==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 21-MAR-03 1OT2 . COMPND 2 MOLECULE: CYCLOMALTODEXTRIN GLUCANOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CIRCULANS; . AUTHOR H.J.ROZEBOOM,B.W.DIJKSTRA . 686 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22893.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 442 64.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 122 17.8 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 1.0 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 . 57 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.3 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 1 1 1 0 0 3 0 1 1 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 3 1 4 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 PARALLEL BRIDGES PER LADDER . 6 1 7 4 2 3 0 2 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 . 3 2 4 1 1 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 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 A 0 0 56 0, 0.0 544,-0.1 0, 0.0 546,-0.0 0.000 360.0 360.0 360.0 149.8 41.7 63.3 16.3 2 2 A P > - 0 0 54 0, 0.0 3,-2.1 0, 0.0 6,-0.2 -0.304 360.0-108.1 -73.7 160.4 43.3 66.7 15.2 3 3 A D T 3 S+ 0 0 2 1,-0.3 11,-0.2 516,-0.2 8,-0.1 0.767 118.7 57.5 -56.8 -26.5 45.1 69.0 17.6 4 4 A T T 3 S+ 0 0 39 395,-0.1 -1,-0.3 9,-0.1 396,-0.0 0.484 80.0 122.3 -85.1 -4.8 42.2 71.4 17.5 5 5 A S S X S- 0 0 31 -3,-2.1 3,-1.5 1,-0.1 0, 0.0 -0.208 71.0-126.0 -59.8 148.5 39.6 68.8 18.7 6 6 A V T 3 S+ 0 0 24 1,-0.3 -1,-0.1 120,-0.1 -3,-0.0 0.752 108.6 67.8 -65.5 -22.5 37.6 69.6 21.8 7 7 A S T 3 S+ 0 0 64 1,-0.1 2,-1.5 124,-0.1 -1,-0.3 0.598 71.7 103.0 -74.3 -11.3 38.8 66.2 23.1 8 8 A N X + 0 0 0 -3,-1.5 3,-0.7 1,-0.2 -1,-0.1 -0.574 40.9 169.1 -77.9 90.6 42.4 67.5 23.4 9 9 A K T 3 + 0 0 55 -2,-1.5 244,-3.1 1,-0.2 -1,-0.2 0.591 69.7 60.9 -77.4 -11.4 42.7 68.1 27.1 10 10 A Q T 3 S+ 0 0 22 242,-0.2 2,-0.4 1,-0.2 -1,-0.2 0.565 101.9 49.7 -93.8 -7.6 46.5 68.6 27.0 11 11 A N < + 0 0 0 -3,-0.7 -1,-0.2 -8,-0.1 3,-0.2 -0.957 41.4 162.3-141.5 116.0 46.6 71.7 24.7 12 12 A F > + 0 0 0 -2,-0.4 3,-1.6 1,-0.1 -1,-0.1 0.278 53.7 102.5-111.6 7.8 44.6 74.9 24.9 13 13 A S T 3 S+ 0 0 0 1,-0.3 -1,-0.1 342,-0.1 -9,-0.1 0.723 82.4 