==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 15-OCT-12 4HK7 . COMPND 2 MOLECULE: URACIL-5-CARBOXYLATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CORDYCEPS MILITARIS; . AUTHOR S.XU,J.ZHU,J.DING . 1510 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 55076.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1074 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 152 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 2.0 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 . 6 0.4 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 . 82 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 230 15.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 502 33.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 48 3.2 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 4 8 2 10 3 9 6 6 2 4 4 4 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 4 8 12 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 4 3 1 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 4 0 0 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 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 6 A P 0 0 138 0, 0.0 2,-0.1 0, 0.0 355,-0.0 0.000 360.0 360.0 360.0 143.1 57.4 -46.0 23.6 2 7 A V - 0 0 23 1,-0.1 2,-0.6 82,-0.0 358,-0.2 -0.388 360.0-136.8 -73.8 139.0 56.3 -45.4 20.0 3 8 A V - 0 0 33 80,-0.1 83,-2.4 356,-0.1 82,-1.2 -0.863 22.1-171.7 -96.2 119.3 58.7 -45.5 17.1 4 9 A V E -a 86 0A 1 354,-2.3 2,-0.6 -2,-0.6 83,-0.2 -0.948 13.8-155.5-115.0 129.5 58.2 -42.6 14.5 5 10 A D E +a 87 0A 0 81,-2.9 83,-2.9 -2,-0.5 311,-0.3 -0.903 15.4 174.0 -98.8 113.5 60.0 -42.4 11.2 6 11 A I E + 0 0 0 309,-2.4 2,-0.5 -2,-0.6 310,-0.2 0.430 68.4 61.2 -97.3 -2.1 60.2 -38.7 10.0 7 12 A H E S+ 0 0 0 308,-0.2 311,-3.3 2,-0.0 310,-1.5 -0.799 72.4 115.5-129.7 91.2 62.3 -39.2 7.0 8 13 A T E -ab 89 319A 0 80,-0.6 82,-1.5 -2,-0.5 2,-0.2 -0.974 41.3-152.9-164.8 135.7 60.6 -41.5 4.5 9 14 A H E -a 90 0A 0 310,-3.4 2,-0.3 -2,-0.3 82,-0.2 -0.730 14.6-175.5-125.4 163.9 59.2 -41.1 1.0 10 15 A M E -a 91 0A 1 80,-1.4 82,-0.8 -2,-0.2 60,-0.2 -0.982 18.9-145.6-147.1 150.4 56.8 -42.0 -1.7 11 16 A Y - 0 0 0 58,-2.0 5,-0.1 -2,-0.3 80,-0.0 -0.957 30.4-133.5-109.6 108.3 56.1 -41.2 -5.3 12 17 A P >> - 0 0 0 0, 0.0 4,-1.8 0, 0.0 3,-1.3 -0.294 