==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PEPTIDE BINDING PROTEIN 17-MAY-07 2Z23 . COMPND 2 MOLECULE: PERIPLASMIC OLIGOPEPTIDE-BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: YERSINIA PESTIS; . AUTHOR M.TANABE,T.BERTLAND,O.MIRZA,B.BYRNE,K.A.BROWN . 519 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20103.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 348 67.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 14.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 5 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 40 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 23.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 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 3 1 2 2 0 2 3 0 1 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 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 0 PARALLEL BRIDGES PER LADDER . 5 2 1 2 1 2 1 0 0 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 . 2 0 1 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 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 1 A A 0 0 13 0, 0.0 2,-0.5 0, 0.0 510,-0.1 0.000 360.0 360.0 360.0 158.6 -0.1 25.0 -4.5 2 2 A N - 0 0 132 509,-0.4 511,-0.1 2,-0.0 213,-0.0 -0.850 360.0-162.5-127.0 91.2 -2.7 25.3 -7.4 3 3 A V - 0 0 45 -2,-0.5 2,-0.2 212,-0.1 3,-0.1 -0.640 26.8-120.6 -75.4 116.1 -1.3 24.1 -10.6 4 4 A P > - 0 0 60 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.414 37.2-102.1 -59.5 123.0 -3.5 25.4 -13.4 5 5 A T T 3 S+ 0 0 150 1,-0.2 3,-0.1 -2,-0.2 -3,-0.0 -0.192 106.6 35.0 -48.5 127.3 -4.9 22.4 -15.3 6 6 A G T 3 S+ 0 0 76 1,-0.4 -1,-0.2 -3,-0.1 2,-0.2 -0.291 87.1 105.2 121.6 -47.9 -3.0 22.1 -18.6 7 7 A V < - 0 0 59 -3,-1.8 -1,-0.4 1,-0.1 2,-0.4 -0.455 65.8-134.3 -69.6 135.8 0.5 23.2 -17.5 8 8 A Q - 0 0 130 -2,-0.2 508,-3.0 508,-0.1 2,-0.3 -0.766 15.6-130.1 -94.8 137.2 3.0 20.4 -17.1 9 9 A L B -A 515 0A 72 -2,-0.4 506,-0.2 506,-0.3 4,-0.1 -0.686 22.2-112.2 -90.7 136.6 5.3 20.3 -14.1 10 10 A A - 0 0 21 504,-2.9 504,-0.2 -2,-0.3 506,-0.1 -0.164 21.3-123.3 -59.9 156.6 9.1 19.8 -14.3 11 11 A E S S+ 0 0 186 1,-0.2 2,-0.7 2,-0.0 -1,-0.1 0.863 100.8 