==== 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 HYDROLASE 10-MAY-07 2PVW . COMPND 2 MOLECULE: GLUTAMATE CARBOXYPEPTIDASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.BARINKA,J.LUBKOWSKI . 690 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25937.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 459 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 61 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 26 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 69 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 210 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 1 0 5 2 3 1 1 0 0 0 0 1 1 0 3 0 0 0 1 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 1 2 1 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 PARALLEL BRIDGES PER LADDER . 7 1 1 1 2 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 56 A H 0 0 106 0, 0.0 2,-0.2 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 77.0 14.6 47.0 78.8 2 57 A N > - 0 0 92 0, 0.0 4,-1.8 0, 0.0 5,-0.1 -0.573 360.0 -76.2-129.8-168.4 16.8 49.4 76.9 3 58 A M H > S+ 0 0 16 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.909 127.8 56.0 -66.7 -40.0 18.7 49.3 73.6 4 59 A K H > S+ 0 0 144 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.899 105.1 52.3 -57.3 -42.1 21.5 47.2 75.0 5 60 A A H > S+ 0 0 35 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.915 112.6 47.0 -55.8 -47.6 18.9 44.5 76.2 6 61 A F H >X S+ 0 0 0 -4,-1.8 4,-0.6 1,-0.2 3,-0.6 0.945 114.4 44.7 -60.4 -50.1 17.6 44.5 72.6 7 62 A L H >< S+ 0 0 15 -4,-2.9 3,-0.8 1,-0.2 -2,-0.2 0.837 109.6 54.8 -68.7 -35.9 21.0 44.3 70.9 8 63 A D H 3< S+ 0 0 88 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.729 99.8 62.2 -70.8 -22.2 22.4 41.6 73.2 9 64 A E H << S+ 0 0 59 -4,-1.0 -1,-0.2 -3,-0.6 2,-0.2 0.748 82.2 97.1 -74.6 -23.8 19.4 39.3 72.4 10 65 A L << - 0 0 6 -3,-0.8 2,-0.4 -4,-0.6 3,-0.1 -0.485 60.6-163.9 -66.5 134.8 20.4 39.2 68.7 11 66 A K >> - 0 0 91 -2,-0.2 4,-1.6 1,-0.1 3,-0.7 -0.977 28.5-147.8-131.0 131.8 22.4 36.0 67.8 12 67 A A H 3> S+ 0 0 22 -2,-0.4 4,-2.4 1,-0.2 5,-0.1 0.845 102.7 60.4 -52.6 -39.9 24.6 35.1 64.8 13 68 A E H 3> S+ 0 0 101 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.843 104.5 48.1 -63.0 -35.3 23.5 31.5 65.3 14 69 A N H <> S+ 0 0 36 -3,-0.7 4,-2.3 2,-0.2 -1,-0.2 0.891 108.5 52.6 -73.0 -39.3 19.9 32.4 64.8 15 70 A I H X S+ 0 0 0 -4,-1.6 4,-2.7 1,-0.2 -2,-0.2 0.924 109.6 51.4 -61.0 -42.9 20.6 34.4 61.7 16 71 A K H X S+ 0 0 57 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.940 109.4 49.0 -58.6 -50.7 22.4 31.3 60.3 17 72 A K H X S+ 0 0 121 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.889 113.5 46.8 -54.7 -44.1 19.5 29.0 61.1 18 73 A F H X S+ 0 0 27 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.930 109.8 52.9 -68.6 -40.4 17.0 31.3 59.4 19 74 A L H X S+ 0 0 0 -4,-2.7 4,-0.6 1,-0.2 3,-0.3 0.939 110.3 48.1 -60.7 -47.2 19.2 31.8 56.3 20 75 A Y H >< S+ 0 0 113 -4,-2.5 3,-1.3 1,-0.2 4,-0.3 0.946 111.7 50.9 -56.8 -44.5 19.5 28.1 55.8 21 76 A N H 3< S+ 0 0 72 -4,-2.0 3,-0.4 1,-0.3 -1,-0.2 0.792 111.4 47.4 -64.5 -31.4 15.7 27.7 56.2 22 77 A F H 3< S+ 0 0 2 -4,-2.0 -1,-0.3 -3,-0.3 -2,-0.2 0.476 110.0 51.5 -90.4 -0.7 14.9 30.4 53.6 23 78 A T S << S+ 0 0 0 -3,-1.3 479,-0.4 -4,-0.6 -1,-0.2 0.285 74.3 95.4-128.8 17.0 17.3 29.2 50.9 24 79 A Q S S+ 0 0 58 -3,-0.4 -1,-0.1 -4,-0.3 -2,-0.1 0.773 95.3 19.4 -79.4 -29.6 16.6 25.5 50.3 25 80 A I S S- 0 0 74 303,-0.1 76,-0.1 302,-0.1 302,-0.1 -0.911 95.8 -85.9-135.1 161.8 14.2 26.0 47.4 26 81 A P - 0 0 4 0, 0.0 302,-0.2 0, 0.0 301,-0.1 -0.350 28.6-162.5 -66.2 148.2 13.5 28.9 44.9 27 82 A H + 0 0 9 300,-1.5 298,-1.6 6,-0.1 300,-0.1 -0.407 19.9 173.2-127.9 56.7 11.0 31.6 46.1 28 83 A L > - 0 0 13 296,-0.2 3,-2.0 73,-0.2 6,-0.4 -0.350 42.4 -95.2 -64.0 138.0 10.2 33.3 42.8 29 84 A A T 3 S+ 0 0 0 296,-0.3 -1,-0.1 1,-0.3 3,-0.1 -0.290 108.6 20.4 -58.2 139.6 7.4 35.9 43.0 30 85 A G T 3 S+ 0 0 27 1,-0.3 -1,-0.3 269,-0.1 2,-0.2 0.360 98.3 119.9 84.7 -0.9 3.9 34.6 42.2 31 86 A T S <> S- 0 0 37 -3,-2.0 4,-1.6 1,-0.1 3,-0.5 -0.590 74.3-117.6 -92.7 160.7 4.9 30.9 42.8 32 87 A E H > S+ 0 0 109 1,-0.2 4,-2.7 -2,-0.2 5,-0.2 0.873 113.0 58.5 -62.3 -34.5 3.4 28.5 45.3 33 88 A Q H > S+ 0 0 41 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.857 105.5 49.0 -64.2 -34.2 6.7 28.1 47.1 34 89 A N H > S+ 0 0 1 -3,-0.5 4,-2.0 -6,-0.4 -1,-0.2 0.866 109.9 51.1 -75.3 -34.4 6.9 31.9 47.8 35 90 A F H X S+ 0 0 47 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.916 108.7 53.4 -62.9 -45.5 3.2 31.9 49.1 36 91 A Q H X S+ 0 0 85 