==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 05-FEB-13 4J3B . COMPND 2 MOLECULE: M1 FAMILY AMINOPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR S.DALAL,D.R.T.RAGHEB,F.D.SCHUBOT,M.KLEMBA . 889 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35099.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 640 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 125 14.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 0.8 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 . 57 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 300 33.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 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 2 1 1 1 2 0 3 2 2 0 1 3 0 0 1 2 1 0 0 0 0 0 0 0 1 1 1 RESIDUES PER ALPHA HELIX . 3 0 2 0 2 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 . 2 4 1 3 2 2 1 0 4 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 1 3 2 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 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 1 197 A K 0 0 219 0, 0.0 2,-0.2 0, 0.0 371,-0.0 0.000 360.0 360.0 360.0 122.8 -0.0 -7.7 29.8 2 198 A I - 0 0 76 369,-0.0 2,-0.5 372,-0.0 371,-0.2 -0.545 360.0-144.5 -81.4 138.9 0.4 -5.4 26.8 3 199 A H E -A 372 0A 89 369,-3.2 369,-1.9 -2,-0.2 2,-0.4 -0.900 13.7-157.8 -99.8 134.3 1.7 -6.6 23.4 4 200 A Y E > -A 371 0A 105 -2,-0.5 3,-1.5 367,-0.2 367,-0.2 -0.936 17.0-139.4-115.4 136.1 4.0 -4.2 21.5 5 201 A R G > S+ 0 0 57 365,-2.8 3,-1.4 -2,-0.4 -1,-0.1 0.884 102.8 54.2 -57.8 -42.5 4.5 -4.5 17.7 6 202 A K G 3 S+ 0 0 161 364,-0.4 -1,-0.3 1,-0.3 365,-0.1 0.645 97.9 66.8 -69.6 -14.5 8.2 -3.7 17.9 7 203 A D G < + 0 0 97 -3,-1.5 -1,-0.3 2,-0.0 -2,-0.2 0.379 68.1 139.1 -89.8 4.0 8.8 -6.5 20.4 8 204 A Y < + 0 0 59 -3,-1.4 307,-0.0 -4,-0.1 -3,-0.0 -0.207 23.2 168.7 -54.3 134.4 7.9 -9.3 17.9 9 205 A K - 0 0 119 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 -0.980 36.1-108.0-147.7 137.7 10.3 -12.3 18.3 10 206 A P - 0 0 43 0, 0.0 2,-0.1 0, 0.0 129,-0.0 -0.210 45.3 -97.6 -57.5 153.1 10.1 -15.8 16.8 11 207 A S - 0 0 17 2,-0.2 31,-0.4 1,-0.1 32,-0.2 -0.392 14.6-133.4 -69.2 149.5 9.3 -18.7 19.2 12 208 A G S S+ 0 0 4 30,-0.2 28,-2.0 29,-0.1 2,-0.3 0.363 90.9 60.0 -77.0 3.0 12.0 -20.8 20.7 13 209 A F E -B 39 0B 11 26,-0.3 2,-0.4 29,-0.1 26,-0.2 -0.884 67.0-152.0-130.8 161.6 9.8 -23.8 19.7 14 210 A I E -B 38 0B 60 24,-2.3 24,-2.1 -2,-0.3 2,-0.5 -0.985 2.5-158.7-130.2 140.6 8.3 -25.3 16.5 15 211 A I E +B 37 0B 1 -2,-0.4 22,-0.2 125,-0.3 3,-0.1 -0.984 15.9 171.0-118.6 118.8 5.2 -27.3 16.2 16 212 A N E + 0 0 53 20,-2.9 126,-2.2 -2,-0.5 2,-0.3 0.842 63.0 18.9 -96.0 -39.8 5.2 -29.4 13.0 17 213 A N E -Bc 36 142B 66 19,-1.1 19,-2.2 124,-0.2 2,-0.4 -0.983 55.6-161.5-137.5 145.8 2.1 -31.6 13.4 18 214 A V E -Bc 35 143B 0 124,-2.6 126,-2.7 -2,-0.3 2,-0.5 -0.998 6.1-172.1-127.1 125.3 -1.1 -31.6 15.5 19 215 A T E -Bc 34 144B 33 15,-2.4 15,-2.3 -2,-0.4 2,-0.4 -0.965 14.5-172.8-122.1 113.4 -3.1 -34.7 16.0 20 216 A L E -Bc 33 145B 0 124,-2.7 126,-2.9 -2,-0.5 2,-0.5 -0.849 20.8-169.3-113.7 137.9 -6.4 -34.1 17.7 21 217 A N E -Bc 32 146B 45 11,-3.0 11,-2.9 -2,-0.4 2,-0.7 -0.981 11.8-172.4-119.3 117.9 -9.1 -36.4 19.1 22 218 A I E -Bc 31 147B 0 124,-2.9 126,-2.6 -2,-0.5 2,-0.8 -0.914 0.9-171.1-115.5 105.3 -12.2 -34.5 20.0 23 219 A N E -Bc 30 148B 17 7,-3.4 7,-2.6 -2,-0.7 2,-0.5 -0.848 8.4-158.3-106.2 106.1 -14.7 -36.7 21.8 24 220 A I E +B 29 0B 4 124,-2.6 126,-0.3 -2,-0.8 2,-0.3 -0.687 17.9 165.5 -91.1 125.8 -18.1 -34.9 22.2 25 221 A H - 0 0 78 3,-1.9 3,-0.5 -2,-0.5 123,-0.0 -0.837 49.1 -98.9-124.4 171.1 -20.5 -36.0 24.9 26 222 A D S S+ 0 0 100 -2,-0.3 77,-0.1 1,-0.2 3,-0.1 0.896 118.8 22.7 -50.8 -47.4 -23.7 -34.4 26.4 27 223 A N S S+ 0 0 124 1,-0.2 2,-0.3 75,-0.1 -1,-0.2 0.240 130.2 16.1-118.7 11.0 -22.0 -33.0 29.5 28 224 A E - 0 0 71 -3,-0.5 -3,-1.9 2,-0.0 2,-0.4 -0.910 56.1-142.9-170.9 152.5 -18.3 -32.9 28.6 29 225 A T E -BD 24 100B 0 71,-2.9 71,-2.6 -2,-0.3 2,-0.5 -0.997 18.5-151.2-120.3 129.1 -16.0 -32.9 25.6 30 226 A I E -BD 23 99B 27 -7,-2.6 -7,-3.4 -2,-0.4 2,-0.6 -0.855 8.7-164.4-101.4 129.7 -12.7 -34.6 25.9 31 227 A V E -BD 22 98B 0 67,-2.7 