56.0 -71.3 -36.5 10.5 16.5 -13.0 12 12 A K - 0 0 161 2,-0.1 2,-1.2 206,-0.0 -1,-0.2 -0.869 69.0-166.1-103.7 108.9 12.9 18.4 -10.6 13 13 A Q + 0 0 14 -2,-0.7 206,-2.1 204,-0.1 207,-1.1 -0.681 36.7 135.4 -95.0 81.8 11.0 20.7 -8.2 14 14 A V E -b 220 0B 66 -2,-1.2 2,-0.4 205,-0.2 207,-0.2 -0.967 32.0-165.4-129.2 144.4 13.9 22.8 -6.9 15 15 A L E -b 221 0B 0 205,-2.5 207,-3.0 -2,-0.4 2,-0.5 -0.994 11.0-163.8-137.4 139.3 14.1 26.5 -6.3 16 16 A V E +b 222 0B 30 -2,-0.4 226,-1.9 205,-0.2 227,-1.4 -0.979 17.0 177.9-121.0 117.0 16.9 29.0 -5.7 17 17 A R E -bc 223 243B 1 205,-3.4 207,-2.6 -2,-0.5 2,-0.2 -0.958 25.6-133.2-120.3 136.6 15.8 32.4 -4.4 18 18 A N E -b 224 0B 2 225,-2.6 228,-0.1 -2,-0.4 205,-0.0 -0.634 16.7-166.3 -82.7 152.3 18.1 35.3 -3.4 19 19 A N - 0 0 1 205,-2.6 2,-2.6 -2,-0.2 19,-0.1 0.024 35.6-113.9-130.9 29.7 17.1 36.8 -0.1 20 20 A G S S- 0 0 9 206,-0.4 2,-0.3 227,-0.1 377,-0.1 -0.195 80.2 -13.5 71.2 -49.5 18.9 40.1 0.2 21 21 A S S S- 0 0 12 -2,-2.6 205,-0.2 203,-0.2 375,-0.0 -0.988 83.9 -59.4-166.4-179.8 21.1 39.0 3.1 22 22 A E - 0 0 4 203,-0.4 376,-0.2 -2,-0.3 2,-0.1 -0.409 64.5-123.4 -72.0 124.7 22.1 36.8 6.0 23 23 A P - 0 0 3 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.182 7.5-123.3 -62.3 157.7 19.0 36.9 8.3 24 24 A Q S S- 0 0 52 1,-0.2 2,-0.3 -2,-0.1 7,-0.1 0.948 82.4 -39.8 -73.3 -36.5 19.2 38.0 11.9 25 25 A S - 0 0 21 1,-0.0 -1,-0.2 3,-0.0 5,-0.1 -0.963 38.7-121.3 179.5 169.9 17.8 34.6 13.0 26 26 A L S S+ 0 0 6 -2,-0.3 5,-0.1 -3,-0.1 -2,-0.0 0.354 81.2 104.0-108.0 -2.8 15.2 31.9 12.3 27 27 A D S > S- 0 0 8 1,-0.1 3,-1.5 3,-0.1 4,-0.1 -0.738 73.7-138.4 -77.8 125.2 13.6 32.3 15.6 28 28 A P G > S+ 0 0 0 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.770 99.6 55.1 -58.5 -25.9 10.3 34.2 15.0 29 29 A H G 3 S+ 0 0 0 1,-0.2 80,-0.1 78,-0.1 81,-0.1 0.109 103.4 52.4 -99.2 24.9 10.8 36.3 18.1 30 30 A K G < S+ 0 0 80 -3,-1.5 2,-0.3 77,-0.2 -1,-0.2 0.174 96.1 90.6-135.3 11.4 14.2 37.5 17.2 31 31 A I < + 0 0 1 -3,-0.8 78,-0.1 1,-0.1 -5,-0.0 -0.736 27.7 155.8-116.5 163.8 13.3 38.9 13.8 32 32 A E + 0 0 6 -2,-0.3 487,-2.8 487,-0.1 2,-0.2 0.363 51.1 87.2-156.2 -9.4 12.2 42.0 