49.7 -65.7 -22.7 46.8 77.0 22.6 14 14 A T T 3 S+ 0 0 2 -11,-0.2 -1,-0.3 -3,-0.2 2,-0.2 0.389 105.6 82.8 -94.1 3.8 44.4 76.7 19.7 15 15 A D < - 0 0 1 -3,-1.6 2,-0.4 383,-0.1 56,-0.1 -0.559 66.9-143.3-105.6 167.3 41.5 77.8 22.1 16 16 A V - 0 0 1 -2,-0.2 56,-1.6 54,-0.2 57,-1.0 -0.986 23.8-147.3-129.4 117.5 40.1 81.0 23.4 17 17 A I E -ab 73 357A 0 339,-3.2 341,-3.2 -2,-0.4 2,-0.5 -0.617 3.8-150.9 -88.5 146.0 38.9 80.8 27.0 18 18 A Y E -ab 74 358A 0 55,-1.6 57,-1.8 -2,-0.3 2,-0.9 -0.976 17.8-137.0-115.9 115.8 36.0 82.8 28.5 19 19 A Q E -ab 75 359A 2 339,-3.2 341,-2.4 -2,-0.5 2,-0.7 -0.641 23.0-164.9 -76.8 104.7 36.4 83.5 32.2 20 20 A I E -a 76 0A 1 55,-2.5 2,-1.5 -2,-0.9 57,-0.6 -0.819 17.9-161.5-100.4 112.7 33.0 82.8 33.8 21 21 A F > - 0 0 11 -2,-0.7 3,-2.3 1,-0.2 4,-0.4 -0.744 24.7-150.8 -86.5 90.2 32.4 84.1 37.3 22 22 A T G >> S+ 0 0 0 -2,-1.5 3,-1.4 1,-0.3 4,-0.8 0.739 85.0 51.2 -33.5 -55.4 29.5 81.7 37.7 23 23 A D G 34 S+ 0 0 2 74,-0.4 29,-2.4 1,-0.3 -1,-0.3 0.748 115.6 43.8 -62.5 -22.7 27.3 83.7 40.1 24 24 A R G <4 S+ 0 0 1 -3,-2.3 354,-2.1 27,-0.1 -1,-0.3 0.321 103.9 64.9-107.2 8.4 27.4 86.8 37.9 25 25 A F T <4 S- 0 0 4 -3,-1.4 2,-0.3 -4,-0.4 -2,-0.1 0.918 110.9 -22.0 -95.3 -69.1 26.9 85.2 34.5 26 26 A S < - 0 0 26 -4,-0.8 27,-2.1 27,-0.2 2,-1.3 -0.862 42.8-146.0-156.1 119.4 23.4 83.7 34.2 27 27 A D + 0 0 53 25,-0.3 25,-0.2 -2,-0.3 27,-0.1 -0.655 30.2 163.5 -81.2 91.8 20.9 82.4 36.7 28 28 A G + 0 0 24 -2,-1.3 -1,-0.2 1,-0.2 24,-0.1 0.598 69.1 40.6 -87.4 -11.6 19.4 79.5 34.8 29 29 A N > - 0 0 50 22,-0.4 3,-1.8 -3,-0.1 -1,-0.2 -0.732 57.8-178.2-139.0 88.3 17.7 77.8 37.8 30 30 A P G > S+ 0 0 86 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.738 77.8 75.9 -57.5 -21.0 16.1 80.2 40.3 31 31 A A G 3 S+ 0 0 87 1,-0.3 80,-0.0 -3,-0.1 -3,-0.0 0.736 93.2 48.0 -65.4 -25.3 15.3 77.2 42.4 32 32 A N G < S+ 0 0 33 -3,-1.8 -1,-0.3 79,-0.1 81,-0.1 0.245 82.4 129.8-100.6 14.8 18.8 76.7 43.7 33 33 A N < - 0 0 29 -3,-1.5 6,-0.1 -4,-0.1 79,-0.0 -0.454 65.3-115.3 -67.8 133.7 19.2 80.4 44.6 34 34 A P - 0 0 29 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.324 39.9-138.6 -63.0 158.0 20.4 81.0 48.2 35 35 A T > + 0 0 122 -3,-0.1 3,-1.3 4,-0.0 14,-0.1 -0.645 48.2 