==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 20-AUG-10 3AMI . COMPND 2 MOLECULE: ZINC PEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SPHINGOMONAS; . AUTHOR Y.MARUYAMA,A.CHUMA,B.MIKAMI,W.HASHIMOTO,K.MURATA . 844 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35332.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 608 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 114 13.5 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 . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 47 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 93 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 286 33.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 2 2 0 4 4 2 2 2 3 3 0 0 3 2 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 2 0 2 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 0 1 0 2 6 4 2 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 . 0 0 0 0 2 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 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 29 A P > 0 0 134 0, 0.0 3,-1.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -86.7 -1.6 10.4 13.9 2 30 A A G > + 0 0 54 1,-0.3 3,-1.6 2,-0.2 380,-0.0 0.723 360.0 73.3 -64.9 -23.8 -0.9 7.2 15.9 3 31 A A G 3 S+ 0 0 89 1,-0.3 -1,-0.3 16,-0.0 16,-0.0 0.587 101.2 43.2 -67.8 -10.2 1.3 9.3 18.1 4 32 A S G < S+ 0 0 42 -3,-1.5 16,-2.9 2,-0.0 2,-0.4 0.198 95.5 97.5-118.4 12.7 -1.9 10.8 19.5 5 33 A T E < +A 19 0A 10 -3,-1.6 2,-0.3 14,-0.2 14,-0.3 -0.876 44.8 174.8-112.9 138.1 -3.9 7.6 19.9 6 34 A F E -A 18 0A 59 12,-3.1 12,-3.9 -2,-0.4 2,-0.3 -0.999 5.1-173.5-143.5 139.0 -4.3 5.7 23.1 7 35 A E E +A 17 0A 57 -2,-0.3 2,-0.3 10,-0.3 10,-0.2 -0.937 7.4 175.3-132.1 155.8 -6.3 2.6 24.2 8 36 A T E -A 16 0A 46 8,-2.4 8,-3.4 -2,-0.3 2,-0.5 -0.957 20.1-143.7-149.8 147.2 -7.1 0.6 27.3 9 37 A T E -A 15 0A 83 -2,-0.3 6,-0.3 6,-0.2 5,-0.1 -0.960 24.3-134.7-113.1 122.2 -9.4 -2.3 28.0 10 38 A L > - 0 0 6 4,-3.0 3,-2.7 -2,-0.5 -2,-0.0 -0.241 27.5-101.9 -72.0 158.3 -11.1 -2.2 31.4 11 39 A P T 3 S+ 0 0 129 0, 0.0 -1,-0.1 0, 0.0 199,-0.0 0.835 122.9 58.6 -44.3 -39.5 -11.4 -5.3 33.7 12 40 A N T 3 S- 0 0 14 198,-0.1 203,-0.2 2,-0.1 174,-0.2 0.341 123.2-103.9 -79.2 6.5 -15.1 -5.7 32.5 13 41 A G S < S+ 0 0 19 -3,-2.7 2,-0.3 1,-0.3 -1,-0.1 0.292 74.4 140.7 93.2 -9.0 -13.9 -6.0 28.8 14 42 A L - 0 0 0 -5,-0.1 -4,-3.0 173,-0.1 2,-0.5 -0.502 42.0-145.8 -67.7 127.5 -14.9 -2.5 27.7 15 43 A K E -Ab 9 189A 45 173,-1.4 175,-3.0 170,-0.3 2,-0.5 -0.855 11.6-165.4-100.1 131.6 -12.4 -1.0 25.3 16 44 A V E -Ab 8 190A 0 -8,-3.4 -8,-2.4 -2,-0.5 2,-0.4 -0.971 4.7-174.6-116.4 130.5 -11.6 2.7 25.4 17 45 A V E -Ab 7 191A 0 173,-2.5 175,-2.4 -2,-0.5 2,-0.4 -0.993 3.3-169.9-127.0 129.8 -9.7 4.4 22.5 18 46 A V E -Ab 6 192A 0 -12,-3.9 -12,-3.1 -2,-0.4 2,-0.5 -0.974 10.8-171.6-126.2 128.0 -8.7 8.0 22.6 19 47 A R E -Ab 5 193A 15 173,-2.0 175,-1.7 -2,-0.4 2,-0.4 -0.981 23.8-138.6-114.9 117.5 -7.3 10.2 19.9 20 48 A E E + b 0 194A 31 -16,-2.9 2,-0.3 -2,-0.5 175,-0.2 -0.630 30.6 163.8 -82.2 127.1 -6.1 13.6 21.1 21 49 A D > - 0 0 27 173,-2.4 3,-0.6 -2,-0.4 -2,-0.0 -0.820 11.3-180.0-144.8 98.3 -6.9 16.6 18.9 22 50 A H T 3 + 0 0 95 -2,-0.3 173,-0.1 1,-0.2 -2,-0.0 0.119 50.0 109.9 -92.8 22.6 -6.6 20.0 20.6 23 51 A R T 3 S+ 0 0 213 1,-0.2 -1,-0.2 3,-0.1 171,-0.0 0.820 90.1 10.9 -65.7 -32.8 -7.6 22.1 17.6 24 52 A A S < S- 0 0 42 -3,-0.6 2,-2.5 2,-0.2 171,-0.5 -0.993 81.7-108.0-147.9 147.1 -10.9 23.1 19.2 25 53 A P S S+ 0 0 89 0, 0.0 70,-1.4 0, 0.0 71,-0.3 -0.266 90.0 86.1 -74.6 53.8 -12.4 22.7 22.8 26 54 A T E -C 94 0A 41 -2,-2.5 169,-2.4 68,-0.3 2,-0.3 -0.872 54.2-167.0-137.5 175.1 -14.9 20.0 21.6 27 55 A L E -CD 93 194A 0 66,-1.7 66,-1.8 -2,-0.3 2,-0.5 -0.962 20.9-122.4-153.6 166.4 -14.8 16.3 21.3 28 56 A V E -CD 92 193A 0 165,-2.9 165,-2.1 -2,-0.3 2,-0.5 -0.974 22.1-164.7-115.1 132.2 -16.8 13.4 19.8 29 57 A H E +CD 91 192A 0 62,-2.9 62,-2.7 -2,-0.5 2,-0.4 -0.978 13.3 175.3-119.3 121.2 -17.9 10.7 22.0 30 58 A M E -CD 90 191A 5 161,-3.0 161,-3.0 -2,-0.5 2,-0.5 -0.969 19.9-159.3-127.0 141.1 -19.1 7.4 20.4 31 59 A V E -CD 89 190A 0 58,-3.1 58,-2.1 -2,-0.4 2,-0.6 -0.961 12.7-161.6-121.6 117.7 -20.2 4.1 21.8 32 60 A W E -CD 88 189A 3 157,-3.1 157,-1.4 -2,-0.5 2,-0.5 -0.845 0.8-162.6-102.6 112.1 -20.0 1.1 19.4 33 61 A Y E -CD 87 188A 0 54,-2.9 2,-2.0 -2,-0.6 54,-1.9 -0.803 20.7-133.3 -93.5 133.2 -22.0 -2.0 20.2 34 62 A R S S+ 0 0 90 153,-2.7 2,-0.3 -2,-0.5 52,-0.2 -0.527 75.8 92.1 -84.4 70.8 -21.0 -5.2 18.4 35 63 A V + 0 0 0 -2,-2.0 48,-0.2 52,-0.1 2,-0.2 -0.903 43.1 150.3-162.4 134.9 -24.5 -6.2 17.4 36 64 A G > - 0 0 0 -2,-0.3 3,-1.7 48,-0.3 48,-0.3 -0.758 64.1 -63.0-148.8-168.4 -26.6 -5.4 14.3 37 65 A S G > S+ 0 0 2 46,-1.8 3,-1.6 1,-0.3 