==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER UNKNOWN FUNCTION 08-FEB-03 1NX4 . COMPND 2 MOLECULE: CARBAPENEM SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PECTOBACTERIUM CAROTOVORUM; . AUTHOR I.J.CLIFTON,L.X.DOAN,M.C.SLEEMAN,M.TOPF,H.SUZUKI,R.C.WILMOUT . 753 9 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33598.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 502 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 183 24.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 1 0.1 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 . 76 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 140 18.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 0 0 3 3 1 5 0 3 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 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 0 PARALLEL BRIDGES PER LADDER . 6 9 6 6 9 0 0 0 3 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 3 0 3 0 0 3 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 2 A S 0 0 164 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 80.0 -4.1 62.8 3.3 2 3 A E - 0 0 102 1,-0.0 2,-0.4 0, 0.0 24,-0.0 -0.357 360.0-131.0 -85.1 166.4 -3.1 59.1 3.7 3 4 A I - 0 0 160 -2,-0.1 2,-0.4 31,-0.0 28,-0.1 -0.954 9.2-156.3-117.9 131.9 -2.3 57.2 6.8 4 5 A V - 0 0 11 -2,-0.4 2,-0.3 26,-0.2 19,-0.1 -0.861 26.7-119.1-100.0 144.1 0.7 55.1 7.5 5 6 A K + 0 0 65 -2,-0.4 2,-0.3 14,-0.1 14,-0.2 -0.676 47.5 157.2 -78.4 140.1 0.4 52.4 10.1 6 7 A F - 0 0 72 -2,-0.3 12,-0.2 12,-0.1 10,-0.0 -0.992 36.9-138.3-156.5 161.8 2.8 52.8 13.0 7 8 A N B -A 17 0A 114 10,-2.1 10,-3.9 -2,-0.3 -2,-0.0 -0.973 35.6-110.8-121.9 138.4 3.5 52.0 16.6 8 9 A P - 0 0 61 0, 0.0 8,-0.2 0, 0.0 7,-0.2 -0.246 14.6-150.6 -63.5 153.9 4.9 54.6 19.0 9 10 A V S S+ 0 0 25 5,-1.8 2,-0.2 6,-0.3 6,-0.2 0.865 76.4 54.0 -94.1 -43.4 8.4 54.3 20.3 10 11 A X S > S- 0 0 16 4,-2.6 3,-1.9 1,-0.1 196,-0.1 -0.630 83.2-121.7 -93.4 155.5 8.0 56.0 23.7 11 12 A A T 3 S+ 0 0 118 1,-0.3 -1,-0.1 -2,-0.2 195,-0.1 0.751 114.4 63.4 -62.6 -26.5 5.5 55.2 26.4 12 13 A S T 3 S- 0 0 46 194,-0.3 -1,-0.3 1,-0.1 3,-0.1 0.688 122.3-107.9 -69.2 -20.5 4.4 58.9 26.0 13 14 A G S < S+ 0 0 32 -3,-1.9 -2,-0.1 1,-0.4 2,-0.1 0.335 77.3 131.3 106.3 -4.1 3.3 58.0 22.5 14 15 A F + 0 0 10 -6,-0.1 -4,-2.6 2,-0.0 -5,-1.8 -0.320 46.3 40.1 -76.2 162.4 6.2 59.9 20.7 15 16 A G S