12.2 33 33 A G B > S-g 519 0C 0 485,-0.2 4,-2.9 1,-0.1 487,-0.2 -0.655 74.8-116.9-109.7 167.2 13.2 42.1 8.5 34 34 A V H > S+ 0 0 2 485,-2.4 4,-2.8 2,-0.2 5,-0.2 0.897 115.5 56.0 -58.6 -44.3 11.8 41.0 5.2 35 35 A P H > S+ 0 0 2 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.917 112.8 44.3 -54.7 -41.1 14.7 38.6 4.6 36 36 A E H > S+ 0 0 2 1,-0.2 4,-2.6 2,-0.2 3,-0.4 0.940 112.1 50.1 -63.7 -56.8 13.8 37.0 7.9 37 37 A S H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.827 103.5 62.3 -54.3 -37.7 10.1 37.0 7.3 38 38 A N H X S+ 0 0 2 -4,-2.8 4,-0.6 1,-0.2 -1,-0.2 0.931 112.9 33.9 -58.0 -47.9 10.7 35.3 3.9 39 39 A I H >X S+ 0 0 1 -4,-1.2 4,-1.4 -3,-0.4 3,-0.8 0.857 113.0 61.6 -75.9 -35.4 12.2 32.2 5.4 40 40 A S H 3X S+ 0 0 4 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.857 98.0 58.6 -58.4 -37.5 10.0 32.3 8.5 41 41 A R H 3< S+ 0 0 13 -4,-2.1 149,-0.3 1,-0.2 -1,-0.2 0.785 106.7 45.3 -66.1 -29.4 6.9 31.9 6.4 42 42 A D H << S+ 0 0 2 -3,-0.8 149,-2.7 -4,-0.6 148,-0.3 0.787 119.2 41.6 -83.6 -28.5 8.0 28.6 4.9 43 43 A L H < S+ 0 0 1 -4,-1.4 146,-2.2 146,-0.2 145,-0.6 0.754 119.8 33.4 -89.2 -29.1 9.2 27.1 8.2 44 44 A L < - 0 0 3 -4,-2.3 2,-0.4 144,-0.2 -1,-0.2 -0.980 61.7-158.4-134.6 145.9 6.4 28.3 10.5 45 45 A E - 0 0 6 -2,-0.4 4,-0.1 121,-0.1 -4,-0.1 -0.981 8.9-156.2-128.3 127.5 2.7 28.8 10.2 46 46 A G - 0 0 5 -2,-0.4 14,-3.3 2,-0.3 15,-0.3 -0.019 47.9 -74.3 -84.4-169.1 0.5 31.0 12.4 47 47 A L S S+ 0 0 1 117,-0.4 14,-2.2 112,-0.3 12,-1.9 0.869 117.9 9.3 -56.7 -38.1 -3.3 30.9 13.1 48 48 A V E S-N 58 0D 0 111,-0.4 -2,-0.3 10,-0.2 2,-0.3 -0.933 71.3-158.6-139.4 160.4 -3.9 32.3 9.6 49 49 A I E -N 57 0D 12 8,-2.6 8,-3.1 -2,-0.3 2,-0.4 -0.879 23.5-106.1-137.2 167.6 -1.8 33.1 6.4 50 50 A N E -N 56 0D 6 -2,-0.3 6,-0.2 6,-0.2 452,-0.0 -0.809 32.3-141.5 -95.7 134.9 -1.9 35.2 3.2 51 51 A D > - 0 0 34 4,-2.6 3,-2.6 -2,-0.4 455,-0.2 -0.270 43.5 -77.1 -85.2 179.6 -2.6 33.5 -0.1 52 52 A P T 3 S+ 0 0 51 0, 0.0 449,-0.5 0, 0.0 450,-0.4 0.725 134.6 42.6 -49.0 -24.2 -0.9 34.3 -3.4 53 53 A N T 3 S- 0 0 74 448,-0.1 445,-0.0 2,-0.1 -3,-0.0 0.323 122.1 -99.8-107.5 7.7 -3.1 37.5 -3.7 54 54 A G S < S+ 