==== 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 TRANSFERASE 06-DEC-07 2ZE8 . COMPND 2 MOLECULE: ISOPENTENYL TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AGROBACTERIUM TUMEFACIENS; . AUTHOR H.SAKAKIBARA . 904 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42219.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 655 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 92 10.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 44 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 150 16.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 347 38.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 3 4 0 1 0 5 5 1 4 4 0 0 4 0 0 0 0 0 0 0 1 3 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 2 5 0 8 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 . 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 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 4 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 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 40 0, 0.0 116,-1.2 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 133.2 18.5 5.1 71.0 2 2 A L E -ab 92 117A 26 89,-1.6 91,-3.3 114,-0.2 2,-0.8 -0.603 360.0-160.2 -81.7 131.5 19.5 7.6 68.4 3 3 A L E -ab 93 118A 0 114,-2.8 116,-1.6 -2,-0.3 2,-0.8 -0.897 6.4-166.8-110.9 100.5 23.0 8.5 67.3 4 4 A H E -ab 94 119A 33 89,-2.6 91,-3.2 -2,-0.8 2,-0.5 -0.781 19.2-165.9 -80.7 114.4 23.0 11.8 65.5 5 5 A L E +ab 95 120A 0 114,-1.6 116,-1.4 -2,-0.8 2,-0.4 -0.860 15.2 179.6-114.4 139.0 26.4 11.7 64.0 6 6 A I E +ab 96 121A 0 89,-2.8 91,-1.7 -2,-0.5 2,-0.3 -0.986 14.0 151.8-134.6 123.5 28.1 14.7 62.5 7 7 A Y E +ab 97 122A 4 114,-2.0 116,-2.0 -2,-0.4 91,-0.2 -0.975 6.6 110.9-149.5 172.1 31.5 14.6 61.0 8 8 A G - 0 0 0 89,-0.9 116,-0.1 -2,-0.3 4,-0.1 -0.951 57.6 -20.9 155.4-174.2 33.6 16.3 58.5 9 9 A P S > S- 0 0 0 0, 0.0 3,-0.9 0, 0.0 5,-0.3 0.018 74.0 -82.4 -66.9 171.6 36.7 18.5 57.9 10 10 A T T 3 S+ 0 0 42 1,-0.2 3,-0.1 201,-0.2 202,-0.1 0.556 115.6 25.5 -59.1 -20.3 38.3 20.8 60.3 11 11 A C T 3 S+ 0 0 15 1,-0.1 -1,-0.2 200,-0.1 123,-0.1 -0.313 71.2 118.8-139.6 76.8 36.1 23.9 59.9 12 12 A S S < S- 0 0 24 -3,-0.9 -1,-0.1 -4,-0.1 -2,-0.1 0.235 86.6-105.0-113.4 13.7 32.7 23.1 58.8 13 13 A G > + 0 0 36 -3,-0.1 4,-1.6 3,-0.1 5,-0.1 0.841 69.3 149.3 61.3 36.2 31.0 24.5 62.0 14 14 A K H >> + 0 0 19 -5,-0.3 4,-1.9 2,-0.2 3,-1.7 0.995 66.3 52.1 -57.9 -68.1 30.3 21.0 63.2 15 15 A T H 3> S+ 0 0 29 1,-0.3 4,-3.3 2,-0.2 5,-0.3 0.805 108.0 49.4 -33.4 -59.1 30.5 22.0 66.9 16 16 A D H 3> S+ 0 0 100 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.871 109.9 53.1 -59.2 -33.9 28.0 24.8 66.6 17 17 A M H XX S+ 0 0 56 -3,-1.7 4,-2.2 -4,-1.6 3,-0.9 0.997 110.7 46.4 -58.6 -57.7 25.6 22.5 64.8 18 18 A A H 3X S+ 0 0 0 -4,-1.9 4,-3.5 1,-0.3 5,-0.3 0.893 108.0 56.3 -53.5 -45.7 26.0 20.0 67.7 19 19 A I H 3X S+ 0 0 8 -4,-3.3 4,-3.4 -5,-0.2 -1,-0.3 0.919 109.7 47.4 -51.9 -41.1 25.5 22.8 70.2 20 20 A Q H S+ 0 0 57 -2,-0.4 3,-2.8 1,-0.2 37,-0.3 0.941 91.8 49.9 -38.4 -65.6 41.6 12.5 70.2 35 35 A V G > S+ 0 0 42 1,-0.3 3,-1.0 2,-0.1 -1,-0.2 0.817 100.9 62.3 -59.0 -31.8 43.6 15.8 70.3 36 36 A Q G 3 S+ 0 0 8 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.2 0.596 81.8 83.6 -74.3 -2.9 40.9 17.7 72.1 37 37 A C G < S+ 0 0 0 -3,-2.8 27,-2.4 -4,-0.4 -1,-0.3 0.170 74.8 82.0 -79.6 12.7 41.2 15.3 75.1 38 38 A C X - 0 0 0 -3,-1.0 3,-2.4 25,-0.2 7,-0.2 -0.886 60.7-172.1-124.1 95.8 44.1 17.5 76.3 39 39 A P G > S+ 0 0 3 0, 0.0 3,-2.4 0, 0.0 4,-0.3 0.760 78.3 75.2 -71.7 -17.4 42.7 20.3 78.1 40 40 A Q G 3 S+ 0 0 45 24,-0.4 119,-0.1 1,-0.3 4,-0.1 0.704 105.7 38.3 -68.4 -8.4 46.1 21.9 78.3 41 41 A I G <> S+ 0 0 0 -3,-2.4 4,-3.6 -6,-0.2 -1,-0.3 -0.160 80.1 138.3-123.6 41.6 45.6 22.7 74.7 42 42 A A H <>>S+ 0 0 22 -3,-2.4 5,-2.2 1,-0.2 4,-0.8 0.966 76.0 36.0 -35.0 -73.4 41.9 23.5 75.0 43 43 A T H >45S+ 0 0 2 -4,-0.3 3,-1.1 1,-0.2 -1,-0.2 0.897 118.9 47.2 -59.3 -45.3 41.9 26.4 72.8 44 44 A G H 345S+ 0 0 12 1,-0.3 -1,-0.2 107,-0.2 -2,-0.2 0.930 109.7 53.1 -72.5 -37.0 44.4 25.3 70.3 45 45 A S H 3<5S- 0 0 19 -4,-3.6 -1,-0.3 -7,-0.2 -2,-0.2 0.594 121.8-108.3 -75.3 -4.5 42.8 21.9 69.9 46 46 A G T <<5 + 0 0 11 -3,-1.1 -3,-0.2 -4,-0.8 -2,-0.1 0.752 57.7 161.7 92.2 24.4 39.5 23.7 