47,-0.2 0.743 121.2 71.1 -59.6 -23.9 -29.3 -6.8 12.1 38 66 A M G 3 S+ 0 0 14 46,-2.0 -1,-0.3 1,-0.3 47,-0.1 0.663 91.9 57.4 -69.7 -14.8 -27.1 -9.8 11.3 39 67 A D G < S+ 0 0 23 -3,-1.7 -1,-0.3 45,-0.2 -2,-0.2 0.401 88.7 115.5 -93.4 3.9 -27.5 -11.1 14.8 40 68 A E < - 0 0 9 -3,-1.6 2,-0.3 -4,-0.1 5,-0.2 -0.282 61.2-121.2 -83.8 161.3 -31.3 -11.2 14.5 41 69 A T > - 0 0 49 3,-0.5 3,-1.9 423,-0.1 2,-0.2 -0.677 32.6 -98.0 -99.5 146.5 -33.8 -14.1 14.4 42 70 A T T 3 S+ 0 0 31 -2,-0.3 -1,-0.1 1,-0.3 604,-0.0 -0.483 114.9 23.0 -60.2 126.1 -36.3 -15.1 11.7 43 71 A G T 3 S+ 0 0 2 -2,-0.2 -1,-0.3 533,-0.1 126,-0.1 0.078 121.1 61.2 100.3 -21.5 -39.7 -13.6 12.7 44 72 A T X + 0 0 23 -3,-1.9 3,-0.8 126,-0.1 -3,-0.5 -0.222 67.8 146.1-132.2 43.3 -38.1 -10.9 14.9 45 73 A T T 3 + 0 0 4 1,-0.2 125,-0.1 -5,-0.2 115,-0.1 -0.452 57.9 42.5 -77.1 155.8 -36.0 -8.9 12.4 46 74 A G T 3> S+ 0 0 3 114,-0.2 4,-1.7 -2,-0.1 -1,-0.2 0.439 75.3 116.9 86.4 1.6 -35.6 -5.2 13.0 47 75 A V H <> S+ 0 0 3 -3,-0.8 4,-2.5 2,-0.2 5,-0.2 0.884 72.3 54.8 -70.4 -38.2 -35.1 -5.6 16.8 48 76 A A H > S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.936 113.2 42.7 -56.4 -46.5 -31.6 -4.1 16.7 49 77 A H H > S+ 0 0 14 111,-0.4 4,-1.1 2,-0.2 -1,-0.2 0.777 112.4 53.1 -73.0 -28.6 -32.9 -1.0 14.9 50 78 A A H X S+ 0 0 2 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.863 106.8 52.3 -75.6 -36.2 -36.0 -0.8 17.2 51 79 A L H X S+ 0 0 0 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.911 100.7 62.3 -60.7 -43.9 -33.7 -0.9 20.3 52 80 A E H < S+ 0 0 19 -4,-1.6 3,-0.4 1,-0.2 -1,-0.2 0.904 108.2 43.5 -46.9 -45.3 -31.7 2.0 18.8 53 81 A H H >< S+ 0 0 29 -4,-1.1 3,-1.9 1,-0.2 -1,-0.2 0.906 109.3 54.5 -67.2 -45.2 -34.9 4.0 19.0 54 82 A M H >< S+ 0 0 1 -4,-2.0 3,-1.3 1,-0.3 -1,-0.2 0.625 89.6 78.2 -69.6 -12.0 -35.9 2.9 22.5 55 83 A M T 3< S+ 0 0 2 -4,-1.5 -1,-0.3 -3,-0.4 3,-0.2 0.615 95.8 49.0 -67.6 -12.8 -32.5 4.0 23.8 56 84 A F T < S+ 0 0 36 -3,-1.9 9,-2.0 1,-0.1 -1,-0.3 0.324 94.0 76.6-106.8 5.4 -34.0 7.5 23.7 57 85 A K S < S- 0 0 63 -3,-1.3 58,-0.2 7,-0.2 -2,-0.1 0.294 103.4 -78.0-104.7 7.6 -37.2 6.6 25.6 58 86 A G - 0 0 5 5,-0.4 55,-2.3 -3,-0.2 5,-0.3 0.199 24.5-135.4 120.6 139.5 -35.6 6.4 29.0 59 87 A T B -F 112 0B 10 3,-2.5 53,-0.2 53,-0.3 49,-0.1 -0.416 53.2 -90.8 -98.0-174.0 -33.6 4.8 31.8 60 88 A K S S+ 0 0 144 51,-0.9 3,-0.2 -2,-0.2 52,-0.1 0.929 126.3 27.5 -63.3 -44.1 -34.8 4.8 35.5 61 89 A D S S+ 0 0 129 1,-0.2 2,-0.5 50,-0.1 -1,-0.2 0.706 124.5 46.4 -94.2 -25.8 -33.0 8.1 36.3 62 90 A V S S- 0 0 12 42,-0.1 -3,-2.5 45,-0.0 -1,-0.2 -0.855 85.3-157.3-124.0 93.8 -33.0 9.8 32.9 63 91 A G >> - 0 0 23 -2,-0.5 3,-1.8 -5,-0.3 4,-0.6 0.210 35.7 -41.7 -69.9-174.9 -36.5 9.5 31.4 64 92 A P T 34 S- 0 0 75 0, 0.0 -7,-0.2 0, 0.0 -1,-0.2 -0.222 126.3 -0.9 -52.5 117.1 -38.0 9.6 27.8 65 93 A G T 3> S+ 0 0 22 -9,-2.0 4,-2.0 -3,-0.2 5,-0.1 0.152 103.4 105.4 89.9 -18.1 -36.5 12.4 25.7 66 94 A E H <> + 0 0 74 -3,-1.8 4,-2.8 2,-0.2 5,-0.2 0.809 69.3 61.4 -69.6 -31.7 -34.2 13.6 28.5 67 95 A F H X S+ 0 0 9 -4,-0.6 4,-1.4 -5,-0.2 -1,-0.2 0.975 111.8 38.2 -57.8 -55.3 -31.0 12.1 27.1 68 96 A S H > S+ 0 0 40 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.876 115.6 54.5 -64.3 -38.5 -31.2 14.3 23.9 69 97 A K H X S+ 0 0 125 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.938 108.3 47.7 -58.7 -49.8 -32.5 17.3 25.9 70 98 A R H X S+ 0 0 111 -4,-2.8 4,-0.7 2,-0.2 -1,-0.2 0.761 110.2 52.0 -67.3 -27.7 -29.6 17.3 28.3 71 99 A V H ><>S+ 0 0 0 -4,-1.4 5,-2.4 -5,-0.2 3,-0.6 0.912 109.8 48.9 -74.3 -44.4 -27.0 17.0 25.5 72 100 A A H ><5S+ 0 0 65 -4,-2.1 3,-1.7 1,-0.2 -2,-0.2 0.891 108.1 55.6 -57.2 -40.4 -28.6 20.0 23.7 73 101 A A H 3<5S+ 0 0 85 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.733 100.4 58.6 -67.4 -22.8 -28.5 21.9 27.0 74 102 A M T <<5S- 0 0 19 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.465 126.7-103.5 -78.2 -4.7 -24.7 21.2 27.2 75 103 A G T < 5S+ 0 0 64 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.2 0.607 85.9 116.6 87.8 16.0 -24.5 23.0 23.9 76 104 A G < - 0 0 13 -5,-2.4 2,-0.3 -6,-0.1 -1,-0.2 -0.325 56.8-128.8-111.3-172.8 -24.1 19.7 22.1 77 105 A R E -E 92 0A 180 15,-2.4 15,-2.8 -2,-0.1 2,-0.3 -0.955 18.9-171.0-134.5 154.5 -25.6 17.3 19.5 78 106 A D E +E 91 0A 39 -2,-0.3 2,-0.3 13,-0.3 13,-0.2 -0.980 11.1 153.3-144.5 157.4 -26.4 13.6 19.5 79 107 A N E -E 90 0A 86 11,-2.5 11,-2.8 -2,-0.3 2,-0.3 -0.956 19.9-143.6-164.6-177.4 -27.5 10.8 17.2 80 108 A A E -E 89 0A 5 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.987 6.8-164.7-156.2 157.9 -27.4 7.0 16.6 81 109 A F E -E 88 0A 117 7,-2.5 7,-2.7 -2,-0.3 2,-0.4 -0.992 5.9-156.0-152.3 140.2 -27.2 4.5 13.7 82 110 A T E +E 87 0A 6 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.946 