24.6-112.3 -55.3 144.5 52.3 -41.3 -5.9 13 18 A P H 3> S+ 0 0 77 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.834 118.4 56.0 -52.8 -38.0 51.5 -43.2 -9.1 14 19 A S H 3> S+ 0 0 53 2,-0.2 4,-1.3 1,-0.2 97,-0.0 0.832 106.0 51.4 -59.9 -36.5 50.2 -40.0 -10.8 15 20 A Y H <> S+ 0 0 1 -3,-1.3 4,-1.6 2,-0.2 -1,-0.2 0.885 107.3 53.0 -65.4 -40.5 53.6 -38.4 -10.0 16 21 A I H X S+ 0 0 29 -4,-1.8 4,-1.6 1,-0.2 -2,-0.2 0.859 101.3 61.8 -61.7 -37.0 55.3 -41.4 -11.6 17 22 A A H X S+ 0 0 58 -4,-1.9 4,-0.6 1,-0.2 3,-0.2 0.927 103.5 48.8 -51.5 -49.6 53.0 -40.8 -14.7 18 23 A M H >< S+ 0 0 36 -4,-1.3 3,-0.9 1,-0.2 4,-0.4 0.889 104.3 60.0 -60.0 -43.8 54.7 -37.4 -15.1 19 24 A L H >< S+ 0 0 0 -4,-1.6 9,-1.1 1,-0.3 3,-0.9 0.859 107.2 43.0 -59.3 -42.1 58.2 -38.8 -14.9 20 25 A E H 3< S+ 0 0 111 -4,-1.6 -1,-0.3 7,-0.2 -2,-0.2 0.561 107.0 64.1 -79.7 -5.9 57.9 -41.2 -17.9 21 26 A K T << S+ 0 0 165 -3,-0.9 2,-0.3 -4,-0.6 -1,-0.2 0.551 91.0 95.3 -81.5 -8.9 56.2 -38.3 -19.7 22 27 A R < - 0 0 63 -3,-0.9 6,-0.2 -4,-0.4 3,-0.0 -0.634 56.1-165.7 -97.6 140.6 59.5 -36.4 -19.4 23 28 A Q S S+ 0 0 171 -2,-0.3 2,-0.3 2,-0.1 -1,-0.1 0.675 77.4 41.5 -92.2 -22.9 62.3 -36.1 -22.0 24 29 A T S S- 0 0 94 2,-0.2 -1,-0.1 1,-0.0 -2,-0.0 -0.917 102.5 -37.0-128.1 156.6 64.9 -34.7 -19.5 25 30 A I S S+ 0 0 39 -2,-0.3 16,-0.1 2,-0.1 2,-0.1 -0.192 112.3 55.3 -49.5 131.0 66.0 -35.4 -15.9 26 31 A P S S+ 0 0 9 0, 0.0 2,-0.3 0, 0.0 -2,-0.2 0.446 88.8 133.1 -77.6 145.3 64.1 -36.1 -13.7 27 32 A L E -I 40 0B 5 13,-2.4 13,-3.1 -2,-0.1 2,-0.4 -0.988 47.8-137.1-155.6 159.8 62.7 -39.1 -15.7 28 33 A V E +I 39 0B 4 -9,-1.1 2,-0.3 -2,-0.3 11,-0.2 -0.993 27.9 174.4-122.4 129.9 61.7 -42.8 -15.5 29 34 A R E -I 38 0B 103 9,-1.9 9,-3.7 -2,-0.4 2,-0.4 -0.959 26.2-134.1-133.8 151.9 62.5 -45.2 -18.4 30 35 A T - 0 0 65 -2,-0.3 5,-0.1 7,-0.3 -2,-0.0 -0.908 23.4-159.0-104.6 133.5 62.2 -48.9 -19.0 31 36 A F - 0 0 19 3,-0.6 3,-0.4 -2,-0.4 5,-0.1 -0.828 27.7-110.8-113.9 152.4 65.3 -50.7 -20.5 32 37 A P S S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 0.826 109.5 54.4 -47.6 -46.2 65.4 -54.0 -22.4 33 38 A Q S S+ 0 0 106 1,-0.1 2,-0.4 23,-0.1 -3,-0.0 0.882 113.4 31.3 -62.4 -47.2 67.3 -56.1 -19.7 34 39 A A - 0 0 33 -3,-0.4 -3,-0.6 2,-0.1 -1,-0.1 -0.946 58.6-149.6-119.5 136.5 64.9 -55.5 -16.7 35 