==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 06-JAN-98 1A2M . COMPND 2 MOLECULE: DISULFIDE BOND FORMATION PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.L.MARTIN,L.W.GUDDAT . 376 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17745.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 260 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 4.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 6.4 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 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 13 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 39.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 1 0 1 4 0 1 1 1 1 1 1 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 0 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 . 0 2 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 A 0 0 125 0, 0.0 3,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -53.2 42.7 63.9 32.8 2 2 A Q + 0 0 139 1,-0.3 2,-0.3 0, 0.0 0, 0.0 0.801 360.0 28.0 -70.6 -29.4 46.1 64.6 31.2 3 3 A Y S S+ 0 0 55 4,-0.0 2,-0.3 181,-0.0 -1,-0.3 -0.806 77.6 178.4-137.5 92.7 46.9 67.2 33.9 4 4 A E >>> - 0 0 123 -3,-0.4 3,-1.6 -2,-0.3 2,-1.2 -0.724 38.9-107.2 -96.9 146.0 45.2 66.7 37.3 5 5 A D B 345S+a 9 0A 62 -2,-0.3 5,-0.2 1,-0.2 -1,-0.0 -0.576 109.8 29.9 -73.0 97.9 45.7 68.9 40.3 6 6 A G T 345S+ 0 0 53 3,-2.3 -1,-0.2 -2,-1.2 4,-0.2 0.128 113.1 59.9 140.2 -19.1 47.8 66.8 42.6 7 7 A K T <45S+ 0 0 45 -3,-1.6 158,-0.5 2,-0.3 -2,-0.1 0.875 124.5 4.6 -98.6 -63.5 49.8 64.7 40.1 8 8 A Q T <5S+ 0 0 44 -4,-1.0 154,-1.3 1,-0.3 2,-0.3 0.483 137.8 16.1-103.4 -6.3 51.8 67.0 37.9 9 9 A Y E < -aB 5 161A 34 -5,-0.7 -3,-2.3 152,-0.3 2,-0.5 -0.959 65.0-138.8-164.4 145.9 50.9 70.2 39.6 10 10 A T E - B 0 160A 47 150,-2.9 150,-2.6 -2,-0.3 2,-0.6 -0.948 20.3-130.7-114.5 127.4 49.4 71.4 43.0 11 11 A T E - B 0 159A 69 -2,-0.5 148,-0.2 148,-0.2 2,-0.0 -0.640 31.6-117.6 -76.7 117.4 46.9 74.2 43.2 12 12 A L - 0 0 33 146,-0.9 -1,-0.1 -2,-0.6 133,-0.0 -0.301 12.8-141.3 -55.3 130.2 48.1 76.7 45.9 13 13 A E S S+ 0 0 198 1,-0.3 -1,-0.1 -2,-0.0 -2,-0.0 0.790 99.1 32.0 -62.3 -33.5 45.5 76.9 48.8 14 14 A K S S- 0 0 76 131,-0.0 -1,-0.3 2,-0.0 -2,-0.1 -0.445 92.2-152.4-128.9 66.5 46.1 80.7 49.1 15 15 A P - 0 0 66 0, 0.0 2,-0.5 0, 0.0 143,-0.2 0.272 8.4-129.7 -36.3 147.7 46.9 82.0 45.6 16 16 A V > - 0 0 29 141,-2.7 3,-0.6 129,-0.0 2,-0.2 -0.944 17.9-151.7-113.5 122.0 49.0 85.1 45.1 17 17 A A T 3 S+ 0 0 97 -2,-0.5 140,-0.1 1,-0.2 139,-0.0 -0.496 76.8 34.0 -87.3 161.1 47.8 87.8 42.8 18 18 A G T 3 S+ 0 0 87 1,-0.3 -1,-0.2 -2,-0.2 139,-0.1 0.532 85.7 140.9 73.0 3.9 50.1 90.2 40.9 19 19 A A < - 0 0 38 -3,-0.6 -1,-0.3 137,-0.2 139,-0.0 -0.430 57.1 -95.6 -77.2 153.6 52.6 87.4 40.5 20 20 A P - 0 0 39 0, 0.0 3,-0.3 0, 0.0 137,-0.3 -0.126 34.9-102.3 -65.6 166.6 54.5 86.9 37.2 21 21 A Q S S+ 0 0 100 1,-0.3 135,-2.2 34,-0.2 2,-0.4 0.961 105.6 3.4 -51.4 -67.2 53.5 84.6 34.4 22 22 A V E S-cD 56 155A 2 33,-1.2 35,-2.4 133,-0.2 2,-0.4 -0.949 76.5-168.4-130.3 109.2 56.0 81.8 35.0 23 23 A L E -cD 57 154A 8 131,-2.0 131,-2.8 -2,-0.4 2,-0.5 -0.848 4.6-172.9-104.3 132.8 58.2 82.1 38.1 24 24 A E E -cD 58 153A 3 33,-3.0 35,-2.2 -2,-0.4 2,-0.3 -0.949 7.7-158.1-128.8 113.2 61.2 79.9 38.8 25 25 A F E +cD 59 152A 1 127,-2.0 127,-1.4 -2,-0.5 2,-0.3 -0.659 24.6 153.9 -88.5 142.1 63.1 80.1 42.0 26 26 A F E -c 60 0A 0 33,-2.5 35,-2.2 -2,-0.3 2,-0.3 -0.944 29.3-143.3-156.3 174.0 66.7 78.9 42.2 27 27 A S - 0 0 1 -2,-0.3 3,-0.4 33,-0.2 6,-0.2 -0.991 21.2-134.4-147.0 141.8 70.0 79.2 44.0 28 28 A F S S+ 0 0 0 -2,-0.3 69,-0.1 1,-0.2 68,-0.1 0.580 111.4 53.2 -71.4 -9.7 73.6 79.1 42.8 29 29 A F S S+ 0 0 56 35,-0.2 -1,-0.2 67,-0.1 36,-0.1 0.709 84.3 99.9 -93.4 -27.4 