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.919 108.1 48.6 -59.7 -39.5 4.2 29.0 51.4 37 92 A L H X S+ 0 0 6 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.894 108.1 55.5 -66.7 -40.8 7.1 30.9 52.8 38 93 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.920 108.2 47.8 -53.2 -46.7 4.8 34.0 53.3 39 94 A K H X S+ 0 0 75 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.879 110.7 52.4 -64.0 -37.2 2.5 31.8 55.4 40 95 A Q H X S+ 0 0 60 -4,-2.1 4,-2.4 -5,-0.2 5,-0.2 0.932 111.0 46.0 -60.3 -48.0 5.5 30.4 57.4 41 96 A I H X S+ 0 0 7 -4,-2.5 4,-3.2 2,-0.2 5,-0.3 0.932 110.5 53.3 -63.6 -41.6 6.8 34.0 58.2 42 97 A Q H X S+ 0 0 33 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.942 111.8 47.1 -58.2 -47.6 3.3 35.1 59.2 43 98 A S H X S+ 0 0 52 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.919 114.0 45.3 -58.2 -48.2 3.1 32.1 61.6 44 99 A Q H X S+ 0 0 40 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.882 108.3 55.3 -69.3 -40.4 6.5 32.7 63.1 45 100 A W H X>S+ 0 0 5 -4,-3.2 5,-1.8 -5,-0.2 4,-0.6 0.876 108.9 49.9 -61.2 -35.4 6.1 36.4 63.6 46 101 A K H ><5S+ 0 0 112 -4,-1.7 3,-1.3 -5,-0.3 -2,-0.2 0.955 112.5 46.7 -61.7 -49.0 2.8 35.6 65.5 47 102 A E H 3<5S+ 0 0 114 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.864 105.7 60.7 -60.3 -36.6 4.7 33.1 67.7 48 103 A F H 3<5S- 0 0 29 -4,-2.7 -1,-0.3 -5,-0.2 304,-0.2 0.711 126.4 -96.4 -68.3 -18.9 7.6 35.6 68.2 49 104 A G T <<5 + 0 0 8 -3,-1.3 -3,-0.2 -4,-0.6 -2,-0.1 0.404 66.5 151.9 125.3 -4.7 5.1 38.0 69.9 50 105 A L < - 0 0 12 -5,-1.8 -1,-0.2 1,-0.1 257,-0.2 -0.225 47.2-128.0 -61.2 149.3 3.8 40.6 67.4 51 106 A D S S- 0 0 54 255,-1.4 2,-0.3 1,-0.2 256,-0.2 0.864 87.1 -1.0 -63.6 -39.2 0.3 42.0 68.1 52 107 A S E -A 306 0A 44 254,-1.2 254,-2.5 -7,-0.0 2,-0.3 -0.987 58.6-171.4-151.1 146.4 -1.1 41.3 64.6 53 108 A V E +A 305 0A 0 -2,-0.3 2,-0.3 252,-0.2 252,-0.2 -0.919 17.5 172.3-144.6 118.0 0.4 39.8 61.4 54 109 A E E -A 304 0A 115 250,-2.5 250,-2.7 -2,-0.3 2,-0.5 -0.846 31.3-126.3-125.0 155.2 -1.6 39.9 58.2 55 110 A L E -A 303 0A 42 -2,-0.3 2,-0.6 248,-0.2 248,-0.2 -0.909 19.8-161.3 -96.7 133.2 -1.0 39.0 54.5 56 111 A A E -A 302 0A 19 246,-2.6 246,-3.1 -2,-0.5 2,-0.3 -0.983 16.3-165.7-111.0 117.7 -1.8 41.9 52.1 57 112 A H E +A 301 0A 70 -2,-0.6 2,-0.3 244,-0.2 244,-0.2 -0.792 12.5 177.8-109.4 152.7 -2.3 40.5 48.6 58 113 A Y E -A 300 0A 2 242,-1.9 242,-2.9 -2,-0.3 2,-0.6 -0.972 28.1-128.3-142.0 158.8 -2.4 42.2 45.2 59 114 A D E +A 299 0A 25 160,-2.4 2,-0.3 -2,-0.3 240,-0.3 -0.928 42.7 166.6-114.6 106.7 -2.7 41.0 41.6 60 115 A V E -A 298 0A 0 238,-2.4 238,-3.0 -2,-0.6 2,-0.5 -0.790 43.7 -89.2-121.4 160.7 0.1 42.5 39.5 61 116 A L E +A 297 0A 6 -2,-0.3 236,-0.2 236,-0.2 2,-0.2 -0.574 51.1 170.8 -72.6 118.2 1.7 42.1 36.1 62 117 A L E -A 296 0A 0 234,-2.6 234,-2.4 -2,-0.5 2,-0.3 -0.614 20.9-139.3-116.1 176.1 4.6 39.5 36.3 63 118 A S E +A 295 0A 0 232,-0.3 232,-0.2 -2,-0.2 45,-0.1 -0.989 21.0 170.6-143.0 136.5 6.7 37.9 33.5 64 119 A Y E -A 294 0A 30 230,-2.1 230,-2.5 -2,-0.3 43,-0.0 -0.982 34.9-103.7-146.7 148.9 7.9 34.3 33.1 65 120 A P - 0 0 16 0, 0.0 2,-0.6 0, 0.0 228,-0.1 -0.354 42.6-103.8 -63.3 159.3 9.6 32.3 30.4 66 121 A N > - 0 0 58 3,-0.5 3,-1.3 1,-0.1 226,-0.1 -0.773 26.0-149.4 -85.9 117.6 7.5 29.7 28.4 67 122 A K T 3 S+ 0 0 189 -2,-0.6 -1,-0.1 1,-0.3 226,-0.0 0.788 95.0 39.4 -59.5 -32.9 8.4 26.3 29.8 68 123 A T T 3 S+ 0 0 128 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.0 0.332 117.9 47.7-102.7 10.2 7.8 24.5 26.5 69 124 A H S < S- 0 0 81 -3,-1.3 -3,-0.5 223,-0.0 -1,-0.2 -0.605 84.2-153.8-150.2 77.1 9.3 27.2 24.1 70 125 A P - 0 0 58 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 -0.095 12.9-120.1 -65.1 149.2 12.7 28.2 25.5 71 126 A N + 0 0 12 34,-0.2 2,-0.3 17,-0.1 220,-0.2 -0.694 47.2 144.4 -81.8 138.9 14.4 31.6 25.0 72 127 A Y E -I 290 0B 49 218,-1.6 218,-2.2 -2,-0.3 2,-0.4 -0.978 39.6-126.0-164.2 170.2 17.8 31.5 23.2 73 128 A I E -I 289 0B 0 -2,-0.3 13,-2.8 216,-0.2 2,-0.3 -0.967 25.4-168.0-122.8 142.5 20.0 33.4 20.8 74 129 A S E -IJ 288 85B 0 214,-3.0 214,-2.8 -2,-0.4 2,-0.5 -0.900 26.5-133.1-119.4 156.3 21.6 32.0 17.6 75 130 A I E -IJ 287 84B 3 9,-1.9 8,-2.0 -2,-0.3 9,-1.3 -0.947 36.6-162.8 -95.4 132.3 24.2 32.8 15.1 76 131 A I E -IJ 286 82B 12 210,-2.6 210,-2.4 -2,-0.5 6,-0.2 -0.932 6.8-138.3-120.1 133.9 22.5 32.0 11.8 77 132 A N > - 0 0 36 4,-2.5 3,-2.6 -2,-0.4 208,-0.1 -0.387 40.2 -85.8 -85.0 176.2 24.2 31.5 8.4 78 133 A E T 3 S+ 0 0 144 1,-0.3 -1,-0.1 2,-0.1 207,-0.1 0.627 129.3 52.2 -55.6 -17.9 23.1 32.8 5.0 79 134 A D T 3 S- 0 0 138 