==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 29-JAN-09 3G18 . COMPND 2 MOLECULE: OROTIDINE 5'-PHOSPHATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOTHERMOBACTER THERMAUTOTROPHICUS . AUTHOR A.A.FEDOROV,E.V.FEDOROV,K.K.CHAN,J.A.GERLT,S.C.ALMO . 422 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17301.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 320 75.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 70 16.6 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 . 20 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 158 37.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 2 0 0 2 0 0 2 4 2 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 8 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 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 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 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 4 A R 0 0 221 0, 0.0 2,-0.4 0, 0.0 6,-0.1 0.000 360.0 360.0 360.0 163.4 -1.4 -5.7 -16.7 2 5 A R > - 0 0 95 169,-0.2 3,-1.2 4,-0.2 169,-0.0 -0.793 360.0-141.1 -97.0 135.2 0.3 -3.5 -19.3 3 6 A V T 3 S+ 0 0 151 -2,-0.4 -1,-0.1 1,-0.2 4,-0.1 0.806 97.0 58.1 -63.3 -33.3 2.9 -4.9 -21.7 4 7 A D T 3 S+ 0 0 107 2,-0.1 2,-0.3 167,-0.0 -1,-0.2 0.459 99.3 67.0 -81.3 -0.4 5.2 -1.9 -21.6 5 8 A V S < S- 0 0 15 -3,-1.2 145,-0.1 1,-0.1 167,-0.0 -0.829 98.4 -76.2-118.3 159.8 5.8 -2.0 -17.8 6 9 A M - 0 0 26 -2,-0.3 2,-0.7 1,-0.1 -4,-0.2 -0.149 37.7-132.3 -56.4 141.4 7.5 -4.5 -15.6 7 10 A D - 0 0 78 -4,-0.1 2,-0.6 -6,-0.1 -1,-0.1 -0.863 19.5-163.6 -98.4 115.4 5.8 -7.8 -14.8 8 11 A V > - 0 0 8 -2,-0.7 3,-2.1 178,-0.1 5,-0.1 -0.885 26.5-115.9-100.8 119.1 6.0 -8.6 -11.1 9 12 A M G > S- 0 0 53 -2,-0.6 3,-1.5 1,-0.3 27,-0.3 -0.298 93.5 -7.4 -58.6 129.4 5.3 -12.2 -10.2 10 13 A N G 3 S- 0 0 49 1,-0.3 -1,-0.3 25,-0.1 3,-0.1 0.579 108.9 -92.0 61.3 11.4 2.1 -12.5 -8.1 11 14 A R G < S+ 0 0 95 -3,-2.1 177,-2.4 1,-0.2 2,-0.5 0.786 95.5 123.7 55.3 30.4 2.0 -8.7 -7.8 12 15 A L E < -a 188 0A 0 -3,-1.5 25,-0.5 175,-0.2 2,-0.5 -0.963 43.0-168.2-128.5 116.9 4.0 -9.1 -4.6 13 16 A I E -a 189 0A 0 175,-3.1 177,-2.9 -2,-0.5 2,-0.5 -0.869 19.0-134.2-104.4 132.4 7.3 -7.4 -4.0 14 17 A L E -ab 190 38A 0 23,-2.1 25,-3.4 -2,-0.5 2,-1.1 -0.742 6.6-149.9 -88.1 124.1 9.5 -8.4 -1.0 15 18 A A E - b 0 39A 5 175,-2.8 2,-1.6 -2,-0.5 180,-0.2 -0.808 13.0-162.7 -91.4 98.0 10.9 -5.5 1.0 16 19 A M E + b 0 40A 0 23,-2.2 25,-0.6 -2,-1.1 28,-0.2 -0.647 26.5 156.7 -85.9 85.8 14.1 -7.1 2.2 17 20 A D + 0 0 34 -2,-1.6 -1,-0.2 23,-0.1 2,-0.1 0.321 28.3 119.1 -94.3 5.7 15.0 -4.7 5.0 18 21 A L - 0 0 30 1,-0.1 -2,-0.0 -3,-0.1 26,-0.0 -0.434 54.1-150.7 -70.0 149.0 17.1 -7.1 7.0 19 22 A M + 0 0 56 -2,-0.1 2,-0.5 28,-0.1 -1,-0.1 0.468 69.1 86.6-101.9 -3.3 