==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING/PROTEIN BINDING 19-AUG-12 2LXC . COMPND 2 MOLECULE: UBIQUITIN-LIKE PROTEIN MDY2; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR J.W.CHARTRON,D.G.VANDERVELDE,W.M.CLEMONS JR. . 229 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12229.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 160 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 8.7 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 . 1 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 . 27 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 33.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 3.5 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 0 0 0 0 0 1 0 0 0 0 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 1 0 1 0 0 1 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 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 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 73 A M 0 0 170 0, 0.0 2,-0.4 0, 0.0 20,-0.2 0.000 360.0 360.0 360.0 143.8 -26.5 12.3 0.2 2 74 A V E -A 20 0A 40 18,-3.4 18,-2.9 2,-0.0 2,-0.6 -0.841 360.0-130.9-101.5 133.4 -22.8 11.6 0.1 3 75 A H E +A 19 0A 128 -2,-0.4 2,-0.5 16,-0.2 16,-0.2 -0.728 28.3 178.5 -86.3 120.1 -21.1 10.7 -3.2 4 76 A L E -A 18 0A 2 14,-3.0 14,-2.3 -2,-0.6 2,-0.7 -0.979 15.3-157.0-125.7 120.1 -18.9 7.7 -2.9 5 77 A T E -Ab 17 71A 35 65,-2.7 67,-3.4 -2,-0.5 2,-0.7 -0.864 11.3-149.4 -99.5 113.0 -17.0 6.3 -5.9 6 78 A L E -Ab 16 72A 1 10,-2.8 10,-1.6 -2,-0.7 2,-0.6 -0.728 16.4-176.4 -84.6 114.6 -16.2 2.6 -5.4 7 79 A K E -Ab 15 73A 25 65,-3.4 67,-2.6 -2,-0.7 2,-0.6 -0.912 5.8-166.9-117.9 103.8 -12.9 1.9 -7.3 8 80 A K E +Ab 14 74A 1 6,-3.1 6,-1.1 -2,-0.6 67,-0.1 -0.815 8.4 179.0 -92.2 121.8 -11.9 -1.8 -7.2 9 81 A I + 0 0 13 65,-1.0 -1,-0.2 -2,-0.6 4,-0.2 0.939 60.8 65.0 -85.0 -57.8 -8.3 -2.4 -8.4 10 82 A Q S S- 0 0 14 64,-0.5 4,-0.1 1,-0.1 64,-0.1 -0.226 101.7 -48.1 -66.2 158.5 -7.9 -6.1 -8.0 11 83 A A S S+ 0 0 65 1,-0.2 -1,-0.1 2,-0.1 -2,-0.1 -0.490 128.3 42.4 -79.3 139.7 -10.0 -8.5 -10.1 12 84 A P S S- 0 0 66 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 0.416 94.1-174.9 -75.2 129.4 -12.8 -8.5 -10.6 13 85 A K + 0 0 110 -4,-0.2 2,-0.3 -2,-0.1 -4,-0.2 -0.559 12.3 149.5 -92.1 159.0 -12.2 -4.7 -10.9 14 86 A F E -A 8 0A 30 -6,-1.1 -6,-3.1 -2,-0.2 2,-0.3 -0.969 35.2-138.8-173.2 167.9 -14.8 -2.1 -11.4 15 87 A S E +A 7 0A 80 -2,-0.3 2,-0.3 -8,-0.2 -8,-0.2 -0.782 27.3 172.0-146.6 97.7 -15.7 1.6 -10.7 16 88 A I E -A 6 0A 45 -10,-1.6 -10,-2.8 -2,-0.3 2,-0.5 -0.837 21.9-143.7-110.4 146.0 -19.2 2.3 -9.6 17 89 A E E +A 5 0A 152 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.929 29.4 162.7-111.0 126.2 -20.6 5.7 -8.4 18 90 A H E -A 4 0A 70 -14,-2.3 -14,-3.0 -2,-0.5 2,-0.5 -0.961 34.9-123.4-142.5 159.4 -23.2 5.7 -5.6 19 91 A D E -A 3 0A 90 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.2 -0.897 30.8-177.0-105.7 126.8 -24.9 7.9 -3.1 20 92 A F E -A 2 0A 24 -18,-2.9 -18,-3.4 -2,-0.5 -2,-0.0 -0.760 27.2-103.2-117.9 167.7 -24.8 6.9 0.6 21 93 A S > - 0 0 63 -2,-0.3 3,-2.0 -20,-0.2 39,-0.3 -0.571 26.8-119.0 -89.7 153.7 -26.2 8.4 3.8 22 94 A P T 3 S+ 0 0 74 0, 0.0 39,-1.0 0, 0.0 -1,-0.1 0.799 119.4 42.9 -60.5 -27.9 -24.1 10.3 6.4 23 95 A S T 3 S+ 0 0 84 37,-0.2 2,-0.1 36,-0.1 -2,-0.0 0.123 90.2 129.2-104.0 17.9 -25.0 7.6 8.9 24 96 A D < - 0 0 31 -3,-2.0 36,-1.6 1,-0.1 2,-0.3 -0.400 54.1-129.0 -73.3 152.1 -24.5 4.8 6.5 25 97 A T B >> -E 59 0B 32 34,-0.2 3,-1.2 1,-0.1 4,-0.8 -0.787 11.8-128.7-104.6 147.1 -22.3 1.8 7.5 26 98 A I H 3> S+ 0 0 0 32,-2.1 4,-2.1 29,-0.3 3,-0.2 0.762 106.6 72.1 -62.3 -23.8 -19.5 0.4 5.4 27 99 A L H 3> S+ 0 0 36 29,-1.0 4,-2.6 31,-0.3 -1,-0.3 0.871 90.9 56.9 -59.2 -37.9 -21.1 -3.0 5.9 28 100 A Q H <> S+ 0 0 109 -3,-1.2 4,-2.2 2,-0.2 -1,-0.2 0.891 106.0 49.9 -61.8 -40.0 -23.9 -1.9 3.5 29 101 A I H X S+ 0 0 3 -4,-0.8 4,-2.1 -3,-0.2 -2,-0.2 0.942 110.3 50.1 -63.1 -47.5 -21.2 -1.2 0.8 30 102 A K H X S+ 0 0 2 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.912 111.0 48.8 -56.5 -47.4 -19.7 -4.7 1.4 31 103 A Q H X S+ 0 0 88 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.891 108.6 54.1 -61.3 -40.0 -23.1 -6.3 1.1 32 104 A H H X S+ 0 0 67 -4,-2.2 4,-1.0 1,-0.2 -1,-0.2 0.885 106.3 52.2 -62.7 -38.5 -23.8 -4.4 -2.1 33 105 A L H <>S+ 0 0 1 -4,-2.1 5,-2.6 1,-0.2 6,-0.9 0.889 111.8 45.8 -65.4 -39.6 -20.6 -5.7 -3.6 34 106 A I H ><5S+ 0 0 40 -4,-1.8 3,-1.8 4,-0.2 -2,-0.2 0.897 109.6 54.5 -69.7 -39.7 -21.5 -9.3 -2.8 35 107 A S H 3<5S+ 0 0 94 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.721 106.0 54.0 -67.1 -20.3 -25.0 -8.8 -4.1 36 108 A E T 3<5S- 0 0 82 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.199 117.6-112.8 -98.8 14.6 -23.5 -7.6 -7.4 37 109 A E T < 5S+ 0 0 161 -3,-1.8 -3,-0.2 2,-0.1 -2,-0.1 0.831 92.1 109.8 58.1 35.1 -21.4 -10.8 -7.7 38 110 A K S - 0 0 102 36,-0.3 3,-1.3 1,-0.1 -1,-0.4 -0.984 57.0-127.4-138.0 147.8 -17.4 -12.5 1.8 42 114 A I G > S+ 0 0 49 -2,-0.3 3,-1.8 1,-0.3 -1,-0.1 0.826 109.0 66.4 -60.4 -33.0 -17.5 -9.3 3.8 43 115 A S G 3 S+ 0 0 95 1,-0.3 -1,-0.3 -3,-0.0 13,-0.0 0.768 98.8 51.1 -58.6 -28.8 -14.6 -10.7 5.8 44 116 A E G < S+ 0 0 68 -3,-1.3 33,-1.3 33,-0.1 2,-0.4 0.217 95.8 93.0 -96.9 14.6 -12.3 -10.5 2.8 45 117 A I E < +C 76 0A 6 -3,-1.8 2,-0.4 31,-0.2 31,-0.2 -0.910 43.5 171.7-115.9 135.4 -13.1 -6.9 2.0 46 118 A K E -C 75 0A 27 29,-2.2 29,-1.6 -2,-0.4 2,-0.4 -0.987 20.9-143.4-140.9 129.1 -11.3 -3.7 3.1 47 119 A L E -C 74 0A 2 -2,-0.4 7,-1.9 7,-0.3 2,-0.4 -0.770 11.2-157.4 -96.2 136.1 -12.0 -0.2 1.9 48 120 A L E -CD 73 53A 2 25,-2.9 25,-3.2 -2,-0.4 2,-0.5 -0.921 7.8-170.4-112.5 134.7 -9.2 2.3 1.4 49 121 A L E > S- D 0 52A 4 3,-3.0 3,-2.0 -2,-0.4 23,-0.1 -0.848 73.1 -52.6-127.5 96.6 -9.7 6.1 1.4 50 122 A K T 3 S- 0 0 56 -2,-0.5 2,-0.7 21,-0.4 3,-0.1 0.894 117.4 -41.5 36.4 59.4 -6.5 7.8 0.2 51 123 A G T 3 S+ 0 0 0 1,-0.3 -1,-0.3 146,-0.1 2,-0.1 -0.169 117.6 116.3 88.3 -44.0 -4.4 