==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE/CHAPERONE 21-OCT-11 3UAI . COMPND 2 MOLECULE: H/ACA RIBONUCLEOPROTEIN COMPLEX SUBUNIT 4; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR K.YE . 824 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39325.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 553 67.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 141 17.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 50 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 233 28.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 3 3 3 2 1 3 0 1 3 2 1 1 2 2 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 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 . 3 7 3 1 6 3 0 2 1 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 . 2 1 0 0 0 2 0 0 0 0 1 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 18 A D 0 0 142 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 114.6 -52.7 3.4 50.3 2 19 A T > + 0 0 25 2,-0.1 3,-1.2 3,-0.1 9,-0.9 0.233 360.0 100.3-128.0 6.1 -49.5 2.8 52.2 3 20 A S T 3 S+ 0 0 37 1,-0.2 7,-0.1 7,-0.2 -1,-0.0 0.205 75.6 64.1 -83.8 17.4 -47.0 2.5 49.2 4 21 A E T 3 S+ 0 0 160 5,-0.1 -1,-0.2 2,-0.1 6,-0.1 0.510 77.7 110.2-107.2 -15.5 -45.9 6.2 49.7 5 22 A W S < S- 0 0 127 -3,-1.2 5,-0.1 4,-0.2 -3,-0.1 -0.310 75.5 -97.5 -65.1 144.3 -44.4 5.5 53.2 6 23 A P > - 0 0 51 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.193 65.6 -40.4 -67.1 150.5 -40.6 5.6 53.6 7 24 A L G > S+ 0 0 42 1,-0.3 3,-1.6 2,-0.2 234,-0.1 0.025 127.8 9.6 47.3-123.9 -38.1 2.7 53.6 8 25 A L G 3 S+ 0 0 4 282,-0.3 -1,-0.3 1,-0.3 282,-0.1 0.507 123.9 65.6 -69.7 -6.6 -39.2 -0.5 55.5 9 26 A L G X S+ 0 0 10 -3,-2.1 3,-1.0 280,-0.1 -1,-0.3 0.532 70.7 118.5 -94.1 -9.8 -42.7 0.9 55.9 10 27 A K T < S+ 0 0 90 -3,-1.6 -7,-0.2 1,-0.2 4,-0.0 -0.362 85.0 8.3 -53.3 131.2 -43.5 0.9 52.1 11 28 A N T > S+ 0 0 53 -9,-0.9 3,-1.0 1,-0.1 -1,-0.2 0.844 76.8 159.0 64.6 40.9 -46.5 -1.5 51.4 12 29 A F G X S+ 0 0 36 -3,-1.0 3,-0.9 -10,-0.4 -2,-0.1 0.799 71.3 54.1 -65.8 -33.9 -47.4 -2.1 55.1 13 30 A D G 3 S+ 0 0 84 1,-0.3 -1,-0.3 3,-0.0 4,-0.1 0.601 93.0 73.4 -77.6 -12.3 -51.0 -3.2 54.3 14 31 A K G < S+ 0 0 127 -3,-1.0 2,-0.5 2,-0.1 261,-0.4 0.100 78.9 98.6 -85.8 20.6 -49.5 -5.8 51.8 15 32 A L S < S- 0 0 4 -3,-0.9 2,-0.4 259,-0.1 259,-0.2 -0.948 83.5-118.9-107.0 130.0 -48.5 -7.7 54.9 16 33 A L E -A 273 0A 78 257,-1.8 257,-1.7 -2,-0.5 -2,-0.1 -0.542 34.1-127.4 -71.9 122.9 -50.7 -10.6 56.0 17 34 A V E +A 272 0A 78 -2,-0.4 255,-0.2 255,-0.2 3,-0.1 -0.332 32.2 171.9 -76.0 150.3 -52.1 -9.9 59.5 18 35 A R + 0 0 80 253,-2.1 2,-0.3 1,-0.4 254,-0.1 0.657 63.7 30.6-116.7 -64.3 -51.9 -12.2 62.5 19 36 A S - 0 0 24 252,-0.8 -1,-0.4 251,-0.2 3,-0.0 -0.759 43.2-175.0-106.3 148.8 -53.0 -10.5 65.7 20 37 A G + 0 0 77 -2,-0.3 2,-0.5 -3,-0.1 -1,-0.1 0.666 67.9 79.6-104.4 -28.6 -55.6 -7.7 66.3 21 38 A H + 0 0 109 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.749 58.4 108.0 -91.7 121.1 -55.0 -7.1 70.0 22 39 A Y - 0 0 93 -2,-0.5 230,-0.0 -3,-0.0 0, 0.0 -0.935 49.7-129.3-175.7 165.2 -52.0 -5.1 71.2 23 40 A T - 0 0 118 -2,-0.3 2,-0.6 0, 0.0 231,-0.1 -0.994 27.5-118.7-132.4 130.2 -51.0 -1.7 72.8 24 41 A P - 0 0 94 0, 0.0 228,-0.0 0, 0.0 -2,-0.0 -0.541 21.6-140.0 -79.7 110.0 -48.3 0.7 71.5 25 42 A I - 0 0 34 -2,-0.6 303,-0.0 1,-0.1 228,-0.0 -0.453 14.9-131.4 -65.2 130.4 -45.4 1.3 73.9 26 43 A P S S+ 0 0 117 0, 0.0 -1,-0.1 0, 0.0 300,-0.0 0.652 74.1 104.7 -62.6 -19.2 -44.3 5.0 73.8 27 44 A A + 0 0 13 300,-0.2 299,-0.1 2,-0.0 298,-0.1 -0.153 65.0 23.7 -63.8 156.1 -40.6 4.2 73.4 28 45 A G - 0 0 33 297,-0.2 2,-0.3 2,-0.0 298,-0.0 0.226 67.6-121.7 74.4 163.3 -38.7 4.5 70.1 29 46 A S - 0 0 40 6,-0.0 5,-0.1 2,-0.0 260,-0.1 -0.906 30.2 -93.4-133.6 161.1 -39.2 6.6 67.0 30 47 A S - 0 0 12 -2,-0.3 260,-0.2 3,-0.2 261,-0.0 -0.429 42.6-109.6 -73.3 155.9 -39.7 5.8 63.3 31 48 A P S > S+ 0 0 6 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.905 116.3 38.9 -58.4 -49.3 -36.5 5.8 61.1 32 49 A L T 3 S+ 0 0 85 1,-0.2 7,-0.0 -26,-0.1 -25,-0.0 0.835 117.1 51.6 -66.1 -35.3 -37.3 9.0 59.1 33 50 A K T 3 S+ 0 0 165 2,-0.0 -1,-0.2 6,-0.0 -3,-0.2 0.092 84.2 127.4 -92.4 21.0 -38.8 10.7 62.1 34 51 A R < - 0 0 20 -3,-1.1 2,-0.3 -5,-0.1 -4,-0.0 -0.275 62.7-110.4 -67.0 163.4 -35.7 10.0 64.3 35 52 A D >> - 0 0 106 1,-0.1 4,-2.6 -6,-0.0 3,-0.7 -0.755 32.2 -99.7-103.3 154.2 -34.1 12.9 66.1 36 53 A L H 3> S+ 0 0 16 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.748 114.7 45.6 -42.0 -59.8 -30.6 14.2 65.2 37 54 A K H 3> S+ 0 0 157 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.902 125.0 34.0 -55.0 -45.6 -28.3 12.6 67.7 38 55 A S H <4 S+ 0 0 49 -3,-0.7 4,-0.4 2,-0.2 -1,-0.2 0.665 113.8 59.0 -86.3 -20.4 -29.9 9.1 67.3 39 56 A Y H >< S+ 0 0 10 -4,-2.6 3,-1.1 2,-0.2 -2,-0.2 0.956 110.8 42.7 -66.3 -55.8 -30.6 9.6 63.6 40 57 A I H >< S+ 0 0 23 -4,-2.7 3,-1.7 1,-0.2 -2,-0.2 0.840 109.7 59.8 -49.1 -41.2 -26.9 10.1 63.0 41 58 A S T 3< S+ 0 0 28 -4,-1.1 50,-1.7 -5,-0.3 51,-0.7 0.623 109.9 40.6 -73.8 -12.2 -26.3 7.2 65.4 42 59 A S T < S+ 0 0 17 -3,-1.1 197,-3.0 -4,-0.4 -1,-0.3 -0.095 102.1 138.2-113.5 32.2 -28.3 4.9 63.1 43 60 A G E < -G 238 0B 0 -3,-1.7 46,-2.6 195,-0.2 2,-0.3 -0.347 34.2-179.1 -92.7 160.0 -26.6 6.6 60.2 44 61 A V E -GH 237 88B 0 193,-0.9 193,-3.2 44,-0.2 2,-0.5 -0.948 9.5-159.8-159.2 123.3 -25.1 5.4 56.9 45 62 A I E - H 0 87B 0 42,-2.4 42,-2.4 -2,-0.3 2,-1.2 -0.960 14.3-145.8-113.7 122.1 -23.4 7.5 54.2 46 63 A N E - H 0 86B 0 -2,-0.5 165,-2.1 163,-0.5 2,-0.3 -0.780 36.1-164.3 -80.2 94.6 -23.1 6.2 50.7 47 64 A L E -iH 211 85B 0 38,-3.2 38,-1.9 -2,-1.2 2,-1.2 -0.639 27.6-139.4 -93.2 140.4 -19.7 7.8 50.1 48 65 A D E - H 0 84B 11 163,-2.1 165,-0.4 -2,-0.3 36,-0.2 -0.781 32.9-145.1 -88.2 90.5 -18.0 8.4 46.7 49 66 A K E - H 0 83B 5 34,-2.8 34,-1.3 -2,-1.2 2,-0.2 -0.341 11.9-125.3 -58.3 131.0 -14.5 7.6 48.0 50 67 A P - 0 0 8 0, 0.0 2,-1.9 0, 0.0 342,-0.1 -0.508 29.7-100.8 -72.9 153.0 -11.9 9.7 46.3 51 68 A S S S+ 0 0 23 340,-0.4 31,-0.2 -2,-0.2 29,-0.1 -0.586 99.3 36.1 -75.4 83.5 -9.0 7.8 44.6 52 69 A N S S+ 0 0 99 -2,-1.9 6,-0.1 1,-0.4 29,-0.1 -0.740 78.9 70.9 174.5-113.9 -6.4 8.3 47.3 53 70 A P S S- 0 0 33 0, 0.0 -1,-0.4 0, 0.0 5,-0.1 0.116 90.9 -96.1 -40.8 133.8 -6.3 8.4 51.0 54 71 A S > - 0 0 58 1,-0.1 4,-2.3 3,-0.1 5,-0.2 0.008 32.4-104.2 -49.8 156.7 -7.0 4.8 52.1 55 72 A S H > S+ 0 0 7 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.826 122.4 51.3 -53.5 -33.5 -10.5 3.7 53.1 56 73 A H H > S+ 0 0 125 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.898 108.6 48.3 -74.0 -42.3 -9.5 3.8 56.8 57 74 A E H > S+ 0 0 103 2,-0.2 4,-1.9 -3,-0.2 -2,-0.2 0.858 112.5 50.6 -60.1 -39.9 -8.1 7.3 56.7 58 75 A V H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.903 109.7 48.4 -67.9 -42.1 -11.2 8.6 54.8 59 76 A V H X S+ 0 0 7 -4,-1.8 4,-2.3 -5,-0.2 -2,-0.2 0.917 108.9 55.5 -64.7 -39.9 -13.5 7.0 57.4 60 77 A A H X S+ 0 0 36 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.884 105.6 51.9 -55.2 -43.4 -11.3 8.6 60.1 61 78 A W H X S+ 0 0 35 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.879 108.3 50.5 -61.6 -38.6 -11.9 12.0 58.4 62 79 A I H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 5,-0.3 0.878 111.3 49.8 -66.8 -36.6 -15.7 11.3 58.5 63 80 A K H X S+ 0 0 89 -4,-2.3 4,-3.2 2,-0.2 5,-0.3 0.936 111.1 47.1 -65.8 -49.3 -15.3 10.5 62.2 64 81 A R H < S+ 0 0 154 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.882 116.1 46.3 -59.1 -40.7 -13.4 13.7 62.9 65 82 A I H < S+ 0 0 25 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.923 124.5 29.9 -68.9 -47.6 -15.9 15.8 61.0 66 83 A L H < S- 0 0 11 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.829 95.9-142.3 -82.7 -33.2 -19.1 14.3 62.5 67 84 A R < + 0 0 149 -4,-3.2 2,-0.3 -5,-0.3 -3,-0.1 0.964 40.4 148.5 59.5 95.8 -17.6 13.4 65.9 68 85 A C - 0 0 20 -5,-0.3 -1,-0.2 1,-0.1 -2,-0.1 -0.975 56.1-108.3-156.8 153.2 -19.2 10.0 66.9 69 86 A E S S+ 0 0 160 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.879 93.0 12.0 -59.7 -47.9 -18.1 7.0 68.9 70 87 A K - 0 0 83 -3,-0.1 20,-2.4 -7,-0.0 2,-0.3 -0.971 53.3-178.7-135.2 145.8 -17.6 4.4 66.1 71 88 A T E +J 89 0B 27 -2,-0.3 2,-0.2 18,-0.2 18,-0.2 -0.987 11.3 166.2-138.3 138.5 -17.3 4.3 62.3 72 89 A G E -J 88 0B 12 16,-1.5 16,-2.1 -2,-0.3 2,-0.3 -0.787 17.4-139.8-133.5-177.4 -16.8 1.2 60.1 73 90 A H E -J 87 0B 8 -2,-0.2 14,-0.2 14,-0.2 3,-0.1 -0.989 21.7-112.3-163.1 154.1 -17.1 0.4 56.3 74 91 A S S S- 0 0 0 12,-1.5 2,-0.2 -2,-0.3 28,-0.2 0.518 83.1 -27.9 -57.8 -20.0 -18.2 -1.9 53.5 75 92 A G - 0 0 9 11,-0.1 -1,-0.1 1,-0.1 11,-0.0 -0.782 31.3-168.9 160.9 149.5 -14.8 -2.9 52.0 76 93 A T + 0 0 60 -2,-0.2 -21,-0.2 -3,-0.1 5,-0.1 0.342 38.7 134.0-135.1 -1.1 -11.2 -2.2 51.2 77 94 A L S S+ 0 0 46 2,-0.1 -1,-0.1 97,-0.1 98,-0.1 0.740 79.5 31.2 -41.5 -47.3 -9.9 -4.7 48.8 78 95 A D S S- 0 0 2 1,-0.1 3,-0.5 -3,-0.0 -3,-0.0 -0.896 71.7-151.5-112.7 138.0 -8.1 -2.2 46.5 79 96 A P S S+ 0 0 75 0, 0.0 -27,-0.3 0, 0.0 -1,-0.1 0.700 90.7 50.5 -88.0 -16.2 -6.7 1.0 48.0 80 97 A K S S+ 0 0 147 -29,-0.1 116,-0.3 -26,-0.1 -26,-0.0 0.270 80.2 125.5-103.4 9.6 -7.0 3.3 45.0 81 98 A V - 0 0 13 -3,-0.5 -29,-0.4 -5,-0.1 2,-0.3 -0.338 44.6-156.6 -60.8 146.4 -10.7 