74.4 76.8 45.7 30 30 A a > - 0 0 3 -3,-0.4 4,-0.9 1,-0.2 -3,-0.2 -0.493 58.3-161.3 -66.8 113.1 71.5 74.4 44.9 31 31 A P H > S+ 0 0 87 0, 0.0 4,-1.5 0, 0.0 3,-0.3 0.837 90.3 56.0 -63.1 -39.4 73.1 71.4 43.1 32 32 A H H > S+ 0 0 92 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.891 102.2 59.3 -62.1 -37.0 69.8 70.2 41.6 33 33 A a H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.837 99.9 54.7 -60.3 -35.8 69.5 73.7 40.1 34 34 A Y H X>S+ 0 0 65 -4,-0.9 4,-1.7 -3,-0.3 5,-1.0 0.922 108.8 49.4 -63.8 -41.6 72.8 73.1 38.2 35 35 A Q H <>S+ 0 0 86 -4,-1.5 5,-3.2 1,-0.2 6,-0.3 0.861 109.9 52.3 -63.7 -36.6 71.2 70.0 36.8 36 36 A F H <5S+ 0 0 6 -4,-2.0 6,-2.9 3,-0.2 7,-0.3 0.915 123.0 25.6 -66.4 -45.3 68.2 72.0 35.9 37 37 A E H <5S+ 0 0 25 -4,-2.4 4,-0.4 4,-0.2 -2,-0.2 0.965 128.5 32.9 -84.9 -64.5 70.1 74.7 34.0 38 38 A E T <5S+ 0 0 35 -4,-1.7 -3,-0.2 -5,-0.2 -2,-0.1 0.915 132.3 22.1 -63.3 -49.5 73.4 73.3 32.7 39 39 A V T + 0 0 92 -4,-0.4 4,-1.2 -6,-0.3 -4,-0.2 0.908 39.3 157.7 58.1 42.3 68.4 72.9 29.9 42 42 A I H > + 0 0 9 -6,-2.9 4,-2.6 1,-0.2 5,-0.3 0.925 63.2 53.9 -63.9 -46.6 64.9 73.2 31.6 43 43 A S H > S+ 0 0 12 -7,-0.3 4,-0.7 1,-0.2 -1,-0.2 0.801 114.0 40.0 -61.4 -33.7 64.8 77.0 31.5 44 44 A D H 4 S+ 0 0 89 -7,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.668 116.3 50.7 -89.7 -18.2 65.4 77.3 27.8 45 45 A N H < S+ 0 0 70 -4,-1.2 3,-0.3 -3,-0.3 -2,-0.2 0.861 107.7 50.0 -84.0 -41.6 63.2 74.4 26.8 46 46 A V H >X S+ 0 0 3 -4,-2.6 3,-1.3 1,-0.2 4,-1.1 0.871 109.4 55.4 -63.3 -34.2 60.2 75.5 28.8 47 47 A K T 3< S+ 0 0 54 -4,-0.7 -1,-0.2 -5,-0.3 -2,-0.2 0.778 102.3 55.9 -67.7 -29.1 60.7 78.8 27.0 48 48 A K T 34 S+ 0 0 86 -4,-0.5 -1,-0.3 -3,-0.3 -2,-0.2 0.129 112.7 42.3 -90.6 19.5 60.5 77.0 23.7 49 49 A K T <4 S+ 0 0 37 -3,-1.3 -2,-0.2 2,-0.1 -1,-0.2 0.416 88.3 105.2-135.7 -17.8 57.1 75.5 24.5 50 50 A L S < S- 0 0 26 -4,-1.1 3,-0.1 -5,-0.1 133,-0.1 -0.447 75.8-108.2 -70.4 141.0 55.4 78.6 26.1 51 51 A P > - 0 0 64 0, 0.0 3,-0.8 0, 0.0 2,-0.1 -0.138 46.4 -77.4 -65.7 165.5 52.8 80.3 24.0 52 52 A E T 3 S+ 0 0 205 1,-0.2 3,-0.1 3,-0.0 0, 0.0 -0.419 115.5 26.7 -66.3 134.1 53.3 83.7 22.5 53 53 A G T 3 S+ 0 0 71 1,-0.4 -1,-0.2 -2,-0.1 2,-0.1 -0.206 92.3 107.8 108.9 -42.9 53.0 86.6 24.9 54 54 A V < - 0 0 29 -3,-0.8 -1,-0.4 -33,-0.1 2,-0.4 -0.383 52.0-157.9 -70.5 147.9 54.0 84.8 28.1 55 55 A K - 0 0 57 -3,-0.1 -33,-1.2 -2,-0.1 -34,-0.2 -0.990 9.5-131.4-133.4 139.6 57.3 85.5 29.7 56 56 A M E -c 22 0A 48 -2,-0.4 2,-0.4 -35,-0.1 -33,-0.2 -0.546 18.8-163.7 -87.4 152.6 59.5 83.5 32.1 57 57 A T E -c 23 0A 33 -35,-2.4 -33,-3.0 -2,-0.2 2,-0.4 -0.994 4.1-159.4-141.6 130.1 61.1 84.9 35.3 58 58 A K E -c 24 0A 34 -2,-0.4 2,-0.4 -35,-0.2 -33,-0.2 -0.922 8.1-171.3-113.5 133.9 63.9 83.6 37.5 59 59 A Y E -c 25 0A 42 -35,-2.2 -33,-2.5 -2,-0.4 2,-0.3 -0.943 16.6-133.8-122.5 143.7 64.5 84.6 41.1 60 60 A H E -c 26 0A 3 -2,-0.4 2,-0.4 13,-0.2 -33,-0.2 -0.755 19.3-142.6 -97.2 145.6 67.4 83.8 43.4 61 61 A V - 0 0 8 -35,-2.2 3,-0.3 -2,-0.3 -33,-0.2 -0.841 11.5-159.0-112.9 148.0 67.0 82.6 46.9 62 62 A N + 0 0 56 -2,-0.4 8,-0.2 1,-0.2 4,-0.2 0.146 70.0 91.9-107.8 18.8 68.9 83.3 50.1 63 63 A F S S+ 0 0 105 1,-0.1 2,-0.4 6,-0.1 -1,-0.2 0.325 85.0 64.0 -92.5 13.3 68.1 80.4 52.5 64 64 A M S S+ 0 0 66 -3,-0.3 -35,-0.2 2,-0.2 -1,-0.1 -0.949 99.8 18.8-141.8 114.0 71.1 78.6 51.1 65 65 A G S > S- 0 0 41 -2,-0.4 3,-0.7 -36,-0.1 4,-0.1 0.400 91.9-112.3 114.8 -2.6 74.7 79.7 51.4 66 66 A G T >> S- 0 0 51 1,-0.2 3,-1.6 2,-0.2 4,-1.2 -0.378 78.1 -19.1 76.5-156.6 74.8 82.2 54.3 67 67 A D H 3> S+ 0 0 141 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.822 137.6 59.1 -55.6 -35.0 75.6 85.9 53.8 68 68 A L H <> S+ 0 0 32 -3,-0.7 4,-1.9 1,-0.2 -1,-0.3 0.765 