67,-2.2 -2,-0.5 2,-0.4 -0.949 4.9-172.6-118.6 114.2 -9.8 -33.4 23.8 32 228 A R E -BD 21 97B 101 -11,-2.9 -11,-3.0 -2,-0.6 2,-0.4 -0.877 13.3-177.7-101.0 139.6 -6.7 -35.5 23.3 33 229 A S E -BD 20 96B 3 63,-2.4 63,-2.1 -2,-0.4 2,-0.5 -0.997 19.7-169.5-143.6 130.7 -3.8 -33.8 21.5 34 230 A V E -BD 19 95B 54 -15,-2.3 -15,-2.4 -2,-0.4 2,-0.5 -0.992 10.2-167.0-116.9 124.1 -0.3 -34.8 20.3 35 231 A L E -BD 18 94B 0 59,-3.7 59,-2.7 -2,-0.5 2,-0.8 -0.951 13.8-147.2-104.9 125.3 2.0 -32.1 19.1 36 232 A D E +BD 17 93B 67 -19,-2.2 -20,-2.9 -2,-0.5 -19,-1.1 -0.854 37.6 179.2 -89.5 114.4 5.1 -33.2 17.3 37 233 A M E -BD 15 92B 2 55,-3.3 55,-2.2 -2,-0.8 2,-0.3 -0.679 22.6-172.5-124.1 164.3 7.5 -30.5 18.4 38 234 A D E -B 14 0B 40 -24,-2.1 -24,-2.3 53,-0.2 2,-0.5 -0.948 33.0-100.3-148.7 168.2 11.1 -29.2 18.0 39 235 A I E -B 13 0B 35 -2,-0.3 -26,-0.3 -26,-0.2 52,-0.1 -0.819 40.2-139.0 -91.9 129.5 13.5 -26.7 19.4 40 236 A S > - 0 0 15 -28,-2.0 3,-1.6 -2,-0.5 -26,-0.1 -0.396 23.0-109.6 -84.7 166.1 13.9 -23.6 17.1 41 237 A K T 3 S+ 0 0 189 1,-0.3 -29,-0.1 -2,-0.1 -1,-0.1 0.632 118.9 61.0 -68.7 -11.5 17.2 -21.8 16.3 42 238 A H T 3 S+ 0 0 61 -31,-0.4 -1,-0.3 -29,-0.0 -30,-0.2 0.436 77.9 122.5 -92.7 0.2 15.9 -18.9 18.4 43 239 A N < - 0 0 46 -3,-1.6 -4,-0.0 -31,-0.2 -32,-0.0 -0.395 36.2-179.6 -68.0 135.1 15.6 -21.1 21.6 44 240 A V - 0 0 120 -2,-0.1 -1,-0.1 0, 0.0 -3,-0.0 -0.067 63.2 -83.7-126.3 30.2 17.6 -19.9 24.6 45 241 A G S S+ 0 0 47 1,-0.2 39,-0.1 -33,-0.1 3,-0.1 0.695 78.3 156.7 77.4 20.7 16.8 -22.6 27.1 46 242 A E - 0 0 67 1,-0.1 -1,-0.2 38,-0.1 -3,-0.0 -0.234 50.1 -87.0 -72.5 161.6 13.5 -21.1 28.2 47 243 A D - 0 0 61 1,-0.1 2,-0.7 36,-0.1 36,-0.2 -0.355 43.7-112.4 -54.8 147.2 10.6 -22.9 29.9 48 244 A L E -I 82 0C 0 34,-2.2 34,-3.2 -3,-0.1 2,-0.5 -0.821 41.4-171.8 -83.0 112.9 8.1 -24.4 27.4 49 245 A V E -I 81 0C 61 -2,-0.7 2,-0.4 32,-0.2 32,-0.2 -0.944 6.4-169.8-115.0 120.2 4.9 -22.3 27.9 50 246 A F E -I 80 0C 0 30,-3.0 30,-2.9 -2,-0.5 2,-0.3 -0.863 23.2-125.1-101.3 142.3 1.6 -23.2 26.3 51 247 A D E +IJ 79 133C 23 82,-2.8 82,-2.1 -2,-0.4 28,-0.2 -0.663 41.3 157.8 -70.3 137.8 -1.5 -21.1 26.1 52 248 A G - 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0 0 13 -2,-0.4 3,-0.1 1,-0.1 -58,-0.1 -0.338 45.4 -83.5 -69.1 157.5 -29.3 14.0 4.6 632 828 A P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 -283,-0.0 -0.210 58.6 -83.8 -59.5 156.1 -25.8 12.9 5.5 633 829 A Q >> - 0 0 84 1,-0.1 4,-2.5 -3,-0.1 3,-1.1 -0.298 31.6-122.5 -59.7 142.4 -25.4 10.4 8.4 634 830 A D H 3> S+ 0 0 44 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.865 114.0 55.0 -49.8 -40.7 -25.4 11.8 11.9 635 831 A R H 34 S+ 0 0 53 2,-0.2 4,-0.3 1,-0.2 -1,-0.2 0.688 108.2 48.5 -76.5 -16.7 -22.0 10.1 12.5 636 832 A Y H X4 S+ 0 0 16 -3,-1.1 3,-1.1 2,-0.1 4,-0.2 0.900 111.7 49.8 -77.1 -49.4 -20.6 11.9 9.4 637 833 A I H >< S+ 0 0 0 -4,-2.5 3,-2.5 1,-0.2 -2,-0.2 0.872 100.1 63.9 -53.3 -42.7 -22.0 15.3 10.6 638 834 A I G >< S+ 0 0 4 -4,-2.2 3,-1.2 1,-0.3 -1,-0.2 0.729 88.7 69.2 -64.4 -21.8 -20.6 15.0 14.1 639 835 A N G < S+ 0 0 30 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.663 102.4 46.7 -64.7 -15.0 -17.0 15.1 12.7 640 836 A F G < S+ 0 0 79 -3,-2.5 2,-0.4 -4,-0.2 -1,-0.2 0.321 104.4 70.6-109.8 5.5 -17.7 18.7 11.7 641 837 A V < - 0 0 17 -3,-1.2 3,-0.4 -4,-0.2 2,-0.3 -0.987 62.9-149.5-134.3 128.2 -19.2 19.9 15.0 642 838 A S S S+ 0 0 103 -2,-0.4 3,-0.2 1,-0.2 210,-0.1 -0.719 82.6 5.6 -89.1 144.3 -17.7 20.5 18.5 643 839 A N S S- 0 0 98 -2,-0.3 210,-0.3 208,-0.3 211,-0.3 0.926 90.8-148.3 54.3 55.1 -19.8 20.1 21.6 644 840 A L B -b 853 0I 4 208,-3.0 210,-2.5 -3,-0.4 2,-0.8 -0.343 14.0-153.2 -70.9 125.4 -22.7 18.7 19.7 645 841 A D > - 0 0 16 208,-0.2 4,-1.8 -3,-0.2 3,-0.4 -0.868 9.7-161.9 -92.5 106.4 -26.2 19.4 21.0 646 842 A T H > S+ 0 0 1 -2,-0.8 4,-2.3 1,-0.2 -1,-0.2 0.789 85.4 55.2 -65.8 -31.1 -28.1 16.4 19.6 647 843 A D H > S+ 0 0 39 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.881 108.6 49.3 -69.5 -36.6 -31.6 18.0 20.0 648 844 A V H > S+ 0 0 4 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.870 110.5 50.1 -68.9 -37.7 -30.5 21.0 18.0 649 845 