2.6 44.2 82 99 A T E + k 0 197B 1 114,-1.2 116,-2.9 -31,-0.2 2,-0.2 -0.715 50.1 52.6-107.5 169.2 -13.1 5.4 43.9 83 100 A G E S+Hk 49 198B 1 -34,-1.3 -34,-2.8 -2,-0.3 116,-0.2 -0.635 83.5 24.2 112.2-164.0 -16.8 4.9 44.4 84 101 A C E +H 48 0B 1 114,-1.9 2,-0.4 -2,-0.2 -36,-0.2 -0.177 50.4 163.1 -51.1 114.1 -19.3 3.3 46.9 85 102 A L E -H 47 0B 1 -38,-1.9 -38,-3.2 -40,-0.1 2,-1.0 -0.981 27.2-150.1-124.1 119.8 -18.0 3.2 50.4 86 103 A I E -H 46 0B 0 -2,-0.4 -12,-1.5 -40,-0.2 2,-0.6 -0.826 12.5-163.8 -90.9 105.6 -20.7 2.7 52.8 87 104 A V E -HJ 45 73B 0 -42,-2.4 -42,-2.4 -2,-1.0 2,-0.4 -0.827 6.0-155.2 -91.8 120.4 -19.6 4.4 56.0 88 105 A C E -HJ 44 72B 0 -16,-2.1 -16,-1.5 -2,-0.6 2,-0.4 -0.802 3.1-147.9 -96.5 138.5 -21.7 3.2 59.0 89 106 A I E > - J 0 71B 0 -46,-2.6 3,-2.3 -2,-0.4 -18,-0.2 -0.893 49.3 -52.1-108.5 135.8 -22.0 5.4 62.1 90 107 A D G > S+ 0 0 34 -20,-2.4 3,-2.2 -2,-0.4 4,-0.4 -0.091 131.2 19.1 46.3-114.7 -22.4 4.1 65.7 91 108 A R G > S+ 0 0 69 -50,-1.7 3,-1.6 1,-0.3 -1,-0.3 0.810 119.5 67.2 -57.8 -26.6 -25.3 1.6 66.0 92 109 A A G X S+ 0 0 0 -3,-2.3 3,-2.7 -51,-0.7 -1,-0.3 0.738 78.3 78.8 -66.7 -21.5 -25.1 1.0 62.2 93 110 A T G X> S+ 0 0 18 -3,-2.2 3,-2.2 1,-0.3 4,-0.5 0.819 77.2 76.5 -55.1 -28.5 -21.6 -0.5 62.7 94 111 A R G <4 S+ 0 0 29 -3,-1.6 -1,-0.3 -4,-0.4 4,-0.3 0.785 95.8 48.0 -50.4 -29.2 -23.7 -3.6 63.7 95 112 A L G <> S+ 0 0 1 -3,-2.7 4,-2.3 -4,-0.2 -1,-0.3 0.405 82.5 91.4 -98.1 3.1 -24.3 -4.0 60.0 96 113 A V H <> S+ 0 0 22 -3,-2.2 4,-2.1 -4,-0.2 5,-0.2 0.911 79.3 61.9 -65.9 -39.8 -20.8 -3.7 58.5 97 114 A K H X S+ 0 0 107 -4,-0.5 4,-1.4 1,-0.2 3,-0.4 0.938 111.2 40.1 -47.2 -52.2 -20.0 -7.4 58.7 98 115 A S H >4 S+ 0 0 43 -4,-0.3 3,-0.6 1,-0.2 4,-0.5 0.936 112.3 55.3 -65.1 -47.6 -22.9 -8.0 56.3 99 116 A Q H 3< S+ 0 0 9 -4,-2.3 -1,-0.2 1,-0.2 3,-0.2 0.774 108.3 50.7 -53.7 -26.1 -22.0 -5.0 54.2 100 117 A Q H 3< S+ 0 0 93 -4,-2.1 -1,-0.2 -3,-0.4 -2,-0.2 0.790 111.2 45.1 -85.1 -30.8 -18.5 -6.5 53.8 101 118 A G S << S+ 0 0 62 -4,-1.4 71,-0.4 -3,-0.6 -1,-0.2 0.275 94.9 114.2 -89.6 7.0 -19.7 -9.9 52.7 102 119 A A S S- 0 0 18 -4,-0.5 100,-0.1 -3,-0.2 -3,-0.0 -0.518 79.0 -94.0 -82.6 146.3 -22.2 -8.2 50.4 103 120 A G - 0 0 37 -2,-0.2 99,-3.0 98,-0.1 2,-0.4 -0.247 42.5-159.3 -59.4 142.1 -21.9 -8.4 46.6 104 121 A K E -LM 170 201B 6 66,-2.0 66,-2.4 97,-0.2 2,-0.4 -0.957 7.4-152.6-129.3 145.2 -20.0 -5.6 44.9 105 122 A E E -LM 169 200B 43 95,-2.2 94,-1.6 -2,-0.4 95,-1.4 -0.917 16.7-170.1-116.5 145.9 -19.9 -4.4 41.3 106 123 A Y E -LM 168 198B 2 62,-2.8 62,-1.7 -2,-0.4 2,-0.5 -0.898 25.3-146.9-132.5 157.9 -17.0 -2.6 39.6 107 124 A V E -LM 167 197B 4 90,-3.0 90,-2.0 -2,-0.3 2,-0.4 -0.986 35.2-171.0-122.8 120.3 -16.0 -0.7 36.5 108 125 A C E -LM 166 196B 0 58,-3.1 58,-2.5 -2,-0.5 2,-0.6 -0.881 24.2-151.9-122.4 137.4 -12.4 -1.6 35.7 109 126 A I E -LM 165 195B 0 86,-2.7 85,-2.8 -2,-0.4 86,-1.4 -0.947 20.6-160.9-107.1 117.9 -9.8 -0.4 33.3 110 127 A V E -LM 164 193B 0 54,-2.6 54,-2.0 -2,-0.6 2,-0.6 -0.744 7.4-148.4 -96.7 142.5 -7.3 -3.1 32.4 111 128 A R E -LM 163 192B 72 81,-3.2 