S- 0 0 0 23,-1.9 2,-0.4 -7,-0.2 -6,-0.3 0.254 71.9-120.8 75.8 153.6 8.2 58.3 17.9 16 17 A A E - b 0 41A 0 24,-1.7 26,-2.8 -8,-0.2 2,-0.6 -0.919 11.6-162.3-136.2 114.0 7.0 56.0 15.1 17 18 A Y E -Ab 7 42A 77 -10,-3.9 -10,-2.1 -2,-0.4 2,-0.4 -0.823 23.0-173.8 -85.7 126.5 8.2 52.4 14.4 18 19 A I - 0 0 4 24,-2.9 26,-0.4 -2,-0.6 -12,-0.1 -0.995 24.5-120.2-128.5 125.3 7.1 51.8 10.8 19 20 A D > - 0 0 60 -2,-0.4 4,-2.6 -14,-0.2 5,-0.2 -0.329 27.7-117.6 -57.5 141.1 7.3 48.4 9.1 20 21 A H H > S+ 0 0 50 24,-0.5 4,-2.1 2,-0.2 5,-0.1 0.781 112.4 48.8 -53.9 -35.3 9.5 48.5 5.9 21 22 A R H > S+ 0 0 147 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.972 113.2 46.7 -71.3 -53.2 6.7 47.5 3.5 22 23 A D H > S+ 0 0 64 1,-0.2 4,-1.0 2,-0.2 -2,-0.2 0.846 113.2 51.6 -52.3 -41.3 4.4 50.1 5.0 23 24 A F H < S+ 0 0 8 -4,-2.6 3,-0.4 1,-0.2 -1,-0.2 0.924 111.4 45.3 -62.3 -48.3 7.3 52.7 4.8 24 25 A L H < S+ 0 0 94 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.785 113.4 50.2 -70.0 -28.3 8.1 52.0 1.2 25 26 A E H < S+ 0 0 157 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.651 94.9 94.5 -82.8 -17.0 4.4 52.1 0.1 26 27 A A S < S- 0 0 24 -4,-1.0 2,-0.1 -3,-0.4 -22,-0.1 -0.480 81.5-110.0 -80.9 145.7 3.8 55.4 1.8 27 28 A K > - 0 0 122 -2,-0.2 4,-1.4 1,-0.1 3,-0.3 -0.401 25.7-120.8 -64.5 143.6 3.9 58.8 0.2 28 29 A T H > S+ 0 0 47 1,-0.2 4,-3.1 2,-0.2 3,-0.4 0.921 113.8 56.5 -47.9 -48.7 6.8 60.9 1.2 29 30 A E H > S+ 0 0 111 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.832 101.3 56.9 -58.1 -36.9 4.3 63.6 2.4 30 31 A T H > S+ 0 0 16 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.916 113.3 39.2 -63.1 -41.6 2.7 61.1 4.8 31 32 A I H X S+ 0 0 2 -4,-1.4 4,-2.9 -3,-0.4 -2,-0.2 0.951 114.4 53.4 -74.1 -46.9 6.0 60.4 6.5 32 33 A K H X S+ 0 0 32 -4,-3.1 4,-0.9 1,-0.2 -2,-0.2 0.893 112.1 46.8 -52.4 -46.6 7.1 64.0 6.5 33 34 A N H >X S+ 0 0 61 -4,-2.8 3,-1.0 -5,-0.2 4,-0.8 0.956 110.4 51.4 -59.5 -48.1 3.8 64.9 8.1 34 35 A L H >X S+ 0 0 3 -4,-2.3 4,-2.5 1,-0.2 3,-0.7 0.899 103.1 60.8 -59.0 -41.6 4.1 62.2 10.7 35 36 A L H 3X S+ 0 0 0 -4,-2.9 4,-2.0 1,-0.2 187,-0.3 0.746 93.1 65.0 -54.0 -35.7 7.6 63.3 11.6 36 37 A X H << S+ 0 0 59 -3,-1.0 -1,-0.2 -4,-0.9 -2,-0.2 0.939 117.6 23.9 -58.0 -45.2 6.4 66.7 12.7 37 38 A R H << S+ 0 0 157 -4,-0.8 -2,-0.2 -3,-0.7 -1,-0.2 0.698 128.0 46.4 -94.1 -23.1 4.4 65.3 