A L H X S+ 0 0 2 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.902 108.9 52.7 -65.6 -40.5 -29.1 18.7 15.3 650 846 A A H X S+ 0 0 11 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.929 110.7 46.7 -59.9 -45.5 -32.4 16.8 15.2 651 847 A D H X S+ 0 0 56 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.881 110.8 54.2 -60.7 -38.7 -34.3 20.1 14.8 652 848 A T H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.944 109.9 44.5 -60.9 -49.5 -31.8 21.1 12.1 653 849 A K H X S+ 0 0 31 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.896 113.4 52.3 -64.4 -39.6 -32.4 17.9 10.0 654 850 A E H X S+ 0 0 123 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.917 109.3 48.5 -61.3 -47.9 -36.1 18.2 10.5 655 851 A Y H X S+ 0 0 36 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.943 112.9 48.2 -57.3 -50.0 -36.2 21.8 9.2 656 852 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.933 112.3 47.4 -59.9 -48.7 -34.1 20.9 6.2 657 853 A Y H X S+ 0 0 59 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.862 112.7 51.1 -58.4 -39.1 -36.2 17.9 5.3 658 854 A K H X S+ 0 0 113 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.933 108.8 50.3 -65.7 -45.3 -39.4 20.0 5.7 659 855 A Q H X S+ 0 0 46 -4,-2.7 4,-0.7 1,-0.2 -2,-0.2 0.915 114.6 44.0 -60.2 -43.3 -38.0 22.8 3.5 660 856 A I H >X S+ 0 0 4 -4,-2.3 4,-2.3 -5,-0.2 3,-1.0 0.932 113.6 50.2 -68.4 -44.0 -37.2 20.3 0.7 661 857 A G H 3X S+ 0 0 6 -4,-2.6 4,-2.6 1,-0.3 5,-0.3 0.856 98.1 66.4 -62.3 -37.7 -40.5 18.4 1.1 662 858 A D H 3< S+ 0 0 99 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.814 116.8 29.6 -54.0 -30.7 -42.5 21.6 0.9 663 859 A K H << S+ 0 0 121 -3,-1.0 -2,-0.2 -4,-0.7 -1,-0.2 0.805 131.3 32.2 -92.7 -36.0 -41.2 21.8 -2.7 664 860 A L H X S+ 0 0 3 -4,-2.3 4,-2.8 1,-0.1 3,-0.3 0.469 81.5 99.3-109.5 -4.6 -40.7 18.1 -3.6 665 861 A N H X S+ 0 0 24 -4,-2.6 4,-2.7 1,-0.3 5,-0.2 0.869 86.3 50.5 -61.8 -37.7 -43.3 16.0 -1.9 666 862 A D H > S+ 0 0 112 -5,-0.3 4,-2.6 2,-0.2 -1,-0.3 0.891 112.3 48.2 -64.5 -39.0 -45.7 15.8 -4.9 667 863 A V H > S+ 0 0 17 -3,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.905 110.7 51.8 -64.6 -41.9 -42.7 14.7 -7.0 668 864 A Y H X S+ 0 0 5 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.923 111.8 46.2 -57.3 -46.8 -41.8 12.2 -4.3 669 865 A Y H X S+ 0 0 63 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.923 110.6 52.7 -65.0 -45.3 -45.4 10.8 -4.3 670 866 A K H X S+ 0 0 136 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.925 112.3 45.2 -53.1 -50.5 -45.5 10.7 -8.1 671 867 A M H X S+ 0 0 16 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.898 107.9 56.9 -61.1 -44.2 -42.2 8.6 -8.2 672 868 A F H < S+ 0 0 3 -4,-2.4 4,-0.4 1,-0.2 -1,-0.2 0.908 113.7 41.0 -55.2 -41.9 -43.3 6.3 -5.4 673 869 A K H >< S+ 0 0 97 -4,-2.0 3,-0.8 1,-0.2 4,-0.4 0.905 116.4 47.0 -74.4 -43.1 -46.4 5.4 -7.5 674 870 A S H 3< S+ 0 0 89 -4,-2.5 4,-0.4 1,-0.2 3,-0.3 0.755 108.8 54.9 -74.0 -24.1 -44.7 5.2 -10.9 675 871 A L T 3X S+ 0 0 24 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.622 85.7 89.3 -78.2 -14.2 -41.7 3.1 -9.7 676 872 A E H <> S+ 0 0 82 -3,-0.8 4,-2.9 -4,-0.4 5,-0.2 0.871 81.2 50.5 -59.4 -47.1 -44.0 0.4 -8.2 677 873 A A H > S+ 0 0 69 -4,-0.4 4,-0.6 -3,-0.3 -1,-0.2 0.917 118.9 36.3 -64.0 -46.8 -44.4 -1.9 -11.3 678 874 A K H 4 S+ 0 0 147 -4,-0.4 3,-0.4 2,-0.2 -1,-0.2 0.882 118.5 52.1 -70.0 -39.1 -40.7 -2.2 -12.0 679 875 A A H < S+ 0 0 0 -4,-2.7 20,-0.2 1,-0.2 -2,-0.2 0.899 118.8 32.7 -67.2 -41.6 -39.8 -2.2 -8.3 680 876 A D H < S+ 0 0 21 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.312 81.8 139.0-104.9 6.0 -42.1 -4.9 -7.2 681 877 A D < - 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0 0 29 -2,-0.5 2,-0.9 -3,-0.1 3,-0.1 -0.999 19.8-150.1-129.7 131.0 -30.8 -11.3 -8.1 692 888 A D > - 0 0 70 -2,-0.4 4,-2.0 1,-0.2 5,-0.1 -0.844 12.8-176.5-101.3 99.4 -31.6 -8.0 -9.8 693 889 A F H > S+ 0 0 21 -2,-0.9 4,-2.3 1,-0.2 -1,-0.2 0.853 82.5 56.7 -69.3 -33.7 -29.6 -5.4 -7.9 694 890 A D H > S+ 0 0 71 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.908 107.7 48.3 -58.4 -44.7 -31.1 -2.6 -9.9 695 891 A Q H > S+ 0 0 18 