81,-1.9 -2,-0.3 2,-0.3 -0.955 9.5-158.9-111.2 111.4 -3.9 -2.3 30.9 112 129 A L E - M 0 191B 1 50,-2.3 79,-0.3 -2,-0.6 78,-0.1 -0.702 16.3-137.1 -85.5 144.2 -2.6 -5.0 28.5 113 130 A H S S+ 0 0 80 77,-2.7 2,-0.3 -2,-0.3 78,-0.1 0.502 82.1 16.4 -84.5 -4.9 1.2 -4.9 28.1 114 131 A D S S- 0 0 90 76,-0.4 2,-0.2 48,-0.1 75,-0.1 -0.977 93.2 -82.2-158.6 160.5 1.1 -5.3 24.3 115 132 A A - 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0 0 100 -3,-0.1 2,-0.8 1,-0.1 31,-0.2 -0.353 26.4-115.7 -68.3 151.4 0.1 -3.0 82.3 506 168 D T - 0 0 47 29,-2.3 31,-0.2 28,-0.1 -1,-0.1 -0.867 34.8-134.4 -93.8 109.5 -1.8 -4.8 85.0 507 169 D K + 0 0 93 -2,-0.8 2,-0.2 5,-0.2 8,-0.2 -0.092 31.1 171.1 -61.1 158.7 -2.1 -8.4 83.9 508 170 D Y B +B 514 0G 0 6,-2.3 6,-2.0 2,-0.1 5,-0.2 -0.856 29.6 56.4-155.3-176.2 -5.4 -10.3 84.1 509 171 D G S > S+ 0 0 6 167,-0.3 3,-2.0 -2,-0.2 247,-0.2 -0.396 98.0 14.9 77.6-158.1 -7.1 -13.5 83.1 510 172 D F G > S- 0 0 2 245,-2.6 3,-2.2 1,-0.3 4,-0.2 -0.270 141.8 -19.6 -55.1 125.3 -5.9 -17.0 84.0 511 173 D D G 3 S- 0 0 45 1,-0.3 -1,-0.3 121,-0.1 -2,-0.1 0.693 113.5 -78.7 45.8 23.9 -3.2 -16.7 86.7 512 174 D N G < S+ 0 0 78 -3,-2.0 -1,-0.3 243,-0.1 -3,-0.2 0.858 98.3 132.0 56.7 41.2 -2.8 -13.1 85.7 513 175 D L < + 0 0 92 -3,-2.2 2,-0.2 -5,-0.2 -4,-0.1 0.662 46.7 76.8 -93.9 -18.7 -0.7 -14.1 82.7 514 176 D Y B +B 508 0G 45 -6,-2.0 -6,-2.3 -4,-0.2 2,-0.3 -0.606 45.5 158.5-104.5 151.6 -2.4 -12.0 80.0 515 177 D D + 0 0 39 -2,-0.2 2,-2.7 -8,-0.2 -8,-0.1 -0.961 56.0 24.9-152.5 174.6 -2.4 -8.4 78.8 516 178 D T S > S+ 0 0 64 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 -0.129 91.8 94.8 71.1 -43.3 -3.2 -6.1 75.9 517 179 D V H > S+ 0 0 37 -2,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.851 87.1 42.2 -46.8 -50.9 -5.5 -8.6 74.3 518 180 D I H > S+ 0 0 0 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.930 110.1 55.3 -65.6 -51.0 -8.7 -7.1 75.8 519 181 D S H >> S+ 0 0 47 1,-0.3 3,-0.7 2,-0.2 4,-0.7 0.911 110.3 47.1 -48.7 -49.1 -7.8 -3.5 75.2 520 182 D V H >X S+ 0 0 83 -4,-2.4 3,-0.9 1,-0.2 4,-0.6 0.881 105.1 61.2 -60.2 -39.0 -7.3 -4.2 71.5 521 183 D S H 3<>S+ 0 0 7 -4,-1.5 5,-2.2 -5,-0.2 3,-0.4 0.726 90.9 66.8 -65.8 -24.7 -10.6 -6.1 71.4 522 184 D T H X<5S+ 0 0 59 -4,-1.3 3,-1.2 -3,-0.7 -1,-0.2 0.877 98.9 51.5 -66.9 -34.6 -12.7 -3.0 72.4 523 185 D S H <<5S+ 0 0 94 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.738 108.8 55.8 -65.6 -22.4 -11.7 -1.4 69.0 524 186 D N T 3<5S- 0 0 108 -4,-0.6 -1,-0.2 -3,-0.4 -2,-0.2 0.079 132.1 -85.1-101.8 21.9 -13.0 -4.6 67.4 525 187 D G T < 5 + 0 0 25 -3,-1.2 2,-1.1 1,-0.2 -3,-0.2 0.649 69.2 156.7 89.5 16.4 -16.5 -4.6 68.9 526 188 D N < + 0 0 9 -5,-2.2 -1,-0.2 1,-0.2 -2,-0.0 -0.680 2.3 161.6 -74.6 102.3 -15.9 -6.3 72.3 527 189 D D + 0 0 64 -2,-1.1 -1,-0.2 1,-0.1 -5,-0.1 0.077 61.3 76.5-109.8 15.9 -18.9 -4.9 74.3 528 190 D I S S+ 0 0 0 145,-0.0 -1,-0.1 139,-0.0 -2,-0.1 0.847 75.9 87.1 -85.9 -45.4 -18.7 -7.6 77.0 529 191 D N + 0 0 20 1,-0.1 146,-0.2 -11,-0.1 145,-0.1 -0.245 51.4 177.6 -53.8 138.9 -15.7 -5.8 78.6 530 192 D E + 0 0 33 