5.9 2.8 52 124 A K E < -D 49 0A 80 -3,-2.0 -3,-3.0 -2,-0.7 2,-0.3 -0.398 63.2-135.6 -59.7 126.9 -7.1 6.4 5.5 53 125 A V E -D 48 0A 22 -5,-0.2 2,-0.3 -2,-0.1 -5,-0.2 -0.695 13.0-151.1 -94.1 140.7 -8.4 2.9 6.4 54 126 A L - 0 0 4 -7,-1.9 -7,-0.3 -2,-0.3 2,-0.3 -0.773 8.2-140.1-106.7 154.4 -12.2 2.2 6.9 55 127 A H > - 0 0 96 -2,-0.3 3,-1.4 -9,-0.1 -29,-0.3 -0.774 22.3-112.9-115.3 158.4 -13.7 -0.4 9.2 56 128 A D T 3 S+ 0 0 60 -2,-0.3 -29,-1.0 1,-0.3 -30,-0.2 0.917 117.4 31.9 -51.4 -55.0 -16.7 -2.8 8.7 57 129 A N T 3 S+ 0 0 117 -31,-0.2 -1,-0.3 -32,-0.1 2,-0.1 0.159 95.5 126.3 -94.0 19.3 -19.0 -1.2 11.3 58 130 A L < - 0 0 31 -3,-1.4 -32,-2.1 1,-0.0 2,-0.3 -0.468 52.0-138.0 -78.3 149.6 -17.6 2.2 10.6 59 131 A F B >> -E 25 0B 77 -34,-0.2 4,-2.0 -2,-0.1 3,-1.8 -0.811 18.1-121.9-108.9 150.3 -19.9 5.1 9.7 60 132 A L H 3>>S+ 0 0 7 -36,-1.6 4,-1.5 -2,-0.3 5,-0.7 0.783 114.9 56.5 -59.1 -28.2 -19.3 7.8 7.0 61 133 A S H 345S+ 0 0 80 -39,-1.0 -1,-0.3 -37,-0.2 -38,-0.1 0.609 109.1 48.0 -79.1 -12.6 -19.6 10.5 9.7 62 134 A D H <45S+ 0 0 109 -3,-1.8 -2,-0.2 1,-0.1 -1,-0.1 0.888 117.4 35.8 -92.1 -49.9 -16.8 8.8 11.7 63 135 A L H <5S- 0 0 4 -4,-2.0 -2,-0.2 -8,-0.1 -3,-0.2 0.765 105.2-135.2 -75.1 -25.9 -14.2 8.2 9.0 64 136 A K T <5 - 0 0 141 -4,-1.5 2,-0.8 -5,-0.3 -3,-0.2 0.928 8.7-121.9 67.9 99.4 -15.2 11.6 7.4 65 137 A V < - 0 0 27 -5,-0.7 -1,-0.1 1,-0.1 -62,-0.1 -0.598 27.0-134.0 -73.0 107.7 -15.5 11.3 3.6 66 138 A T >> - 0 0 55 -2,-0.8 3,-1.8 1,-0.2 4,-1.7 -0.484 4.7-149.3 -66.6 123.5 -13.0 13.9 2.2 67 139 A P T 34 S+ 0 0 122 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.766 96.5 66.7 -64.0 -24.0 -14.7 16.0 -0.5 68 140 A A T 34 S+ 0 0 96 1,-0.1 -2,-0.1 2,-0.0 -3,-0.0 0.396 118.9 19.0 -78.3 4.3 -11.2 16.3 -2.1 69 141 A N T <4 + 0 0 54 -3,-1.8 3,-0.1 -20,-0.0 -1,-0.1 0.506 59.1 172.5-132.8 -72.6 -11.4 12.6 -2.8 70 142 A S < + 0 0 29 -4,-1.7 -65,-2.7 1,-0.2 2,-0.5 0.634 49.8 121.9 60.3 14.9 -14.8 10.9 -2.8 71 143 A T E -b 5 0A 53 -5,-0.2 2,-0.6 -67,-0.2 -21,-0.4 -0.937 45.4-167.3-114.0 120.1 -12.9 7.9 -4.1 72 144 A I E -b 6 0A 0 -67,-3.4 -65,-3.4 -2,-0.5 2,-0.5 -0.931 14.4-142.0-110.2 119.7 -13.0 4.6 -2.1 73 145 A T E -bC 7 48A 8 -25,-3.2 -25,-2.9 -2,-0.6 2,-0.5 -0.688 15.1-146.4 -83.2 123.9 -10.6 1.9 -3.1 74 146 A V E -bC 8 47A 0 -67,-2.6 -65,-1.0 -2,-0.5 2,-0.5 -0.814 14.2-172.7 -97.5 125.0 -12.1 -1.6 -2.9 75 147 A M E + C 0 46A 7 -29,-1.6 -29,-2.2 -2,-0.5 2,-0.4 -0.968 13.0 165.7-117.9 118.4 -9.8 -4.5 -1.8 76 148 A I E - C 0 45A 4 -2,-0.5 -31,-0.2 -31,-0.2 -34,-0.1 -0.996 27.6-146.5-136.5 140.8 -11.3 -8.0 -2.0 77 149 A K - 0 0 90 -33,-1.3 -36,-0.3 -2,-0.4 2,-0.3 -0.922 27.0-126.4-106.7 120.1 -9.8 -11.5 -1.9 78 150 A P - 0 0 85 0, 0.0 -39,-0.0 0, 0.0 -67,-0.0 -0.492 24.0-177.6 -69.9 126.2 -11.6 -14.1 -4.1 79 151 A N + 0 0 66 -2,-0.3 2,-0.5 2,-0.1 -40,-0.0 0.552 61.5 91.0 -96.0 -13.2 -12.6 -17.2 -2.2 80 152 A L 0 0 144 1,-0.0 -40,-0.0 0, 0.0 0, 0.0 -0.753 360.0 360.0 -88.4 125.2 -14.0 -18.8 -5.4 81 153 A E 0 0 266 -2,-0.5 -2,-0.1 0, 0.0 -1,-0.0 -0.652 360.0 360.0 -77.0 360.0 -11.5 -20.9 -7.3 82 !