98.9 60.2 -65.8 -25.1 77.2 85.0 50.4 69 69 A G H <> S+ 0 0 0 -3,-1.6 4,-1.6 2,-0.2 -1,-0.2 0.935 104.8 46.9 -66.4 -44.1 73.8 83.6 49.5 70 70 A K H X S+ 0 0 38 -4,-1.2 4,-2.1 1,-0.2 -2,-0.2 0.852 111.2 53.0 -63.9 -35.6 72.3 87.1 50.1 71 71 A D H X S+ 0 0 42 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.836 107.7 50.2 -68.8 -35.5 75.1 88.5 48.0 72 72 A L H X S+ 0 0 0 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.794 109.6 51.2 -72.8 -28.9 74.4 86.1 45.1 73 73 A T H X S+ 0 0 1 -4,-1.6 4,-1.4 2,-0.2 -2,-0.2 0.902 114.7 42.7 -71.8 -41.5 70.7 87.1 45.3 74 74 A Q H X S+ 0 0 45 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.848 113.4 52.8 -70.7 -34.4 71.8 90.8 45.1 75 75 A A H X S+ 0 0 0 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.830 107.7 52.0 -68.6 -32.6 74.3 89.8 42.5 76 76 A W H X S+ 0 0 3 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.815 104.0 56.7 -72.2 -32.9 71.4 88.2 40.6 77 77 A A H >X S+ 0 0 0 -4,-1.4 4,-3.2 2,-0.2 3,-0.5 0.950 106.0 50.2 -62.3 -47.1 69.4 91.4 40.9 78 78 A V H 3X S+ 0 0 0 -4,-1.8 4,-2.1 1,-0.3 6,-0.2 0.862 107.1 55.4 -57.9 -37.6 72.3 93.2 39.1 79 79 A A H 3<>S+ 0 0 0 -4,-1.3 5,-1.9 1,-0.2 6,-0.9 0.849 113.7 41.0 -64.8 -34.4 72.1 90.5 36.4 80 80 A M H <<5S+ 0 0 43 -4,-1.5 3,-0.4 -3,-0.5 -2,-0.2 0.905 112.8 51.4 -79.4 -46.7 68.4 91.3 35.9 81 81 A A H <5S+ 0 0 48 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.861 117.1 40.8 -58.8 -39.1 68.7 95.1 36.1 82 82 A L T <5S- 0 0 60 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.580 106.8-130.9 -85.3 -13.0 71.5 95.1 33.5 83 83 A G T 5S+ 0 0 46 -3,-0.4 3,-0.2 -4,-0.3 -3,-0.2 0.836 72.0 121.8 65.8 35.3 69.7 92.4 31.5 84 84 A V >>< + 0 0 39 -5,-1.9 4,-1.4 -6,-0.2 3,-0.8 0.159 27.7 119.0-111.3 16.9 72.8 90.2 31.2 85 85 A E H 3> + 0 0 68 -6,-0.9 4,-1.2 1,-0.3 2,-1.0 0.829 64.1 67.9 -51.4 -38.2 71.2 87.2 32.8 86 86 A D H 34 S+ 0 0 156 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.0 -0.077 111.2 29.8 -79.0 40.1 71.7 85.1 29.6 87 87 A K H <4 S+ 0 0 53 -2,-1.0 -1,-0.2 -3,-0.8 -2,-0.2 0.347 113.6 53.6-160.9 -34.5 75.5 85.1 30.0 88 88 A V H X S+ 0 0 0 -4,-1.4 4,-1.2 1,-0.1 5,-0.2 0.650 88.8 80.4 -88.7 -17.3 76.4 85.3 33.7 89 89 A T H X S+ 0 0 16 -4,-1.2 4,-1.5 -5,-0.2 3,-0.2 0.924 94.5 42.8 -55.5 -53.2 74.2 82.3 34.8 90 90 A V H >> S+ 0 0 69 1,-0.2 4,-3.0 2,-0.2 3,-0.6 0.963 112.8 49.0 -62.4 -56.4 76.7 79.5 33.8 91 91 A P H 3> S+ 0 0 40 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.721 111.5 53.1 -59.0 -19.9 80.0 81.0 35.0 92 92 A L H 3X S+ 0 0 0 -4,-1.2 4,-1.0 -3,-0.2 5,-0.2 0.830 110.9 44.7 -81.6 -36.1 78.3 81.7 38.4 93 93 A F H S+ 0 0 5 -4,-1.5 4,-2.9 -3,-0.6 5,-0.7 0.930 119.9 42.5 -70.1 -44.7 77.1 78.1 38.7 94 94 A E H X>S+ 0 0 80 -4,-3.0 5,-2.2 1,-0.2 6,-0.9 0.861 112.4 52.5 -68.9 -40.1 80.6 76.9 37.6 95 95 A G H <5S+ 0 0 3 -4,-1.8 7,-2.6 -5,-0.3 6,-1.1 0.737 121.3 32.8 -69.9 -22.3 82.5 79.4 39.7 96 96 A V H <5S+ 0 0 21 -4,-1.0 -2,-0.2 4,-0.2 -3,-0.2 0.871 132.5 22.9 -98.8 -50.5 80.5 78.3 42.8 97 97 A Q H <5S+ 0 0 52 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.1 0.756 132.7 25.5 -91.4 -29.1 79.8 74.6 42.4 98 98 A K T < S- 0 0 42 -3,-0.1 4,-1.2 -36,-0.1 3,-0.2 -0.949 90.2 -82.7-164.2 178.4 83.2 86.0 48.5 105 105 A A H > S+ 0 0 43 -2,-0.3 4,-1.3 1,-0.2 5,-0.1 0.777 122.0 56.9 -64.0 -28.5 81.5 89.2 47.2 106 106 A S H > S+ 0 0 78 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.871 101.6 52.5 -73.0 -39.1 84.7 90.1 45.3 107 107 A D H > S+ 0 0 55 -3,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.856 106.4 54.9 -66.2 -35.2 85.0 86.9 43.2 108 108 A I H >X S+ 0 0 0 -4,-1.2 4,-1.5 2,-0.2 3,-0.6 0.930 107.4 49.8 -62.4 -46.4 81.4 87.3 42.0 109 109 A R H 3X S+ 0 0 90 -4,-1.3 