==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 10-MAY-05 1ZMO . COMPND 2 MOLECULE: HALOHYDRIN DEHALOGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARTHROBACTER SP. AD2; . AUTHOR R.M.DE JONG,K.H.KALK,L.TANG,D.B.JANSSEN,B.W.DIJKSTRA . 1944 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 62929.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1471 75.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 270 13.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 0.8 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 . 8 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 129 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 299 15.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 659 33.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 49 2.5 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 7 9 0 0 0 24 8 2 6 0 0 7 1 0 8 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 0 10 28 2 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 V 0 0 111 0, 0.0 25,-3.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 116.6 -2.0 25.7 24.2 2 3 A I E -ab 26 72A 10 69,-0.6 71,-2.2 23,-0.2 72,-1.1 -0.747 360.0-175.2-107.3 154.0 -0.1 22.7 25.3 3 4 A A E -ab 27 74A 0 23,-1.9 25,-2.3 -2,-0.3 2,-0.4 -0.959 19.2-137.4-133.5 151.0 1.3 19.7 23.4 4 5 A L E -ab 28 75A 0 70,-2.8 72,-2.6 -2,-0.3 2,-0.4 -0.948 16.5-170.9-111.3 133.7 3.0 16.7 25.0 5 6 A V E -ab 29 76A 0 23,-2.2 25,-3.3 -2,-0.4 3,-0.5 -0.990 10.5-149.9-125.1 129.4 6.2 15.2 23.4 6 7 A T S S+ 0 0 0 70,-2.0 25,-0.1 -2,-0.4 4,-0.1 -0.618 77.5 17.0 -96.4 161.7 7.6 11.9 24.6 7 8 A H S > S- 0 0 26 -2,-0.2 3,-3.6 1,-0.1 6,-0.4 0.803 77.3-177.5 44.2 40.8 11.3 10.9 24.5 8 9 A A T 3 S+ 0 0 1 22,-2.9 9,-0.2 -3,-0.5 23,-0.1 0.652 72.3 50.5 -36.8 -39.1 12.0 14.6 24.0 9 10 A R T 3 S+ 0 0 44 21,-0.2 2,-0.3 4,-0.2 -1,-0.3 0.433 106.6 66.7 -86.5 -0.1 15.8 14.1 23.7 10 11 A H S X S- 0 0 51 -3,-3.6 3,-2.8 -4,-0.1 2,-0.3 -0.857 98.1 -24.8-125.6 160.2 15.6 11.3 21.0 11 12 A F T 3 S- 0 0 5 -2,-0.3 4,-0.3 1,-0.3 172,-0.1 -0.249 128.9 -4.6 56.2-111.7 14.6 10.6 17.5 12 13 A A T 3> S+ 0 0 0 -2,-0.3 4,-2.7 1,-0.1 -1,-0.3 0.378 111.2 96.2 -97.4 3.1 12.0 13.1 16.3 13 14 A G H <> S+ 0 0 0 -3,-2.8 4,-3.4 -6,-0.4 5,-0.2 0.945 81.7 46.8 -59.4 -56.8 11.7 14.8 19.8 14 15 A P H > S+ 0 0 60 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.931 116.6 46.5 -53.4 -44.8 14.1 17.7 19.2 15 16 A A H > S+ 0 0 7 -4,-0.3 4,-2.1 1,-0.2 5,-0.2 0.936 114.6 46.5 -62.6 -45.0 12.5 18.5 15.9 16 17 A A H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.3 0.947 113.8 48.5 -62.4 -50.4 9.0 18.2 