* 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 83 -1 B S 0 0 99 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -78.5 18.6 11.3 -12.0 84 0 B V + 0 0 114 2,-0.0 2,-0.5 0, 0.0 63,-0.1 0.235 360.0 147.2 -83.1 14.0 21.3 8.7 -11.3 85 1 B D + 0 0 39 1,-0.2 63,-0.2 63,-0.0 61,-0.0 -0.367 21.1 176.7 -56.4 106.8 18.7 6.5 -9.5 86 2 B S + 0 0 68 61,-0.9 2,-0.5 -2,-0.5 62,-0.2 0.190 38.0 122.3 -98.2 13.2 19.9 3.0 -10.3 87 3 B A - 0 0 10 60,-1.4 2,-0.3 59,-0.2 59,-0.1 -0.667 58.1-137.2 -81.1 126.1 17.2 1.4 -8.2 88 4 B S > - 0 0 59 -2,-0.5 4,-2.1 1,-0.1 5,-0.2 -0.601 8.6-133.2 -84.8 142.5 15.0 -1.0 -10.1 89 5 B K H > S+ 0 0 60 -2,-0.3 4,-3.2 1,-0.2 5,-0.2 0.902 107.7 54.5 -60.1 -43.4 11.2 -0.9 -9.5 90 6 B E H > S+ 0 0 125 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.864 107.8 51.6 -59.0 -36.3 11.0 -4.7 -9.2 91 7 B E H > S+ 0 0 52 2,-0.2 4,-1.9 -3,-0.2 -2,-0.2 0.954 113.3 42.8 -64.7 -51.0 13.7 -4.5 -6.5 92 8 B I H X S+ 0 0 8 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.927 113.0 52.9 -61.5 -46.8 11.9 -1.9 -4.5 93 9 B A H X S+ 0 0 0 -4,-3.2 4,-2.0 1,-0.2 5,-0.2 0.926 111.8 45.4 -55.4 -47.8 8.5 -3.6 -4.9 94 10 B A H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.828 111.6 53.8 -65.9 -32.1 9.9 -6.9 -3.6 95 11 B L H X S+ 0 0 27 -4,-1.9 4,-3.0 2,-0.2 -2,-0.2 0.878 106.7 52.0 -69.5 -38.1 11.6 -5.0 -0.8 96 12 B I H X S+ 0 0 5 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.952 114.3 40.5 -63.5 -50.9 8.3 -3.4 0.2 97 13 B V H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.855 117.1 51.2 -67.8 -33.6 6.4 -6.8 0.4 98 14 B N H X S+ 0 0 11 -4,-1.9 4,-2.0 -5,-0.2 -2,-0.2 0.941 112.3 45.1 -67.4 -48.4 9.5 -8.4 2.0 99 15 B Y H X S+ 0 0 2 -4,-3.0 4,-1.5 2,-0.2 -2,-0.2 0.956 112.8 50.1 -60.6 -52.3 9.7 -5.7 4.7 100 16 B F H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 3,-0.4 0.905 109.7 51.1 -54.7 -46.8 6.0 -5.6 5.5 101 17 B S H X S+ 0 0 48 -4,-2.0 4,-1.3 1,-0.3 -1,-0.2 0.908 111.5 46.9 -59.5 -42.6 5.9 -9.4 5.9 102 18 B S H X S+ 0 0 6 -4,-2.0 4,-1.1 1,-0.2 -1,-0.3 0.735 110.2 55.6 -72.4 -19.1 8.8 -9.3 8.3 103 19 B I H <>S+ 0 0 0 -4,-1.5 5,-2.7 -3,-0.4 4,-0.3 0.892 109.5 43.1 -79.9 -39.8 7.2 -6.5 10.2 104 20 B V H <5S+ 0 0 49 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.749 105.5 68.8 -75.7 -22.8 3.9 -8.3 10.8 105 21 B E H <5S+ 0 0 113 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.922 115.4 22.6 -60.0 -49.0 6.1 -11.3 11.7 106 22 B K T <5S- 0 0 103 -4,-1.1 -1,-0.2 -3,-0.1 -2,-0.2 0.299 108.8-120.7-102.1 6.7 7.4 -9.7 14.9 107 23 B K T 5 + 0 0 116 -4,-0.3 -3,-0.2 1,-0.2 -4,-0.1 0.946 47.9 167.9 50.8 56.9 4.4 -7.4 15.1 108 24 B E < + 0 0 58 -5,-2.7 2,-0.3 -6,-0.1 -1,-0.2 -0.070 58.6 39.1 -90.6 33.7 6.6 -4.3 15.0 109 25 B I S S- 0 0 26 -6,-0.2 5,-0.1 -5,-0.1 94,-0.1 -0.971 99.8 -60.7-168.4 168.6 3.6 -2.0 14.4 110 26 B S > - 0 0 