8.1-117.8 175.1 17.8 82.7 50.2 36 36 A G G > S- 0 0 63 1,-0.2 3,-1.7 -2,-0.2 0, 0.0 -0.269 122.8 -5.6 64.1-139.5 17.4 85.5 52.8 37 37 A A G 3 S+ 0 0 56 1,-0.3 -1,-0.2 3,-0.0 56,-0.0 0.583 128.7 64.8 -67.8 -12.0 20.4 87.7 53.7 38 38 A A G < S+ 0 0 12 -3,-1.3 11,-2.5 10,-0.1 2,-0.4 0.448 99.5 65.8 -90.0 0.7 22.7 85.6 51.6 39 39 A F B < +g 49 0B 54 -3,-1.7 2,-0.3 9,-0.2 11,-0.2 -0.951 44.3 173.8-133.5 144.9 20.9 86.6 48.4 40 40 A D > - 0 0 30 9,-2.5 3,-2.1 -2,-0.4 8,-0.1 -0.775 10.8-168.0-145.2 94.5 20.2 89.7 46.3 41 41 A G T 3 S+ 0 0 36 1,-0.3 9,-0.1 -2,-0.3 -1,-0.1 0.676 90.3 55.9 -58.0 -19.6 18.3 88.9 43.0 42 42 A T T 3 S- 0 0 94 3,-0.0 -1,-0.3 335,-0.0 335,-0.1 0.618 101.2-136.7 -87.3 -13.8 19.0 92.4 41.7 43 43 A a < + 0 0 13 -3,-2.1 334,-0.4 6,-0.2 3,-0.1 0.896 64.0 129.8 57.8 44.2 22.7 91.9 42.2 44 44 A T + 0 0 111 1,-0.2 2,-1.2 332,-0.1 -1,-0.1 0.827 63.4 61.4 -90.0 -41.7 23.1 95.4 43.7 45 45 A N S > S- 0 0 59 1,-0.1 3,-1.9 4,-0.1 -1,-0.2 -0.747 75.6-165.2 -87.0 96.7 25.0 94.0 46.8 46 46 A L T 3 S+ 0 0 24 -2,-1.2 -1,-0.1 1,-0.3 4,-0.1 0.439 79.9 64.3 -66.2 0.9 28.0 92.5 44.9 47 47 A R T 3 S+ 0 0 74 46,-0.1 48,-1.9 2,-0.1 50,-0.3 0.426 94.3 69.0-103.7 -0.6 29.1 90.6 48.0 48 48 A L S < S- 0 0 13 -3,-1.9 2,-0.3 46,-0.2 -9,-0.2 -0.597 98.9 -79.5-109.0 172.5 26.0 88.3 48.1 49 49 A Y B -g 39 0B 15 -11,-2.5 -9,-2.5 -2,-0.2 -6,-0.2 -0.557 35.4-174.4 -73.4 135.9 24.8 85.6 45.8 50 50 A a - 0 0 0 -2,-0.3 -1,-0.1 -11,-0.2 -23,-0.1 0.563 48.8-104.9-105.4 -15.4 23.1 86.9 42.7 51 51 A G + 0 0 2 1,-0.3 -22,-0.4 -19,-0.1 -23,-0.2 0.268 61.3 153.7 112.9 -13.6 22.0 83.5 41.3 52 52 A G + 0 0 4 -29,-2.4 -25,-0.3 -25,-0.2 -1,-0.3 -0.237 23.0 162.4 -52.1 134.0 24.4 82.8 38.5 53 53 A D > - 0 0 0 -27,-2.1 4,-1.3 -30,-0.1 -27,-0.2 -0.796 53.0 -90.5-144.8-175.8 24.6 79.0 38.0 54 54 A W H > S+ 0 0 0 58,-2.4 4,-2.5 -2,-0.2 5,-0.2 0.815 119.5 58.9 -73.3 -31.6 25.6 76.1 35.8 55 55 A Q H > S+ 0 0 56 57,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.911 105.2 53.3 -62.2 -38.4 22.2 75.8 34.2 56 56 A G H > S+ 0 0 0 -30,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.901 107.7 48.5 -61.7 -42.6 22.7 79.4 33.1 57 57 A I H X S+ 0 0 0 -4,-1.3 4,-1.4 -31,-0.2 -1,-0.2 0.908 