0 0 23 -3,-2.6 2,-0.2 1,-0.3 367,-0.2 0.506 73.1 142.4 90.8 3.3 -2.9 38.7 -0.2 55 55 A N - 0 0 94 1,-0.1 -4,-2.6 -5,-0.0 2,-0.5 -0.563 56.0-114.5 -79.0 143.5 -6.3 37.3 1.0 56 56 A I E +N 50 0D 36 -6,-0.2 -6,-0.2 -2,-0.2 101,-0.1 -0.671 46.0 168.0 -80.6 125.2 -6.3 36.0 4.6 57 57 A V E -N 49 0D 43 -8,-3.1 -8,-2.6 -2,-0.5 5,-0.0 -0.849 41.1 -63.2-132.5 169.1 -7.0 32.3 4.7 58 58 A P E +N 48 0D 51 0, 0.0 -10,-0.2 0, 0.0 4,-0.2 -0.246 52.7 160.4 -56.7 131.9 -6.8 29.4 7.2 59 59 A G S S- 0 0 0 -12,-1.9 -12,-0.2 2,-0.8 -11,-0.2 0.263 75.3 -18.6-116.7-116.0 -3.4 28.5 8.7 60 60 A A S S+ 0 0 0 -14,-3.3 17,-3.2 16,-0.1 2,-0.4 0.800 133.1 66.0 -66.6 -27.4 -2.9 26.6 11.9 61 61 A A E -O 76 0E 0 -14,-2.2 -2,-0.8 -15,-0.3 15,-0.3 -0.819 67.9-161.6 -97.7 134.1 -6.5 27.5 12.7 62 62 A E E S- 0 0 72 13,-2.4 2,-0.3 -2,-0.4 14,-0.1 0.758 74.9 -4.1 -83.9 -27.2 -9.3 26.0 10.4 63 63 A S E -O 75 0E 44 12,-1.0 12,-3.1 2,-0.0 2,-0.3 -0.975 63.0-177.9-158.6 164.5 -11.9 28.5 11.5 64 64 A W E -O 74 0E 53 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.982 4.3-168.3-162.6 162.9 -12.4 31.4 13.9 65 65 A D E -O 73 0E 115 8,-2.1 8,-2.7 -2,-0.3 2,-0.3 -0.943 9.5-146.3-151.0 167.8 -15.0 34.0 15.1 66 66 A N E -O 72 0E 60 -2,-0.3 2,-0.6 6,-0.2 6,-0.2 -0.976 10.8-140.6-141.6 155.3 -15.2 37.1 17.1 67 67 A K E >> S-O 71 0E 134 4,-2.3 3,-2.2 -2,-0.3 4,-1.7 -0.968 91.2 -26.4-117.8 112.6 -17.5 38.9 19.5 68 68 A D T 34 S- 0 0 98 -2,-0.6 -1,-0.1 1,-0.3 4,-0.1 0.636 106.2 -80.9 58.1 16.6 -17.5 42.6 18.9 69 69 A F T 34 S+ 0 0 85 2,-0.3 83,-2.5 82,-0.2 -1,-0.3 0.653 124.2 91.6 65.4 14.5 -14.0 42.3 17.6 70 70 A K T <4 S+ 0 0 99 -3,-2.2 78,-3.3 1,-0.3 2,-0.5 0.736 83.2 41.2-105.3 -36.5 -12.8 42.2 21.2 71 71 A V E < S-OP 67 147E 49 -4,-1.7 -4,-2.3 76,-0.2 2,-0.4 -0.966 71.8-170.2-119.5 116.7 -12.9 38.5 21.9 72 72 A W E -OP 66 146E 6 74,-3.2 74,-3.6 -2,-0.5 2,-0.5 -0.909 5.2-165.4-112.3 133.4 -11.6 36.2 19.2 73 73 A T E -OP 65 145E 43 -8,-2.7 -8,-2.1 -2,-0.4 2,-0.4 -0.968 4.4-167.1-120.7 124.0 -11.9 32.4 19.2 74 74 A F E -OP 64 144E 0 70,-3.4 70,-2.7 -2,-0.5 2,-0.9 -0.918 14.8-144.6-112.6 131.9 -9.8 30.2 16.9 75 75 A N E -OP 63 143E 