,-2.6 -5,-0.2 3,-0.4 0.724 90.5 82.3 -92.8 -25.8 21.4 -12.6 -72.9 676 171 C Q H X S+ 0 0 70 -4,-1.4 4,-2.5 -5,-0.3 5,-0.2 0.864 86.5 53.2 -48.0 -49.8 17.6 -13.1 -72.9 677 172 C P H > S+ 0 0 25 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.934 113.5 44.1 -54.1 -46.7 17.2 -13.7 -69.2 678 173 C A H > S+ 0 0 0 -3,-0.4 4,-2.3 -4,-0.3 5,-0.2 0.905 109.9 56.3 -63.8 -43.1 19.0 -10.5 -68.4 679 174 C F H X S+ 0 0 24 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.922 108.1 47.8 -54.7 -47.5 17.1 -8.6 -71.1 680 175 C K H X>S+ 0 0 84 -4,-2.5 4,-3.0 1,-0.2 5,-0.5 0.895 110.5 51.4 -62.2 -41.4 13.8 -9.6 -69.5 681 176 C L H X5S+ 0 0 30 -4,-1.9 4,-1.0 -5,-0.2 -1,-0.2 0.868 114.5 43.5 -64.6 -36.2 15.0 -8.5 -66.1 682 177 C A H <5S+ 0 0 0 -4,-2.3 47,-2.3 2,-0.2 51,-0.2 0.920 119.5 42.1 -74.7 -44.2 16.0 -5.2 -67.4 683 178 C R H <5S+ 0 0 119 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.949 127.2 29.0 -67.8 -52.2 12.9 -4.7 -69.5 684 179 C D H <5S- 0 0 97 -4,-3.0 -3,-0.2 -5,-0.2 -1,-0.2 0.673 105.7-138.3 -85.0 -19.4 10.3 -5.9 -67.0 685 180 C G << - 0 0 16 -4,-1.0 2,-0.3 -5,-0.5 43,-0.2 -0.030 9.5-122.5 83.7 168.5 12.2 -5.0 -63.9 686 181 C F E -K 727 0P 27 41,-1.4 41,-3.0 -4,-0.1 2,-0.4 -0.947 29.4 -85.8-146.6 164.0 12.7 -6.8 -60.6 687 182 C I E -K 726 0P 119 -2,-0.3 2,-0.4 39,-0.2 39,-0.2 -0.593 40.5-121.4 -79.4 130.0 12.1 -6.3 -56.9 688 183 C V - 0 0 1 37,-3.0 36,-2.3 -2,-0.4 37,-0.1 -0.539 34.8-161.8 -70.2 123.6 14.8 -4.4 -55.0 689 184 C N > - 0 0 35 -2,-0.4 4,-2.4 34,-0.2 5,-0.2 -0.211 35.1 -86.9 -95.5-170.6 16.1 -6.7 -52.2 690 185 C D H > S+ 0 0 47 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.925 123.4 52.6 -64.9 -46.3 18.0 -5.9 -49.0 691 186 C A H > S+ 0 0 21 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.946 116.2 38.1 -55.0 -53.9 21.4 -6.2 -50.6 692 187 C L H > S+ 0 0 3 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.906 115.3 53.0 -66.5 -44.1 20.6 -3.7 -53.4 693 188 C A H X S+ 0 0 13 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.933 112.6 45.3 -57.8 -46.8 18.6 -1.4 -51.2 694 189 C D H X S+ 0 0 85 -4,-2.7 4,-2.8 -5,-0.2 5,-0.3 0.894 113.4 48.5 -65.6 -41.6 21.4 -1.1 -48.7 695 190 C D H X>S+ 0 0 39 -4,-2.1 5,-2.6 -5,-0.3 4,-2.3 0.889 109.7 53.2 -67.0 -37.3 24.1 -0.6 -51.3 696 191 C L H <>S+ 0 