==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-OCT-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 21-AUG-13 4MCC . COMPND 2 MOLECULE: TRNA (GUANINE-N(1)-)-METHYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE; . AUTHOR N.B.OLIVIER,P.HILL . 439 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21036.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 282 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 2.7 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 . 2 0.5 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 . 19 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 124 28.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 3 0 0 4 2 0 0 0 2 2 0 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 8 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 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 . 4 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 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 M 0 0 30 0, 0.0 31,-2.0 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 139.8 8.8 47.3 19.7 2 2 A W E -ab 32 107A 34 104,-2.5 106,-2.0 29,-0.2 2,-0.4 -0.957 360.0-173.4-114.5 131.8 11.3 50.0 18.7 3 3 A I E -ab 33 108A 0 29,-2.9 31,-2.3 -2,-0.4 2,-0.3 -0.983 6.9-163.0-129.9 121.9 13.1 49.8 15.3 4 4 A G E -ab 34 109A 0 104,-2.8 106,-3.0 -2,-0.4 2,-0.4 -0.768 12.4-159.9 -97.3 144.1 15.9 52.2 14.3 5 5 A V E -ab 35 110A 0 29,-2.4 31,-2.7 -2,-0.3 2,-0.6 -0.996 14.1-159.7-130.8 135.0 16.8 52.3 10.6 6 6 A I E +ab 36 111A 0 104,-2.9 106,-2.7 -2,-0.4 2,-0.3 -0.960 36.6 143.8-110.2 117.7 20.0 53.5 8.7 7 7 A S - 0 0 0 29,-2.2 32,-0.1 -2,-0.6 106,-0.1 -0.986 56.3-140.4-156.3 145.5 19.2 54.2 5.1 8 8 A L S S+ 0 0 21 -2,-0.3 3,-0.1 1,-0.3 220,-0.1 0.569 110.9 45.2 -76.4 -12.5 20.1 56.6 2.2 9 9 A F > + 0 0 41 1,-0.1 3,-1.7 218,-0.1 4,-0.3 -0.527 65.4 159.9-129.1 65.5 16.3 56.5 1.3 10 10 A P G > + 0 0 24 0, 0.0 3,-1.6 0, 0.0 4,-0.2 0.803 69.6 69.2 -62.5 -25.8 14.5 56.9 4.7 11 11 A E G > S+ 0 0 87 1,-0.3 3,-1.5 2,-0.2 4,-0.3 0.721 83.3 72.6 -62.8 -21.9 11.2 58.0 2.9 12 12 A M G X S+ 0 0 5 -3,-1.7 3,-1.7 1,-0.2 -1,-0.3 0.823 85.5 68.8 -58.7 -31.1 10.9 54.4 1.5 13 13 A F G X> S+ 0 0 3 -3,-1.6 4,-2.5 -4,-0.3 3,-1.3 0.615 75.3 80.1 -69.7 -10.8 10.0 53.4 5.1 14 14 A K H <> S+ 0 0 106 -3,-1.5 4,-2.3 1,-0.3 5,-0.3 0.799 80.9 69.2 -63.2 -26.1 6.6 55.3 4.8 15 15 A A H <4 S+ 0 0 3 -3,-1.7 -1,-0.3 -4,-0.3 4,-0.2 0.819 111.2 32.2 -61.0 -29.3 5.5 52.1 2.9 16 16 A I H <4 S+ 0 0 0 -3,-1.3 3,-0.3 -4,-0.2 -2,-0.2 0.869 122.7 44.5 -89.0 -51.1 5.7 50.4 6.4 17 17 A T H < S+ 0 0 34 -4,-2.5 -3,-0.2 1,-0.2 -2,-0.2 0.692 118.2 39.2 -73.1 -25.4 4.8 53.2 8.8 18 18 A E S < S+ 0 0 109 -4,-2.3 2,-0.3 -5,-0.2 -1,-0.2 0.503 108.7 58.8-104.0 -7.9 1.8 54.7 7.0 19 19 A F S > S- 0 0 29 -5,-0.3 4,-2.0 -3,-0.3 3,-0.3 -0.944 88.9 -25.6-134.4 153.6 -0.0 51.6 5.7 20 20 A G H > S- 0 0 15 -2,-0.3 4,-2.3 2,-0.2 5,-0.1 -0.126 109.1 -17.9 59.0-146.2 -1.7 48.3 6.6 21 21 A V H > S+ 0 0 18 