17.3 17 18 A V H X S+ 0 0 1 -4,-3.4 4,-2.2 -9,-0.2 5,-0.3 0.905 111.8 48.8 -57.1 -48.3 9.9 20.4 20.4 18 19 A E H X S+ 0 0 121 -4,-2.5 4,-1.7 -5,-0.2 -1,-0.2 0.908 115.4 42.8 -57.3 -48.5 11.5 23.1 18.3 19 20 A A H X S+ 0 0 16 -4,-2.1 4,-1.2 -5,-0.2 -2,-0.2 0.907 115.3 47.1 -71.3 -40.8 8.6 23.4 15.8 20 21 A L H ><>S+ 0 0 0 -4,-2.7 5,-2.4 -5,-0.2 3,-0.7 0.959 115.5 45.3 -65.2 -50.4 5.8 23.2 18.4 21 22 A T H ><5S+ 0 0 36 -4,-2.2 3,-1.2 -5,-0.3 -1,-0.2 0.850 112.0 53.7 -61.1 -35.8 7.4 25.8 20.7 22 23 A Q H 3<5S+ 0 0 141 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.766 105.6 54.7 -72.4 -23.7 8.2 27.9 17.6 23 24 A D T <<5S- 0 0 96 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.304 129.4 -92.8 -92.4 5.6 4.5 27.8 16.7 24 25 A G T < 5S+ 0 0 58 -3,-1.2 -3,-0.2 1,-0.3 2,-0.2 0.408 78.6 140.2 100.2 -3.0 3.3 29.1 20.1 25 26 A Y < - 0 0 24 -5,-2.4 2,-0.7 -6,-0.2 -1,-0.3 -0.486 52.7-134.6 -78.3 145.7 2.8 25.8 21.9 26 27 A T E -a 2 0A 56 -25,-3.3 -23,-1.9 -2,-0.2 2,-0.8 -0.865 33.8-151.0 -89.4 122.4 3.7 25.3 25.6 27 28 A V E -ac 3 50A 0 22,-2.6 24,-1.5 -2,-0.7 2,-0.4 -0.839 12.9-160.1-110.2 108.6 5.3 21.9 25.2 28 29 A V E -ac 4 51A 0 -25,-2.3 -23,-2.2 -2,-0.8 2,-0.4 -0.654 22.1-155.7 -79.1 131.2 5.3 19.5 28.0 29 30 A C E -ac 5 52A 0 22,-3.3 24,-2.6 -2,-0.4 2,-0.3 -0.915 15.2-159.3-121.0 142.3 8.1 16.9 27.5 30 31 A H + 0 0 2 -25,-3.3 -22,-2.9 -2,-0.4 2,-0.3 -0.820 23.0 151.7-109.9 146.1 8.7 13.4 28.6 31 32 A D > - 0 0 2 24,-0.4 3,-1.9 22,-0.3 4,-0.2 -0.879 50.1-121.8-171.2 140.5 12.2 11.7 28.7 32 33 A A G > S+ 0 0 37 1,-0.3 3,-1.1 -2,-0.3 4,-0.1 0.783 112.5 60.0 -59.0 -26.8 13.8 9.0 30.7 33 34 A S G > S+ 0 0 34 1,-0.2 3,-1.4 2,-0.1 -1,-0.3 0.629 86.3 77.6 -77.7 -11.5 16.5 11.4 31.8 34 35 A F G < + 0 0 2 -3,-1.9 -1,-0.2 1,-0.3 6,-0.2 0.544 66.6 85.1 -76.1 -5.5 13.9 13.7 33.4 35 36 A A G < S+ 0 0 5 -3,-1.1 2,-0.5 -4,-0.2 -1,-0.3 0.823 81.6 78.2 -61.7 -23.8 13.7 11.4 36.4 36 37 A D S <> S- 0 0 3 -3,-1.4 4,-1.8 1511,-0.2 1611,-0.2 -0.730 77.8-150.4 -87.2 121.9 16.7 13.6 37.4 37 38 A A H > S+ 0 0 29 1609,-2.9 4,-1.9 -2,-0.5 5,-0.2 0.883 96.8 55.3 -59.6 -38.4 15.7 17.0 38.7 38 39 A A H > S+ 0 0 6 1,-0.2 4,-2.3 1608,-0.2 -1,-0.2 0.893 106.7 50.6 -62.9 -40.1 18.8 18.6 37.5 39 40 A E H > S+ 0 0 62 -6,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.845 107.9 52.3 -67.3 -35.4 18.2 17.3 33.9 40 41 A R H X S+ 0 0 43 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.898 110.8 47.5 -68.0 -38.2 14.7 18.7 33.9 41 42 A Q H X S+ 0 0 116 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.886 112.0 50.5 -70.6 -33.4 16.1 22.1 35.0 42 43 A