79 92,-0.3 4,-2.6 -2,-0.3 5,-0.2 -0.161 51.4-109.6 -58.2 154.8 -0.0 -1.4 15.4 111 27 B E H > S+ 0 0 135 1,-0.2 4,-1.7 2,-0.2 3,-0.2 0.935 120.0 35.4 -52.1 -58.2 -2.7 -4.1 14.8 112 28 B D H > S+ 0 0 47 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.771 113.0 63.5 -70.6 -23.6 -4.5 -2.2 12.0 113 29 B G H > S+ 0 0 7 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.929 104.1 45.2 -64.0 -44.2 -1.1 -0.9 10.9 114 30 B A H X S+ 0 0 15 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.892 112.7 51.7 -64.6 -40.7 0.0 -4.4 10.1 115 31 B D H X S+ 0 0 83 -4,-1.7 4,-2.5 -5,-0.2 -2,-0.2 0.909 109.5 49.8 -62.6 -43.2 -3.3 -5.1 8.3 116 32 B S H X S+ 0 0 7 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.903 110.3 50.1 -62.6 -42.5 -2.9 -1.9 6.2 117 33 B L H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.891 111.0 50.1 -64.1 -38.9 0.7 -3.0 5.3 118 34 B N H X S+ 0 0 67 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.935 113.4 43.7 -65.8 -46.7 -0.6 -6.4 4.3 119 35 B V H X S+ 0 0 18 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.885 115.4 48.7 -67.8 -38.3 -3.4 -5.1 2.1 120 36 B A H X S+ 0 0 3 -4,-2.6 4,-2.8 -5,-0.2 -1,-0.2 0.910 110.0 53.2 -66.6 -39.9 -1.2 -2.5 0.5 121 37 B M H X S+ 0 0 1 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.914 108.0 50.4 -59.2 -45.1 1.5 -5.1 -0.1 122 38 B D H X S+ 0 0 19 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.921 113.8 44.0 -61.1 -46.2 -1.1 -7.3 -1.9 123 39 B C H X S+ 0 0 1 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.871 111.8 53.6 -67.6 -38.4 -2.2 -4.4 -4.1 124 40 B I H X S+ 0 0 0 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.894 106.1 53.1 -63.6 -39.0 1.4 -3.4 -4.7 125 41 B S H <>S+ 0 0 6 -4,-2.4 5,-2.7 1,-0.2 4,-0.4 0.898 111.7 45.8 -63.0 -38.5 2.2 -6.9 -5.9 126 42 B E H ><5S+ 0 0 103 -4,-1.6 3,-0.7 3,-0.2 -2,-0.2 0.901 108.4 56.8 -69.8 -41.0 -0.7 -6.7 -8.3 127 43 B A H 3<5S+ 0 0 24 -4,-2.7 58,-0.3 1,-0.3 -2,-0.2 0.862 115.5 35.9 -59.0 -39.5 0.4 -3.2 -9.5 128 44 B F T 3<5S- 0 0 41 -4,-2.0 -1,-0.3 2,-0.2 -2,-0.2 0.449 110.1-123.3 -94.9 -0.7 3.9 -4.5 -10.4 129 45 B G T < 5S+ 0 0 66 -3,-0.7 2,-0.3 -4,-0.4 -3,-0.2 0.873 70.9 119.4 61.4 39.8 2.5 -7.8 -11.6 130 46 B F < - 0 0 33 -5,-2.7 2,-0.4 -6,-0.2 -1,-0.2 -0.895 65.2-109.1-131.3 160.8 4.7 -9.8 -9.3 131 47 B E > - 0 0 143 -2,-0.3 3,-2.1 1,-0.1 4,-0.1 -0.739 17.2-133.5 -94.1 140.4 4.0 -12.3 -6.4 132 48 B R G > S+ 0 0 77 -2,-0.4 3,-0.8 1,-0.3 -1,-0.1 0.799 108.2 57.3 -57.7 -29.7 4.7 -11.3 -2.8 133 49 B E G 3 S+ 0 0 115 1,-0.2 3,-0.4 2,-0.1 -1,-0.3 0.447 84.5 80.9 -83.8 -0.4 6.4 -14.7 -2.4 134 50 B A G X> + 0 0 31 -3,-2.1 4,-1.8 1,-0.2 3,-1.6 0.404 58.9 111.0 -85.7 3.5 8.9 -14.0 -5.2 135 51 B V H <>>S+ 0 0 18 -3,-0.8 4,-2.9 1,-0.3 5,-0.7 0.881 75.5 48.1 -41.4 -59.7 11.0 -11.9 -2.8 136 52 B S H 345S+ 0 0 31 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.701 111.1 54.5 -59.0 -21.0 14.0 -14.4 -2.7 137 53 B G H <45S+ 0 0 73 -3,-1.6 -1,-0.2 -4,-0.1 -2,-0.2 0.861 118.6 29.8 -81.9 -38.4 13.8 -14.5 -6.5 138 54 B I H <5S+ 0 0 51 -4,-1.8 -2,-0.2 -3,-0.4 -3,-0.2 0.921 137.0 19.8 -86.2 -51.7 14.1 -10.8 -7.1 139 55 B L T ><5S+ 0 0 7 -4,-2.9 3,-1.0 -5,-0.2 2,-0.7 0.967 74.1 155.7 -83.6 -67.3 16.2 -9.6 -4.1 140 56 B G T 3 - 0 0 76 -2,-0.3 3,-1.5 67,-0.0 -1,-0.1 0.708 37.1-149.1 -85.4 -23.5 18.2 9.7 -4.1 150 66 B A T 3 - 0 0 25 1,-0.3 3,-0.1 3,-0.0 -2,-0.0 0.692 61.1 -76.1 59.5 19.8 15.3 11.2 -6.1 151 67 B D T 3 S+ 0 0 92 1,-0.2 2,-0.8 2,-0.0 -1,-0.3 0.872 82.7 164.4 59.4 41.3 17.6 14.2 -6.3 152 68 B I < + 0 0 25 -3,-1.5 -1,-0.2 63,-0.2 3,-0.1 -0.804 15.1 153.2 -95.0 106.7 16.9 15.2 -2.7 153 69 B L + 0 0 108 -2,-0.8 3,-0.4 1,-0.1 -1,-0.1 0.198 54.8 89.8-112.8 10.5 19.4 17.7 -1.5 154 70 B N + 0 0 127 1,-0.2 -1,-0.1 61,-0.1 61,-0.1 -0.230 43.5 131.5-100.7 41.7 17.0 19.2 1.1 155 71 B S 0 0 39 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.826 360.0 360.0 -62.5 -32.9 18.2 16.8 3.7 156 72 B A 0 0 156 -3,-0.4 -1,-0.3 59,-0.0 56,-0.0 -0.718 360.0 360.0-147.0 360.0 18.6 19.7 6.1 157 !* 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 0.0 158 -1 C S 0 0 82 0, 0.0 2,-0.2 0, 0.0 65,-0.0 0.000 360.0 360.0 360.0 -99.4 18.0 -11.7 12.0 159 0 C V + 0 0 105 2,-0.0 2,-1.2 0, 0.0 63,-0.1 -0.371 360.0 168.7-106.5 50.4 20.4 -8.7 12.1 160 1 C D - 0 0 33 -2,-0.2 2,-1.5 1,-0.1 63,-0.2 -0.517 14.8-170.6 -69.0 96.3 18.1 -6.4 10.1 161 2 C S B +F 222 0C 69 -2,-1.2 61,-0.9 61,-0.9 2,-0.3 -0.440 46.6 106.9 -89.4 61.2 19.8 -3.1 10.6 162 3 C A - 0 0 17 -2,-1.5 2,-0.4 59,-0.2 59,-0.1 -0.999 62.0-133.1-139.8 143.4 17.0 -1.0 9.1 163 4 C S > - 0 0 56 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.777 13.2-137.1 -98.8 138.5 14.4 1.3 10.6 164 5 C K H > S+ 0 0 61 -2,-0.4 4,-2.8 1,-0.2 5,-0.2 0.837 105.6 58.5 -60.6 -32.7 10.8 1.1 9.6 165 6 C E H > S+ 0 0 109 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.953 106.9 45.9 -59.7 -52.3 10.7 4.9 9.5 166 7 C E H > S+ 0 0 64 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.935 114.3 47.9 -55.6 -51.5 13.5 5.0 6.9 167 8 C I H X S+ 0 0 22 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.929 109.8 52.3 -57.2 -48.9 11.9 2.3 4.8 168 9 C A H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 5,-0.2 0.906 111.3 47.1 -54.3 -45.0 8.5 3.9 4.9 169 10 C A H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.841 109.8 53.8 -66.7 -33.8 10.0 7.2 3.7 170 11 C L H X S+ 0 0 30 -4,-2.1 4,-2.8 -5,-0.2 -2,-0.2 0.882 108.7 49.8 -68.6 -37.4 11.9 5.3 1.0 171 12 C I H X S+ 0 0 0 -4,-2.4 4,-3.1 2,-0.2 5,-0.2 0.979 114.4 41.4 -64.0 -57.1 8.6 3.7 -0.3 172 13 C V H X S+ 0 0 0 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.780 117.1 51.2 -63.6 -26.2 6.6 7.0 -0.4 173 14 C N H X S+ 0 0 9 -4,-1.6 4,-1.6 -5,-0.2 -1,-0.2 0.926 112.7 43.4 -75.7 -46.8 9.7 8.7 -1.9 174 15 C Y H X S+ 0 0 5 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.920 112.0 54.4 -64.1 -43.7 10.3 6.1 -4.6 175 16 C F H X S+ 0 0 1 -4,-3.1 4,-2.1 1,-0.2 5,-0.3 0.895 104.8 54.8 -57.2 -42.7 6.5 6.0 -5.4 176 17 C S H X S+ 0 0 49 -4,-1.4 4,-1.0 1,-0.2 -1,-0.2 0.904 110.9 44.4 -58.0 -42.9 6.6 9.8 -5.9 177 18 C S H X S+ 0 0 8 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.723 108.5 59.4 -75.6 -20.7 9.4 9.4 -8.4 178 19 C I H <>S+ 0 0 0 -4,-1.6 5,-2.6 -3,-0.2 4,-0.5 0.906 111.6 38.1 -74.6 -40.4 7.6 6.5 -10.1 179 20 C V H <5S+ 0 0 41 -4,-2.1 -2,-0.2 3,-0.2 -1,-0.2 0.673 109.5 68.0 -82.1 -17.2 4.5 8.5 -10.8 180 21 C E H <5S+ 0 0 124 -4,-1.0 -2,-0.2 -5,-0.3 -1,-0.2 0.983 116.1 21.3 -64.5 -59.6 6.7 11.5 -11.6 181 22 C K T <5S- 0 0 108 -4,-1.7 -1,-0.2 0, 0.0 -2,-0.2 0.485 109.9-121.8 -87.7 -3.3 8.3 10.0 -14.8 182 23 C K T 5 + 0 0 122 -4,-0.5 -3,-0.2 -5,-0.2 -4,-0.1 0.970 49.1 165.5 59.5 58.2 5.3 7.7 -15.1 183 24 C E < + 0 0 71 -5,-2.6 2,-0.3 -6,-0.2 -4,-0.1 0.278 62.0 47.0 -86.2 9.8 7.4 4.5 -15.0 184 25 C I S S- 0 0 25 -6,-0.4 5,-0.1 1,-0.0 -56,-0.1 -0.928 100.5 -75.4-144.4 165.5 4.2 2.5 -14.3 185 26 C S > - 0 0 83 -2,-0.3 4,-2.6 -58,-0.3 5,-0.2 -0.208 43.1-113.7 -61.0 154.7 0.6 2.2 -15.7 186 27 C E H > S+ 0 0 121 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.916 120.0 46.9 -56.3 -47.0 -1.9 5.0 -14.8 187 28 C D H > S+ 0 0 54 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.863 111.5 52.7 -64.3 -35.2 -4.0 2.5 -12.8 188 29 C G H > S+ 0 0 8 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.901 107.2 51.2 -66.3 -40.0 -0.8 1.3 -11.1 189 30 C A H X S+ 0 0 14 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.878 108.1 52.7 -63.1 -39.2 0.1 4.9 -10.2 190 31 C D H X S+ 0 0 73 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.907 110.0 48.4 -62.8 -42.1 -3.4 5.4 -8.7 191 32 C S H X S+ 0 0 2 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.914 111.5 48.6 -65.0 -43.8 -2.8 2.3 -6.6 192 33 C L H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.804 108.6 56.0 -68.0 -27.7 0.6 3.4 -5.4 193 34 C N H X S+ 0 0 54 -4,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.881 110.8 41.3 -73.0 -39.3 -0.9 6.8 -4.6 194 35 C V H X S+ 0 0 7 -4,-1.7 4,-1.3 2,-0.2 -2,-0.2 0.880 115.8 50.9 -75.2 -36.1 -3.5 5.4 -2.2 195 36 C A H X S+ 0 0 5 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.856 101.9 64.1 -67.0 -34.6 -1.0 3.0 -0.8 196 37 C M H X S+ 0 0 6 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.941 106.8 39.8 -54.3 -53.5 1.4 5.8 -0.2 197 38 C D H X S+ 0 0 31 -4,-1.2 4,-2.7 1,-0.2 -1,-0.2 0.784 112.2 59.3 -69.9 -26.0 -0.9 7.6 2.3 198 39 C C H X S+ 0 0 2 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.946 110.5 39.9 -66.5 -47.6 -1.8 4.2 3.8 199 40 C I H X S+ 0 0 0 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.883 115.8 52.7 -68.0 -37.9 1.8 3.5 4.7 200 41 C S H X>S+ 0 0 6 -4,-2.3 5,-2.5 -5,-0.3 4,-0.7 0.916 111.7 45.5 -63.3 -43.5 2.3 7.1 5.7 201 42 C E H <5S+ 0 0 99 -4,-2.7 3,-0.3 3,-0.2 -2,-0.2 0.882 107.8 58.5 -66.7 -39.8 -0.8 6.9 8.0 202 43 C A H <5S+ 0 0 19 -4,-2.3 -92,-0.3 