15.6 38 39 A Q H < S- 0 0 22 -4,-2.5 -23,-1.9 -5,-0.2 2,-1.5 0.606 88.3-148.4 -94.1 -10.8 6.2 62.1 16.1 39 40 A G < + 0 0 0 -4,-2.0 183,-2.9 -5,-0.3 2,-0.3 -0.171 68.5 25.2 77.9 -48.3 9.7 63.5 16.1 40 41 A F E - C 0 221A 0 -2,-1.5 -24,-1.7 181,-0.2 2,-0.4 -0.995 61.9-146.2-153.9 151.7 11.4 60.5 14.6 41 42 A V E -bC 16 220A 0 179,-2.7 179,-2.4 -2,-0.3 2,-0.5 -0.945 9.8-162.3-123.5 134.0 10.7 57.4 12.5 42 43 A V E +bC 17 219A 3 -26,-2.8 -24,-2.9 -2,-0.4 2,-0.4 -0.990 10.2 176.4-122.2 121.1 12.4 54.0 12.8 43 44 A V E - C 0 218A 0 175,-2.5 175,-2.7 -2,-0.5 2,-0.2 -0.997 8.5-167.4-120.7 129.1 12.3 51.5 10.0 44 45 A K + 0 0 69 -2,-0.4 -24,-0.5 -26,-0.4 173,-0.2 -0.721 62.3 30.4-108.9 166.6 14.1 48.1 10.3 45 46 A N S S+ 0 0 117 170,-0.4 2,-0.6 -2,-0.2 -1,-0.2 0.761 72.2 148.0 59.9 33.9 14.9 45.5 7.6 46 47 A L - 0 0 2 170,-1.8 2,-0.8 -3,-0.2 -1,-0.2 -0.852 32.0-161.1 -94.8 123.8 15.2 47.9 4.7 47 48 A D + 0 0 160 -2,-0.6 2,-0.3 168,-0.0 60,-0.1 -0.658 33.2 139.7-110.2 86.2 17.7 46.7 2.1 48 49 A I - 0 0 25 -2,-0.8 2,-0.1 2,-0.0 168,-0.1 -0.814 42.7-130.1-121.5 160.0 18.7 49.7 -0.1 49 50 A D > - 0 0 79 -2,-0.3 4,-2.1 1,-0.0 3,-0.2 -0.417 41.7 -91.7 -95.8-179.3 21.8 51.1 -1.7 50 51 A S H > S+ 0 0 43 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.833 123.0 53.9 -63.8 -30.9 23.1 54.8 -1.5 51 52 A D H > S+ 0 0 80 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.866 109.9 45.6 -71.5 -39.6 21.2 55.8 -4.7 52 53 A T H > S+ 0 0 52 2,-0.2 4,-2.4 -3,-0.2 -2,-0.2 0.889 110.3 55.0 -70.6 -38.2 17.9 54.6 -3.4 53 54 A F H X S+ 0 0 1 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.918 108.9 48.8 -59.2 -45.7 18.5 56.2 -0.0 54 55 A R H X S+ 0 0 90 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.905 109.1 52.0 -58.8 -46.1 19.1 59.5 -1.9 55 56 A D H X S+ 0 0 108 -4,-2.0 4,-0.7 2,-0.2 -2,-0.2 0.847 111.5 48.5 -59.3 -40.1 15.8 59.0 -3.9 56 57 A I H >< S+ 0 0 26 -4,-2.4 3,-0.6 1,-0.1 4,-0.3 0.982 118.3 36.9 -65.8 -54.1 13.9 58.5 -0.6 57 58 A Y H >< S+ 0 0 0 -4,-2.7 3,-1.7 1,-0.2 -2,-0.2 0.837 108.1 60.7 -72.2 -35.4 15.3 61.5 1.2 58 59 A S H >< S+ 0 0 38 -4,-2.7 3,-1.0 1,-0.3 -1,-0.2 0.696 92.6 68.1 -66.7 -23.3 15.5 64.1 -1.6 59 60 A A T << S+ 0 0 62 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.749 88.8 67.5 -66.2 -20.7 11.8 63.8 -2.2 60 61 A Y T < S- 0 0 3 -3,-1.7 2,-0.3 -4,-0.3 -1,-0.2 0.584 117.9 -64.8 -76.8 -9.9 11.3 65.5 1.3 61 62 A G S < S- 0 0 22 -3,-1.0 2,-0.5 -4,-0.2 188,-0.2 -0.985 84.4 -17.4 161.5-151.9 12.7 68.9 0.3 62 63 A T E -D 248 0A 102 186,-2.8 186,-1.7 -2,-0.3 2,-0.2 -0.788 68.2-116.1 -90.0 131.6 15.9 70.7 -0.8 63 64 A I E -D 247 0A 47 -2,-0.5 2,-0.5 184,-0.2 184,-0.2 -0.481 20.6-143.1 -67.0 129.2 19.0 68.7 -0.1 64 65 A V 0 0 23 182,-2.9 182,-0.3 -2,-0.2 -1,-0.0 -0.882 360.0 360.0 -95.1 126.2 21.4 70.4 2.4 65 66 A E 0 0 165 -2,-0.5 3,-0.2 180,-0.1 -1,-0.0 -0.049 360.0 360.0-102.4 360.0 25.0 69.8 1.4 66 ! 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 67 79 A R 0 0 116 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 48.0 28.3 66.8 -1.8 68 80 A D + 0 0 52 -3,-0.2 2,-0.5 1,-0.1 178,-0.3 0.941 360.0 50.1 -86.9 -53.4 24.8 65.3 -0.9 69 81 A T S S- 0 0 41 176,-0.1 2,-0.6 174,-0.0 176,-0.2 -0.809 71.6-145.0 -95.1 122.1 25.2 62.1 1.1 70 82 A L E -E 244 0A 52 174,-2.2 174,-1.2 -2,-0.5 2,-1.2 -0.747 5.6-149.2 -87.3 124.4 27.5 62.1 4.1 71 83 A K E -E 243 0A 45 -2,-0.6 2,-1.1 172,-0.2 172,-0.2 -0.727 11.6-172.2 -93.8 91.4 29.4 58.8 4.7 72 84 A L E +E 242 0A 14 170,-1.6 170,-3.2 -2,-1.2 9,-0.1 -0.768 23.4 153.8 -80.6 103.6 29.9 58.6 8.5 73 85 A E - 0 0 92 -2,-1.1 167,-0.5 8,-0.3 -1,-0.2 0.407 64.5 -97.7-117.8 -1.0 32.2 55.6 8.4 74 86 A G - 0 0 10 7,-0.8 2,-0.4 8,-0.2 8,-0.2 0.935 53.0-174.6 82.0 49.4 34.2 55.9 11.6 75 87 A E > - 0 0 46 6,-2.5 3,-0.9 7,-0.2 -1,-0.2 -0.650 23.3-119.7 -81.4 131.3 37.3 57.5 10.1 76 88 A K T 3 S+ 0 0 95 -2,-0.4 3,-0.1 1,-0.2 -1,-0.1 -0.426 92.0 28.3 -74.5 140.8 40.2 58.1 12.5 77 89 A G T 3 S+ 0 0 93 1,-0.4 2,-0.3 -2,-0.1 -1,-0.2 0.627 103.2 97.1 86.4 14.9 41.5 61.6 13.2 78 90 A K < - 0 0 46 -3,-0.9 5,-0.4 1,-0.1 -1,-0.4 -0.827 60.0-148.4-129.3 168.6 38.2 63.2 12.5 79 91 A I S S+ 0 0 32 -2,-0.3 5,-0.4 3,-0.2 3,-0.3 0.890 89.4 23.8-102.5 -71.0 35.3 64.4 14.6 80 92 A V S S+ 0 0 46 1,-0.2 -6,-0.1 3,-0.1 -2,-0.0 0.937 135.7 38.1 -63.6 -45.1 31.8 64.2 13.0 81 93 A T S S+ 0 0 43 -9,-0.1 -6,-2.5 -7,-0.1 -7,-0.8 0.439 110.6 97.6 -85.9 2.6 33.0 61.4 10.7 82 94 A G S S- 0 0 1 -3,-0.3 -8,-0.2 -8,-0.2 -3,-0.2 0.224 85.1-104.7 -79.0-161.5 35.1 60.1 13.6 83 95 A R S S+ 0 0 32 -5,-0.4 150,-3.2 -8,-0.2 33,-0.1 0.354 84.6 75.3-113.7 1.6 34.6 57.4 16.3 84 96 A G S S- 0 0 12 -5,-0.4 91,-0.1 148,-0.3 -10,-0.0 -0.213 