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.896 141.2 45.4 -63.8 -43.0 -1.0 46.2 9.7 22 22 A T H > S+ 0 0 3 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.876 112.6 52.9 -66.4 -38.3 2.4 47.9 10.4 23 23 A G H X S+ 0 0 9 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.898 109.7 48.1 -61.5 -41.4 0.8 51.3 9.8 24 24 A R H X S+ 0 0 126 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.893 110.2 52.3 -65.0 -41.8 -2.0 50.4 12.3 25 25 A A H <>S+ 0 0 2 -4,-2.1 5,-2.7 2,-0.2 6,-1.3 0.882 110.3 48.6 -62.5 -39.9 0.7 49.2 14.8 26 26 A V H ><5S+ 0 0 41 -4,-2.2 3,-1.7 4,-0.2 -2,-0.2 0.942 111.0 49.5 -64.5 -50.6 2.5 52.6 14.4 27 27 A K H 3<5S+ 0 0 75 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.821 112.2 49.1 -58.3 -34.5 -0.8 54.6 14.9 28 28 A H T 3<5S- 0 0 120 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.194 113.8-117.0 -92.2 14.7 -1.5 52.5 18.1 29 29 A N T < 5S+ 0 0 152 -3,-1.7 -3,-0.2 2,-0.2 -2,-0.1 0.720 85.5 116.4 56.2 28.4 2.0 53.1 19.6 30 30 A L S - 0 0 15 -2,-0.4 3,-2.1 -31,-0.2 4,-0.2 -0.937 10.7-145.1-108.4 121.2 20.2 59.0 6.7 38 38 A P G > S+ 0 0 7 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 0.808 99.9 69.1 -51.6 -29.3 24.1 58.8 6.3 39 39 A R G > S+ 0 0 121 1,-0.3 3,-1.2 2,-0.2 -31,-0.1 0.835 92.8 58.2 -58.5 -30.6 23.8 61.8 3.8 40 40 A D G < S+ 0 0 108 -3,-2.1 -1,-0.3 1,-0.2 7,-0.0 0.443 101.7 56.0 -77.6 -2.6 22.8 63.9 6.8 41 41 A F G < S+ 0 0 43 -3,-2.2 -1,-0.2 -4,-0.2 2,-0.2 0.172 82.8 114.6-113.4 11.9 26.2 63.0 8.4 42 42 A T < - 0 0 17 -3,-1.2 7,-0.1 1,-0.1 -3,-0.0 -0.571 49.4-161.7 -85.5 149.8 28.4 64.3 5.5 43 43 A F + 0 0 168 -2,-0.2 2,-0.2 5,-0.2 -1,-0.1 0.555 62.2 84.8-103.8 -17.3 30.8 67.3 5.8 44 44 A D S > S- 0 0 62 4,-0.1 3,-1.7 1,-0.1 -2,-0.1 -0.563 83.3-115.7 -93.8 158.9 31.3 68.1 2.1 45 45 A K T 3 S+ 0 0 202 1,-0.3 -1,-0.1 -2,-0.2 -3,-0.0 0.845 116.7 51.6 -56.5 -38.5 29.3 70.3 -0.3 46 46 A H T 3 S- 0 0 163 2,-0.0 -1,-0.3 1,-0.0 3,-0.2 0.466 103.1-131.7 -81.6 -1.2 28.5 67.2 -2.5 47 47 A K < - 0 0 77 -3,-1.7 2,-0.4 1,-0.2 -2,-0.1 0.936 30.8-156.6 50.1 52.2 27.2 65.2 0.5 48 48 A T + 0 0 50 1,-0.1 -1,-0.2 -9,-0.0 -5,-0.2 -0.515 27.6 169.6 -69.5 121.1 29.4 62.2 -0.6 49 49 A V + 0 0 18 -2,-0.4 14,-2.8 -3,-0.2 2,-0.3 0.403 56.0 68.7-111.5 -3.5 28.1 58.8 0.7 50 50 A D E -E 62 0B 48 12,-0.3 2,-0.3 65,-0.0 12,-0.2 -0.763 56.0-172.5-116.3 163.0 30.3 56.5 -1.3 51 51 A D E -E 61 0B 14 10,-2.5 10,-2.9 -2,-0.3 -2,-0.0 -0.976 29.6 -95.8-151.1 157.8 34.0 55.7 -1.4 52 52 A R - 0 0 187 -2,-0.3 328,-0.4 8,-0.2 2,-0.2 -0.540 38.6-116.5 -78.8 141.0 36.5 53.6 -3.4 53 53 A P > - 0 0 23 0, 0.0 3,-1.3 0, 0.0 326,-0.3 -0.517 23.0-120.7 -77.5 141.8 37.5 50.1 -2.5 54 54 A Y T 3 S+ 0 0 48 324,-3.0 324,-0.4 1,-0.2 340,-0.2 -0.517 103.7 35.2 -71.1 142.9 41.1 49.3 -1.5 55 55 A G T 3 S- 0 0 22 338,-0.7 -1,-0.2 -2,-0.2 339,-0.1 0.399 110.0-123.2 91.0 -4.0 42.4 46.6 -3.9 56 56 A G < + 0 0 34 -3,-1.3 -2,-0.0 1,-0.1 337,-0.0 -0.181 53.4 139.3 66.6-153.8 40.4 48.2 -6.8 57 57 A G - 0 0 51 -4,-0.0 -1,-0.1 0, 0.0 2,-0.1 -0.247 63.4 -55.1 97.0 168.1 37.9 46.3 -8.9 58 58 A P S S+ 0 0 134 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.397 95.5 49.1 -75.6 163.0 34.5 47.7 -10.1 59 59 A G - 0 0 31 -2,-0.1 2,-0.2 2,-0.0 -3,-0.0 0.227 68.0-116.8 90.3 149.8 31.9 49.1 -7.6 60 60 A M - 0 0 59 -8,-0.1 56,-2.7 319,-0.0 2,-0.3 -0.634 20.3-138.0-110.0 169.3 32.0 51.6 -4.8 61 61 A L E -E 51 0B 1 -10,-2.9 -10,-2.5 -2,-0.2 57,-0.2 -0.817 35.9 -85.3-120.9 167.4 31.3 51.0 -1.0 62 62 A M E -E 50 0B 5 55,-2.6 57,-0.4 52,-0.3 -12,-0.3 -0.552 54.5-104.1 -71.8 138.9 29.4 53.1 1.4 63 63 A M > - 0 0 36 -14,-2.8 4,-1.2 -2,-0.2 5,-0.2 -0.462 28.1-137.4 -65.4 134.6 31.7 55.8 2.9 64 64 A V H > S+ 0 0 4 316,-0.6 4,-3.2 2,-0.2 5,-0.3 0.934 91.1 53.2 -62.2 -57.2 32.7 54.8 6.5 65 65 A Q H > S+ 0 0 48 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.897 111.9 41.3 -53.2 -54.6 32.4 58.1 8.4 66 66 A P H > S+ 0 0 1 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.900 120.2 45.7 -61.6 -39.3 28.8 59.2 7.4 67 67 A L H X S+ 0 0 2 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.938 114.0 47.1 -66.5 -49.3 27.6 55.6 7.8 68 68 A R H X S+ 0 0 59 -4,-3.2 4,-2.4 2,-0.2 -3,-0.2 0.917 113.2 49.1 -58.7 -47.1 29.4 55.0 11.2 69 69 A D H X S+ 0 0 46 -4,-2.5 4,-2.1 -5,-0.3 -1,-0.2 0.895 110.5 50.4 -62.4 -41.4 28.1 58.4 12.6 70 70 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.927 110.1 50.4 -62.2 -44.2 24.5 57.6 11.5 71 71 A I H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.930 108.9 52.9 -58.3 -45.8 24.7 54.1 13.3 72 72 A H H X S+ 0 0 71 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.879 107.6 50.3 -59.2 -41.1 26.0 55.8 16.4 73 73 A T H X S+ 0 0 57 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.901 111.5 48.4 -64.1 -41.0 23.0 58.3 16.5 74 74 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.914 110.9 51.6 -63.6 -41.3 20.6 55.3 16.1 75 75 A K H X S+ 0 0 96 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.878 108.8 50.2 -63.2 -37.1 22.4 53.5 18.9 76 76 A A H < S+ 0 0 83 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.886 112.0 47.6 -69.6 -36.7 22.1 56.6 21.2 77 77 A A H < S+ 0 0 49 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.866 113.7 49.4 -68.8 -35.9 18.3 56.8 20.4 78 78 A A H < S- 0 0 7 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.870 89.2-167.8 -70.6 -45.2 17.9 53.0 21.1 79 79 A G >< + 0 0 40 -4,-2.1 3,-0.9 -5,-0.1 -1,-0.1 -0.356 45.7 1.4 82.3-162.9 19.8 52.8 24.5 80 80 A E T 3 S+ 0 0 180 1,-0.2 -4,-0.0 -2,-0.1 0, 0.0 -0.248 122.1 18.2 -63.1 139.9 20.8 49.5 26.2 81 81 A G T 3 S+ 0 0 69 1,-0.3 26,-0.3 25,-0.0 2,-0.3 0.482 74.0 147.9 84.4 9.2 20.1 46.1 24.5 82 82 A A < - 0 0 22 -3,-0.9 2,-0.5 -7,-0.1 -1,-0.3 -0.611 40.6-139.6 -79.3 135.5 19.5 47.0 20.9 83 83 A K E -c 108 0A 64 24,-1.8 26,-2.4 -2,-0.3 2,-0.6 -0.820 12.9-141.3 -92.8 129.8 20.7 44.4 18.4 84 84 A V E -c 109 0A 2 -2,-0.5 44,-2.5 24,-0.2 45,-1.9 -0.848 19.1-168.5 -99.2 117.1 22.3 45.8 15.3 85 85 A I E -cd 110 129A 0 24,-3.5 26,-3.3 -2,-0.6 2,-0.6 -0.903 12.5-154.7-109.5 129.0 21.5 44.0 12.1 86 86 A Y E -cd 111 130A 8 43,-2.8 45,-2.1 -2,-0.5 2,-0.7 -0.897 18.0-137.6 -98.8 120.7 23.2 44.5 8.8 87 87 A L E +cd 112 131A 7 24,-2.4 26,-0.5 -2,-0.6 45,-0.2 -0.722 44.1 161.8 -78.4 112.2 20.9 43.6 5.8 88 88 A S E > - 0 0 4 43,-2.3 3,-2.0 -2,-0.7 -2,-0.0 -0.998 55.6-136.2-138.8 141.5 23.4 41.7 3.6 89 89 A P E 3 S+ 0 0 84 0, 0.0 43,-0.1 0, 0.0 -1,-0.1 0.705 113.2 55.6 -64.7 -15.9 23.3 39.2 0.7 90 90 A Q E 3 S+ 0 0 22 41,-0.1 40,-0.1 283,-0.1 42,-0.1 0.314 94.8 100.3 -95.1 5.1 26.1 37.4 2.7 91 91 A G E < S- 0 0 4 -3,-2.0 40,-0.4 1,-0.2 2,-0.1 -0.212 89.5 -65.8 -85.9 179.6 23.9 37.1 5.8 92 92 A R E - d 0 131A 109 38,-2.7 40,-2.8 1,-0.1 2,-0.4 -0.433 58.7-114.0 -61.8 127.9 21.8 34.3 7.4 93 93 A K E - d 0 132A 65 38,-0.2 40,-0.2 -2,-0.1 5,-0.1 -0.596 35.0-118.2 -73.8 121.4 18.9 33.5 4.9 94 94 A L + 0 0 7 38,-2.7 249,-0.4 -2,-0.4 2,-0.3 -0.353 45.2 155.0 -61.6 137.9 15.6 34.5 6.6 95 95 A D > - 0 0 73 247,-0.1 4,-2.2 -2,-0.1 3,-0.3 -0.868 59.5 -85.8-148.1 173.5 13.0 31.8 7.3 96 96 A Q H > S+ 0 0 49 247,-2.0 4,-2.3 -2,-0.3 5,-0.1 0.830 127.8 53.4 -58.6 -33.1 10.1 31.6 9.9 97 97 A G H > S+ 0 0 42 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.902 110.4 48.3 -64.3 -40.4 12.4 30.2 12.6 98 98 A G H > S+ 0 0 0 -3,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.894 109.6 51.5 -64.8 -43.1 14.7 33.1 12.0 99 99 A V H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.920 107.8 53.2 -59.9 -46.7 11.8 35.6 12.2 100 100 A T H < S+ 0 0 58 -4,-2.3 4,-0.3 2,-0.2 -1,-0.2 0.888 111.4 45.9 -56.5 -42.9 10.7 34.0 15.6 101 101 A E H >< S+ 0 0 105 -4,-1.7 3,-1.6 1,-0.2 4,-0.2 0.945 113.7 47.7 -65.0 -51.2 14.2 34.5 17.0 102 102 A L H >< S+ 0 0 2 -4,-2.6 3,-1.5 1,-0.3 -2,-0.2 0.830 103.7 63.6 -59.8 -33.8 14.5 38.2 15.7 103 103 A A T 3< S+ 0 0 17 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.574 85.3 73.3 -69.2 -10.4 11.0 38.9 17.1 104 104 A Q T < S+ 0 0 139 -3,-1.6 2,-0.4 -4,-0.3 -1,-0.3 0.615 79.2 94.6 -76.9 -13.3 12.3 38.3 20.7 105 105 A N < - 0 0 32 -3,-1.5 3,-0.1 -4,-0.2 -23,-0.1 -0.691 58.2-164.6 -83.9 126.4 14.1 41.6 20.5 106 106 A Q S S+ 0 0 145 -2,-0.4 -104,-2.5 1,-0.2 2,-0.4 0.745 83.2 36.9 -76.1 -24.6 12.3 44.7 22.0 107 107 A K E +b 2 0A 64 -26,-0.3 -24,-1.8 -106,-0.2 2,-0.3 -0.994 67.3 172.4-133.9 127.5 14.9 46.9 20.1 108 108 A L E -bc 3 83A 0 -106,-2.0 -104,-2.8 -2,-0.4 2,-0.4 -0.957 18.6-156.6-129.6 153.3 16.5 46.5 16.7 109 109 A I E -bc 4 84A 0 -26,-2.4 -24,-3.5 -2,-0.3 2,-0.6 -0.998 14.9-158.9-126.6 121.0 18.7 48.7 14.5 110 110 A L E -bc 5 85A 0 -106,-3.0 -104,-2.9 -2,-0.4 2,-0.6 -0.911 1.1-158.2-108.4 117.3 18.6 47.8 10.8 111 111 A V E -bc 6 86A 0 -26,-3.3 -24,-2.4 -2,-0.6 2,-0.5 -0.872 7.0-158.3 -99.8 120.1 21.5 49.0 8.7 112 112 A C E - c 0 87A 3 -106,-2.7 -104,-0.2 -2,-0.6 2,-0.2 -0.879 7.3-154.7-104.3 120.6 20.7 49.2 4.9 113 113 A G - 0 0 7 -26,-0.5 