==== 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 15-JUN-03 1POJ . COMPND 2 MOLECULE: ISOASPARTYL DIPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR D.JOZIC,J.T.KAISER,R.HUBER,W.BODE,K.MASKOS . 776 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31645.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 549 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 86 11.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 86 11.1 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 . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 6 0.8 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 . 70 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 151 19.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 4 2 2 2 0 2 2 2 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 10 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 PARALLEL BRIDGES PER LADDER . 8 2 2 4 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 2 0 0 2 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 M 0 0 221 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -18.7 63.7 25.9 86.6 2 2 A I - 0 0 114 1,-0.1 2,-0.5 2,-0.0 0, 0.0 0.616 360.0-126.9 71.8 136.8 65.8 28.7 88.2 3 3 A D + 0 0 114 1,-0.1 3,-0.1 45,-0.0 -1,-0.1 -0.960 27.5 169.4-121.7 127.4 69.4 28.5 89.6 4 4 A Y > + 0 0 101 -2,-0.5 3,-0.6 1,-0.1 4,-0.4 -0.007 42.1 118.2-121.1 27.5 70.5 29.6 93.1 5 5 A T G > + 0 0 86 1,-0.2 3,-2.1 2,-0.2 -1,-0.1 0.868 62.7 66.6 -63.8 -41.5 74.0 28.1 93.2 6 6 A A G 3 S+ 0 0 98 1,-0.3 -1,-0.2 -3,-0.1 26,-0.1 0.841 93.8 62.8 -51.1 -33.8 76.0 31.3 93.5 7 7 A A G < S- 0 0 22 -3,-0.6 25,-2.3 24,-0.1 -1,-0.3 0.825 91.6-155.0 -62.6 -29.4 74.4 31.7 96.9 8 8 A G < - 0 0 42 -3,-2.1 25,-0.3 -4,-0.4 -3,-0.1 0.930 14.7-158.1 53.9 53.7 76.1 28.5 98.0 9 9 A F - 0 0 35 -5,-0.4 42,-1.2 39,-0.2 2,-0.3 -0.306 12.9-173.9 -65.7 144.5 73.6 27.6 100.7 10 10 A T E -Ab 30 51A 24 20,-2.5 20,-3.5 40,-0.2 2,-0.8 -0.931 14.7-164.3-147.6 119.5 74.6 25.3 103.6 11 11 A L E -Ab 29 52A 0 40,-2.8 42,-2.4 -2,-0.3 2,-0.9 -0.867 8.1-173.0-104.8 101.8 72.5 23.8 106.4 12 12 A L E +Ab 28 53A 2 16,-2.4 16,-1.6 -2,-0.8 3,-0.2 -0.828 25.0 178.0 -96.0 102.0 74.8 22.4 109.1 13 13 A Q E + b 0 54A 56 40,-1.4 42,-1.1 -2,-0.9 14,-0.1 -0.633 37.1 19.6-116.3 167.4 72.4 20.6 111.5 14 14 A G E S+ 0 0 19 -2,-0.2 43,-1.1 1,-0.2 2,-0.3 0.669 78.8 136.2 61.0 23.8 72.0 18.5 114.6 15 15 A A E -A 26 0A 1 11,-0.6 11,-1.9 -3,-0.2 2,-1.1 -0.689 64.4-111.5-101.5 153.5 75.4 19.4 116.1 16 16 A H E -Ac 25 59A 59 42,-2.1 44,-1.8 -2,-0.3 9,-0.2 -0.741 44.6-145.9 -83.4 105.3 76.2 20.3 119.7 17 17 A L E + c 0 60A 0 7,-1.9 6,-2.4 -2,-1.1 2,-0.4 -0.530 27.6 178.7 -80.6 137.2 77.1 24.0 119.2 18 18 A Y E -A 22 0A 17 42,-1.9 3,-0.3 -2,-0.2 4,-0.2 -0.937 1.0-179.5-132.3 103.1 79.8 25.8 121.3 19 19 A A S S- 0 0 6 2,-2.6 329,-2.1 -2,-0.4 3,-0.1 0.347 86.1 -79.2 -92.6 9.5 79.9 29.3 119.9 20 20 A P S S+ 0 0 0 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.986 133.3 83.4 -66.2 -26.9 82.0 29.2 122.2 21 21 A E S S- 0 0 87 -3,-0.3 -2,-2.6 1,-0.2 2,-0.8 -0.158 100.3-103.9 -45.6 137.9 79.1 29.5 124.6 22 22 A D E +A 18 0A 97 -4,-0.2 -4,-0.2 1,-0.2 -1,-0.2 -0.582 48.8 172.8 -66.7 108.4 77.5 26.2 125.1 23 23 A R E - 0 0 116 -6,-2.4 -1,-0.2 -2,-0.8 -5,-0.2 0.108 34.0-132.6-107.0 19.9 74.4 26.7 122.9 24 24 A G E - 0 0 25 -7,-0.4 -7,-1.9 -8,-0.1 2,-0.5 0.017 57.2 -24.0 58.4-170.1 73.1 23.1 123.2 25 25 A I E S+A 16 0A 110 -9,-0.2 2,-0.3 -3,-0.1 -9,-0.2 -0.613 87.4 130.3 -75.7 120.9 72.1 21.1 120.1 26 26 A C E -A 15 0A 6 -11,-1.9 -11,-0.6 -2,-0.5 14,-0.3 -0.981 47.7-104.0-162.5 164.6 71.1 23.5 117.3 27 27 A D E - D 0 39A 5 12,-2.1 12,-0.8 -2,-0.3 2,-0.3 -0.377 14.8-149.4 -94.1 174.0 71.6 24.3 113.6 28 28 A V E -AD 12 38A 0 -16,-1.6 -16,-2.4 10,-0.2 2,-0.5 -0.947 7.3-153.9-143.8 115.8 73.6 26.9 111.6 29 29 A L E -AD 11 37A 8 8,-2.8 7,-2.7 -2,-0.3 8,-1.1 -0.818 15.1-167.0 -94.9 126.5 72.5 28.1 108.2 30 30 A V E +AD 10 35A 6 -20,-3.5 -20,-2.5 -2,-0.5 2,-0.3 -0.947 14.1 163.9-118.4 129.4 75.4 29.4 106.0 31 31 A A E > + D 0 34A 6 3,-2.5 3,-1.8 -2,-0.5 -23,-0.2 -0.998 67.8 3.0-142.8 139.7 75.1 31.4 102.8 32 32 A N T 3 S- 0 0 118 -25,-2.3 -24,-0.1 -2,-0.3 3,-0.1 0.826 128.3 -61.0 55.0 35.8 77.7 33.4 100.9 33 33 A G T 3 S+ 0 0 13 -25,-0.3 321,-1.6 1,-0.2 2,-0.3 0.702 117.5 110.8 66.2 19.4 80.3 32.4 103.4 34 34 A K E < S-DE 31 353A 97 -3,-1.8 -3,-2.5 319,-0.2 2,-0.7 -0.935 75.7-118.3-127.0 150.1 78.4 34.0 106.2 35 35 A I E +D 30 0A 1 317,-2.7 316,-3.1 -2,-0.3 -5,-0.2 -0.769 37.0 170.5 -83.0 115.9 76.4 32.7 109.1 36 36 A I E + 0 0 76 -7,-2.7 2,-0.3 -2,-0.7 -6,-0.2 0.507 59.4 19.6-107.6 -4.1 72.9 33.8 108.4 37 37 A A E -D 29 0A 29 -8,-1.1 -8,-2.8 