86.9 -47.8-104.9-163.0 33.9 59.4 19.4 85 97 A Q - 0 0 13 87,-0.1 146,-0.2 -2,-0.1 -1,-0.2 -0.278 29.1-167.4 -69.0 140.4 31.0 61.3 21.0 86 98 A L E -H 230 0B 14 144,-2.6 144,-2.8 91,-0.1 3,-0.1 -0.950 29.0-147.1-118.1 111.9 28.8 63.8 19.3 87 99 A P E - 0 0 2 0, 0.0 141,-0.1 0, 0.0 84,-0.1 -0.235 40.9 -46.6 -74.9 170.2 26.9 65.4 22.2 88 100 A F E S+ 0 0 2 82,-0.1 81,-2.9 80,-0.1 2,-0.3 0.021 80.7 128.2 -41.5 122.9 23.4 66.8 22.2 89 101 A H E -HI 228 168B 10 139,-1.8 139,-3.2 79,-0.2 2,-0.3 -0.973 51.3-124.1-160.5 171.5 22.6 69.0 19.3 90 102 A A - 0 0 0 77,-0.7 3,-0.5 -2,-0.3 2,-0.1 -0.888 44.9-100.4-117.0 157.9 20.4 69.7 16.4 91 103 A D S S+ 0 0 11 -2,-0.3 8,-0.4 1,-0.2 11,-0.0 -0.461 88.8 23.9 -82.9 148.8 21.8 69.9 12.9 92 104 A G S S+ 0 0 22 -2,-0.1 5,-0.5 6,-0.1 -1,-0.2 0.673 78.5 105.0 81.4 23.8 22.7 73.0 10.9 93 105 A G S S+ 0 0 14 -3,-0.5 -2,-0.1 3,-0.1 5,-0.1 0.499 77.9 54.5-109.9 -3.0 23.4 75.8 13.4 94 106 A L S S+ 0 0 44 3,-0.1 2,-0.3 59,-0.0 53,-0.1 0.751 114.9 42.7 -95.1 -35.1 27.2 76.0 13.2 95 107 A L S S- 0 0 60 2,-0.2 2,-0.6 0, 0.0 0, 0.0 -0.711 105.4-119.4 -86.9 157.8 27.0 76.4 9.5 96 108 A L S S+ 0 0 118 -2,-0.3 2,-0.4 -3,-0.1 -3,-0.1 -0.231 72.9 117.4-103.7 60.1 24.2 78.9 8.9 97 109 A S - 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0 0 39 -2,-0.2 -116,-2.5 -116,-0.1 -148,-0.3 -0.067 33.7-175.7 -55.7 154.7 31.2 56.9 21.3 233 256 A F + 0 0 2 -150,-3.2 2,-2.2 -118,-0.2 5,-0.2 -0.153 22.1 154.1-142.8 45.5 32.4 53.8 19.5 234 257 A N + 0 0 100 3,-0.1 2,-0.4 2,-0.1 -150,-0.1 -0.270 33.1 111.3 -82.5 56.3 36.1 53.9 20.1 235 258 A D > - 0 0 35 -2,-2.2 3,-1.5 -152,-0.1 0, 0.0 -0.999 63.5-143.2-123.5 125.5 36.8 50.2 19.7 236 259 A D T 3 S+ 0 0 132 -2,-0.4 -2,-0.1 1,-0.3 -1,-0.1 0.621 94.3 66.8 -69.9 -14.8 38.8 49.5 16.5 237 260 A D T 3 S+ 0 0 116 -126,-0.1 -1,-0.3 2,-0.0 2,-0.3 0.641 82.2 102.2 -78.5 -14.6 37.0 46.2 15.8 238 261 A I < - 0 0 6 -3,-1.5 2,-0.6 -5,-0.2 -127,-0.2 -0.500 53.2-163.9 -78.0 131.0 33.7 48.1 15.1 239 262 A V E + G 0 110A 43 -129,-2.1 -129,-2.0 -2,-0.3 2,-0.4 -0.979 17.6 166.9-107.5 120.9 32.4 48.8 11.7 240 263 A R E + G 0 109A 6 -2,-0.6 2,-0.6 -167,-0.5 -131,-0.2 -0.882 4.4 170.0-134.2 103.9 29.8 51.5 11.8 241 264 A R E + G 0 108A 61 -133,-2.5 -134,-1.8 -2,-0.4 -133,-1.4 -0.954 5.6 176.3-124.5 113.3 29.0 52.9 8.4 242 265 A L E -EG 72 106A 