R H X S+ 0 0 26 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.854 110.4 49.9 -72.1 -32.8 18.8 21.9 32.3 43 44 A F H X S+ 0 0 29 -4,-2.0 4,-1.4 2,-0.2 -2,-0.2 0.930 110.0 48.2 -70.1 -46.1 16.3 21.0 29.5 44 45 A E H < S+ 0 0 68 -4,-2.0 6,-0.3 1,-0.2 -1,-0.2 0.850 112.1 51.6 -62.2 -35.0 13.8 23.8 30.3 45 46 A S H < S+ 0 0 59 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.877 114.7 41.2 -69.0 -42.6 16.8 26.3 30.4 46 47 A E H < S+ 0 0 72 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.625 121.7 45.6 -80.6 -14.7 18.0 25.1 27.0 47 48 A N S >< S- 0 0 50 -4,-1.4 3,-1.1 -5,-0.1 -1,-0.2 -0.596 75.9-161.8-131.6 72.6 14.4 24.9 25.6 48 49 A P T 3 S+ 0 0 101 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.193 79.4 40.9 -53.0 143.5 12.3 28.0 26.5 49 50 A G T 3 S+ 0 0 45 1,-0.3 -22,-2.6 -5,-0.1 2,-0.3 0.508 97.7 106.9 93.2 4.9 8.6 27.3 26.1 50 51 A T E < -c 27 0A 13 -3,-1.1 2,-0.4 -6,-0.3 -1,-0.3 -0.828 51.3-160.2-119.7 156.7 8.9 23.7 27.7 51 52 A I E -c 28 0A 43 -24,-1.5 -22,-3.3 -2,-0.3 2,-0.5 -0.998 20.1-145.9-130.1 125.7 8.0 22.0 30.9 52 53 A A E -c 29 0A 7 -2,-0.4 2,-0.3 -24,-0.2 -22,-0.2 -0.867 13.2-143.6 -97.8 129.5 9.9 18.8 31.6 53 54 A L - 0 0 8 -24,-2.6 -22,-0.3 -2,-0.5 -19,-0.1 -0.666 10.6-152.7 -91.6 148.3 7.9 16.1 33.4 54 55 A A + 0 0 17 -2,-0.3 -1,-0.1 -24,-0.1 -23,-0.1 0.823 63.8 110.5 -85.2 -33.3 9.4 13.8 36.0 55 56 A E + 0 0 37 1,-0.1 -24,-0.4 5,-0.1 -2,-0.1 -0.055 40.3 179.9 -52.3 136.3 6.8 11.1 35.3 56 57 A Q + 0 0 63 -26,-0.1 -1,-0.1 -21,-0.1 5,-0.1 0.504 48.3 98.9-114.3 -12.1 8.1 7.9 33.5 57 58 A K >> - 0 0 79 1,-0.1 3,-1.8 2,-0.0 4,-0.7 -0.692 65.3-141.8 -86.1 130.0 5.0 5.7 33.2 58 59 A P G >4 S+ 0 0 15 0, 0.0 3,-0.6 0, 0.0 4,-0.4 0.845 101.6 49.2 -53.2 -42.3 3.2 5.8 29.8 59 60 A E G 34 S+ 0 0 61 1,-0.2 4,-0.2 2,-0.1 -2,-0.0 0.433 110.9 52.2 -78.6 -4.1 -0.3 5.7 31.3 60 61 A R G <> S+ 0 0 97 -3,-1.8 4,-1.8 2,-0.1 -1,-0.2 0.483 84.8 83.2-110.9 -2.6 0.5 8.5 33.7 61 62 A L H S+ 0 0 2 -4,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.941 112.7 43.2 -62.0 -44.5 -1.5 12.7 30.3 63 64 A D H 4 S+ 0 0 104 2,-0.2 4,-0.4 -4,-0.2 -1,-0.2 0.879 112.8 52.6 -66.7 -38.5 -2.4 13.3 34.0 64 65 A A H >< S+ 0 0 22 -4,-1.8 3,-0.9 1,-0.2 -2,-0.2 0.920 112.0 47.5 -61.9 -40.5 1.1 14.7 34.7 65 66 A T H >< S+ 0 0 0 -4,-2.8 3,-2.6 1,-0.2 -2,-0.2 0.869 100.9 62.0 -68.7 -41.7 0.6 17.0 31.7 66 67 A L G >< S+ 0 0 40 -4,-2.3 3,-0.6 1,-0.3 -1,-0.2 0.566 87.8 73.9 -64.2 -7.5 -2.9 18.2 32.7 67 68 A Q G < S+ 0 0 150 -3,-0.9 -1,-0.3 -4,-0.4 -2,-0.2 0.701 100.2 47.6 -75.0 -15.7 -1.3 19.6 35.9 68 69 A H G < S+ 0 0 83 -3,-2.6 2,-0.3 -4,-0.2 -1,-0.2 0.323 125.0 1.0-107.6 7.3 0.1 22.3 33.5 69 70 A G S < S- 0 0 29 -3,-0.6 3,-0.1 -4,-0.1 -1,-0.1 -0.966 71.9-103.8-173.3 176.8 -3.0 23.3 31.5 70 71 A E S S+ 0 0 185 -2,-0.3 2,-0.3 1,-0.2 -4,-0.1 0.686 98.3 5.7 -89.4 -19.7 -6.7 22.6 31.2 71 72 A A - 0 0 42 -6,-0.1 2,-0.6 -3,-0.0 -69,-0.6 -0.993 66.3-119.3-159.1 162.3 -6.3 20.4 28.0 72 73 A I E -b 2 0A 6 -2,-0.3 -69,-0.2 1,-0.2 3,-0.1 -0.933 19.6-176.3-111.3 114.7 -3.8 18.8 25.6 73 74 A D E S+ 0 0 34 -71,-2.2 54,-1.7 -2,-0.6 2,-0.3 0.888 71.0 14.9 -72.9 -43.1 -4.1 20.1 22.0 74 75 A T E -bd 3 127A 0 -72,-1.1 -70,-2.8 52,-0.2 2,-0.4 -0.994 55.4-166.7-140.5 142.6 -1.5 17.7 20.6 75 76 A I E -bd 4 128A 1 52,-2.0 54,-2.7 -2,-0.3 2,-0.6 -0.988 5.3-164.1-127.2 134.4 0.5 14.6 21.5 76 77 A V E -bd 5 129A 0 -72,-2.6 -70,-2.0 -2,-0.4 2,-1.4 -0.981 9.5-156.7-117.7 108.3 3.6 13.4 19.7 77 78 A S E - d 0 130A 0 52,-2.0 54,-2.4 -2,-0.6 2,-1.3 -0.767 14.4-174.7 -87.9 89.8 4.2 9.8 20.7 78 79 A N + 0 0 0 -2,-1.4 -65,-0.2 52,-0.2 2,-0.2 -0.457 11.5 179.4 -90.4 62.1 7.9 9.8 19.8 79 80 A D + 0 0 0 -2,-1.3 2,-0.3 52,-0.4 26,-0.1 -0.400 5.8 158.9 -70.3 132.9 8.7 6.1 20.4 80 81 A Y - 0 0 35 24,-0.2 -73,-0.0 -2,-0.2 -2,-0.0 -0.928 34.5-142.4-147.9 170.0 12.1 4.7 19.9 81 82 A I - 0 0 3 -2,-0.3 5,-0.3 24,-0.1 20,-0.0 -0.990 41.5-104.2-135.1 129.1 14.5 1.9 20.6 82 83 A P > - 0 0 53 0, 0.0 3,-1.5 0, 0.0 4,-0.4 -0.162 53.4 -69.0 -55.3 142.5 18.2 2.7 21.1 83 84 A R T 3 S+ 0 0 115 1,-0.3 101,-0.0 2,-0.2 0, 0.0 -0.426 112.1 18.4 -74.6 144.7 20.7 1.9 18.4 84 85 A P T > S+ 0 0 100 0, 0.0 3,-1.7 0, 0.0 -1,-0.3 -0.873 106.9 79.4 -94.7 23.3 21.8 -0.6 17.3 85 86 A M G X S+ 0 0 33 -3,-1.5 3,-1.9 1,-0.3 -2,-0.2 0.794 83.0 71.4 -56.9 -28.2 18.9 -2.7 18.8 86 87 A N G 3 S+ 0 0 16 -4,-0.4 60,-0.5 1,-0.3 59,-0.3 0.811 98.4 48.5 -56.8 -29.8 16.7 -1.6 15.9 87 88 A R G < S+ 0 0 134 -3,-1.7 -1,-0.3 56,-0.1 -2,-0.2 0.146 77.3 142.5 -97.8 15.8 18.8 -3.9 13.6 88 89 A L < - 0 0 32 -3,-1.9 57,-0.4 9,-0.1 58,-0.3 -0.381 43.8-140.7 -58.4 131.3 18.6 -6.9 15.9 89 90 A P - 0 0 75 0, 0.0 4,-0.2 0, 0.0 53,-0.1 -0.266 17.2-111.7 -84.6 179.4 18.3 -10.0 13.7 90 91 A L S > S+ 0 0 13 2,-0.1 3,-1.0 -2,-0.1 2,-0.1 0.963 94.5 72.7 -77.2 -52.8 16.0 -13.0 14.5 91 92 A E T 3 S+ 0 0 84 1,-0.2 3,-0.1 -3,-0.0 268,-0.1 -0.395 109.0 8.6 -66.5 135.0 18.6 -15.6 15.2 92 93 A G T 3 S+ 0 0 83 1,-0.3 2,-0.3 -2,-0.1 -1,-0.2 0.154 91.4 130.7 85.6 -19.8 20.5 -15.3 18.4 93 94 A T < - 0 0 9 -3,-1.0 -1,-0.3 -4,-0.2 265,-0.0 -0.530 57.0-121.8 -72.8 129.1 18.4 -12.5 19.8 94 95 A S > - 0 0 45 -2,-0.3 4,-1.9 1,-0.1 5,-0.1 -0.182 14.7-117.0 -67.9 163.3 17.2 -13.1 