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.419 121.2-105.7 -97.3 -2.3 20.9 29.7 4.5 80 135 A G < + 0 0 44 -3,-2.6 2,-0.5 1,-0.3 -2,-0.1 0.736 69.5 147.5 84.0 22.7 19.2 30.2 7.9 81 136 A N - 0 0 87 -4,-0.1 -4,-2.5 1,-0.0 2,-1.0 -0.792 50.6-129.1 -86.4 133.9 20.9 27.4 9.7 82 137 A E E +J 76 0B 68 -2,-0.5 -6,-0.3 -6,-0.2 3,-0.1 -0.746 32.0 175.6 -84.0 104.3 21.5 28.1 13.4 83 138 A I E + 0 0 83 -8,-2.0 2,-0.3 -2,-1.0 -1,-0.2 0.640 65.8 26.2 -92.0 -15.8 25.2 27.3 13.7 84 139 A F E -J 75 0B 45 -9,-1.3 -9,-1.9 166,-0.0 2,-0.4 -0.981 66.8-169.8-143.8 135.4 25.6 28.4 17.3 85 140 A N E -J 74 0B 81 -2,-0.3 -11,-0.2 -11,-0.2 3,-0.1 -0.995 20.8-126.4-121.5 137.2 23.0 28.4 20.1 86 141 A T - 0 0 4 -13,-2.8 156,-0.0 -2,-0.4 -2,-0.0 -0.322 46.5 -79.0 -70.1 166.9 23.3 30.0 23.6 87 142 A S - 0 0 62 1,-0.1 -1,-0.1 -15,-0.1 -14,-0.1 -0.160 24.5-147.6 -70.7 152.0 22.5 27.8 26.6 88 143 A L S S+ 0 0 88 1,-0.2 2,-0.3 -3,-0.1 -17,-0.1 0.534 80.0 6.4 -96.3 -7.7 19.0 27.0 27.8 89 144 A F S S- 0 0 128 15,-0.1 -1,-0.2 107,-0.0 14,-0.0 -0.973 78.5-100.8-164.6 157.5 19.9 26.8 31.5 90 145 A E - 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0 0 0 42,-0.8 2,-0.3 9,-0.1 -296,-0.2 -0.455 52.0-175.4 -71.2 145.0 11.0 37.0 46.7 325 380 A S - 0 0 0 -298,-1.6 -296,-0.3 2,-0.2 43,-0.1 -0.890 35.8-123.3-131.8 163.2 14.3 35.8 44.9 326 381 A W S S- 0 0 4 6,-0.4 -223,-0.4 -2,-0.3 -298,-0.2 0.931 96.7 -24.1 -70.2 -46.8 15.2 34.9 41.3 327 382 A V S S- 0 0 4 170,-0.2 -300,-1.5 -300,-0.1 -2,-0.2 0.159 127.1 -19.8-130.1-111.8 16.4 31.5 42.4 328 383 A F S S- 0 0 0 169,-0.2 -303,-0.1 -302,-0.2 173,-0.1 0.706 70.3-148.5 -82.1 -22.2 17.6 30.5 46.0 329 384 A G > + 0 0 4 168,-0.2 5,-1.7 1,-0.1 6,-0.4 0.813 31.4 164.9 63.9 34.9 18.4 34.1 47.1 330 385 A G T 5S+ 0 0 0 170,-2.1 171,-0.2 1,-0.2 -1,-0.1 0.845 85.6 7.1 -59.9 -33.4 21.3 33.1 49.4 331 386 A I T >>S+ 0 0 0 1,-0.2 4,-1.7 3,-0.1 5,-0.7 0.761 118.9 78.6-103.8 -55.6 22.4 36.8 49.5 332 387 A D T 45S- 0 0 8 1,-0.3 -6,-0.4 2,-0.2 -1,-0.2 -0.817 122.6 -24.4-104.5 103.2 19.6 38.7 47.7 333 388 A P T >>5S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 3,-1.4 -0.959 128.3 69.9-110.6 6.6 17.3 38.9 49.7 334 389 A Q H 3><>S+ 0 0 7 -4,-1.8 5,-2.1 1,-0.2 3,-0.6 0.911 111.3 53.4 -61.6 -43.5 11.2 42.1 75.1 351 406 A K H ><5S+ 0 0 47 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.871 103.2 55.8 -60.7 -38.7 7.5 42.4 74.4 352 407 A K H 3<5S+ 0 0 142 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.760 103.8 56.3 -68.7 -21.5 6.8 39.0 76.2 353 408 A E T <<5S- 0 0 114 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.179 132.0 -93.8 -88.8 10.9 8.5 40.5 79.3 354 409 A G T < 5S+ 0 0 69 -3,-1.8 -3,-0.2 1,-0.3 2,-0.2 0.462 82.4 131.3 95.6 2.2 6.1 43.4 79.2 355 410 A W < - 0 0 27 -5,-2.1 -1,-0.3 -6,-0.1 -2,-0.1 -0.537 28.9-178.4 -86.2 150.5 7.9 46.0 77.2 356 411 A R - 0 0 65 -2,-0.2 -47,-0.1 -49,-0.0 4,-0.1 -0.982 31.0-110.9-141.0 145.7 6.4 48.0 74.3 357 412 A P - 0 0 0 0, 0.0 -47,-2.6 0, 0.0 -46,-0.3 -0.363 27.0-117.5 -68.6 163.7 8.1 50.6 72.1 358 413 A R S S+ 0 0 42 173,-0.4 -46,-2.3 -49,-0.2 -47,-2.0 0.968 99.7 33.0 -64.6 -51.7 7.0 54.2 72.5 359 414 A R E S- c 0 312A 2 172,-2.8 -49,-0.2 -50,-0.2 2,-0.2 -0.613 101.3 -88.6-101.0 165.3 5.9 54.3 68.8 360 415 A T E - c 0 316A 6 -45,-1.8 -43,-2.6 -48,-0.9 2,-0.5 -0.440 35.9-154.1 -71.6 134.3 4.3 51.6 66.6 361 416 A I E -Bc 307 317A 0 -54,-2.1 -54,-2.8 -45,-0.2 2,-0.4 -0.961 6.5-163.9-110.2 131.2 6.8 49.4 64.7 362 417 A L E -Bc 306 318A 15 -45,-2.6 -43,-2.9 -2,-0.5 2,-0.4 -0.933 2.2-161.3-111.9 139.0 5.6 47.8 61.5 363 418 A F E -Bc 305 319A 0 -58,-2.7 -58,-2.8 -2,-0.4 2,-0.4 -0.970 9.8-169.1-120.5 137.3 7.6 44.9 60.0 364 419 A A E -Bc 304 320A 2 -45,-2.2 -43,-1.7 -2,-0.4 2,-0.6 -0.975 23.4-165.1-134.9 141.6 7.2 43.9 56.3 365 420 A S E -Bc 303 321A 11 -62,-2.3 -62,-2.0 -2,-0.4 -43,-0.2 -0.954 33.3-152.7-118.8 102.7 8.3 41.0 54.1 366 421 A W E - c 0 322A 0 -45,-2.6 -43,-2.7 -2,-0.6 -42,-0.8 -0.544 3.9-145.0 -86.4 150.8 7.6 42.4 50.6 367 422 A D S S+ 0 0 2 -45,-0.2 8,-1.6 -2,-0.2 9,-0.3 -0.662 72.0 18.0-107.3 164.3 6.8 40.4 47.6 368 423 A A > + 0 0 0 -2,-0.2 6,-1.8 6,-0.2 3,-0.8 0.730 69.2 141.5 50.0 30.7 7.7 40.9 43.9 369 424 A E G >> S+ 0 0 11 -3,-0.3 4,-2.2 4,-0.3 3,-1.9 0.904 70.1 58.3 -63.0 -36.1 10.6 43.3 44.6 370 425 A E G 34 S+ 0 0 9 1,-0.3 -168,-0.7 2,-0.2 -1,-0.2 0.714 99.4 57.0 -71.5 -16.2 12.5 41.7 41.8 371 426 A F G <4 S- 0 0 0 -3,-0.8 -1,-0.3 -170,-0.1 -2,-0.2 0.159 141.7 -56.9 -98.8 15.7 9.8 42.5 39.3 372 427 A G T <4 S- 0 0 4 -3,-1.9 -162,-0.2 -170,-0.1 -2,-0.2 0.720 83.9 -68.6 119.0 33.0 10.0 