144,-2.2 2,-0.4 4,-0.0 -1,-0.1 0.288 39.0 116.2-129.5 2.4 -16.9 -3.3 81.0 531 193 D L - 0 0 6 143,-0.3 4,-0.1 1,-0.2 11,-0.0 -0.637 56.3-149.7 -77.8 131.0 -13.6 -2.0 82.4 532 194 D D S S+ 0 0 122 -2,-0.4 -1,-0.2 1,-0.3 -3,-0.0 0.798 96.9 17.7 -65.4 -30.7 -13.0 1.6 81.6 533 195 D D S > S+ 0 0 76 1,-0.1 3,-1.7 -3,-0.0 -1,-0.3 -0.558 70.5 176.3-145.2 73.8 -9.2 0.9 81.6 534 196 D P T 3 S+ 0 0 11 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.714 80.1 48.1 -53.5 -27.8 -8.6 -2.9 81.2 535 197 D E T 3 S+ 0 0 8 1,-0.2 -29,-2.3 -30,-0.1 -2,-0.0 0.543 115.8 38.8 -95.8 -8.7 -4.8 -2.5 81.0 536 198 D H S < S+ 0 0 91 -3,-1.7 2,-0.4 -31,-0.2 -1,-0.2 -0.262 88.0 100.9-139.4 48.1 -4.1 -0.2 83.9 537 199 D T - 0 0 12 -3,-0.4 5,-0.0 -31,-0.2 -6,-0.0 -0.945 58.1-140.8-141.9 114.7 -6.5 -1.3 86.7 538 200 D D > - 0 0 72 -2,-0.4 4,-1.8 1,-0.1 -2,-0.1 -0.021 32.9 -96.9 -70.5 175.9 -5.4 -3.5 89.7 539 201 D A H > S+ 0 0 33 2,-0.2 4,-1.2 1,-0.2 141,-0.2 0.904 121.3 46.3 -62.7 -45.4 -7.5 -6.3 91.2 540 202 D N H >> S+ 0 0 33 1,-0.2 4,-2.0 2,-0.2 3,-0.5 0.928 110.7 51.7 -65.4 -47.2 -9.0 -4.2 94.1 541 203 D D H 3> S+ 0 0 80 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.848 102.9 61.5 -58.7 -34.4 -9.9 -1.3 91.8 542 204 D R H 3X S+ 0 0 7 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.884 105.4 47.3 -57.8 -42.4 -11.7 -3.7 89.5 543 205 D V H - 0 0 64 148,-0.4 4,-2.6 1,-0.1 5,-0.1 -0.929 11.2-171.1-119.7 108.5 -33.0 -0.9 86.9 556 218 D P H > S+ 0 0 14 0, 0.0 4,-3.1 0, 0.0 5,-0.3 0.882 88.6 55.2 -67.2 -37.4 -35.6 -1.2 89.6 557 219 D E H > S+ 0 0 60 1,-0.2 4,-2.0 2,-0.2 -227,-0.4 0.894 112.4 44.8 -62.0 -38.4 -38.5 -0.3 87.3 558 220 D Y H > S+ 0 0 16 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.896 113.4 51.8 -66.4 -43.2 -37.4 -3.1 85.1 559 221 D Y H X S+ 0 0 2 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.903 112.0 44.1 -60.3 -44.9 -37.0 -5.3 88.2 560 222 D V H X S+ 0 0 3 -4,-3.1 4,-3.2 2,-0.2 5,-0.3 0.910 110.0 55.8 -70.2 -40.4 -40.5 -4.6 89.5 561 223 D S H X S+ 0 0 8 -4,-2.0 4,-2.3 -5,-0.3 -1,-0.2 0.922 109.3 47.3 -54.3 -47.0 -42.1 -5.0 86.1 562 224 D E H X S+ 0 0 6 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.858 114.8 46.2 -64.3 -38.2 -40.6 -8.5 85.8 563 225 D Y H X S+ 0 0 18 -4,-1.7 4,-2.2 2,-0.2 5,-0.2 0.962 112.6 48.1 -68.2 -54.5 -41.7 -9.4 89.3 564 226 D M H X>S+ 0 0 0 -4,-3.2 4,-3.8 1,-0.2 5,-0.9 0.875 110.1 53.1 -55.7 -42.1 -45.3 -8.1 89.0 565 227 D T H X5S+ 0 0 13 -4,-2.3 4,-1.2 -5,-0.3 -1,-0.2 0.928 109.8 48.6 -58.6 -44.7 -45.7 -9.9 85.7 566 228 D H H <5S+ 0 0 30 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.885 124.8 29.4 -64.5 -37.3 -44.6 -13.2 87.2 567 229 D K H <5S+ 0 0 123 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.808 138.1 14.3 -92.1 -34.4 -47.0 -12.8 90.2 568 230 D Y H <5S+ 0 0 86 -4,-3.8 -3,-0.2 -5,-0.2 -2,-0.1 0.506 90.6 108.7-129.7 -10.0 -49.9 -10.7 88.8 569 231 D G << - 0 0 16 -4,-1.2 -4,-0.0 -5,-0.9 2,-0.0 -0.331 65.3-111.6 -71.5 157.8 -49.9 -10.6 85.0 570 232 D N > - 0 0 86 1,-0.1 4,-1.9 -2,-0.0 5,-0.2 -0.119 35.3 -86.5 -83.8-178.9 -52.5 -12.6 83.0 571 233 D E H > S+ 0 0 184 1,-0.2 4,-0.6 2,-0.2 -2,-0.1 0.848 126.8 46.3 -55.4 -39.2 -52.2 -15.6 80.7 572 234 D E H >> S+ 0 0 77 2,-0.2 4,-1.3 1,-0.2 3,-1.2 0.975 112.7 44.4 -70.0 -58.8 -51.3 -13.4 77.7 573 235 D D H 3> S+ 0 0 70 1,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.756 112.1 56.3 -58.2 -29.0 -48.7 -11.1 79.3 574 236 D L H 3X S+ 0 0 26 -4,-1.9 4,-1.9 2,-0.2 6,-0.4 0.704 104.4 50.7 -75.2 -26.9 -47.0 -14.1 80.9 575 237 D E H << S+ 0 0 123 -3,-1.2 -2,-0.2 -4,-0.6 -1,-0.2 0.743 109.1 50.8 -88.4 -26.6 -46.5 -15.9 77.7 576 238 D I H < S+ 0 0 30 -4,-1.3 -2,-0.2 1,-0.1 -1,-0.2 0.891 114.2 45.9 -68.8 -42.8 -44.9 -13.0 76.0 577 239 D N H < S- 0 0 12 -4,-1.4 -2,-0.2 -5,-0.2 -3,-0.1 0.919 91.5-152.0 -68.6 -49.6 -42.5 -12.6 79.0 578 240 D G >X + 0 0 14 -4,-1.9 4,-2.2 -5,-0.1 3,-0.9 0.053 52.4 125.1 103.4 -23.1 -41.6 -16.3 79.2 579 241 D I H 3> S+ 0 0 0 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.747 70.6 52.9 -46.6 -40.5 -40.8 -16.6 83.0 580 242 D K H 3> S+ 0 0 103 -6,-0.4 4,-0.7 2,-0.2 -1,-0.3 0.920 113.7 43.2 -65.2 -43.2 -43.2 -19.4 83.9 581 243 D E H X> S+ 0 0 101 -3,-0.9 3,-1.2 1,-0.2 4,-1.0 0.924 110.5 56.4 -65.4 -44.8 -41.8 -21.7 81.1 582 244 D L H >< S+ 0 0 4 -4,-2.2 3,-0.9 1,-0.3 -2,-0.2 0.909 105.2 52.1 -52.5 -44.1 -38.2 -20.7 82.0 583 245 D L H 3< S+ 0 0 40 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.691 107.6 52.2 -71.4 -17.7 -38.8 -21.8 85.6 584 246 D K H << S+ 0 0 146 -3,-1.2 -1,-0.2 -4,-0.7 -2,-0.2 0.650 91.1 106.6 -85.9 -15.4 -40.1 -25.3 84.4 585 247 D F << - 0 0 46 -4,-1.0 67,-0.1 -3,-0.9 71,-0.0 -0.295 50.0-163.5 -77.4 145.9 -37.0 -25.9 82.1 586 248 D T - 0 0 35 65,-0.1 5,-0.0 -2,-0.1 -3,-0.0 -0.956 21.9-127.0-129.6 112.8 -34.1 -28.3 82.8 587 249 D P > - 0 0 0 0, 0.0 4,-2.7 0, 0.0 3,-0.4 -0.223 26.3-112.2 -55.1 142.5 -30.9 -28.0 80.8 588 250 D S H > S+ 0 0 79 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.785 116.8 49.7 -44.6 -40.4 -29.6 -31.1 79.0 589 251 D I H > S+ 0 0 8 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.922 111.9 45.8 -72.4 -42.7 -26.6 -31.4 81.3 590 252 D V H >> S+ 0 0 0 -3,-0.4 4,-2.9 1,-0.2 3,-0.6 0.917 109.0 59.0 -60.9 -42.3 -28.7 -31.1 84.6 591 253 D K H 3X S+ 0 0 123 -4,-2.7 4,-2.0 1,-0.3 -1,-0.2 0.829 103.4 49.2 -62.8 -35.5 -31.1 -33.5 83.1 592 254 D Q H 3X S+ 0 0 62 -4,-1.3 4,-1.1 -5,-0.2 -1,-0.3 0.737 111.4 50.5 -80.8 -19.9 -28.6 -36.3 82.7 593 255 D Y H + 0 0 76 1,-0.1 3,-1.3 -5,-0.0 -1,-0.2 -0.809 67.2 179.5-121.1 89.0 -26.0 -44.3 96.1 603 265 D P T 3 S+ 0 0 50 0, 0.0 -1,-0.1 0, 0.0 -6,-0.1 0.451 72.4 71.5 -66.4 1.8 -26.8 -40.7 95.2 604 266 D N T 3 S+ 0 0 100 2,-0.1 -7,-0.0 -7,-0.0 -3,-0.0 0.608 77.1 89.5 -99.3 -15.1 -23.5 -39.6 96.9 605 267 D L S < S- 0 0 104 -3,-1.3 2,-0.2 1,-0.1 -3,-0.0 -0.134 87.1 -90.0 -71.3 171.6 -20.9 -41.0 94.4 606 268 D V - 0 0 69 1,-0.0 122,-0.2 122,-0.0 121,-0.1 -0.530 45.6-109.3 -78.1 156.3 -19.4 -39.2 91.4 607 269 D M - 0 0 19 120,-2.1 2,-0.3 -2,-0.2 124,-0.1 -0.798 27.5-124.5 -96.1 121.2 -21.3 -39.6 88.2 608 270 D P - 0 0 101 