53 -12,-3.1 -13,-2.4 -2,-0.4 -12,-1.0 -0.828 25.7-135.8 -97.0 103.1 -10.4 26.5 16.2 76 76 A I E -O 61 0E 2 66,-2.1 -15,-0.3 -2,-0.9 14,-0.1 -0.331 26.9-100.6 -61.5 134.0 -7.0 24.9 15.8 77 77 A R > - 0 0 24 -17,-3.2 3,-1.2 1,-0.2 11,-0.2 -0.301 24.3-139.5 -55.1 129.7 -6.8 22.5 12.9 78 78 A K T 3 S+ 0 0 156 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.681 101.4 43.8 -69.2 -17.2 -7.0 18.9 14.2 79 79 A D T 3 S+ 0 0 73 -19,-0.1 2,-0.3 8,-0.1 -1,-0.2 0.269 78.3 126.1-111.2 11.7 -4.3 17.7 11.9 80 80 A A < + 0 0 5 -3,-1.2 8,-1.8 -20,-0.2 2,-0.3 -0.556 40.4 177.4 -69.3 128.7 -1.8 20.6 12.3 81 81 A K B -R 87 0F 103 128,-0.3 130,-0.2 -2,-0.3 2,-0.1 -0.971 31.0-119.3-138.7 153.1 1.5 19.0 13.3 82 82 A W > - 0 0 0 4,-3.6 3,-2.1 -2,-0.3 106,-0.2 -0.403 43.5-101.0 -80.5 164.8 5.1 20.0 14.1 83 83 A S T 3 S+ 0 0 23 104,-2.7 126,-0.1 1,-0.3 105,-0.1 0.667 123.7 55.9 -63.0 -14.4 7.8 18.6 11.8 84 84 A N T 3 S- 0 0 76 103,-0.2 -1,-0.3 2,-0.1 104,-0.1 0.251 124.3-100.1-100.6 10.7 8.6 16.0 14.6 85 85 A G S < S+ 0 0 38 -3,-2.1 -2,-0.1 1,-0.3 0, 0.0 0.234 77.8 134.7 93.9 -12.8 5.1 14.7 14.6 86 86 A D - 0 0 61 1,-0.1 -4,-3.6 -5,-0.1 -1,-0.3 -0.319 60.2-100.8 -73.2 149.4 3.8 16.6 17.8 87 87 A P B -R 81 0F 81 0, 0.0 2,-0.6 0, 0.0 -6,-0.2 -0.434 21.8-129.2 -73.1 141.6 0.6 18.2 17.7 88 88 A V - 0 0 0 -8,-1.8 2,-0.2 -11,-0.2 -8,-0.2 -0.825 42.2-178.2 -87.9 118.3 0.2 21.9 17.2 89 89 A T > - 0 0 25 -2,-0.6 4,-1.2 1,-0.1 53,-0.2 -0.671 45.4-107.9-119.4 174.2 -2.1 23.0 20.1 90 90 A A H > S+ 0 0 0 51,-1.6 4,-2.2 1,-0.2 3,-0.2 0.866 120.8 57.9 -66.0 -34.9 -3.8 26.1 21.5 91 91 A Q H > S+ 0 0 91 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.855 95.7 63.2 -64.1 -33.9 -1.2 26.0 24.3 92 92 A D H > S+ 0 0 18 1,-0.2 4,-2.4 2,-0.2 75,-0.4 0.942 108.4 42.1 -54.7 -46.8 1.6 26.2 21.7 93 93 A F H X S+ 0 0 0 -4,-1.2 4,-2.8 2,-0.2 5,-0.3 0.907 112.0 53.1 -67.6 -41.6 0.2 29.6 20.8 94 94 A V H X S+ 0 0 21 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.945 113.3 45.5 -57.4 -46.7 -0.4 30.7 24.4 95 95 A Y H X S+ 0 0 42 -4,-3.4 4,-1.6 1,-0.2 -2,-0.2 0.900 113.9 48.8 -62.4 -43.6 3.2 29.8 25.1 96 96 A S