46.3 40.0 373 428 A L S X S+ 0 0 7 -4,-2.2 4,-1.9 -5,-0.2 -4,-0.3 0.849 82.9 153.7 64.8 34.7 9.3 47.0 43.7 374 429 A L H > + 0 0 0 -6,-1.8 4,-2.7 1,-0.2 -163,-0.3 0.909 59.4 46.5 -70.6 -45.1 5.8 45.9 43.2 375 430 A G H > S+ 0 0 0 -8,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.922 115.7 43.9 -64.3 -46.5 4.7 44.6 46.6 376 431 A S H > S+ 0 0 0 -9,-0.3 4,-2.7 2,-0.2 5,-0.2 0.920 116.1 49.7 -65.5 -42.5 6.0 47.6 48.6 377 432 A T H X S+ 0 0 1 -4,-1.9 4,-2.8 1,-0.2 -2,-0.2 0.926 110.8 47.3 -65.9 -45.6 4.6 50.1 46.0 378 433 A E H X S+ 0 0 0 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.912 113.7 48.2 -61.9 -42.4 1.2 48.6 45.9 379 434 A W H X S+ 0 0 23 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.918 111.9 48.9 -62.9 -41.8 0.9 48.5 49.7 380 435 A A H < S+ 0 0 1 -4,-2.7 4,-0.4 1,-0.2 -2,-0.2 0.883 109.9 53.3 -67.7 -38.3 2.2 52.1 50.0 381 436 A E H >< S+ 0 0 9 -4,-2.8 3,-0.6 1,-0.2 -1,-0.2 0.910 111.8 45.5 -58.3 -43.8 -0.5 53.1 47.3 382 437 A E H 3< S+ 0 0 83 -4,-2.2 3,-0.3 1,-0.2 -2,-0.2 0.906 124.3 32.4 -62.5 -42.8 -3.2 51.4 49.4 383 438 A N T 3X S+ 0 0 36 -4,-2.4 4,-2.6 1,-0.2 3,-0.4 0.091 79.1 122.7-105.4 18.4 -2.0 53.0 52.7 384 439 A S H <> S+ 0 0 23 -3,-0.6 4,-2.6 -4,-0.4 5,-0.2 0.825 72.4 53.0 -58.9 -33.5 -0.7 56.3 51.5 385 440 A R H > S+ 0 0 174 -3,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.895 112.3 45.4 -71.0 -37.6 -2.9 58.5 53.7 386 441 A L H > S+ 0 0 64 -3,-0.4 4,-1.9 1,-0.2 5,-0.3 0.917 115.1 47.8 -67.7 -42.4 -1.8 56.7 56.8 387 442 A L H X S+ 0 0 2 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.882 109.7 49.7 -69.9 -39.9 1.8 56.8 55.9 388 443 A Q H < S+ 0 0 55 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.862 119.6 36.7 -73.9 -22.9 2.0 60.4 55.0 389 444 A E H < S+ 0 0 106 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.711 134.0 23.6 -96.5 -10.7 0.3 61.6 58.2 390 445 A R H < S+ 0 0 88 -4,-1.9 -74,-2.7 -5,-0.2 2,-0.6 0.487 86.7 115.1-128.5 -8.8 1.9 59.0 60.5 391 446 A G E < +d 316 0A 1 -4,-2.0 85,-0.2 -5,-0.3 -74,-0.2 -0.543 28.3 172.2 -80.6 116.7 5.1 57.7 59.0 392 447 A V E - 0 0 0 -76,-2.9 84,-0.6 -2,-0.6 2,-0.3 0.921 62.3 -23.5 -82.5 -52.8 8.2 58.5 60.9 393 448 A A E -de 317 476A 0 -77,-1.2 -75,-2.5 82,-0.1 2,-0.4 -0.989 45.9-142.6-161.9 156.4 10.9 56.5 59.1 394 449 A Y E -de 318 477A 0 82,-2.1 84,-2.2 -2,-0.3 2,-0.5 -0.999 12.4-168.2-128.0 125.9 11.5 53.5 56.9 395 450 A I E -de 319 478A 2 -77,-3.0 -75,-2.4 -2,-0.4 84,-0.2 -0.976 17.3-143.5-116.5 126.6 14.6 51.3 57.3 396 451 A N E -d 320 0A 2 82,-2.6 84,-0.3 -2,-0.5 -75,-0.2 -0.453 13.1-168.4 -88.6 163.8 15.2 48.9 54.4 397 452 A A + 0 0 0 -77,-1.5 -57,-0.2 -2,-0.1 3,-0.1 -0.352 31.1 135.3-154.3 61.0 16.5 45.4 54.9 398 453 A D S S- 0 0 11 1,-0.3 -66,-0.1 -77,-0.2 66,-0.0 -0.070 72.4 -4.9 -83.2-158.9 17.5 43.7 51.6 399 454 A S - 0 0 16 1,-0.2 -1,-0.3 -2,-0.1 -67,-0.1 0.126 58.2-157.4 -37.0 125.2 20.9 41.8 51.3 400 455 A S S S+ 0 0 0 -69,-0.4 82,-3.0 1,-0.2 2,-0.4 0.731 77.8 31.1 -77.5 -21.3 22.9 42.2 54.6 401 456 A I B +f 482 0A 1 80,-0.2 82,-0.2 -70,-0.2 -1,-0.2 -0.990 40.3 158.3-136.7 139.6 26.2 41.4 52.8 402 457 A E S S- 0 0 29 80,-1.5 2,-0.3 1,-0.4 82,-0.2 0.190 88.7 -8.8-135.2 4.6 27.5 42.0 49.3 403 458 A G - 0 0 6 79,-0.4 -1,-0.4 80,-0.2 81,-0.2 -0.922 64.9-119.6-174.5-172.9 31.1 41.7 50.6 404 459 A N S S+ 0 0 75 -2,-0.3 80,-0.2 -3,-0.1 3,-0.1 0.087 82.3 92.9-135.6 31.9 32.9 41.5 53.9 405 460 A Y S S- 0 0 71 78,-2.2 2,-0.3 1,-0.3 79,-0.2 0.927 91.1 -36.2 -95.2 -54.9 35.1 44.6 53.8 406 461 A T E -G 483 0A 3 77,-1.6 77,-3.2 39,-0.1 -1,-0.3 -0.958 67.8 -67.9-161.1 176.2 33.1 47.4 55.5 407 462 A L E -G 482 0A 1 -2,-0.3 2,-0.4 75,-0.2 75,-0.2 -0.448 33.8-162.0 -71.2 147.1 29.8 49.1 56.1 408 463 A R E -G 481 0A 30 73,-2.5 73,-1.9 -2,-0.1 2,-0.4 -0.987 12.7-178.4-132.1 119.0 27.9 50.8 53.3 409 464 A V E +G 480 0A 4 47,-0.5 49,-2.2 -2,-0.4 2,-0.4 -0.972 11.5 179.3-125.4 133.5 25.1 53.3 54.4 410 465 A D E +Gh 479 458A 10 69,-1.8 69,-2.0 -2,-0.4 2,-0.3 -0.998 29.2 131.5-125.4 128.8 22.7 55.4 52.2 411 466 A C E -G 478 0A 2 47,-1.7 49,-0.2 -2,-0.4 67,-0.2 -0.943 57.6 -74.2-163.8 174.7 20.2 57.6 54.0 412 467 A T > - 0 0 0 65,-1.5 3,-2.2 -2,-0.3 4,-0.4 -0.608 46.5-115.4 -72.5 146.9 18.5 61.0 54.4 413 468 A P G > S+ 0 0 0 0, 0.0 3,-1.5 0, 0.0 4,-0.4 0.784 113.0 73.1 -49.2 -25.3 20.7 63.6 56.0 414 469 A L G 3 S+ 0 0 0 1,-0.3 125,-1.2 2,-0.1 4,-0.3 0.726 99.9 45.4 -66.0 -22.3 18.1 63.6 58.9 415 470 A M G <> S+ 0 0 0 -3,-2.2 4,-2.6 123,-0.2 -1,-0.3 0.473 83.5 96.3-101.4 1.8 19.6 60.2 60.0 416 471 A Y H <> S+ 0 0 33 -3,-1.5 4,-2.6 -4,-0.4 5,-0.2 