69.1 47 47 A R < - 0 0 33 -5,-2.2 -1,-0.3 -6,-0.2 3,-0.1 -0.630 43.3-115.5 -69.6 143.7 37.4 23.1 72.3 48 48 A P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 -0.273 32.3 -93.7 -72.6 162.8 34.6 25.6 72.4 49 49 A L - 0 0 15 1,-0.1 4,-0.2 -3,-0.1 0, 0.0 -0.331 29.6-119.6 -70.7 163.0 34.4 28.2 75.1 50 50 A E S > S+ 0 0 104 1,-0.2 3,-1.4 2,-0.2 5,-0.5 0.919 118.8 53.3 -71.6 -43.5 32.3 27.3 78.0 51 51 A S G > S+ 0 0 74 1,-0.2 3,-0.9 2,-0.2 -1,-0.2 0.840 103.0 56.9 -53.2 -38.6 30.2 30.3 77.2 52 52 A E G 3 S+ 0 0 63 1,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.582 93.8 75.8 -67.8 -1.1 29.8 29.0 73.5 53 53 A L G X S- 0 0 11 -3,-1.4 3,-1.7 -4,-0.2 -1,-0.2 0.745 85.9-148.8 -84.8 -27.8 28.4 25.9 75.1 54 54 A Q T < - 0 0 105 -3,-0.9 -3,-0.1 -4,-0.5 3,-0.1 0.932 65.2 -62.2 66.6 41.1 25.1 27.4 75.9 55 55 A S T 3 S+ 0 0 75 -5,-0.5 -1,-0.3 1,-0.1 2,-0.1 0.657 105.2 131.0 53.5 10.4 24.7 25.2 79.0 56 56 A T < - 0 0 10 -3,-1.7 2,-0.5 1,-0.0 -1,-0.1 -0.437 61.6-106.6 -82.1 171.2 24.7 22.1 76.8 57 57 A R E -c 28 0A 38 -30,-0.5 -28,-3.9 -2,-0.1 2,-0.5 -0.893 28.2-173.3 -97.5 124.7 27.0 19.1 77.6 58 58 A R E -c 29 0A 24 -2,-0.5 2,-0.3 -30,-0.2 -28,-0.2 -0.955 13.4-158.7-113.3 120.9 30.2 18.3 75.6 59 59 A I E -c 30 0A 39 -30,-2.3 -28,-2.8 -2,-0.5 2,-0.4 -0.834 1.8-150.1-106.2 132.2 31.8 14.9 76.7 60 60 A Y - 0 0 44 -2,-0.3 -28,-0.1 -30,-0.2 3,-0.1 -0.801 23.9-124.2-110.9 141.2 35.6 14.0 76.0 61 61 A L S S- 0 0 1 -30,-0.5 2,-0.3 -2,-0.4 -1,-0.1 0.841 88.7 -38.7 -55.4 -19.0 36.9 10.5 75.5 62 62 A D - 0 0 15 -28,-0.1 2,-0.4 2,-0.1 -1,-0.1 -0.942 59.5-118.0 177.2-179.7 39.2 11.2 78.3 63 63 A S + 0 0 25 -2,-0.3 -25,-0.2 -25,-0.1 474,-0.1 -0.945 41.1 157.8-143.1 124.0 41.2 14.0 79.7 64 64 A R - 0 0 45 -27,-2.4 -24,-0.4 -2,-0.4 2,-0.1 -0.960 44.0 -82.3-153.6 158.2 44.9 13.8 80.0 65 65 A P > - 0 0 33 0, 0.0 3,-2.9 0, 0.0 4,-0.1 -0.417 37.0-129.9 -58.4 125.6 48.4 15.5 80.3 66 66 A L G > S+ 0 0 0 1,-0.3 3,-2.9 2,-0.2 -29,-0.0 0.939 109.9 59.7 -38.8 -50.9 49.8 16.6 76.9 67 67 A T G 3 S+ 0 0 57 1,-0.3 -1,-0.3 2,-0.1 3,-0.1 0.648 89.5 69.0 -68.7 -2.7 52.9 14.8 77.9 68 68 A E G < S- 0 0 124 -3,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.319 116.7-107.2 -90.1 14.2 51.1 11.5 78.3 69 69 A G < - 0 0 18 -3,-2.9 -1,-0.3 2,-0.1 2,-0.2 0.081 42.3 -61.4 82.6 156.2 50.8 11.6 74.6 70 70 A I S S- 0 0 36 1,-0.1 -35,-0.1 -3,-0.1 3,-0.1 -0.593 73.6 -90.1 -78.4 143.3 47.7 12.3 72.5 71 71 A L - 0 0 3 -37,-0.3 -1,-0.1 -2,-0.2 -34,-0.1 -0.413 50.6-118.7 -68.4 130.2 45.2 9.6 73.3 72 72 A D > - 0 0 84 1,-0.1 4,-2.0 -38,-0.1 3,-0.3 -0.148 20.8-108.8 -67.8 164.5 45.9 6.8 70.8 73 73 A A H > S+ 0 0 27 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.916 109.7 53.1 -61.8 -59.4 43.3 5.6 68.3 74 74 A E H > S+ 0 0 113 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.797 111.6 45.1 -45.3 -45.8 42.3 2.3 69.7 75 75 A S H >> S+ 0 0 18 -3,-0.3 4,-2.9 2,-0.2 3,-0.7 0.961 105.9 57.4 -71.4 -55.0 41.6 3.5 73.2 76 76 A A H 3X S+ 0 0 0 -4,-2.0 4,-4.2 1,-0.3 5,-0.2 0.956 110.0 49.8 -32.8 -54.5 39.7 6.5 72.1 77 77 A H H 3X S+ 0 0 19 -4,-2.4 4,-1.9 2,-0.2 -1,-0.3 0.857 111.4 43.8 -58.4 -38.4 37.6 3.8 70.3 78 78 A R H < S+ 0 0 0 -4,-3.8 3,-1.9 -5,-0.3 -2,-0.2 0.986 114.5 54.8 -72.0 -52.5 28.0 5.5 74.3 85 85 A D H >< S+ 0 0 58 -4,-3.6 3,-1.5 -5,-0.3 -2,-0.2 0.835 103.2 50.9 -49.0 -58.1 27.2 2.1 75.9 86 86 A W T 3< S+ 0 0 53 -4,-2.2 -1,-0.3 1,-0.3 3,-0.1 0.406 108.5 54.9 -63.6 -0.6 26.5 3.2 79.5 87 87 A R T X S+ 0 0 20 -3,-1.9 3,-2.5 -5,-0.3 -1,-0.3 0.130 71.6 121.4-104.7 25.0 24.1 5.8 78.3 88 88 A K T < + 0 0 92 -3,-1.5 -2,-0.1 1,-0.3 -1,-0.1 0.627 66.3 59.5 -76.7 -7.6 22.0 3.3 76.3 89 89 A S T 3 S+ 0 0 86 -3,-0.1 -1,-0.3 -4,-0.1 2,-0.1 0.399 86.7 92.3 -96.9 4.3 18.8 4.0 78.1 90 90 A E S < S- 0 0 66 -3,-2.5 3,-0.1 1,-0.1 512,-0.1 -0.447 87.0-105.9 -89.5 178.1 18.7 7.7 77.2 91 91 A E S S- 0 0 146 1,-0.3 -89,-1.6 -2,-0.1 2,-0.3 0.975 80.0 -26.4 -81.7 -60.0 17.0 9.0 74.2 92 92 A G E -a 2 0A 0 -91,-0.2 2,-0.4 -67,-0.1 -1,-0.3 -0.979 51.2-143.7-139.9 162.5 19.6 10.0 71.8 93 93 A L E -a 3 0A 0 -91,-3.3 -89,-2.6 -2,-0.3 2,-0.4 -0.989 13.6-135.5-112.6 147.8 23.2 11.1 71.8 94 94 A I E -ad 4 29A 0 -66,-1.9 -64,-2.5 -2,-0.4 2,-0.4 -0.741 18.0-169.0 -81.6 142.4 25.0 13.5 69.5 