4,-2.0 1,-0.3 3,-0.3 0.916 105.7 57.3 -57.4 -43.9 82.2 90.8 40.7 110 110 A D H 3X S+ 0 0 106 -4,-1.9 4,-1.7 1,-0.2 -1,-0.3 0.808 102.6 55.6 -58.0 -32.0 85.3 89.4 39.0 111 111 A V H S+ 0 0 0 -4,-1.5 5,-2.0 -3,-0.3 4,-1.4 0.875 109.6 51.1 -62.7 -41.5 80.8 89.9 35.7 113 113 A I H <5S+ 0 0 63 -4,-2.0 3,-0.3 1,-0.2 -1,-0.2 0.911 110.9 47.4 -64.0 -43.6 83.9 91.8 34.5 114 114 A N H <5S+ 0 0 145 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.794 107.7 59.9 -67.0 -27.2 85.2 88.8 32.7 115 115 A A H <5S- 0 0 49 -4,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.833 130.1 -89.0 -70.1 -34.9 81.7 88.4 31.3 116 116 A G T <5S+ 0 0 68 -4,-1.4 2,-0.4 1,-0.3 -3,-0.2 0.473 84.5 122.8 138.4 6.5 81.8 91.8 29.6 117 117 A I < - 0 0 12 -5,-2.0 -1,-0.3 1,-0.0 -2,-0.1 -0.829 64.2-110.0-100.7 135.4 80.5 94.4 32.1 118 118 A K > - 0 0 44 -2,-0.4 4,-2.1 1,-0.1 5,-0.2 -0.296 22.4-123.6 -60.7 141.9 82.6 97.4 33.1 119 119 A G H > S+ 0 0 27 1,-0.2 4,-1.1 2,-0.2 -1,-0.1 0.721 114.2 49.9 -58.9 -23.1 83.9 97.4 36.6 120 120 A E H > S+ 0 0 77 2,-0.2 4,-2.3 3,-0.1 -1,-0.2 0.863 106.5 54.2 -82.4 -39.8 82.2 100.7 37.2 121 121 A E H > S+ 0 0 111 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.906 109.6 47.3 -60.0 -46.1 78.8 99.6 35.8 122 122 A Y H X S+ 0 0 6 -4,-2.1 4,-3.0 2,-0.2 -1,-0.2 0.943 114.1 44.5 -61.6 -54.6 78.6 96.6 38.1 123 123 A D H X S+ 0 0 63 -4,-1.1 4,-1.4 2,-0.2 -2,-0.2 0.892 114.7 49.0 -59.3 -42.5 79.5 98.5 41.3 124 124 A A H < S+ 0 0 70 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.863 115.3 45.5 -65.5 -35.9 77.2 101.4 40.5 125 125 A A H >< S+ 0 0 12 -4,-1.9 3,-1.8 -5,-0.2 6,-0.3 0.878 105.0 61.5 -74.1 -38.4 74.4 98.9 39.7 126 126 A W H 3< S+ 0 0 41 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.849 109.5 41.3 -56.2 -38.9 75.1 96.9 42.9 127 127 A N T 3< S+ 0 0 113 -4,-1.4 -1,-0.3 -5,-0.1 2,-0.2 0.214 93.8 117.2 -95.4 13.9 74.3 99.9 45.1 128 128 A S S X> S- 0 0 32 -3,-1.8 4,-1.8 1,-0.1 3,-0.9 -0.547 70.6-128.1 -86.3 149.1 71.3 101.0 43.0 129 129 A F H 3> S+ 0 0 58 1,-0.3 4,-3.7 2,-0.2 5,-0.3 0.885 108.8 63.4 -58.4 -42.6 67.7 101.2 44.3 130 130 A V H 3> S+ 0 0 87 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.819 107.3 45.5 -51.9 -33.3 66.5 99.1 41.3 131 131 A V H <> S+ 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24.1-129.6 -95.2 124.0 52.8 75.1 41.7 161 161 A L E -B 9 0A 3 -8,-2.6 -8,-0.5 -2,-0.5 -152,-0.3 -0.615 17.2-150.8 -77.7 120.4 54.5 72.7 39.2 162 162 A N - 0 0 25 -154,-1.3 3,-0.4 -2,-0.5 -10,-0.1 -0.829 13.3-171.3 -95.9 113.1 55.3 69.3 40.8 163 163 A P S S+ 0 0 56 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.614 79.9 74.1 -75.3 -12.0 58.4 67.6 39.3 164 164 A Q S S+ 0 0 170 1,-0.2 2,-1.6 -157,-0.0 -156,-0.1 0.925 86.4 59.1 -66.5 -48.4 57.5 64.5 41.3 165 165 A G S S+ 0 0 31 -158,-0.5 2,-0.3 -3,-0.4 -1,-0.2 -0.296 94.8 84.1 -82.5 54.8 54.5 63.4 39.1 166 166 A M S S- 0 0 21 -2,-1.6 8,-0.1 -3,-0.5 7,-0.0 -0.964 88.6 -71.6-149.8 162.7 56.5 63.1 35.9 167 167 A D + 0 0 80 -2,-0.3 11,-0.1 6,-0.2 10,-0.1 -0.273 36.1 179.1 -57.5 135.7 58.6 60.6 33.9 168 168 A T + 0 0 124 5,-0.1 -1,-0.1 6,-0.0 6,-0.1 0.576 63.2 77.4-112.4 -18.7 62.1 60.1 35.4 169 169 A S S S+ 0 0 83 1,-0.1 2,-0.4 2,-0.1 3,-0.0 0.960 91.8 36.4 -56.3 -95.7 63.4 57.6 32.9 170 170 A N S >> S- 0 0 55 1,-0.2 4,-1.6 2,-0.1 3,-0.7 -0.527 73.5-147.9 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191 2 B Q + 0 0 65 1,-0.2 2,-0.6 2,-0.0 6,-0.1 0.966 360.0 51.6 -79.3 -65.3 47.2 127.0 46.2 192 3 B Y S S+ 0 0 67 4,-0.1 2,-0.2 5,-0.1 -1,-0.2 -0.658 79.5 176.4 -77.8 115.8 48.7 123.5 46.1 193 4 B E >>> - 0 0 120 -2,-0.6 5,-1.2 -3,-0.1 3,-0.9 -0.719 34.5 -96.7-119.3 168.2 51.7 123.6 43.8 194 5 B D B 345S+f 198 0B 115 -2,-0.2 