40 A D S S+ 0 0 157 -2,-0.4 -1,-0.1 -5,-0.1 -2,-0.1 0.350 79.8 97.6 -77.8 5.1 61.1 -54.9 -16.6 36 41 A E S S- 0 0 90 -5,-0.1 -5,-0.3 1,-0.0 -2,-0.1 -0.883 81.8-124.8 -94.2 113.1 61.8 -52.8 -13.6 37 42 A P - 0 0 32 0, 0.0 28,-3.9 0, 0.0 2,-0.5 -0.022 17.1-117.7 -56.3 160.8 62.0 -49.1 -14.7 38 43 A R E -IJ 29 64B 28 -9,-3.7 -9,-1.9 26,-0.3 2,-0.7 -0.908 15.5-147.3-106.3 126.4 64.9 -46.8 -14.0 39 44 A L E -IJ 28 63B 0 24,-4.0 24,-2.4 -2,-0.5 2,-0.7 -0.843 15.6-174.0 -94.0 113.0 64.5 -43.7 -11.8 40 45 A I E +I 27 0B 0 -13,-3.1 -13,-2.4 -2,-0.7 -2,-0.0 -0.874 25.0 142.1-115.3 98.6 66.8 -41.0 -13.1 41 46 A L + 0 0 1 -2,-0.7 2,-0.3 -15,-0.2 -1,-0.1 0.721 45.3 73.2-107.5 -30.7 66.7 -38.0 -10.7 42 47 A L S > S- 0 0 6 1,-0.1 3,-1.8 -17,-0.0 4,-0.3 -0.679 71.2-129.2-107.9 146.9 70.1 -36.5 -10.4 43 48 A S G > S+ 0 0 75 -2,-0.3 3,-1.2 1,-0.3 4,-0.4 0.792 109.4 65.3 -51.1 -34.1 72.5 -34.4 -12.5 44 49 A S G 3 S+ 0 0 32 1,-0.2 4,-0.3 2,-0.1 -1,-0.3 0.653 94.9 57.2 -66.5 -19.5 75.2 -37.1 -11.7 45 50 A E G <> S+ 0 0 5 -3,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.536 83.2 88.9 -88.2 -8.7 73.2 -39.8 -13.6 46 51 A L H <> S+ 0 0 84 -3,-1.2 4,-2.3 -4,-0.3 5,-0.2 0.891 83.4 50.6 -59.5 -50.3 73.2 -37.8 -16.9 47 52 A A H > S+ 0 0 77 -4,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.873 113.9 45.0 -57.6 -43.0 76.5 -39.1 -18.4 48 53 A A H > S+ 0 0 24 -4,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.752 109.5 57.2 -73.5 -27.6 75.4 -42.7 -17.8 49 54 A L H X S+ 0 0 11 -4,-1.7 4,-1.5 2,-0.2 -2,-0.2 0.940 108.9 44.3 -65.8 -50.1 71.9 -42.0 -19.2 50 55 A D H X S+ 0 0 85 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.864 114.4 51.2 -60.7 -39.0 73.4 -40.8 -22.5 51 56 A A H X S+ 0 0 46 -4,-1.6 4,-0.7 -5,-0.2 7,-0.3 0.867 112.0 45.6 -66.0 -39.3 75.8 -43.8 -22.5 52 57 A A H < S+ 0 0 12 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.676 110.4 55.0 -77.8 -19.7 72.9 -46.2 -21.9 53 58 A L H < S+ 0 0 87 -4,-1.5 -2,-0.2 1,-0.1 -1,-0.2 0.732 118.2 33.7 -80.7 -25.7 70.8 -44.5 -24.6 54 59 A A H < S+ 0 0 90 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.1 0.434 123.2 44.8-107.6 -4.1 73.5 -44.9 -27.2 55 60 A D >< - 0 0 74 -4,-0.7 3,-0.6 -5,-0.1 -1,-0.2 -0.921 52.8-166.5-149.5 114.1 74.9 -48.3 -26.0 56 61 A P T 3 S+ 0 0 