28,-2.2 -2,-0.5 29,-0.3 -0.605 10.4-173.4 -93.9 151.9 23.6 49.1 2.5 114 114 A R > + 0 0 22 -2,-0.2 3,-1.4 26,-0.2 -52,-0.3 -0.694 57.8 23.2-126.4 177.9 23.8 50.5 -1.1 115 115 A Y T 3 S- 0 0 108 24,-0.3 -54,-0.2 1,-0.2 3,-0.1 -0.260 129.9 -30.0 57.4-143.7 26.6 50.2 -3.7 116 116 A E T 3 S- 0 0 104 -56,-2.7 2,-0.3 1,-0.2 -1,-0.2 0.430 105.8 -99.6 -84.3 0.2 28.8 47.0 -3.2 117 117 A G < - 0 0 8 -3,-1.4 -55,-2.6 -57,-0.2 2,-0.3 -0.881 50.4 -41.9 124.3-154.1 28.2 47.1 0.5 118 118 A I - 0 0 4 -2,-0.3 259,-0.5 -57,-0.2 -55,-0.1 -0.817 60.8 -82.1-122.2 157.6 30.1 48.2 3.7 119 119 A D >> - 0 0 0 -57,-0.4 3,-1.0 -2,-0.3 4,-1.0 -0.328 37.2-130.4 -57.5 132.1 33.7 48.1 5.0 120 120 A E H 3> S+ 0 0 41 257,-2.7 4,-1.5 1,-0.2 3,-0.3 0.802 107.2 59.3 -54.7 -35.1 34.4 44.6 6.6 121 121 A R H 3> S+ 0 0 8 1,-0.2 4,-2.7 256,-0.2 -1,-0.2 0.830 98.4 57.9 -68.3 -28.9 35.8 46.4 9.8 122 122 A L H <>>S+ 0 0 1 -3,-1.0 4,-2.4 2,-0.2 5,-0.8 0.820 102.1 55.9 -67.7 -31.8 32.4 48.1 10.3 123 123 A I H X5S+ 0 0 22 -4,-1.0 4,-1.1 -3,-0.3 -2,-0.2 0.942 112.7 41.5 -62.9 -44.9 30.8 44.7 10.5 124 124 A Q H <5S+ 0 0 141 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.900 122.2 39.4 -68.2 -42.7 33.3 43.8 13.3 125 125 A T H <5S+ 0 0 33 -4,-2.7 -2,-0.2 -5,-0.1 -1,-0.2 0.768 133.9 12.9 -81.0 -27.8 33.0 47.1 15.2 126 126 A E H <5S+ 0 0 11 -4,-2.4 2,-0.4 -5,-0.2 -3,-0.2 0.677 100.6 86.6-120.9 -29.8 29.2 47.8 14.8 127 127 A I << - 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0 0 29 -2,-0.5 3,-0.1 -192,-0.0 -195,-0.1 -0.643 40.1-114.3-113.9 170.6 4.3 38.5 5.9 347 139 B T S S- 0 0 23 -2,-0.2 -24,-0.3 1,-0.1 2,-0.3 0.582 88.7 -22.2 -82.3 -12.2 1.1 40.6 6.2 348 140 B G - 0 0 15 -26,-0.1 3,-0.3 -328,-0.0 -26,-0.2 -0.980 69.0 -86.4-178.9 179.6 0.6 40.7 2.5 349 141 B G S > S+ 0 0 7 -28,-1.5 4,-2.4 -2,-0.3 5,-0.1 0.422 94.5 90.5 -87.4 -3.2 2.0 40.5 -1.1 350 142 B E H > S+ 0 0 1 2,-0.2 4,-2.5 -29,-0.2 5,-0.2 0.925 88.7 44.7 -61.6 -50.7 3.1 44.2 -1.4 351 143 B L H > S+ 0 0 5 -3,-0.3 4,-2.6 1,-0.2 5,-0.2 0.962 115.1 50.0 -62.8 -42.8 6.7 43.8 -0.0 352 144 B P H > S+ 0 0 12 0, 0.0 4,-2.4 0, 0.0 -2,-0.2 0.900 111.1 49.1 -56.7 -43.4 7.1 40.6 -2.2 353 145 B A H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.919 113.0 46.8 -62.8 -44.9 5.8 42.5 -5.3 354 146 B M H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.889 111.2 52.0 -63.0 -40.2 8.2 45.4 -4.7 355 147 B T H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.929 110.4 48.8 -61.5 -45.1 11.1 43.0 -4.1 356 148 B L H X S+ 0 0 3 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.909 111.0 50.4 -60.9 -45.2 10.3 41.3 -7.4 357 149 B I H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.946 111.5 47.3 -58.4 -51.8 10.2 44.7 -9.2 358 150 B D H X S+ 0 0 5 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.914 113.3 49.1 -56.3 -47.5 13.6 45.8 -7.8 359 151 B A H >< S+ 0 0 0 -4,-2.4 3,-0.5 1,-0.2 4,-0.2 0.920 116.8 39.7 -59.9 -49.4 15.2 42.4 -8.8 360 152 B V H >< S+ 0 0 1 -4,-2.5 