==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CALCIUM-BINDING PROTEIN 11-JUL-11 3SUI . COMPND 2 MOLECULE: CALMODULIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.-Y.LAU,R.GAUDET . 161 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8729.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 113 70.2 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 . 5 3.1 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 . 0 0.0 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 . 11 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 78 48.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.2 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 1 0 0 0 2 1 3 0 0 2 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 . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 3 A Q 0 0 231 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 20.9 -15.8 -12.0 -32.6 2 4 A L - 0 0 114 4,-0.0 2,-0.2 3,-0.0 3,-0.0 -0.683 360.0-144.1 -70.0 130.5 -13.0 -13.3 -30.4 3 5 A T > - 0 0 67 -2,-0.4 4,-1.9 1,-0.1 5,-0.1 -0.651 21.1-116.8-101.3 160.9 -10.9 -10.2 -29.6 4 6 A E H > S+ 0 0 173 -2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.852 117.6 56.2 -55.8 -38.2 -7.2 -9.7 -29.1 5 7 A E H > S+ 0 0 57 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.894 104.6 49.6 -60.0 -49.4 -7.9 -8.7 -25.5 6 8 A Q H > S+ 0 0 69 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.897 111.1 51.5 -60.6 -37.9 -9.7 -12.0 -24.8 7 9 A I H X S+ 0 0 73 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.935 108.5 49.1 -65.8 -49.2 -6.7 -14.0 -26.3 8 10 A A H X S+ 0 0 56 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.872 110.9 52.4 -54.8 -42.0 -4.2 -12.2 -24.2 9 11 A E H X S+ 0 0 44 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.916 110.6 46.0 -61.4 -45.2 -6.3 -12.9 -21.1 10 12 A F H X S+ 0 0 31 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.887 111.2 54.2 -63.5 -38.0 -6.5 -16.6 -21.9 11 13 A K H X S+ 0 0 141 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.903 107.4 49.0 -63.4 -44.4 -2.7 -16.5 -22.6 12 14 A E H X S+ 0 0 46 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.903 113.0 48.7 -55.8 -46.6 -2.1 -15.0 -19.1 13 15 A A H X S+ 0 0 0 -4,-2.0 4,-1.0 1,-0.2 -2,-0.2 0.895 110.6 50.1 -65.8 -41.5 -4.3 -17.8 -17.5 14 16 A F H >X S+ 0 0 13 -4,-2.7 4,-2.6 1,-0.2 3,-0.7 0.929 109.1 51.6 -59.7 -46.0 -2.6 -20.5 -19.5 15 17 A S H 3< S+ 0 0 69 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.779 98.0 66.2 -68.1 -27.1 0.8 -19.3 -18.3 16 18 A L H 3< S+ 0 0 0 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.898 113.8 33.0 -53.9 -45.7 -0.3 -19.3 -14.6 17 19 A F H << S+ 0 0 1 -4,-1.0 2,-2.4 -3,-0.7 -2,-0.2 0.890 108.2 68.0 -78.6 -43.4 -0.5 -23.0 -15.0 18 20 A D >< + 0 0 13 -4,-2.6 3,-1.3 1,-0.2 -1,-0.2 -0.437 62.0 164.2 -80.5 68.2 2.4 -23.6 -17.4 19 21 A K T 3 S+ 0 0 