1,-0.2 -1,-0.2 0.862 116.3 33.3 -58.8 -39.1 0.4 3.5 9.4 203 44 C F H <5S- 0 0 49 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.476 109.0-123.8 -97.0 -3.3 3.7 5.0 10.6 204 45 C G T <5 + 0 0 65 -4,-0.7 2,-0.3 -3,-0.3 -3,-0.2 0.874 69.8 121.0 63.7 39.5 2.1 8.4 11.4 205 46 C F < - 0 0 30 -5,-2.5 2,-0.3 -6,-0.2 -1,-0.2 -0.933 61.4-117.3-131.9 154.7 4.5 10.3 9.1 206 47 C E > - 0 0 147 -2,-0.3 3,-2.1 1,-0.1 4,-0.1 -0.717 16.6-130.5 -94.2 145.3 4.0 12.6 6.2 207 48 C R G > S+ 0 0 77 -2,-0.3 3,-0.9 1,-0.3 -1,-0.1 0.682 108.0 68.1 -63.3 -15.7 5.3 11.8 2.7 208 49 C E G 3 S+ 0 0 152 1,-0.2 3,-0.4 2,-0.1 -1,-0.3 0.589 87.7 64.5 -80.2 -11.1 6.7 15.3 2.8 209 50 C A G X> + 0 0 42 -3,-2.1 4,-1.6 1,-0.2 3,-0.5 0.399 67.9 106.6 -93.5 2.4 9.2 14.4 5.6 210 51 C V H <>>S+ 0 0 13 -3,-0.9 4,-2.7 1,-0.2 5,-0.6 0.861 75.7 55.0 -47.6 -44.9 11.1 12.0 3.3 211 52 C S H 345S+ 0 0 30 -3,-0.4 -1,-0.2 1,-0.2 4,-0.2 0.894 107.6 47.7 -59.2 -44.7 14.0 14.4 3.0 212 53 C G H <45S+ 0 0 64 -3,-0.5 -1,-0.2 -4,-0.2 -2,-0.2 0.784 119.9 40.2 -69.2 -26.7 14.5 14.8 6.7 213 54 C I H <5S+ 0 0 35 -4,-1.6 -2,-0.2 -3,-0.2 -3,-0.2 0.956 129.0 21.8 -84.6 -63.4 14.4 11.0 7.2 214 55 C L T ><5S+ 0 0 10 -4,-2.7 3,-0.9 1,-0.1 2,-0.2 0.986 78.3 153.2 -70.8 -61.1 16.3 9.6 4.3 215 56 C G T 3 < - 0 0 6 -5,-0.6 -63,-0.2 1,-0.2 -1,-0.1 -0.483 69.0 -70.8 66.3-130.0 18.5 12.5 3.2 216 57 C K T 3 S+ 0 0 112 -2,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.042 90.6 120.5-151.3 28.7 21.7 11.3 1.5 217 58 C S S < S- 0 0 101 -3,-0.9 3,-0.3 1,-0.1 -2,-0.1 -0.003 95.7 -87.1 -87.5 30.8 23.7 9.7 4.4 218 59 C E - 0 0 132 1,-0.2 2,-2.1 3,-0.0 -2,-0.1 0.984 39.2-135.2 61.1 86.3 23.7 6.4 2.5 219 60 C F - 0 0 51 1,-0.1 2,-1.9 -4,-0.1 -1,-0.2 -0.493 27.3-178.6 -72.6 81.3 20.5 4.6 3.6 220 61 C K + 0 0 153 -2,-2.1 2,-2.2 -3,-0.3 -1,-0.1 -0.522 2.3 178.3 -83.4 71.4 22.0 1.2 4.2 221 62 C G - 0 0 25 -2,-1.9 2,-1.0 -59,-0.1 -59,-0.2 -0.484 9.2-167.6 -77.8 74.0 18.8 -0.5 5.2 222 63 C Q B +F 161 0C 101 -2,-2.2 -61,-0.9 -61,-0.9 2,-0.3 -0.508 22.8 154.7 -66.7 100.3 20.2 -4.0 5.7 223 64 C H + 0 0 5 -2,-1.0 -63,-0.1 -63,-0.2 -1,-0.1 -0.748 13.1 166.4-133.4 85.7 17.1 -6.1 5.9 224 65 C L > - 0 0 61 -2,-0.3 3,-1.3 1,-0.1 -1,-0.1 0.798 30.1-152.2 -67.6 -31.0 17.8 -9.7 4.9 225 66 C A T 3 - 0 0 16 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.0 0.737 63.6 -71.0 60.9 23.2 14.4 -10.8 6.3 226 67 C D T 3 S+ 0 0 82 1,-0.2 2,-0.8 2,-0.0 -1,-0.3 0.826 81.6 170.2 63.6 35.8 16.1 -14.2 6.8 227 68 C I < + 0 0 13 -3,-1.3 -1,-0.2 1,-0.2 3,-0.1 -0.689 18.0 144.6 -83.5 109.0 16.2 -14.9 3.1 228 69 C L + 0 0 139 -2,-0.8 2,-0.5 1,-0.1 -1,-0.2 0.407 54.0 84.6-118.9 -5.6 18.3 -17.9 2.5 229 70 C N + 0 0 122 1,-0.2 -1,-0.1 -3,-0.1 -89,-0.1 -0.232 49.6 124.3 -92.2 44.7 16.2 -19.3 -0.4 230 71 C S 0 0 43 -2,-0.5 -1,-0.2 1,-0.2 -89,-0.2 -0.056 360.0 360.0 -94.2 31.6 18.1 -17.1 -2.9 231 72 C A 0 0 148 -91,-0.1 -1,-0.2 -3,-0.0 -2,-0.1 0.477 360.0 360.0-141.8 360.0 19.0 -20.2 -5.0