312,-0.1 2,-0.4 -0.865 48.6-178.2-168.9 130.9 71.0 31.9 111.0 38 38 A V E +D 28 0A 21 -2,-0.3 2,-0.3 -10,-0.2 -10,-0.2 -0.915 39.6 103.9-134.9 109.4 71.5 30.1 114.3 39 39 A A E S-D 27 0A 51 -12,-0.8 -12,-2.1 -2,-0.4 2,-0.5 -0.905 70.1 -80.6-163.1 179.1 68.6 28.3 116.1 40 40 A S S S+ 0 0 62 -14,-0.3 -14,-0.1 -2,-0.3 -2,-0.0 -0.870 102.8 14.6-104.7 126.4 67.5 24.8 116.5 41 41 A N - 0 0 129 -2,-0.5 -1,-0.2 1,-0.2 -28,-0.0 0.883 67.9-174.7 86.8 46.5 65.5 23.0 113.8 42 42 A I - 0 0 22 -3,-0.4 -1,-0.2 1,-0.1 -14,-0.1 -0.598 41.1-100.5 -71.1 124.0 66.0 25.2 110.8 43 43 A P > - 0 0 69 0, 0.0 3,-2.8 0, 0.0 4,-0.3 -0.243 21.1-135.1 -52.2 122.3 63.8 23.7 108.1 44 44 A S T 3 S+ 0 0 75 1,-0.3 3,-0.2 2,-0.1 6,-0.1 0.652 106.8 41.8 -51.0 -17.7 65.8 21.6 105.6 45 45 A D T 3 S+ 0 0 134 1,-0.1 -1,-0.3 4,-0.1 4,-0.0 0.237 73.5 115.8-118.2 12.7 63.9 23.2 102.8 46 46 A I S < S+ 0 0 94 -3,-2.8 -2,-0.1 1,-0.1 -1,-0.1 0.785 86.8 22.8 -52.9 -28.3 63.8 26.8 104.0 47 47 A V S > S- 0 0 31 -4,-0.3 3,-0.8 -3,-0.2 -1,-0.1 -0.969 88.5-100.1-140.1 154.6 66.0 27.8 101.0 48 48 A P T 3 S+ 0 0 52 0, 0.0 -39,-0.2 0, 0.0 3,-0.1 -0.240 96.4 10.0 -73.1 160.7 66.7 26.4 97.5 49 49 A N T 3 S+ 0 0 84 1,-0.2 -40,-0.2 -41,-0.1 2,-0.2 0.729 87.9 164.3 44.1 28.9 69.7 24.4 96.4 50 50 A C < - 0 0 27 -3,-0.8 2,-0.6 -6,-0.1 -40,-0.2 -0.479 32.8-140.2 -75.8 145.8 70.7 24.1 100.0 51 51 A T E -b 10 0A 85 -42,-1.2 -40,-2.8 -2,-0.2 2,-0.5 -0.928 15.5-156.2-110.1 118.2 73.3 21.6 101.1 52 52 A V E -b 11 0A 58 -2,-0.6 2,-0.6 -42,-0.2 -40,-0.2 -0.808 4.3-160.5 -99.8 134.1 72.6 19.8 104.3 53 53 A V E -b 12 0A 27 -42,-2.4 2,-2.1 -2,-0.5 -40,-1.4 -0.943 16.3-140.2-112.9 114.7 75.3 18.2 106.4 54 54 A D E +b 13 0A 126 -2,-0.6 -40,-0.1 1,-0.2 -42,-0.1 -0.510 37.0 160.1 -74.9 81.8 74.1 15.6 108.9 55 55 A L > + 0 0 3 -2,-2.1 3,-2.6 -42,-1.1 -39,-0.2 0.292 17.6 146.1 -87.6 10.2 76.4 16.6 111.7 56 56 A S T 3 + 0 0 78 1,-0.3 -41,-0.2 -41,-0.1 -42,-0.1 -0.252 69.2 20.9 -51.3 121.7 74.2 14.8 114.2 57 57 A G T 3 S+ 0 0 53 -43,-1.1 -1,-0.3 1,-0.4 2,-0.1 0.102 106.9 94.7 106.3 -23.6 76.5 13.5 117.0 58 58 A Q S < S- 0 0 61 -3,-2.6 -42,-2.1 -44,-0.1 -1,-0.4 -0.426 72.5-115.8 -95.1 173.6 79.5 15.7 116.3 59 59 A I E -cF 16 359A 14 300,-3.2 300,-2.3 -44,-0.2 2,-0.4 -0.870 21.1-157.2-111.6 145.5 80.5 19.1 117.9 60 60 A L E +cF 17 358A 1 -44,-1.8 -42,-1.9 -2,-0.4 298,-0.2 -0.974 23.2 150.4-124.3 134.5 80.6 22.4 116.1 61 61 A C E - F 0 357A 0 296,-1.9 296,-2.3 -2,-0.4 -42,-0.2 -0.976 47.1 -70.6-154.9 167.2 82.7 25.4 117.2 62 62 A P E - F 0 356A 4 0, 0.0 294,-0.2 0, 0.0 292,-0.1 -0.264 52.3-107.4 -63.7 147.4 84.6 28.4 115.8 63 63 A G - 0 0 3 292,-1.8 2,-0.2 306,-0.1 34,-0.2 -0.122 45.0 -89.6 -64.4 170.9 87.8 28.0 113.8 64 64 A F E -j 97 0B 1 32,-3.0 35,-2.3 292,-0.1 34,-2.3 -0.547 23.3-149.2 -88.2 151.1 91.1 28.9 115.5 65 65 A I E -j 99 0B 2 267,-2.5 2,-0.9 -2,-0.2 35,-0.2 -0.955 13.0-168.4-118.9 106.9 92.8 32.3 115.4 66 66 A D E -j 100 0B 0 33,-2.8 35,-2.6 -2,-0.6 3,-0.2 -0.861 4.9-175.7 -99.1 104.1 96.6 31.8 115.5 67 67 A Q E + 0 0 2 -2,-0.9 -1,-0.1 215,-0.3 216,-0.1 -0.129 69.5 55.0 -93.2 39.6 98.1 35.2 116.1 68 68 A H E + 0 0 0 -2,-0.2 217,-1.8 35,-0.0 218,-0.8 -0.302 64.2 135.8-168.5 74.5 101.7 34.1 115.9 69 69 A V E -jk 102 286B 0 32,-1.8 2,-2.0 216,-0.2 34,-1.2 -0.991 49.1-138.0-134.3 132.1 102.8 32.2 112.8 70 70 A H > + 0 0 8 216,-1.3 3,-3.1 -2,-0.4 17,-0.1 -0.337 30.9 179.1 -79.7 56.1 106.0 32.7 110.7 71 71 A L T 3 S+ 0 0 0 -2,-2.0 16,-1.9 1,-0.3 -1,-0.2 0.677 77.5 35.5 -30.0 -42.4 104.1 32.3 107.5 72 72 A I T 3 S- 0 0 14 1,-0.4 -1,-0.3 31,-0.3 2,-0.2 0.559 124.3 -89.8 -96.5 -8.1 107.1 32.8 105.2 73 73 A G < - 0 0 1 -3,-3.1 -1,-0.4 213,-0.1 2,-0.2 -0.559 41.8-161.7 124.0 170.0 109.6 31.0 107.5 74 74 A G + 0 0 5 10,-0.4 10,-1.0 213,-0.3 214,-0.1 -0.732 39.5 88.7-159.8-151.8 112.0 31.7 110.3 75 75 A G B +P 83 0C 4 8,-0.2 32,-0.5 -2,-0.2 8,-0.2 -0.333 21.3 147.0 75.5-161.2 114.9 30.4 112.2 76 76 A G > + 0 0 24 6,-1.3 3,-1.3 30,-0.1 7,-0.2 0.227 34.8 121.9 112.0 -10.5 118.5 31.2 111.0 77 77 A E T 3 S+ 0 0 46 5,-0.3 222,-0.1 1,-0.3 6,-0.1 0.716 80.6 40.3 -55.9 -25.8 120.0 31.3 114.5 78 78 A A T 3 S- 0 0 41 1,-0.5 -1,-0.3 4,-0.1 3,-0.3 -0.288 129.2 -66.8-121.7 49.8 122.4 28.6 113.6 79 79 A G S X S- 0 0 35 -3,-1.3 3,-1.2 1,-0.2 -1,-0.5 -0.321 71.2 -59.5 96.9 175.7 123.5 29.6 110.1 80 80 A P G > S+ 0 0 109 0, 0.0 3,-0.9 0, 0.0 -1,-0.2 0.660 125.2 71.8 -71.1 -17.6 121.5 29.7 106.8 81 81 A T G 3 S+ 0 0 135 -3,-0.3 -2,-0.1 1,-0.3 -6,-0.0 0.632 88.8 62.4 -73.8 -13.5 120.8 26.0 107.1 82 82 A T G < + 0 0 26 -3,-1.2 -6,-1.3 -6,-0.1 2,-1.1 -0.077 67.8 124.9-103.6 34.1 118.3 26.6 109.9 83 83 A R B < -P 75 0C 101 -3,-0.9 -8,-0.2 -8,-0.2 -1,-0.0 -0.769 56.7-142.2 -95.3 91.5 115.9 28.8 107.8 84 84 A T - 0 0 11 -2,-1.1 -10,-0.4 -10,-1.0 205,-0.1 -0.113 20.2-114.5 -50.7 147.0 112.6 27.0 108.3 85 85 A P - 0 0 90 0, 0.0 -11,-0.2 0, 0.0 2,-0.2 0.067 36.0 -82.3 -74.1-170.9 110.4 26.9 105.2 86 86 A E - 0 0 113 -13,-0.1 2,-0.2 -14,-0.1 -14,-0.2 -0.499 48.9 -99.4 -90.0 163.8 107.0 28.6 104.7 87 87 A V - 0 0 1 -16,-1.9 2,-0.4 -2,-0.2 -1,-0.1 -0.598 29.4-130.9 -87.1 149.4 103.7 27.2 105.9 88 88 A A > - 0 0 21 -2,-0.2 4,-0.6 1,-0.1 3,-0.2 -0.811 17.9-124.0 -98.5 135.5 101.4 25.3 103.6 89 89 A L H >> S+ 0 0 2 -2,-0.4 4,-1.8 1,-0.2 3,-1.8 0.897 108.8 58.0 -41.2 -49.8 97.7 26.2 103.5 90 90 A S H 3> S+ 0 0 8 1,-0.3 4,-3.0 2,-0.2 5,-0.3 0.918 97.3 54.2 -51.6 -59.0 96.9 22.6 104.4 91 91 A R H 34 S+ 0 0 130 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.2 0.558 111.8 50.9 -60.3 0.1 98.8 22.2 107.6 92 92 A L H X<>S+ 0 0 0 -3,-1.8 5,-2.1 -4,-0.6 3,-1.9 0.871 115.5 34.7 -95.9 -63.1 96.9 25.2 108.9 93 93 A T H ><5S+ 0 0 0 -4,-1.8 3,-2.8 1,-0.3 -2,-0.2 0.922 114.7 59.1 -56.2 -45.0 93.3 24.3 108.1 94 94 A E T 3<5S+ 0 0 83 -4,-3.0 -1,-0.3 1,-0.3 -3,-0.2 0.622 106.5 51.1 -60.6 -10.0 94.1 20.7 108.8 95 95 A A T < 5S- 0 0 17 -3,-1.9 -1,-0.3 -5,-0.3 216,-0.2 0.318 123.7-102.6-109.2 3.1 95.1 22.0 112.3 96 96 A G T < 5S+ 0 0 0 -3,-2.8 -32,-3.0 1,-0.3 2,-0.5 0.474 77.6 136.1 89.0 2.5 91.9 23.9 112.9 97 97 A V E < +j 64 0B 0 -5,-2.1 -1,-0.3 -34,-0.2 -2,-0.2 -0.746 14.4 156.8 -89.4 127.7 93.4 27.3 112.1 98 98 A T E + 0 0 1 -34,-2.3 31,-2.5 -2,-0.5 2,-0.4 0.571 67.9 42.3-118.6 -24.6 91.2 29.5 109.9 99 99 A S E +jl 65 129B 0 -35,-2.3 -33,-2.8 29,-0.2 2,-0.3 -0.989 68.8 176.8-128.1 136.5 92.6 32.9 110.9 100 100 A V E -jl 66 130B 0 29,-2.1 31,-2.2 -2,-0.4 2,-0.5 -1.000 22.7-153.7-146.8 141.4 96.2 33.7 111.3 101 101 A V E - l 0 131B 3 -35,-2.6 -32,-1.8 -2,-0.3 31,-0.3 -0.966 24.3-154.6-113.0 118.1 98.4 36.7 112.0 102 102 A G E +jl 69 132B 0 29,-3.2 31,-2.3 -2,-0.5 2,-0.3 -0.666 16.7 170.5 -98.3 152.2 101.9 36.3 110.7 103 103 A L - 0 0 0 -34,-1.2 -31,-0.3 -2,-0.3 2,-0.2 -0.874 27.1-118.4-144.7 174.6 105.2 37.9 111.8 104 104 A L - 0 0 3 31,-0.6 2,-0.1 -2,-0.3 4,-0.1 -0.504 28.1-163.1-106.2-176.5 109.0 37.8 111.3 105 105 A G - 0 0 8 2,-0.6 32,-1.6 -2,-0.2 33,-0.4 -0.235 52.0 -25.6-136.0-134.2 111.6 37.0 113.8 106 106 A T S S+ 0 0 35 30,-0.2 2,-0.5 31,-0.1 32,-0.2 0.952 115.3 72.4 -52.6 -55.2 115.3 37.2 114.5 107 107 A D + 0 0 26 -32,-0.5 -2,-0.6 1,-0.2 -1,-0.1 -0.523 41.9 147.7 -73.5 113.4 116.2 37.3 110.8 108 108 A S + 0 0 13 -2,-0.5 -1,-0.2 -4,-0.1 -2,-0.1 0.138 68.4 67.0-126.7 10.2 115.3 40.6 109.1 109 109 A I S S+ 0 0 121 3,-0.1 -2,-0.1 1,-0.0 3,-0.0 0.819 113.9 23.7 -97.9 -45.6 118.2 40.5 106.7 110 110 A S S S+ 0 0 52 1,-0.1 2,-0.3 2,-0.0 -2,-0.1 0.020 122.6 60.6-110.0 25.4 117.2 37.5 104.6 111 111 A R - 0 0 26 -6,-0.1 -1,-0.1 -7,-0.0 -7,-0.0 -0.925 68.3-169.0-149.9 119.2 113.5 37.8 105.4 112 112 A H >> - 0 0 89 -2,-0.3 3,-1.4 1,-0.1 4,-0.6 -0.872 30.8-128.2-116.6 149.6 111.5 41.0 104.4 113 113 A P H >> S+ 0 0 8 0, 0.0 4,-2.4 0, 0.0 3,-0.8 0.804 105.8 69.3 -63.2 -23.5 108.1 42.1 105.4 114 114 A E H 3> S+ 0 0 103 1,-0.3 4,-0.7 2,-0.2 30,-0.0 0.786 102.1 43.6 -63.8 -28.5 107.3 42.7 101.7 115 115 A S H <> S+ 0 0 59 -3,-1.4 4,-1.3 2,-0.2 -1,-0.3 0.502 110.5 55.6 -94.9 -4.9 107.4 38.9 101.1 116 116 A L H < S+ 0 0 29 -4,-0.9 3,-2.3 -5,-0.2 -1,-0.2 0.970 107.8 47.9 -73.9 -58.5 93.7 34.9 101.8 125 125 A E H 3< S+ 0 0 184 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.1 0.892 109.5 54.5 -46.7 -48.4 93.1 34.1 98.1 126 126 A E T 3< S- 0 0 49 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.543 128.4 -84.5 -69.2 -7.2 93.4 30.4 98.8 127 127 A G S < S+ 0 0 10 -3,-2.3 -3,-0.1 1,-0.4 246,-0.1 -0.350 93.6 80.7 144.5 -69.8 90.8 30.4 101.5 128 128 A I S S- 0 0 0 -5,-0.4 2,-0.4 1,-0.1 -1,-0.4 0.114 75.1-104.1 -65.2-173.8 91.6 31.3 105.1 129 129 A S E -l 99 0B 10 -31,-2.5 -29,-2.1 -3,-0.1 2,-0.3 -0.972 38.9-176.5-119.8 129.1 92.0 34.8 106.5 130 130 A A E +l 100 0B 0 -2,-0.4 2,-0.3 -10,-0.2 -29,-0.2 -0.936 13.5 174.8-131.5 152.0 95.4 36.3 107.2 131 131 A W E -l 101 0B 34 -31,-2.2 -29,-3.2 -2,-0.3 2,-0.3 -0.902 17.1-146.8-141.7 164.4 96.9 39.4 108.7 132 132 A M E -lm 102 158B 0 25,-3.3 27,-2.0 -2,-0.3 28,-0.6 -0.915 10.6-128.7-138.3 164.7 100.5 40.4 109.5 133 133 A L E - m 0 160B 2 -31,-2.3 28,-0.3 -2,-0.3 -29,-0.2 -0.923 30.5-124.0-111.3 137.0 102.7 42.4 111.9 134 134 A T E S+ m 0 161B 0 26,-2.8 28,-2.2 -2,-0.4 9,-0.1 -0.463 71.1 4.9 -81.0 153.0 105.2 44.9 110.6 135 135 A G S S- 0 0 1 7,-0.6 -31,-0.6 26,-0.2 2,-0.2 -0.304 72.1-130.7 75.2-161.5 108.9 44.7 111.5 136 136 A A - 0 0 1 2,-0.6 28,-0.2 26,-0.4 -30,-0.2 -0.766 