19.8 164.7-117.1 138.3 -27.8 0.8 13.2 83 111 A T - 0 0 27 3,-2.9 -46,-1.8 -2,-0.4 -45,-0.2 -0.654 54.6 -83.5-131.0-171.6 -26.2 -1.4 10.4 84 112 A R S S+ 0 0 78 -48,-0.3 -46,-2.0 -2,-0.2 -48,-0.3 0.857 126.5 30.6 -59.8 -38.1 -25.8 -5.1 9.6 85 113 A D S S+ 0 0 11 -49,-0.2 2,-0.3 1,-0.1 -49,-0.2 0.665 123.4 3.8-101.1 -22.7 -22.7 -5.3 11.8 86 114 A Y - 0 0 51 -52,-0.2 -3,-2.9 2,-0.0 2,-0.4 -0.962 48.2-132.8-159.3 166.7 -23.1 -2.8 14.7 87 115 A T E -CE 33 82A 0 -54,-1.9 -54,-2.9 -2,-0.3 2,-0.4 -0.989 30.5-171.1-133.0 123.8 -25.2 -0.2 16.5 88 116 A A E -CE 32 81A 3 -7,-2.7 -7,-2.5 -2,-0.4 2,-0.4 -0.932 12.0-165.1-124.7 142.8 -23.5 3.1 17.4 89 117 A Y E +CE 31 80A 0 -58,-2.1 -58,-3.1 -2,-0.4 2,-0.3 -0.981 18.1 179.4-126.1 134.9 -24.5 6.0 19.6 90 118 A Y E -CE 30 79A 62 -11,-2.8 -11,-2.5 -2,-0.4 2,-0.3 -0.993 17.3-172.9-147.1 144.1 -22.7 9.4 19.5 91 119 A Q E -CE 29 78A 0 -62,-2.7 -62,-2.9 -2,-0.3 2,-0.4 -0.953 14.4-149.5-126.4 150.1 -22.6 12.9 20.9 92 120 A Q E +CE 28 77A 50 -15,-2.8 -15,-2.4 -2,-0.3 -64,-0.2 -0.987 36.0 158.2-116.4 137.4 -20.6 16.0 20.0 93 121 A V E -C 27 0A 2 -66,-1.8 -66,-1.7 -2,-0.4 -18,-0.1 -0.993 50.7 -80.4-161.9 142.2 -20.0 18.2 23.0 94 122 A P E > -C 26 0A 44 0, 0.0 3,-2.7 0, 0.0 -68,-0.3 -0.365 56.5-111.6 -53.5 137.8 -17.7 20.9 24.5 95 123 A S G > S+ 0 0 25 -70,-1.4 3,-0.9 1,-0.3 -69,-0.1 0.673 112.8 60.2 -55.8 -27.2 -14.7 19.0 25.7 96 124 A S G 3 S+ 0 0 99 -71,-0.3 3,-0.5 1,-0.2 -1,-0.3 0.595 93.3 67.3 -76.4 -12.6 -15.3 19.5 29.5 97 125 A R G <> + 0 0 83 -3,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.153 64.6 107.0 -93.1 18.0 -18.7 17.8 29.3 98 126 A L H <> S+ 0 0 7 -3,-0.9 4,-2.3 1,-0.2 5,-0.2 0.886 77.9 54.4 -60.5 -39.9 -17.1 14.4 28.6 99 127 A S H > S+ 0 0 63 -3,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.908 104.9 52.7 -60.2 -48.0 -18.0 13.3 32.1 100 128 A D H > S+ 0 0 59 -4,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.932 114.2 41.2 -53.0 -50.9 -21.7 14.2 31.6 101 129 A V H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.839 111.2 53.9 -77.6 -31.3 -22.1 12.1 28.4 102 130 A M H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.867 111.0 49.6 -64.3 -36.0 -20.0 9.1 29.6 103 131 A G H X S+ 0 0 27 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.943 111.3 48.5 -65.0 -49.5 -22.3 9.0 32.6 104 132 A L H X S+ 0 0 19 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.891 115.5 42.4 -55.3 -47.2 -25.4 9.2 30.4 105 133 A E H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.899 113.5 51.3 -73.4 -41.0 -24.3 6.4 28.1 106 134 A A H X S+ 0 0 6 -4,-2.2 4,-0.8 2,-0.2 -2,-0.2 0.896 112.5 47.9 -59.1 -42.3 -23.0 4.2 30.9 107 135 A D H >X S+ 0 0 23 -4,-2.6 4,-3.2 1,-0.2 3,-1.0 0.944 113.3 47.5 -59.0 -49.6 -26.4 4.7 32.5 108 136 A R H 3< S+ 0 0 5 -4,-2.5 4,-0.4 1,-0.2 -2,-0.2 0.724 105.4 61.0 -65.0 -25.4 -28.1 3.9 29.2 109 137 A M H 3< S+ 0 0 4 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.768 123.1 16.1 -71.4 -25.8 -25.8 0.8 28.8 110 138 A A H << S+ 0 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-4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.872 108.4 54.5 -62.2 -37.5 -30.9 -3.1 -2.9 144 172 A E H X S+ 0 0 19 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.944 111.2 43.3 -63.2 -48.4 -33.4 -4.9 -0.7 145 173 A A H X S+ 0 0 16 -4,-1.7 4,-2.5 2,-0.2 5,-0.3 0.934 114.3 52.7 -60.0 -45.7 -34.4 -7.2 -3.5 146 174 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.915 111.0 44.1 -56.6 -51.1 -30.7 -7.7 -4.5 147 175 A M H X S+ 0 0 24 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.885 113.8 52.1 -63.3 -37.9 -29.5 -8.7 -1.0 148 176 A A H < S+ 0 0 6 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.880 117.4 36.8 -68.7 -39.5 -32.6 -11.0 -0.6 149 177 A A H < S+ 0 0 22 -4,-2.5 -2,-0.2 -5,-0.1 -1,-0.2 0.842 116.9 52.1 -77.0 -37.7 -31.9 -12.8 -3.8 150 178 A S H < S+ 0 0 0 -4,-2.8 2,-0.6 -5,-0.3 -2,-0.2 0.849 109.9 46.9 -76.2 -36.9 -28.1 -12.8 -3.6 151 179 A Y < + 0 0 3 -4,-2.1 -1,-0.2 -5,-0.2 74,-0.0 -0.930 60.6 178.2-104.8 113.8 -27.8 -14.3 -0.1 152 180 A V S S+ 0 0 16 -2,-0.6 -1,-0.1 74,-0.2 73,-0.1 0.749 84.3 5.4 -82.2 -24.0 -30.0 -17.3 0.4 153 181 A A S S+ 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191 A W >> - 0 0 16 1,-0.1 4,-2.2 -3,-0.1 3,-0.8 -0.562 49.5-123.5 -73.2 139.6 -39.4 -7.1 7.4 164 192 A M H 3> S+ 0 0 39 1,-0.3 4,-1.9 -2,-0.2 5,-0.1 0.856 111.3 53.4 -49.2 -42.3 -42.7 -5.2 7.8 165 193 A N H 3> S+ 0 0 63 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.835 109.6 46.8 -69.3 -30.8 -44.4 -8.3 9.2 166 194 A D H <> S+ 0 0 6 -3,-0.8 4,-1.1 2,-0.2 3,-0.4 0.834 108.9 56.3 -75.7 -34.7 -41.8 -8.8 11.9 167 195 A I H < S+ 0 0 4 -4,-2.2 3,-0.3 1,-0.2 -2,-0.2 