==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-JAN-11 3QGU . COMPND 2 MOLECULE: LL-DIAMINOPIMELATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CHLAMYDOMONAS REINHARDTII; . AUTHOR R.C.J.DOBSON,I.GIRON,A.O.HUDSON . 819 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27803.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 558 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 6.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 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 . 44 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 264 32.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.7 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 2 0 0 1 1 2 2 7 1 2 4 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 2 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 PARALLEL BRIDGES PER LADDER . 4 2 2 4 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 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 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 33 A G 0 0 136 0, 0.0 684,-0.1 0, 0.0 683,-0.0 0.000 360.0 360.0 360.0-179.9 8.8 29.5 -9.6 2 34 A T + 0 0 31 652,-0.2 2,-0.4 681,-0.2 622,-0.3 0.324 360.0 88.2-130.5 8.5 9.7 27.9 -6.3 3 35 A I - 0 0 10 680,-0.2 622,-0.2 681,-0.2 684,-0.2 -0.960 43.0-177.3-111.9 132.1 12.1 25.0 -7.2 4 36 A D + 0 0 98 620,-2.5 2,-0.3 -2,-0.4 621,-0.1 0.448 48.5 113.5-106.8 -2.6 15.8 25.6 -7.5 5 37 A V - 0 0 3 619,-0.8 680,-2.8 588,-0.2 2,-0.2 -0.530 64.5-133.4 -69.6 128.4 16.8 22.1 -8.6 6 38 A Q - 0 0 112 -2,-0.3 3,-0.1 678,-0.2 -2,-0.1 -0.592 26.1 -98.3 -81.1 149.9 18.1 22.1 -12.1 7 39 A R - 0 0 73 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.295 48.7 -93.0 -60.5 142.3 16.9 19.6 -14.7 8 40 A N >> - 0 0 17 525,-0.3 3,-1.6 1,-0.2 4,-0.8 -0.458 33.8-139.7 -55.8 119.3 19.2 16.7 -15.2 9 41 A E H 3> S+ 0 0 77 -2,-0.3 4,-0.5 1,-0.3 3,-0.3 0.765 98.5 64.7 -55.5 -31.3 21.5 17.8 -18.1 10 42 A N H >> S+ 0 0 27 1,-0.2 3,-0.6 2,-0.2 4,-0.6 0.831 96.3 56.0 -68.4 -28.8 21.3 14.3 -19.6 11 43 A F H <4 S+ 0 0 3 -3,-1.6 3,-0.4 1,-0.2 -1,-0.2 0.789 101.0 58.2 -71.3 -28.3 17.6 14.6 -20.2 12 44 A G H 3< S+ 0 0 44 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.2 0.637 95.2 66.3 -71.7 -17.3 18.2 17.8 -22.2 13 45 A K H << S+ 0 0 33 -3,-0.6 136,-0.3 -4,-0.5 -1,-0.2 0.808 80.9 91.5 -72.8 -27.7 20.4 15.6 -24.5 14 46 A L < - 0 0 21 -4,-0.6 3,-0.1 -3,-0.4 134,-0.0 -0.403 62.5-162.0 -67.5 138.6 17.4 13.6 -25.7 15 47 A R + 0 0 86 1,-0.2 