==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 14-MAY-10 2XEE . COMPND 2 MOLECULE: NI3C DARPIN MUTANT5; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; . AUTHOR M.KRAMER,S.K.WETZEL,A.PLUCKTHUN,P.MITTL,M.GRUTTER . 628 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26920.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 436 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 16 2.5 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 . 33 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 275 43.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 35 5.6 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 0 6 10 10 10 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 13 A D > 0 0 139 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 118.5 33.6 -35.2 63.6 2 14 A L H > + 0 0 64 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.774 360.0 62.6 -69.4 -28.4 33.5 -35.4 59.8 3 15 A G H > S+ 0 0 11 2,-0.2 4,-1.6 1,-0.2 3,-0.2 0.961 103.6 44.6 -62.2 -55.3 31.0 -32.6 59.5 4 16 A K H > S+ 0 0 156 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.886 114.9 50.1 -57.2 -42.1 33.1 -29.8 61.0 5 17 A K H X S+ 0 0 120 -4,-1.3 4,-2.4 1,-0.2 -1,-0.2 0.816 106.9 54.2 -68.8 -31.6 36.1 -31.0 59.0 6 18 A L H X S+ 0 0 0 -4,-1.7 4,-1.5 -3,-0.2 -1,-0.2 0.817 108.6 50.3 -71.0 -31.1 34.1 -30.9 55.8 7 19 A L H X S+ 0 0 18 -4,-1.6 4,-1.4 2,-0.2 -2,-0.2 0.896 112.6 45.7 -70.8 -43.0 33.1 -27.3 56.5 8 20 A E H X S+ 0 0 106 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.915 115.4 45.7 -66.4 -44.7 36.7 -26.3 57.1 9 21 A A H X>S+ 0 0 0 -4,-2.4 5,-3.0 1,-0.2 4,-0.8 0.841 110.1 55.9 -68.0 -33.2 38.0 -28.1 54.0 10 22 A A H <5S+ 0 0 0 -4,-1.5 -1,-0.2 3,-0.2 -2,-0.2 0.840 113.9 37.4 -69.3 -35.6 35.1 -26.7 51.9 11 23 A R H <5S+ 0 0 107 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.794 114.4 53.8 -88.5 -30.6 35.9 -23.1 52.6 12 24 A A H <5S- 0 0 48 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.603 113.7-117.8 -78.0 -11.9 39.7 -23.4 52.7 13 25 A G T <5 + 0 0 22 -4,-0.8 2,-1.1 1,-0.2 -3,-0.2 0.859 56.2 158.2 79.3 38.2 39.4 -24.9 49.2 14 26 A Q >< + 0 0 67 -5,-3.0 4,-2.0 1,-0.2 -1,-0.2 -0.731 13.1 177.7 -99.0 87.6 40.9 -28.3 50.1 15 27 A D H > S+ 0 0 43 -2,-1.1 4,-2.8 1,-0.2 3,-0.3 0.936 77.0 47.7 -54.5 -59.1 39.6 -30.6 47.3 16 28 A D H > S+ 0 0 114 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.864 111.6 51.2 -55.8 -40.7 41.3 -33.9 48.3 17 29 A E H > S+ 0 0 87 2,-0.2 4,-2.9 1,-0.2 -1,-0.3 0.889 111.2 49.7 -62.8 -39.0 40.2 -33.4 52.0 18 30 A V H X S+ 0 0 1 -4,-2.0 4,-2.6 -3,-0.3 -2,-0.2 0.943 111.8 46.4 -63.3 -49.7 36.7 -32.9 50.7 19 31 A R H X S+ 0 0 74 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.886 116.6 45.6 -61.7 -39.8 36.7 -36.0 48.5 20 32 A I H X S+ 0 0 102 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.935 112.2 49.6 -69.4 -48.7 38.2 -38.1 51.3 21 33 A L H <>S+ 0 0 14 -4,-2.9 5,-1.4 1,-0.2 3,-0.3 0.939 112.9 47.9 -54.4 -50.0 35.8 -36.7 54.0 22 34 A M H ><5S+ 0 0 47 -4,-2.6 3,-1.5 1,-0.2 -1,-0.2 0.867 107.7 55.8 -60.2 -38.8 32.8 -37.5 51.7 23 35 A A H 3<5S+ 0 0 83 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.860 103.8 55.0 -61.7 -35.6 34.2 -40.9 51.0 24 36 A N T 3<5S- 0 0 112 -4,-1.9 -1,-0.3 -3,-0.3 -2,-0.2 0.131 132.7 -90.4 -87.0 21.7 34.2 -41.6 54.7 25 37 A G T < 5 + 0 0 62 -3,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.838 62.5 175.5 77.7 36.1 30.6 -40.7 55.0 26 38 A A < - 0 0 9 -5,-1.4 2,-0.6 -8,-0.1 -1,-0.2 -0.558 38.9-110.6 -73.9 134.9 30.8 -37.0 55.7 27 39 A D > - 0 0 97 -2,-0.3 3,-1.2 1,-0.2 -1,-0.1 -0.544 25.0-163.0 -69.2 113.0 27.5 -35.2 55.9 28 40 A V T 3 S+ 0 0 19 -2,-0.6 11,-0.4 1,-0.3 -1,-0.2 0.729 90.1 53.6 -71.1 -22.3 27.3 -33.0 52.8 29 41 A N T 3 S+ 0 0 64 8,-0.1 -1,-0.3 30,-0.1 2,-0.2 -0.120 80.0 148.6-101.9 34.7 24.5 -31.0 54.4 30 42 A A < - 0 0 9 -3,-1.2 2,-0.3 -27,-0.1 -4,-0.0 -0.490 30.6-156.3 -71.3 135.0 26.4 -30.3 57.6 31 43 A K - 0 0 120 -2,-0.2 6,-0.2 6,-0.1 2,-0.1 -0.880 6.2-160.8-115.6 148.9 25.6 -27.0 59.3 32 44 A D - 0 0 66 4,-1.3 3,-0.4 -2,-0.3 -1,-0.1 -0.045 47.8 -72.0-101.0-153.2 27.7 -24.9 61.7 33 45 A K S S+ 0 0 174 1,-0.2 -2,-0.0 2,-0.1 33,-0.0 0.861 130.5 48.6 -74.2 -38.1 26.7 -22.1 64.2 34 46 A D S S- 0 0 89 2,-0.1 32,-1.9 31,-0.1 -1,-0.2 0.398 118.9-107.7 -85.8 4.1 25.9 -19.5 61.5 35 47 A G + 0 0 8 -3,-0.4 2,-0.2 1,-0.3 -2,-0.1 0.583 69.5 148.8 82.7 11.3 23.8 -21.9 59.6 36 48 A Y - 0 0 26 29,-0.1 -4,-1.3 4,-0.0 -1,-0.3 -0.511 31.8-156.0 -79.0 145.4 26.3 -22.4 56.8 37 49 A T >> - 0 0 2 -6,-0.2 4,-1.7 -2,-0.2 3,-0.6 -0.778 35.7-102.9-111.5 163.3 26.8 -25.6 54.8 