2 -170,-3.2 -170,-1.6 -2,-0.6 2,-0.4 -0.899 25.5-138.9-117.2 145.9 26.0 55.1 8.0 243 266 A Y E -EG 71 105A 42 -138,-2.9 -138,-2.5 -2,-0.4 2,-0.4 -0.799 25.1-158.4 -93.6 142.3 24.6 57.0 5.1 244 267 A R E +EG 70 104A 45 -174,-1.2 -174,-2.2 -2,-0.4 2,-0.3 -0.985 14.0 176.1-126.5 132.4 23.5 60.6 6.0 245 268 A G E - G 0 103A 0 -142,-2.1 -142,-2.8 -2,-0.4 2,-0.4 -0.971 7.1-166.7-130.4 148.5 21.0 62.8 4.2 246 269 A Q E + G 0 102A 14 -2,-0.3 -182,-2.9 -182,-0.3 2,-0.3 -0.994 8.2 177.7-138.3 131.0 19.6 66.2 5.2 247 270 A T E +DG 63 101A 0 -146,-2.5 -146,-2.6 -2,-0.4 -147,-2.5 -0.915 3.4 170.2-131.9 163.3 16.7 68.2 3.8 248 271 A A E D 62 0A 9 -186,-1.7 -186,-2.8 -2,-0.3 -149,-0.0 -0.984 360.0 360.0-159.9 158.2 14.8 71.5 4.3 249 272 A D 0 0 119 -2,-0.3 -1,-0.1 -188,-0.2 -188,-0.1 0.349 360.0 360.0-122.1 360.0 12.2 73.9 3.0 250 !* 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 0.0 251 2 B S 0 0 172 0, 0.0 2,-0.2 0, 0.0 29,-0.0 0.000 360.0 360.0 360.0 89.8 -11.4 85.1 54.5 252 3 B E - 0 0 110 25,-0.0 2,-0.4 1,-0.0 24,-0.0 -0.538 360.0-137.1 -92.7 162.7 -9.5 86.8 51.7 253 4 B I - 0 0 164 -2,-0.2 2,-0.4 28,-0.0 28,-0.1 -0.947 6.2-154.9-121.3 131.0 -7.8 85.2 48.6 254 5 B V - 0 0 14 -2,-0.4 2,-0.3 26,-0.2 19,-0.1 -0.876 24.8-119.4 -98.6 147.0 -4.5 86.0 47.0 255 6 B K + 0 0 59 -2,-0.4 2,-0.3 14,-0.1 14,-0.2 -0.588 49.2 153.8 -75.3 133.7 -3.9 85.2 43.3 256 7 B F - 0 0 72 -2,-0.3 12,-0.2 12,-0.1 10,-0.0 -0.985 36.8-137.3-156.0 162.6 -1.0 82.8 43.0 257 8 B N B -O 267 0E 112 10,-2.0 10,-3.5 -2,-0.3 -2,-0.0 -0.949 33.3-108.7-121.0 143.7 0.5 80.1 40.7 258 9 B P - 0 0 63 0, 0.0 8,-0.2 0, 0.0 7,-0.2 -0.319 16.3-156.5 -67.4 154.7 1.9 76.8 42.0 259 10 B V S S+ 0 0 25 5,-1.9 -127,-0.2 6,-0.2 2,-0.2 0.824 76.0 54.6 -95.7 -43.1 5.7 76.3 41.8 260 11 B X S > S- 0 0 14 4,-3.0 3,-1.5 1,-0.1 205,-0.1 -0.579 83.0-124.5 -91.5 154.5 5.7 72.5 41.8 261 12 B A T 3 S+ 0 0 115 1,-0.3 -1,-0.1 -2,-0.2 204,-0.1 0.759 111.8 63.7 -67.4 -27.9 3.8 70.3 39.3 262 13 B S T 3 S- 0 0 47 203,-0.2 -1,-0.3 2,-0.1 203,-0.0 0.576 124.9-101.8 -69.9 -11.0 2.2 68.6 42.3 263 14 B G S < S+ 0 0 32 -3,-1.5 -2,-0.1 1,-0.3 2,-0.1 0.313 80.6 130.5 104.3 -3.5 0.5 71.9 43.2 264 15 B F + 0 0 9 -6,-0.1 -4,-3.0 2,-0.0 -5,-1.9 -0.376 45.4 36.7 -81.6 153.2 2.9 72.9 46.0 265 16 B G S S- 0 0 0 23,-1.5 2,-0.4 -6,-0.2 -6,-0.2 0.100 70.3-121.2 