0.905 87.6 44.8 -57.6 -49.3 23.3 61.1 59.7 417 472 A S H > S+ 0 0 33 -4,-0.4 4,-2.9 2,-0.2 -1,-0.2 0.907 111.8 53.1 -62.1 -41.7 23.7 61.8 63.5 418 473 A L H > S+ 0 0 10 119,-0.4 4,-2.5 -4,-0.3 5,-0.2 0.920 111.5 46.1 -57.1 -47.8 21.7 58.8 64.5 419 474 A V H X S+ 0 0 1 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.927 113.1 48.7 -65.1 -46.3 24.0 56.5 62.3 420 475 A H H X S+ 0 0 30 -4,-2.6 4,-1.5 -5,-0.2 -2,-0.2 0.966 115.0 45.6 -56.3 -53.1 27.3 58.1 63.6 421 476 A N H X S+ 0 0 99 -4,-2.9 4,-0.5 1,-0.2 -2,-0.2 0.867 114.5 46.5 -61.7 -39.5 26.1 57.8 67.3 422 477 A L H >< S+ 0 0 5 -4,-2.5 3,-1.8 -5,-0.2 4,-0.4 0.961 111.0 50.7 -71.2 -45.7 24.9 54.2 67.0 423 478 A T H >< S+ 0 0 0 -4,-2.6 16,-1.8 1,-0.3 3,-0.7 0.767 103.7 60.0 -65.4 -25.0 28.0 52.9 65.1 424 479 A K H 3< S+ 0 0 110 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.700 106.8 48.2 -70.2 -19.7 30.2 54.5 67.8 425 480 A E T << S+ 0 0 135 -3,-1.8 2,-0.3 -4,-0.5 -1,-0.2 0.437 99.5 84.4 -95.3 -9.8 28.4 52.3 70.4 426 481 A L S < S- 0 0 10 -3,-0.7 12,-2.4 -4,-0.4 13,-0.3 -0.769 80.4-115.7-101.5 146.5 28.8 49.0 68.3 427 482 A K B -U 437 0I 169 -2,-0.3 10,-0.2 10,-0.2 7,-0.1 -0.600 29.9-119.0 -77.2 137.1 31.7 46.7 68.2 428 483 A S - 0 0 13 8,-2.7 7,-0.3 5,-0.4 8,-0.2 -0.539 15.0-160.3 -70.6 137.5 33.6 46.3 64.9 429 484 A P + 0 0 16 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.467 54.3 117.3 -92.5 0.8 33.6 42.7 63.5 430 485 A D S > S- 0 0 2 3,-0.2 3,-1.7 1,-0.1 2,-0.3 -0.314 75.0-101.6 -75.7 147.1 36.6 43.5 61.2 431 486 A E T 3 S+ 0 0 130 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 -0.502 109.4 18.9 -59.9 124.7 40.0 41.7 61.4 432 487 A G T 3 S+ 0 0 58 -2,-0.3 -1,-0.3 -3,-0.1 -2,-0.1 0.524 108.5 81.0 89.2 6.8 42.4 44.0 63.1 433 488 A F X + 0 0 27 -3,-1.7 3,-2.3 3,-0.1 -5,-0.4 -0.014 54.5 149.7-127.1 28.4 39.8 46.2 64.8 434 489 A E T 3 S+ 0 0 127 1,-0.3 3,-0.1 -5,-0.1 -3,-0.0 -0.375 75.4 16.4 -64.1 137.3 39.0 44.0 67.7 435 490 A G T 3 S+ 0 0 82 1,-0.3 -1,-0.3 -7,-0.3 2,-0.2 0.472 107.5 109.6 75.7 -2.3 38.0 46.1 70.7 436 491 A K S < S- 0 0 90 -3,-2.3 -8,-2.7 -8,-0.2 -1,-0.3 -0.687 73.7-102.9 -97.6 161.1 37.5 49.1 68.3 437 492 A S B > -U 427 0I 30 -2,-0.2 4,-1.9 -10,-0.2 -10,-0.2 -0.462 21.2-119.5 -78.8 156.5 34.1 50.6 67.4 438 493 A L H > S+ 0 0 0 -12,-2.4 4,-2.8 -15,-0.6 5,-0.3 0.884 116.6 59.5 -54.7 -42.6 32.3 50.0 64.1 439 494 A Y H > S+ 0 0 29 -16,-1.8 4,-2.5 -13,-0.3 -1,-0.2 0.904 104.6 49.4 -54.7 -43.4 32.5 53.8 63.6 440 495 A E H > S+ 0 0 84 -17,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.957 114.9 41.5 -66.4 -47.0 36.3 53.6 63.7 441 496 A S H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.933 116.7 49.0 -64.8 -45.1 36.7 50.7 61.2 442 497 A W H X S+ 0 0 1 -4,-2.8 4,-2.4 1,-0.2 14,-0.3 0.909 112.1 47.7 -61.6 -44.3 34.0 52.1 58.9 443 498 A T H < S+ 0 0 17 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.884 113.1 49.1 -67.0 -35.9 35.6 55.6 58.9 444 499 A K H < S+ 0 0 153 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.937 119.3 36.5 -65.7 -45.2 39.1 54.2 58.3 445 500 A K H < S+ 0 0 47 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.727 130.7 28.6 -84.7 -23.7 38.0 51.9 55.4 446 501 A S S < S- 0 0 27 -4,-2.4 10,-2.8 -5,-0.2 -1,-0.2 -0.546 81.1-173.3-134.5 68.8 35.4 54.3 53.8 447 502 A P B -V 455 0J 77 0, 0.0 5,-0.1 0, 0.0 -3,-0.1 -0.279 32.3-103.2 -70.0 148.9 36.4 57.9 54.5 448 503 A S - 0 0 17 6,-3.3 6,-0.2 3,-0.4 5,-0.1 -0.466 19.5-142.4 -62.5 135.1 34.1 60.8 53.7 449 504 A P S S+ 0 0 83 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.844 101.5 39.4 -66.9 -31.9 35.4 62.6 50.6 450 505 A E S S+ 0 0 95 1,-0.1 2,-0.3 2,-0.0 6,-0.0 0.930 113.6 46.7 -79.3 -48.0 34.3 65.9 52.3 451 506 A F S > S- 0 0 100 3,-0.1 3,-1.1 4,-0.1 -3,-0.4 -0.792 70.9-120.4-120.5 144.7 35.3 65.5 56.0 452 507 A S T 3 S+ 0 0 126 -2,-0.3 -2,-0.0 1,-0.2 -1,-0.0 -0.518 97.3 5.2 -75.4 130.3 38.1 64.4 58.2 453 508 A G T 3 S+ 0 0 57 -2,-0.3 -1,-0.2 1,-0.2 -10,-0.1 0.711 105.5 110.0 72.4 22.8 37.4 61.5 60.6 454 509 A M < - 0 0 76 -3,-1.1 -6,-3.3 -6,-0.2 -1,-0.2 -0.972 64.7-122.2-125.6 144.8 33.9 60.9 59.2 455 510 A P B -V 447 0J 6 0, 0.0 2,-0.3 0, 0.0 -12,-0.1 -0.437 32.6 -97.8 -81.1 158.5 32.6 58.0 57.1 456 511 A R - 0 0 111 -10,-2.8 -47,-0.5 -14,-0.3 2,-0.4 -0.539 36.8-175.7 -70.6 134.8 31.0 58.2 53.6 457 512 A I - 0 0 26 -2,-0.3 -47,-0.2 -49,-0.1 2,-0.1 -0.994 16.1-147.3-131.1 123.9 27.2 58.1 53.6 458 513 A S B -h 410 0A 17 -49,-2.2 -47,-1.7 -2,-0.4 2,-0.1 -0.403 15.7 -99.7 -91.9 170.9 25.6 58.0 50.1 459 514 A K - 0 0 52 -49,-0.2 2,-0.5 185,-0.1 185,-0.4 -0.477 34.8-113.7 -84.4 156.9 22.4 59.4 48.7 460 515 A L + 0 0 2 -49,-0.2 185,-0.3 -2,-0.1 183,-0.1 -0.796 43.6 153.6 -90.8 126.2 19.2 57.4 48.1 461 516 A G - 0 0 3 -2,-0.5 2,-0.2 181,-0.4 181,-0.2 0.360 48.2 -80.8-108.6-111.3 18.0 56.8 44.5 462 517 A S S S+ 0 0 2 179,-1.9 -1,-0.3 178,-0.1 3,-0.1 -0.607 75.5 108.0-138.2-157.3 16.0 53.8 43.7 463 518 A G S S+ 0 0 18 1,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.662 82.0 64.2 91.5 9.1 16.4 50.1 43.0 464 519 A N S > S- 0 0 9 -3,-0.1 3,-2.0 -92,-0.1 -1,-0.3 -0.977 95.8 -90.4-159.3 172.7 15.0 48.9 46.4 465 520 A D T 3 S+ 0 0 0 1,-0.3 4,-0.5 -2,-0.3 3,-0.4 0.571 111.2 72.0 -71.9 -8.3 11.8 48.9 48.4 466 521 A F T 3> S+ 0 0 0 1,-0.2 4,-2.6 2,-0.1 5,-0.3 0.626 76.2 90.5 -71.1 -13.3 12.5 52.2 50.2 467 522 A E H <>>S+ 0 0 3 -3,-2.0 4,-2.1 1,-0.2 5,-0.9 0.909 85.3 43.6 -56.4 -46.8 11.7 54.0 46.9 468 523 A V H >>S+ 0 0 1 -3,-0.4 5,-2.0 1,-0.2 4,-0.7 0.900 115.7 49.7 -68.5 -38.5 8.0 54.6 47.3 469 524 A F H 45S+ 0 0 0 -4,-0.5 6,-3.0 3,-0.2 -1,-0.2 0.908 124.5 26.5 -65.1 -43.0 8.4 55.7 51.0 470 525 A F H X5S+ 0 0 1 -4,-2.6 4,-0.8 4,-0.2 -2,-0.2 0.949 128.3 35.3 -88.6 -52.3 11.1 58.2 50.3 471 526 A Q H <5S+ 0 0 0 -4,-2.1 159,-3.0 -5,-0.3 160,-0.8 0.791 131.0 28.0 -79.0 -30.2 10.8 59.4 46.7 472 527 A R T <> 0 0 87 0, 0.0 3,-1.7 0, 0.0 4,-0.8 0.000 360.0 360.0 360.0 12.3 31.9 48.2 40.9 488 545 A K T 34 + 0 0 87 1,-0.3 3,-0.2 2,-0.2 4,-0.1 0.809 360.0 31.5 -49.9 -39.0 29.5 49.9 43.4 489 546 A F T 34 S+ 0 0 56 1,-0.1 -1,-0.3 2,-0.1 -338,-0.2 0.344 104.1 77.3-102.7 6.0 26.5 49.5 41.1 490 547 A S T <4 S- 0 0 4 -3,-1.7 -2,-0.2 -339,-0.1 -1,-0.1 0.760 91.7-124.2 -93.6 -20.6 27.4 46.3 39.3 491 548 A G < - 0 0 16 -4,-0.8 -1,-0.1 -3,-0.2 -2,-0.1 -0.033 35.1 -66.2 90.9 155.4 26.6 43.6 41.9 492 549 A Y > - 0 0 10 1,-0.1 3,-1.7 -4,-0.1 -89,-0.1 -0.218 63.4 -93.2 -67.4 163.6 28.8 40.9 43.5 493 550 A P T 3 S+ 0 0 16 0, 0.0 -301,-0.1 0, 0.0 -1,-0.1 0.850 122.7 43.1 -56.8 -37.4 29.9 38.3 41.0 494 551 A L T > S+ 0 0 0 -303,-0.3 3,-2.1 5,-0.1 6,-0.3 0.271 80.5 150.5 -94.5 14.4 27.1 35.6 41.6 495 552 A Y T < S- 0 0 36 -3,-1.7 3,-0.1 1,-0.3 -295,-0.1 -0.185 74.8 -7.5 -48.5 121.3 24.3 38.3 41.7 496 553 A H T 3 S+ 0 0 5 1,-0.2 -296,-1.6 -297,-0.2 -1,-0.3 0.658 106.0 124.5 66.6 20.0 20.9 36.9 40.4 497 554 A S S X S- 0 0 3 -3,-2.1 3,-1.6 -298,-0.2 -169,-0.2 -0.668 78.2-110.6-103.8 162.4 22.5 33.6 39.3 498 555 A V T 3 S+ 0 0 1 1,-0.2 -170,-0.1 -2,-0.2 -1,-0.1 0.711 114.0 70.1 -61.5 -15.6 21.6 30.0 40.4 499 556 A Y T 3 + 0 0 14 -5,-0.1 2,-1.6 1,-0.1 -1,-0.2 0.560 66.7 101.3 -84.5 -4.1 24.9 29.9 42.3 500 557 A E < + 0 0 5 -3,-1.6 -170,-2.1 -6,-0.3 2,-0.2 -0.609 60.1 142.1 -81.6 88.2 23.8 32.4 44.9 501 558 A T S > S- 0 0 0 -2,-1.6 4,-1.4 -172,-0.2 3,-0.2 -0.697 70.3 -93.9-124.1 173.8 23.1 29.8 47.6 502 559 A Y H > S+ 0 0 24 -479,-0.4 4,-2.6 -2,-0.2 5,-0.3 0.913 122.7 55.3 -52.2 -42.9 23.4 29.2 51.3 503 560 A E H > S+ 0 0 45 1,-0.3 4,-2.5 2,-0.2 5,-0.5 0.859 100.1 59.0 -65.8 -37.4 26.8 27.6 50.7 504 561 A L H >>S+ 0 0 0 -5,-0.2 4,-1.9 -3,-0.2 5,-0.9 0.930 113.4 39.0 -52.2 -49.1 28.1 30.6 49.0 505 562 A V H X>S+ 0 0 0 -4,-1.4 5,-3.0 -3,-0.2 4,-1.1 0.959 118.2 45.0 -68.8 -52.5 27.4 32.6 52.1 506 563 A E H <5S+ 0 0 52 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.820 123.7 35.1 -63.1 -34.5 28.5 30.1 54.8 507 564 A K H <5S+ 0 0 118 -4,-2.5 -1,-0.2 -5,-0.3 -3,-0.2 0.871 133.7 14.6 -88.4 -39.7 31.7 29.1 53.0 508 565 A F H <5S+ 0 0 60 -4,-1.9 -3,-0.2 -5,-0.5 -2,-0.1 0.720 125.9 35.7-116.2 -26.9 33.0 32.3 51.4 509 566 A Y T < < + 0 0 1 -5,-3.0 3,-1.6 -6,-0.1 6,-0.1 -0.460 56.7 168.2-153.9 66.1 30.4 35.1 56.4 511 568 A P T 3 S+ 0 0 65 0, 0.0 -1,-0.1 0, 0.0 -5,-0.1 0.829 87.5 41.4 -59.4 -31.9 31.1 31.7 58.0 512 569 A M T 3 S- 0 0 148 -496,-0.0 -496,-0.1 1,-0.0 -500,-0.1 0.447 102.9-129.7 -92.8 -1.0 30.7 33.0 61.5 513 570 A F <> + 0 0 1 -3,-1.6 4,-1.7 -8,-0.1 -498,-0.1 0.742 68.8 131.0 58.2 27.3 27.7 35.2 60.7 514 571 A K H > + 0 0 59 2,-0.2 4,-1.8 1,-0.2 -1,-0.1 0.805 68.9 49.1 -82.5 -30.2 29.5 38.1 62.5 515 572 A Y H > S+ 0 0 13 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.913 111.5 50.4 -73.6 -45.0 28.9 40.5 59.6 516 573 A H H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.894 110.7 49.8 -51.0 -45.3 25.2 39.6 59.5 517 574 A L H X S+ 0 0 35 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.922 109.0 51.4 -63.6 -41.5 25.1 40.1 63.3 518 575 A T H X S+ 0 0 7 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.930 111.5 47.7 -61.4 -46.9 26.7 43.6 62.9 519 576 A V H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.3 