5,-0.3 1,-0.2 154,-0.0 -0.727 108.6 16.9 -86.5 129.3 54.4 121.2 42.7 195 6 B G T 345S+ 0 0 54 3,-1.7 -1,-0.2 -2,-0.4 4,-0.2 0.614 124.4 61.0 85.5 14.0 57.7 121.4 44.6 196 7 B K T <45S+ 0 0 32 -3,-0.9 158,-0.5 2,-0.8 3,-0.2 0.497 116.0 10.6-129.2 -79.6 56.0 123.3 47.5 197 8 B Q T <5S- 0 0 26 -4,-0.8 154,-3.1 1,-0.3 2,-0.3 0.957 142.8 -0.3 -71.3 -52.5 53.1 121.5 49.3 198 9 B Y E - 0 0 40 141,-1.6 3,-0.7 -2,-0.2 2,-0.1 -0.828 19.9-151.9 -94.7 109.5 55.4 103.8 40.8 206 17 B A T 3 S+ 0 0 97 -2,-0.8 140,-0.1 1,-0.2 139,-0.0 -0.366 73.7 35.7 -78.0 159.3 52.0 102.3 39.9 207 18 B G T 3 S+ 0 0 87 1,-0.3 -1,-0.2 138,-0.1 3,-0.1 0.120 84.4 131.4 86.5 -22.4 50.1 99.8 42.1 208 19 B A S < S- 0 0 33 -3,-0.7 -1,-0.3 1,-0.1 4,-0.1 -0.328 70.8 -86.9 -63.9 143.1 51.5 101.5 45.2 209 20 B P - 0 0 41 0, 0.0 137,-0.5 0, 0.0 -1,-0.1 -0.219 34.3-119.2 -56.4 137.0 48.9 102.2 47.9 210 21 B Q S S+ 0 0 76 1,-0.2 135,-2.6 135,-0.2 2,-0.6 0.876 103.7 31.4 -40.3 -57.3 47.0 105.5 47.6 211 22 B V E S+hI 245 344B 0 33,-1.2 35,-2.1 133,-0.2 2,-0.4 -0.938 77.6 176.5-113.7 114.8 48.3 106.9 50.9 212 23 B L E -hI 246 343B 5 131,-2.2 131,-2.3 -2,-0.6 2,-0.4 -0.943 7.5-177.1-119.3 140.3 51.7 105.7 52.0 213 24 B E E -hI 247 342B 5 33,-1.4 35,-1.5 -2,-0.4 2,-0.4 -0.930 7.0-164.9-142.6 115.8 53.7 106.7 55.0 214 25 B F E +hI 248 341B 0 127,-1.4 127,-1.4 -2,-0.4 2,-0.2 -0.770 24.1 153.5 -96.0 142.1 57.2 105.6 56.0 215 26 B F E -h 249 0B 3 33,-1.8 35,-1.1 -2,-0.4 2,-0.3 -0.845 28.6-142.5-151.2-174.7 58.5 106.2 59.5 216 27 B S > - 0 0 0 -2,-0.2 3,-1.7 33,-0.2 6,-0.2 -0.914 20.6-136.7-162.5 132.9 60.9 104.9 62.2 217 28 B F T 3 S+ 0 0 0 -2,-0.3 69,-0.1 1,-0.3 37,-0.1 0.623 111.2 55.7 -65.1 -11.6 60.7 104.5 65.9 218 29 B F T 3 S+ 0 0 68 35,-0.1 -1,-0.3 67,-0.1 36,-0.1 0.510 86.3 97.0 -96.0 -9.9 64.3 105.9 65.9 219 30 B b <> - 0 0 2 -3,-1.7 4,-1.0 1,-0.1 3,-0.3 -0.755 63.3-152.8 -88.9 119.5 63.3 109.1 64.0 220 31 B P H >> S+ 0 0 72 0, 0.0 4,-1.3 0, 0.0 3,-0.6 0.871 95.9 48.9 -54.4 -49.8 62.7 112.2 66.2 221 32 B H H 3> S+ 0 0 111 1,-0.2 4,-2.1 118,-0.2 5,-0.1 0.795 105.7 61.1 -64.4 -27.4 60.2 114.0 63.9 222 33 B b H 34 S+ 0 0 4 -3,-0.3 -1,-0.2 2,-0.2 5,-0.2 0.813 98.5 55.8 -68.7 -31.2 58.4 110.6 63.6 223 34 B Y H XX>S+ 0 0 49 -4,-1.0 4,-1.9 -3,-0.6 3,-0.9 0.917 111.2 44.2 -66.4 -42.5 57.7 110.7 67.4 224 35 B Q H 3X>S+ 0 0 95 -4,-1.3 5,-3.0 1,-0.3 4,-0.7 0.860 103.0 64.8 -69.9 -36.3 56.1 114.1 66.9 225 36 B F H 3<5S+ 0 0 15 -4,-2.1 7,-0.9 4,-0.2 6,-0.3 0.224 124.6 14.1 -72.6 17.4 54.2 113.0 63.8 226 37 B E H <45S+ 0 0 17 -3,-0.9 -2,-0.2 4,-0.2 -3,-0.1 0.230 127.0 43.9-148.5 -74.6 52.4 110.6 66.2 227 38 B E H <5S+ 0 0 38 -4,-1.9 -3,-0.2 -5,-0.2 -2,-0.1 0.717 132.3 17.8 -57.5 -25.3 52.7 111.2 70.0 228 39 B V T < + 0 0 77 -6,-0.7 4,-2.2 3,-0.1 -4,-0.2 0.937 31.6 164.2 62.1 50.5 48.8 112.8 65.4 231 42 B I H > + 0 0 0 -6,-0.3 4,-2.6 1,-0.2 5,-0.3 0.913 68.8 56.3 -64.4 -44.1 49.2 113.3 61.6 232 43 B S H > S+ 0 0 8 -7,-0.9 4,-0.9 1,-0.2 -1,-0.2 0.864 112.2 44.0 -56.4 -39.5 48.4 109.6 60.7 233 44 B D H > S+ 0 0 92 2,-0.2 4,-1.3 1,-0.2 3,-0.3 0.935 114.5 46.6 -72.2 -49.7 45.1 109.9 62.5 234 45 B N H X S+ 0 0 55 -4,-2.2 4,-1.4 1,-0.2 -2,-0.2 0.821 107.1 57.1 -64.1 -35.2 44.1 113.3 61.2 235 46 B V H X S+ 0 0 1 -4,-2.6 4,-1.0 1,-0.2 -1,-0.2 0.856 103.4 57.1 -65.3 -32.1 44.9 112.5 57.6 236 47 B K H >< S+ 0 0 50 -4,-0.9 3,-0.8 -3,-0.3 -2,-0.2 0.943 101.4 53.4 -63.0 -52.1 42.5 109.5 57.9 237 48 B K H 3< S+ 0 0 177 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.899 109.9 46.9 -50.0 -51.4 39.5 111.6 58.9 238 49 B K H 3< S+ 0 0 47 -4,-1.4 -1,-0.3 2,-0.0 -2,-0.2 0.723 92.6 103.1 -66.6 -22.8 39.8 114.0 55.9 239 50 B L S << S- 0 0 22 -4,-1.0 3,-0.1 -3,-0.8 133,-0.0 -0.384 