104 0, 0.0 -23,-0.1 0, 0.0 -1,-0.1 0.701 94.6 58.6 -70.8 -21.6 72.9 -51.4 -24.9 57 62 A A T 3 S+ 0 0 93 2,-0.0 -5,-0.1 0, 0.0 -2,-0.0 0.676 87.8 99.9 -79.5 -19.2 76.1 -53.0 -23.4 58 63 A A S < S- 0 0 24 -3,-0.6 -10,-0.0 -7,-0.3 -3,-0.0 -0.265 86.0 -88.8 -67.2 153.8 76.5 -49.9 -21.1 59 64 A K - 0 0 74 1,-0.1 -1,-0.1 967,-0.0 -4,-0.1 -0.131 48.8 -90.2 -61.7 156.5 75.3 -50.1 -17.4 60 65 A L - 0 0 44 1,-0.1 -1,-0.1 -29,-0.0 2,-0.1 -0.534 47.4-129.3 -67.6 129.5 71.7 -49.3 -16.4 61 66 A P - 0 0 1 0, 0.0 -22,-0.1 0, 0.0 -15,-0.1 -0.446 63.2 -4.3 -83.7 158.6 71.5 -45.5 -15.5 62 67 A G S S- 0 0 7 -17,-0.1 -22,-0.2 -2,-0.1 -34,-0.0 -0.231 100.8 -52.4 62.5-149.4 70.0 -44.1 -12.3 63 68 A R E -J 39 0B 31 -24,-2.4 -24,-4.0 962,-0.0 2,-0.2 -0.839 60.3 -84.7-124.7 159.4 68.4 -46.5 -9.8 64 69 A P E -J 38 0B 50 0, 0.0 2,-1.5 0, 0.0 -26,-0.3 -0.449 32.0-134.2 -67.2 128.7 65.7 -49.2 -10.0 65 70 A L - 0 0 22 -28,-3.9 -27,-0.0 -2,-0.2 2,-0.0 -0.675 37.7-175.5 -78.6 88.2 62.1 -47.9 -9.8 66 71 A S > - 0 0 24 -2,-1.5 3,-1.0 254,-0.1 4,-0.5 -0.223 41.9-108.0 -77.6 172.7 60.8 -50.5 -7.3 67 72 A T T 3> S+ 0 0 90 1,-0.2 4,-2.1 2,-0.2 7,-0.2 0.641 110.7 80.6 -72.4 -16.0 57.3 -51.0 -6.0 68 73 A H T 34 S+ 0 0 8 1,-0.2 -1,-0.2 2,-0.2 253,-0.1 0.643 87.5 55.9 -66.3 -16.9 58.6 -49.5 -2.7 69 74 A F T <4 S+ 0 0 9 -3,-1.0 -58,-2.0 -59,-0.1 -1,-0.2 0.901 120.8 22.2 -79.0 -42.5 58.3 -46.0 -4.2 70 75 A A T 4 S+ 0 0 34 -4,-0.5 2,-0.7 -3,-0.2 -2,-0.2 0.541 99.1 93.7-107.9 -10.2 54.6 -46.1 -5.1 71 76 A S X - 0 0 36 -4,-2.1 4,-1.8 1,-0.2 5,-0.1 -0.778 46.0-168.8 -99.6 116.6 53.0 -48.8 -3.0 72 77 A L H > S+ 0 0 27 -2,-0.7 4,-2.5 2,-0.2 5,-0.2 0.891 94.8 56.4 -62.1 -39.3 51.3 -47.8 0.3 73 78 A A H > S+ 0 0 72 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.930 106.1 49.9 -58.1 -45.8 51.0 -51.6 1.1 74 79 A Q H > S+ 0 0 33 -7,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.876 109.2 52.8 -58.7 -39.6 54.8 -51.8 0.6 75 80 A K H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.936 110.5 46.1 -59.7 -48.8 55.3 -48.9 3.0 76 81 A M H X S+ 0 0 14 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.864 112.3 51.0 -65.5 -38.6 53.1 -50.5 5.7 77 82 A H H X S+ 0 0 65 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.952 109.0 51.0 -61.2 -50.1 55.0 -53.8 