95 95 A L E +ad 5 30A 0 -91,-3.2 -89,-2.8 -2,-0.4 2,-0.4 -0.981 17.6 165.0-132.4 127.7 28.5 12.3 68.2 96 96 A E E +ad 6 31A 3 -66,-2.1 -64,-4.3 -2,-0.4 2,-0.3 -0.990 12.9 83.2-147.2 132.7 30.4 15.0 66.5 97 97 A G E -a 7 0A 2 -91,-1.7 -89,-0.9 -2,-0.4 -64,-0.1 -0.934 60.1 -99.0 163.3-167.2 34.0 15.5 65.4 98 98 A G + 0 0 9 -66,-0.3 2,-0.6 -2,-0.3 -65,-0.2 0.366 54.6 135.0-125.8 9.4 36.8 15.1 63.0 99 99 A S > - 0 0 16 -67,-2.3 4,-1.1 1,-0.2 5,-0.2 -0.454 34.8-163.7 -63.0 111.2 39.1 12.3 64.1 100 100 A I H >> S+ 0 0 36 -2,-0.6 4,-1.9 2,-0.2 3,-1.1 0.954 89.6 47.0 -50.8 -57.7 39.9 10.2 61.0 101 101 A S H 3> S+ 0 0 36 1,-0.3 4,-1.6 2,-0.2 5,-0.2 0.897 110.0 55.1 -62.4 -36.1 41.1 7.2 63.0 102 102 A L H 3> S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.851 109.9 44.9 -65.2 -24.1 38.1 7.3 65.3 103 103 A L H - 0 0 130 1,-0.1 4,-1.9 4,-0.0 -1,-0.3 -0.457 58.3-134.7 -64.9 133.2 36.1 25.8 47.9 128 128 A S H >> S+ 0 0 63 1,-0.2 4,-2.2 2,-0.2 3,-1.0 0.969 104.2 59.8 -36.8 -65.3 39.7 26.2 49.2 129 129 A D H 3> S+ 0 0 131 1,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.850 108.8 39.5 -40.3 -55.8 39.3 29.9 48.9 130 130 A A H 3> S+ 0 0 53 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.712 109.4 61.6 -75.9 -21.7 36.3 30.2 51.4 131 131 A F H X S+ 0 0 42 -4,-2.5 4,-1.6 -5,-0.2 3,-0.7 0.919 105.9 52.5 -53.7 -39.1 42.1 34.9 64.8 141 141 A E H >< S+ 0 0 63 -4,-2.2 3,-1.6 1,-0.3 -2,-0.2 0.988 105.3 50.3 -64.3 -53.3 39.7 33.7 67.4 142 142 A M H 3< S+ 0 0 8 -4,-2.0 10,-2.8 1,-0.3 -1,-0.3 0.687 111.9 51.5 -56.8 -16.6 42.1 31.3 69.0 143 143 A F H << S+ 0 0 15 -4,-1.5 -1,-0.3 -3,-0.7 -2,-0.2 0.684 82.6 112.9 -93.9 -22.9 44.6 34.2 69.1 144 144 A A << - 0 0 41 -3,-1.6 2,-0.2 -4,-1.6 8,-0.1 -0.160 69.9-125.7 -42.5 132.3 42.2 36.6 70.8 145 145 A I + 0 0 147 6,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.639 40.1 168.3 -82.0 148.8 43.4 37.5 74.3 146 146 A R - 0 0 98 3,-0.4 5,-0.0 -2,-0.2 0, 0.0 -0.990 47.1-126.6-161.2 148.7 40.8 36.8 77.1 147 147 A E S S+ 0 0 192 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 0.883 109.6 43.9 -62.4 -39.5 40.2 36.6 80.8 148 148 A D S S+ 0 0 77 1,-0.2 -1,-0.2 396,-0.1 395,-0.0 0.983 116.3 37.8 -69.9 -52.7 38.5 33.1 80.6 149 149 A R S S- 0 0 21 1,-0.1 -3,-0.4 395,-0.0 -1,-0.2 -0.849 70.5-128.3-120.9 127.1 40.9 31.3 78.3 150 150 A P - 0 0 48 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.071 41.3-117.3 -39.8 173.7 44.5 31.2 77.5 151 151 A S > - 0 0 5 1,-0.1 4,-1.5 -8,-0.1 -8,-0.2 -0.629 24.3 -98.1-114.8-178.4 45.2 31.8 73.9 152 152 A L H > S+ 0 0 1 -10,-2.8 4,-2.0 -2,-0.2 3,-0.3 0.939 123.6 47.2 -61.6 -43.6 46.8 29.5 71.3 153 153 A L H > S+ 0 0 8 1,-0.3 4,-1.4 -11,-0.2 -1,-0.2 0.917 112.6 48.8 -69.0 -40.1 50.2 31.2 71.7 154 154 A E H > S+ 0 0 77 2,-0.3 4,-1.6 1,-0.2 5,-0.4 0.747 105.4 56.4 -71.2 -30.3 50.1 31.1 75.4 155 155 A E H X S+ 0 0 9 -4,-1.5 4,-2.4 -3,-0.3 -1,-0.2 0.962 112.8 44.6 -67.8 -46.0 49.1 27.5 75.6 156 156 A L H < S+ 0 0 0 -4,-2.0 4,-0.4 -5,-0.2 -2,-0.3 0.819 112.5 53.3 -66.7 -28.4 52.2 26.9 73.6 157 157 A A H >X S+ 0 0 24 -4,-1.4 3,-3.1 2,-0.2 4,-0.5 0.988 113.5 37.2 -68.3 -80.8 54.2 29.3 75.7 158 158 A E H >< S+ 0 0 87 -4,-1.6 3,-1.8 1,-0.3 4,-0.5 0.894 118.5 52.1 -24.9 -61.4 53.5 27.8 79.1 159 159 A L T 3< S+ 0 0 8 -4,-2.4 -1,-0.3 -5,-0.4 6,-0.2 0.615 94.7 73.3 -67.2 -8.6 53.6 24.3 77.7 160 160 A W T <4 S+ 0 0 30 -3,-3.1 -1,-0.3 -4,-0.4 -2,-0.2 0.649 82.2 68.7 -89.4 -12.8 57.0 24.9 76.0 161 161 A N S << S+ 0 0 105 -3,-1.8 -1,-0.2 -4,-0.5 -2,-0.2 0.914 84.6 73.2 -62.0 -47.0 58.9 24.8 79.2 162 162 A Y S > S- 0 0 120 -4,-0.5 3,-1.1 1,-0.2 4,-0.3 -0.631 75.0-154.3 -74.7 116.4 58.3 21.1 79.8 163 163 A P T > S+ 0 0 89 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.832 87.6 66.4 -64.0 -35.6 60.6 19.4 77.2 164 164 A A T 3> S+ 0 0 66 1,-0.3 4,-0.7 2,-0.1 -2,-0.1 0.764 97.6 62.0 -58.1 -17.6 58.6 16.1 76.8 165 165 A A H <> S+ 0 0 0 -3,-1.1 4,-3.8 -6,-0.2 -1,-0.3 0.754 85.1 76.3 -70.8 -29.0 55.8 18.4 75.3 166 166 A R H <> S+ 0 0 89 -3,-1.8 4,-2.6 -4,-0.3 5,-0.2 0.947 92.7 44.4 -69.1 -48.9 57.9 19.6 72.4 167 167 A P H 4 S+ 0 0 75 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.906 116.8 49.0 -60.9 -32.5 57.8 16.6 70.1 168 168 A I H >X S+ 0 0 44 -4,-0.7 3,-2.5 