2,-0.3 2,-0.1 -1,-0.1 0.746 65.1 3.7-100.6 -23.2 16.0 15.3 -28.9 16 48 A A S S- 0 0 75 1,-0.1 -1,-0.2 0, 0.0 3,-0.1 -0.872 87.5 -80.9-153.1 165.9 12.4 13.7 -29.0 17 49 A G - 0 0 56 -2,-0.3 -2,-0.1 1,-0.2 -1,-0.1 -0.087 69.2 -63.7 -66.0 171.2 10.3 11.4 -27.0 18 50 A Y > - 0 0 9 1,-0.1 4,-1.5 4,-0.0 -1,-0.2 -0.293 48.4-119.7 -63.5 144.0 10.7 7.7 -27.1 19 51 A L H > S+ 0 0 13 355,-0.2 4,-2.4 1,-0.2 5,-0.2 0.909 103.9 50.9 -51.2 -52.4 9.9 6.0 -30.5 20 52 A F H > S+ 0 0 17 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.908 108.9 48.9 -67.6 -44.7 7.0 3.6 -29.5 21 53 A P H > S+ 0 0 36 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.858 111.1 52.7 -57.7 -34.8 4.9 6.2 -27.8 22 54 A E H X S+ 0 0 62 -4,-1.5 4,-2.3 2,-0.2 -2,-0.2 0.881 107.7 49.8 -67.6 -39.6 5.3 8.4 -30.8 23 55 A I H X S+ 0 0 2 -4,-2.4 4,-2.3 2,-0.2 5,-0.2 0.936 111.8 49.6 -63.3 -38.8 4.1 5.7 -33.2 24 56 A A H X S+ 0 0 11 -4,-2.4 4,-2.6 1,-0.2 465,-0.3 0.901 110.4 50.1 -66.1 -37.2 1.1 5.1 -30.9 25 57 A R H X S+ 0 0 91 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.901 110.4 49.7 -65.8 -39.8 0.4 8.8 -30.9 26 58 A R H X S+ 0 0 69 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.870 110.0 51.1 -65.7 -37.9 0.6 9.0 -34.7 27 59 A R H X S+ 0 0 53 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.913 111.2 48.1 -65.0 -46.2 -1.7 6.1 -35.0 28 60 A K H X S+ 0 0 62 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.909 111.8 49.1 -61.9 -42.1 -4.2 7.7 -32.7 29 61 A A H X S+ 0 0 35 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.921 110.7 50.9 -65.9 -39.8 -4.0 11.1 -34.6 30 62 A H H X S+ 0 0 16 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.903 110.2 49.8 -61.8 -40.4 -4.5 9.3 -38.0 31 63 A Q H < S+ 0 0 65 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.880 108.2 52.9 -66.7 -40.5 -7.6 7.5 -36.5 32 64 A E H < S+ 0 0 143 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.861 112.2 45.2 -64.3 -32.7 -9.0 10.8 -35.3 33 65 A K H < S+ 0 0 125 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.740 126.0 32.3 -75.0 -24.7 -8.6 12.3 -38.8 34 66 A N >< + 0 0 55 -4,-1.2 3,-1.8 -5,-0.2 -1,-0.2 -0.632 69.1 172.8-133.9 69.9 -10.1 9.1 -40.4 35 67 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.694 80.6 49.2 -64.0 -18.2 -12.7 7.7 -38.0 36 68 A D T 3 S+ 0 0 157 2,-0.1 2,-0.1 -5,-0.0 -5,-0.1 0.568 83.3 114.1 -92.4 -11.9 -13.9 5.1 -40.5 37 69 A A < - 0 0 20 -3,-1.8 2,-1.0 -6,-0.2 -3,-0.1 -0.385 62.9-141.2 -61.3 132.2 -10.4 3.8 -41.4 38 70 A K - 0 0 85 -2,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.819 25.4-157.9 -92.5 96.0 -9.7 0.2 -40.3 39 71 A I - 0 0 27 -2,-1.0 2,-0.5 328,-0.1 328,-0.2 -0.582 7.9-158.3 -86.8 128.2 -6.1 0.5 -39.2 40 72 A I E -a 367 0A 6 326,-2.7 328,-2.4 -2,-0.3 2,-0.6 -0.949 12.7-143.8-102.6 124.5 -3.9 -2.6 -39.1 41 73 A S E +a 368 0A 18 -2,-0.5 328,-0.1 326,-0.2 6,-0.1 -0.790 40.0 152.1 -94.8 122.9 -0.9 -2.3 -36.8 42 74 A L + 0 0 2 326,-2.7 344,-2.6 -2,-0.6 328,-0.2 -0.206 62.8 92.2-120.7 31.8 2.3 -4.0 -37.9 43 75 A G S S+ 0 0 0 326,-0.2 327,-0.2 342,-0.2 326,-0.1 0.864 90.5 7.1 -96.3 -95.4 4.0 -1.3 -35.9 44 76 A I S S- 0 0 46 325,-0.1 -24,-0.1 -24,-0.1 325,-0.0 0.828 91.3-120.4 -64.3 -31.6 5.0 -1.6 -32.3 45 77 A G + 0 0 8 343,-0.1 3,-0.2 341,-0.1 208,-0.1 0.607 70.0 135.2 97.0 20.2 4.0 -5.4 -32.1 46 78 A D + 0 0 20 1,-0.2 2,-1.7 439,-0.0 343,-0.1 0.761 49.5 80.3 -76.8 -17.4 1.4 -4.8 -29.4 47 79 A T + 0 0 20 341,-0.4 -1,-0.2 -6,-0.1 439,-0.1 -0.344 64.3 166.1 -89.4 56.0 -1.2 -7.0 -31.0 48 80 A T - 0 0 0 -2,-1.7 437,-2.2 -3,-0.2 3,-0.1 -0.299 40.6-102.5 -66.6 154.1 0.2 -10.3 -29.9 49 81 A E - 0 0 48 204,-0.3 206,-0.7 435,-0.2 -1,-0.1 -0.316 56.4 -67.2 -75.2 165.0 -2.0 -13.4 -30.2 50 82 A P - 0 0 47 0, 0.0 431,-0.2 0, 0.0 -1,-0.2 -0.194 61.9-100.6 -55.6 141.4 -3.8 -14.9 -27.2 51 83 A L - 0 0 3 429,-2.2 5,-0.1 432,-0.4 203,-0.1 -0.386 45.3 -91.7 -62.3 139.2 -1.5 -16.4 -24.6 52 84 A P >> - 0 0 14 0, 0.0 4,-2.0 0, 0.0 3,-1.1 -0.267 37.7-129.0 -50.1 133.4 -1.1 -20.2 -24.7 53 85 A K H 3> S+ 0 0 123 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.808 103.2 63.1 -68.5 -25.4 -3.8 -21.4 -22.2 54 86 A Y H 3> S+ 0 0 81 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.866 109.1 43.3 -66.1 -33.2 -1.4 -23.7 -20.3 55 87 A I H <> S+ 0 0 6 -3,-1.1 4,-2.1 2,-0.2 -2,-0.2 0.916 113.9 49.3 -70.1 -50.4 0.5 -20.5 -19.3 56 88 A A H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 5,-0.2 0.923 108.5 56.0 -55.1 -41.6 -2.6 -18.4 -18.6 57 89 A D H X S+ 0 0 69 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.893 106.9 48.4 -56.6 -47.2 -4.0 -21.3 -16.4 58 90 A A H X S+ 0 0 23 -4,-1.2 4,-2.3 -5,-0.2 -1,-0.2 0.900 112.9 48.0 -65.7 -40.6 -0.9 -21.3 -14.2 59 91 A M H X S+ 0 0 2 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.937 112.3 48.6 -64.8 -39.7 -1.1 -17.6 -13.7 60 92 A A H X S+ 0 0 16 -4,-2.8 4,-3.1 1,-0.2 5,-0.2 0.909 112.1 48.7 -67.5 -43.9 -4.8 -17.6 -12.9 61 93 A K H X S+ 0 0 162 