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.891 108.9 53.3 -66.1 -38.6 -34.6 -3.6 -9.0 696 892 A M H X S+ 0 0 16 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.907 106.6 53.4 -59.6 -42.3 -33.6 -3.9 -5.3 697 893 A N H X S+ 0 0 17 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.858 105.0 54.8 -58.2 -37.9 -32.3 -0.3 -5.6 698 894 A M H X S+ 0 0 31 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.918 108.2 48.3 -63.4 -43.3 -35.7 0.7 -7.0 699 895 A R H X S+ 0 0 11 -4,-2.0 4,-2.6 -20,-0.2 5,-0.2 0.920 109.7 52.8 -60.6 -43.7 -37.3 -0.8 -3.9 700 896 A T H X S+ 0 0 58 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.945 110.1 48.5 -56.0 -48.3 -34.8 1.1 -1.7 701 897 A L H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.941 111.6 48.4 -56.8 -50.0 -35.8 4.3 -3.5 702 898 A R H X S+ 0 0 7 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.887 112.9 48.3 -59.5 -39.9 -39.5 3.7 -3.1 703 899 A N H X S+ 0 0 15 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.876 110.5 51.3 -71.3 -34.3 -39.0 2.9 0.6 704 900 A T H X S+ 0 0 29 -4,-2.5 4,-2.1 -5,-0.2 -2,-0.2 0.940 112.6 46.0 -63.4 -48.5 -36.9 6.0 1.1 705 901 A L H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.900 110.1 53.5 -61.5 -41.8 -39.6 8.1 -0.6 706 902 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.907 108.3 51.5 -61.3 -38.5 -42.3 6.4 1.5 707 903 A S H X S+ 0 0 34 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.924 110.7 46.8 -63.4 -45.1 -40.4 7.3 4.6 708 904 A L H X S+ 0 0 16 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.933 113.5 49.1 -61.9 -45.4 -40.1 11.0 3.6 709 905 A L H <>S+ 0 0 0 -4,-2.8 5,-2.3 2,-0.2 4,-0.2 0.822 110.9 50.1 -65.4 -33.7 -43.8 11.1 2.8 710 906 A S H ><5S+ 0 0 0 -4,-2.1 3,-1.7 -5,-0.2 -1,-0.2 0.941 108.0 51.1 -70.6 -48.9 -44.8 9.5 6.0 711 907 A K H 3<5S+ 0 0 94 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.859 112.3 49.8 -52.0 -35.9 -42.7 11.9 8.2 712 908 A A T 3<5S- 0 0 47 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.506 105.9-130.0 -83.6 -4.4 -44.4 14.7 6.2 713 909 A Q T < 5 - 0 0 103 -3,-1.7 -3,-0.2 -4,-0.2 3,-0.2 0.880 33.2-164.9 54.0 38.7 -48.0 13.3 6.8 714 910 A Y > < - 0 0 38 -5,-2.3 3,-2.1 1,-0.2 4,-0.3 -0.249 38.1 -76.1 -51.3 139.6 -48.6 13.7 3.1 715 911 A P T 3 S- 0 0 92 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.123 109.6 -9.9 -48.3 124.9 -52.4 13.5 2.4 716 912 A N T >> S+ 0 0 122 -3,-0.2 3,-1.0 1,-0.1 4,-0.8 0.636 86.4 137.9 65.6 16.4 -53.7 9.9 2.5 717 913 A I H <> + 0 0 2 -3,-2.1 4,-2.2 1,-0.2 3,-0.4 0.807 60.9 70.6 -63.0 -29.0 -50.2 8.3 2.7 718 914 A L H 3> S+ 0 0 38 -4,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.861 92.1 58.6 -56.9 -35.7 -51.5 5.9 5.4 719 915 A N H <> S+ 0 0 100 -3,-1.0 4,-2.1 1,-0.2 -1,-0.2 0.911 107.2 45.8 -59.2 -43.8 -53.5 4.2 2.7 720 916 A E H X S+ 0 0 27 -4,-0.8 4,-2.7 -3,-0.4 -2,-0.2 0.855 109.6 55.1 -69.3 -34.0 -50.3 3.5 0.7 721 917 A I H X S+ 0 0 0 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.955 108.8 48.0 -60.7 -48.7 -48.5 2.3 3.9 722 918 A I H < S+ 0 0 39 -4,-2.6 3,-0.3 1,-0.2 4,-0.3 0.923 113.9 46.1 -57.2 -48.5 -51.3 -0.2 4.5 723 919 A E H >< S+ 0 0 114 -4,-2.1 3,-2.0 1,-0.2 -1,-0.2 0.902 108.1 56.8 -60.7 -43.7 -51.1 -1.4 0.9 724 920 A H H >< S+ 0 0 10 -4,-2.7 3,-1.6 1,-0.3 -1,-0.2 0.824 97.3 64.4 -56.7 -33.4 -47.3 -1.6 1.0 725 921 A S T 3< S+ 0 0 4 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.596 95.6 58.4 -68.8 -11.2 -47.7 -3.9 4.0 726 922 A K T < S+ 0 0 122 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.394 79.4 116.8 -98.0 1.1 -49.3 -6.5 1.8 727 923 A S < - 0 0 15 -3,-1.6 6,-0.1 -4,-0.2 -3,-0.0 -0.322 69.8-131.6 -64.1 149.9 -46.3 -6.7 -0.6 728 924 A P S S+ 0 0 61 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.679 84.2 91.3 -76.1 -14.7 -44.6 -10.1 -0.7 729 925 A Y >> - 0 0 8 1,-0.2 4,-2.1 -444,-0.1 3,-1.0 -0.699 68.8-150.0 -84.7 120.3 -41.2 -8.5 -0.3 730 926 A P H 3> S+ 0 0 0 0, 0.0 4,-2.9 0, 0.0 5,-0.4 0.856 96.9 65.1 -55.9 -34.8 -40.1 -8.2 3.3 731 927 A S H 3> S+ 0 0 17 -445,-0.4 4,-1.1 1,-0.2 -444,-0.1 0.893 109.0 41.1 -53.0 -39.2 -38.1 -5.0 2.5 732 928 A N