38 50 A P H 3> S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.819 123.8 57.2 -54.6 -30.7 29.9 -26.7 52.9 39 51 A L H 3> S+ 0 0 0 -11,-0.4 4,-2.3 2,-0.2 5,-0.2 0.888 103.2 53.0 -67.7 -40.9 28.1 -25.7 49.7 40 52 A H H <> S+ 0 0 0 -3,-0.6 4,-2.5 2,-0.2 5,-0.2 0.971 112.3 43.1 -54.9 -58.2 27.7 -22.1 51.0 41 53 A L H X S+ 0 0 13 -4,-1.7 4,-3.1 1,-0.2 5,-0.2 0.880 113.6 51.0 -59.6 -43.8 31.4 -21.7 51.9 42 54 A A H X>S+ 0 0 0 -4,-2.1 5,-2.8 -5,-0.2 4,-0.9 0.910 113.5 45.5 -60.6 -43.4 32.6 -23.3 48.6 43 55 A A H <5S+ 0 0 0 -4,-2.3 -2,-0.2 3,-0.2 -1,-0.2 0.868 115.8 46.7 -68.4 -37.6 30.3 -21.0 46.6 44 56 A R H <5S+ 0 0 54 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.933 116.9 41.0 -70.8 -47.8 31.3 -17.9 48.6 45 57 A E H <5S- 0 0 68 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.565 114.6-118.7 -79.1 -9.4 35.1 -18.6 48.5 46 58 A G T <5 + 0 0 16 -4,-0.9 2,-0.9 -5,-0.2 -3,-0.2 0.913 53.6 158.2 76.1 46.4 34.7 -19.7 44.8 47 59 A H >< - 0 0 47 -5,-2.8 4,-1.8 1,-0.2 3,-0.3 -0.758 14.3-178.8-101.7 86.9 35.9 -23.3 44.9 48 60 A L H > S+ 0 0 23 -2,-0.9 4,-2.3 1,-0.2 3,-0.4 0.907 78.0 47.3 -52.4 -56.6 34.3 -24.6 41.7 49 61 A E H > S+ 0 0 20 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.843 112.4 51.5 -59.5 -34.8 35.5 -28.2 41.9 50 62 A I H > S+ 0 0 2 -3,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.834 109.1 53.0 -68.7 -32.8 34.4 -28.4 45.6 51 63 A V H X S+ 0 0 0 -4,-1.8 4,-2.1 -3,-0.4 -2,-0.2 0.962 111.0 42.3 -66.2 -54.5 31.0 -27.1 44.6 52 64 A E H X S+ 0 0 77 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.891 110.9 56.8 -63.0 -41.7 30.2 -29.6 41.9 53 65 A V H X S+ 0 0 23 -4,-1.9 4,-1.3 -5,-0.3 -1,-0.2 0.905 110.7 44.7 -54.9 -43.8 31.6 -32.5 44.0 54 66 A L H X>S+ 0 0 1 -4,-1.5 5,-1.9 1,-0.2 4,-0.7 0.860 108.8 56.6 -68.6 -37.0 29.1 -31.5 46.7 55 67 A L H <5S+ 0 0 33 -4,-2.1 3,-0.5 1,-0.2 -2,-0.2 0.843 106.4 50.4 -64.4 -34.0 26.3 -31.1 44.2 56 68 A K H <5S+ 0 0 192 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.850 101.6 62.3 -69.9 -35.6 26.9 -34.7 43.1 57 69 A A H <5S- 0 0 44 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.701 123.0-102.8 -64.3 -20.7 26.7 -35.9 46.7 58 70 A G T <5 + 0 0 54 -4,-0.7 -3,-0.2 -3,-0.5 -2,-0.1 0.612 60.6 168.5 104.1 18.3 23.2 -34.7 47.0 59 71 A A < - 0 0 11 -5,-1.9 2,-0.7 