53.2 -39.9-162.4-153.8 110.5 41.9 113.6 137 137 A Y S S+ 0 0 13 -32,-1.6 27,-1.4 26,-0.2 34,-0.4 0.895 107.2 93.2 -52.5 -45.5 112.8 41.4 116.6 138 138 A H S S- 0 0 55 -33,-0.4 -2,-0.6 -32,-0.2 4,-0.4 -0.291 71.4-135.6 -59.7 129.8 115.0 44.4 115.5 139 139 A V S S+ 0 0 6 2,-0.2 2,-0.2 25,-0.1 39,-0.1 -0.999 92.3 55.4-131.1 130.0 114.3 47.8 116.9 140 140 A P S S- 0 0 83 0, 0.0 38,-0.1 0, 0.0 2,-0.1 0.399 111.5-115.6 -56.1 142.3 114.2 50.3 115.3 141 141 A S - 0 0 20 -2,-0.2 2,-1.0 1,-0.1 -2,-0.2 -0.296 12.9-132.3 -63.9 136.2 111.7 48.4 113.3 142 142 A R - 0 0 93 -4,-0.4 -7,-0.6 -2,-0.1 -1,-0.1 -0.798 41.4-179.5 -92.6 102.7 112.4 47.5 109.7 143 143 A T - 0 0 29 -2,-1.0 -29,-0.2 -9,-0.1 5,-0.1 0.026 39.3-118.8 -90.6-167.0 109.2 48.4 107.9 144 144 A I S S+ 0 0 36 3,-0.2 4,-0.1 -31,-0.1 -1,-0.1 0.756 111.9 23.6-104.7 -38.9 107.7 48.5 104.4 145 145 A T S S- 0 0 52 2,-0.3 3,-0.1 3,-0.0 5,-0.0 0.532 115.2-100.5-104.1 -12.2 107.1 52.2 103.9 146 146 A G S S+ 0 0 65 1,-0.1 2,-0.4 -5,-0.0 3,-0.1 0.385 97.8 77.9 107.1 -1.6 109.8 53.4 106.4 147 147 A S > - 0 0 33 1,-0.2 4,-3.4 -5,-0.0 -2,-0.3 -0.983 63.3-150.6-142.7 127.6 107.4 54.2 109.3 148 148 A V H > S+ 0 0 6 -2,-0.4 4,-2.6 1,-0.2 5,-0.3 0.968 108.0 49.7 -58.1 -47.1 105.8 51.8 111.8 149 149 A E H > S+ 0 0 69 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.931 112.6 44.3 -55.4 -50.7 103.0 54.4 111.9 150 150 A K H > S+ 0 0 115 2,-0.2 4,-2.8 1,-0.2 5,-0.4 0.903 112.1 54.2 -64.2 -40.1 102.7 54.7 108.1 151 151 A D H X S+ 0 0 0 -4,-3.4 4,-2.2 1,-0.2 7,-0.3 0.969 112.2 41.5 -57.7 -55.5 102.8 50.9 107.7 152 152 A V H < S+ 0 0 0 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.859 116.7 51.1 -61.1 -37.0 100.0 50.2 110.1 153 153 A A H < S+ 0 0 20 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.942 124.8 18.7 -68.5 -48.8 98.0 53.1 108.8 154 154 A I H < S+ 0 0 103 -4,-2.8 2,-0.9 -5,-0.2 -3,-0.2 0.805 98.1 81.9-102.0 -29.3 98.2 52.3 105.1 155 155 A I S >< S- 0 0 19 -4,-2.2 3,-2.2 -5,-0.4 -1,-0.1 -0.690 71.2-144.9 -79.5 110.3 99.1 48.6 104.3 156 156 A D T 3 S+ 0 0 69 -2,-0.9 -1,-0.2 1,-0.3 -4,-0.0 0.719 91.3 49.0 -44.8 -38.5 95.7 46.8 104.7 157 157 A R T 3 S+ 0 0 51 -26,-0.1 -25,-3.3 -3,-0.0 2,-0.7 0.479 87.9 97.6 -87.4 -0.9 97.0 43.6 106.1 158 158 A V E < +m 132 0B 0 -3,-2.2 -25,-0.2 -7,-0.3 3,-0.1 -0.791 37.6 164.1 -92.7 117.2 99.2 45.2 108.8 159 159 A I E - 0 0 5 -27,-2.0 37,-2.0 -2,-0.7 38,-1.1 0.485 62.4 -21.5-108.5 -8.2 97.5 45.3 112.2 160 160 A G E -mn 133 197B 0 -28,-0.6 -26,-2.8 36,-0.2 2,-0.3 -0.936 65.5 -92.5-173.5-164.0 100.4 46.0 114.5 161 161 A V E -mn 134 198B 0 36,-2.5 38,-2.3 -2,-0.3 2,-0.4 -0.937 24.4-147.1-133.5 155.5 104.2 45.8 115.0 162 162 A X E + n 0 199B 4 -28,-2.2 -26,-0.4 -2,-0.3 2,-0.3 -0.931 21.0 161.8-125.1 150.0 106.4 43.2 116.6 163 163 A C E - n 0 200B 0 36,-1.9 38,-2.6 -2,-0.4 2,-0.4 -0.886 28.5-123.0-150.2 179.8 109.6 43.6 118.5 164 164 A A E + n 0 201B 0 -27,-1.4 7,-0.4 -2,-0.3 2,-0.3 -0.998 26.7 171.2-137.4 133.0 111.8 41.7 120.8 165 165 A I + 0 0 4 36,-2.4 38,-0.3 -2,-0.4 40,-0.1 -0.969 58.5 24.3-139.2 156.6 113.0 42.5 124.3 166 166 A S S S+ 0 0 14 -2,-0.3 39,-1.5 1,-0.2 2,-0.3 0.922 94.9 106.6 57.2 48.8 114.8 40.8 127.2 167 167 A D S > S- 0 0 11 36,-0.2 3,-1.8 37,-0.2 2,-0.7 -0.980 81.3-116.1-152.9 146.8 116.5 38.3 124.9 168 168 A H T 3 S+ 0 0 107 -2,-0.3 -3,-0.0 1,-0.3 -2,-0.0 -0.033 113.7 57.8 -76.8 33.2 120.1 37.9 123.7 169 169 A R T 3 S+ 0 0 53 -2,-0.7 -1,-0.3 -32,-0.1 2,-0.1 0.112 80.1 112.5-141.1 7.6 118.9 38.6 120.1 170 170 A S S < S- 0 0 37 -3,-1.8 -32,-0.1 1,-0.1 -5,-0.1 -0.422 77.5-123.1 -79.0 162.2 117.4 41.9 120.8 171 171 A A - 0 0 40 -34,-0.4 -1,-0.1 -7,-0.4 -6,-0.1 0.195 50.8-107.7 -90.9 16.1 119.0 44.9 119.2 172 172 A A - 0 0 83 -5,-0.2 -7,-0.1 1,-0.1 -34,-0.0 0.913 52.0-169.7 60.5 46.1 119.3 46.3 122.8 173 173 A P - 0 0 33 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.199 9.6-134.3 -65.2 160.8 116.6 48.9 122.3 174 174 A D > - 0 0 76 1,-0.0 4,-2.1 37,-0.0 5,-0.3 -0.610 29.8 -91.9-110.3 172.4 116.1 51.6 124.9 175 175 A V H > S+ 0 0 50 -2,-0.2 4,-2.8 2,-0.2 5,-0.2 0.911 122.1 48.7 -50.2 -50.4 113.0 53.0 126.6 176 176 A Y H > S+ 0 0 148 2,-0.2 4,-3.5 1,-0.2 5,-0.3 0.978 111.6 44.6 -55.4 -67.7 112.6 55.8 124.0 177 177 A H H > S+ 0 0 77 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.806 116.9 49.0 -46.5 -36.5 112.9 53.7 120.8 178 178 A L H X S+ 0 0 4 -4,-2.1 4,-2.5 2,-0.2 -1,-0.3 0.924 114.4 44.0 -70.5 -47.2 110.6 51.2 122.3 179 179 A A H X S+ 0 0 9 -4,-2.8 4,-1.8 -5,-0.3 -2,-0.2 0.897 112.2 51.6 -65.7 -44.9 108.1 53.8 123.3 180 180 A N H >X S+ 0 0 59 -4,-3.5 4,-2.2 -5,-0.2 3,-0.5 0.969 111.9 47.5 -57.0 -54.0 108.2 55.7 120.1 181 181 A M H >X