H <> S+ 0 0 0 -3,-1.0 4,-2.4 2,-0.2 -1,-0.2 0.946 116.3 45.0 -72.8 -53.0 -41.5 -3.5 1.7 733 929 A W H X S+ 0 0 12 -4,-2.1 4,-1.3 1,-0.2 -2,-0.2 0.831 114.3 49.3 -71.1 -27.0 -43.6 -4.8 4.6 734 930 A L H X S+ 0 0 7 -4,-2.9 4,-1.9 -5,-0.2 -1,-0.2 0.868 109.5 53.0 -71.0 -37.0 -40.9 -4.1 7.2 735 931 A T H X S+ 0 0 25 -4,-1.1 4,-2.8 -5,-0.4 5,-0.3 0.928 103.9 57.2 -58.6 -42.1 -40.7 -0.6 5.7 736 932 A S H X S+ 0 0 0 -4,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.881 104.5 53.0 -61.4 -35.8 -44.4 -0.3 6.2 737 933 A L H < S+ 0 0 0 -4,-1.3 4,-0.2 2,-0.2 -1,-0.2 0.950 112.9 41.5 -58.4 -52.7 -44.0 -1.1 9.9 738 934 A S H >< S+ 0 0 20 -4,-1.9 3,-1.2 1,-0.2 37,-0.5 0.883 114.4 49.6 -71.6 -36.1 -41.4 1.6 10.5 739 935 A V H >< S+ 0 0 2 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.766 101.0 65.7 -72.3 -21.7 -43.1 4.3 8.4 740 936 A S G >< S+ 0 0 0 -4,-1.3 3,-2.4 -5,-0.3 6,-0.4 0.569 74.1 94.1 -72.2 -7.5 -46.3 3.6 10.2 741 937 A A G < S+ 0 0 6 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.800 79.6 57.5 -52.6 -29.4 -44.6 4.9 13.4 742 938 A Y G < S+ 0 0 64 -3,-1.1 -1,-0.3 -4,-0.2 2,-0.3 0.329 104.6 63.4 -87.4 7.6 -46.1 8.3 12.7 743 939 A F S X S- 0 0 31 -3,-2.4 3,-1.5 -25,-0.0 -33,-0.0 -0.873 88.5-112.0-134.5 161.6 -49.7 7.0 12.6 744 940 A D T 3 S+ 0 0 135 -2,-0.3 3,-0.3 1,-0.3 4,-0.2 0.574 110.0 72.0 -70.3 -7.2 -52.2 5.4 15.0 745 941 A K T 3> + 0 0 72 -5,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.367 66.8 102.0 -86.5 3.8 -51.9 2.2 12.9 746 942 A Y H <> S+ 0 0 1 -3,-1.5 4,-2.9 -6,-0.4 3,-0.3 0.942 81.1 44.3 -58.9 -54.8 -48.4 1.4 14.2 747 943 A F H > S+ 0 0 78 -3,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.800 109.4 58.3 -64.8 -28.6 -49.2 -1.3 16.7 748 944 A E H > S+ 0 0 113 -4,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.927 112.6 39.3 -61.4 -46.2 -51.6 -2.9 14.2 749 945 A L H X S+ 0 0 3 -4,-1.9 4,-3.1 -3,-0.3 5,-0.3 0.835 109.7 61.7 -75.8 -33.3 -48.7 -3.3 11.8 750 946 A Y H X S+ 0 0 6 -4,-2.9 4,-2.0 -5,-0.2 -2,-0.2 0.968 109.9 41.2 -47.4 -57.3 -46.4 -4.2 14.7 751 947 A D H X S+ 0 0 76 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.905 115.6 49.5 -61.4 -45.5 -48.7 -7.3 15.3 752 948 A K H X S+ 0 0 77 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.929 113.7 44.4 -62.3 -46.2 -49.1 -8.2 11.7 753 949 A T H X S+ 0 0 0 -4,-3.1 4,-1.0 1,-0.2 -1,-0.2 0.811 109.0 58.2 -74.1 -28.3 -45.4 -8.0 10.8 754 950 A Y H >X S+ 0 0 68 -4,-2.0 4,-2.4 -5,-0.3 3,-1.0 0.964 106.8 47.4 -57.6 -52.2 -44.6 -10.0 14.0 755 951 A K H 3< S+ 0 0 127 -4,-2.1 4,-0.3 1,-0.3 -2,-0.2 0.870 111.7 50.9 -60.8 -36.9 -46.8 -12.8 12.9 756 952 A L H 3< S+ 0 0 84 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.738 121.0 35.7 -65.7 -22.6 -45.1 -12.7 9.4 757 953 A S H X< S+ 0 0 0 -3,-1.0 3,-1.8 -4,-1.0 7,-0.5 0.718 91.3 84.8-102.6 -27.4 -41.7 -12.8 11.1 758 954 A K T 3< S+ 0 0 86 -4,-2.4 -3,-0.1 1,-0.3 -1,-0.1 0.611 86.5 55.1 -70.9 -14.9 -41.9 -15.0 14.1 759 955 A D T 3 S+ 0 0 103 -4,-0.3 2,-0.5 1,-0.1 -1,-0.3 0.501 98.8 65.1 -98.6 -5.6 -41.3 -18.4 12.4 760 956 A D S <> S- 0 0 10 -3,-1.8 4,-3.0 1,-0.1 5,-0.2 -0.978 72.3-149.7-118.9 120.4 -38.0 -17.5 10.7 761 957 A E H > S+ 0 0 35 -2,-0.5 4,-1.4 1,-0.2 -1,-0.1 0.871 96.5 41.4 -56.1 -45.9 -35.2 -16.8 13.1 762 958 A L H > S+ 0 0 16 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.851 114.1 51.6 -75.5 -35.8 -33.4 -14.3 10.8 763 959 A L H > S+ 0 0 1 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.897 106.6 54.7 -67.8 -40.9 -36.5 -12.6 9.7 764 960 A L H X S+ 0 0 30 -4,-3.0 4,-2.7 -7,-0.5 -2,-0.2 0.893 106.9 51.9 -56.1 -39.4 -37.6 -12.1 13.4 765 961 A Q H X S+ 0 0 8 -4,-1.4 4,-1.9 -5,-0.2 -2,-0.2 0.888 108.1 50.2 -67.6 -36.7 -34.2 -10.5 13.9 766 962 A E H X S+ 0 0 22 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.921 110.5 51.1 -61.5 -42.8 -34.9 -8.1 11.0 767 963 A W H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.921 107.7 52.7 -60.5 -45.3 -38.3 -7.4 12.6 768 964 A L H X S+ 0 0 2 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.888 109.0 49.4 -54.5 -43.7 -36.6 -6.6 15.9 769 965 A K H X S+ 0 0 68 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.889 