109.2 54.0 -64.1 -41.2 26.0 78.5 31.5 58 58 A I H X S+ 0 0 11 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.909 108.7 49.8 -57.9 -43.5 24.4 75.6 29.7 59 59 A N H X S+ 0 0 60 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.902 110.1 48.5 -63.6 -42.9 21.7 78.0 28.3 60 60 A K H <>S+ 0 0 22 -4,-2.1 6,-1.3 1,-0.2 5,-0.7 0.709 111.4 52.0 -72.1 -18.7 24.3 80.5 27.1 61 61 A I H ><5S+ 0 0 0 -4,-1.4 3,-0.6 -3,-0.2 6,-0.3 0.875 114.5 42.0 -79.5 -41.2 26.2 77.6 25.5 62 62 A N H 3<5S+ 0 0 83 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.771 110.1 54.6 -79.0 -27.3 23.0 76.4 23.7 63 63 A D T 3<5S- 0 0 90 -4,-2.4 -1,-0.2 -5,-0.2 -3,-0.1 0.378 112.5-113.7 -90.1 7.7 21.7 79.7 22.6 64 64 A G T <>5S+ 0 0 23 -3,-0.6 4,-2.3 -5,-0.1 5,-0.2 0.482 76.7 126.9 82.7 4.6 24.9 80.6 20.8 65 65 A Y T 4>>S+ 0 0 0 -6,-1.3 5,-2.1 2,-0.2 3,-0.9 0.929 121.4 48.3 -76.6 -47.5 29.6 81.9 23.4 67 67 A T G >45S+ 0 0 56 -7,-0.3 3,-1.2 1,-0.3 -2,-0.2 0.875 106.6 58.0 -62.6 -36.4 29.9 79.9 20.2 68 68 A G G 3<5S+ 0 0 28 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.756 105.9 51.7 -64.3 -21.8 28.9 83.0 18.1 69 69 A M G <45S- 0 0 0 -3,-0.9 326,-0.3 -4,-0.4 -1,-0.3 0.569 119.0-111.0 -89.2 -13.2 31.9 84.7 19.7 70 70 A G T <<5 + 0 0 14 -3,-1.2 2,-0.3 -4,-0.6 -3,-0.2 0.620 61.7 157.9 89.9 12.5 34.3 82.0 18.7 71 71 A V < + 0 0 4 -5,-2.1 -1,-0.3 1,-0.1 -54,-0.1 -0.567 15.7 174.2 -71.7 130.3 34.8 80.9 22.4 72 72 A T + 0 0 25 -56,-1.6 59,-2.1 -2,-0.3 2,-0.3 0.213 62.1 30.2-122.7 12.0 36.0 77.3 22.5 73 73 A A E -ac 17 131A 0 -57,-1.0 -55,-1.6 57,-0.3 2,-0.3 -0.970 58.0-166.8-165.7 152.0 36.7 77.0 26.2 74 74 A I E -ac 18 132A 0 57,-2.2 59,-2.8 -2,-0.3 2,-0.4 -0.976 8.1-153.5-140.5 152.6 35.4 78.3 29.6 75 75 A W E -ac 19 133A 5 -57,-1.8 -55,-2.5 -2,-0.3 2,-0.3 -0.960 18.8-159.4-123.9 149.6 36.7 78.3 33.1 76 76 A I E -ac 20 134A 0 57,-2.0 59,-1.4 -2,-0.4 -55,-0.2 -0.845 28.3 -81.9-127.8 164.0 34.3 78.5 36.1 77 77 A S S S- 0 0 4 -57,-0.6 58,-0.1 -2,-0.3 22,-0.1 -0.207 74.5 -69.2 -56.7 152.3 34.4 79.4 39.8 78 78 A Q - 0 0 0 20,-0.4 -1,-0.2 1,-0.2 58,-0.1 -0.233 48.4-151.7 -48.0 124.2 35.5 76.6 42.0 79 79 A P + 0 0 0 0, 0.0 30,-1.9 0, 0.0 -1,-0.2 0.599 57.4 107.9 -77.6 -13.7 32.7 74.1 