5.2 78 83 A F H X S+ 0 0 2 -4,-2.7 4,-1.0 1,-0.2 -2,-0.2 0.906 111.8 48.1 -52.1 -45.9 58.3 -52.0 5.6 79 84 A M H <>S+ 0 0 0 -4,-2.3 5,-2.8 1,-0.2 3,-0.3 0.902 112.6 48.0 -62.4 -44.0 57.0 -50.3 8.8 80 85 A D H ><5S+ 0 0 97 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.911 113.7 46.3 -62.9 -43.9 55.8 -53.6 10.2 81 86 A T H 3<5S+ 0 0 47 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.591 116.1 45.0 -79.9 -11.9 59.0 -55.5 9.5 82 87 A N T 3<5S- 0 0 31 -4,-1.0 -1,-0.2 -3,-0.3 -2,-0.2 0.220 113.0-110.5-115.7 12.4 61.2 -52.8 10.9 83 88 A G T < 5 + 0 0 52 -3,-0.8 2,-0.6 -4,-0.3 -3,-0.2 0.788 65.4 149.4 67.0 29.9 59.3 -52.1 14.1 84 89 A I < - 0 0 1 -5,-2.8 -1,-0.2 -6,-0.2 -80,-0.1 -0.864 25.3-177.1 -98.2 121.6 58.1 -48.6 13.0 85 90 A R + 0 0 115 -82,-1.2 2,-0.4 -2,-0.6 -81,-0.2 0.910 68.4 25.2 -80.6 -47.3 54.8 -47.6 14.4 86 91 A V E -a 4 0A 0 -83,-2.4 -81,-2.9 -7,-0.1 2,-0.4 -0.971 61.7-164.4-126.5 134.1 54.3 -44.2 12.7 87 92 A S E -ac 5 126A 0 38,-2.9 40,-2.5 -2,-0.4 2,-0.8 -0.968 11.6-158.2-115.4 133.4 55.6 -42.8 9.4 88 93 A V E - c 0 127A 0 -83,-2.9 -80,-0.6 -2,-0.4 40,-0.3 -0.857 31.3-161.3-100.2 92.2 55.5 -39.1 8.4 89 94 A I E -ac 8 128A 0 38,-2.2 40,-2.1 -2,-0.8 2,-0.3 -0.318 12.3-175.2 -77.4 156.1 55.8 -39.6 4.7 90 95 A S E -ac 9 129A 0 -82,-1.5 -80,-1.4 38,-0.2 40,-0.1 -0.992 34.6 -97.5-147.9 150.3 56.9 -37.0 2.1 91 96 A L E -a 10 0A 2 38,-0.6 -80,-0.2 -2,-0.3 2,-0.1 -0.445 49.4-123.0 -61.4 138.4 57.2 -36.7 -1.6 92 97 A A > - 0 0 0 -82,-0.8 3,-1.7 1,-0.2 -1,-0.1 -0.419 46.3 -42.8 -83.1 161.7 60.8 -37.4 -2.6 93 98 A N T 3 S+ 0 0 3 1,-0.3 -1,-0.2 98,-0.2 99,-0.1 -0.277 117.3 34.0 -51.7 144.9 63.1 -35.1 -4.5 94 99 A P T > S+ 0 0 3 0, 0.0 3,-1.7 0, 0.0 -1,-0.3 -0.924 77.0 175.9 -93.9 16.9 62.8 -33.3 -7.0 95 100 A W T < - 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0 0 12 -3,-0.7 -1,-0.3 1,-0.2 3,-0.2 -0.430 61.7 -32.7 67.2-137.4 40.3 24.2 33.5 1344 214 D H T 3> S+ 0 0 26 -703,-0.2 4,-2.3 1,-0.2 5,-0.4 0.264 108.0 108.9 -96.1 9.0 40.4 21.2 31.2 1345 215 D V H <> S+ 0 0 2 -3,-1.4 4,-3.0 1,-0.2 5,-0.4 0.899 76.8 42.5 -59.5 -48.3 42.4 19.2 33.8 1346 216 D L H >>S+ 0 0 2 -3,-0.2 5,-2.2 -7,-0.2 4,-2.0 0.938 116.9 44.5 -70.1 -47.8 39.7 16.7 34.8 1347 217 D P H 4>S+ 0 0 9 0, 0.0 5,-2.0 0, 0.0 -1,-0.2 0.913 