23.3 95 96 A E H > S+ 0 0 84 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.859 115.2 59.1 -66.4 -36.3 13.6 -13.2 24.4 96 97 A A H > S+ 0 0 60 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.914 105.9 46.4 -61.9 -43.5 14.2 -10.2 26.6 97 98 A D H > S+ 0 0 33 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.852 110.2 54.0 -69.0 -33.9 15.3 -8.1 23.6 98 99 A I H X S+ 0 0 1 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.953 111.4 45.3 -63.0 -45.7 12.3 -9.2 21.6 99 100 A R H X S+ 0 0 78 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.901 110.5 53.4 -65.7 -40.6 10.0 -8.2 24.4 100 101 A Q H X S+ 0 0 79 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.851 103.6 57.6 -60.7 -37.8 11.8 -4.8 24.9 101 102 A M H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 5,-0.2 0.965 113.7 38.6 -55.2 -53.3 11.3 -4.1 21.1 102 103 A F H X>S+ 0 0 6 -4,-1.8 5,-2.8 2,-0.2 4,-1.9 0.875 113.5 55.3 -67.3 -37.5 7.5 -4.4 21.6 103 104 A E H <>S+ 0 0 71 -4,-2.9 5,-1.8 3,-0.2 -2,-0.2 0.919 115.8 38.9 -60.3 -44.6 7.4 -2.7 25.0 104 105 A A H <5S+ 0 0 19 -4,-2.5 -24,-0.2 -5,-0.2 -2,-0.2 0.888 128.8 27.0 -76.7 -36.4 9.2 0.4 23.5 105 106 A L H <5S+ 0 0 1 -4,-2.2 -3,-0.2 -5,-0.3 -2,-0.2 0.521 135.1 17.7-107.6 -2.7 7.5 0.7 20.1 106 107 A S T X5S+ 0 0 0 -4,-1.9 4,-1.3 -5,-0.2 -3,-0.2 0.698 122.2 39.9-131.9 -52.7 4.2 -0.9 20.7 107 108 A I H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.870 110.9 51.5 -66.7 -32.9 2.2 3.9 22.7 110 111 A I H X S+ 0 0 1 -4,-1.3 4,-2.8 1,-0.2 5,-0.2 0.926 111.3 49.1 -63.5 -44.2 -1.0 1.9 23.3 111 112 A L H X S+ 0 0 8 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.888 111.7 48.3 -66.2 -34.3 -0.8 2.6 27.0 112 113 A L H X S+ 0 0 1 -4,-2.1 4,-0.9 -5,-0.2 3,-0.4 0.997 115.7 43.6 -65.6 -61.5 -0.2 6.3 26.3 113 114 A L H >X S+ 0 0 2 -4,-2.4 4,-1.2 1,-0.2 3,-1.1 0.876 109.0 56.9 -47.3 -49.1 -3.2 6.5 23.8 114 115 A Q H >< S+ 0 0 38 -4,-2.8 3,-0.7 1,-0.3 4,-0.5 0.923 109.5 46.5 -51.5 -46.1 -5.5 4.5 26.0 115 116 A S H 3< S+ 0 0 34 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.586 109.2 56.0 -73.7 -14.1 -5.1 6.9 28.9 116 117 A A H S+ 0 0 55 -4,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.903 119.7 38.3 -51.0 -51.3 -11.2 10.2 28.0 119 120 A P H > S+ 0 0 45 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.818 116.3 50.6 -70.4 -34.5 -9.6 13.7 28.6 120 121 A L H <>S+ 0 0 4 -4,-2.1 5,-2.2 2,-0.2 4,-0.2 0.892 115.1 44.5 -69.4 -43.9 -8.9 14.4 24.9 121 122 A R H ><5S+ 0 0 81 -4,-2.8 3,-1.9 -5,-0.3 -3,-0.2 0.924 110.0 53.9 -64.8 -49.4 -12.6 13.5 24.1 122 123 A A H 3<5S+ 0 0 88 