41.8 80 80 A V E S-H 108 0C 0 28,-0.3 28,-0.3 19,-0.2 25,-0.2 -0.262 83.7 -83.6 -71.6 154.1 33.2 72.5 45.3 81 81 A E E -H 104 0C 16 26,-1.5 22,-2.8 23,-1.1 23,-1.6 -0.301 49.1-162.3 -58.1 127.9 30.8 73.1 48.2 82 82 A N E -H 102 0C 2 20,-0.3 20,-0.3 21,-0.2 60,-0.1 -0.608 30.6 -79.8-105.4 170.0 31.5 76.3 50.1 83 83 A I - 0 0 2 18,-2.2 13,-0.3 -2,-0.2 -1,-0.2 -0.252 29.4-142.3 -65.0 159.3 30.5 77.4 53.6 84 84 A Y + 0 0 112 11,-0.1 -1,-0.1 -3,-0.1 68,-0.0 0.399 57.2 127.1-104.5 0.2 27.0 78.8 53.9 85 85 A S - 0 0 25 1,-0.1 2,-0.7 10,-0.1 11,-0.3 -0.193 54.8-144.1 -60.8 145.9 27.9 81.5 56.4 86 86 A I - 0 0 67 9,-0.1 2,-0.4 66,-0.1 9,-0.2 -0.933 27.5-158.9-110.0 100.8 26.9 85.1 55.9 87 87 A I E -K 94 0D 6 7,-2.4 7,-2.8 -2,-0.7 2,-0.8 -0.702 10.9-143.2 -91.1 133.2 30.0 86.8 57.3 88 88 A N E -K 93 0D 94 -2,-0.4 2,-0.9 5,-0.2 5,-0.2 -0.824 16.6-173.9 -96.4 106.3 29.8 90.5 58.5 89 89 A Y E > S-K 92 0D 70 3,-2.8 3,-0.8 -2,-0.8 -2,-0.0 -0.841 72.5 -35.9-103.5 97.8 33.1 92.2 57.7 90 90 A S T 3 S- 0 0 120 -2,-0.9 -1,-0.2 1,-0.2 3,-0.1 0.967 127.8 -34.0 52.8 64.2 33.0 95.7 59.2 91 91 A G T 3 S+ 0 0 66 -3,-0.1 2,-0.4 1,-0.1 -1,-0.2 0.319 120.9 96.3 81.1 -8.5 29.3 96.4 58.7 92 92 A V E < -K 89 0D 59 -3,-0.8 -3,-2.8 -45,-0.0 2,-0.2 -0.959 69.0-128.6-122.9 131.2 28.9 94.5 55.4 93 93 A N E -K 88 0D 62 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.511 25.4-169.0 -75.2 138.7 27.7 91.0 54.8 94 94 A N E -K 87 0D 17 -7,-2.8 -7,-2.4 -2,-0.2 2,-0.2 -0.972 3.7-173.0-129.2 141.9 29.8 88.7 52.7 95 95 A T - 0 0 2 -48,-1.9 3,-0.4 -2,-0.4 -9,-0.1 -0.737 40.6-103.0-125.3 176.3 29.0 85.2 51.2 96 96 A A S > S+ 0 0 1 -13,-0.3 3,-2.5 -11,-0.3 5,-0.2 0.004 72.9 129.4 -89.4 28.6 30.9 82.5 49.4 97 97 A Y T 3 + 0 0 3 -50,-0.3 -74,-0.4 1,-0.3 -1,-0.2 0.766 69.0 60.0 -53.7 -26.5 29.4 83.6 46.1 98 98 A H T 3 S- 0 0 18 -3,-0.4 -20,-0.4 -51,-0.1 -1,-0.3 0.585 105.6-129.7 -80.1 -12.4 32.9 83.6 44.7 99 99 A G S < S+ 0 0 0 -3,-2.5 -19,-0.2 -22,-0.1 -2,-0.1 0.461 76.0 113.5 79.0 3.0 33.5 79.9 45.4 100 100 A Y + 0 0 26 1,-0.2 2,-0.7 36,-0.1 40,-0.1 0.451 55.0 79.9 -87.3 -1.0 36.8 80.3 47.3 101 101 A W - 0 0 22 -5,-0.2 -18,-2.2 -18,-0.1 41,-0.2 -0.584 69.5-174.4-106.8 71.2 35.5 79.3 50.7 102 102 