1,-0.1 -1,-0.2 -0.311 46.7 -98.3 -61.9 145.3 23.8 -31.5 48.9 60 72 A D > - 0 0 78 1,-0.2 3,-0.9 2,-0.1 -1,-0.1 -0.557 30.9-165.8 -71.1 111.8 20.9 -29.1 49.2 61 73 A V T 3 S+ 0 0 16 -2,-0.7 11,-0.4 1,-0.2 -1,-0.2 0.707 89.2 47.0 -69.3 -20.2 21.5 -26.4 46.5 62 74 A N T 3 S+ 0 0 46 8,-0.1 -1,-0.2 9,-0.1 -2,-0.1 0.347 78.2 141.3-105.9 4.5 18.9 -24.2 48.2 63 75 A A < - 0 0 7 -3,-0.9 2,-0.4 1,-0.1 -26,-0.1 -0.094 37.9-148.6 -48.1 145.1 20.0 -24.5 51.8 64 76 A K - 0 0 87 6,-0.1 6,-0.2 -28,-0.1 -1,-0.1 -0.950 4.1-145.6-125.8 141.1 19.8 -21.3 53.8 65 77 A D > - 0 0 11 4,-1.4 3,-1.7 -2,-0.4 -30,-0.3 -0.145 50.2 -76.4 -87.5-170.2 21.8 -19.9 56.7 66 78 A K T 3 S+ 0 0 142 -32,-1.9 -31,-0.1 1,-0.3 -1,-0.1 0.326 134.1 50.9 -74.3 11.2 20.6 -17.7 59.6 67 79 A D T 3 S- 0 0 73 -33,-0.2 32,-2.8 2,-0.1 33,-0.3 0.379 119.1-106.4-122.4 -4.3 20.4 -14.8 57.2 68 80 A G < + 0 0 12 -3,-1.7 2,-0.2 30,-0.3 -2,-0.1 0.456 67.7 152.9 90.6 3.3 18.4 -16.5 54.5 69 81 A Y - 0 0 33 4,-0.1 -4,-1.4 3,-0.1 -1,-0.3 -0.458 27.7-162.2 -70.8 132.1 21.4 -16.8 52.2 70 82 A T >> - 0 0 0 -2,-0.2 4,-1.5 -6,-0.2 3,-1.1 -0.726 39.0-102.3-101.7 161.6 21.5 -19.6 49.6 71 83 A P H 3> S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.835 125.7 56.7 -51.3 -32.2 24.8 -20.7 48.0 72 84 A L H 3> S+ 0 0 0 -11,-0.4 4,-2.2 1,-0.2 5,-0.2 0.832 100.8 56.5 -69.4 -34.0 23.5 -18.8 44.9 73 85 A H H <> S+ 0 0 0 -3,-1.1 4,-1.6 1,-0.2 -1,-0.2 0.904 111.6 42.1 -62.4 -43.3 23.2 -15.6 47.0 74 86 A L H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 5,-0.3 0.851 113.0 53.3 -73.2 -35.3 26.9 -15.8 48.0 75 87 A A H X>S+ 0 0 0 -4,-1.9 5,-2.2 -5,-0.2 4,-1.6 0.881 111.1 45.8 -68.1 -39.2 28.0 -16.8 44.5 76 88 A A H <5S+ 0 0 0 -4,-2.2 -1,-0.2 3,-0.2 -2,-0.2 0.863 114.5 49.7 -69.6 -37.3 26.3 -13.8 42.9 77 89 A R H <5S+ 0 0 53 -4,-1.6 -2,-0.2 -5,-0.2 -3,-0.2 0.966 115.5 39.5 -65.1 -55.7 27.7 -11.5 45.6 78 90 A E H <5S- 0 0 78 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.788 112.9-119.5 -68.9 -29.3 31.3 -12.6 45.4 79 91 A G T <5 + 0 0 6 -4,-1.6 2,-0.9 -5,-0.3 -3,-0.2 0.892 53.0 156.7 93.0 46.6 31.1 -12.8 41.6 80 92 A H >< - 0 0 43 -5,-2.2 4,-2.2 1,-0.2 3,-0.3 -0.766 14.4-179.2-103.3 86.9 31.9 -16.4 40.8 81 93 A L H > S+ 0 0 7 -2,-0.9 4,-2.1 1,-0.2 -1,-0.2 0.915 78.3 50.0 -51.8 -55.2 30.2 -16.8 37.4 82 94 