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.898 111.2 50.0 -65.1 -40.5 -4.3 -20.5 -10.4 62 94 A A H < S+ 0 0 26 -4,-2.3 4,-0.5 -5,-0.2 -1,-0.2 0.911 113.6 47.1 -62.4 -39.2 -1.4 -18.6 -8.7 63 95 A A H >< S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.2 4,-0.4 0.925 112.0 48.0 -65.9 -48.5 -3.6 -15.5 -8.5 64 96 A A H >< S+ 0 0 41 -4,-3.1 3,-1.5 1,-0.3 -1,-0.2 0.877 105.1 61.4 -59.9 -37.6 -6.6 -17.3 -7.1 65 97 A G G >< S+ 0 0 25 -4,-2.1 3,-2.0 1,-0.3 4,-0.3 0.679 82.6 80.3 -64.8 -12.3 -4.3 -19.0 -4.6 66 98 A L G X S+ 0 0 1 -3,-1.4 399,-2.1 -4,-0.5 3,-0.7 0.803 84.7 62.5 -65.0 -26.5 -3.4 -15.6 -3.1 67 99 A A G < S+ 0 0 19 -3,-1.5 -1,-0.3 -4,-0.4 400,-0.2 0.579 111.0 36.6 -73.3 -9.1 -6.7 -15.7 -1.2 68 100 A T G < S+ 0 0 123 -3,-2.0 2,-0.3 -4,-0.1 -1,-0.2 0.134 107.1 67.6-135.0 23.1 -5.6 -18.8 0.7 69 101 A R S < S- 0 0 46 -3,-0.7 396,-0.4 -4,-0.3 2,-0.2 -0.970 71.2-119.4-139.4 155.6 -1.9 -18.4 1.4 70 102 A E - 0 0 78 -2,-0.3 393,-0.2 1,-0.2 391,-0.1 -0.480 51.3 -79.2 -76.4 161.2 0.4 -16.3 3.5 71 103 A G - 0 0 5 391,-2.4 2,-0.2 -2,-0.2 -1,-0.2 -0.260 56.5-104.3 -55.9 146.1 3.1 -14.1 1.9 72 104 A Y - 0 0 117 -3,-0.1 2,-0.4 389,-0.1 390,-0.1 -0.482 35.8-169.7 -74.1 147.2 6.1 -16.1 0.9 73 105 A S + 0 0 53 -2,-0.2 2,-0.2 -3,-0.1 -3,-0.0 -0.978 24.1 126.9-134.7 147.9 9.2 -15.8 3.1 74 106 A G - 0 0 52 -2,-0.4 3,-0.3 1,-0.1 4,-0.1 -0.837 57.1-133.1 171.3 148.3 12.6 -17.3 2.1 75 107 A Y S > S+ 0 0 56 -2,-0.2 2,-1.2 1,-0.2 3,-0.6 0.910 90.4 85.5 -77.3 -46.4 16.3 -16.8 1.5 76 108 A G T 3 S+ 0 0 62 1,-0.3 6,-0.8 2,-0.1 -1,-0.2 -0.511 97.3 17.1 -94.1 74.9 16.2 -18.6 -1.9 77 109 A A T > + 0 0 36 -2,-1.2 3,-1.7 -3,-0.3 -1,-0.3 0.644 33.4 130.2 175.7 151.1 15.4 -16.0 -3.3 78 110 A E T < S+ 0 0 60 -3,-0.6 213,-0.2 1,-0.2 3,-0.1 0.520 102.0 73.8 -68.2 2.5 14.8 -12.4 -4.1 79 111 A Q T 3 S- 0 0 25 1,-0.3 26,-3.0 25,-0.1 -1,-0.2 0.521 121.4 -77.2 -88.9 -4.9 16.6 -13.5 -7.3 80 112 A G < - 0 0 3 -3,-1.7 -1,-0.3 24,-0.2 23,-0.1 -0.323 68.0 -48.9 124.2 152.2 13.5 -15.4 -8.5 81 113 A Q > - 0 0 49 1,-0.1 4,-2.8 -2,-0.1 3,-0.3 -0.283 49.5-130.4 -53.4 137.3 11.9 -18.7 -7.5 82 114 A G H > S+ 0 0 31 -6,-0.8 4,-2.7 1,-0.2 5,-0.2 0.874 106.1 55.5 -55.0 -42.4 14.5 -21.6 -7.4 83 115 A A H > S+ 0 0 57 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.909 110.5 44.6 -64.0 -34.9 12.3 -23.8 -9.5 84 116 A L H > S+ 0 0 2 -3,-0.3 4,-2.7 2,-0.2 5,-0.2 0.922 112.7 50.1 -74.8 -41.0 12.0 -21.2 -12.2 85 117 A R H X S+ 0 0 27 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.911 