108.8 53.2 -65.2 -39.3 -34.2 -4.2 14.2 770 966 A T H < S+ 0 0 4 -4,-2.1 4,-0.4 2,-0.2 -2,-0.2 0.905 112.1 44.0 -65.0 -41.9 -37.2 -2.5 12.5 771 967 A V H >< S+ 0 0 0 -4,-2.3 3,-1.7 1,-0.2 -2,-0.2 0.956 112.1 52.8 -64.6 -50.4 -39.0 -2.0 15.8 772 968 A S H 3< S+ 0 0 0 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.840 113.0 45.0 -49.4 -38.8 -35.8 -0.8 17.5 773 969 A R T 3< S+ 0 0 132 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.474 85.3 127.2 -88.5 -5.8 -35.3 1.8 14.8 774 970 A S < - 0 0 0 -3,-1.7 2,-1.8 -4,-0.4 -35,-0.1 -0.253 66.2-125.6 -61.3 138.1 -38.9 2.9 14.8 775 971 A D + 0 0 67 -37,-0.5 2,-0.4 3,-0.0 -1,-0.1 -0.559 57.0 147.4 -86.8 77.8 -39.4 6.7 15.2 776 972 A R > - 0 0 40 -2,-1.8 3,-1.1 1,-0.1 4,-0.1 -0.909 53.2-146.2-121.5 138.5 -41.7 6.5 18.2 777 973 A K T 3 S+ 0 0 173 -2,-0.4 3,-0.4 1,-0.3 -1,-0.1 0.807 107.9 49.7 -68.2 -30.6 -42.1 8.8 21.2 778 974 A D T 3> S+ 0 0 45 1,-0.2 4,-2.1 2,-0.1 3,-0.5 0.005 73.3 126.4 -95.3 28.1 -42.9 5.7 23.3 779 975 A I H <> + 0 0 0 -3,-1.1 4,-2.5 1,-0.2 -1,-0.2 0.840 68.8 55.8 -58.0 -36.8 -39.8 3.9 22.1 780 976 A Y H > S+ 0 0 16 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.904 108.7 47.2 -62.5 -40.6 -38.5 3.2 25.6 781 977 A E H > S+ 0 0 104 -3,-0.5 4,-2.2 1,-0.2 -2,-0.2 0.881 111.1 53.0 -67.2 -37.1 -41.8 1.4 26.5 782 978 A I H X S+ 0 0 2 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.906 106.2 52.3 -64.6 -41.4 -41.5 -0.5 23.2 783 979 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.916 108.4 50.8 -60.9 -43.9 -38.0 -1.7 24.1 784 980 A K H X S+ 0 0 105 -4,-1.9 4,-2.8 2,-0.2 5,-0.2 0.925 109.0 52.6 -55.7 -46.6 -39.2 -3.0 27.4 785 981 A K H X S+ 0 0 66 -4,-2.2 4,-2.0 1,-0.2 5,-0.3 0.908 109.6 47.9 -54.2 -46.5 -42.0 -4.8 25.5 786 982 A L H X>S+ 0 0 0 -4,-2.4 5,-2.5 2,-0.2 4,-2.1 0.900 112.0 51.2 -61.9 -41.5 -39.4 -6.4 23.3 787 983 A E H <>S+ 0 0 49 -4,-2.6 5,-2.1 1,-0.2 -2,-0.2 0.942 117.2 37.0 -59.8 -50.3 -37.4 -7.4 26.3 788 984 A N H <5S+ 0 0 112 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.755 127.7 32.7 -75.8 -26.5 -40.3 -9.0 28.1 789 985 A E H <5S+ 0 0 99 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.2 0.684 132.3 6.3-110.9 -22.8 -42.0 -10.5 25.2 790 986 A V T <5S+ 0 0 32 -4,-2.1 -3,-0.2 -5,-0.3 -4,-0.1 0.663 126.9 39.0-131.4 -57.7 -39.4 -11.6 22.6 791 987 A L T > - 0 0 10 1,-0.2 4,-2.2 -536,-0.1 3,-0.4 -0.649 58.1-146.8 -76.5 117.9 -27.9 -15.0 20.9 797 993 A P H > S+ 0 0 1 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.865 97.1 56.6 -54.8 -39.0 -25.7 -12.1 19.7 798 994 A N H > S+ 0 0 6 -539,-0.3 4,-2.2 1,-0.2 5,-0.1 0.922 109.4 45.9 -60.1 -43.3 -28.0 -11.5 16.7 799 995 A D H > S+ 0 0 34 -3,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.935 115.1 45.3 -62.8 -49.9 -31.0 -11.0 19.0 800 996 A I H X S+ 0 0 8 -4,-2.2 4,-1.9 1,-0.2 5,-0.3 0.946 116.2 45.7 -63.2 -47.6 -29.2 -8.7 21.5 801 997 A R H X S+ 0 0 35 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.869 110.6 54.9 -62.6 -38.2 -27.6 -6.6 18.7 802 998 A A H < S+ 0 0 5 -4,-2.2 -1,-0.2 -5,-0.3 -30,-0.2 0.851 110.9 44.6 -62.9 -36.6 -31.0 -6.4 16.8 803 999 A V H < S+ 0 0 0 -4,-1.8 4,-0.3 -3,-0.2 -2,-0.2 0.911 126.2 23.2 -76.8 -42.0 -32.8 -5.0 19.9 804 1000 A Y H X S+ 0 0 14 -4,-1.9 4,-1.3 -5,-0.2 -3,-0.2 0.826 108.9 62.8-100.3 -37.3 -30.4 -2.4 21.1 805 1001 A L T >< S+ 0 0 47 -4,-1.7 3,-0.5 -5,-0.3 4,-0.4 0.927 102.4 48.4 -64.3 -47.7 -28.0 -1.2 18.4 806 1002 A P G >4 S+ 0 0 16 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.900 108.1 57.2 -62.0 -38.9 -30.5 0.3 15.9 807 1003 A F G >4 S+ 0 0 1 -4,-0.3 3,-2.5 1,-0.3 7,-0.3 0.841 94.3 65.6 -54.2 -39.3 -32.1 2.2 18.8 808 1004 A T G << S+ 0 0 12 -4,-1.3 -1,-0.3 -3,-0.5 -3,-0.1 0.645 93.4 62.5 -65.1 -11.9 -28.8 3.9 19.7 809 1005 A N G < S+ 0 0 77 -3,-1.6 2,-1.2 -4,-0.4 -1,-0.3 0.493 71.9 110.8 -87.1 -5.0 -29.0 5.6 16.3 810 1006 A N <>> - 0 0 21 -3,-2.5 4,-2.2 1,-0.2 5,-0.8 -0.585 55.3-165.2 -70.1 97.9 -32.2 7.4 17.4 811 1007 A L T 45S+ 0 0 21 -2,-1.2 4,-0.5 1,-0.2 -1,-0.2 0.874 81.2 39.5 -59.1 -40.4 -30.7 10.9 17.6 812 1008 A R T 45S+ 0 0 56 2,-0.1 -1,-0.2 -3,-0.1 -2,-0.1 