2,-0.2 4,-1.4 0.970 111.0 48.9 -66.9 -44.6 54.0 16.2 70.7 169 169 A L H 3< S+ 0 0 0 -4,-3.8 3,-0.4 1,-0.3 7,-0.4 0.931 107.5 56.6 -58.1 -47.7 53.4 20.1 70.1 170 170 A E T 3< S+ 0 0 87 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.561 109.0 49.5 -47.1 -12.0 55.4 19.7 66.8 171 171 A D T <4 S+ 0 0 122 -3,-2.5 2,-0.2 -5,-0.2 -2,-0.2 0.802 91.9 80.7-106.3 -26.4 52.9 16.9 65.9 172 172 A I S >X S- 0 0 14 -4,-1.4 4,-1.4 -3,-0.4 3,-0.6 -0.602 88.6-102.8 -83.5 139.7 49.6 18.5 66.4 173 173 A D T 34 S+ 0 0 46 -2,-0.2 2,-5.8 1,-0.2 3,-0.2 0.264 102.2 21.7 -58.3-172.7 48.2 20.9 63.8 174 174 A G T 3> S+ 0 0 2 1,-0.2 4,-1.6 33,-0.2 -1,-0.2 0.135 119.1 62.7 39.9 -37.3 48.3 24.7 64.4 175 175 A Y H <> S+ 0 0 2 -2,-5.8 4,-2.1 -3,-0.6 -1,-0.2 0.970 96.2 56.4 -77.1 -39.7 51.1 24.2 66.9 176 176 A R H X S+ 0 0 59 -4,-1.4 4,-2.3 -7,-0.4 5,-0.4 0.915 109.3 49.3 -53.7 -53.8 53.6 22.8 64.3 177 177 A C H > S+ 0 0 2 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.900 106.0 54.0 -55.1 -46.5 53.0 25.8 62.4 178 178 A A H X S+ 0 0 0 -4,-1.6 4,-1.4 2,-0.2 -2,-0.2 0.904 114.9 40.8 -58.0 -45.0 53.6 28.1 65.3 179 179 A I H >X S+ 0 0 5 -4,-2.1 4,-2.9 2,-0.2 3,-1.8 0.999 114.9 49.7 -61.1 -71.6 57.0 26.6 66.1 180 180 A R H 3X S+ 0 0 139 -4,-2.3 4,-1.3 1,-0.3 -2,-0.2 0.816 112.5 51.2 -42.7 -34.4 58.2 26.2 62.4 181 181 A F H 3X S+ 0 0 15 -4,-2.4 4,-1.8 -5,-0.4 -1,-0.3 0.879 111.2 43.6 -83.3 -25.9 57.2 29.7 62.0 182 182 A A H <<>S+ 0 0 0 -3,-1.8 5,-2.0 -4,-1.4 -2,-0.2 0.875 112.8 53.3 -74.3 -38.3 59.2 31.1 65.1 183 183 A R H ><5S+ 0 0 142 -4,-2.9 3,-0.6 3,-0.2 -2,-0.2 0.856 108.2 54.9 -65.3 -29.8 62.2 29.0 64.1 184 184 A K H 3<5S+ 0 0 133 -4,-1.3 -2,-0.2 -5,-0.4 -1,-0.2 0.966 116.2 32.4 -63.2 -54.4 61.8 30.6 60.7 185 185 A H T 3<5S- 0 0 57 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.162 112.9-115.2 -98.1 25.6 62.0 34.1 61.9 186 186 A D T < 5 + 0 0 149 -3,-0.6 2,-0.3 -4,-0.2 -3,-0.2 0.790 68.5 133.7 50.9 34.2 64.3 33.3 64.8 187 187 A L < - 0 0 40 -5,-2.0 2,-0.4 -6,-0.2 -1,-0.2 -0.754 57.0-114.6-101.1 163.9 62.0 34.2 67.7 188 188 A A >> - 0 0 52 -2,-0.3 3,-1.5 1,-0.1 4,-0.8 -0.754 26.8-114.7 -90.2 144.3 61.5 32.0 70.7 189 189 A I G >4 S+ 0 0 5 -2,-0.4 3,-0.5 1,-0.3 -1,-0.1 0.785 113.3 70.5 -37.0 -37.2 58.0 30.6 71.2 190 190 A S G 34 S+ 0 0 80 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.321 101.9 42.9 -66.7 10.0 57.8 32.8 74.3 191 191 A Q G X4 S+ 0 0 88 -3,-1.5 3,-0.9 2,-0.1 -1,-0.2 0.502 76.1 100.9-141.7 -30.5 57.6 35.8 72.2 192 192 A L G X< S+ 0 0 0 -4,-0.8 3,-1.7 -3,-0.5 -2,-0.1 0.836 77.2 68.1 -30.4 -48.5 55.2 34.8 69.6 193 193 A P G 3 S+ 0 0 47 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.931 100.7 44.9 -38.1 -65.2 52.6 36.7 71.7 194 194 A N G < S+ 0 0 117 -3,-0.9 2,-1.2 -4,-0.1 -2,-0.2 0.087 74.4 146.6 -78.2 25.6 54.2 40.2 70.9 195 195 A I < - 0 0 17 -3,-1.7 5,-0.2 -2,-0.4 -3,-0.1 -0.454 58.3-113.2 -67.4 98.2 54.7 39.5 67.2 196 196 A D >> - 0 0 112 -2,-1.2 4,-1.2 1,-0.1 3,-1.1 0.183 35.0 -93.8 -33.0 155.2 54.2 43.0 65.8 197 197 A A H 3> S+ 0 0 87 1,-0.3 4,-0.8 2,-0.2 -1,-0.1 0.605 119.1 60.2 -61.3 -17.5 51.0 43.4 63.6 198 198 A G H 3> S+ 0 0 55 2,-0.2 4,-0.5 1,-0.2 3,-0.3 0.906 109.2 37.9 -71.0 -48.0 52.8 42.7 60.2 199 199 A R H <> S+ 0 0 84 -3,-1.1 4,-2.1 1,-0.2 5,-0.2 0.612 103.9 76.2 -85.4 -14.5 54.1 39.2 60.9 200 200 A H H X S+ 0 0 56 -4,-1.2 4,-2.6 -5,-0.2 -1,-0.2 0.941 92.2 50.6 -56.1 -50.2 50.9 38.5 62.7 201 201 A V H X S+ 0 0 82 -4,-0.8 4,-3.6 -3,-0.3 -1,-0.2 0.802 109.6 48.5 -65.9 -31.8 49.0 38.1 59.5 202 202 A E H X S+ 0 0 78 -4,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.934 111.2 50.3 -72.0 -47.5 51.4 35.7 57.9 203 203 A L H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 5,-0.2 0.894 116.3 43.3 -60.9 -40.3 51.4 33.5 61.1 204 204 A I H X S+ 0 0 28 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.985 114.2 48.6 -64.4 -58.6 47.7 33.6 60.9 205 205 A E H X S+ 0 0 87 -4,-3.6 4,-1.7 1,-0.2 -2,-0.2 0.808 109.7 56.8 -50.7 -23.4 47.6 33.1 57.3 206 206 A A H X S+ 0 0 30 -4,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.958 107.9 41.7 -76.6 -56.7 50.0 30.2 57.8 207 207 A I H >X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 3,-1.2 0.969 106.9 64.1 -44.5 -61.3 48.0 28.2 60.3 208 