0 0 -4,-2.7 5,-0.9 3,-0.2 -2,-0.2 0.925 115.6 40.0 -62.1 -43.7 22.0 2.1 -53.0 697 192 C K H <5S+ 0 0 133 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.908 124.5 36.2 -72.7 -43.4 21.6 4.0 -49.8 698 193 C T H <5S+ 0 0 78 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.930 138.3 9.8 -78.2 -49.8 25.1 3.5 -48.4 699 194 C Y T ><5S+ 0 0 94 -4,-2.3 3,-1.3 -5,-0.3 4,-0.5 0.823 124.0 58.3-100.1 -40.5 27.3 3.6 -51.5 700 195 C G G >>< S+ 0 0 0 -4,-2.0 3,-1.4 1,-0.3 7,-0.4 0.880 98.7 49.9 -55.9 -45.9 24.4 8.1 -58.4 705 200 C P G 3 S+ 0 0 27 0, 0.0 -1,-0.3 0, 0.0 -4,-0.1 0.638 97.9 72.7 -71.3 -7.7 22.3 11.2 -57.7 706 201 C N G < S+ 0 0 115 -3,-1.3 2,-0.4 1,-0.1 -2,-0.2 0.486 93.0 58.7 -82.4 -4.5 25.2 13.3 -59.0 707 202 C H S <> S- 0 0 38 -3,-1.4 4,-3.2 -4,-0.2 5,-0.3 -0.989 77.4-139.9-131.2 123.4 24.6 12.4 -62.6 708 203 C E H > S+ 0 0 144 -2,-0.4 4,-2.0 1,-0.2 -1,-0.1 0.855 102.0 46.2 -48.4 -47.6 21.3 13.1 -64.4 709 204 C N H > S+ 0 0 33 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.898 115.9 45.0 -66.2 -41.0 21.2 9.8 -66.3 710 205 C S H >> S+ 0 0 0 -3,-0.2 4,-2.5 1,-0.2 3,-0.9 0.921 112.3 52.6 -67.7 -43.3 22.2 7.6 -63.3 711 206 C K H 3X S+ 0 0 75 -4,-3.2 4,-1.9 -7,-0.4 -2,-0.2 0.886 102.8 58.5 -59.4 -40.9 19.7 9.5 -61.0 712 207 C A H 3< S+ 0 0 83 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.769 115.3 36.1 -61.5 -25.9 16.9 8.9 -63.5 713 208 C I H << S+ 0 0 28 -3,-0.9 15,-0.2 -4,-0.8 -2,-0.2 0.895 128.3 26.4 -94.0 -48.8 17.4 5.1 -63.1 714 209 C F H < S+ 0 0 1 -4,-2.5 7,-1.9 -10,-0.1 2,-0.3 0.579 109.9 69.4 -96.2 -12.2 18.4 4.5 -59.5 715 210 C W E < -L 720 0Q 30 -4,-1.9 2,-0.4 -5,-0.4 -19,-0.0 -0.821 57.5-163.8-110.0 148.6 16.8 7.4 -57.7 716 211 C K E > S-L 719 0Q 111 3,-4.0 3,-1.6 -2,-0.3 -4,-0.1 -0.955 71.0 -27.7-135.4 115.0 13.1 8.0 -57.1 717 212 C E T 3 S- 0 0 176 -2,-0.4 -1,-0.1 1,-0.3 0, 0.0 0.913 127.8 -40.9 44.8 59.7 11.8 11.5 -56.0 718 213 C G T 3 S+ 0 0 58 1,-0.1 -1,-0.3 -7,-0.1 -3,-0.0 0.369 126.6 83.1 77.7 -4.5 15.0 12.5 -54.3 719 214 C E E < S-L 716 0Q 112 -3,-1.6 -3,-4.0 3,-0.0 -1,-0.1 -0.942 82.3-102.3-132.5 153.5 15.6 9.1 -52.6 720 215 C P E -L 715 0Q 5 0, 0.0 -5,-0.2 0, 0.0 -23,-0.1 -0.351 53.8 -87.4 -68.9 153.1 17.3 5.8 -53.7 721 216 C L - 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