A A E +H 82 0C 0 39,-0.8 -20,-0.3 -2,-0.7 3,-0.1 -0.254 26.6 164.8 -68.7 148.0 35.6 75.5 50.4 103 103 A R E S+ 0 0 35 -22,-2.8 55,-3.7 1,-0.2 2,-0.3 0.449 78.4 24.0-131.4 -21.9 34.2 73.1 53.0 104 104 A D E > -Hi 81 158C 0 -23,-1.6 3,-1.3 53,-0.2 -23,-1.1 -0.810 54.5-170.5-151.5 105.9 34.0 69.9 51.0 105 105 A F E 3 S+ 0 0 0 53,-0.5 54,-0.1 -2,-0.3 -1,-0.1 0.489 88.4 59.2 -74.9 -1.7 36.1 69.3 47.8 106 106 A K E 3 S+ 0 0 42 52,-0.3 2,-0.3 2,-0.1 -1,-0.2 0.278 101.7 58.7-109.6 9.6 34.1 66.2 47.0 107 107 A K E < S- 0 0 67 -3,-1.3 -26,-1.5 -26,-0.1 2,-0.2 -0.870 81.9-111.8-130.2 165.0 30.7 67.9 46.7 108 108 A T E -H 80 0C 17 -28,-0.3 -28,-0.3 -2,-0.3 -27,-0.1 -0.539 32.1-103.1 -95.0 163.2 29.3 70.7 44.6 109 109 A N >> - 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0 0 0 -56,-2.5 -57,-1.6 -2,-0.3 2,-0.5 -0.408 36.1-134.5 -60.9 111.5 42.3 78.5 57.3 199 199 A D E -L 140 0E 2 -2,-0.5 -23,-2.5 -23,-0.4 -59,-0.3 -0.561 14.8-129.9 -76.4 121.1 45.6 77.5 55.7 200 200 A L B -M 175 0F 0 -61,-2.1 2,-0.9 -2,-0.5 -25,-0.3 -0.428 9.9-136.3 -72.1 141.8 45.7 73.8 54.7 201 201 A N > - 0 0 17 -27,-2.8 3,-1.9 1,-0.1 6,-0.3 -0.828 18.2-175.3-100.6 96.5 48.7 71.8 55.8 202 202 A H T 3 S+ 0 0 5 -2,-0.9 -1,-0.1 1,-0.3 386,-0.1 0.562 79.9 70.0 -71.0 -6.5 49.7 69.7 52.9 203 203 A N T 3 S+ 0 0 27 474,-0.1 2,-0.6 4,-0.1 -1,-0.3 0.587 78.7 94.2 -83.5 -11.3 52.4 68.0 54.9 204 204 A N S <> S- 0 0 22 -3,-1.9 4,-2.7 1,-0.1 5,-0.2 -0.731 77.0-142.5 -80.6 122.2 49.5 66.3 56.8 205 205 A S H > S+ 0 0 51 -2,-0.6 4,-2.6 1,-0.2 5,-0.3 0.830 98.8 54.6 -55.7 -37.3 49.0 62.9 55.1 206 206 A T H > S+ 0 0 63 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.953 112.1 43.6 -62.3 -48.6 45.2 63.1 55.5 207 207 A V H > S+ 0 0 0 -6,-0.3 4,-2.6 2,-0.2 5,-0.2 0.922 114.6 50.2 -61.3 -47.4 45.1 66.5 53.7 208 208 A D H X S+ 0 0 2 -4,-2.7 4,-1.8 -7,-0.3 -2,-0.2 0.951 116.2 39.6 -56.4 -55.7 47.6 65.4 51.0 209 209 A V H X S+ 0 0 55 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.875 114.6 55.2 -64.0 -39.2 45.7 62.2 50.2 210 210 A Y H X S+ 0 0 8 -4,-2.5 4,-2.3 -5,-0.3 -2,-0.2 0.936 108.9 45.3 -60.5 -50.3 42.3 63.9 50.5 211 211 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.887 113.1 50.0 -64.2 -39.4 43.1 66.7 48.0 212 212 A K H X S+ 0 0 17 -4,-1.8 4,-1.3 -5,-0.2 -1,-0.2 0.868 112.0 48.5 -68.1 -34.3 44.6 64.3 45.5 213 213 A D H X S+ 0 0 70 -4,-2.1 4,-1.5 -5,-0.2 -2,-0.2 0.882 110.1 53.8 -69.9 -37.1 41.5 62.0 45.8 214 214 A A H X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 3,-0.4 0.947 106.5 48.8 -63.2 -49.9 39.3 65.1 45.3 215 215 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.854 107.2 57.8 -60.8 -33.1 40.9 66.3 42.1 216 216 A K H X S+ 0 0 58 -4,-1.3 4,-2.6 1,-0.2 -1,-0.2 0.887 101.5 55.6 -63.4 -38.2 40.6 62.7 40.7 217 217 A M H X S+ 0 0 49 -4,-1.5 4,-0.9 -3,-0.4 -1,-0.2 0.920 110.5 44.6 -59.1 -44.9 36.8 62.8 41.3 218 218 A W H <>S+ 0 0 0 -4,-1.6 5,-1.3 2,-0.2 3,-0.5 0.882 110.5 54.4 -68.0 -37.4 36.6 66.0 39.2 219 219 A L H ><5S+ 0 0 8 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.914 106.1 52.9 -60.9 -41.6 38.9 64.5 36.5 220 220 A D H 3<5S+ 0 0 82 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.743 99.1 64.6 -65.6 -23.4 36.5 61.5 36.4 221 221 A L T 3<5S- 0 0 33 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.481 122.4-103.3 -78.9 -3.0 33.6 63.9 35.8 222 222 A G T < 5 + 0 0 18 -3,-1.7 -90,-0.2 -4,-0.2 -3,-0.2 0.622 57.9 165.9 95.8 14.0 35.2 65.0 32.5 223 223 A I < - 0 0 1 -5,-1.3 -1,-0.2 1,-0.1 -90,-0.2 -0.256 26.7-153.0 -61.2 151.8 36.9 68.3 33.1 224 224 A D + 0 0 1 -92,-2.9 29,-0.9 1,-0.2 2,-0.3 0.521 68.2 1.4-104.9 -8.6 39.4 69.4 30.5 225 225 A G E -de 133 253A 0 -93,-1.1 -91,-1.8 27,-0.2 2,-0.4 -0.986 59.9-128.7-168.6 168.2 41.6 71.6 32.6 226 226 A I E -de 134 254A 0 27,-2.4 29,-2.1 -2,-0.3 2,-0.7 -0.996 3.5-157.4-134.5 132.4 42.4 73.0 36.0 227 227 A R E -de 135 255A 8 -93,-2.9 -91,-2.4 -2,-0.4 2,-0.5 -0.906 22.2-149.9-107.6 101.9 43.0 76.6 37.2 228 228 A M E -de 136 256A 0 27,-2.6 29,-2.3 -2,-0.7 3,-0.5 -0.619 11.7-137.1 -78.2 122.1 45.0 76.3 40.4 229 229 A D S S- 0 0 20 -93,-2.6 -90,-0.2 -2,-0.5 4,-0.1 -0.524 71.6 -5.7 -81.6 143.3 44.3 79.2 42.8 230 230 A A > + 0 0 11 -2,-0.2 3,-1.5 1,-0.1 -1,-0.2 0.834 68.4 167.3 43.8 54.4 47.0 81.0 44.8 231 231 A V G > + 0 0 0 26,-1.0 3,-1.1 -3,-0.5 27,-0.2 0.721 69.9 66.2 -70.2 -20.6 49.9 78.8 43.7 232 232 A K G 3 S+ 0 0 56 25,-0.7 -1,-0.3 1,-0.2 4,-0.1 0.596 100.5 