20.7 -5.8 7.4 20 23 A N > - 0 0 59 1,-0.1 4,-2.7 28,-0.0 5,-0.2 -0.861 67.1-147.0-101.9 129.3 22.5 -9.2 7.7 21 24 A R H > S+ 0 0 82 -2,-0.5 4,-2.7 1,-0.2 5,-0.3 0.908 97.8 54.1 -59.1 -45.0 23.6 -10.9 4.5 22 25 A D H > S+ 0 0 102 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.935 114.7 39.1 -56.4 -50.5 23.0 -14.4 5.9 23 26 A D H > S+ 0 0 55 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.902 114.5 54.5 -67.9 -41.4 19.4 -13.7 6.9 24 27 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.919 112.0 42.4 -59.2 -46.6 18.7 -11.6 3.8 25 28 A L H X S+ 0 0 22 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.877 112.3 54.8 -68.5 -38.7 19.7 -14.4 1.4 26 29 A R H X S+ 0 0 139 -4,-1.8 4,-1.5 -5,-0.3 -2,-0.2 0.933 112.5 41.6 -60.9 -49.0 18.0 -17.1 3.4 27 30 A V H X S+ 0 0 5 -4,-2.4 4,-0.8 2,-0.2 -2,-0.2 0.933 115.9 48.6 -65.9 -48.1 14.6 -15.4 3.3 28 31 A T H >X S+ 0 0 2 -4,-2.0 3,-1.1 -5,-0.3 4,-0.6 0.924 110.9 49.8 -59.8 -47.3 14.8 -14.3 -0.3 29 32 A G H >< S+ 0 0 31 -4,-2.5 3,-0.7 1,-0.2 4,-0.3 0.862 106.7 57.2 -60.5 -35.2 15.8 -17.7 -1.6 30 33 A E H 3< S+ 0 0 68 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.683 112.8 39.0 -70.0 -19.2 13.0 -19.3 0.3 31 34 A V H XX S+ 0 0 1 -3,-1.1 4,-3.1 -4,-0.8 3,-2.2 0.337 80.6 105.4-113.0 6.1 10.4 -17.1 -1.5 32 35 A R T << S+ 0 0 77 -3,-0.7 -1,-0.1 -4,-0.6 -2,-0.1 0.774 75.5 61.9 -57.5 -27.4 11.8 -17.1 -5.0 33 36 A E T 34 S+ 0 0 133 -4,-0.3 -1,-0.3 1,-0.2 3,-0.1 0.633 118.9 26.9 -74.4 -12.0 9.1 -19.5 -6.1 34 37 A Y T <4 S+ 0 0 66 -3,-2.2 2,-0.4 1,-0.3 -2,-0.2 0.650 124.2 45.3-118.0 -30.3 6.5 -16.9 -5.2 35 38 A I < + 0 0 1 -4,-3.1 -1,-0.3 -7,-0.2 -25,-0.1 -0.970 43.9 171.7-123.5 131.8 8.3 -13.6 -5.6 36 39 A D + 0 0 32 -2,-0.4 27,-3.6 -27,-0.3 2,-0.4 0.367 68.0 68.3-116.0 3.5 10.6 -12.6 -8.4 37 40 A T E - c 0 63A 0 -25,-0.5 -23,-2.1 25,-0.2 2,-0.4 -0.981 59.0-176.1-130.4 122.6 11.0 -8.9 -7.4 38 41 A V E -bc 14 64A 1 25,-3.0 27,-2.4 -2,-0.4 2,-0.5 -0.955 16.0-147.5-122.4 134.2 12.9 -7.8 -4.3 39 42 A K E -bc 15 65A 16 -25,-3.4 -23,-2.2 -2,-0.4 2,-0.4 -0.882 19.2-172.1-100.5 124.7 13.3 -4.3 -3.0 40 43 A I E -bc 16 66A 2 25,-2.4 27,-2.9 -2,-0.5 2,-0.2 -0.937 2.9-168.9-117.8 140.4 16.7 -3.6 -1.3 41 44 A G E > - c 0 67A 5 -25,-0.6 4,-2.1 -2,-0.4 3,-0.4 -0.538 40.3 -85.1-118.8-174.5 17.5 -0.5 0.6 42 45 A Y H > S+ 0 0 9 25,-0.6 4,-3.2 1,-0.2 5,-0.5 0.820 114.9 68.9 -62.6 -33.7 20.5 1.2 2.2 43 46 A P H > S+ 0 0 4 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.946 112.3 32.0 -52.2 -46.8 20.3 -0.7 5.5 44 47 A L H > S+ 0 0 1 -3,-0.4 4,-2.7 -28,-0.2 5,-0.4 0.941 121.6 48.4 -75.6 -47.8 21.4 -3.9 3.7 45 48 A V H X S+ 0 0 3 -4,-2.1 4,-2.1 1,-0.2 -3,-0.2 0.874 113.7 45.7 -61.7 -40.1 23.6 -2.3 1.1 46 49 A L H < S+ 0 0 13 -4,-3.2 -1,-0.2 -5,-0.2 217,-0.2 0.811 117.1 46.2 -74.3 -27.5 25.6 -0.1 3.5 47 50 A S H < S+ 0 0 50 -4,-1.0 -2,-0.2 -5,-0.5 -1,-0.2 0.857 130.4 18.3 -81.4 -37.0 26.0 -3.0 5.9 48 51 A E H < S- 0 0 77 -4,-2.7 -3,-0.2 1,-0.2 -2,-0.2 0.518 111.3-102.8-114.4 -8.6 27.0 -5.7 3.4 49 52 A G >< - 0 0 22 -4,-2.1 3,-1.7 -5,-0.4 4,-0.2 0.000 31.2 -85.5 101.1 151.7 28.2 -3.9 0.3 50 53 A M T >> S+ 0 0 15 1,-0.3 3,-1.9 209,-0.2 4,-0.6 0.709 116.0 78.5 -66.3 -19.4 26.6 -3.1 -3.1 51 54 A D H 3> S+ 0 0 139 1,-0.3 4,-1.6 2,-0.2 -1,-0.3 0.676 74.9 78.3 -63.2 -14.4 27.9 -6.5 -4.3 52 55 A I H <> S+ 0 0 5 -3,-1.7 4,-2.0 1,-0.2 -1,-0.3 0.782 85.7 60.5 -65.0 -25.3 24.9 -8.0 -2.5 53 56 A I H <> S+ 0 0 1 -3,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.946 103.8 47.4 -66.9 -47.6 22.8 -6.9 -5.4 54 57 A A H X S+ 0 0 44 -4,-0.6 4,-3.2 1,-0.2 5,-0.2 0.871 110.5 54.7 -61.1 -36.3 24.7 -9.0 -7.9 55 58 A E H X S+ 0 0 24 -4,-1.6 4,-2.6 2,-0.2 5,-0.4 0.903 105.6 50.3 -65.6 -41.7 24.5 -11.9 -5.5 56 59 A F H X>S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 6,-0.7 0.914 116.5 43.1 -61.9 -41.1 20.7 -11.7 -5.2 57 60 A R H X5S+ 0 0 100 -4,-2.0 4,-1.5 3,-0.2 -2,-0.2 0.906 116.8 45.2 -70.8 -44.5 20.5 -11.7 -9.0 58 61 A K H <5S+ 0 0 160 -4,-3.2 -2,-0.2 -5,-0.2 -3,-0.2 0.830 122.2 36.9 -69.7 -33.8 23.1 -14.5 -9.6 59 62 A R H <5S+ 0 0 135 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.826 136.7 15.4 -88.3 -34.6 21.7 -16.7 -6.9 60 63 A F H <5S- 0 0 41 -4,-2.1 -3,-0.2 -5,-0.4 -2,-0.2 0.562 83.8-135.0-117.4 -13.8 18.0 -16.1 -7.3 61 64 A G << + 0 0 49 -4,-1.5 -4,-0.2 -5,-0.5 2,-0.2 0.851 53.2 151.5 60.3 33.0 17.6 -14.4 -10.7 62 65 A C - 0 0 7 -6,-0.7 2,-0.3 1,-0.1 -25,-0.2 -0.558 52.1-107.2 -94.3 161.5 15.2 -11.9 -9.2 63 66 A R E -c 37 0A 54 -27,-3.6 -25,-3.0 -2,-0.2 2,-0.5 -0.650 35.3-147.0 -82.9 143.2 14.5 -8.4 -10.2 64 67 A I E -c 38 0A 0 -2,-0.3 26,-2.0 24,-0.2 27,-1.5 -0.967 13.2-167.7-120.8 126.5 16.0 -5.8 -7.8 65 68 A I E -cd 39 91A 0 -27,-2.4 -25,-2.4 -2,-0.5 2,-0.9 -0.956 18.4-143.2-109.1 121.4 14.6 -2.4 -7.1 66 69 A A E -cd 40 92A 0 25,-3.2 27,-2.5 -2,-0.6 2,-1.9 -0.769 6.0-158.2 -89.8 109.1 17.0 -0.2 -5.2 67 70 A D E +c 41 0A 14 -27,-2.9 -25,-0.6 -2,-0.9 25,-0.1 -0.562 42.2 138.4 -86.7 75.8 15.1 1.8 -2.6 68 71 A F E - 0 0 6 -2,-1.9 -1,-0.2 25,-0.4 3,-0.2 0.425 53.6-142.2-100.4 -0.4 17.7 4.5 -2.3 69 72 A K E - 0 0 20 24,-0.2 25,-0.3 -3,-0.2 -2,-0.1 0.871 24.1-146.1 36.4 53.9 15.2 7.5 -2.3 70 73 A V E + d 0 94A 3 23,-1.7 25,-2.5 1,-0.1 -1,-0.2 -0.226 33.9 161.5 -51.4 125.7 17.8 9.5 -4.3 71 74 A A + 0 0 6 -3,-0.2 2,-0.2 23,-0.2 -1,-0.1 -0.227 28.5 105.3-148.9 52.0 17.5 13.1 -3.3 72 75 A D S S- 0 0 12 1,-0.2 264,-0.0 30,-0.1 209,-0.0 -0.478 75.3 -65.0-119.8-170.6 20.6 15.1 -4.3 73 76 A I > - 0 0 44 -2,-0.2 4,-2.8 