3,-2.0 1,-0.2 4,-0.3 0.817 104.2 67.8 -71.3 -33.0 13.9 42.4 -12.4 361 153 B A H >< S+ 0 0 0 -4,-2.8 3,-1.5 1,-0.3 -1,-0.2 0.783 88.1 68.1 -57.5 -29.4 14.5 46.2 -12.9 362 154 B R T << S+ 0 0 68 -4,-0.9 6,-0.3 -3,-0.5 -1,-0.3 0.727 95.6 56.6 -61.2 -24.0 18.3 45.4 -12.7 363 155 B F T < S+ 0 0 77 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.498 79.7 105.8 -87.0 -8.8 17.9 43.5 -16.1 364 156 B I S X S- 0 0 19 -3,-1.5 3,-1.9 -4,-0.3 4,-0.5 -0.621 82.5-111.7 -74.7 125.7 16.5 46.5 -18.0 365 157 B P T 3 S+ 0 0 118 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.366 102.5 22.8 -60.5 128.8 19.2 48.0 -20.4 366 158 B G T 3 S+ 0 0 64 -2,-0.1 -128,-0.1 -3,-0.0 -3,-0.1 0.228 97.4 96.1 100.9 -10.5 20.3 51.4 -19.1 367 159 B V < 0 0 18 -3,-1.9 -5,-0.1 -6,-0.2 -4,-0.1 0.908 360.0 360.0 -77.0 -46.5 19.2 50.9 -15.5 368 160 B L 0 0 133 -4,-0.5 -5,-0.0 -6,-0.3 -6,-0.0 0.277 360.0 360.0 -95.3 360.0 22.6 49.8 -14.0 369 ! 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 0.0 370 173 B D 0 0 189 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 148.4 29.5 32.8 -9.8 371 174 B G + 0 0 41 1,-0.3 2,-0.3 53,-0.0 0, 0.0 0.455 360.0 110.9 82.0 6.2 27.1 31.2 -7.2 372 175 B L S S- 0 0 34 1,-0.1 -1,-0.3 49,-0.0 38,-0.1 -0.781 74.9-103.6-109.7 155.5 29.5 32.2 -4.4 373 176 B L - 0 0 14 36,-0.5 40,-0.2 -2,-0.3 39,-0.1 -0.404 49.3 -95.1 -73.0 152.7 29.2 34.8 -1.5 374 177 B D - 0 0 56 1,-0.1 -1,-0.1 38,-0.1 3,-0.1 -0.225 36.9-114.6 -65.9 156.5 31.1 38.0 -2.0 375 178 B C - 0 0 10 1,-0.1 -1,-0.1 -3,-0.1 30,-0.1 -0.441 45.7 -80.2 -81.6 168.6 34.6 38.5 -0.4 376 179 B P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.376 49.3-151.6 -68.1 147.1 35.2 41.2 2.4 377 180 B H - 0 0 28 -259,-0.5 -257,-2.7 -3,-0.1 2,-0.3 -0.924 9.2-163.4-120.5 150.9 35.6 44.8 1.0 378 181 B Y + 0 0 25 -324,-0.4 -324,-3.0 -2,-0.3 2,-0.2 -0.986 11.9 167.4-137.3 144.6 37.5 47.7 2.5 379 182 B T - 0 0 0 -2,-0.3 -316,-0.0 -326,-0.3 -317,-0.0 -0.708 43.2 -11.1-137.0-174.9 37.5 51.5 2.0 380 183 B R S S+ 0 0 137 -328,-0.4 -316,-0.6 -2,-0.2 -1,-0.2 -0.281 90.1 64.9 -59.3 150.2 39.0 54.5 3.8 381 184 B P - 0 0 53 0, 0.0 3,-0.2 0, 0.0 -2,-0.2 0.527 61.0-147.8 -86.9 170.2 40.3 54.9 6.5 382 185 B E S S+ 0 0 130 1,-0.2 7,-0.7 -2,-0.1 2,-0.5 0.859 95.7 33.4 -63.8 -34.3 43.6 52.9 6.6 383 186 B V E S-L 388 0F 87 5,-0.2 2,-0.6 3,-0.0 -1,-0.2 -0.962 70.5-178.4-128.3 112.3 43.0 52.4 10.4 384 187 B L E > S-L 387 0F 11 3,-2.5 3,-2.4 -2,-0.5 -259,-0.0 -0.954 80.5 -23.7-115.3 112.6 39.4 52.1 11.7 385 188 B E T 3 S- 0 0 110 -2,-0.6 -1,-0.2 1,-0.3 3,-0.1 0.878 127.4 -53.0 51.6 41.0 39.3 51.7 15.5 386 189 B G T 3 S+ 0 0 61 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.410 112.0 126.3 78.5 -1.5 42.8 50.4 15.3 387 190 B L E < -L 384 0F 48 -3,-2.4 -3,-2.5 -266,-0.0 -1,-0.2 -0.774 46.5-150.7 -95.1 129.6 41.9 47.7 12.7 388 191 B T E -L 383 0F 97 -2,-0.4 -5,-0.2 -5,-0.2 -6,-0.1 -0.563 18.5-105.3-100.0 161.8 44.0 47.7 9.5 389 192 B V - 0 0 8 -7,-0.7 5,-0.1 -2,-0.2 -1,-0.1 -0.668 51.4 -91.7 -79.9 136.8 43.2 46.7 5.8 390 193 B P > - 0 0 27 0, 0.0 3,-1.4 0, 0.0 4,-0.4 -0.270 37.7-128.1 -49.0 126.8 44.7 43.3 4.7 391 194 B P G > S+ 0 0 110 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.797 102.6 69.1 -53.8 -33.2 48.1 44.3 3.2 392 195 B V G > S+ 0 0 33 1,-0.3 3,-1.5 2,-0.2 5,-0.5 0.856 93.5 59.5 -53.7 -34.2 47.5 42.4 -0.1 393 196 B L G < S+ 0 0 6 -3,-1.4 -338,-0.7 1,-0.3 -1,-0.3 0.703 108.2 44.0 -70.6 -18.8 44.8 45.0 -1.0 394 197 B M G < S+ 0 0 84 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.257 92.8 89.1-100.4 0.8 47.4 47.8 -0.8 395 198 B S S < S- 0 0 46 -3,-1.5 -2,-0.1 -4,-0.3 -1,-0.1 0.672 83.5-136.1 -75.2 -24.1 50.0 45.8 -2.8 396 199 B G + 0 0 55 -4,-0.3 2,-0.9 1,-0.2 -3,-0.1 0.578 63.9 130.9 73.7 9.2 49.1 46.8 -6.4 397 200 B H > - 0 0 120 -5,-0.5 4,-2.2 1,-0.2 -1,-0.2 -0.817 40.3-169.0 -95.9 96.1 49.5 43.0 -7.3 398 201 B H H > S+ 0 0 156 -2,-0.9 4,-2.7 1,-0.2 -1,-0.2 0.882 81.2 46.6 -56.5 -46.8 46.3 42.3 -9.2 399 202 B E H > S+ 0 0 110 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.918 112.0 51.0 -65.8 -39.2 46.6 38.5 -9.4 400 203 B E H > S+ 0 0 111 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.924 113.0 46.9 -62.0 -40.7 47.4 38.2 -5.7 401 204 B I H X S+ 0 0 8 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.929 112.4 48.8 -65.3 -47.1 44.4 40.4 -4.9 402 205 B R H X S+ 0 0 86 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.936 114.4 46.0 -59.1 -46.7 42.1 38.4 -7.2 403 206 B K H X S+ 0 0 67 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.876 112.6 50.0 -66.0 -36.7 43.3 35.1 -5.6 404 207 B W H X S+ 0 0 55 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.944 113.8 45.1 -65.6 -47.2 43.0 36.4 -2.1 405 208 B R H X S+ 0 0 49 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.893 113.5 50.3 -62.7 -42.2 39.4 37.6 -2.8 406 209 B L H X S+ 0 0 27 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.936 111.3 48.0 -62.9 -44.1 38.5 34.3 -4.5 407 210 B K H X S+ 0 0 29 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.892 113.2 48.2 -61.0 -43.7 39.9 32.3 -1.5 408 211 B Q H X S+ 0 0 42 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.889 111.1 50.8 -64.3 -42.6 37.9 34.5 0.9 409 212 B S H X S+ 0 0 14 -4,-2.5 4,-2.2 2,-0.2 -36,-0.5 0.921 112.5 46.2 -61.2 -44.7 34.7 34.1 -1.2 410 213 B L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.949 114.7 47.3 -63.4 -48.6 35.1 30.3 -1.2 411 214 B Q H X S+ 0 0 41 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.899 113.5 47.4 -58.4 -48.9 35.8 30.2 2.6 412 215 B R H X S+ 0 0 14 -4,-2.8 4,-2.3 2,-0.2 5,-0.5 0.876 113.0 49.0 -62.7 -39.9 32.8 32.5 3.4 413 216 B T H X S+ 0 0 0 -4,-2.2 4,-2.3 -40,-0.2 7,-0.2 0.959 113.4 47.9 -63.2 -48.5 30.5 30.3 1.1 414 217 B W H < S+ 0 0 67 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.872 118.1 39.1 -58.0 -47.0 31.8 27.1 2.8 415 218 B L H < S+ 0 0 83 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.828 129.7 