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.830 106.1 55.5 -56.2 -29.6 -14.0 15.5 27.0 123 124 A A T 3<5S- 0 0 56 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.557 123.4-104.2 -83.5 -4.7 -12.0 18.5 25.7 124 125 A G T < 5S- 0 0 56 -3,-1.9 -3,-0.2 -4,-0.2 2,-0.2 0.442 74.4 -48.8 99.4 -0.0 -13.6 18.3 22.3 125 126 A G < - 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j 01944V 0 60,-3.5 62,-2.0 -2,-0.5 2,-0.1 -0.757 14.6-171.2-112.1 87.1 39.6 -14.4 48.3 1884 177 H P E + j 01945V 6 0, 0.0 -42,-1.7 0, 0.0 2,-0.3 -0.375 16.7 162.2 -79.7 150.8 43.1 -15.8 48.6 1885 178 H N S S+ 0 0 17 60,-1.8 33,-0.1 -44,-0.2 64,-0.1 -0.911 72.9 19.2-153.2 149.0 46.2 -14.4 50.2 1886 179 H F S S+ 0 0 15 -2,-0.3 32,-2.9 1,-0.2 2,-0.6 0.843 86.0 148.7 56.9 37.0 49.3 -16.4 51.3 1887 180 H F B -k 1918 0W 2 30,-0.3 2,-0.4 2,-0.0 6,-0.4 -0.903 55.2-121.6-106.1 116.5 48.2 -19.1 48.9 1888 181 H N + 0 0 39 30,-1.9 7,-0.0 -2,-0.6 3,-0.0 -0.434 58.5 140.9 -59.0 111.0 51.0 -21.0 47.2 1889 182 H N B > -L 1893 0X 8 4,-1.0 4,-1.1 -2,-0.4 -169,-0.1 -0.981 63.6-108.8-153.4 150.6 50.4 -20.4 43.5 1890 183 H P T 4 S+ 0 0 70 0, 0.0 -170,-0.1 0, 0.0 -172,-0.1 0.782 110.6 46.3 -57.8 -27.6 52.6 -19.7 40.6 1891 184 H T T 4 S+ 0 0 16 2,-0.1 -100,-0.2 -172,-0.1 -3,-0.1 0.952 127.3 11.0 -84.5 -49.1 51.6 -16.0 40.2 1892 185 H Y T 4 S+ 0 0 19 -5,-0.2 -4,-0.1 1,-0.2 -1,-0.1 0.780 137.5 18.3-103.5 -28.1 51.7 -14.5 43.7 1893 186 H F B < S-L 1889 0X 33 -4,-1.1 -4,-1.0 -6,-0.4 -1,-0.2 -0.517 75.0-180.0-143.2 69.0 53.4 -16.9 46.1 1894 187 H P >> - 0 0 21 0, 0.0 4,-1.6 0, 0.0 3,-0.8 -0.326 41.5-110.9 -70.1 158.9 55.4 -19.5 44.1 1895 188 H T H 3> S+ 0 0 90 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.851 117.1 63.7 -56.8 -38.6 57.3 -22.2 45.8 1896 189 H S H 3> S+ 0 0 72 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.906 103.1 50.4 -55.4 -42.3 60.6 -20.6 44.8 1897 190 H D H <> S+ 0 0 42 -3,-0.8 4,-2.9 2,-0.2 -1,-0.2 0.944 111.0 46.1 -60.9 -49.9 59.6 -17.6 46.9 1898 191 H W H < S+ 0 0 80 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.853 115.2 49.0 -63.6 -32.8 58.8 -19.6 50.0 1899 192 H E H < S+ 0 0 55 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.823 126.7 21.2 -75.5 -34.2 62.0 -21.6 49.6 1900 193 H N H < S+ 0 0 127 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.644 101.2 81.9-114.3 -13.4 64.3 -18.7 49.1 1901 194 H N >X - 0 0 59 -4,-2.9 4,-1.5 -5,-0.2 3,-1.4 -0.748 47.3-172.5-102.8 95.2 62.8 -15.5 50.5 1902 195 H P H 3> S+ 0 0 95 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.859 85.1 64.5 -45.2 -43.7 63.3 -15.1 54.3 1903 196 H E H 3> S+ 0 0 150 