73.5-121.1 -67.1 135.9 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95.0 61.2 270 81 B A H <5S+ 0 0 42 -4,-1.0 -2,-0.2 -5,-0.2 -1,-0.2 0.901 118.3 35.8 -77.2 -45.2 49.9 91.3 61.1 271 82 B L H <5S- 0 0 74 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.342 103.7-129.9 -90.0 5.4 48.3 90.9 64.5 272 83 B G T <5S+ 0 0 43 -4,-0.5 3,-0.5 1,-0.2 -3,-0.2 0.562 72.5 126.3 58.0 10.2 46.6 94.3 64.1 273 84 B V >>< + 0 0 33 -5,-0.7 4,-1.9 -6,-0.3 3,-0.8 0.176 30.0 121.0 -83.5 21.0 47.9 95.3 67.5 274 85 B E H 3> + 0 0 71 -6,-0.7 4,-1.9 1,-0.2 3,-0.4 0.909 68.8 51.0 -48.6 -55.7 49.3 98.4 65.8 275 86 B D H 3> S+ 0 0 134 -3,-0.5 4,-0.5 1,-0.2 -1,-0.2 0.774 112.3 47.4 -57.2 -30.5 47.4 101.0 68.0 276 87 B K H <4 S+ 0 0 43 -3,-0.8 -1,-0.2 1,-0.1 -2,-0.2 0.807 117.2 39.2 -83.7 -31.0 48.5 99.3 71.2 277 88 B V H X S+ 0 0 0 -4,-1.9 4,-1.6 -3,-0.4 5,-0.2 0.611 98.4 74.6 -96.2 -13.1 52.2 99.0 70.5 278 89 B T H X S+ 0 0 10 -4,-1.9 4,-2.2 -5,-0.2 5,-0.2 0.969 98.5 44.1 -63.4 -54.1 52.9 102.3 68.7 279 90 B V H X S+ 0 0 59 -4,-0.5 4,-1.7 1,-0.2 -1,-0.2 0.918 117.0 42.6 -59.1 -50.8 52.8 104.5 71.8 280 91 B P H > S+ 0 0 43 0, 0.0 4,-2.9 0, 0.0 -1,-0.2 0.840 113.7 52.2 -68.6 -33.3 54.8 102.3 74.1 281 92 B L H X S+ 0 0 0 -4,-1.6 4,-3.3 2,-0.2 5,-0.3 0.955 109.1 48.9 -66.3 -49.7 57.5 101.4 71.5 282 93 B F H X>S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.2 5,-0.8 0.889 117.6 43.2 -55.5 -40.4 58.1 105.1 70.6 283 94 B E H <>S+ 0 0 68 -4,-1.7 5,-2.0 -5,-0.2 6,-0.8 0.868 114.1 48.9 -74.8 -38.6 58.4 105.8 74.3 284 95 B G H <5S+ 0 0 6 -4,-2.9 7,-1.7 4,-0.2 6,-0.8 0.917 120.2 38.5 -66.7 -41.4 60.5 102.8 75.1 285 96 B V H <5S+ 0 0 14 -4,-3.3 -2,-0.2 4,-0.2 -3,-0.2 0.964 134.0 16.3 -73.2 -56.5 62.8 103.6 72.2 286 97 B Q T <5S+ 0 0 59 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.1 0.954 128.4 35.7 -87.8 -57.2 63.0 107.4 72.4 287 98 B K T > S- 0 0 50 -36,-0.0 4,-1.5 1,-0.0 3,-0.8 -0.944 85.1 -94.4-150.9 170.4 67.4 94.6 72.4 294 105 B A H 3> S+ 0 0 38 -2,-0.3 4,-1.7 1,-0.3 5,-0.1 0.754 121.6 61.1 -59.3 -25.8 64.8 92.4 70.6 295 106 B S H 3> S+ 0 0 57 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.874 102.7 49.5 -69.2 -38.3 63.8 91.1 74.0 296 107 B D H <> S+ 0 0 41 -3,-0.8 4,-1.9 2,-0.2 -2,-0.2 0.843 109.0 51.5 -69.3 -34.8 62.8 94.5 75.2 297 108 B I H X S+ 0 0 0 -4,-1.5 4,-1.5 2,-0.2 -1,-0.2 0.889 109.6 51.9 -66.8 -37.7 60.7 95.0 72.0 298 109 B R H X S+ 0 0 14 -4,-1.7 4,-3.0 1,-0.2 -2,-0.2 0.900 105.7 54.2 -63.7 -41.3 59.2 91.6 72.9 299 110 B D H X S+ 0 0 72 -4,-2.1 4,-3.2 1,-0.2 5,-0.3 0.897 103.6 55.8 -60.2 -41.9 58.4 92.9 76.4 300 111 B V H X S+ 0 0 22 -4,-1.9 4,-0.5 1,-0.2 -1,-0.2 0.887 113.4 40.9 -58.2 -41.8 56.6 95.9 74.9 301 112 B F H <>S+ 0 0 1 -4,-1.5 5,-1.6 2,-0.2 3,-0.5 0.923 115.7 50.2 -72.5 -45.5 54.3 93.6 72.9 302 113 B I H ><5S+ 0 0 72 -4,-3.0 3,-0.6 1,-0.2 -2,-0.2 0.918 110.7 47.8 -59.5 -48.0 53.9 91.1 75.8 303 114 B N H 3<5S+ 0 0 135 -4,-3.2 2,-0.4 1,-0.3 -1,-0.2 0.686 101.1 71.3 -67.8 -17.2 53.0 93.7 78.4 304 115 B A T 3<5S- 0 0 32 -4,-0.5 -1,-0.3 -3,-0.5 -2,-0.1 -0.225 127.9 -88.3 -94.0 43.0 50.5 95.1 75.8 305 116 B G T < 5S+ 0 0 80 -3,-0.6 2,-0.4 -2,-0.4 -3,-0.2 0.339 93.5 126.8 72.0 -10.9 48.1 92.2 76.1 306 117 B I < - 0 0 15 -5,-1.6 2,-0.3 -6,-0.2 -1,-0.2 -0.664 59.8-126.9 -83.0 133.1 50.0 90.3 73.4 307 118 B K > - 0 0 58 -2,-0.4 4,-2.2 1,-0.1 3,-0.4 -0.585 9.1-131.0 -80.6 140.9 51.0 86.7 74.4 308 119 B G H > S+ 0 0 22 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.769 109.5 56.4 -59.7 -26.7 54.7 85.7 74.0 309 120 B E H > S+ 0 0 80 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.865 109.5 44.0 -72.3 -39.1 53.5 82.6 72.2 310 121 B E H > S+ 0 0 44 -3,-0.4 4,-1.6 2,-0.2 -2,-0.2 0.814 115.5 