112.9 48.1 -61.4 -40.2 15.7 -20.4 -12.2 86 118 A E H X S+ 0 0 106 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.901 111.5 49.9 -63.8 -40.8 16.5 -24.1 -12.4 87 119 A A H X S+ 0 0 15 -4,-2.1 4,-2.5 -5,-0.2 5,-0.3 0.871 113.1 46.3 -67.4 -39.8 14.0 -24.5 -15.3 88 120 A V H X>S+ 0 0 1 -4,-2.7 4,-2.7 2,-0.2 5,-0.6 0.936 112.4 50.0 -64.9 -45.3 15.6 -21.6 -17.2 89 121 A A H X5S+ 0 0 5 -4,-2.6 4,-1.3 -5,-0.2 7,-0.2 0.908 117.7 40.6 -60.4 -43.9 19.1 -22.8 -16.5 90 122 A S H X5S+ 0 0 72 -4,-2.5 4,-0.7 3,-0.2 -2,-0.2 0.918 120.4 41.6 -70.4 -42.1 18.1 -26.4 -17.8 91 123 A T H <5S+ 0 0 59 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.891 130.6 21.4 -75.0 -43.5 16.0 -25.3 -20.7 92 124 A F H <5S+ 0 0 51 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.669 136.3 27.2-104.1 -15.8 18.0 -22.5 -22.1 93 125 A Y H > - 0 0 39 -2,-0.2 3,-2.1 1,-0.1 4,-0.3 -0.741 26.7-111.6-103.9 157.6 23.8 -22.4 -13.2 100 132 A A G > S+ 0 0 17 -2,-0.3 3,-1.6 1,-0.3 -1,-0.1 0.824 115.8 61.7 -56.5 -29.4 20.5 -21.5 -11.6 101 133 A D G 3 S+ 0 0 67 1,-0.3 -1,-0.3 3,-0.0 -15,-0.0 0.554 97.2 58.4 -78.9 -3.1 22.3 -19.0 -9.2 102 134 A E G < S+ 0 0 15 -3,-2.1 162,-2.3 -17,-0.1 2,-0.4 0.443 89.9 90.9 -95.0 -2.4 23.5 -17.0 -12.2 103 135 A I E < -B 263 0B 0 -3,-1.6 2,-0.5 -4,-0.3 160,-0.2 -0.807 55.5-169.8-101.9 132.7 19.8 -16.4 -13.3 104 136 A F E -B 262 0B 1 158,-2.7 158,-2.0 -2,-0.4 2,-0.3 -0.975 13.4-146.5-125.3 114.7 18.0 -13.3 -12.0 105 137 A I E +B 261 0B 2 -26,-3.0 186,-0.5 -2,-0.5 156,-0.2 -0.629 27.3 166.1 -82.1 134.1 14.2 -13.2 -12.7 106 138 A S E -B 260 0B 0 154,-2.7 154,-2.1 -2,-0.3 3,-0.1 -0.748 49.7-100.7-133.5-175.8 12.7 -9.8 -13.4 107 139 A D S S- 0 0 12 1,-0.3 2,-0.2 152,-0.3 152,-0.1 0.265 95.0 -24.0 -89.4 4.6 9.5 -8.1 -14.7 108 140 A G > - 0 0 0 150,-0.2 4,-1.7 1,-0.1 -1,-0.3 -0.654 56.1-107.6 157.9 154.6 11.0 -7.4 -18.1 109 141 A S H > S+ 0 0 1 150,-0.3 4,-2.5 2,-0.2 5,-0.2 0.825 111.3 58.6 -72.3 -32.0 14.2 -6.8 -20.1 110 142 A K H > S+ 0 0 14 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.923 107.6 48.8 -68.5 -35.7 13.8 -3.0 -20.6 111 143 A C H > S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.913 111.3 50.7 -68.7 -37.7 13.7 -2.6 -16.8 112 144 A D H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.892 106.7 53.4 -65.0 -39.2 16.8 -4.7 -16.5 113 145 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.932 109.7 48.5 -62.5 -43.3 18.7 -2.7 -19.2 114 146 A A H X S+ 0 0 8 