0.895 108.4 48.0 -59.5 -40.8 -42.0 -5.1 12.7 168 196 A Q H < S+ 0 0 91 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.627 114.9 44.0 -80.1 -15.0 -45.7 -5.5 13.3 169 197 A N H < S+ 0 0 39 -4,-0.6 -1,-0.2 -3,-0.4 -2,-0.2 0.505 86.3 116.9-103.8 -8.5 -45.3 -8.6 15.5 170 198 A M < - 0 0 14 -4,-1.1 2,-0.2 -3,-0.3 -126,-0.1 -0.309 49.9-156.4 -62.5 141.0 -42.4 -7.3 17.5 171 199 A T > - 0 0 62 1,-0.1 4,-1.0 -48,-0.0 3,-0.1 -0.732 30.0-111.7-114.9 167.6 -43.1 -6.9 21.3 172 200 A A H > S+ 0 0 4 -2,-0.2 4,-2.0 1,-0.2 3,-0.3 0.863 119.3 57.4 -62.6 -36.8 -41.6 -4.7 24.0 173 201 A Q H > S+ 0 0 94 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.853 97.0 61.9 -64.0 -35.3 -40.2 -7.9 25.6 174 202 A D H > S+ 0 0 28 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.893 107.5 44.8 -54.1 -42.0 -38.4 -8.6 22.3 175 203 A V H X S+ 0 0 0 -4,-1.0 4,-2.7 -3,-0.3 -2,-0.2 0.876 111.4 51.4 -71.9 -39.9 -36.5 -5.4 22.9 176 204 A R H X S+ 0 0 70 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.947 111.5 48.7 -59.4 -47.6 -35.9 -6.1 26.6 177 205 A D H X S+ 0 0 88 -4,-3.1 4,-2.1 2,-0.2 -2,-0.2 0.929 113.2 46.3 -57.2 -49.4 -34.5 -9.5 25.6 178 206 A W H X S+ 0 0 20 -4,-2.1 4,-2.6 -5,-0.2 5,-0.3 0.929 114.0 48.1 -59.4 -49.6 -32.2 -8.0 22.9 179 207 A Y H X S+ 0 0 28 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.884 112.3 49.0 -57.1 -44.6 -31.0 -5.2 25.2 180 208 A K H < S+ 0 0 159 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.870 116.0 43.8 -67.3 -37.8 -30.2 -7.7 28.0 181 209 A R H < S+ 0 0 131 -4,-2.1 -2,-0.2 -5,-0.2 3,-0.2 0.926 126.2 22.3 -72.8 -47.6 -28.3 -10.0 25.8 182 210 A W H < S+ 0 0 9 -4,-2.6 2,-0.5 -5,-0.2 -148,-0.2 0.568 100.6 78.6-106.8 -11.0 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G T 3 S+ 0 0 88 1,-0.3 2,-0.5 -3,-0.1 -1,-0.3 0.586 96.6 115.3 81.6 9.5 -34.5 5.0 -24.6 320 348 A V < - 0 0 27 -3,-2.1 -1,-0.3 -29,-0.1 2,-0.1 -0.960 62.8-133.7-108.0 125.6 -31.8 2.7 -23.2 321 349 A T > - 0 0 89 -2,-0.5 4,-2.1 1,-0.1 5,-0.1 -0.358 16.6-120.0 -75.2 159.5 -33.1 -0.7 -22.2 322 350 A I H > S+ 0 0 51 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.826 117.6 54.7 -66.3 -28.7 -32.3 -2.3 -18.8 323 351 A A H > S+ 0 0 59 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.854 107.3 48.4 -70.2 -39.3 -30.7 -5.1 -20.9 324 352 A Q H > S+ 0 0 73 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.879 110.3 52.4 -67.7 -38.8 -28.5 -2.7 -22.8 325 353 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.852 106.8 52.2 -65.9 -37.3 -27.4 -1.0 -19.6 326 354 A E H X S+ 0 0 20 -4,-1.7 4,-2.9 2,-0.2 5,-0.2 0.931 109.2 50.5 -63.3 -45.1 -26.4 -4.4 -18.1 327 355 A T H X S+ 0 0 83 -4,-1.8 4,-1.7 1,-0.2 -2,-0.2 0.902 110.9 50.0 -55.9 -42.8 -24.4 -5.0 -21.2 328 356 A D H X S+ 0 0 18 -4,-2.1 4,-1.2 2,-0.2 -2,-0.2 0.909 112.4 45.7 -64.5 -43.9 -22.8 -1.6 -20.7 329 357 A L H X S+ 0 0 0 -4,-2.6 4,-0.8 1,-0.2 3,-0.3 0.913 113.9 48.2 -67.1 -42.3 -22.0 -2.3 -17.0 330 358 A R H X S+ 0 0 33 -4,-2.9 4,-2.8 1,-0.2 -1,-0.2 0.803 103.7 61.7 -69.9 -27.9 -20.5 -5.7 -17.7 331 359 A A H X S+ 0 0 43 -4,-1.7 4,-3.2 -5,-0.2 -1,-0.2 0.870 97.3 58.3 -63.9 -36.8 -18.4 -4.4 -20.6 332 360 A Q H X S+ 0 0 11 -4,-1.2 4,-1.1 -3,-0.3 -1,-0.2 0.853 112.2 41.6 -57.4 -36.8 -16.6 -2.1 -18.0 333 361 A V H X S+ 0 0 1 -4,-0.8 4,-1.7 -3,-0.2 -2,-0.2 0.883 114.9 49.5 -77.4 -42.9 -15.7 -5.4 -16.3 334 362 A R H X S+ 0 0 107 -4,-2.8 4,-1.4 1,-0.2 -2,-0.2 0.848 106.5 58.3 -64.2 -35.9 -14.9 -7.2 -19.5 335 363 A D H X S+ 0 0 35 -4,-3.2 4,-2.8 1,-0.2 5,-0.3 0.906 109.5 41.6 -62.9 -46.1 -12.7 -4.4 -20.7 336 364 A I H X S+ 0 0 0 -4,-1.1 4,-1.9 2,-0.2 -1,-0.2 0.834 110.5 56.7 -72.6 -34.2 -10.4 -4.5 -17.7 337 365 A A H < S+ 0 0 17 -4,-1.7 -1,-0.2 66,-0.2 -2,-0.2 0.801 118.8 34.3 -65.8 -28.7 -10.3 -8.3 -17.7 338 366 A A H < S+ 0 0 65 -4,-1.4 -2,-0.2 -5,-0.1 -1,-0.2 0.869 135.6 19.7 -91.4 -44.0 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387 A Y H >X S+ 0 0 180 -4,-1.1 3,-2.0 1,-0.2 4,-0.7 0.957 102.7 47.2 -47.6 -62.4 -10.2 14.1 4.3 360 388 A E T 3< S+ 0 0 62 -4,-1.5 7,-0.5 1,-0.3 -1,-0.2 0.671 100.6 72.3 -58.4 -17.3 -11.9 12.2 7.2 361 389 A Q T <4 S+ 0 0 51 -3,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.642 94.5 49.1 -77.6 -17.0 -8.7 12.7 9.2 362 390 A D T <4 S+ 0 0 114 -3,-2.0 2,-0.3 -4,-0.5 -1,-0.2 0.697 99.5 81.6 -90.6 -22.9 -9.2 16.4 9.8 363 391 A S S X S- 0 0 48 -4,-0.7 4,-2.0 1,-0.1 5,-0.1 -0.602 73.2-145.3 -81.7 139.9 -12.8 15.8 10.9 364 392 A L H > S+ 0 0 28 -2,-0.3 4,-2.2 2,-0.2 5,-0.1 0.915 103.8 46.7 -69.2 -42.8 -13.4 14.7 14.5 365 393 A M H > S+ 0 0 47 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.893 110.5 53.8 -67.2 -40.7 -16.4 12.6 13.5 366 394 A G H > S+ 0 0 13 