0.892 109.0 53.8 -63.4 -35.9 24.1 44.5 60.2 520 577 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.899 108.6 50.1 -65.1 -38.4 21.3 43.3 62.5 521 578 A Q H X S+ 0 0 33 -4,-2.2 4,-1.8 3,-0.2 -2,-0.2 0.875 113.0 45.9 -65.2 -40.1 22.7 45.6 65.2 522 579 A V H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.976 119.8 38.6 -66.7 -53.7 22.8 48.6 62.9 523 580 A R H X S+ 0 0 5 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.920 122.6 41.7 -64.0 -44.6 19.3 48.1 61.4 524 581 A G H X S+ 0 0 0 -4,-2.6 4,-2.9 -5,-0.3 -1,-0.2 0.886 113.0 54.4 -71.4 -36.5 17.7 47.0 64.6 525 582 A G H X S+ 0 0 0 -4,-1.8 4,-2.5 -5,-0.3 5,-0.2 0.886 109.3 48.8 -60.4 -45.3 19.5 49.7 66.6 526 583 A M H X S+ 0 0 3 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.948 112.6 46.7 -62.5 -47.5 18.1 52.4 64.2 527 584 A V H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.924 111.3 52.2 -59.7 -46.2 14.6 51.0 64.5 528 585 A F H X S+ 0 0 10 -4,-2.9 4,-1.2 2,-0.2 5,-0.2 0.941 113.1 43.4 -58.3 -47.5 14.9 50.8 68.2 529 586 A E H >X S+ 0 0 55 -4,-2.5 4,-2.6 1,-0.2 3,-0.6 0.931 115.2 49.1 -66.0 -45.5 16.0 54.5 68.6 530 587 A L H 3< S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.869 117.1 41.6 -60.3 -37.6 13.5 55.8 66.0 531 588 A A H 3< S+ 0 0 0 -4,-2.5 -172,-2.8 -5,-0.2 -173,-0.4 0.624 127.2 29.2 -85.1 -12.0 10.7 53.9 67.8 532 589 A N H << S+ 0 0 30 -4,-1.2 -3,-0.2 -3,-0.6 -2,-0.2 0.691 83.2 107.1-124.7 -22.6 11.7 54.7 71.4 533 590 A S < - 0 0 32 -4,-2.6 -174,-0.0 -5,-0.2 3,-0.0 -0.281 63.1-138.1 -62.6 139.2 13.6 58.0 71.7 534 591 A I S S+ 0 0 91 1,-0.1 2,-0.5 2,-0.1 -1,-0.1 0.966 97.0 39.0 -67.6 -50.4 11.5 60.7 73.3 535 592 A V S S- 0 0 38 1,-0.0 -1,-0.1 71,-0.0 -3,-0.1 -0.859 109.1-103.4 -91.1 134.7 12.6 63.3 70.8 536 593 A L - 0 0 6 -2,-0.5 2,-2.2 1,-0.1 -6,-0.1 -0.289 31.6-120.7 -56.2 137.3 12.9 61.9 67.3 537 594 A P + 0 0 26 0, 0.0 2,-0.4 0, 0.0 -119,-0.4 -0.239 69.8 124.2 -85.4 56.3 16.5 61.3 66.5 538 595 A F - 0 0 10 -2,-2.2 2,-0.6 -121,-0.1 -123,-0.2 -0.923 47.2-154.4-111.5 139.9 16.7 63.6 63.5 539 596 A D >> - 0 0 28 -125,-1.2 3,-1.5 -2,-0.4 4,-0.7 -0.873 5.5-170.6-116.6 99.4 19.1 66.5 63.1 540 597 A C H 3> S+ 0 0 2 -2,-0.6 4,-1.6 1,-0.2 3,-0.4 0.761 81.6 69.0 -59.1 -24.7 17.8 69.2 60.7 541 598 A R H 3> S+ 0 0 111 1,-0.2 4,-1.8 45,-0.2 -1,-0.2 0.818 91.7 60.7 -63.6 -26.9 21.2 71.0 60.7 542 599 A D H <> S+ 0 0 38 -3,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.871 101.2 53.4 -69.0 -32.6 22.7 68.1 58.8 543 600 A Y H X S+ 0 0 0 -4,-0.7 4,-2.6 -3,-0.4 5,-0.2 0.931 105.8 54.8 -65.2 -41.8 20.2 68.8 55.9 544 601 A A H X S+ 0 0 4 -4,-1.6 4,-1.5 1,-0.2 -2,-0.2 0.926 106.5 50.5 -56.6 -43.7 21.4 72.4 55.9 545 602 A V H X S+ 0 0 81 -4,-1.8 4,-1.7 1,-0.2 3,-0.2 0.950 113.4 44.0 -58.4 -49.2 25.0 71.3 55.4 546 603 A V H X S+ 0 0 6 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.878 106.3 60.2 -69.9 -34.6 24.2 69.0 52.5 547 604 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.883 105.6 49.5 -59.0 -37.6 21.9 71.5 50.8 548 605 A R H X S+ 0 0 138 -4,-1.5 4,-2.7 -3,-0.2 -1,-0.2 0.924 110.5 49.8 -67.0 -42.2 24.7 74.0 50.5 549 606 A K H X S+ 0 0 62 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.923 112.7 46.4 -58.8 -46.4 27.0 71.3 49.0 550 607 A Y H X S+ 0 0 6 -4,-2.7 4,-2.2 2,-0.2 5,-0.2 0.861 111.4 52.5 -67.7 -35.1 24.3 70.3 46.4 551 608 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 5,-0.2 0.940 109.8 48.3 -65.2 -46.1 23.7 74.0 45.6 552 609 A D H X S+ 0 0 66 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.906 112.6 50.4 -54.2 -43.1 27.4 74.6 45.0 553 610 A K H X S+ 0 0 89 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.930 111.4 44.2 -68.4 -44.3 27.6 71.5 42.8 554 611 A I H X S+ 0 0 6 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.912 112.5 54.0 -68.8 -39.7 24.6 72.3 40.6 555 612 A Y H X S+ 0 0 86 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.930 106.8 53.0 -54.1 -44.8 25.9 76.0 40.3 556 613 A S H < S+ 0 0 70 -4,-2.1 4,-0.3 1,-0.2 -1,-0.2 0.835 107.2 50.7 -62.3 -38.0 29.2 74.6 39.1 557 614 A I H >< S+ 0 0 33 -4,-1.6 3,-1.1 1,-0.2 -1,-0.2 0.905 111.5 47.6 -63.8 -40.6 27.6 72.5 36.4 558 615 A S H >< S+ 0 0 0 -4,-2.1 3,-2.1 1,-0.2 -2,-0.2 0.914 101.4 66.6 -69.2 -38.0 25.7 75.5 35.1 559 616 A M T 3< S+ 0 0 78 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.470 78.5 78.4 -67.9 -4.6 28.8 77.6 35.2 560 617 A K T < S+ 0 0 145 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.1 0.505 97.7 50.4 -67.9 -8.7 30.4 75.5 32.4 561 618 A H <> + 0 0 23 -3,-2.1 4,-2.1 1,-0.1 3,-0.3 -0.466 66.9 154.0-127.2 55.6 28.0 