49.4 -74.9 -32.9 51.6 84.6 69.6 311 122 B Y H X S+ 0 0 5 -4,-2.2 4,-2.8 2,-0.2 3,-0.3 0.973 112.7 43.3 -70.2 -57.5 54.4 87.1 69.2 312 123 B D H X S+ 0 0 90 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.811 113.3 56.6 -59.0 -29.0 57.3 84.6 68.7 313 124 B A H < S+ 0 0 65 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.899 111.9 39.5 -68.8 -43.5 54.9 82.7 66.4 314 125 B A H >< S+ 0 0 12 -4,-1.6 3,-1.4 -3,-0.3 6,-0.5 0.840 107.5 65.8 -75.3 -34.0 54.3 85.7 64.1 315 126 B W H 3< S+ 0 0 44 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.932 111.1 32.8 -52.9 -54.8 58.0 86.7 64.3 316 127 B N T 3< S+ 0 0 127 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.252 99.7 118.2 -88.7 13.0 59.3 83.7 62.5 317 128 B S S <> S- 0 0 28 -3,-1.4 4,-1.5 1,-0.1 3,-0.2 -0.452 73.0-125.6 -81.7 154.0 56.1 83.4 60.4 318 129 B F H > S+ 0 0 68 1,-0.2 4,-1.6 2,-0.2 -172,-0.1 0.654 107.5 65.7 -70.5 -17.2 56.1 83.7 56.6 319 130 B V H > S+ 0 0 87 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.941 103.5 43.7 -70.0 -47.7 53.5 86.5 56.9 320 131 B V H > S+ 0 0 1 -6,-0.5 4,-2.6 1,-0.2 5,-0.2 0.904 109.3 59.0 -63.2 -41.1 56.0 88.9 58.6 321 132 B K H X S+ 0 0 112 -4,-1.5 4,-1.8 1,-0.2 -1,-0.2 0.896 108.1 45.0 -53.3 -46.0 58.7 87.8 56.1 322 133 B S H X S+ 0 0 9 -4,-1.6 4,-1.1 -179,-0.2 -1,-0.2 0.792 112.6 52.0 -70.0 -30.6 56.5 89.1 53.2 323 134 B L H X S+ 0 0 36 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.851 108.1 49.9 -75.8 -35.2 55.6 92.2 55.1 324 135 B V H X S+ 0 0 21 -4,-2.6 4,-2.0 2,-0.2 5,-0.2 0.949 110.3 50.3 -67.3 -47.8 59.2 93.2 55.8 325 136 B A H X S+ 0 0 2 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.812 111.1 50.0 -59.5 -32.2 60.2 92.7 52.1 326 137 B Q H X S+ 0 0 60 -4,-1.1 4,-2.8 2,-0.2 5,-0.2 0.891 109.2 49.8 -74.6 -39.8 57.2 94.9 51.1 327 138 B Q H X S+ 0 0 3 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.810 117.2 43.6 -66.0 -30.1 58.3 97.6 53.5 328 139 B E H X S+ 0 0 50 -4,-2.0 4,-0.9 2,-0.2 -2,-0.2 0.792 114.2 48.7 -84.2 -32.3 61.7 97.3 52.0 329 140 B K H X S+ 0 0 72 -4,-2.0 4,-2.6 -193,-0.2 5,-0.3 0.930 109.7 51.3 -72.9 -47.0 60.6 97.1 48.4 330 141 B A H X S+ 0 0 18 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.934 109.8 49.1 -55.5 -50.5 58.3 100.1 48.7 331 142 B A H <>S+ 0 0 10 -4,-1.1 5,-2.4 -5,-0.2 4,-0.3 0.819 112.1 52.4 -59.6 -30.9 61.0 102.3 50.1 332 143 B A H ><5S+ 0 0 7 -4,-0.9 3,-1.7 2,-0.2 -2,-0.2 0.968 109.5 43.7 -70.5 -56.6 63.3 101.1 47.3 333 144 B D H 3<5S+ 0 0 62 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.882 113.4 54.8 -55.1 -39.9 61.0 101.9 44.4 334 145 B V T 3<5S- 0 0 22 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.629 104.3-135.5 -68.7 -15.1 60.3 105.2 46.1 335 146 B Q T < 5 - 0 0 42 -3,-1.7 -3,-0.2 -4,-0.3 -2,-0.1 0.868 38.9-174.8 57.4 35.5 64.0 105.9 46.2 336 147 B L < + 0 0 11 -5,-2.4 -1,-0.1 -6,-0.2 3,-0.1 -0.218 28.1 159.1 -62.0 151.7 63.4 107.0 49.8 337 148 B R + 0 0 195 1,-0.4 2,-0.3 -3,-0.1 -1,-0.1 0.423 59.6 48.5-146.5 -24.2 66.2 108.5 51.9 338 149 B G S S- 0 0 41 -124,-0.0 -1,-0.4 2,-0.0 -124,-0.1 -0.903 71.3-124.5-128.0 155.6 64.5 110.4 54.6 339 150 B V S S+ 0 0 24 -2,-0.3 -118,-0.2 1,-0.2 -117,-0.2 -0.981 81.1 54.2-145.0 141.2 61.7 109.8 57.2 340 151 B P S S+ 0 0 27 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.347 80.1 144.2 -70.2 141.5 59.1 111.1 58.0 341 152 B A E -I 214 0B 5 -127,-1.4 -127,-1.4 -2,-0.1 2,-0.4 -0.968 32.6-156.7-148.1 153.5 57.7 111.0 54.5 342 153 B M E -I 213 0B 0 8,-0.5 8,-2.5 -2,-0.3 2,-0.5 -0.994 3.3-161.7-140.1 132.9 54.3 110.4 52.8 343 154 B F E -IJ 212 349B 5 -131,-2.3 -131,-2.2 -2,-0.4 2,-0.5 -0.951 4.0-160.5-120.6 123.1 53.5 109.3 49.2 344 155 B V E >> S-IJ 211 348B 0 4,-2.2 