0.900 125.7 29.7 -78.6 -40.4 -33.6 12.3 19.6 813 1009 A R T >45S+ 0 0 58 2,-0.2 3,-1.5 -6,-0.1 8,-0.2 0.856 115.9 51.6 -95.8 -39.0 -34.4 9.6 22.1 814 1010 A F T 3<5S+ 0 0 1 -4,-2.2 7,-0.3 -7,-0.3 8,-0.3 0.906 113.8 49.0 -64.0 -39.8 -31.2 7.7 22.7 815 1011 A H T 3 S+ 0 0 5 -3,-2.7 4,-2.2 -5,-0.1 5,-0.2 0.522 70.8 129.5 87.7 6.2 -29.2 10.1 30.2 820 1016 A K H > + 0 0 89 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.739 69.0 54.3 -72.5 -23.9 -31.7 7.2 30.3 821 1017 A G H > S+ 0 0 0 -5,-0.3 4,-2.2 -7,-0.3 -1,-0.2 0.924 110.4 47.2 -67.3 -45.5 -30.6 6.0 26.9 822 1018 A Y H > S+ 0 0 0 -8,-0.3 4,-2.3 -6,-0.3 -2,-0.2 0.878 112.4 49.3 -61.7 -41.0 -27.0 5.9 28.1 823 1019 A K H X S+ 0 0 114 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.879 109.5 52.7 -69.4 -38.4 -28.0 4.1 31.3 824 1020 A L H X S+ 0 0 29 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.941 112.1 43.1 -62.5 -50.9 -30.0 1.5 29.4 825 1021 A I H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.905 111.3 55.3 -65.9 -39.4 -27.3 0.6 27.0 826 1022 A A H X S+ 0 0 4 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.914 107.3 50.4 -55.5 -46.0 -24.6 0.5 29.8 827 1023 A E H X S+ 0 0 109 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.925 111.7 47.5 -58.3 -47.3 -26.8 -2.0 31.8 828 1024 A V H X S+ 0 0 14 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.917 111.6 50.8 -59.5 -44.7 -27.1 -4.2 28.7 829 1025 A I H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.933 112.7 45.9 -58.4 -46.9 -23.3 -3.9 28.1 830 1026 A T H X S+ 0 0 22 -4,-2.8 4,-0.6 2,-0.2 -2,-0.2 0.910 114.4 47.4 -65.6 -43.1 -22.6 -4.9 31.7 831 1027 A K H >< S+ 0 0 109 -4,-2.7 3,-1.1 1,-0.2 4,-0.3 0.931 113.7 47.9 -60.6 -47.3 -25.1 -7.8 31.6 832 1028 A T H >X S+ 0 0 2 -4,-2.9 4,-3.2 1,-0.2 3,-1.8 0.842 101.4 64.7 -64.4 -34.0 -23.8 -9.1 28.3 833 1029 A D H 3< S+ 0 0 14 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.687 88.2 70.3 -67.2 -18.9 -20.1 -8.9 29.5 834 1030 A K T << S+ 0 0 144 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.702 121.5 10.9 -73.0 -19.7 -20.8 -11.6 32.1 835 1031 A F T <4 S+ 0 0 32 -3,-1.8 -2,-0.2 -4,-0.3 -1,-0.1 0.592 137.9 28.8-127.1 -24.1 -21.2 -14.2 29.3 836 1032 A N X + 0 0 1 -4,-3.2 4,-2.0 1,-0.1 -2,-0.2 -0.715 53.3 176.9-146.1 86.1 -19.9 -12.7 26.0 837 1033 A P H > S+ 0 0 29 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.822 81.7 59.4 -57.6 -35.3 -17.3 -9.9 26.3 838 1034 A M H > S+ 0 0 27 -731,-0.2 4,-1.9 1,-0.2 5,-0.1 0.966 109.8 40.6 -64.0 -50.0 -17.0 -9.6 22.5 839 1035 A V H > S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.878 110.3 60.1 -63.7 -37.6 -20.6 -8.6 22.1 840 1036 A A H < S+ 0 0 0 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.902 106.6 46.8 -56.1 -44.1 -20.5 -6.4 25.2 841 1037 A T H >< S+ 0 0 11 -4,-2.1 3,-2.0 1,-0.2 -1,-0.2 0.917 107.5 56.0 -66.1 -42.6 -17.8 -4.4 23.6 842 1038 A Q H >< S+ 0 0 62 -4,-1.9 3,-1.6 1,-0.3 -2,-0.2 0.887 101.7 58.5 -54.5 -39.0 -19.7 -4.2 20.3 843 1039 A L T 3< S+ 0 0 0 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.585 91.4 71.6 -69.3 -8.7 -22.6 -2.7 22.3 844 1040 A C T X + 0 0 0 -3,-2.0 3,-2.3 -4,-0.3 4,-0.4 0.527 65.8 105.0 -79.1 -8.1 -20.3 0.1 23.4 845 1041 A E G X S+ 0 0 58 -3,-1.6 3,-1.8 1,-0.3 4,-0.3 0.793 70.3 59.3 -45.2 -45.5 -20.3 1.6 19.9 846 1042 A P G > S+ 0 0 13 0, 0.0 3,-0.8 0, 0.0 -1,-0.3 0.753 99.2 59.4 -57.7 -29.0 -22.7 4.5 20.8 847 1043 A F G X S+ 0 0 0 -3,-2.3 3,-2.3 1,-0.2 4,-0.2 0.592 78.3 89.8 -78.2 -11.6 -20.1 5.8 23.4 848 1044 A K G < S+ 0 0 4 -3,-1.8 3,-0.3 -4,-0.4 -1,-0.2 0.787 89.8 46.9 -59.2 -26.0 -17.4 6.2 20.8 849 1045 A L G X S+ 0 0 18 -3,-0.8 3,-2.4 -4,-0.3 4,-0.5 0.292 75.7 117.1 -98.5 11.9 -18.6 9.8 20.2 850 1046 A W G X S+ 0 0 16 -3,-2.3 3,-1.4 1,-0.3 -1,-0.2 0.848 73.6 51.6 -47.6 -45.5 -18.9 10.8 23.9 851 1047 A N G 3 S+ 0 0 53 -3,-0.3 -1,-0.3 1,-0.3 -208,-0.3 0.446 102.6 61.7 -79.7 3.4 -16.2 13.6 23.8 852 1048 A K G < S+ 0 0 24 -3,-2.4 -208,-3.0 -210,-0.1 -1,-0.3 0.501 89.7 89.2 -99.3 -8.6 -17.8 15.2 20.8 853 1049 A L B < S-b 644 0I 0 -3,-1.4 -210,-0.2 -4,-0.5 -208,-0.2 -0.397 89.9 -77.9 -89.6 166.6 -21.1 16.0 22.6 854 