1,-0.1 3,-0.4 -0.354 60.5 -95.9 -72.7 160.3 21.6 17.6 -6.9 74 77 A P H > S+ 0 0 30 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.879 120.5 47.8 -44.6 -54.7 21.5 16.5 -10.6 75 78 A E H > S+ 0 0 95 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.874 115.4 44.7 -61.3 -37.3 25.2 15.6 -11.0 76 79 A T H > S+ 0 0 20 -3,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.908 110.8 54.3 -73.3 -38.9 25.3 13.6 -7.8 77 80 A N H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.897 106.7 53.3 -59.1 -39.8 22.0 11.8 -8.6 78 81 A E H X S+ 0 0 74 -4,-2.3 4,-2.5 -5,-0.3 -1,-0.2 0.925 110.3 46.1 -61.1 -45.3 23.5 10.8 -11.9 79 82 A K H X S+ 0 0 50 -4,-1.6 4,-2.4 2,-0.2 5,-0.2 0.881 111.8 51.1 -66.0 -40.3 26.5 9.2 -10.2 80 83 A I H X S+ 0 0 5 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.938 113.2 45.8 -63.1 -45.3 24.4 7.5 -7.6 81 84 A C H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 5,-0.3 0.918 112.5 49.5 -64.1 -44.2 22.2 6.0 -10.4 82 85 A R H X S+ 0 0 70 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.925 113.0 46.8 -62.9 -42.6 25.1 4.9 -12.5 83 86 A A H X S+ 0 0 14 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.904 114.5 48.1 -64.7 -40.7 26.8 3.2 -9.6 84 87 A T H <>S+ 0 0 0 -4,-2.3 5,-2.0 -5,-0.2 -2,-0.2 0.886 114.5 44.0 -68.3 -40.3 23.6 1.5 -8.6 85 88 A F H ><5S+ 0 0 0 -4,-2.8 3,-1.4 3,-0.2 -1,-0.2 0.866 110.2 56.2 -72.9 -35.0 22.8 0.3 -12.1 86 89 A K H 3<5S+ 0 0 155 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.902 102.8 56.7 -60.9 -38.9 26.4 -0.8 -12.6 87 90 A A T 3<5S- 0 0 22 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.574 130.5 -97.8 -68.8 -9.9 26.0 -2.9 -9.5 88 91 A G T < 5 + 0 0 2 -3,-1.4 -24,-0.2 1,-0.3 -3,-0.2 0.430 66.8 154.6 111.3 -2.8 23.0 -4.6 -11.2 89 92 A A < - 0 0 0 -5,-2.0 -1,-0.3 1,-0.2 -24,-0.2 -0.336 32.9-154.7 -61.9 139.7 19.9 -2.9 -10.0 90 93 A D S S+ 0 0 46 -26,-2.0 26,-1.9 1,-0.2 2,-0.3 0.772 77.1 3.6 -83.1 -28.6 17.0 -3.1 -12.4 91 94 A A E -de 65 116A 0 -27,-1.5 -25,-3.2 24,-0.2 2,-0.3 -0.977 62.7-148.8-153.2 161.5 15.3 0.0 -11.0 92 95 A I E -de 66 117A 0 24,-1.9 26,-3.1 -2,-0.3 2,-0.5 -0.986 16.6-130.6-136.9 143.6 15.9 2.8 -8.5 93 96 A I E - e 0 118A 2 -27,-2.5 -23,-1.7 -2,-0.3 -25,-0.4 -0.844 28.9-171.7 -97.7 128.5 13.5 4.8 -6.4 94 97 A V E -de 70 119A 0 24,-3.0 26,-2.7 -2,-0.5 -23,-0.2 -0.936 22.0-119.2-125.0 143.5 14.0 8.6 -6.4 95 98 A H E - e 0 120A 6 -25,-2.5 26,-0.1 -2,-0.4 -23,-0.1 -0.473 11.3-159.4 -75.8 148.3 12.5 11.5 -4.5 96 99 A G S > S+ 0 0 0 24,-0.9 3,-2.2 -2,-0.1 7,-0.1 0.642 75.6 85.9-100.1 -18.6 10.6 14.1 -6.4 97 100 A F T 3 S+ 0 0 7 1,-0.3 248,-0.5 23,-0.2 247,-0.4 0.808 80.7 64.1 -53.8 -33.3 10.9 16.9 -3.7 98 101 A P T 3 S- 0 0 0 0, 0.0 4,-0.3 0, 0.0 -1,-0.3 0.556 112.0-111.7 -71.0 -5.1 14.3 18.0 -5.1 99 102 A G <> - 0 0 0 -3,-2.2 4,-1.6 1,-0.1 5,-0.1 -0.278 32.9 -57.5 106.1 171.9 12.8 19.0 -8.4 100 103 A A H > S+ 0 0 21 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.861 124.2 51.8 -64.2 -42.8 12.5 18.2 -12.0 101 104 A D H > S+ 0 0 31 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.896 108.1 52.6 -66.6 -36.4 16.2 18.4 -12.9 102 105 A S H > S+ 0 0 0 -4,-0.3 4,-0.9 1,-0.2 -1,-0.2 0.890 113.7 43.8 -65.0 -36.9 17.2 16.1 -10.1 103 106 A V H >X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 3,-0.5 0.918 110.9 54.0 -73.1 -41.7 14.7 13.5 -11.4 104 107 A R H 3X S+ 0 0 115 -4,-2.9 4,-2.7 1,-0.3 -2,-0.2 0.874 100.6 60.3 -60.9 -36.0 15.6 14.0 -15.0 105 108 A A H 3X S+ 0 0 8 -4,-2.1 4,-1.5 1,-0.2 -1,-0.3 0.892 108.4 45.8 -57.7 -37.8 19.3 13.3 -14.2 106 109 A C H S+ 0 0 5 -4,-2.1 5,-2.2 2,-0.2 4,-1.0 0.885 110.5 49.7 -64.1 -36.5 18.2 4.9 -16.7 111 114 A E H ><5S+ 0 0 164 -4,-2.2 3,-0.5 2,-0.2 -2,-0.2 0.936 111.9 48.1 -65.7 -47.0 17.7 5.7 -20.4 112 115 A E H 3<5S+ 0 0 128 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.864 120.8 35.8 -61.2 -39.4 21.4 5.2 -21.2 113 116 A M H 3<5S- 0 0 44 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.406 108.2-115.0 -99.8 1.9 21.6 1.9 -19.3 114 117 A G T <<5S+ 0 0 67 -4,-1.0 -3,-0.2 -3,-0.5 2,-0.2 0.836 74.4 121.5 69.4 33.8 18.2 0.4 -20.1 115 118 A R < - 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0 0 62 -5,-2.2 2,-0.3 -6,-0.2 -24,-0.2 -0.452 56.1-105.6-114.4-170.6 28.0 11.4 16.8 329 119 B E E -m 304 0B 72 -26,-1.8 -24,-1.8 -2,-0.2 2,-0.4 -0.923 11.7-150.1-128.7 150.2 26.4 14.4 15.0 330 120 B V E -m 305 0B 3 -2,-0.3 2,-0.5 -26,-0.2 33,-0.5 -0.950 8.7-158.1-116.2 131.3 23.5 15.1 12.6 331 121 B F E -m 306 0B 0 -26,-3.0 -24,-3.0 -2,-0.4 2,-0.6 -0.940 13.4-143.1-106.9 128.6 23.5 18.0 10.1 332 122 B L E -mn 307 364B 0 31,-2.6 33,-2.5 -2,-0.5 2,-0.8 -0.828 7.9-142.6 -94.9 124.0 20.1 19.2 8.9 333 123 B L E +mn 308 365B 10 -26,-2.7 -24,-0.9 -2,-0.6 -23,-0.2 -0.765 23.3 175.8 -86.4 112.7 20.0 20.1 5.2 334 124 B T - 0 0 3 31,-2.3 2,-0.3 -2,-0.8 18,-0.2 0.746 59.1 -4.0 -91.7 -25.1 17.7 23.2 5.1 335 125 B E - 0 0 13 30,-0.7 2,-0.3 17,-0.1 -1,-0.2 -0.988 55.7-141.5-163.0 162.7 18.0 24.1 1.4 336 126 B M - 0 0 15 -2,-0.3 13,-0.1 2,-0.1 10,-0.0 -0.912 9.1-146.1-130.4 158.7 19.7 23.3 -1.9 337 127 B S + 0 0 55 -2,-0.3 5,-0.1 29,-0.1 -1,-0.0 0.449 58.7 110.5-108.0 -1.2 20.9 25.5 -4.7 338 128 B H S > S- 0 0 13 1,-0.1 3,-1.9 -240,-0.0 4,-0.3 -0.370 82.5-103.9 -70.4 157.0 20.4 23.5 -7.9 339 129 B P G > S+ 0 0 89 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.870 118.5 58.1 -47.2 -47.6 17.6 24.9 -10.3 340 130 B G G >> S+ 0 0 6 1,-0.3 3,-1.5 2,-0.2 4,-0.5 0.676 85.3 80.9 -60.8 -17.7 15.1 22.2 -9.3 341 131 B A