H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.3 -2,-0.2 0.915 111.3 46.2 -66.3 -46.3 4.5 31.6 22.0 97 97 A W H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.847 111.4 53.5 -67.8 -31.4 2.7 34.9 22.4 98 98 A Q H X S+ 0 0 44 -4,-1.7 4,-2.1 -5,-0.3 -1,-0.2 0.879 110.0 48.5 -68.6 -36.1 3.7 34.9 26.1 99 99 A R H < S+ 0 0 37 -4,-1.6 6,-0.3 2,-0.2 -2,-0.2 0.926 108.9 52.8 -68.0 -45.0 7.4 34.5 25.0 100 100 A L H < S+ 0 0 0 -4,-2.5 7,-0.4 1,-0.2 -2,-0.2 0.936 113.6 43.5 -54.5 -49.4 7.0 37.2 22.4 101 101 A A H < S+ 0 0 1 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.856 89.0 103.8 -65.5 -39.3 5.7 39.6 25.1 102 102 A D >X - 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0 0 21 1,-0.2 4,-2.1 -2,-0.2 3,-0.3 -0.825 20.2-179.1-104.3 96.1 14.4 66.3 -4.2 299 299 A R H >>S+ 0 0 9 -2,-0.9 4,-2.5 1,-0.2 5,-0.6 0.839 79.9 59.1 -61.7 -36.3 12.1 63.4 -4.7 300 300 A D H >>S+ 0 0 82 3,-0.2 4,-1.1 2,-0.2 5,-0.5 0.893 111.7 41.2 -62.2 -39.6 11.6 64.0 -8.4 301 301 A I H >>S+ 0 0 61 -3,-0.3 5,-2.2 3,-0.2 4,-1.7 0.988 120.7 38.4 -71.1 -61.7 15.3 63.7 -9.0 302 302 A I H <>S+ 0 0 1 -4,-2.1 5,-1.9 3,-0.2 6,-0.2 0.833 126.8 36.3 -61.1 -34.7 16.2 60.7 -6.8 303 303 A V H <>S+ 0 0 0 -4,-2.5 5,-2.7 -5,-0.3 6,-0.4 0.952 129.8 24.3 -85.4 -55.1 12.9 58.8 -7.6 304 304 A N H < - 0 0 0 0, 0.0 3,-1.9 0, 0.0 6,-0.1 -0.445 18.3-135.1 -63.6 130.4 1.4 54.6 1.4 320 320 A P T 3 S+ 0 0 40 0, 0.0 7,-0.2 0, 0.0 5,-0.1 0.702 102.7 61.6 -61.8 -17.4 -1.8 56.2 0.2 321 321 A Y T 3 S+ 0 0 79 2,-0.1 2,-0.2 5,-0.1 -51,-0.1 0.275 75.5 119.9 -92.9 13.8 -2.8 53.0 -1.6 322 322 A T S X S- 0 0 4 -3,-1.9 3,-2.3 1,-0.1 2,-0.1 -0.557 81.8 -95.1 -74.2 138.8 -3.0 51.1 1.7 323 323 A S T 3 S+ 0 0 61 1,-0.3 -1,-0.1 -2,-0.2 3,-0.1 -0.375 111.6 15.2 -59.0 125.5 -6.5 49.7 2.2 324 324 A G T 3 S+ 0 0 38 1,-0.3 2,-0.4 98,-0.1 -1,-0.3 0.450 94.0 127.1 91.1 -0.5 -8.4 52.2 4.4 325 325 A A < + 0 0 5 -3,-2.3 2,-0.4 -5,-0.1 -1,-0.3 -0.783 31.8 179.3 -94.2 133.4 -6.0 55.1 3.9 326 326 A E + 0 0 130 -2,-0.4 2,-0.3 137,-0.4 141,-0.1 -0.791 25.6 153.1-132.1 85.6 -7.5 58.4 2.8 327 327 A L - 0 0 24 -2,-0.4 -2,-0.0 -7,-0.2 137,-0.0 -0.799 29.0-166.0-119.0 159.4 -4.5 60.7 2.6 328 328 A T - 0 0 98 -2,-0.3 -2,-0.0 139,-0.1 0, 0.0 -0.989 37.6 -97.4-140.4 139.0 -3.6 63.9 0.6 329 329 A P - 0 0 54 0, 0.0 -13,-0.1 0, 0.0 5,-0.1 -0.151 43.4-103.7 -57.5 147.7 -0.1 65.4 0.4 330 330 A P >> - 0 0 19 0, 0.0 3,-1.7 0, 0.0 4,-0.5 -0.237 36.6 -97.0 -70.2 163.8 0.8 68.3 2.7 331 331 A E H >> S+ 0 0 142 1,-0.3 3,-2.4 2,-0.2 4,-0.6 0.896 120.8 56.4 -44.8 -56.1 1.1 71.9 1.5 332 332 A W H 34 S+ 0 0 14 1,-0.3 3,-0.3 2,-0.2 -1,-0.3 0.683 92.8 69.9 -54.6 -21.9 4.8 71.9 0.9 333 333 A F H <4 S+ 0 0 60 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.779 97.1 54.0 -68.5 -23.6 4.5 68.9 -1.4 334 334 A S H << S+ 0 0 95 -3,-2.4 -1,-0.2 -4,-0.5 -2,-0.2 0.750 91.7 88.9 -81.5 -27.3 2.8 71.3 -3.9 335 335 A W S < S- 0 0 84 -4,-0.6 2,-0.2 -3,-0.3 -3,-0.0 0.048 87.4 -93.9 -62.1 178.4 5.6 73.9 -4.0 336 336 A T > - 0 0 84 1,-0.1 4,-2.5 0, 0.0 5,-0.2 -0.618 31.5-115.9 -91.7 155.4 8.6 73.9 -6.4 337 337 A Q H > S+ 0 0 14 1,-0.2 4,-2.5 -2,-0.2 5,-0.2 0.834 118.3 58.5 -61.7 -30.1 11.8 72.4 -5.2 338 338 A E H > S+ 0 0 131 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.939 107.4 45.9 -62.3 -47.4 13.3 75.8 -5.5 339 339 A K H >> S+ 0 0 86 1,-0.2 4,-2.2 2,-0.2 3,-0.5 0.944 112.7 49.7 -59.8 -51.0 10.8 77.2 -3.0 340 340 A R H 3X S+ 0 0 28 -4,-2.5 4,-2.8 1,-0.3 -1,-0.2 0.873 109.5 51.9 -56.4 -40.4 11.3 74.2 -0.7 341 341 A N H 3X S+ 0 0 24 -4,-2.5 4,-1.8 2,-0.2 -1,-0.3 0.791 106.5 55.6 -66.8 -28.9 15.0 74.8 -0.8 342 342 A E H S+ 0 0 9 -4,-2.0 5,-2.6 -5,-0.2 -1,-0.2 0.807 112.8 50.2 -68.1 -29.5 18.9 75.9 8.9 349 349 A A H ><5S+ 0 0 51 -4,-1.8 3,-3.3 3,-0.2 -2,-0.2 0.963 108.4 46.4 -73.5 -57.0 20.0 79.5 9.2 350 350 A E T 3<5S+ 0 0 106 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.596 107.4 63.8 -64.4 -4.7 17.7 80.5 12.0 351 351 A A T 3 5S- 0 0 20 -4,-0.4 -1,-0.3 -5,-0.3 -2,-0.2 0.350 128.1 -97.9 -97.1 3.4 18.9 77.3 13.6 352 352 A G T < 5S+ 0 0 57 -3,-3.3 2,-0.4 1,-0.3 -3,-0.2 0.609 80.8 131.4 93.0 13.7 22.5 78.6 13.7 353 353 A Y < + 0 0 55 -5,-2.6 -1,-0.3 -6,-0.1 2,-0.2 -0.834 24.9 156.9-104.8 137.2 23.9 77.0 10.6 354 354 A T - 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