1050 A D > - 0 0 22 -210,-2.5 4,-2.6 -211,-0.3 3,-0.3 -0.124 55.6 -96.5 -57.1 160.9 -22.3 19.0 24.6 855 1051 A T H > S+ 0 0 104 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.821 121.3 49.0 -61.4 -39.1 -20.9 19.2 28.2 856 1052 A K H > S+ 0 0 125 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.925 113.9 45.8 -65.1 -43.9 -23.9 17.6 29.9 857 1053 A R H > S+ 0 0 4 -3,-0.3 4,-2.5 1,-0.2 5,-0.2 0.882 110.5 53.9 -70.8 -36.8 -24.1 14.7 27.5 858 1054 A Q H X S+ 0 0 45 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.934 110.1 48.0 -53.3 -51.1 -20.4 14.2 27.8 859 1055 A E H X S+ 0 0 113 -4,-2.2 4,-2.9 -5,-0.2 -2,-0.2 0.918 111.7 49.0 -60.5 -45.3 -20.7 14.0 31.5 860 1056 A L H X S+ 0 0 45 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.900 114.1 45.0 -62.8 -43.1 -23.6 11.6 31.4 861 1057 A M H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.922 113.5 50.4 -65.4 -44.5 -21.8 9.2 29.0 862 1058 A L H X S+ 0 0 46 -4,-2.8 4,-2.8 -5,-0.2 5,-0.3 0.926 107.9 53.6 -60.7 -45.5 -18.6 9.5 31.0 863 1059 A N H X S+ 0 0 81 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.914 110.0 47.7 -54.2 -46.4 -20.5 8.6 34.2 864 1060 A E H X S+ 0 0 40 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.886 112.2 49.0 -63.9 -38.2 -21.9 5.5 32.6 865 1061 A M H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.913 111.5 48.2 -70.7 -41.1 -18.6 4.4 31.2 866 1062 A N H X S+ 0 0 74 -4,-2.8 4,-0.6 2,-0.2 -1,-0.2 0.853 110.2 54.0 -65.3 -33.3 -16.9 4.9 34.6 867 1063 A T H >< S+ 0 0 70 -4,-1.9 3,-1.3 -5,-0.3 4,-0.4 0.942 108.3 48.2 -62.3 -48.4 -19.7 2.9 36.2 868 1064 A M H >< S+ 0 0 1 -4,-2.3 3,-1.5 1,-0.3 -2,-0.2 0.888 106.8 58.1 -57.9 -38.4 -19.1 0.0 33.8 869 1065 A L H 3< S+ 0 0 27 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.693 100.8 57.7 -66.9 -16.9 -15.4 0.2 34.6 870 1066 A Q T << S+ 0 0 158 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.500 77.5 118.9 -93.2 -6.6 -16.3 -0.4 38.3 871 1067 A E S X S- 0 0 61 -3,-1.5 3,-1.4 -4,-0.4 2,-0.1 -0.411 71.1-113.6 -65.5 131.6 -18.1 -3.7 37.7 872 1068 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.413 98.4 12.8 -62.4 135.6 -16.5 -6.6 39.5 873 1069 A N T 3 S+ 0 0 168 1,-0.2 3,-0.1 -2,-0.1 -2,-0.1 0.696 83.3 174.4 67.2 20.6 -15.0 -9.2 37.1 874 1070 A I < - 0 0 28 -3,-1.4 -1,-0.2 -5,-0.1 -40,-0.1 -0.328 37.6-104.6 -50.3 136.3 -15.3 -6.9 34.1 875 1071 A S > - 0 0 20 1,-0.1 4,-2.4 -42,-0.1 5,-0.2 -0.286 15.4-122.1 -65.1 152.6 -13.6 -8.7 31.1 876 1072 A N H > S+ 0 0 109 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.895 113.4 59.8 -55.1 -41.7 -10.2 -7.6 29.9 877 1073 A N H > S+ 0 0 17 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.935 111.4 35.2 -51.6 -55.4 -11.9 -7.0 26.6 878 1074 A L H > S+ 0 0 2 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.893 116.8 53.8 -73.4 -40.8 -14.4 -4.4 27.9 879 1075 A K H X S+ 0 0 99 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.953 109.9 47.2 -58.7 -52.2 -12.0 -2.9 30.4 880 1076 A E H X S+ 0 0 17 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.945 113.4 50.2 -52.3 -50.7 -9.3 -2.3 27.7 881 1077 A Y H X S+ 0 0 17 -4,-1.9 4,-2.6 -5,-0.3 -2,-0.2 0.908 114.6 41.3 -55.4 -49.2 -11.9 -0.8 25.4 882 1078 A L H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.830 112.4 53.5 -76.3 -35.2 -13.4 1.7 28.0 883 1079 A L H <>S+ 0 0 63 -4,-2.8 5,-3.4 -5,-0.3 -1,-0.2 0.896 113.8 44.4 -62.0 -40.3 -10.0 2.7 29.4 884 1080 A R H ><5S+ 0 0 59 -4,-2.4 3,-1.9 -5,-0.3 -2,-0.2 0.953 112.6 51.0 -67.2 -48.7 -8.9 3.5 25.9 885 1081 A L H 3<5S+ 0 0 0 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.821 112.4 46.7 -60.1 -33.3 -12.1 5.3 25.0 886 1082 A T T 3<5S- 0 0 18 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.098 118.7-106.5-100.0 21.4 -11.9 7.5 28.1 887 1083 A N T < 5 0 0 87 -3,-1.9 -3,-0.2 -5,-0.0 -2,-0.1 0.814 360.0 360.0 63.1 32.3 -8.3 8.4 27.7 888 1084 A K < 0 0 99 -5,-3.4 -4,-0.1 -6,-0.2 -6,-0.0 0.049 360.0 360.0 128.1 360.0 -6.9 6.2 30.5 889 ! 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 0.0 890 1101 A R 0 0 24 0, 0.0 -624,-0.2 0, 0.0 -626,-0.1 0.000 360.0 360.0 360.0 360.0 -12.9 -13.2 9.9