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.943 110.2 46.1 -54.1 -52.3 -14.4 11.1 10.6 367 395 A Q H X S+ 0 0 14 -4,-2.0 4,-2.1 -7,-0.5 -2,-0.2 0.896 113.4 49.4 -61.3 -42.5 -11.6 10.0 12.9 368 396 A A H X S+ 0 0 0 -4,-2.2 4,-3.2 2,-0.2 5,-0.2 0.897 112.0 46.3 -63.5 -44.0 -14.0 8.5 15.5 369 397 A T H X S+ 0 0 57 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.885 109.8 56.4 -69.8 -38.2 -15.9 6.5 12.9 370 398 A Q H X S+ 0 0 23 -4,-2.3 4,-0.8 -5,-0.3 -2,-0.2 0.931 113.4 40.0 -51.8 -50.8 -12.6 5.4 11.4 371 399 A I H >X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 3,-1.1 0.972 118.7 44.5 -66.3 -54.3 -11.6 4.0 14.9 372 400 A G H 3X S+ 0 0 0 -4,-3.2 4,-2.3 1,-0.3 5,-0.2 0.834 104.8 64.9 -60.9 -34.1 -15.0 2.6 15.8 373 401 A G H 3< S+ 0 0 24 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.768 112.2 33.3 -60.9 -29.8 -15.4 1.0 12.4 374 402 A L H X<>S+ 0 0 12 -3,-1.1 5,-1.9 -4,-0.8 3,-1.0 0.836 115.6 54.4 -93.1 -42.9 -12.5 -1.3 12.9 375 403 A E H ><5S+ 0 0 11 -4,-2.3 3,-1.8 1,-0.3 -2,-0.2 0.893 103.8 55.8 -59.5 -41.8 -12.7 -1.9 16.6 376 404 A V T 3<5S+ 0 0 2 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.1 0.677 104.3 56.0 -67.8 -16.9 -16.4 -3.1 16.4 377 405 A L T < 5S- 0 0 29 -3,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.439 123.5-103.9 -89.3 -3.9 -15.2 -5.7 13.8 378 406 A G T < 5S+ 0 0 62 -3,-1.8 -3,-0.2 1,-0.4 -2,-0.1 0.374 89.0 116.5 90.2 -2.7 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H X S+ 0 0 0 -4,-2.0 4,-3.0 -5,-0.2 5,-0.3 0.941 110.3 49.4 -68.5 -46.2 -47.7 -45.8 23.9 526 131 B G H X S+ 0 0 31 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.939 114.4 45.4 -51.6 -50.8 -45.5 -46.4 26.9 527 132 B L H X S+ 0 0 9 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.892 115.5 45.0 -63.5 -43.2 -42.4 -46.0 24.6 528 133 B E H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.903 113.8 49.0 -72.1 -38.7 -43.7 -42.8 22.9 529 134 B A H X S+ 0 0 6 -4,-3.0 4,-0.8 2,-0.2 5,-0.2 0.889 112.3 49.5 -64.2 -40.5 -44.8 -41.2 26.2 530 135 B D H >X S+ 0 0 23 -4,-2.3 4,-2.9 -5,-0.3 3,-1.1 0.952 113.6 46.3 -57.0 -51.1 -41.4 -42.1 27.7 531 136 B R H 3X S+ 0 0 4 -4,-2.4 4,-0.5 1,-0.2 -2,-0.2 0.756 103.5 64.4 -65.0 -29.1 -39.8 -40.5 24.6 532 137 B M H 3< S+ 0 0 3 -4,-1.8 -1,-0.2 1,-0.1 -2,-0.2 0.763 123.0 12.6 -66.5 -26.0 -42.0 -37.4 24.8 533 138 B A H << S+ 0 0 51 -3,-1.1 -2,-0.2 -4,-0.8 -1,-0.1 0.650 124.5 49.9-124.1 -25.5 -40.6 -36.4 28.2 534 139 B N H < + 0 0 83 -4,-2.9 -51,-0.5 -5,-0.2 -3,-0.2 0.239 64.2 141.7-113.5 13.1 -37.4 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45.8 -65.1 -53.5 -21.7 -38.7 15.5 545 150 B E H 3X S+ 0 0 22 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.850 104.7 61.7 -62.9 -36.9 -25.3 -38.2 14.3 546 151 B I H 3X S+ 0 0 13 -4,-3.1 4,-1.5 1,-0.2 -1,-0.2 0.853 105.0 48.0 -58.2 -35.8 -24.7 -34.6 13.2 547 152 B Q H S+ 0 0 11 -4,-1.2 5,-2.6 3,-0.2 6,-0.3 0.877 110.1 50.1 -75.1 -39.9 -27.5 -33.7 2.9 554 159 B R H <5S+ 0 0 98 -4,-1.7 5,-0.4 3,-0.2 -2,-0.2 0.907 118.8 38.3 -63.5 -43.9 -24.6 -34.4 0.4 555 160 B W H <5S+ 0 0 169 -4,-2.7 4,-0.3 3,-0.2 -2,-0.2 0.940 127.2 29.8 -72.5 -50.3 -26.2 -37.6 -0.8 556 161 B R T <5S+ 0 0 123 -4,-2.0 -3,-0.2 -5,-0.2 7,-0.2 0.978 131.3 17.4 -77.7 -83.7 -29.9 -36.6 -0.9 557 162 B T T > 5S+ 0 0 24 -5,-0.4 3,-0.5 1,-0.2 -3,-0.2 0.805 127.7 50.1 -65.1 -33.9 -30.5 -32.9 -1.5 558 163 B D T 3 S- 0 0 125 -3,-0.5 3,-2.3 1,-0.2 4,-0.7 -0.721 70.0-137.9-151.4 100.5 -30.4 -35.5 -6.8 561 166 B P H 3> S+ 0 0 46 0, 0.0 4,-1.6 0, 0.0 3,-0.5 0.599 95.8 49.0 -18.1 -74.4 -31.9 -33.1 -9.5 562 167 B R H 3> S+ 0 0 126 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.771 112.2 53.2 -50.7 -29.8 -35.5 -32.4 -8.4 563 168 B S H <> S+ 0 0 52 -3,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.913 104.7 49.1 -75.2 -45.3 -34.3 -31.5 -4.9 564 169 B K H X S+ 0 0 53 -4,-0.7 4,-2.0 -3,-0.5 -2,-0.2 0.872 113.2 47.5 -67.1 -36.9 -31.6 -28.9 -5.6 565 170 B A H X S+ 0 0 0 -4,-1.6 4,-2.9 2,-0.2 -1,-0.2 0.890 110.9 52.3 -68.5 -40.3 -33.8 -26.9 -7.9 566 171 B Y H X S+ 0 0 51 -4,-1.3 4,-2.9 -5,-0.3 5,-0.3 0.905 108.4 50.3 -61.9 -44.2 -36.6 -27.1 -5.3 567 172 B E H X S+ 0 0 36 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.930 114.3 44.7 -57.2 -47.4 -34.3 -25.7 -2.6 568 173 B A H X S+ 0 0 15 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.902 113.5 51.5 -62.6 -40.8 -33.3 -22.9 -5.0 569 174 B L H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 3,-0.2 0.921 112.9 43.0 -64.0 -47.5 -37.0 -22.3 -5.9 570 175 B M H X S+ 0 0 25 -4,-2.9 4,-1.7 1,-0.2 -1,-0.2 0.876 112.5 53.3 -67.6 -38.5 -38.2 -22.1 -2.4 571 176 B A H < S+ 0 0 3 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.745 117.7 37.4 -69.6 -23.5 -35.2 -19.9 -1.3 