G <4>S+ 0 0 5 -3,-1.9 5,-2.7 1,-0.3 4,-0.3 0.720 78.9 70.8 -61.5 -21.1 15.3 23.3 -5.7 342 132 B E G <45S+ 0 0 129 -3,-1.8 5,-0.3 -4,-0.3 -1,-0.3 0.792 86.6 66.4 -67.1 -27.9 12.9 26.2 -6.5 343 133 B M T <45S- 0 0 92 -3,-1.5 -1,-0.2 -4,-0.2 -2,-0.2 0.920 130.0 -21.9 -62.3 -49.2 10.0 23.8 -7.0 344 134 B F T X5S+ 0 0 29 -4,-0.5 4,-0.7 -247,-0.4 -2,-0.1 0.614 127.6 62.4-133.0 -37.1 9.5 22.6 -3.4 345 135 B I H >>5S+ 0 0 6 -248,-0.5 4,-1.2 -5,-0.3 3,-1.1 0.926 98.8 54.0 -64.7 -48.6 12.7 23.0 -1.3 346 136 B Q H >4 S+ 0 0 40 -4,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.900 115.3 47.0 -61.0 -40.9 12.6 28.4 6.6 351 141 B E H > S+ 0 0 102 -4,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.863 111.3 51.6 -69.8 -34.3 10.1 26.0 8.1 352 142 B I H X S+ 0 0 5 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.921 110.1 49.5 -67.1 -41.3 12.7 23.1 7.9 353 143 B A H X S+ 0 0 1 -4,-2.5 4,-2.0 -5,-0.2 -2,-0.2 0.923 112.1 47.9 -61.8 -43.9 15.2 25.4 9.6 354 144 B R H X S+ 0 0 89 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.873 108.3 54.8 -64.7 -37.0 12.7 26.2 12.3 355 145 B M H < S+ 0 0 10 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.911 106.2 52.8 -61.7 -42.2 11.8 22.5 12.7 356 146 B G H ><>S+ 0 0 0 -4,-2.2 5,-2.4 1,-0.2 3,-1.9 0.929 107.1 50.7 -58.6 -45.9 15.5 21.9 13.3 357 147 B V H ><5S+ 0 0 64 -4,-2.0 3,-1.2 1,-0.3 -1,-0.2 0.903 109.2 52.2 -58.8 -39.6 15.6 24.5 16.0 358 148 B D T 3<5S+ 0 0 138 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.342 108.6 51.5 -79.6 8.3 12.6 22.7 17.5 359 149 B L T < 5S- 0 0 28 -3,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.308 116.7-111.1-120.7 0.4 14.5 19.4 17.4 360 150 B G T < 5 + 0 0 40 -3,-1.2 -3,-0.2 -4,-0.4 -2,-0.1 0.661 56.0 169.9 76.3 16.4 17.5 20.7 19.2 361 151 B V < + 0 0 4 -5,-2.4 -1,-0.2 -6,-0.2 -2,-0.1 -0.392 16.9 179.9 -63.1 135.1 19.6 20.4 16.0 362 152 B K + 0 0 97 -32,-0.3 24,-3.0 1,-0.1 2,-0.4 0.368 61.4 62.9-117.1 -0.4 23.0 22.2 16.4 363 153 B N E + o 0 386B 1 -33,-0.5 -31,-2.6 22,-0.2 2,-0.3 -0.993 60.8 176.7-133.2 129.9 24.5 21.5 12.9 364 154 B Y E -no 332 387B 1 22,-2.6 24,-2.4 -2,-0.4 2,-0.5 -0.950 23.6-152.7-134.4 151.6 23.1 22.7 9.6 365 155 B V E +no 333 388B 5 -33,-2.5 -31,-2.3 -2,-0.3 -30,-0.7 -0.992 30.4 171.2-119.8 121.8 23.9 22.7 5.9 366 156 B G - 0 0 1 22,-1.9 -29,-0.1 -2,-0.5 8,-0.1 -0.542 35.9 -80.1-120.4-172.5 22.5 25.6 4.0 367 157 B P - 0 0 6 0, 0.0 -1,-0.3 0, 0.0 -33,-0.0 0.043 31.7-171.9 -74.3-166.0 22.8 27.1 0.5 368 158 B S + 0 0 26 22,-0.1 6,-0.1 21,-0.1 5,-0.1 0.403 66.5 78.6-157.7 -36.0 25.8 29.3 -0.6 369 159 B T S S+ 0 0 96 1,-0.2 25,-0.0 2,-0.1 -32,-0.0 0.585 97.9 56.1 -62.8 -8.5 25.3 30.9 -4.0 370 160 B R >> - 0 0 113 1,-0.1 3,-1.5 24,-0.0 4,-1.0 -0.872 63.3-169.0-132.4 