55.8 -74.1 -6.2 52.5 81.2 45.1 233 233 A H G < S+ 0 0 26 -3,-1.5 -1,-0.2 -4,-0.1 -2,-0.2 0.351 95.2 70.1-110.3 6.8 51.1 80.3 48.5 234 234 A M S < S- 0 0 0 -3,-1.1 -43,-0.1 -4,-0.1 2,-0.1 -0.876 99.2 -83.0-119.9 155.1 51.4 76.5 48.6 235 235 A P > - 0 0 6 0, 0.0 4,-2.2 0, 0.0 5,-0.2 -0.366 35.8-143.3 -57.4 127.0 54.7 74.5 48.9 236 236 A F H > S+ 0 0 28 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.874 99.3 53.6 -61.8 -37.6 56.0 74.3 45.3 237 237 A G H > S+ 0 0 10 402,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.880 108.4 49.0 -64.9 -38.6 57.3 70.7 46.0 238 238 A W H > S+ 0 0 1 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.923 108.8 53.1 -66.6 -42.6 53.8 69.6 47.1 239 239 A Q H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.873 106.4 53.4 -60.9 -36.2 52.2 71.2 44.0 240 240 A K H X S+ 0 0 29 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.926 108.8 48.5 -63.6 -42.8 54.6 69.3 41.8 241 241 A S H X S+ 0 0 0 -4,-1.8 4,-1.9 1,-0.2 345,-0.2 0.832 110.7 53.1 -65.8 -30.3 53.6 66.0 43.6 242 242 A F H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.938 109.0 46.9 -67.5 -48.5 50.0 67.1 43.0 243 243 A M H X S+ 0 0 1 -4,-2.8 4,-3.1 33,-0.3 -2,-0.2 0.818 110.2 54.7 -63.5 -30.3 50.6 67.7 39.3 244 244 A A H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 -1,-0.2 0.910 106.5 50.8 -67.8 -42.1 52.3 64.3 39.2 245 245 A A H < S+ 0 0 23 -4,-1.9 5,-0.2 2,-0.2 -2,-0.2 0.921 114.9 43.8 -60.3 -44.8 49.1 62.7 40.7 246 246 A V H >X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 3,-1.4 0.966 117.7 43.3 -63.9 -54.7 47.0 64.4 38.0 247 247 A N H 3< S+ 0 0 4 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.813 110.6 54.3 -64.0 -33.9 49.3 63.6 35.1 248 248 A N T 3< S+ 0 0 26 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.411 123.0 29.6 -82.5 4.6 50.0 60.0 36.2 249 249 A Y T <4 S- 0 0 93 -3,-1.4 -2,-0.2 -5,-0.1 -3,-0.2 0.586 141.1 -16.6-119.7 -77.2 46.2 59.5 36.3 250 250 A K S < S- 0 0 90 -4,-1.7 -2,-0.2 -5,-0.2 2,-0.2 -0.805 70.8-145.6-138.5 92.7 44.4 61.7 33.8 251 251 A P + 0 0 18 0, 0.0 2,-0.3 0, 0.0 -242,-0.1 -0.380 24.8 169.4 -64.5 129.4 46.5 64.6 32.5 252 252 A V - 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