77.7 30.2 562 619 A P H > S+ 0 0 55 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.864 71.1 55.4 -62.0 -34.9 28.8 81.3 31.3 563 620 A Q H > S+ 0 0 109 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.908 109.9 45.8 -64.8 -40.6 27.8 82.9 28.0 564 621 A E H > S+ 0 0 69 -3,-0.3 4,-2.9 1,-0.2 -1,-0.2 0.879 108.7 55.4 -68.2 -35.0 24.4 81.3 28.2 565 622 A M H X>S+ 0 0 19 -4,-2.1 5,-1.9 2,-0.2 4,-0.5 0.848 112.0 45.1 -66.2 -31.8 23.9 82.3 31.8 566 623 A K H ><5S+ 0 0 141 -4,-1.7 3,-0.8 -5,-0.2 -2,-0.2 0.955 114.4 47.6 -72.1 -48.6 24.6 85.9 30.8 567 624 A T H 3<5S+ 0 0 82 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.908 122.3 33.5 -58.3 -47.3 22.3 85.8 27.7 568 625 A Y H 3<5S- 0 0 52 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.397 105.0-122.0 -97.1 7.3 19.4 84.2 29.5 569 626 A S T <<5 - 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0 0 103 -3,-1.9 6,-0.0 -4,-0.2 -4,-0.0 -0.492 62.4-143.1 -75.1 138.6 19.3 71.4 22.5 661 719 A V S S+ 0 0 148 1,-0.2 -1,-0.1 -2,-0.2 -3,-0.0 0.811 93.8 47.1 -74.5 -29.1 18.0 73.0 19.3 662 720 A D > + 0 0 85 1,-0.2 4,-2.2 2,-0.0 3,-0.4 -0.794 64.5 176.9-113.6 87.7 16.1 75.8 21.1 663 721 A P H > S+ 0 0 55 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.819 78.7 58.6 -61.2 -33.2 18.5 77.2 23.7 664 722 A S H > S+ 0 0 66 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.913 110.7 41.6 -60.1 -47.3 16.1 79.9 24.8 665 723 A K H > S+ 0 0 162 -3,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.869 114.5 52.0 -66.7 -41.3 13.5 77.3 25.7 666 724 A A H X S+ 0 0 11 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.912 112.7 43.9 -65.9 -42.8 16.1 75.0 27.3 667 725 A W H X S+ 0 0 5 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.820 107.7 59.8 -74.6 -28.0 17.5 77.7 29.6 668 726 A G H X S+ 0 0 33 -4,-1.5 4,-2.1 -5,-0.3 -1,-0.2 0.877 106.0 49.4 -59.9 -41.5 14.0 78.9 30.4 669 727 A E H X S+ 0 0 64 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.865 106.6 54.0 -74.1 -32.7 13.4 75.4 31.8 670 728 A V H X S+ 0 0 0 -4,-1.5 4,-2.2 -17,-0.2 -2,-0.2 0.951 110.3 48.2 -60.1 -47.6 16.7 75.5 33.9 671 729 A K H X S+ 0 0 79 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.897 108.6 53.5 -63.2 -40.0 15.4 78.8 35.4 672 730 A R H X S+ 0 0 118 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.922 109.9 47.9 -55.5 -45.2 12.0 77.2 36.1 673 731 A Q H X S+ 0 0 10 -4,-2.3 4,-2.5 1,-0.2 -23,-0.2 0.849 107.7 54.8 -69.8 -31.2 13.7 74.4 38.0 674 732 A I H X S+ 0 0 3 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.932 109.9 48.1 -63.8 -44.7 15.9 76.8 40.0 675 733 A Y H X S+ 0 0 164 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.917 111.4 48.9 -60.1 -44.4 12.7 78.6 41.1 676 734 A V H X S+ 0 0 23 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.941 113.9 46.9 -62.7 -42.9 11.0 75.3 42.1 677 735 A A H X S+ 0 0 2 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.927 114.3 46.2 -63.5 -45.2 14.1 74.2 44.0 678 736 A A H X S+ 0 0 8 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.929 113.4 49.5 -65.1 -43.2 14.4 77.6 45.8 679 737 A F H X S+ 0 0 133 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.921 112.1 47.4 -59.6 -44.5 10.7 77.7 46.7 680 738 A T H X S+ 0 0 6 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.900 111.4 50.4 -72.1 -36.3 10.7 74.2 48.1 681 739 A V H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.938 113.4 46.3 -63.3 -47.3 13.8 74.7 50.2 682 740 A Q H X S+ 0 0 45 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.900 112.3 50.1 -61.0 -40.5 12.3 77.9 51.6 683 741 A A H X S+ 0 0 30 -4,-2.5 4,-0.9 -5,-0.2 -2,-0.2 0.919 110.5 49.4 -67.5 -37.3 9.0 76.2 52.3 684 742 A A H >< S+ 0 0 0 -4,-2.5 3,-1.1 1,-0.2 4,-0.4 0.940 109.8 52.5 -65.2 -44.7 10.7 73.3 54.1 685 743 A A H >< S+ 0 0 0 -4,-2.6 3,-2.1 1,-0.2 4,-0.4 0.911 103.8 57.9 -53.3 -48.6 12.6 75.8 56.2 686 744 A E H >< S+ 0 0 111 -4,-2.5 3,-0.8 1,-0.3 -1,-0.2 0.746 93.0 65.8 -59.3 -20.3 9.4 77.5 57.1 687 745 A T T << S+ 0 0 53 -3,-1.1 -1,-0.3 -4,-0.9 -2,-0.2 0.707 101.6 51.2 -74.3 -13.0 8.0 74.3 58.6 688 746 A L T < S+ 0 0 0 -3,-2.1 -1,-0.2 -4,-0.4 -2,-0.2 0.442 89.9 100.2 -99.9 -11.4 10.8 74.6 61.3 689 747 A S S < S- 0 0 39 -3,-0.8 -104,-0.0 -4,-0.4 -3,-0.0 -0.280 98.3 -72.3 -59.8 163.3 9.9 78.3 62.1 690 748 A E - 0 0 136 1,-0.1 -1,-0.1 2,-0.1 -2,-0.1 -0.375 48.0-128.3 -58.0 141.4 7.8 78.9 65.3 691 749 A V 0 0 98 1,-0.2 -1,-0.1 -3,-0.1 -2,-0.1 0.666 360.0 360.0 -74.8 -21.6 4.3 77.7 64.4 692 750 A A 0 0 144 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.189 360.0 360.0-172.3 360.0 2.4 80.8 65.5