208 A A H 3X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.3 -2,-0.2 0.891 109.3 41.5 -28.1 -58.9 45.0 28.9 58.1 209 209 A N H 3X S+ 0 0 79 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.3 0.744 108.7 57.6 -66.5 -27.8 47.0 26.9 55.4 210 210 A E H XX S+ 0 0 19 -4,-1.3 4,-1.8 -3,-1.2 3,-0.8 0.995 111.6 42.9 -71.5 -56.2 48.1 24.2 57.8 211 211 A Y H 3X S+ 0 0 15 -4,-2.0 4,-3.6 1,-0.2 5,-0.4 0.869 106.9 62.6 -43.3 -46.0 44.5 23.5 58.6 212 212 A L H 3X S+ 0 0 24 -4,-1.9 4,-1.9 -5,-0.5 -1,-0.2 0.932 105.6 46.1 -52.1 -43.9 43.6 23.7 55.0 213 213 A E H X S+ 0 0 59 -4,-1.8 4,-3.5 2,-0.3 3,-2.2 0.955 107.6 54.7 -42.1 -62.7 44.5 18.7 57.2 215 215 A A H 3X S+ 0 0 0 -4,-3.6 4,-2.8 1,-0.3 -1,-0.2 0.920 106.8 55.5 -36.4 -47.2 41.0 19.4 56.0 216 216 A L H 3X S+ 0 0 73 -4,-1.9 4,-1.0 -5,-0.4 -1,-0.3 0.748 109.8 40.8 -68.4 -24.5 42.3 18.1 52.8 217 217 A S H X S+ 0 0 6 -4,-3.5 4,-2.9 1,-0.2 3,-0.9 0.981 106.7 54.6 -52.1 -48.4 40.5 14.4 56.4 219 219 A E H 3< S+ 0 0 39 -4,-2.8 -1,-0.2 -5,-0.4 -2,-0.2 0.905 111.9 38.9 -51.6 -47.2 38.7 14.6 53.1 220 220 A R H 3< S+ 0 0 163 -4,-1.0 -1,-0.3 1,-0.2 -2,-0.2 0.641 123.3 42.2 -88.1 -7.8 40.6 11.8 51.4 221 221 A D H << S+ 0 0 80 -4,-2.1 -2,-0.2 -3,-0.9 -1,-0.2 0.671 84.6 101.0-113.7 -11.8 40.7 9.6 54.4 222 222 A F S < S- 0 0 17 -4,-2.9 2,-0.2 -5,-0.2 -122,-0.1 -0.087 70.4-125.0 -51.1 158.0 37.2 9.8 56.1 223 223 A P - 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0 0 0 89,-1.1 116,-0.2 -2,-0.3 4,-0.1 -0.951 56.8 -30.5 156.2-177.9 65.0 -16.8 -7.1 236 9 B P S > S- 0 0 0 0, 0.0 3,-0.8 0, 0.0 5,-0.3 0.027 74.4 -77.5 -68.9 178.3 61.9 -18.8 -7.6 237 10 B T T 3 S+ 0 0 39 1,-0.2 3,-0.1 201,-0.2 202,-0.1 0.521 117.1 25.5 -60.5 -15.5 60.3 -21.1 -5.3 238 11 B C T 3 S+ 0 0 16 1,-0.1 -1,-0.2 200,-0.1 123,-0.1 -0.287 70.4 118.6-145.9 72.6 62.5 -24.2 -5.7 239 12 B S S < S- 0 0 26 -3,-0.8 -1,-0.1 -4,-0.1 -2,-0.1 0.168 84.8-107.6-112.6 15.7 65.9 -23.4 -6.7 240 13 B G > + 0 0 38 -3,-0.1 4,-1.5 3,-0.1 5,-0.1 0.851 67.7 149.2 53.4 36.7 67.5 -24.8 -3.5 241 14 B K H >> + 0 0 19 -5,-0.3 4,-2.4 2,-0.2 3,-1.0 0.996 67.8 53.9 -54.2 -62.2 68.4 -21.3 -2.3 242 15 B T H 3> S+ 0 0 28 1,-0.3 4,-3.3 2,-0.2 5,-0.3 0.886 106.2 49.8 -43.3 -56.2 68.0 -22.4 1.3 243 16 B D H 3> S+ 0 0 104 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.877 111.2 52.0 -55.3 -34.9 70.5 -25.3 1.1 244 17 B M H S+ 0 0 55 -2,-0.3 3,-1.7 1,-0.2 37,-0.5 0.936 94.2 49.0 -41.6 -51.9 57.0 -12.7 4.5 262 35 B V G > S+ 0 0 36 1,-0.3 3,-1.3 2,-0.1 -1,-0.2 0.848 99.6 65.6 -68.2 -31.1 55.0 -16.1 4.8 263 36 B Q G 3 S+ 0 0 10 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.380 81.8 80.5 -70.8 11.3 57.7 -17.8 6.5 264 37 B C G < S+ 0 0 1 -3,-1.7 27,-2.1 1,-0.2 -1,-0.3 0.273 74.4 80.1-100.8 5.9 57.3 -15.6 9.4 265 38 B C X - 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0 0 37 -3,-2.0 2,-0.2 -4,-1.0 8,-0.1 -0.401 69.8-123.9 -45.8 129.0 56.3 -36.9 5.2 372 145 B I + 0 0 138 -2,-0.1 2,-0.3 6,-0.1 -1,-0.1 -0.572 42.4 165.7 -73.8 146.8 55.0 -37.9 8.7 373 146 B R - 0 0 96 3,-0.3 5,-0.1 -2,-0.2 -2,-0.0 -0.927 48.4-127.6-170.9 145.0 57.6 -37.2 11.5 374 147 B E S S+ 0 0 192 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.0 0.862 103.0 50.2 -62.0 -39.5 58.2 -36.9 15.2 375 148 B D S S+ 0 0 73 1,-0.1 -1,-0.1 396,-0.1 -2,-0.0 0.999 112.4 21.3 -67.5 -74.0 59.9 -33.4 15.0 376 149 B R S S- 0 0 29 1,-0.1 -3,-0.3 395,-0.0 -1,-0.1 -0.711 79.3-109.6-107.3 145.9 57.7 -31.0 13.0 377 150 B P - 0 0 47 0, 0.0 -107,-0.2 0, 0.0 -1,-0.1 -0.395 41.5-114.0 -55.0 146.9 54.0 -31.1 12.1 378 151 B S > - 0 0 4 -8,-0.1 4,-2.6 1,-0.1 -107,-0.3 -0.065 26.4-103.1 -72.4-173.5 53.3 -31.9 8.4 379 152 B L H > S+ 0 0 0 -10,-1.7 4,-2.7 2,-0.2 -9,-0.1 0.883 123.5 46.6 -78.7 -40.1 51.7 -29.4 6.0 380 153 B L H > S+ 0 0 6 -11,-0.3 4,-4.0 2,-0.3 -1,-0.2 0.790 113.5 48.3 -74.8 -30.5 48.4 -31.2 6.1 381 154 B E H > S+ 0 0 75 2,-0.3 4,-2.2 1,-0.2 5,-0.5 0.968 110.7 51.0 -74.4 -48.3 48.6 -31.3 9.9 382 155 B E H X S+ 0 0 7 -4,-2.6 4,-1.8 1,-0.2 -2,-0.3 0.927 112.2 51.4 -47.2 -46.8 49.5 -27.7 9.8 383 156 B L H X S+ 0 0 0 -4,-2.7 4,-1.5 2,-0.2 -2,-0.3 0.969 113.9 38.3 -62.0 -52.2 46.4 -27.5 7.7 384 157 B A H >X S+ 0 0 21 -4,-4.0 3,-1.3 1,-0.2 4,-1.0 0.990 115.7 49.8 -60.9 -57.6 44.0 -29.3 