87.1 153.6 4.5 76.3 46.3 266 17 B A E - p 0 291E 0 24,-1.3 26,-2.8 -8,-0.2 2,-0.5 -0.941 11.3-161.6-139.4 117.2 3.2 79.7 45.5 267 18 B Y E -Op 257 292E 76 -10,-3.5 -10,-2.0 -2,-0.4 2,-0.4 -0.858 22.5-170.2 -86.2 126.8 4.5 82.3 43.0 268 19 B I E - p 0 293E 7 24,-2.9 26,-0.5 -2,-0.5 -12,-0.1 -0.982 23.5-121.8-124.6 130.8 2.9 85.6 43.9 269 20 B D > - 0 0 59 -2,-0.4 4,-2.4 -14,-0.2 3,-0.2 -0.408 29.0-121.4 -60.9 142.2 3.1 88.8 41.9 270 21 B H H > S+ 0 0 52 24,-0.4 4,-2.5 1,-0.2 5,-0.2 0.823 111.3 50.4 -59.1 -34.4 4.6 91.6 43.9 271 22 B R H > S+ 0 0 161 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.851 111.3 47.8 -74.5 -37.8 1.6 93.9 43.7 272 23 B D H > S+ 0 0 74 2,-0.2 4,-0.7 -3,-0.2 -2,-0.2 0.862 113.7 49.2 -69.8 -36.0 -0.7 91.1 44.8 273 24 B F H >< S+ 0 0 8 -4,-2.4 3,-0.6 2,-0.2 -2,-0.2 0.932 111.8 46.5 -63.7 -54.1 1.6 90.3 47.7 274 25 B L H 3< S+ 0 0 96 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.838 113.4 49.8 -61.3 -33.5 1.9 93.9 48.9 275 26 B E H 3< S+ 0 0 85 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.664 95.4 97.7 -79.2 -14.7 -1.8 94.3 48.7 276 27 B A S << S- 0 0 23 -4,-0.7 2,-0.1 -3,-0.6 -22,-0.1 -0.462 79.9-113.7 -78.7 145.3 -2.5 91.2 50.6 277 28 B K >> - 0 0 123 -2,-0.2 4,-1.2 1,-0.1 3,-0.7 -0.485 26.9-118.3 -68.0 142.2 -3.2 91.0 54.3 278 29 B T H >> S+ 0 0 47 1,-0.2 4,-2.7 2,-0.2 3,-0.7 0.913 114.1 56.3 -44.2 -50.5 -0.5 89.3 56.4 279 30 B E H 3> S+ 0 0 104 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.781 100.3 57.6 -55.6 -36.3 -3.0 86.7 57.4 280 31 B T H <> S+ 0 0 16 -3,-0.7 4,-1.8 2,-0.2 -1,-0.2 0.876 112.9 39.6 -67.4 -36.0 -3.8 85.7 53.8 281 32 B I H X S+ 0 0 4 -4,-1.8 4,-2.8 1,-0.2 3,-0.6 0.865 102.7 60.5 -65.6 -37.4 -1.4 80.2 52.4 285 36 B L H 3X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 196,-0.3 0.852 93.9 65.5 -56.3 -41.2 2.1 79.2 53.6 286 37 B X H 3< S+ 0 0 53 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.893 117.5 23.0 -49.9 -46.7 0.7 76.5 55.8 287 38 B R H << S+ 0 0 155 -4,-0.8 -2,-0.2 -3,-0.6 -1,-0.2 0.731 127.9 46.7 -98.1 -20.5 -0.5 74.4 52.8 288 39 B Q H < S- 0 0 22 -4,-2.8 2,-2.0 -5,-0.2 -23,-1.5 0.594 88.3-148.5 -95.2 -10.4 1.8 75.8 50.0 289 40 B G < + 0 0 0 -4,-2.5 192,-3.4 -5,-0.3 2,-0.3 -0.247 69.0 26.5 79.6 -49.7 5.0 75.5 52.1 290 41 B F E - 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