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.918 112.7 47.7 -60.7 -38.4 18.0 0.5 -17.2 115 147 A R H X S+ 0 0 10 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.879 109.9 53.2 -70.6 -36.6 19.2 -1.2 -14.0 116 148 A I H X S+ 0 0 1 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.919 108.3 50.4 -59.9 -43.1 22.3 -2.5 -15.8 117 149 A Q H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.897 108.9 51.8 -65.5 -37.7 23.0 1.1 -16.9 118 150 A M H < S+ 0 0 9 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.902 109.9 50.1 -58.1 -45.8 22.6 2.3 -13.2 119 151 A M H < S+ 0 0 0 -4,-2.1 303,-0.3 1,-0.2 -2,-0.2 0.886 112.5 46.0 -67.0 -40.5 25.1 -0.4 -12.2 120 152 A F H < S- 0 0 7 -4,-2.4 3,-0.4 -5,-0.1 -2,-0.2 0.873 98.5-161.9 -69.7 -36.7 27.6 0.7 -14.8 121 153 A G < - 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0 0 2 -2,-0.5 16,-0.2 -11,-0.2 -326,-0.2 -0.556 37.9-108.8-125.6-175.3 13.0 -8.7 14.3 784 402 B T E -X 798 0J 0 14,-2.1 14,-2.8 -328,-0.2 2,-0.2 -0.996 28.4-120.1-121.3 139.3 14.9 -6.0 12.4 785 403 B P E > -X 797 0J 0 0, 0.0 3,-1.7 0, 0.0 4,-0.3 -0.470 14.6-134.2 -77.3 137.8 17.7 -3.9 14.0 786 404 B G G > S+ 0 0 0 10,-2.9 3,-2.3 1,-0.3 8,-0.3 0.826 101.9 66.0 -62.2 -27.6 17.1 -0.2 14.1 787 405 B S G > S+ 0 0 33 6,-0.4 3,-1.6 9,-0.3 -1,-0.3 0.745 87.4 69.9 -70.9 -17.0 20.6 0.6 12.9 788 406 B G G < S+ 0 0 17 -3,-1.7 -1,-0.3 1,-0.3 -355,-0.2 0.665 95.5 56.9 -67.6 -12.3 19.7 -1.0 9.5 789 407 B Y G < S- 0 0 2 -3,-2.3 -243,-2.5 1,-0.4 -1,-0.3 0.200 125.4 -78.4-103.7 16.8 17.4 2.1 9.1 790 408 B G X - 0 0 20 -3,-1.6 3,-2.1 -245,-0.2 4,-0.4 -0.444 62.2 -53.0 112.8 174.1 20.2 4.6 9.5 791 409 B P G > S+ 0 0 37 0, 0.0 3,-1.5 0, 0.0 -1,-0.2 0.868 130.2 51.7 -57.2 -43.7 22.3 6.2 12.2 792 410 B A G 3 S+ 0 0 27 1,-0.3 -5,-0.1 -3,-0.2 -2,-0.1 0.442 95.7 72.7 -78.0 4.1 19.4 7.4 14.3 793 411 B G G X S+ 0 0 0 -3,-2.1 3,-1.4 -7,-0.2 -6,-0.4 0.613 70.7 113.1 -85.7 -14.0 17.9 3.9 14.3 794 412 B E T < S+ 0 0 85 -3,-1.5 3,-0.1 -4,-0.4 0, 0.0 -0.296 70.6 34.1 -64.0 140.5 20.6 2.7 16.7 795 413 B G T 3 S+ 0 0 16 1,-0.3 -32,-3.0 -29,-0.2 2,-0.3 0.423 108.0 79.0 96.5 1.8 19.2 1.7 20.1 796 414 B F E < -W 762 0J 35 -3,-1.4 -10,-2.9 -34,-0.3 2,-0.3 -0.909 58.4-152.9-135.6 162.1 15.8 0.4 18.7 797 415 B V E -WX 761 785J 3 -36,-1.9 -36,-2.9 -2,-0.3 2,-0.4 -0.978 14.9-139.5-132.7 142.2 14.4 -2.7 17.0 798 416 B R E -WX 760 784J 3 -14,-2.8 -14,-2.1 -2,-0.3 2,-0.5 -0.856 12.3-164.5 -99.1 141.8 11.3 -2.9 14.7 799 417 B A E -W 759 0J 