10.0 385 158 B E H >< S+ 0 0 90 -4,-2.2 3,-0.7 1,-0.3 4,-0.4 0.879 114.2 47.2 -44.8 -44.1 45.2 -28.0 13.3 386 159 B L H 3< S+ 0 0 9 -4,-1.8 3,-0.3 -5,-0.5 6,-0.3 0.779 97.0 70.7 -78.9 -24.6 45.0 -24.5 11.9 387 160 B W H << S+ 0 0 28 -4,-1.5 -1,-0.2 -3,-1.3 6,-0.2 0.793 82.6 73.1 -63.1 -28.7 41.5 -24.8 10.3 388 161 B N S << S+ 0 0 112 -4,-1.0 -1,-0.2 -3,-0.7 -2,-0.1 0.957 81.9 72.0 -52.9 -54.5 39.7 -24.9 13.7 389 162 B Y S > S- 0 0 126 -4,-0.4 3,-1.6 -3,-0.3 4,-0.4 -0.470 85.1-143.6 -65.1 119.9 40.3 -21.2 14.4 390 163 B P T > S+ 0 0 95 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.849 91.9 61.6 -70.1 -32.0 37.9 -19.7 11.9 391 164 B A T 3> S+ 0 0 56 1,-0.3 4,-1.0 2,-0.2 5,-0.1 0.711 89.9 73.0 -68.0 -18.5 40.0 -16.6 10.9 392 165 B A H <> S+ 0 0 0 -3,-1.6 4,-3.3 -6,-0.3 -1,-0.3 0.758 85.1 70.9 -53.9 -32.6 42.7 -19.0 9.6 393 166 B R H <> S+ 0 0 87 -3,-1.8 4,-2.5 -4,-0.4 -1,-0.2 0.894 98.6 36.9 -66.7 -50.1 40.6 -19.8 6.6 394 167 B P H 4 S+ 0 0 71 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.942 122.4 48.8 -63.0 -42.2 40.5 -16.7 4.4 395 168 B I H >< S+ 0 0 50 -4,-1.0 3,-1.8 1,-0.2 4,-0.4 0.948 114.2 44.3 -62.2 -52.1 44.2 -16.1 5.4 396 169 B L H >< S+ 0 0 0 -4,-3.3 3,-1.3 1,-0.3 7,-0.3 0.890 101.4 65.6 -60.6 -46.4 45.2 -19.6 4.7 397 170 B E T 3< S+ 0 0 75 -4,-2.5 -1,-0.3 -5,-0.3 -2,-0.2 0.730 103.3 55.8 -47.6 -14.6 43.3 -19.8 1.4 398 171 B D T < S+ 0 0 121 -3,-1.8 2,-0.3 -4,-0.5 -1,-0.2 0.676 85.1 77.3-101.2 -22.5 45.8 -17.2 0.3 399 172 B I S <> S- 0 0 17 -3,-1.3 4,-1.1 -4,-0.4 3,-0.4 -0.691 89.7-106.5 -85.0 141.6 49.2 -18.6 0.8 400 173 B D T >4 S+ 0 0 31 -2,-0.3 2,-3.1 1,-0.2 3,-1.2 0.413 98.5 39.7 -41.1-158.9 50.3 -21.0 -1.9 401 174 B G T 3> S+ 0 0 2 1,-0.3 4,-0.9 33,-0.2 -1,-0.2 -0.092 115.5 47.6 56.4 -61.5 50.4 -24.7 -0.9 402 175 B Y H 3> S+ 0 0 3 -2,-3.1 4,-4.2 -3,-0.4 -1,-0.3 0.794 100.9 63.9 -88.3 -30.1 47.3 -24.9 1.2 403 176 B R H S+ 0 0 3 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.880 112.7 56.0 -45.2 -42.5 45.5 -25.9 -3.5 405 178 B A H X S+ 0 0 0 -4,-0.9 4,-1.7 1,-0.2 -2,-0.3 0.959 111.8 39.3 -68.1 -47.9 45.1 -28.1 -0.4 406 179 B I H X S+ 0 0 4 -4,-4.2 4,-2.1 2,-0.2 -1,-0.2 0.839 115.9 53.3 -68.0 -33.0 41.7 -26.6 0.5 407 180 B R H >X S+ 0 0 148 -4,-3.5 4,-1.8 -5,-0.3 3,-0.7 0.998 107.7 48.3 -60.0 -67.9 40.7 -26.5 -3.2 408 181 B F H 3X S+ 0 0 18 -4,-2.6 4,-0.6 1,-0.2 5,-0.3 0.862 115.0 51.9 -36.2 -43.9 41.4 -30.1 -3.9 409 182 B A H 3<>S+ 0 0 0 -4,-1.7 5,-3.4 -5,-0.3 4,-0.4 0.881 106.4 45.8 -67.5 -43.1 39.4 -30.7 -0.7 410 183 B R H <<5S+ 0 0 145 -4,-2.1 -1,-0.2 -3,-0.7 -2,-0.2 0.625 115.1 58.8 -78.4 -12.2 36.2 -28.8 -1.4 411 184 B K H <5S+ 0 0 124 -4,-1.8 2,-1.1 -3,-0.3 -2,-0.2 0.703 112.6 28.0 -75.4-112.2 36.5 -30.6 -4.7 412 185 B H T <5S- 0 0 68 -4,-0.6 -2,-0.2 1,-0.2 -3,-0.1 0.603 117.3-117.0 -28.7 -5.1 36.5 -34.3 -4.0 413 186 B D T 5 + 0 0 141 -2,-1.1 2,-0.3 -4,-0.4 -3,-0.2 0.956 57.6 161.3 66.5 51.0 34.5 -33.1 -1.1 414 187 B L < - 0 0 33 -5,-3.4 2,-0.2 -6,-0.2 -1,-0.2 -0.723 44.4-113.3 -99.8 154.7 36.9 -34.1 1.6 415 188 B A > - 0 0 54 -2,-0.3 3,-1.4 1,-0.1 4,-0.1 -0.555 25.0-126.8 -74.9 147.6 36.8 -32.8 5.0 416 189 B I G > S+ 0 0 11 1,-0.3 3,-2.6 -2,-0.2 2,-1.7 0.999 110.0 62.1 -60.7 -57.9 39.9 -30.8 5.7 417 190 B S G 3 S+ 0 0 75 1,-0.3 -1,-0.3 -33,-0.1 4,-0.2 0.398 104.6 55.5 -40.0 8.1 40.6 -32.8 8.8 418 191 B Q G < S+ 0 0 88 -2,-1.7 -1,-0.3 -3,-1.4 -2,-0.2 0.403 70.7 91.8-132.7 4.6 40.9 -35.6 6.5 419 192 B L S < S+ 0 0 1 -3,-2.6 -2,-0.1 1,-0.2 3,-0.1 0.753 81.0 66.8 -80.7 -26.0 43.4 -34.8 3.8 420 193 B P S S+ 0 0 46 0, 0.0 2,-1.5 0, 0.0 -1,-0.2 0.993 101.0 47.9 -50.5 -69.9 46.1 -36.5 6.0 421 194 B N S S+ 0 0 106 -4,-0.2 2,-0.5 3,-0.0 3,-0.0 -0.629 79.4 148.2 -71.4 92.7 44.4 -40.0 5.5 422 195 B I - 0 0 22 -2,-1.5 5,-0.2 -3,-0.1 -3,-0.1 -0.931 58.1-103.3-130.5 112.9 44.0 -39.9 1.8 423 196 B D > - 0 0 103 -2,-0.5 4,-0.6 1,-0.2 3,-0.3 0.052 33.1-117.1 -30.2 138.1 44.2 -43.1 -0.1 424 197 B A H >> S+ 0 0 86 1,-0.2 4,-1.0 2,-0.2 3,-0.7 0.805 115.1 65.9 -52.6 -34.8 47.7 -43.2 -1.8 425 198 B G H 34 S+ 0 0 56 1,-0.2 3,-0.4 2,-0.1 4,-0.4 0.984 107.4 39.6 -40.2 -67.1 45.8 -43.2 -5.1 426 199 B R H 3> S+ 0 0 86 -3,-0.3 4,-1.3 1,-0.2 -1,-0.2 0.417 99.4 76.0 -74.8 -3.6 44.5 -39.7 -4.4 427 200 B H H