572 177 B A H < S+ 0 0 23 -4,-1.2 -2,-0.2 -3,-0.2 -1,-0.2 0.819 113.4 53.1 -94.6 -38.0 -35.9 -17.4 -4.1 573 178 B S H < S+ 0 0 0 -4,-2.5 2,-0.6 1,-0.2 -2,-0.2 0.836 110.6 50.1 -71.2 -35.5 -39.7 -17.4 -4.1 574 179 B Y < + 0 0 3 -4,-1.7 -1,-0.2 -5,-0.2 74,-0.0 -0.917 60.9 179.7-107.0 111.9 -40.0 -16.7 -0.4 575 180 B V S S+ 0 0 15 -2,-0.6 -1,-0.1 74,-0.2 73,-0.1 0.768 84.6 0.8 -77.2 -24.5 -37.8 -13.7 0.6 576 181 B A S S+ 0 0 10 73,-0.1 72,-0.1 71,-0.1 -533,-0.1 0.627 96.1 105.6-136.4 -35.4 -38.8 -13.9 4.3 577 182 B H S > S- 0 0 3 1,-0.2 3,-2.9 72,-0.1 4,-0.1 -0.387 72.0-125.4 -64.5 130.8 -41.3 -16.7 5.1 578 183 B P G > S+ 0 0 4 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.617 104.0 80.7 -52.2 -15.6 -39.6 -19.6 7.0 579 184 B Y G 3 S+ 0 0 3 1,-0.3 4,-0.1 -118,-0.1 -2,-0.1 0.695 76.9 75.6 -62.6 -17.8 -40.9 -21.9 4.3 580 185 B R G < S+ 0 0 12 -3,-2.9 -1,-0.3 -9,-0.1 -6,-0.1 0.675 80.0 84.2 -66.8 -20.2 -37.9 -20.7 2.3 581 186 B V S < S- 0 0 18 -3,-1.6 2,-0.1 -4,-0.1 -121,-0.1 -0.701 86.2-116.0 -91.9 132.7 -35.5 -22.8 4.3 582 187 B P > - 0 0 22 0, 0.0 3,-1.7 0, 0.0 -113,-0.1 -0.451 25.7-121.2 -66.6 142.8 -34.9 -26.5 3.4 583 188 B V T 3 S+ 0 0 38 1,-0.3 -111,-0.4 -2,-0.1 -114,-0.2 0.812 110.9 54.5 -55.8 -38.6 -36.1 -28.9 6.1 584 189 B I T 3 S- 0 0 10 1,-0.2 -1,-0.3 -112,-0.1 -31,-0.1 0.715 113.3-122.5 -71.2 -19.2 -32.7 -30.5 6.6 585 190 B G < - 0 0 0 -3,-1.7 2,-0.2 -116,-0.1 -1,-0.2 -0.027 32.9 -56.9 97.2 156.3 -31.2 -27.1 7.2 586 191 B W >> - 0 0 13 1,-0.1 4,-2.0 -3,-0.1 3,-1.0 -0.493 51.1-120.1 -64.8 139.6 -28.4 -25.1 5.5 587 192 B M H 3> S+ 0 0 41 1,-0.3 4,-2.2 2,-0.2 3,-0.3 0.913 112.8 54.6 -45.5 -53.2 -25.1 -27.0 5.6 588 193 B N H 3> S+ 0 0 53 1,-0.2 4,-0.8 2,-0.2 -1,-0.3 0.812 108.5 48.8 -57.0 -31.8 -23.4 -24.2 7.6 589 194 B D H <> S+ 0 0 6 -3,-1.0 4,-0.7 2,-0.2 -1,-0.2 0.845 107.2 54.7 -77.5 -34.0 -26.0 -24.4 10.3 590 195 B I H >< S+ 0 0 2 -4,-2.0 3,-0.6 -3,-0.3 -2,-0.2 0.900 108.6 50.3 -61.0 -40.0 -25.7 -28.2 10.4 591 196 B Q H 3< S+ 0 0 82 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.734 113.5 44.7 -70.0 -24.9 -22.0 -27.7 11.1 592 197 B N H 3< S+ 0 0 24 -4,-0.8 -1,-0.2 -5,-0.2 -2,-0.2 0.462 86.1 120.3 -99.3 -2.2 -22.6 -25.2 13.8 593 198 B M << - 0 0 15 -4,-0.7 2,-0.3 -3,-0.6 -126,-0.1 -0.311 47.1-154.4 -69.7 145.4 -25.4 -27.1 15.6 594 199 B T >> - 0 0 54 1,-0.1 4,-1.4 -48,-0.0 3,-0.6 -0.879 28.3-120.1-119.6 152.8 -24.9 -28.1 19.2 595 200 B A H 3> S+ 0 0 5 -2,-0.3 4,-1.7 1,-0.2 3,-0.1 0.874 117.7 57.6 -50.2 -39.8 -26.3 -31.0 21.4 596 201 B Q H 3> S+ 0 0 93 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.837 96.9 59.6 -63.2 -37.8 -27.6 -28.1 23.6 597 202 B D H <> S+ 0 0 29 -3,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.922 107.0 48.2 -55.7 -44.4 -29.6 -26.6 20.6 598 203 B V H X S+ 0 0 0 -4,-1.4 4,-2.9 2,-0.2 -2,-0.2 0.894 109.7 51.5 -62.8 -42.7 -31.4 -29.9 20.4 599 204 B R H X S+ 0 0 64 -4,-1.7 4,-2.6 1,-0.2 5,-0.2 0.904 110.4 49.3 -60.4 -43.8 -32.1 -30.0 24.1 600 205 B D H X S+ 0 0 91 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.905 113.3 47.1 -61.2 -43.5 -33.5 -26.4 23.9 601 206 B W H X S+ 0 0 19 -4,-2.1 4,-2.3 -5,-0.2 5,-0.3 0.928 114.5 45.6 -64.3 -48.8 -35.7 -27.4 21.0 602 207 B Y H X S+ 0 0 23 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.914 112.6 49.1 -63.0 -47.2 -37.0 -30.6 22.6 603 208 B K H < S+ 0 0 165 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.849 116.7 44.5 -63.3 -33.3 -37.7 -29.0 26.0 604 209 B R H < S+ 0 0 123 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.868 127.5 20.8 -77.8 -39.5 -39.6 -26.2 24.2 605 210 B W H < S+ 0 0 9 -4,-2.3 2,-1.2 1,-0.1 -3,-0.2 0.688 99.8 83.2-111.1 -21.8 -41.7 -28.1 21.7 606 211 B Y < + 0 0 5 -4,-2.2 -1,-0.1 -5,-0.3 5,-0.1 -0.672 61.7 112.5 -97.9 86.6 -42.1 -31.7 22.7 607 212 B G S > S- 0 0 2 -2,-1.2 3,-1.9 31,-0.1 30,-0.1 -0.946 77.2 -99.6-147.5 165.4 -44.9 -31.9 25.2 608 213 B P G > S+ 0 0 2 0, 0.0 3,-1.7 0, 0.0 -170,-0.3 0.856 117.2 59.3 -59.3 -36.1 -48.4 -33.3 25.4 609 214 B N G 3 S+ 0 0 42 1,-0.3 -173,-0.1 -172,-0.1 28,-0.1 0.389 107.4 47.7 -76.6 4.8 -50.1 -30.0 24.7 610 215 B N G < S+ 0 0 9 -3,-1.9 -153,-2.5 -5,-0.0 2,-0.3 0.134 103.6 81.1-125.4 15.9 -48.3 -29.8 21.4 611 216 B A E < - S 0 456D 5 -3,-1.7 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111.5 46.5 -60.7 -52.1 -45.0 -24.7 -23.2 752 357 B L H 3X S+ 0 0 0 -4,-3.1 4,-0.9 1,-0.3 3,-0.3 0.898 113.0 49.2 -59.7 -43.0 -45.9 -24.9 -19.5 753 358 B R H 3X S+ 0 0 33 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.3 0.579 102.3 64.0 -75.6 -9.0 -47.3 -21.4 -19.5 754 359 B A H S+ 0 0 51 -4,-3.0 4,-3.4 2,-0.2 5,-0.7 0.960 112.3 43.6 -58.2 -52.6 -55.2 -22.0 -22.9 759 364 B I H X5S+ 0 0 0 -4,-1.5 4,-1.0 