A E H > S+ 0 0 28 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.870 111.9 49.0 -55.9 -39.8 31.1 -20.4 36.8 83 95 A I H > S+ 0 0 4 -3,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.878 106.8 56.0 -68.5 -38.3 29.8 -21.4 40.2 84 96 A V H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.919 108.1 48.7 -57.2 -45.2 26.5 -19.5 39.6 85 97 A E H X S+ 0 0 42 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.902 109.7 51.2 -62.8 -43.6 25.9 -21.5 36.5 86 98 A V H X S+ 0 0 29 -4,-1.8 4,-1.1 1,-0.2 -1,-0.2 0.873 109.6 49.7 -64.3 -39.7 26.6 -24.9 38.2 87 99 A L H X>S+ 0 0 0 -4,-2.1 5,-1.3 2,-0.2 4,-0.9 0.896 112.4 48.2 -64.6 -41.1 24.2 -24.1 41.0 88 100 A L H <5S+ 0 0 35 -4,-1.9 -2,-0.2 1,-0.2 3,-0.2 0.855 110.8 50.1 -67.9 -36.6 21.5 -23.1 38.5 89 101 A K H <5S+ 0 0 183 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.718 109.3 53.9 -72.9 -21.0 22.1 -26.3 36.5 90 102 A A H <5S- 0 0 51 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.692 132.9 -89.3 -84.8 -21.6 21.8 -28.2 39.7 91 103 A G T <5 + 0 0 42 -4,-0.9 -3,-0.2 -3,-0.2 2,-0.2 0.730 61.8 172.5 114.8 41.9 18.4 -26.6 40.5 92 104 A A < - 0 0 14 -5,-1.3 2,-1.0 -8,-0.1 -1,-0.1 -0.533 42.4-107.1 -79.5 145.2 19.0 -23.4 42.4 93 105 A D > - 0 0 71 -2,-0.2 3,-1.7 1,-0.2 -1,-0.1 -0.614 27.5-163.3 -73.3 102.3 16.2 -21.0 43.1 94 106 A V T 3 S+ 0 0 19 -2,-1.0 11,-0.4 1,-0.3 -1,-0.2 0.664 89.7 40.7 -61.6 -16.0 16.9 -18.1 40.8 95 107 A N T 3 S+ 0 0 56 30,-0.1 -1,-0.3 8,-0.1 -2,-0.1 -0.028 81.0 145.5-125.3 30.6 14.5 -16.0 42.8 96 108 A A < - 0 0 2 -3,-1.7 2,-0.4 1,-0.0 -26,-0.1 -0.297 34.9-145.6 -66.4 154.0 15.4 -17.0 46.4 97 109 A K - 0 0 113 6,-0.1 6,-0.2 7,-0.1 -2,-0.0 -0.974 7.5-156.8-128.9 139.2 15.2 -14.3 49.1 98 110 A D > - 0 0 16 4,-1.3 3,-1.0 -2,-0.4 -30,-0.3 -0.025 51.5 -72.6 -91.3-159.4 17.2 -13.7 52.3 99 111 A K T 3 S+ 0 0 133 -32,-2.8 -31,-0.1 1,-0.2 -2,-0.0 0.700 134.2 49.7 -72.4 -19.2 16.2 -11.8 55.4 100 112 A D T 3 S- 0 0 57 -33,-0.3 32,-2.3 2,-0.1 33,-0.3 0.362 118.8-108.4-100.1 3.3 16.5 -8.5 53.6 101 113 A G < + 0 0 12 -3,-1.0 2,-0.3 30,-0.3 -2,-0.1 0.580 67.3 155.2 79.7 10.3 14.4 -9.6 50.7 102 114 A Y - 0 0 28 29,-0.1 -4,-1.3 4,-0.1 -1,-0.3 -0.546 27.0-161.8 -73.8 129.5 17.5 -9.7 48.5 103 115 A T >> - 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0 0 27 -2,-0.4 4,-2.3 -6,-0.2 3,-0.6 -0.364 32.5-100.2 -85.8 167.8 25.5 4.4 14.5 611 149 D P H 3> S+ 0 0 1 0, 0.0 4,-2.8 0, 0.0 5,-0.1 0.824 127.2 57.8 -55.7 -30.8 23.6 2.3 11.9 612 150 D F H 3> S+ 0 0 59 -11,-0.4 4,-1.9 2,-0.2 5,-0.2 0.853 105.6 49.4 -67.2 -35.7 23.4 5.5 9.9 613 151 D D H <> S+ 0 0 48 -3,-0.6 4,-1.6 2,-0.2 -1,-0.2 0.947 115.5 41.9 -65.4 -49.9 27.2 5.7 10.0 614 152 D L H X S+ 0 0 6 -4,-2.3 4,-1.2 1,-0.2 6,-0.2 0.862 112.8 55.4 -64.8 -37.6 27.6 2.1 8.9 615 153 D A H <>S+ 0 0 0 -4,-2.8 5,-2.2 -5,-0.2 3,-0.3 0.909 112.9 39.8 -63.3 -44.4 24.8 2.5 6.3 616 154 D I H ><5S+ 0 0 80 -4,-1.9 3,-0.8 1,-0.2 -1,-0.2 0.744 108.1 63.8 -78.2 -23.9 26.4 5.5 4.6 617 155 D D H 3<5S+ 0 0 64 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.798 106.5 43.4 -69.0 -29.2 29.9 3.9 4.9 618 156 D N T 3<5S- 0 0 63 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.280 121.3-103.1-102.1 8.7 28.9 1.0 2.6 619 157 D G T < 5S+ 0 0 52 -3,-0.8 2,-1.6 1,-0.2 3,-0.2 0.611 72.1 145.6 82.5 13.0 27.1 3.1 0.1 620 158 D N >< + 0 0 36 -5,-2.2 4,-1.7 -6,-0.2 -1,-0.2 -0.611 10.9 157.1 -84.2 82.2 23.6 2.2 1.3 621 159 D E H > + 0 0 121 -2,-1.6 4,-3.0 2,-0.2 5,-0.2 0.946 66.6 54.9 -75.1 -51.5 21.9 5.5 0.7 622 160 D D H > S+ 0 0 106 1,-0.3 4,-1.7 -3,-0.2 -1,-0.2 0.874 114.7 43.9 -49.5 -40.3 18.3 4.5 0.4 623 161 D I H > S+ 0 0 5 2,-0.2 4,-2.5 1,-0.2 -1,-0.3 0.876 109.9 54.9 -73.1 -39.6 18.8 2.9 3.9 624 162 D A H X S+ 0 0 5 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.887 107.6 50.9 -60.2 -41.1 20.6 6.0 5.2 625 163 D E H X S+ 0 0 101 -4,-3.0 4,-1.6 2,-0.2 -2,-0.2 0.957 110.2 48.8 -60.1 -52.4 17.7 8.2 4.2 626 164 D V H X S+ 0 0 17 -4,-1.7 4,-2.0 -5,-0.2 -2,-0.2 0.904 111.9 49.8 -53.2 -46.4 15.2 5.9 6.0 627 165 D L H X S+ 0 0 3 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.901 108.4 50.4 -63.8 -44.2 17.4 5.9 9.1 628 166 D Q H < S+ 0 0 126 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.781 108.4 55.0 -67.9 -26.1 17.8 9.7 9.3 629 167 D K H < S+ 0 0 161 -4,-1.6 -1,-0.2 2,-0.2 -2,-0.2 0.945 110.6 43.6 -67.1 -49.9 14.1 10.0 9.0 630 168 D A H < 0 0 59 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.829 360.0 360.0 -64.8 -32.3 13.4 7.8 11.9 631 169 D A < 0 0 82 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.928 360.0 360.0 -81.2 360.0 16.2 9.5 13.9