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.856 100.8 48.1 -51.7 -43.4 61.0 -12.1 54.2 1904 197 H L H <> S+ 0 0 18 -3,-1.4 4,-2.9 -7,-0.2 5,-0.3 0.947 110.7 51.2 -66.6 -45.2 58.0 -14.1 53.1 1905 198 H R H X S+ 0 0 116 -4,-1.5 4,-2.6 1,-0.2 -2,-0.2 0.898 110.9 49.8 -56.1 -40.9 58.6 -16.7 55.8 1906 199 H E H X S+ 0 0 39 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.930 110.8 48.2 -63.6 -48.9 58.8 -13.9 58.4 1907 200 H R H X S+ 0 0 25 -4,-2.3 4,-4.0 2,-0.2 5,-0.3 0.922 114.4 46.5 -58.8 -47.1 55.5 -12.3 57.2 1908 201 H V H X S+ 0 0 1 -4,-2.9 4,-2.0 1,-0.2 7,-0.3 0.919 112.2 49.8 -63.0 -41.2 53.7 -15.7 57.3 1909 202 H D H < S+ 0 0 104 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.886 119.2 40.6 -65.8 -33.2 55.1 -16.5 60.7 1910 203 H R H < S+ 0 0 166 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.928 129.7 19.3 -81.6 -45.5 54.0 -13.1 61.8 1911 204 H D H < S+ 0 0 73 -4,-4.0 -3,-0.2 -5,-0.2 -2,-0.2 0.593 101.6 77.7-111.0 -3.1 50.6 -12.7 60.2 1912 205 H V >< - 0 0 1 -4,-2.0 3,-2.1 -5,-0.3 36,-0.1 -0.879 55.7-161.1-108.2 106.9 49.1 -16.1 59.1 1913 206 H P T 3 S+ 0 0 10 0, 0.0 35,-0.2 0, 0.0 -1,-0.2 0.876 95.2 60.2 -52.3 -36.0 47.7 -18.0 62.1 1914 207 H L T 3 S- 0 0 22 33,-2.3 34,-0.1 32,-0.2 33,-0.1 0.814 101.6-143.6 -61.5 -29.1 47.9 -21.1 60.0 1915 208 H G < + 0 0 23 -3,-2.1 2,-0.3 -7,-0.3 -1,-0.1 0.562 66.1 60.6 78.4 8.8 51.6 -20.4 59.8 1916 209 H R S S- 0 0 68 -8,-0.1 -1,-0.2 31,-0.1 -2,-0.1 -0.953 92.7 -81.2-155.1 170.4 52.1 -21.6 56.2 1917 210 H L - 0 0 16 -2,-0.3 -30,-0.3 1,-0.1 2,-0.2 -0.401 53.8-104.5 -71.2 151.2 51.1 -20.9 52.7 1918 211 H G B -k 1887 0W 4 -32,-2.9 -30,-1.9 27,-0.2 -1,-0.1 -0.605 41.8-119.4 -75.6 142.0 47.7 -22.4 51.7 1919 212 H R >> - 0 0 124 -2,-0.2 4,-1.9 -32,-0.1 3,-0.7 -0.522 8.8-122.8 -85.2 154.1 48.2 -25.5 49.5 1920 213 H P H 3> S+ 0 0 56 0, 0.0 4,-3.6 0, 0.0 5,-0.2 0.934 114.0 54.9 -58.4 -39.4 46.9 -25.9 45.9 1921 214 H D H 3> S+ 0 0 67 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.814 105.5 53.8 -63.9 -27.0 45.0 -29.1 46.9 1922 215 H E H <> S+ 0 0 1 -3,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.903 110.4 44.5 -73.4 -39.2 43.3 -27.1 49.6 1923 216 H M H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 5,-0.2 0.954 113.8 52.3 -68.9 -39.6 42.2 -24.5 47.1 1924 217 H G H X S+ 0 0 0 -4,-3.6 4,-2.5 -5,-0.2 5,-0.3 0.928 107.6 52.4 -59.7 -41.3 41.2 -27.5 44.9 1925 218 H A H X S+ 0 0 4 -4,-2.7 4,-2.1 -723,-0.3 -1,-0.2 0.941 109.8 47.4 -57.2 -50.7 39.2 -28.9 47.8 1926 219 H L H X S+ 0 0 3 -4,-2.2 4,-2.6 -724,-0.2 5,-0.3 0.945 113.4 48.4 -57.1 -46.5 37.2 -25.8 48.3 