102.4 23.0 33.5 -2.2 371 161 B P H >> S+ 0 0 43 0, 0.0 4,-1.8 0, 0.0 3,-0.6 0.865 88.5 59.9 -52.7 -44.1 24.4 35.5 0.7 372 162 B E H 3> S+ 0 0 117 1,-0.3 4,-1.4 2,-0.2 5,-0.1 0.705 100.9 56.7 -61.6 -20.3 21.0 36.8 1.7 373 163 B R H <> S+ 0 0 34 -3,-1.5 4,-2.4 2,-0.2 -1,-0.3 0.839 104.1 51.6 -79.7 -33.3 19.8 33.2 2.3 374 164 B L H X S+ 0 0 4 -4,-2.4 4,-2.9 1,-0.2 3,-0.6 0.914 108.8 52.2 -62.0 -44.1 19.1 31.0 7.9 378 168 B R H 3X S+ 0 0 9 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.836 101.8 59.8 -61.1 -35.0 21.1 32.6 10.7 379 169 B E H 3< S+ 0 0 149 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.841 114.5 38.0 -62.0 -31.8 18.1 34.6 11.9 380 170 B I H << S+ 0 0 27 -4,-1.1 -2,-0.2 -3,-0.6 -1,-0.2 0.918 123.0 36.4 -86.4 -49.5 16.3 31.3 12.4 381 171 B I H X S- 0 0 13 -4,-2.9 4,-0.5 1,-0.2 3,-0.2 0.630 105.3-127.5 -83.1 -12.4 19.1 29.0 13.8 382 172 B G T < - 0 0 29 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.1 -0.224 27.8 -75.1 92.3 174.1 20.9 31.7 15.9 383 173 B Q T 4 S+ 0 0 110 1,-0.1 -1,-0.2 -4,-0.1 -4,-0.1 0.555 121.0 56.3 -88.9 -8.8 24.5 32.7 16.0 384 174 B D T 4 S+ 0 0 97 -3,-0.2 -169,-0.2 2,-0.1 -1,-0.1 0.823 79.8 94.3 -94.0 -35.3 25.7 29.7 18.0 385 175 B S S < S- 0 0 12 -4,-0.5 2,-0.4 1,-0.1 -22,-0.2 -0.153 82.5-104.9 -57.8 154.5 24.7 26.7 15.9 386 176 B F E -o 363 0B 0 -24,-3.0 -22,-2.6 12,-0.1 2,-0.4 -0.704 40.0-174.6 -86.3 129.9 27.2 25.3 13.4 387 177 B L E -o 364 0B 0 -2,-0.4 12,-3.0 -24,-0.2 13,-1.2 -0.988 8.0-175.7-129.9 129.1 26.6 26.1 9.8 388 178 B I E -op 365 400B 0 -24,-2.4 -22,-1.9 -2,-0.4 13,-0.2 -0.945 8.6-157.9-122.4 146.5 28.4 24.8 6.7 389 179 B S E p 0 401B 0 11,-1.8 13,-2.7 -2,-0.4 -21,-0.1 -0.986 360.0 360.0-129.2 131.5 27.8 25.9 3.1 390 180 B P 0 0 86 0, 0.0 14,-0.1 0, 0.0 -22,-0.1 0.167 360.0 360.0 -57.5 360.0 28.7 24.1 -0.2 391 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 392 190 B G 0 0 81 0, 0.0 3,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -83.4 34.7 35.4 1.8 393 191 B E > + 0 0 108 1,-0.2 3,-1.5 2,-0.2 4,-0.3 0.756 360.0 68.1 -74.0 -24.1 31.3 36.9 2.6 394 192 B T G >> S+ 0 0 26 1,-0.3 4,-3.3 2,-0.2 3,-1.8 0.881 91.2 59.3 -62.1 -39.0 30.1 33.3 3.2 395 193 B L G 34 S+ 0 0 19 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.2 0.396 89.1 74.1 -73.1 5.3 32.3 32.9 6.2 396 194 B R G <4 S+ 0 0 175 -3,-1.5 -1,-0.3 1,-0.0 -2,-0.2 0.677 118.6 13.9 -86.6 -20.3 30.4 35.9 7.8 397 195 B F T <4 S+ 0 0 37 -3,-1.8 2,-0.2 -4,-0.3 -2,-0.2 0.682 121.1 64.0-120.9 -42.5 27.5 33.5 8.3 398 196 B A < - 0 0 1 -4,-3.3 -10,-0.2 -5,-0.1 -1,-0.1 -0.610 66.9-144.6 -88.5 150.0 28.8 30.0 7.8 399 197 B D S S+ 0 0 18 -12,-3.0 2,-0.3 1,-0.2 -11,-0.2 0.709 84.4 8.2 -83.6 -22.6 31.4 28.5 10.1 400 198 B A E - p 0 388B 0 -13,-1.2 -11,-1.8 -6,-0.1 2,-0.3 -0.985 69.1-133.9-155.8 152.3 33.0 26.6 7.3 401 199 B I E -ip 225 389B 28 -177,-2.4 -175,-3.1 -2,-0.3 2,-0.5 -0.839 16.3-135.3-110.4 149.9 32.8 26.3 3.5 402 200 B I E -i 226 0B 12 -13,-2.7 2,-0.4 -2,-0.3 -175,-0.2 -0.907 23.5-176.2-106.4 127.6 32.7 23.1 1.5 403 201 B V E +i 227 0B 26 -177,-2.9 -175,-2.8 -2,-0.5 5,-0.1 -0.985 15.1 152.8-128.4 134.5 34.9 22.9 -1.6 404 202 B G >> + 0 0 14 -2,-0.4 3,-2.6 -177,-0.2 4,-1.8 0.576 66.5 32.9-116.9 -91.5 35.1 20.1 -4.2 405 203 B R H 3> S+ 0 0 128 1,-0.3 4,-1.7 2,-0.2 5,-0.4 0.829 110.4 62.4 -37.3 -57.3 36.2 20.6 -7.8 406 204 B S H 34 S+ 0 0 74 1,-0.2 -1,-0.3 2,-0.2 14,-0.1 0.690 119.0 28.3 -48.8 -21.1 38.6 23.4 -7.2 407 205 B I H X4 S+ 0 0 0 -3,-2.6 3,-1.0 -179,-0.1 -2,-0.2 0.840 119.5 44.8-107.8 -59.3 40.6 21.0 -5.1 408 206 B Y H 3< S+ 0 0 17 -4,-1.8 -3,-0.2 1,-0.2 -2,-0.2 0.504 118.2 46.0 -70.6 -1.5 40.2 17.3 -6.2 409 207 B L T 3< S+ 0 0 108 -4,-1.7 -1,-0.2 -5,-0.3 -3,-0.1 0.494 87.9 107.4-113.9 -9.7 40.6 18.2 -9.9 410 208 B A S < S- 0 0 38 -3,-1.0 4,-0.1 -5,-0.4 -3,-0.0 -0.343 78.2-121.6 -70.2 150.7 43.6 20.5 -9.6 411 209 B D S S+ 0 0 178 1,-0.3 -1,-0.1 2,-0.1 3,-0.1 0.891 112.0 23.0 -57.9 -40.2 47.0 19.3 -10.8 412 210 B N >> - 0 0 86 1,-0.1 4,-2.0 2,-0.0 3,-0.9 -0.786 69.9-177.5-130.5 87.1 48.3 19.9 -7.2 413 211 B P H 3> S+ 0 0 5 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.764 82.2 65.9 -55.0 -27.2 45.4 19.8 -4.8 414 212 B A H 3> S+ 0 0 18 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.934 107.6 38.4 -61.4 -46.5 47.9 20.6 -2.0 415 213 B A H <> S+ 0 0 55 -3,-0.9 4,-2.4 2,-0.2 -1,-0.2 0.848 112.7 58.6 -72.2 -35.4 48.5 24.0 -3.5 416 214 B A H X S+ 0 0 21 -4,-2.0 4,-2.1 2,-0.2 5,-0.2 0.940 108.8 44.0 -58.9 -49.4 44.9 24.4 -4.4 417 215 B A H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.937 113.4 50.7 -61.4 -48.3 43.8 24.0 -0.8 418 216 B A H X S+ 0 0 28 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.849 108.8 55.2 -58.6 -35.2 46.6 26.3 0.5 419 217 B G H X S+ 0 0 38 -4,-2.4 4,-1.2 2,-0.2 -2,-0.2 0.966 108.8 42.5 -64.0 -55.7 45.5 28.8 -2.1 420 218 B I H X S+ 0 0 43 -4,-2.1 4,-0.9 1,-0.2 -1,-0.2 0.800 113.1 56.0 -62.7 -28.1 41.8 29.1 -1.1 421 219 B I H >X S+ 0 0 14 -4,-1.9 4,-2.1 -5,-0.2 3,-0.5 0.891 101.8 55.0 -70.5 -39.7 42.9 29.1 2.6 422 220 B E H 3< S+ 0 0 154 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.820 105.8 54.2 -61.4 -30.2 45.2 32.1 2.0 423 221 B S H 3< S+ 0 0 104 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.779 107.5 50.0 -73.5 -27.9 42.1 33.8 0.7 424 222 B I H << 0 0 45 -4,-0.9 -2,-0.2 -3,-0.5 -1,-0.2 0.828 360.0 360.0 -78.1 -34.3 40.3 33.0 3.9 425 223 B K < 0 0 193 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.1 0.958 360.0 360.0 -58.7 360.0 43.2 34.4 6.0