S+ 0 0 3 -4,-1.9 4,-2.0 -5,-0.3 3,-0.5 0.960 109.2 53.5 -49.6 -59.2 107.6 52.5 118.1 182 182 A A H 3X S+ 0 0 0 -4,-2.5 4,-1.0 1,-0.3 -1,-0.2 0.790 111.2 47.1 -47.2 -36.7 104.7 51.4 120.4 183 183 A A H S+ 0 0 2 -4,-2.6 4,-2.1 1,-0.2 5,-1.2 0.888 108.7 54.1 -57.6 -40.9 95.9 51.6 114.1 190 190 A L H <5S+ 0 0 110 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.908 113.7 41.1 -60.3 -44.4 93.7 54.6 114.8 191 191 A L H <5S+ 0 0 123 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.895 122.9 36.9 -72.5 -42.9 94.0 56.0 111.3 192 192 A G H <5S- 0 0 32 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.596 107.4-112.6 -89.1 -11.7 93.7 52.7 109.4 193 193 A G T <5S+ 0 0 69 -4,-2.1 -3,-0.2 1,-0.3 -4,-0.1 0.698 72.8 132.9 88.2 19.3 91.2 50.9 111.5 194 194 A K S - 0 0 37 -39,-1.5 3,-1.8 -40,-0.1 -2,-0.1 -0.366 62.0-129.2 -65.4 139.9 116.5 37.5 130.5 206 206 A K T 3 S+ 0 0 201 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.869 105.3 68.9 -56.6 -37.3 116.6 38.2 134.2 207 207 A K T > S+ 0 0 150 1,-0.2 3,-2.1 2,-0.1 -1,-0.3 0.693 78.3 173.6 -57.0 -20.5 115.1 41.6 133.5 208 208 A A T < - 0 0 3 -3,-1.8 -1,-0.2 1,-0.2 -5,-0.2 -0.188 63.9 -8.9 51.6-127.6 111.8 40.0 132.5 209 209 A L T >> S+ 0 0 0 1,-0.2 3,-1.5 2,-0.1 4,-1.5 0.403 98.2 114.3 -83.1 1.6 109.0 42.4 131.8 210 210 A Q H <> S+ 0 0 84 -3,-2.1 4,-2.7 1,-0.3 5,-0.2 0.841 70.1 58.3 -40.4 -50.7 110.8 45.5 133.1 211 211 A P H 3> S+ 0 0 29 0, 0.0 4,-2.8 0, 0.0 -1,-0.3 0.850 106.6 49.3 -51.7 -38.6 111.0 47.2 129.7 212 212 A I H <> S+ 0 0 0 -3,-1.5 4,-2.5 2,-0.2 5,-0.2 0.985 110.5 47.2 -64.9 -59.0 107.2 47.1 129.4 213 213 A Y H X S+ 0 0 44 -4,-1.5 4,-1.2 1,-0.2 -1,-0.2 0.872 115.3 49.1 -49.5 -41.0 106.6 48.6 132.9 214 214 A D H X S+ 0 0 51 -4,-2.7 4,-1.0 -5,-0.3 3,-0.5 0.932 108.5 51.5 -65.2 -47.2 109.2 51.2 132.0 215 215 A L H < S+ 0 0 0 -4,-2.8 4,-0.4 1,-0.3 3,-0.3 0.835 105.2 56.6 -59.4 -34.5 107.6 52.0 128.6 216 216 A L H >< S+ 0 0 53 -4,-2.5 3,-0.7 1,-0.2 -1,-0.3 0.876 107.7 48.8 -65.2 -35.8 104.3 52.5 130.4 217 217 A E H 3< S+ 0 0 169 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.676 110.4 52.1 -77.2 -18.2 105.9 55.1 132.5 218 218 A N T 3< S+ 0 0 109 -4,-1.0 2,-0.2 -3,-0.3 -1,-0.2 0.364 118.8 10.7-101.0 5.7 107.5 56.9 129.5 219 219 A C < - 0 0 28 -3,-0.7 -39,-0.0 -4,-0.4 -40,-0.0 -0.804 69.7-108.8-156.4-161.1 104.3 57.3 127.4 220 220 A D + 0 0 160 -2,-0.2 -4,-0.1 2,-0.1 -3,-0.1 0.138 56.5 138.8-133.6 22.6 100.6 57.1 127.2 221 221 A V - 0 0 13 -6,-0.2 -2,-0.1 1,-0.1 2,-0.1 -0.506 63.2-103.5 -70.8 134.1 99.9 54.0 125.1 222 222 A P > - 0 0 40 0, 0.0 3,-2.2 0, 0.0 4,-0.2 -0.369 18.4-133.2 -59.6 131.2 97.0 52.0 126.5 223 223 A I G > S+ 0 0 39 1,-0.3 3,-1.4 2,-0.2 27,-0.4 0.721 103.2 76.5 -58.8 -17.7 98.2 48.8 128.3 224 224 A S G 3 S+ 0 0 56 1,-0.3 -1,-0.3 25,-0.1 25,-0.0 0.430 91.8 53.8 -74.0 2.5 95.5 47.1 126.3 225 225 A K G < S+ 0 0 32 -3,-2.2 -27,-2.3 -28,-0.1 2,-0.7 0.380 86.5 90.1-115.1 -1.9 97.8 47.4 123.3 226 226 A L E < -o 198 0B 1 -3,-1.4 24,-0.3 -4,-0.2 -27,-0.2 -0.851 54.1-174.1-104.0 109.1 100.9 45.7 124.7 227 227 A L E -o 199 0B 0 -29,-2.0 -27,-3.2 -2,-0.7 2,-0.6 -0.858 10.5-160.8-109.4 110.1 101.1 41.9 124.2 228 228 A P E -o 200 0B 0 0, 0.0 24,-2.1 0, 0.0 3,-0.3 -0.754 18.4-167.3 -86.1 122.0 103.9 39.9 125.8 229 229 A T E +o 201 0B 0 -29,-2.4 -27,-0.6 -2,-0.6 24,-0.2 -0.598 63.3 33.0-104.8 169.9 104.2 36.5 124.0 230 230 A H > + 0 0 9 22,-0.3 3,-2.7 -2,-0.2 4,-0.2 0.645 69.7 153.6 62.9 12.8 106.1 33.4 125.0 231 231 A V T 3 + 0 0 0 21,-1.2 3,-0.5 -3,-0.3 10,-0.2 0.669 61.8 63.6 -49.0 -18.4 105.3 34.3 128.6 232 232 A N T 3 S+ 0 0 0 20,-0.2 29,-0.7 1,-0.2 -1,-0.3 0.455 71.2 99.8 -89.1 3.2 105.5 30.6 129.6 233 233 A R S < S+ 0 0 51 -3,-2.7 2,-0.3 1,-0.2 -1,-0.2 0.808 93.2 10.9 -58.2 -35.2 109.2 30.3 128.7 234 234 A N S >> S- 0 0 30 -3,-0.5 4,-2.2 -4,-0.2 3,-0.9 -0.992 72.4-120.3-150.6 144.0 110.5 30.6 132.3 235 235 A V H 3> S+ 0 0 58 -2,-0.3 4,-1.8 1,-0.2 5,-0.2 0.824 107.9 50.7 -48.2 -51.9 108.9 30.6 135.7 236 236 A P H 3> S+ 0 0 83 0, 0.0 4,-0.7 0, 0.0 -1,-0.2 0.819 114.4 47.4 -61.0 -28.6 109.9 34.1 137.0 237 237 A L H X> S+ 0 0 1 -3,-0.9 4,-2.5 2,-0.2 3,-0.7 0.919 106.8 54.6 -76.5 -48.5 108.6 35.6 133.8 238 238 A F H 3X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.3 -1,-0.2 0.867 107.2 52.7 -55.4 -37.3 105.3 33.8 133.8 239 239 A E H 3X S+ 0 0 101 -4,-1.8 4,-1.5 1,-0.2 -1,-0.3 0.804 110.1 46.3 -71.2 -28.3 104.6 35.1 137.3 240 240 A Q H S+ 0 0 0 -4,-1.9 5,-1.7 2,-0.2 -1,-0.3 0.841 110.9 50.2 -73.0 -35.6 100.8 42.3 134.1 245 245 A A H ><5S+ 0 0 0 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.832 104.6 57.3 -71.1 -35.1 97.5 40.6 133.4 246 246 A R H 3<5S+ 0 0 149 