3,-1.9 -2,-0.5 4,-1.7 -0.857 74.9 -16.5-104.1 130.4 50.1 109.8 47.5 345 156 B N T 34 S- 0 0 61 -135,-2.6 -1,-0.2 -2,-0.5 -135,-0.2 0.694 106.6 -85.9 51.7 24.5 49.1 107.7 44.5 346 157 B G T 34 S+ 0 0 7 -137,-0.5 -141,-1.6 -136,-0.3 -1,-0.3 0.748 125.1 75.5 51.7 28.4 52.7 106.7 44.0 347 158 B K T <4 S+ 0 0 19 -3,-1.9 -146,-1.9 1,-0.3 2,-0.4 0.417 87.8 52.1-140.7 -11.5 53.3 109.8 42.0 348 159 B Y E < -GJ 200 344B 75 -4,-1.7 -4,-2.2 -148,-0.2 2,-0.5 -0.989 58.9-157.5-135.6 143.1 53.4 112.6 44.6 349 160 B Q E -GJ 199 343B 63 -150,-2.5 -150,-3.2 -2,-0.4 -6,-0.2 -0.976 23.9-123.1-123.1 122.8 55.4 113.1 47.8 350 161 B L E -G 198 0B 2 -8,-2.5 -8,-0.5 -2,-0.5 -152,-0.3 -0.350 18.0-158.4 -65.5 136.6 54.3 115.4 50.6 351 162 B N > - 0 0 54 -154,-3.1 3,-1.6 1,-0.1 -1,-0.1 -0.857 9.8-175.9-120.2 93.7 56.8 118.2 51.5 352 163 B P G > S+ 0 0 37 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.717 76.4 77.0 -60.6 -22.5 56.0 119.4 55.1 353 164 B Q G 3 S+ 0 0 91 1,-0.3 4,-0.1 -156,-0.1 -156,-0.1 0.790 89.0 59.5 -59.3 -28.0 58.7 122.1 54.8 354 165 B G G < S+ 0 0 35 -3,-1.6 2,-0.3 -158,-0.5 -1,-0.3 -0.152 93.8 87.2 -94.9 39.0 56.3 124.0 52.6 355 166 B M S < S- 0 0 14 -3,-1.2 2,-0.3 -2,-0.1 8,-0.1 -0.984 87.3 -94.8-139.2 148.7 53.6 124.3 55.4 356 167 B D + 0 0 81 -2,-0.3 10,-0.1 1,-0.1 3,-0.1 -0.441 37.4 174.8 -63.6 121.0 52.9 126.7 58.2 357 168 B T + 0 0 106 -2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.163 54.6 96.0-114.1 16.6 54.5 125.3 61.4 358 169 B S S S+ 0 0 102 1,-0.2 2,-0.4 2,-0.1 -1,-0.1 0.771 93.5 34.7 -75.0 -27.9 53.7 128.3 63.7 359 170 B N S > S- 0 0 71 1,-0.2 4,-2.1 -3,-0.1 -1,-0.2 -0.998 72.8-147.3-130.3 129.4 50.6 126.5 64.9 360 171 B M H > S+ 0 0 115 -2,-0.4 4,-2.6 1,-0.2 5,-0.2 0.960 98.9 49.3 -59.2 -53.2 50.3 122.7 65.4 361 172 B D H > S+ 0 0 127 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.874 110.8 49.7 -55.0 -44.8 46.6 122.5 64.5 362 173 B V H > S+ 0 0 53 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.944 111.4 49.4 -61.4 -47.8 47.0 124.6 61.3 363 174 B F H X S+ 0 0 11 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.947 112.0 47.1 -55.5 -55.0 50.0 122.5 60.1 364 175 B V H X S+ 0 0 10 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.944 114.0 47.9 -52.0 -53.6 48.2 119.2 60.7 365 176 B Q H X S+ 0 0 96 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.882 112.7 48.2 -55.6 -44.1 45.1 120.4 58.9 366 177 B Q H X S+ 0 0 46 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.841 112.6 49.1 -67.5 -34.5 47.1 121.8 56.0 367 178 B Y H X S+ 0 0 3 -4,-2.5 4,-1.6 -5,-0.2 -2,-0.2 0.956 112.4 47.8 -68.9 -49.3 49.0 118.5 55.8 368 179 B A H X S+ 0 0 6 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.870 110.7 51.2 -59.0 -42.8 45.7 116.5 55.8 369 180 B D H X S+ 0 0 53 -4,-2.4 4,-2.8 1,-0.2 -1,-0.2 0.896 105.2 55.8 -64.2 -40.4 44.1 118.6 53.2 370 181 B T H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 -1,-0.2 0.890 107.7 50.5 -59.3 -38.2 47.0 118.3 50.8 371 182 B V H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.967 111.3 46.4 -63.5 -52.2 46.6 114.5 51.1 372 183 B K H X S+ 0 0 13 -4,-2.2 4,-0.9 1,-0.2 -2,-0.2 0.858 111.9 53.4 -57.6 -37.6 42.9 114.8 50.3 373 184 B Y H >< S+ 0 0 110 -4,-2.8 3,-0.7 1,-0.2 4,-0.4 0.937 112.9 41.5 -63.0 -49.2 43.7 117.1 47.4 374 185 B L H 3< S+ 0 0 9 -4,-2.6 3,-0.5 1,-0.2 -2,-0.2 0.746 107.0 64.7 -71.0 -23.4 46.2 114.7 46.0 375 186 B S H 3< S+ 0 0 25 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.742 104.1 46.0 -70.5 -24.6 43.8 111.8 46.7 376 187 B E << 0 0 157 -4,-0.9 -1,-0.2 -3,-0.7 -2,-0.2 0.519 360.0 360.0 -95.2 -8.3 41.3 113.3 44.2 377 188 B K 0 0 93 -3,-0.5 -2,-0.2 -4,-0.4 -1,-0.1 0.851 360.0 360.0 -77.2 360.0 43.9 114.0 41.5