S+ 0 0 75 -4,-0.4 4,-5.1 2,-0.2 -1,-0.3 0.965 113.1 47.8 -75.9 -51.9 46.9 -35.7 -7.6 430 203 B L H X S+ 0 0 0 -4,-1.3 4,-2.3 -3,-0.3 -2,-0.2 0.856 116.2 46.0 -50.0 -44.1 46.9 -33.5 -4.6 431 204 B I H >X S+ 0 0 17 -4,-3.0 4,-1.4 2,-0.2 3,-0.8 0.939 113.1 46.7 -61.1 -82.1 50.7 -33.5 -4.8 432 205 B E H 3X S+ 0 0 82 -4,-1.9 4,-2.7 1,-0.3 5,-0.3 0.776 111.1 56.0 -24.6 -55.4 50.7 -32.9 -8.5 433 206 B A H >X S+ 0 0 33 -4,-5.1 4,-1.8 1,-0.2 3,-0.6 0.933 111.7 40.5 -44.5 -62.0 48.1 -30.1 -7.9 434 207 B I H X S+ 0 0 131 -4,-2.5 4,-1.8 1,-0.2 3,-1.1 0.877 113.3 44.7 -28.8 -67.1 52.4 -21.0 -11.3 441 214 B H H 3X S+ 0 0 56 -4,-2.1 4,-3.6 1,-0.3 5,-0.3 0.891 107.8 54.0 -52.7 -51.8 53.9 -19.0 -8.5 442 215 B A H 3X S+ 0 0 0 -4,-4.3 4,-0.5 1,-0.3 -1,-0.3 0.624 108.5 55.3 -67.0 -9.0 57.5 -19.3 -9.6 443 216 B L H X S+ 0 0 3 -4,-3.6 4,-2.1 1,-0.2 3,-0.7 0.867 106.6 64.5 -63.1 -27.7 58.0 -14.6 -9.2 446 219 B E H 3< S+ 0 0 29 -4,-0.5 -1,-0.2 -5,-0.3 -2,-0.2 0.929 110.8 29.1 -68.5 -48.3 59.7 -15.1 -12.4 447 220 B R H 3< S+ 0 0 166 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.364 121.4 51.9 -86.1 0.5 58.5 -11.9 -14.2 448 221 B D H << S+ 0 0 70 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.724 80.5 98.3-115.2 -20.9 58.0 -9.7 -11.1 449 222 B F S < S- 0 0 13 -4,-2.1 2,-0.2 -5,-0.2 -122,-0.1 -0.132 70.0-130.5 -50.3 159.5 61.4 -10.0 -9.4 450 223 B P - 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0 0 41 -4,-1.7 2,-0.2 -3,-1.3 8,-0.1 -0.199 69.7-124.2 -42.4 129.9 85.9 -7.1 27.6 826 145 D I + 0 0 141 6,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.567 40.9 168.2 -76.7 146.5 86.9 -5.9 24.1 827 146 D R - 0 0 100 3,-0.5 0, 0.0 -2,-0.2 0, 0.0 -0.978 47.3-128.1-162.7 149.0 86.2 -8.5 21.3 828 147 D E S S+ 0 0 192 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.0 0.890 107.0 47.6 -64.2 -39.1 86.0 -9.1 17.6 829 148 D D S S+ 0 0 75 1,-0.1 -1,-0.1 -512,-0.1 -2,-0.0 0.999 111.9 35.9 -65.5 -67.8 82.5 -10.7 17.8 830 149 D R S S- 0 0 23 1,-0.0 -3,-0.5 -513,-0.0 -1,-0.1 -0.605 73.1-123.5 -99.3 147.2 80.4 -8.4 20.0 831 150 D P - 0 0 53 0, 0.0 2,-0.2 0, 0.0 -107,-0.1 -0.281 47.0-121.4 -55.9 166.1 80.3 -4.6 20.5 832 151 D S > - 0 0 4 -8,-0.1 4,-3.5 -108,-0.1 5,-0.2 -0.652 21.0 -94.6-111.7-176.2 80.9 -4.2 24.2 833 152 D L H > S+ 0 0 0 -10,-2.4 4,-2.1 2,-0.2 -9,-0.1 0.900 125.4 38.1 -59.7 -46.9 78.7 -2.5 26.8 834 153 D L H > S+ 0 0 8 2,-0.2 4,-3.3 -11,-0.2 -1,-0.2 0.894 114.4 54.3 -74.6 -45.9 80.3 0.8 26.7 835 154 D E H > S+ 0 0 74 2,-0.2 4,-1.2 1,-0.2 5,-0.3 0.896 108.4 52.2 -60.9 -35.6 80.7 0.6 22.9 836 155 D E H X S+ 0 0 8 -4,-3.5 4,-2.0 1,-0.2 5,-0.3 0.949 109.6 47.7 -55.0 -47.4 76.9 -0.1 22.9 837 156 D L H X S+ 0 0 0 -4,-2.1 4,-1.4 -5,-0.2 -2,-0.2 0.928 111.8 54.0 -66.8 -35.2 76.4 3.1 25.0 838 157 D A H >X S+ 0 0 28 -4,-3.3 3,-2.9 2,-0.2 4,-0.8 0.950 112.2 38.2 -48.4 -93.1 78.7 5.0 22.6 839 158 D E H >X S+ 0 0 85 -4,-1.2 3,-1.4 1,-0.3 4,-0.6 0.812 117.2 53.0 -23.3 -64.9 77.0 4.2 19.3 840 159 D L H 3< S+ 0 0 8 -4,-2.0 3,-0.5 -5,-0.3 -1,-0.3 0.769 96.4 66.2 -50.8 -29.3 73.5 4.5 20.9 841 160 D W H << S+ 0 0 34 -3,-2.9 -1,-0.2 -4,-1.4 -2,-0.2 0.765 86.2 68.8 -78.2 -20.0 74.0 7.9 22.4 842 161 D N H << S+ 0 0 111 -3,-1.4 -1,-0.3 -4,-0.8 -2,-0.2 0.963 86.6 78.4 -52.9 -47.1 74.3 9.6 19.0 843 162 D Y S >X S- 0 0 122 -4,-0.6 3,-1.0 -3,-0.5 4,-0.6 -0.428 75.8-156.7 -68.0 110.8 70.6 8.8 18.7 844 163 D P T >4 S+ 0 0 93 0, 0.0 3,-2.4 0, 0.0 -1,-0.2 0.916 87.6 54.3 -66.4 -41.8 68.9 11.4 20.8 845 164 D A T 3> S+ 0 0 67 1,-0.3 4,-0.7 2,-0.1 -2,-0.1 0.763 101.0 70.5 -56.0 -26.6 65.6 9.6 21.6 846 165 D A H <> S+ 0 0 0 -3,-1.0 4,-1.8 -6,-0.2 5,-0.4 0.754 78.7 75.9 -50.0 -37.2 67.8 6.9 22.8 847 166 D R H < S+ 0 0 46 -4,-0.7 3,-1.4 2,-0.2 4,-0.3 0.974 113.3 42.1 -62.6 -49.1 65.5 4.7 27.5 850 169 D L H >< S+ 0 0 0 -4,-1.8 3,-2.7 1,-0.3 7,-0.3 0.939 106.0 64.7 -49.9 -52.4 69.1 3.7 28.2 851 170 D E T 3< S+ 0 0 69 -4,-2.4 -1,-0.3 -5,-0.4 -2,-0.2 0.567 105.8 48.6 -49.9 -9.4 69.0 6.2 31.2 852 171 D D T < S+ 0 0 113 -3,-1.4 2,-0.3 -4,-0.2 -1,-0.3 0.539 91.3 88.3-109.9 -13.1 66.4 3.7 32.4 853 172 D I S <> S- 0 0 14 -3,-2.7 4,-2.4 -4,-0.3 3,-0.5 -0.744 81.1-109.9 -99.8 137.1 68.2 0.3 32.0 854 173 D D T 4 S+ 0 0 39 -2,-0.3 2,-2.5 1,-0.2 -1,-0.1 -0.041 105.1 