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.825 99.6 59.1 -67.3 -29.5 96.1 41.6 136.7 247 247 A K T 3<5S- 0 0 115 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.377 134.7 -86.2 -80.3 6.1 96.8 45.3 135.8 248 248 A G T < 5S+ 0 0 21 -3,-1.5 2,-0.2 1,-0.3 -3,-0.2 0.552 86.1 130.2 105.3 9.4 94.5 44.9 132.8 249 249 A G < - 0 0 0 -5,-1.7 2,-0.4 -7,-0.1 -1,-0.3 -0.591 52.4-125.1 -97.7 159.9 96.8 43.5 130.1 250 250 A T - 0 0 12 -27,-0.4 2,-0.4 -24,-0.3 30,-0.2 -0.838 22.5-154.1-101.7 138.3 96.4 40.5 127.8 251 251 A I E -q 280 0D 0 28,-2.7 30,-1.9 -2,-0.4 2,-0.5 -0.945 6.0-143.5-119.2 135.7 99.1 37.8 127.7 252 252 A D E -q 281 0D 0 -24,-2.1 -21,-1.2 -2,-0.4 2,-0.5 -0.824 13.5-158.7 -97.1 120.7 99.9 35.4 124.8 253 253 A I E -q 282 0D 0 28,-3.2 30,-2.5 -2,-0.5 2,-0.6 -0.883 12.8-136.5-104.7 125.5 101.0 31.9 125.8 254 254 A T E > -q 283 0D 0 -2,-0.5 3,-1.0 28,-0.2 30,-0.2 -0.709 7.1-159.5 -84.7 120.5 102.9 29.9 123.2 255 255 A S T 3 S+ 0 0 2 28,-2.8 29,-0.1 -2,-0.6 -1,-0.1 0.331 82.7 74.2 -79.9 5.1 101.7 26.3 123.0 256 256 A S T 3 S+ 0 0 13 27,-0.2 2,-0.5 28,-0.2 -1,-0.2 0.372 79.7 80.8 -98.6 2.4 105.0 25.1 121.5 257 257 A I < - 0 0 28 -3,-1.0 -25,-0.0 1,-0.1 -27,-0.0 -0.952 53.8-178.3-108.9 123.0 106.8 25.3 124.8 258 258 A D + 0 0 128 -2,-0.5 4,-0.2 1,-0.2 -1,-0.1 0.512 50.4 78.4-101.3 -4.7 106.2 22.2 127.0 259 259 A E S S+ 0 0 138 2,-0.2 -1,-0.2 1,-0.1 -27,-0.0 -0.967 83.9 8.4-157.6 158.6 108.2 23.2 130.1 260 260 A P S S+ 0 0 67 0, 0.0 2,-0.5 0, 0.0 -27,-0.1 -0.997 136.9 17.7 -78.3 -8.9 108.9 24.7 132.6 261 261 A V S S- 0 0 1 -29,-0.7 -2,-0.2 -28,-0.0 -4,-0.1 -0.950 82.9-137.8-128.8 110.2 105.2 25.9 132.4 262 262 A A > - 0 0 23 -2,-0.5 4,-3.7 -4,-0.2 5,-0.2 -0.210 18.0-122.4 -64.0 155.2 102.9 23.9 130.2 263 263 A P H > S+ 0 0 17 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.979 116.4 44.4 -62.4 -50.1 100.4 25.8 128.0 264 264 A A H > S+ 0 0 4 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.938 117.2 45.3 -55.2 -50.6 97.5 24.0 129.6 265 265 A E H > S+ 0 0 57 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.930 112.3 54.4 -57.1 -48.7 99.1 24.4 133.1 266 266 A G H X S+ 0 0 0 -4,-3.7 4,-1.2 2,-0.2 -2,-0.2 0.932 108.5 45.4 -52.5 -55.8 99.7 28.1 132.2 267 267 A I H >X S+ 0 0 2 -4,-2.9 4,-1.5 1,-0.2 3,-1.1 0.953 114.6 47.5 -56.7 -53.4 96.2 29.0 131.2 268 268 A A H >X S+ 0 0 3 -4,-2.2 4,-2.6 1,-0.3 3,-0.6 0.926 107.5 56.1 -52.7 -50.7 94.6 27.3 134.2 269 269 A R H 3X S+ 0 0 72 -4,-2.8 4,-0.9 1,-0.3 -1,-0.3 0.761 106.3 52.9 -54.7 -26.7 97.0 28.8 136.6 270 270 A A H S+ 0 0 0 -4,-1.2 5,-2.4 -3,-1.1 4,-0.7 0.840 108.1 48.0 -79.0 -36.6 96.0 32.2 135.3 271 271 A V H X<5S+ 0 0 54 -4,-1.5 3,-1.8 -3,-0.6 -2,-0.2 0.960 111.2 50.1 -68.3 -49.7 92.3 31.7 135.8 272 272 A Q H 3<5S+ 0 0 161 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.840 106.1 59.0 -56.3 -31.8 92.9 30.4 139.3 273 273 A A H 3<5S- 0 0 44 -4,-0.9 -1,-0.3 -5,-0.3 -2,-0.2 0.756 124.4-107.3 -69.3 -24.4 94.9 33.6 139.7 274 274 A G T <<5S+ 0 0 59 -3,-1.8 -3,-0.2 -4,-0.7 -2,-0.1 0.535 71.9 138.7 110.1 8.3 91.8 35.6 138.9 275 275 A I < - 0 0 5 -5,-2.4 -1,-0.3 1,-0.1 -29,-0.1 -0.616 54.7-119.6 -82.3 141.5 92.5 36.8 135.4 276 276 A P > - 0 0 61 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 -0.411 19.6-117.9 -76.8 166.8 89.6 36.6 133.1 277 277 A L G > S+ 0 0 22 1,-0.2 3,-2.0 2,-0.2 -2,-0.0 0.764 107.1 74.2 -74.0 -22.9 89.9 34.4 130.0 278 278 A A G 3 S+ 0 0 68 1,-0.3 -1,-0.2 57,-0.0 60,-0.0 0.565 97.0 50.8 -67.0 -5.0 89.4 37.3 127.6 279 279 A R G < S+ 0 0 74 -3,-1.0 -28,-2.7 -29,-0.1 2,-0.4 0.344 98.8 77.6-111.5 3.1 93.0 38.4 128.6 280 280 A V E < +q 251 0D 0 -3,-2.0 2,-0.3 -30,-0.2 -28,-0.2 -0.938 56.0 172.4-115.7 135.7 94.6 35.1 127.9 281 281 A T E -q 252 0D 0 -30,-1.9 -28,-3.2 -2,-0.4 2,-0.5 -0.977 23.5-139.3-139.3 152.8 95.3 33.8 124.4 282 282 A L E -q 253 0D 3 49,-2.5 -215,-0.3 -2,-0.3 2,-0.3 -0.959 20.3-176.8-115.5 127.1 97.2 30.8 123.0 283 283 A S E -q 254 0D 0 -30,-2.5 -28,-2.8 -2,-0.5 -27,-0.2 -0.770 18.5-149.8-115.7 166.1 99.5 31.2 120.0 284 284 A S - 0 0 0 -2,-0.3 -28,-0.2 -30,-0.2 -215,-0.1 0.815 15.7-144.1-103.2 -42.6 101.4 28.5 118.2 285 285 A D > - 0 0 9 -217,-1.8 3,-1.4 -30,-0.1 20,-0.3 0.883 33.5-160.0 73.1 41.5 104.5 30.1 116.9 286 286 A G B 3 +k 69 0B 0 -218,-0.8 -216,-1.3 1,-0.2 20,-0.2 0.017 61.1 4.7 -51.0 159.9 104.2 27.8 113.9 287 287 A N T 3 S+ 0 0 13 18,-1.4 -213,-0.3 -218,-0.1 -1,-0.2 0.591 99.8 128.8 35.9 19.6 107.2 27.1 111.6 288 288 A G < - 0 0 1 -3,-1.4 17,-1.9 17,-0.1 2,-0.3 -0.391 65.2 -96.7 -89.4 175.7 109.3 29.1 113.9 289 289 A S B -R 304 0E 15 15,-0.2 15,-0.2 -2,-0.1 -214,-0.1 -0.705 17.8-151.2 -96.5 147.6 112.6 27.7 115.3 290 290 A Q + 0 0 