4 -40,-2.5 -40,-2.7 -2,-0.4 2,-0.2 -0.995 16.8-134.7-126.3 127.5 8.8 -5.7 14.9 800 418 B S E -W 758 0J 1 -344,-2.5 -42,-0.3 -2,-0.5 -341,-0.1 -0.564 6.6-153.5 -79.3 141.6 6.3 -6.2 12.1 801 419 B A + 0 0 0 -44,-2.8 2,-1.3 -2,-0.2 -43,-0.2 0.293 64.6 111.2 -88.5 0.8 2.7 -6.9 12.6 802 420 B F + 0 0 5 -45,-0.3 -341,-0.5 -345,-0.1 2,-0.3 -0.684 55.5 86.5 -81.4 99.7 2.3 -8.7 9.3 803 421 B G S S- 0 0 2 -2,-1.3 -340,-0.1 -343,-0.1 2,-0.1 -0.962 82.6 -69.2-177.2 169.7 1.7 -12.3 10.5 804 422 B S > - 0 0 10 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.387 42.6-116.4 -69.9 160.0 -1.0 -14.7 11.5 805 423 B R H > S+ 0 0 60 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.910 116.9 53.4 -66.0 -35.1 -2.8 -14.1 14.8 806 424 B E H > S+ 0 0 138 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.913 110.9 45.4 -65.7 -39.1 -1.4 -17.5 16.1 807 425 B N H > S+ 0 0 60 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.887 112.4 50.7 -71.5 -38.9 2.1 -16.4 15.3 808 426 B I H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.941 113.1 46.9 -60.0 -43.0 1.6 -13.0 16.8 809 427 B L H X S+ 0 0 93 -4,-2.6 4,-1.9 -5,-0.2 -2,-0.2 0.842 112.3 48.8 -70.2 -36.2 0.2 -14.6 20.0 810 428 B E H X S+ 0 0 58 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.896 109.8 52.6 -69.7 -40.1 3.1 -17.2 20.2 811 429 B A H X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 -2,-0.2 0.933 109.0 49.8 -57.2 -47.1 5.6 -14.4 19.7 812 430 B V H X S+ 0 0 9 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.901 110.2 50.5 -57.4 -43.3 4.0 -12.6 22.6 813 431 B R H X S+ 0 0 116 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.929 113.3 46.4 -59.9 -45.6 4.1 -15.8 24.8 814 432 B R H X S+ 0 0 27 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.915 111.3 49.9 -66.3 -38.6 7.8 -16.1 23.9 815 433 B F H X S+ 0 0 1 -4,-3.1 4,-2.7 2,-0.2 5,-0.4 0.871 110.7 50.4 -65.6 -39.5 8.6 -12.5 24.6 816 434 B K H X S+ 0 0 100 -4,-2.4 4,-1.8 -5,-0.2 -1,-0.2 0.915 110.3 51.0 -68.0 -35.9 6.9 -12.6 28.1 817 435 B E H < S+ 0 0 140 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.907 120.0 34.1 -66.3 -38.6 8.8 -15.7 29.0 818 436 B A H < S+ 0 0 26 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.890 136.7 17.2 -84.3 -36.1 12.2 -14.2 28.0 819 437 B Y H < 0 0 39 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.474 360.0 360.0-121.5 -5.9 11.7 -10.6 29.0 820 438 B G < 0 0 85 -4,-1.8 -3,-0.1 -5,-0.4 -4,-0.1 0.668 360.0 360.0 -85.0 360.0 8.7 -10.4 31.3