124.8 34.9 -61.2 -39.4 38.2 15.9 31.4 1348 218 D L H <5S+ 0 0 8 -4,-2.3 -2,-0.2 3,-0.2 -3,-0.2 0.894 125.0 38.6 -83.3 -43.8 41.7 15.6 29.7 1349 219 D A H <5S+ 0 0 0 -4,-3.0 -3,-0.2 -5,-0.4 -711,-0.1 0.776 139.0 10.1 -76.7 -27.5 43.7 14.0 32.6 1350 220 D L T X5S+ 0 0 0 -4,-2.0 4,-2.2 -5,-0.4 5,-0.3 0.790 122.3 52.5-118.2 -57.2 40.9 11.8 33.7 1351 221 D G H > S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 32,-0.5 0.834 116.6 52.6 -65.8 -28.0 42.0 7.7 29.8 1354 224 D M H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.914 107.1 52.0 -70.5 -41.7 39.0 6.4 31.7 1355 225 D E H X S+ 0 0 9 -4,-2.3 4,-3.0 -5,-0.3 5,-0.2 0.943 110.0 49.4 -55.7 -50.7 36.8 6.4 28.6 1356 226 D T H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.924 111.3 49.1 -54.3 -47.9 39.5 4.4 26.7 1357 227 D T H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.937 112.8 46.9 -61.0 -48.7 39.7 1.9 29.6 1358 228 D I H X S+ 0 0 6 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.934 112.3 50.5 -58.1 -47.8 35.9 1.5 29.7 1359 229 D A H X S+ 0 0 5 -4,-3.0 4,-1.8 1,-0.2 -2,-0.2 0.930 114.7 42.1 -58.1 -48.9 35.7 1.1 25.9 1360 230 D V H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.856 111.6 54.9 -67.7 -39.0 38.5 -1.6 25.7 1361 231 D A H X S+ 0 0 3 -4,-2.6 4,-2.9 -5,-0.2 -1,-0.2 0.891 108.1 50.4 -61.7 -39.6 37.2 -3.4 28.8 1362 232 D R H X S+ 0 0 23 -4,-2.3 4,-1.8 -5,-0.2 -2,-0.2 0.896 110.6 48.8 -64.1 -41.6 33.8 -3.7 27.1 1363 233 D M H <>S+ 0 0 0 -4,-1.8 5,-2.2 2,-0.2 4,-0.4 0.934 113.3 48.0 -59.8 -47.3 35.5 -5.1 24.0 1364 234 D Y H ><5S+ 0 0 25 -4,-2.9 3,-1.6 1,-0.2 -2,-0.2 0.947 112.0 47.5 -60.5 -50.3 37.3 -7.5 26.1 1365 235 D M H 3<5S+ 0 0 35 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.782 109.3 54.6 -64.1 -29.6 34.3 -8.7 28.0 1366 236 D A T 3<5S- 0 0 11 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.484 115.5-117.4 -81.7 -4.5 32.3 -9.1 24.8 1367 237 D G T X>5 + 0 0 12 -3,-1.6 4,-2.8 -4,-0.4 3,-0.6 0.671 65.3 145.6 78.0 19.4 35.0 -11.4 23.4 1368 238 D V H 3>< S+ 0 0 4 -4,-2.2 3,-1.5 -5,-0.3 -1,-0.3 -0.738 73.1 172.7-128.9 81.4 38.5 -11.3 15.7 1373 243 D R T 3 S+ 0 0 115 -3,-0.4 -1,-0.1 -2,-0.4 -2,-0.1 0.716 74.6 53.8 -71.0 -22.5 41.8 -13.0 16.5 1374 244 D N T 3 S+ 0 0 81 2,-0.1 -1,-0.3 -4,-0.0 2,-0.3 0.382 81.3 120.3 -93.0 4.5 43.9 -11.1 13.9 1375 245 D L < - 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0 0 9 -3,-1.6 4,-2.6 1,-0.2 5,-0.3 -0.719 51.8-160.8 -87.0 106.7 31.9 -13.0 39.5 1401 271 D G H > S+ 0 0 21 -2,-0.9 4,-2.7 1,-0.2 5,-0.2 0.929 89.2 47.7 -44.7 -55.8 29.2 -15.4 40.6 1402 272 D H H > S+ 0 0 61 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.869 113.4 44.5 -60.8 -46.9 27.0 -14.8 37.6 1403 273 D L H 4>S+ 0 0 5 2,-0.2 5,-3.2 1,-0.2 6,-0.6 0.903 115.9 47.6 -65.5 -41.8 29.7 -15.1 34.9 1404 274 D V H ><5S+ 0 0 21 -4,-2.6 3,-1.5 1,-0.2 5,-0.3 0.948 113.8 45.8 -65.4 -48.5 31.2 -18.2 36.5 1405 275 D K H 3<5S+ 0 0 149 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.652 111.3 52.8 -74.0 -16.9 27.9 -20.0 36.9 1406 276 D T T 3<5S- 0 0 73 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.263 119.8-107.7 -99.1 10.6 26.7 -19.1 33.4 1407 277 D G T < 5S+ 0 0 55 -3,-1.5 -3,-0.2 2,-0.1 -2,-0.1 0.689 82.2 126.7 78.2 21.0 29.9 -20.5 31.9 1408 278 D K < + 0 0 135 -5,-3.2 -4,-0.2 1,-0.2 -5,-0.1 0.511 67.9 56.9 -87.6 -3.1 31.5 -17.2 30.9 1409 279 D V S S+ 0 0 29 -6,-0.6 -1,-0.2 -5,-0.3 -2,-0.1 -0.517 72.1 171.7-125.8 64.1 34.8 -18.0 32.7 1410 280 D P > - 0 0 62 0, 0.0 3,-1.2 0, 0.0 -2,-0.0 -0.292 43.8-113.3 -71.9 163.1 36.1 -21.3 31.3 1411 281 D K T 3 S+ 0 0 218 1,-0.3 0, 0.0 3,-0.0 0, 0.0 0.779 114.6 57.8 -67.5 -28.9 39.6 -22.6 32.2 1412 282 D D T 3 S+ 0 0 143 2,-0.1 -1,-0.3 0, 0.0 2,-0.0 0.174 82.4 144.1 -87.6 17.0 41.0 -22.2 28.7 1413 283 D R < - 0 0 49 -3,-1.2 2,-0.7 1,-0.1 -4,-0.0 -0.263 55.6-124.7 -58.9 133.2 40.1 -18.5 28.9 1414 284 D R - 0 0 46 4,-0.0 -1,-0.1 3,-0.0 -44,-0.1 -0.755 33.5-141.0 -79.2 116.0 42.4 -15.9 27.3 1415 285 D T > - 0 0 38 -2,-0.7 4,-2.0 1,-0.1 3,-0.4 -0.292 22.1-108.9 -74.1 161.6 43.2 -13.5 30.2 1416 286 D I H > S+ 0 0 1 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.829 121.2 60.1 -56.4 -32.0 43.4 -9.7 29.7 1417 287 D W H > S+ 0 0 64 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.885 104.5 47.3 -63.9 -40.9 47.2 -10.2 30.2 1418 288 D T H > S+ 0 0 46 -3,-0.4 4,-1.4 2,-0.2 3,-0.5 0.918 111.4 50.0 -66.0 -45.3 47.4 -12.5 27.2 1419 289 D V H X>S+ 0 0 0 -4,-2.0 4,-2.9 1,-0.2 5,-1.3 0.894 107.7 55.8 -59.4 -39.3 45.4 -10.0 25.1 1420 290 D L H <5S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.791 