0, 0.0 2,-0.4 0, 0.0 120,-0.0 -0.449 31.6-171.9 -69.8 125.3 -19.6 -41.7 85.5 609 271 D I - 0 0 9 -2,-0.3 2,-0.6 2,-0.0 121,-0.0 -0.974 19.3-163.8-122.2 128.1 -19.2 -39.8 82.2 610 272 D E - 0 0 163 -2,-0.4 2,-0.1 120,-0.0 0, 0.0 -0.959 30.3-130.1-102.5 112.8 -18.0 -41.0 78.8 611 273 D F - 0 0 24 -2,-0.6 5,-0.1 1,-0.1 119,-0.0 -0.387 26.4-112.9 -62.2 135.7 -17.1 -37.9 76.7 612 274 D T > - 0 0 67 1,-0.1 4,-2.1 -2,-0.1 5,-0.2 -0.128 25.5-104.9 -66.3 164.7 -18.7 -38.0 73.2 613 275 D D H > S+ 0 0 147 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.886 124.8 50.0 -56.6 -41.7 -16.7 -38.3 70.0 614 276 D E H > S+ 0 0 152 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.857 110.0 51.3 -64.9 -37.0 -17.2 -34.6 69.3 615 277 D E H > S+ 0 0 21 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.812 106.6 52.9 -70.2 -33.4 -16.0 -33.8 72.9 616 278 D Q H X S+ 0 0 92 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.894 109.1 51.3 -65.3 -39.9 -12.8 -35.9 72.4 617 279 D K H X S+ 0 0 127 -4,-1.7 4,-2.7 1,-0.2 5,-0.3 0.901 106.8 52.9 -64.5 -44.6 -12.1 -33.9 69.3 618 280 D Q H X S+ 0 0 27 -4,-1.9 4,-2.1 1,-0.2 5,-0.4 0.886 107.8 50.9 -55.5 -43.9 -12.5 -30.5 71.1 619 281 D M H < S+ 0 0 38 -4,-1.5 4,-0.2 1,-0.2 -1,-0.2 0.781 114.9 42.6 -72.3 -28.8 -10.1 -31.5 73.8 620 282 D Q H < S+ 0 0 129 -4,-1.3 -2,-0.2 -3,-0.2 -1,-0.2 0.945 127.0 28.2 -75.2 -52.8 -7.4 -32.5 71.3 621 283 D D H < S+ 0 0 94 -4,-2.7 -3,-0.2 1,-0.1 -2,-0.2 0.925 121.4 39.9 -78.2 -51.7 -7.8 -29.6 68.9 622 284 D N S < S+ 0 0 54 -4,-2.1 -3,-0.2 -5,-0.3 -1,-0.1 0.468 99.4 71.1 -94.1 -3.5 -9.1 -26.5 70.7 623 285 D L S S- 0 0 11 -5,-0.4 2,-0.1 -4,-0.2 136,-0.1 -0.882 83.2-100.1-119.8 146.3 -7.2 -26.5 74.1 624 286 D P - 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0 0 35 -344,-0.0 3,-1.5 -395,-0.0 4,-0.4 -0.835 39.4 -87.0-137.8 176.2 -28.2 -17.9 70.2 660 322 D T T 3 S+ 0 0 53 -344,-0.6 4,-0.1 -398,-0.3 -398,-0.1 0.548 128.1 45.6 -68.6 -5.7 -26.0 -15.2 68.7 661 323 D E T 3> S+ 0 0 2 -400,-0.1 4,-2.9 -399,-0.1 -1,-0.3 0.392 80.1 104.2-113.8 1.5 -26.0 -13.4 72.1 662 324 D S H <> S+ 0 0 0 -3,-1.5 4,-2.7 1,-0.2 5,-0.2 0.899 82.7 48.2 -43.9 -53.7 -25.3 -16.5 74.3 663 325 D A H > S+ 0 0 3 -4,-0.4 4,-2.9 79,-0.2 -1,-0.2 0.896 111.5 51.5 -56.7 -40.1 -21.6 -15.5 74.8 664 326 D W H > S+ 0 0 17 -3,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.943 110.8 47.2 -61.7 -50.0 -22.7 -11.9 75.7 665 327 D T H X S+ 0 0 4 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.926 116.3 44.4 -56.3 -48.5 -25.3 -13.3 78.3 666 328 D M H X S+ 0 0 2 -4,-2.7 4,-0.7 -5,-0.2 -2,-0.2 0.909 114.0 49.8 -63.8 -41.6 -22.6 -15.6 79.8 667 329 D G H < S+ 0 0 0 -4,-2.9 7,-1.2 -5,-0.2 3,-0.3 0.855 110.6 50.5 -69.5 -36.5 -19.9 -12.9 79.7 668 330 D K H < S+ 0 0 12 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.925 109.3 48.6 -63.2 -46.4 -22.2 -10.4 81.5 669 331 D L H < S+ 0 0 2 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.624 100.6 79.5 -74.3 -7.2 -23.2 -12.7 84.3 670 332 D C >X - 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