43 13,-1.5 2,-0.3 -2,-0.3 14,-0.1 -0.696 34.0 165.5-113.1 74.2 112.9 26.0 118.7 291 291 A P - 0 0 21 0, 0.0 2,-0.3 0, 0.0 11,-0.2 -0.713 18.7-159.6 -94.0 146.2 116.5 26.9 119.5 292 292 A F - 0 0 112 9,-1.7 8,-2.0 -2,-0.3 9,-0.4 -0.912 1.2-155.7-122.5 150.2 117.9 26.6 123.0 293 293 A F B -S 299 0F 58 -2,-0.3 6,-0.2 6,-0.2 0, 0.0 -0.973 5.1-147.6-128.9 145.0 121.0 28.2 124.5 294 294 A D - 0 0 73 4,-2.0 -1,-0.2 -2,-0.4 5,-0.0 0.692 53.8 -68.8 -75.1-121.9 123.3 27.2 127.4 295 295 A D S S+ 0 0 163 1,-0.1 -2,-0.0 2,-0.0 -1,-0.0 0.519 127.5 52.5-116.2 -11.5 125.0 29.8 129.6 296 296 A E S S- 0 0 171 2,-0.1 3,-0.1 0, 0.0 -1,-0.1 0.115 121.3 -97.4-108.9 18.1 127.5 31.4 127.3 297 297 A G S S+ 0 0 41 1,-0.3 2,-0.4 0, 0.0 -2,-0.0 0.701 75.1 153.2 74.3 19.2 124.8 32.1 124.6 298 298 A N - 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0 0 29 1,-0.2 4,-3.4 -5,-0.0 -2,-0.3 -0.983 63.3-150.6-142.6 127.6 48.6 6.8 45.3 537 148 B V H > S+ 0 0 7 -2,-0.4 4,-2.6 1,-0.2 5,-0.3 0.968 108.0 49.7 -58.0 -47.1 45.8 6.9 47.8 538 149 B E H > S+ 0 0 68 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.931 112.6 44.3 -55.4 -50.7 46.4 10.6 47.9 539 150 B K H > S+ 0 0 115 2,-0.2 4,-2.8 1,-0.2 5,-0.4 0.903 112.1 54.2 -64.2 -40.1 46.4 11.0 44.1 540 151 B D H X S+ 0 0 0 -4,-3.4 4,-2.2 1,-0.2 7,-0.3 0.969 112.2 41.5 -57.6 -55.5 43.4 8.8 43.8 541 152 B V H < S+ 0 0 0 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.859 116.7 51.1 -61.1 -37.0 41.2 10.8 46.2 542 153 B A H < S+ 0 0 20 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.942 124.8 18.7 -68.5 -48.9 42.6 14.1 44.8 543 154 B I H < S+ 0 0 104 -4,-2.8 2,-0.9 -5,-0.2 -3,-0.2 0.805 98.1 81.9-102.0 -29.3 41.9 13.5 41.1 544 155 B I S >< S- 0 0 20 -4,-2.2 3,-2.2 -5,-0.4 -1,-0.1 -0.690 71.2-144.9 -79.5 110.3 39.4 10.7 40.3 545 156 B D T 3 S+ 0 0 71 -2,-0.9 -1,-0.2 1,-0.3 -4,-0.0 0.719 91.3 49.0 -44.8 -38.5 36.1 12.5 40.7 546 157 B R T 3 S+ 0 0 54 -26,-0.1 -25,-3.3 -3,-0.0 2,-0.7 0.479 87.9 97.6 -87.4 -1.0 34.0 9.7 42.2 547 158 B V E < +f 521 0H 0 -3,-2.2 -25,-0.2 -7,-0.3 3,-0.1 -0.791 37.6 164.1 -92.6 117.2 36.6 8.7 44.9 548 159 B I E - 0 0 5 -27,-2.0 37,-2.0 -2,-0.7 38,-1.1 0.485 62.4 -21.6-108.5 -8.2 35.8 10.3 48.2 549 160 B G E -fg 522 586H 0 -28,-0.6 -26,-2.8 36,-0.2 2,-0.3 -0.936 65.5 -92.4-173.5-164.0 38.0 8.2 50.5 550 161 B V E -fg 523 587H 0 36,-2.5 38,-2.3 -2,-0.3 2,-0.4 -0.937 24.4-147.1-133.5 155.5 39.9 5.0 51.1 551 162 B X E + g 0 588H 5 -28,-2.2 -26,-0.4 -2,-0.3 2,-0.3 -0.931 21.0 161.8-125.0 150.0 39.0 1.7 52.7 552 163 B C E - g 0 589H 0 36,-1.9 38,-2.6 -2,-0.4 2,-0.4 -0.886 28.5-123.0-150.2 179.9 41.0 -0.8 54.6 553 164 B A E + g 0 590H 0 -27,-1.4 7,-0.4 -2,-0.3 2,-0.3 -0.998 26.7 171.2-137.4 132.9 40.6 -3.7 57.0 554 165 B I + 0 0 4 36,-2.4 38,-0.3 -2,-0.4 40,-0.1 -0.969 58.5 24.2-139.2 156.6 42.0 -4.1 60.5 555 166 B S S S+ 0 0 13 -2,-0.3 39,-1.5 1,-0.2 2,-0.3 0.922 94.9 106.6 57.3 48.7 41.5 -6.6 63.4 556 167 B D S > S- 0 0 11 36,-0.2 3,-1.8 37,-0.2 2,-0.7 -0.980 81.3-116.1-152.9 146.8 40.4 -9.4 61.1 557 168 B H T 3 S+ 0 0 108 -2,-0.3 -3,-0.0 1,-0.3 -2,-0.0 -0.032 113.7 57.8 -76.8 33.2 42.0 -12.6 59.9 558 169 B R T 3 S+ 0 0 54 -2,-0.7 -1,-0.3 -32,-0.1 2,-0.1 0.112 80.1 112.5-141.1 7.6 41.9 -11.3 56.3 559 170 B S S < S- 0 0 38 -3,-1.8 -32,-0.1 1,-0.1 -5,-0.1 -0.422 77.5-123.0 -79.0 162.2 43.8 -8.1 57.0 560 171 B A - 0 0 40 -34,-0.4 -1,-0.1 -7,-0.4 -6,-0.1 0.196 50.8-107.7 -90.9 16.2 47.3 -7.8 55.4 561 172 B A - 0 0 82 -5,-0.2 -7,-0.1 1,-0.1 -34,-0.0 0.913 52.0-169.7 60.5 46.1 48.6 -7.4 58.9 562 173 B P - 0 0 32 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.198 9.6-134.3 -65.2 160.8 49.3 -3.7 58.4 563 174 B D > - 0 0 76 1,-0.0 4,-2.1 37,-0.0 5,-0.3 -0.611 29.8 -91.9-110.3 172.4 51.3 -1.7 61.0 564 175 B V H > S+ 0 0 50 -2,-0.2 4,-2.8 2,-0.2 5,-0.2 0.911 122.1 48.7 -50.2 -50.4 50.8 1.6 62.7 565 176 B Y H > S+ 0 0 146 2,-0.2 4,-3.5 1,-0.2 5,-0.3 0.978 111.6 44.6 -55.4 -67.6 52.8 3.5 60.0 566 177 B H H > S+ 0 0 79 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.806 116.9 49.0 -46.6 -36.5 51.3 2.1 56.8 567 178 B L H X S+ 0 0 4 -4,-2.1 4,-2.5 2,-0.2 -1,-0.3 0.924 114.4 44.0 -70.5 -47.1 47.9 2.6 58.4 568 179 B A H X S+ 0 0 9 -4,-2.8 4,-1.8 -5,-0.3 -2,-0.2 0.898 112.2 51.6 -65.8 -44.9 48.7 6.2 59.4 569 180 B N H >X S+ 0 0 59 -4,-3.5 4,-2.2 -5,-0.2 3,-0.5 0.969 111.9 47.5 -57.1 -54.0 50.3 7.1 56.1 570 181 B M H >X S+ 0 0 3 -4,-1.9 4,-1.9 -5,-0.3 3,-0.5 0.960 109.2 53.5 -49.6 -59.2 47.3 5.8 54.2 571 182 B A H 3X S+ 0 0 0 -4,-2.5 4,-1.0 1,-0.3 -1,-0.2 0.791 111.2 47.1 -47.2 -36.7 44.9 7.6 56.4 572 183 B A H S+ 0 0 2 -4,-2.6 4,-2.1 1,-0.2 5,-1.2 0.888 108.7 54.1 -57.6 -40.9 40.2 15.1 50.1 579 190 B L H <5S+ 0 0 110 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.908 113.7 41.1 -60.2 -44.4 41.5 18.6 50.8 580 191 B L H <5S+ 0 0 123 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.895 122.9 36.9 -72.5 -42.9 42.8 19.0 47.3 581 192 B G H <5S- 0 0 31 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.596 107.4-112.6 -89.0 -11.7 39.9 17.4 45.4 582 193 B G T <5S+ 0 0 69 -4,-2.1 -3,-0.2 1,-0.3 -4,-0.1 0.698 72.8 132.9 88.2 19.3 37.0 18.6 47.5 583 194 B K S - 0 0 37 -39,-1.5 3,-1.8 -40,-0.1 -2,-0.1 -0.367 62.0-129.2 -65.4 139.9 39.7 -9.8 66.7 595 206 B K T 3 S+ 0 0 205 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.869 105.3 68.9 -56.7 -37.3 40.3 -9.4 70.4 596 207 B K T > S+ 0 0 150 1,-0.2 3,-2.1 2,-0.1 -1,-0.3 0.692 78.3 173.6 -57.0 -20.5 42.4 -6.3 69.7 597 208 B A T < - 0 0 4 -3,-1.8 -1,-0.2 1,-0.2 -5,-0.2 -0.189 63.9 -8.9 51.6-127.6 39.2 -4.5 68.7 598 209 B L T >> S+ 0 0 0 1,-0.2 3,-1.5 2,-0.1 4,-1.5 0.404 98.2 114.3 -83.1 1.6 39.7 -0.7 68.0 599 210 B Q H <> S+ 0 0 83 -3,-2.1 4,-2.7 1,-0.3 5,-0.2 0.841 70.1 58.3 -40.4 -50.6 43.3 -0.6 69.3 600 211 B P H 3> S+ 0 0 27 0, 0.0 4,-2.8 0, 0.0 -1,-0.3 0.850 106.6 49.3 -51.7 -38.6 44.8 0.2 65.8 601 212 B I H <> S+ 0 0 0 -3,-1.5 4,-2.5 2,-0.2 5,-0.2 0.985 110.5 47.2 -65.0 -58.9 42.7 3.3 65.5 602 213 B Y H X S+ 0 0 44 -4,-1.5 4,-1.2 1,-0.2 -1,-0.2 0.871 115.3 49.1 -49.5 -41.0 43.6 4.6 69.0 603 214 B D H X S+ 0 0 50 -4,-2.7 4,-1.0 -5,-0.3 3,-0.5 0.932 108.6 51.5 -65.2 -47.2 47.2 3.9 68.0 604 215 B L H < S+ 0 0 0 -4,-2.8 4,-0.4 1,-0.3 3,-0.3 0.835 105.2 56.6 -59.4 -34.5 46.9 5.6 64.7 605 216 B L H >< S+ 0 0 51 -4,-2.5 3,-0.7 1,-0.2 -1,-0.3 0.876 107.7 48.8 -65.2 -35.8 45.5 8.7 66.4 606 217 B E H 3< S+ 0 0 169 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.677 110.4 52.1 -77.3 -18.2 48.7 8.8 68.6 607 218 B N T 3< S+ 0 0 109 -4,-1.0 2,-0.2 -3,-0.3 -1,-0.2 0.364 118.8 10.7-101.0 5.7 50.9 8.4 65.5 608 219 B C < - 0 0 26 -3,-0.7 -39,-0.0 -4,-0.4 -40,-0.0 -0.805 69.7-108.7-156.4-161.1 49.6 11.2 63.4 609 220 B D + 0 0 159 -2,-0.2 -4,-0.1 2,-0.1 -3,-0.1 0.137 56.5 138.7-133.6 22.7 47.3 14.3 63.2 610 221 B V - 0 0 15 -6,-0.2 -2,-0.1 1,-0.1 2,-0.1 -0.506 63.2-103.5 -70.8 134.1 44.4 13.2 61.1 611 222 B P > - 0 0 40 0, 0.0 3,-2.2 0, 0.0 4,-0.2 -0.369 18.4-133.2 -59.6 131.2 41.1 14.5 62.5 612 223 B I G > S+ 0 0 41 1,-0.3 3,-1.4 2,-0.2 27,-0.4 0.721 103.2 76.5 -58.8 -17.8 39.2 11.8 64.3 613 224 B S G 3 S+ 0 0 58 1,-0.3 -1,-0.3 25,-0.1 25,-0.0 0.430 91.8 53.8 -73.9 2.5 36.2 13.1 62.3 614 225 B K G < S+ 0 0 33 -3,-2.2 -27,-2.3 -28,-0.1 2,-0.7 0.380 86.5 90.2-115.1 -1.8 37.7 11.2 59.3 615 226 B L E < -h 587 0H 0 -3,-1.4 24,-0.3 -4,-0.2 -27,-0.2 -0.850 54.1-174.1-104.0 109.1 38.0 7.7 60.8 616 227 B L E -h 588 0H 0 -29,-1.9 -27,-3.2 -2,-0.7 2,-0.6 -0.857 10.5-160.8-109.4 110.1 35.0 5.5 60.3 617 228 B P E -h 589 0H 0 0, 0.0 24,-2.1 0, 0.0 3,-0.3 -0.754 18.4-167.3 -86.0 122.0 34.8 2.1 61.9 618 229 B T E +h 590 0H 0 -29,-2.4 -27,-0.6 -2,-0.6 24,-0.2 -0.598 63.3 33.0-104.8 169.9 32.1 -0.0 60.1 619 230 B H > + 0 0 9 22,-0.3 3,-2.7 -2,-0.2 4,-0.2 0.645 69.7 153.6 62.8 12.8 30.5 -3.3 61.2 620 231 B V T 3 + 0 0 0 21,-1.2 3,-0.5 -3,-0.3 10,-0.2 0.669 61.8 63.6 -49.0 -18.4 30.9 -2.1 64.8 621 232 B N T 3 S+ 0 0 0 20,-0.2 29,-0.7 1,-0.2 -1,-0.3 0.455 71.2 99.8 -89.2 3.3 27.9 -4.3 65.8 622 233 B R S < S+ 0 0 49 -3,-2.7 2,-0.3 1,-0.2 -1,-0.2 0.808 93.2 11.0 -58.3 -35.2 29.6 -7.6 64.9 623 234 B N S >> S- 0 0 31 -3,-0.5 4,-2.2 -4,-0.2 3,-0.9 -0.992 72.4-120.3-150.5 144.0 30.6 -8.4 68.5 624 235 B V H 3> S+ 0 0 57 -2,-0.3 4,-1.8 1,-0.2 5,-0.2 0.824 107.9 50.7 -48.2 -51.9 29.8 -7.1 72.0 625 236 B P H 3> S+ 0 0 81 0, 0.0 4,-0.7 0, 0.0 -1,-0.2 0.819 114.4 47.4 -61.0 -28.7 33.2 -6.0 73.2 626 237 B L H X> S+ 0 0 1 -3,-0.9 4,-2.5 2,-0.2 3,-0.7 0.919 106.8 54.6 -76.5 -48.6 33.8 -4.1 70.0 627 238 B F H 3X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.3 -1,-0.2 0.867 107.2 52.7 -55.4 -37.3 30.4 -2.3 70.0 628 239 B E H 3X S+ 0 0 104 -4,-1.8 4,-1.5 1,-0.2 -1,-0.3 0.804 110.1 46.3 -71.2 -28.2 31.2 -1.1 73.5 629 240 B Q H S+ 0 0 0 -4,-1.9 5,-1.7 2,-0.2 -1,-0.3 0.840 110.9 50.2 -73.0 -35.6 35.1 6.0 70.2 634 245 B A H ><5S+ 0 0 0 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.832 104.5 57.3 -71.1 -35.1 31.9 7.8 69.4 635 246 B R H 3<5S+ 0 0 150 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.825 99.6 59.1 -67.3 -29.4 32.0 9.6 72.8 636 247 B K T 3<5S- 0 0 116 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.377 134.7 -86.2 -80.4 6.1 35.4 11.0 71.9 637 248 B G T < 5S+ 0 0 22 -3,-1.5 2,-0.2 1,-0.3 -3,-0.2 0.552 86.1 130.3 105.3 9.5 33.8 12.7 68.8 638 249 B G < - 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