1927 220 H I H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.941 113.3 45.6 -60.3 -45.0 36.5 -25.4 44.5 1928 221 H T H X S+ 0 0 9 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.819 111.2 55.0 -70.4 -30.7 35.4 -29.0 44.1 1929 222 H F H X>S+ 0 0 13 -4,-2.1 5,-0.7 -5,-0.3 4,-0.6 0.982 112.5 41.3 -65.4 -52.3 33.2 -28.7 47.3 1930 223 H L H ><5S+ 0 0 4 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.924 110.7 59.7 -59.8 -42.4 31.4 -25.6 46.0 1931 224 H A H 3<5S+ 0 0 0 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.874 96.8 61.1 -55.4 -38.8 31.2 -27.3 42.5 1932 225 H S H 3<5S- 0 0 49 -4,-1.9 -1,-0.3 -3,-0.3 -2,-0.2 0.678 94.1-144.0 -60.8 -23.3 29.3 -30.3 44.0 1933 226 H R T X<5 + 0 0 84 -3,-1.7 3,-1.1 -4,-0.6 -3,-0.1 0.687 59.3 132.4 65.4 12.9 26.5 -27.9 45.1 1934 227 H R T 3 S+ 0 0 4 -6,-0.3 3,-2.4 -742,-0.1 -1,-0.3 -0.228 72.5 155.7-120.2 43.1 26.0 -26.9 50.4 1936 229 H A G X + 0 0 5 -3,-1.1 3,-2.1 1,-0.3 -1,-0.1 0.724 58.7 74.9 -40.4 -39.8 24.0 -24.6 48.1 1937 230 H P G 3 S+ 0 0 2 0, 0.0 -722,-2.2 0, 0.0 -723,-1.1 0.644 85.9 64.7 -58.7 -8.6 22.7 -22.4 51.0 1938 231 H I G X S+ 0 0 4 -3,-2.4 3,-0.6 -725,-0.2 -726,-0.2 0.277 77.2 132.5 -94.9 13.6 26.1 -20.7 51.2 1939 232 H V T < + 0 0 1 -3,-2.1 -723,-0.4 1,-0.2 -725,-0.2 -0.241 53.6 32.7 -58.9 150.4 25.7 -19.3 47.8 1940 233 H G T 3 S+ 0 0 1 -61,-3.2 2,-0.3 1,-0.2 -1,-0.2 0.619 91.4 104.6 80.0 22.2 26.5 -15.6 47.1 1941 234 H Q < - 0 0 14 -3,-0.6 -60,-2.1 -62,-0.3 2,-0.4 -0.822 67.2-110.9-131.1 169.4 29.3 -14.8 49.5 1942 235 H F E -j 1881 0V 20 -2,-0.3 2,-0.5 -62,-0.2 -60,-0.2 -0.797 25.3-156.8 -97.7 128.7 33.0 -14.2 49.7 1943 236 H F E -j 1882 0V 4 -62,-2.8 -60,-3.5 -2,-0.4 2,-0.2 -0.951 14.7-134.9-108.3 125.1 35.2 -16.9 51.4 1944 237 H A E -j 1883 0V 6 -2,-0.5 2,-0.1 -62,-0.2 3,-0.1 -0.584 17.1-171.3 -70.1 143.7 38.6 -15.7 52.8 1945 238 H F E +j 1884 0V 1 -62,-2.0 -60,-1.8 -2,-0.2 -739,-0.2 -0.643 50.3 111.9-130.5 69.9 41.4 -18.3 51.8 1946 239 H T S > S- 0 0 3 -741,-1.0 3,-1.5 -62,-0.2 -32,-0.2 0.247 86.5-109.8-132.2 16.0 44.1 -16.8 53.9 1947 240 H G T 3 S- 0 0 3 -742,-2.2 -33,-2.3 1,-0.3 -32,-0.2 0.742 86.6 -45.6 60.8 22.5 44.9 -19.2 56.7 1948 241 H G T 3 S+ 0 0 1 -743,-0.6 -1,-0.3 -741,-0.2 -742,-0.1 0.342 108.1 117.6 104.5 -9.7 43.4 -16.9 59.3 1949 242 H Y < + 0 0 61 -3,-1.5 -2,-0.1 -64,-0.1 -37,-0.1 0.895 67.2 84.6 -55.5 -41.2 45.0 -13.6 58.1 1950 243 H L 0 0 16 1,-0.3 -2,-0.2 -65,-0.1 -4,-0.2 -0.824 360.0 360.0-105.1 150.6 41.4 -12.5 57.4 1951 244 H P 0 0 59 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.993 360.0 360.0 -74.2 360.0 39.2 -11.3 59.1