113.3 40.4 -64.3 -29.4 47.8 -7.3 26.3 1421 291 D K H <5S+ 0 0 112 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.636 127.4 31.1 -89.3 -18.7 50.8 -9.3 25.0 1422 292 D E H <5S+ 0 0 77 -4,-1.4 -3,-0.2 -3,-0.3 -2,-0.2 0.740 131.1 15.7-114.7 -31.6 49.2 -10.5 21.7 1423 293 D Q T <5S+ 0 0 0 -4,-2.9 -46,-2.8 -5,-0.2 2,-0.5 0.457 104.8 80.4-129.0 -4.3 46.7 -8.0 20.3 1424 294 D I E < -n 1377 0J 0 -5,-1.3 2,-0.3 -48,-0.2 -46,-0.2 -0.928 46.3-175.0-116.2 130.2 47.3 -4.7 22.1 1425 295 D Y E -n 1378 0J 25 -48,-3.6 -46,-2.8 -2,-0.5 2,-0.4 -0.895 15.6-150.9-107.4 149.3 49.9 -2.1 21.5 1426 296 D L E -no13791448J 0 21,-2.4 23,-1.9 -2,-0.3 -46,-0.1 -0.971 7.7-135.6-123.7 132.2 50.2 0.9 23.8 1427 297 D D E - 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0 0 14 -4,-2.9 3,-2.0 -5,-0.4 -3,-0.1 0.095 30.7 -87.0 95.8 148.7 56.4 -5.7 26.8 1445 315 D A G > S+ 0 0 14 1,-0.3 3,-0.8 2,-0.2 -1,-0.1 0.721 124.7 62.6 -61.6 -23.4 58.9 -3.2 25.6 1446 316 D D G 3 S+ 0 0 83 1,-0.2 -1,-0.3 -6,-0.1 -2,-0.1 0.428 102.6 51.6 -81.6 2.1 58.4 -4.3 22.0 1447 317 D R G < S+ 0 0 21 -3,-2.0 -21,-2.4 -7,-0.1 2,-0.4 0.244 87.8 94.1-125.0 11.4 54.8 -3.2 22.1 1448 318 D L E < -o 1426 0J 0 -3,-0.8 2,-0.4 -23,-0.2 -21,-0.2 -0.849 53.2-166.4-105.4 143.1 55.2 0.4 23.4 1449 319 D M E -o 1427 0J 2 -23,-1.9 -21,-2.1 -2,-0.4 -20,-0.2 -0.967 20.0-120.5-138.9 121.0 55.4 3.3 21.0 1450 320 D F + 0 0 5 42,-3.2 -309,-2.2 -2,-0.4 2,-0.3 -0.192 38.1 164.7 -51.3 140.5 56.4 7.0 21.5 1451 321 D G - 0 0 0 -311,-0.2 -308,-0.1 -310,-0.2 23,-0.1 -0.952 28.6-160.0-152.0 166.1 53.9 9.7 20.7 1452 322 D T - 0 0 0 -310,-1.4 5,-0.2 -2,-0.3 -309,-0.2 0.562 29.7-132.2-121.9 -22.8 53.5 13.4 21.5 1453 323 D D > - 0 0 7 -311,-3.0 3,-2.5 1,-0.2 4,-0.3 0.692 44.3-148.1 63.3 22.5 49.8 14.3 21.0 1454 324 D H B 3 +i 1143 0J 0 -312,-0.6 -310,-3.3 1,-0.3 -1,-0.2 -0.350 65.6 15.3 -55.6 135.3 50.9 17.3 18.9 1455 325 D P T 3 S+ 0 0 2 0, 0.0 -1,-0.3 0, 0.0 -254,-0.1 -0.796 104.8 79.1-111.3 36.0 49.4 19.8 18.8 1456 326 D F S < S+ 0 0 24 -3,-2.5 -2,-0.2 1,-0.2 -3,-0.1 0.748 96.7 44.1 -75.8 -24.0 47.0 19.6 21.8 1457 327 D F S S+ 0 0 14 -4,-0.3 13,-0.5 -5,-0.2 -1,-0.2 -0.595 73.0 170.8-121.5 70.6 49.5 20.6 24.6 1458 328 D P - 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