1,-0.2 -2,-0.2 0.850 110.9 55.6 -63.5 -36.4 -57.4 -22.6 -19.8 760 365 B A H <5S+ 0 0 17 -4,-2.1 -1,-0.2 66,-0.2 -2,-0.2 0.830 120.2 30.6 -65.4 -31.9 -57.5 -18.9 -19.0 761 366 B A H <5S+ 0 0 70 -4,-1.6 -2,-0.2 -3,-0.4 -3,-0.2 0.833 135.9 22.2 -95.6 -39.0 -58.9 -18.1 -22.5 762 367 B K H <5S- 0 0 166 -4,-3.4 -3,-0.2 -5,-0.2 -2,-0.1 0.670 89.9-156.6-103.7 -24.7 -60.9 -21.2 -23.5 763 368 B G << - 0 0 11 -4,-1.0 2,-0.3 -5,-0.7 -1,-0.2 -0.391 29.9 -66.5 79.0-160.5 -61.7 -22.7 -20.0 764 369 B V - 0 0 17 55,-0.1 2,-0.1 -2,-0.1 59,-0.1 -0.947 44.0-111.4-127.0 151.3 -62.5 -26.4 -19.5 765 370 B T > - 0 0 84 -2,-0.3 4,-2.7 1,-0.1 5,-0.2 -0.493 26.8-118.5 -76.5 152.4 -65.5 -28.4 -20.7 766 371 B E H > S+ 0 0 129 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.870 116.2 55.2 -57.1 -37.5 -68.0 -29.7 -18.1 767 372 B A H > S+ 0 0 60 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.939 108.9 46.4 -62.1 -47.4 -67.1 -33.2 -19.2 768 373 B E H > S+ 0 0 17 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.952 113.1 49.5 -57.3 -50.8 -63.4 -32.6 -18.5 769 374 B L H X S+ 0 0 4 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.915 112.7 47.4 -56.3 -44.5 -64.2 -31.0 -15.2 770 375 B S H X S+ 0 0 78 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.878 110.7 51.7 -66.5 -39.8 -66.4 -34.0 -14.2 771 376 B R H X S+ 0 0 127 -4,-2.8 4,-1.5 -5,-0.2 -2,-0.2 0.952 111.0 48.7 -54.9 -51.7 -63.7 -36.5 -15.3 772 377 B V H X S+ 0 0 2 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.869 110.3 49.1 -63.1 -42.4 -61.1 -34.7 -13.2 773 378 B K H X S+ 0 0 32 -4,-2.2 4,-2.2 1,-0.2 5,-0.2 0.959 108.1 55.7 -59.5 -48.9 -63.3 -34.6 -10.1 774 379 B S H X S+ 0 0 69 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.801 108.2 47.8 -54.5 -34.6 -64.1 -38.3 -10.5 775 380 B Q H X S+ 0 0 88 -4,-1.5 4,-3.3 2,-0.2 5,-0.2 0.917 108.7 53.5 -73.0 -43.0 -60.3 -39.1 -10.5 776 381 B M H < S+ 0 0 48 -4,-2.0 4,-0.4 1,-0.2 -2,-0.2 0.862 112.2 45.8 -57.4 -39.4 -59.6 -37.0 -7.4 777 382 B V H X S+ 0 0 58 -4,-2.2 4,-1.0 2,-0.2 3,-0.3 0.888 113.6 48.0 -71.2 -41.9 -62.4 -38.9 -5.6 778 383 B A H >X S+ 0 0 48 -4,-1.8 4,-0.8 1,-0.2 3,-0.7 0.917 110.5 51.3 -65.2 -44.2 -61.1 -42.3 -6.8 779 384 B G H 3X S+ 0 0 53 -4,-3.3 4,-0.6 1,-0.2 -1,-0.2 0.654 105.5 59.0 -65.8 -16.4 -57.5 -41.4 -5.8 780 385 B K H 3> S+ 0 0 19 -4,-0.4 4,-1.6 -3,-0.3 3,-0.3 0.776 93.1 64.9 -79.9 -30.6 -59.0 -40.4 -2.4 781 386 B V H X S+ 0 0 191 -4,-0.8 4,-1.4 2,-0.2 3,-0.9 0.940 102.6 45.6 -55.0 -51.8 -56.8 -45.3 -1.8 783 388 B E H 3< S+ 0 0 73 -4,-0.6 7,-0.4 -3,-0.3 -2,-0.2 0.934 109.5 54.9 -57.8 -48.5 -56.0 -43.4 1.4 784 389 B Q H 3< S+ 0 0 87 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.671 104.9 58.9 -58.4 -19.3 -59.3 -44.5 3.0 785 390 B D H << S+ 0 0 95 -3,-0.9 -1,-0.2 -4,-0.9 -2,-0.2 0.954 96.6 61.3 -76.4 -54.5 -58.2 -48.1 2.2 786 391 B S S X S- 0 0 55 -4,-1.4 4,-1.5 -3,-0.2 5,-0.1 -0.272 74.0-133.9 -76.4 158.1 -54.9 -48.3 4.1 787 392 B L H > S+ 0 0 27 2,-0.2 4,-2.7 3,-0.1 5,-0.2 0.915 110.7 48.7 -71.9 -45.6 -54.4 -48.0 7.9 788 393 B M H > S+ 0 0 46 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.915 111.3 50.6 -59.4 -44.5 -51.4 -45.7 7.3 789 394 B G H > S+ 0 0 12 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.890 111.7 46.3 -62.5 -44.6 -53.4 -43.6 4.8 790 395 B Q H X S+ 0 0 18 -4,-1.5 4,-1.8 -7,-0.4 -1,-0.2 0.915 115.3 47.4 -62.1 -43.4 -56.3 -43.2 7.2 791 396 B A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.891 112.3 49.4 -65.5 -40.9 -53.9 -42.3 10.1 792 397 B T H X S+ 0 0 51 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.893 108.4 53.5 -66.1 -40.7 -52.0 -39.9 7.9 793 398 B Q H X S+ 0 0 22 -4,-2.3 4,-1.3 -5,-0.2 -1,-0.2 0.920 113.1 43.8 -56.4 -47.9 -55.2 -38.2 6.8 794 399 B I H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 3,-0.3 0.948 118.0 41.6 -66.4 -52.9 -56.3 -37.6 10.4 795 400 B G H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.912 108.9 60.1 -62.9 -45.9 -52.9 -36.4 11.8 796 401 B G H < S+ 0 0 22 -4,-2.7 -1,-0.2 -5,-0.2 4,-0.2 0.848 114.2 37.2 -48.2 -39.9 -52.3 -34.3 8.7 797 402 B L H ><>S+ 0 0 10 -4,-1.3 5,-1.6 -3,-0.3 3,-1.1 0.914 115.8 51.2 -79.7 -44.9 -55.4 -32.3 9.5 798 403 B E H ><5S+ 0 0 13 -4,-2.6 3,-1.3 1,-0.3 -2,-0.2 0.821 104.3 56.5 -65.1 -34.5 -55.2 -32.3 13.3 799 404 B V T 3<5S+ 0 0 2 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.1 0.616 101.1 59.4 -77.0 -12.0 -51.6 -31.0 13.5 800 405 B L T < 5S- 0 0 34 -3,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.507 124.8-102.2 -86.3 -7.5 -52.7 -28.0 11.4 801 406 B G T < 5S+ 0 0 62 -3,-1.3 -3,-0.2 1,-0.4 -2,-0.1 0.328 90.8 112.1 97.2 -4.1 -55.2 -27.0 14.1 802 407 B L < - 0 0 50 -5,-1.6 -1,-0.4 -6,-0.1 2,-0.4 -0.261 67.9-106.5 -92.2-178.4 -58.1 -28.4 12.0 803 408 B S > - 0 0 12 1,-0.1 3,-2.7 -3,-0.1 4,-0.3 -0.880 16.1-124.8-114.6 145.4 -60.3 -31.5 12.7 804 409 B W T > S+ 0 0 25 -2,-0.4 3,-1.5 1,-0.3 4,-0.3 0.828 113.0 65.0 -51.0 -33.3 -60.3 -34.9 10.9 805 410 B R T >> S+ 0 0 124 1,-0.3 3,-1.0 2,-0.1 4,-0.7 0.662 84.4 76.1 -62.9 -17.7 -64.0 -34.2 10.3 806 411 B D H <> S+ 0 0 16 -3,-2.7 4,-2.7 1,-0.2 -1,-0.3 0.685 73.5 77.8 -72.4 -18.0 -62.9 -31.3 8.0 807 412 B D H <> S+ 0 0 11 -3,-1.5 4,-2.5 -4,-0.3 -1,-0.2 0.865 93.8 52.1 -56.8 -36.4 -61.9 -33.6 5.2 808 413 B D H <> S+ 0 0 110 -3,-1.0 4,-1.8 -4,-0.3 -1,-0.2 0.934 110.0 44.8 -67.8 -49.4 -65.6 -33.9 4.4 809 414 B R H X S+ 0 0 94 -4,-0.7 4,-1.8 1,-0.2 -2,-0.2 0.926 113.8 54.2 -56.7 -45.1 -66.3 -30.2 4.2 810 415 B F H X S+ 0 0 14 -4,-2.7 4,-2.0 1,-0.2 3,-0.3 0.930 109.9 44.1 -56.5 -51.7 -63.1 -29.9 2.2 811 416 B Y H X S+ 0 0 49 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.773 109.5 56.3 -69.9 -25.7 -64.1 -32.5 -0.4 812 417 B Q H < S+ 0 0 130 -4,-1.8 4,-0.4 2,-0.2 -1,-0.2 0.813 108.6 48.3 -73.5 -30.3 -67.6 -31.1 -0.7 813 418 B Q H >X S+ 0 0 34 -4,-1.8 3,-0.8 -3,-0.3 4,-0.5 0.879 106.2 58.3 -72.8 -39.7 -66.0 -27.8 -1.6 814 419 B L H >< S+ 0 0 7 -4,-2.0 3,-0.6 1,-0.2 -2,-0.2 0.862 108.5 44.6 -54.6 -41.3 -63.7 -29.4 -4.2 815 420 B R T 3< S+ 0 0 117 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.524 103.9 62.8 -90.3 -1.8 -66.7 -30.9 -6.1 816 421 B S T <4 S+ 0 0 49 -3,-0.8 -1,-0.2 -4,-0.4 -2,-0.2 0.535 76.6 120.8 -88.8 -9.1 -68.6 -27.6 -6.0 817 422 B V << - 0 0 1 -3,-0.6 2,-0.1 -4,-0.5 -3,-0.0 -0.323 55.1-145.8 -58.6 130.5 -65.8 -26.0 -8.0 818 423 B T > - 0 0 62 1,-0.1 4,-1.6 -2,-0.0 5,-0.1 -0.473 22.6-114.0 -97.8 167.3 -67.2 -24.7 -11.3 819 424 B A H > S+ 0 0 13 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.920 117.4 57.0 -60.7 -44.6 -65.7 -24.4 -14.8 820 425 B A H > S+ 0 0 70 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.903 106.1 49.2 -54.5 -45.4 -65.8 -20.6 -14.5 821 426 B E H > S+ 0 0 47 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.871 108.9 51.5 -64.7 -39.3 -63.7 -20.7 -11.3 822 427 B V H X S+ 0 0 0 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.914 113.0 46.5 -63.7 -42.5 -61.1 -23.0 -12.9 823 428 B K H X S+ 0 0 84 -4,-2.5 4,-1.4 1,-0.2 3,-0.3 0.939 112.9 48.4 -60.9 -49.7 -60.9 -20.6 -15.8 824 429 B A H < S+ 0 0 58 -4,-2.8 4,-0.5 1,-0.2 -1,-0.2 0.737 107.3 56.9 -65.3 -26.0 -60.6 -17.6 -13.5 825 430 B A H >< S+ 0 0 1 -4,-1.7 3,-0.8 1,-0.2 4,-0.3 0.851 104.3 52.3 -72.1 -37.9 -57.9 -19.3 -11.5 826 431 B A H >< S+ 0 0 0 -4,-1.5 3,-1.8 -3,-0.3 4,-0.3 0.852 99.1 64.9 -64.4 -34.4 -55.9 -19.7 -14.6 827 432 B A G >< S+ 0 0 52 -4,-1.4 3,-0.6 1,-0.3 4,-0.3 0.725 94.9 58.4 -64.3 -21.8 -56.2 -15.9 -15.3 828 433 B R G < S+ 0 0 87 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.617 101.7 56.5 -81.1 -12.0 -54.2 -15.2 -12.1 829 434 B L G < S+ 0 0 2 -3,-1.8 -1,-0.2 -4,-0.3 -2,-0.2 0.416 81.8 87.1 -99.1 -1.9 -51.3 -17.2 -13.5 830 435 B L S < S+ 0 0 75 -3,-0.6 -1,-0.2 -4,-0.3 -2,-0.1 0.914 79.5 71.1 -60.5 -46.4 -51.0 -15.1 -16.7 831 436 B T - 0 0 54 -4,-0.3 3,-0.1 -3,-0.1 -3,-0.0 -0.216 67.8-149.4 -70.2 159.7 -48.7 -12.6 -15.1 832 437 B D S > S+ 0 0 57 1,-0.1 3,-1.1 2,-0.1 -179,-0.1 0.252 74.9 100.7-107.0 9.4 -45.1 -13.2 -14.1 833 438 B D T 3 S+ 0 0 42 1,-0.3 -180,-2.5 -180,-0.2 -1,-0.1 0.825 94.6 31.2 -61.3 -31.6 -45.3 -10.7 -11.2 834 439 B T T 3 S+ 0 0 17 -182,-0.2 -161,-1.6 -3,-0.1 2,-0.4 0.181 100.5 113.5-112.3 14.0 -45.7 -13.6 -8.7 835 440 B L E < - M 0 672C 0 -3,-1.1 -180,-2.2 -163,-0.2 2,-0.5 -0.732 42.2-171.2 -98.4 132.7 -43.6 -16.1 -10.6 836 441 B T E -lM 655 671C 0 -165,-2.5 -165,-2.2 -2,-0.4 2,-0.6 -0.991 10.5-161.0-114.9 127.8 -40.3 -17.7 -9.6 837 442 B V E -lM 656 670C 3 -182,-3.2 -180,-3.0 -2,-0.5 2,-0.5 -0.945 8.6-176.2-112.1 119.0 -38.5 -19.7 -12.3 838 443 B A E -lM 657 669C 0 -169,-2.3 -169,-2.7 -2,-0.6 2,-0.4 -0.955 2.5-177.4-114.6 131.0 -35.9 -22.2 -11.2 839 444 B N E -lM 658 668C 21 -182,-2.3 -180,-2.8 -2,-0.5 2,-0.5 -0.981 17.2-145.5-128.4 141.6 -33.8 -24.2 -13.6 840 445 B L E -lM 659 667C 0 -173,-2.9 -173,-1.3 -2,-0.4 -180,-0.2 -0.927 8.5-153.9-105.7 123.9 -31.2 -26.9 -13.1 841 446 B V E -l 660 0C 49 -182,-3.1 -180,-1.6 -2,-0.5 2,-0.3 -0.875 24.5-129.6 -94.0 116.6 -28.3 -27.1 -15.6 842 447 B P E -l 661 0C 43 0, 0.0 -178,-0.1 0, 0.0 -182,-0.1 -0.492 19.2-164.1 -76.3 130.8 -27.0 -30.6 -15.7 843 448 B L E -l 662 0C 76 -182,-1.6 -180,-2.3 -2,-0.3 -178,-0.1 -0.901 40.5 -92.6-103.3 140.7 -23.3 -31.3 -15.3 844 449 B P 0 0 119 0, 0.0 -180,-0.1 0, 0.0 -1,-0.0 -0.317 360.0 360.0 -54.0 127.4 -22.0 -34.8 -16.2 845 450 B P 0 0 116 0, 0.0 -182,-0.0 0, 0.0 -184,-0.0 -0.417 360.0 360.0 -71.4 360.0 -22.0 -37.0 -13.1