27.9 -62.6 170.5 70.4 -1.2 34.8 855 174 D G T > S+ 0 0 0 33,-0.2 4,-0.7 1,-0.2 -1,-0.2 -0.272 123.0 54.2 66.6 -58.9 74.1 -1.3 33.8 856 175 D Y H >> S+ 0 0 0 -2,-2.5 4,-1.9 -3,-0.5 3,-1.5 0.937 98.6 58.0 -79.1 -35.1 73.7 1.8 31.6 857 176 D R H 3X S+ 0 0 65 -4,-2.4 4,-2.7 1,-0.3 -1,-0.2 0.872 109.4 47.5 -60.1 -37.9 72.1 4.2 34.0 858 177 D C H 3> S+ 0 0 0 -5,-0.3 4,-2.0 1,-0.2 -1,-0.3 0.718 106.9 57.0 -72.3 -25.0 75.0 3.8 36.1 859 178 D A H << S+ 0 0 0 -3,-1.5 4,-0.2 -4,-0.7 -2,-0.2 0.864 113.0 38.5 -85.9 -38.2 77.3 4.3 33.3 860 179 D I H >X>S+ 0 0 4 -4,-1.9 3,-6.3 2,-0.2 4,-1.2 0.976 113.1 57.2 -60.3 -75.5 75.9 7.7 32.4 861 180 D R H 3X5S+ 0 0 132 -4,-2.7 4,-1.0 1,-0.3 -2,-0.2 0.720 109.2 46.1 -25.9 -53.1 75.5 8.6 36.0 862 181 D F H 3X5S+ 0 0 15 -4,-2.0 4,-1.0 2,-0.2 -1,-0.3 0.520 111.5 52.4 -83.2 -5.4 79.2 8.0 36.5 863 182 D A H <4>S+ 0 0 0 -3,-6.3 5,-3.4 -4,-0.2 -1,-0.2 0.864 111.0 44.4 -81.2 -51.2 80.1 10.0 33.4 864 183 D R H <5S+ 0 0 137 -4,-1.2 3,-0.2 3,-0.3 -2,-0.2 0.749 112.6 60.8 -55.6 -24.0 78.1 13.1 34.4 865 184 D K H < - 0 0 51 -2,-0.2 3,-1.9 1,-0.1 4,-0.3 -0.815 24.2-124.2 -93.9 146.8 81.8 12.2 27.7 870 189 D I G > S+ 0 0 7 -2,-0.4 3,-1.4 1,-0.3 -32,-0.1 0.889 115.0 57.7 -57.0 -37.1 79.9 9.0 27.1 871 190 D S G 3 S+ 0 0 75 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.726 103.2 55.4 -65.4 -14.4 82.2 8.6 24.1 872 191 D Q G < S+ 0 0 88 -3,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.306 80.3 87.1-104.3 9.8 85.1 8.8 26.4 873 192 D L S X S+ 0 0 1 -3,-1.4 3,-0.7 -4,-0.3 -1,-0.2 0.871 79.8 64.7 -72.8 -42.8 84.2 6.0 28.9 874 193 D P T 3 S+ 0 0 46 0, 0.0 2,-1.4 0, 0.0 -1,-0.2 0.920 102.5 49.7 -42.6 -47.8 85.8 3.4 26.7 875 194 D N T 3 S+ 0 0 112 -4,-0.2 2,-1.2 1,-0.1 -2,-0.1 -0.397 74.6 149.5 -94.2 62.2 89.2 5.0 27.4 876 195 D I < > - 0 0 9 -2,-1.4 5,-0.7 -3,-0.7 -1,-0.1 -0.442 59.4-110.2-102.9 66.1 88.9 5.2 31.1 877 196 D D T >>5 - 0 0 105 -2,-1.2 3,-0.9 1,-0.1 4,-0.8 0.584 37.7-106.9 13.8 102.0 92.4 5.0 32.5 878 197 D A H 3>5S+ 0 0 85 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.605 115.6 67.8 -25.0 -42.4 92.4 1.5 34.2 879 198 D G H >45S+ 0 0 52 1,-0.2 3,-1.1 2,-0.2 4,-0.3 0.955 105.2 38.9 -37.2 -80.8 92.3 3.1 37.7 880 199 D R H X>5S+ 0 0 87 -3,-0.9 4,-1.8 1,-0.3 3,-0.7 0.698 97.5 78.8 -51.5 -25.9 88.7 4.5 37.3 881 200 D H H >X S+ 0 0 75 -3,-0.7 4,-0.9 -4,-0.3 -1,-0.3 0.927 115.4 49.6 -74.2 -41.2 84.7 2.2 40.5 884 203 D L H XX S+ 0 0 0 -4,-1.8 4,-2.4 -3,-0.9 3,-1.0 0.955 113.6 44.9 -60.5 -54.7 82.6 2.0 37.4 885 204 D I H 3X S+ 0 0 28 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.3 0.908 118.1 47.5 -50.1 -41.3 82.8 -1.8 37.3 886 205 D E H 3X S+ 0 0 81 -4,-1.7 4,-1.0 -5,-0.5 -2,-0.3 0.653 109.4 51.7 -81.4 -8.2 82.2 -1.4 40.9 887 206 D A H XX S+ 0 0 28 -3,-1.0 4,-1.5 -4,-0.9 3,-0.7 0.942 115.0 39.6 -85.3 -54.4 79.3 1.0 40.6 888 207 D I H >X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.3 3,-1.5 0.947 106.4 70.0 -52.9 -56.0 77.3 -1.1 38.1 889 208 D A H 3X S+ 0 0 0 -4,-1.9 4,-1.1 -5,-0.4 -1,-0.3 0.794 109.0 33.3 -13.2 -70.4 78.5 -4.0 40.2 890 209 D N H X S+ 0 0 60 -4,-2.5 4,-2.6 1,-0.3 3,-2.1 0.970 109.7 56.7 -61.6 -54.3 68.0 -4.5 41.1 896 215 D A H 3X S+ 0 0 0 -4,-4.2 4,-1.8 1,-0.3 -1,-0.3 0.864 104.2 55.4 -38.9 -41.4 68.6 -8.0 42.2 897 216 D L H 3X S+ 0 0 75 -4,-1.6 4,-1.4 -5,-0.3 -1,-0.3 0.745 105.3 48.7 -77.4 -20.9 67.1 -6.9 45.5 898 217 D S H < S+ 0 0 40 -4,-1.8 3,-0.6 -5,-0.3 -1,-0.2 0.987 112.6 36.8 -63.3 -51.3 63.9 -10.5 45.5 901 220 D R H 3< S+ 0 0 161 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.463 121.8 44.6 -82.5 -4.1 60.9 -8.6 47.0 902 221 D D H 3< S+ 0 0 68 -4,-1.8 -1,-0.2 -3,-0.3 -2,-0.2 0.438 83.4 101.8-118.2 0.0 58.7 -8.6 43.8 903 222 D F << - 0 0 15 -4,-1.4 2,-0.4 -3,-0.6 -122,-0.1 -0.195 67.3-128.0 -65.5 170.8 58.9 -12.1 42.4 904 223 D P - 0 0 16 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.943 18.9-115.4-110.0 150.7 56.1 -14.4 43.0 905 224 D Q - 0 0 140 -2,-0.4 0, 0.0 1,-0.1 0, 0.0 -0.603 35.3-111.6 -79.6 154.2 56.4 -17.8 44.5 906 225 D W 0 0 49 -2,-0.2 -1,-0.1 1,-0.1 -105,-0.1 -0.759 360.0 360.0 -91.5 112.9 55.4 -20.6 42.2 907 226 D P 0 0 150 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.618 360.0 360.0 -24.7 360.0 52.3 -22.6 43.1