26.1 -74.7 -39.3 31.3 28.4 6.4 416 219 B R H < S+ 0 0 93 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.800 137.3 15.6 -95.6 -41.4 28.0 30.3 6.0 417 220 B R >< + 0 0 10 -4,-2.3 3,-1.7 -5,-0.5 4,-0.4 -0.444 63.0 162.1-134.3 58.6 26.1 28.7 3.1 418 221 B P T >> S+ 0 0 57 0, 0.0 3,-1.6 0, 0.0 4,-0.6 0.760 71.8 69.5 -54.4 -25.6 27.7 25.3 2.3 419 222 B E H >> S+ 0 0 88 1,-0.3 3,-1.0 2,-0.2 4,-0.8 0.826 88.0 65.9 -58.7 -35.1 24.6 24.1 0.3 420 223 B L H <4 S+ 0 0 49 -3,-1.7 -1,-0.3 1,-0.2 -6,-0.1 0.717 100.5 51.1 -59.4 -23.6 25.6 26.7 -2.4 421 224 B L H X4 S+ 0 0 29 -3,-1.6 3,-0.9 -4,-0.4 -1,-0.2 0.665 93.6 73.9 -85.4 -24.7 28.7 24.5 -3.0 422 225 B E H << S+ 0 0 162 -3,-1.0 2,-0.8 -4,-0.6 -2,-0.2 0.943 104.3 35.6 -55.6 -53.4 26.8 21.2 -3.4 423 226 B G T 3< S+ 0 0 80 -4,-0.8 2,-0.3 2,-0.0 -1,-0.3 -0.511 100.9 106.4-100.5 59.0 25.4 22.0 -6.9 424 227 B L < - 0 0 49 -3,-0.9 2,-0.5 -2,-0.8 -53,-0.0 -0.944 57.9-148.6-145.3 120.4 28.5 23.9 -8.1 425 228 B A - 0 0 97 -2,-0.3 2,-0.3 0, 0.0 -2,-0.0 -0.749 26.8-158.6 -85.4 124.4 31.2 22.9 -10.6 426 229 B L - 0 0 39 -2,-0.5 2,-0.0 -5,-0.1 -2,-0.0 -0.828 14.1-118.1-108.0 149.9 34.5 24.6 -9.5 427 230 B T > - 0 0 67 -2,-0.3 4,-2.9 1,-0.1 5,-0.2 -0.314 35.4-104.5 -73.8 165.5 37.6 25.4 -11.5 428 231 B D H > S+ 0 0 121 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.883 125.3 50.3 -57.6 -41.7 41.0 23.7 -10.6 429 232 B E H > S+ 0 0 41 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.925 111.8 47.0 -62.7 -47.1 42.1 27.1 -9.0 430 233 B Q H > S+ 0 0 30 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.892 113.3 48.8 -62.8 -42.4 38.8 27.3 -7.0 431 234 B R H X S+ 0 0 118 -4,-2.9 4,-2.1 2,-0.2 -2,-0.2 0.928 114.8 45.5 -61.5 -46.2 39.1 23.7 -5.9 432 235 B K H X S+ 0 0 99 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.902 115.3 46.1 -63.9 -46.1 42.8 24.3 -4.9 433 236 B L H X S+ 0 0 8 -4,-3.0 4,-1.8 2,-0.2 -2,-0.2 0.876 111.8 51.9 -66.2 -39.0 41.9 27.7 -3.1 434 237 B L H X S+ 0 0 17 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.909 109.5 49.2 -62.5 -44.4 38.9 26.1 -1.2 435 238 B K H X S+ 0 0 125 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.889 109.9 53.4 -60.9 -39.9 41.1 23.2 0.1 436 239 B E H X S+ 0 0 81 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.870 109.5 46.0 -62.3 -45.4 43.7 25.8 1.3 437 240 B A H X S+ 0 0 0 -4,-1.8 4,-1.0 2,-0.2 -1,-0.2 0.844 113.3 50.8 -67.0 -38.2 41.1 27.8 3.3 438 241 B Q H < S+ 0 0 57 -4,-1.9 4,-0.2 2,-0.2 -2,-0.2 0.878 110.6 48.6 -66.1 -42.7 39.7 24.6 4.8 439 242 B A H >< S+ 0 0 69 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.860 112.1 48.8 -65.6 -40.3 43.2 23.3 5.8 440 243 B E H 3< S+ 0 0 121 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.712 98.8 68.6 -72.4 -24.2 44.0 26.8 7.4 441 244 B H T 3< 0 0 103 -4,-1.0 -1,-0.2 -5,-0.1 -2,-0.2 0.593 360.0 360.0 -70.7 -11.5 40.6 26.6 9.3 442 245 B N < 0 0 171 -3,-1.0 -2,-0.2 -4,-0.2 -3,-0.1 0.721 360.0 360.0-110.3 360.0 42.1 23.7 11.4