97 -2,-2.4 -1,-0.2 1,-0.3 6,-0.1 0.726 72.1 47.7 -65.9 -24.3 5.0 -22.6 -14.9 20 22 A D T 3 S- 0 0 108 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.522 104.1-130.6 -92.8 -5.1 8.0 -24.0 -16.9 21 23 A G < + 0 0 59 -3,-1.3 -2,-0.1 -6,-0.2 -3,-0.1 0.734 64.3 134.1 72.3 20.8 6.8 -22.4 -20.1 22 24 A D S S- 0 0 91 2,-0.3 -1,-0.1 1,-0.0 3,-0.1 0.433 77.0-110.4 -84.8 3.4 7.0 -25.5 -22.2 23 25 A G S S+ 0 0 36 1,-0.2 40,-0.4 -5,-0.2 2,-0.3 0.557 87.9 91.0 83.1 9.9 3.6 -24.8 -23.7 24 26 A T - 0 0 34 38,-0.1 2,-0.6 39,-0.0 -2,-0.3 -0.973 65.7-138.4-133.8 151.0 1.8 -27.8 -22.0 25 27 A I B -A 61 0A 0 36,-2.8 36,-2.8 -2,-0.3 2,-0.2 -0.942 24.9-165.4-107.5 121.5 -0.1 -28.1 -18.7 26 28 A T > - 0 0 32 -2,-0.6 4,-2.2 34,-0.2 5,-0.2 -0.508 36.6-104.0 -98.3 169.6 0.7 -31.3 -16.8 27 29 A T H > S+ 0 0 42 32,-0.3 4,-2.7 1,-0.2 5,-0.2 0.873 123.0 54.8 -57.3 -35.7 -1.2 -32.9 -13.9 28 30 A K H > S+ 0 0 158 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.888 106.7 49.5 -67.1 -41.2 1.6 -31.7 -11.6 29 31 A E H > S+ 0 0 18 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.900 112.9 46.9 -64.3 -43.3 1.2 -28.1 -12.8 30 32 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.934 112.0 51.7 -61.3 -44.7 -2.6 -28.3 -12.2 31 33 A G H X S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.2 5,-0.2 0.927 108.2 51.2 -58.3 -45.6 -2.0 -29.8 -8.8 32 34 A T H X S+ 0 0 66 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.916 112.2 45.9 -62.7 -40.6 0.4 -27.0 -7.8 33 35 A V H X S+ 0 0 0 -4,-1.8 4,-0.8 2,-0.2 -2,-0.2 0.954 113.6 47.5 -69.3 -46.1 -2.1 -24.3 -8.8 34 36 A M H ><>S+ 0 0 1 -4,-2.6 5,-2.2 1,-0.2 3,-0.9 0.910 111.4 51.7 -65.5 -37.3 -5.1 -25.9 -7.0 35 37 A R H ><5S+ 0 0 121 -4,-2.6 3,-2.1 1,-0.2 -1,-0.2 0.864 101.0 60.6 -64.8 -35.4 -3.0 -26.5 -3.9 36 38 A S H 3<5S+ 0 0 43 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.735 104.9 52.2 -64.4 -16.3 -2.0 -22.8 -3.8 37 39 A L T <<5S- 0 0 30 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.214 127.2 -99.3 -99.3 14.2 -5.7 -22.1 -3.5 38 40 A G T < 5S+ 0 0 74 -3,-2.1 -3,-0.2 1,-0.3 2,-0.2 0.546 83.8 126.1 80.7 8.4 -6.2 -24.5 -0.6 39 41 A Q < - 0 0 29 -5,-2.2 -1,-0.3 -6,-0.2 -2,-0.1 -0.561 46.5-155.7 -94.0 161.7 -7.6 -27.4 -2.6 40 42 A N - 0 0 125 -2,-0.2 -9,-0.1 -3,-0.1 2,-0.0 -0.501 14.5-175.5-137.6 70.3 -6.2 -30.9 -2.5 41 43 A P - 0 0 6 0, 0.0 2,-0.1 0, 0.0 -6,-0.1 -0.360 23.4-125.9 -65.6 141.0 -7.1 -32.8 -5.7 42 44 A T > - 0 0 60 1,-0.1 4,-2.3 -2,-0.0 5,-0.2 -0.402 26.2-104.4 -77.4 164.7 -6.1 -36.4 -5.9 43 45 A E H > S+ 0 0 139 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.902 123.4 52.2 -54.4 -40.7 -3.9 -37.9 -8.7 44 46 A A H > S+ 0 0 42 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.922 108.4 49.6 -64.7 -43.3 -7.0 -39.5 -10.2 45 47 A E H > S+ 0 0 74 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.885 111.5 49.8 -61.4 -39.8 -9.0 -36.2 -10.2 46 48 A L H X S+ 0 0 13 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.933 111.5 47.8 -67.1 -44.3 -6.1 -34.4 -11.8 47 49 A Q H X S+ 0 0 124 -4,-2.6 4,-2.7 -5,-0.2 -2,-0.2 0.923 110.9 51.4 -61.6 -42.9 -5.9 -37.1 -14.5 48 50 A D H X S+ 0 0 105 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.857 106.4 55.7 -61.5 -35.1 -9.7 -36.9 -15.0 49 51 A M H < S+ 0 0 24 -4,-2.2 4,-0.5 2,-0.2 -1,-0.2 0.922 112.5 40.8 -62.3 -45.7 -9.4 -33.1 -15.5 50 52 A I H >X S+ 0 0 4 -4,-2.0 3,-1.5 1,-0.2 4,-1.2 0.928 111.9 57.1 -65.7 -44.7 -6.9 -33.6 -18.2 51 53 A N H 3< S+ 0 0 121 -4,-2.7 3,-0.4 1,-0.3 -2,-0.2 0.842 95.8 63.8 -55.9 -40.3 -8.8 -36.5 -19.7 52 54 A E T 3< S+ 0 0 127 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.791 122.2 19.8 -52.8 -30.9 -12.1 -34.4 -20.1 53 55 A V T <4 S+ 0 0 12 -3,-1.5 2,-2.2 -4,-0.5 -1,-0.2 0.404 86.0 118.8-121.8 1.1 -10.2 -32.2 -22.6 54 56 A D >< + 0 0 22 -4,-1.2 3,-1.3 -3,-0.4 5,-0.1 -0.446 32.8 171.1 -79.3 78.3 -7.2 -34.2 -23.8 55 57 A A T 3 S+ 0 0 95 -2,-2.2 -1,-0.2 1,-0.3 6,-0.1 0.804 76.3 42.4 -60.2 -35.0 -8.2 -34.3 -27.6 56 58 A D T 3 S- 0 0 93 -3,-0.2 -1,-0.3 1,-0.0 -2,-0.1 0.414 104.5-126.6 -95.4 4.8 -4.9 -35.9 -28.8 57 59 A G < + 0 0 61 -3,-1.3 -2,-0.1 1,-0.1 -3,-0.1 0.654 68.6 131.1 65.5 18.4 -4.7 -38.4 -25.9 58 60 A N S S- 0 0 87 2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.442 73.0-116.9 -89.0 0.8 -1.1 -37.2 -25.0 59 61 A G S S+ 0 0 38 1,-0.2 -32,-0.3 -5,-0.1 2,-0.3 0.384 85.0 79.5 86.3 -4.0 -1.8 -36.8 -21.2 60 62 A T S S- 0 0 28 -34,-0.1 2,-0.6 -10,-0.1 -2,-0.3 -0.880 78.6-112.8-129.7 166.7 -1.1 -33.0 -21.0 61 63 A I B -A 25 0A 0 -36,-2.8 -36,-2.8 -2,-0.3 2,-0.1 -0.867 28.9-168.4-104.9 121.4 -3.2 -29.9 -21.9 62 64 A D > - 0 0 45 -2,-0.6 4,-2.6 -38,-0.2 5,-0.2 -0.329 43.8 -80.7 -91.3-172.7 -2.1 -27.7 -24.8 63 65 A F H > S+ 0 0 64 -40,-0.4 4,-2.4 1,-0.2 5,-0.2 0.934 127.1 41.2 -61.8 -52.2 -3.4 -24.2 -25.6 64 66 A P H > S+ 0 0 79 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.860 114.5 53.2 -68.6 -29.8 -6.6 -25.1 -27.5 65 67 A E H > S+ 0 0 9 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.881 109.1 50.2 -66.5 -37.6 -7.4 -27.9 -25.0 66 68 A F H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.898 108.6 51.9 -62.6 -43.0 -7.0 -25.3 -22.2 67 69 A L H X S+ 0 0 53 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.902 109.4 50.7 -58.0 -42.5 -9.4 -23.0 -24.0 68 70 A T H X S+ 0 0 60 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.889 107.8 52.4 -59.6 -45.4 -11.8 -25.9 -24.2 69 71 A M H X S+ 0 0 17 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.905 113.1 44.6 -54.9 -46.1 -11.5 -26.5 -20.5 70 72 A M H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.899 111.7 51.3 -69.6 -42.2 -12.3 -22.8 -19.8 71 73 A A H X S+ 0 0 56 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.896 109.9 49.9 -64.5 -42.1 -15.2 -22.6 -22.2 72 74 A R H X S+ 0 0 103 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.937 112.3 48.5 -56.5 -47.6 -16.8 -25.7 -20.7 73 75 A K H X S+ 0 0 12 -4,-1.9 4,-0.6 2,-0.2 -2,-0.2 0.842 108.0 52.7 -65.2 -40.0 -16.4 -24.2 -17.2 74 76 A M H >< S+ 0 0 54 -4,-2.5 3,-0.9 1,-0.2 -1,-0.2 0.928 112.1 46.5 -58.2 -48.4 -17.9 -20.8 -18.2 75 77 A K H 3< S+ 0 0 171 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.790 111.8 52.8 -60.0 -32.7 -20.9 -22.5 -19.6 76 78 A D H 3< S+ 0 0 99 -4,-1.6 2,-0.8 -5,-0.2 3,-0.4 0.504 89.9 88.9 -88.2 -2.9 -21.1 -24.7 -16.4 77 79 A T << + 0 0 6 -3,-0.9 -1,-0.1 -4,-0.6 -4,-0.0 -0.749 40.4 106.4-105.1 90.1 -21.1 -21.8 -13.9 78 80 A D + 0 0 129 -2,-0.8 -1,-0.2 66,-0.0 2,-0.1 0.481 50.1 110.6-124.4 -20.2 -24.6 -20.4 -13.1 79 81 A S > - 0 0 42 -3,-0.4 4,-2.3 1,-0.1 5,-0.2 -0.366 63.0-144.2 -68.3 130.3 -24.9 -21.8 -9.5 80 82 A E H > S+ 0 0 114 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.847 103.1 59.6 -56.9 -34.8 -24.9 -19.3 -6.6 81 83 A E H > S+ 0 0 152 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.911 107.8 42.4 -63.0 -43.4 -23.0 -22.1 -4.7 82 84 A E H > S+ 0 0 39 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.946 117.8 45.7 -68.1 -46.3 -20.2 -22.2 -7.2 83 85 A I H X S+ 0 0 3 -4,-2.3 4,-3.0 1,-0.2 -2,-0.2 0.906 111.8 50.5 -65.0 -43.3 -19.9 -18.4 -7.6 84 86 A R H X S+ 0 0 88 -4,-2.9 4,-2.4 2,-0.2 -1,-0.2 0.894 108.3 55.1 -61.4 -39.6 -20.1 -17.8 -3.8 85 87 A E H X S+ 0 0 79 -4,-1.7 4,-1.0 -5,-0.3 -2,-0.2 0.935 111.2 43.4 -56.8 -48.7 -17.3 -20.4 -3.4 86 88 A A H >X S+ 0 0 0 -4,-2.1 4,-1.1 2,-0.2 3,-0.7 0.917 110.1 57.2 -63.7 -42.2 -15.1 -18.5 -5.8 87 89 A F H >X S+ 0 0 1 -4,-3.0 4,-2.6 1,-0.2 3,-1.0 0.929 103.8 52.5 -53.0 -48.7 -16.0 -15.2 -4.2 88 90 A R H 3< S+ 0 0 154 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.740 97.6 65.9 -63.6 -27.4 -14.8 -16.4 -0.8 89 91 A V H << S+ 0 0 29 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.879 114.9 31.1 -55.3 -39.5 -11.4 -17.4 -2.3 90 92 A F H << S+ 0 0 2 -4,-1.1 2,-2.3 -3,-1.0 9,-0.2 0.812 103.3 74.4 -93.3 -35.0 -10.8 -13.7 -2.9 91 93 A D >< + 0 0 10 -4,-2.6 3,-1.6 1,-0.2 -1,-0.2 -0.484 64.1 175.1 -80.6 73.7 -12.7 -12.1 -0.0 92 94 A K T 3 S+ 0 0 117 -2,-2.3 -1,-0.2 1,-0.3 6,-0.1 0.822 73.5 40.8 -52.5 -42.7 -10.0 -13.1 2.5 93 95 A D T 3 S- 0 0 106 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.450 103.9-127.1 -92.9 2.6 -11.5 -11.3 5.6 94 96 A G < + 0 0 58 -3,-1.6 -2,-0.1 -6,-0.1 4,-0.1 0.628 67.6 132.1 68.9 18.2 -15.0 -12.3 4.7 95 97 A N S S- 0 0 84 2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.496 79.1-108.1 -83.0 -0.3 -16.4 -8.7 4.9 96 98 A G S S+ 0 0 26 1,-0.2 40,-0.6 -5,-0.1 2,-0.4 0.466 91.6 92.6 93.2 1.3 -18.3 -9.1 1.6 97 99 A Y E -B 135 0B 92 38,-0.2 2,-0.7 39,-0.1 -2,-0.3 -0.996 66.0-143.1-130.8 123.5 -15.9 -6.7 -0.4 98 100 A I E -B 134 0B 0 36,-3.5 36,-2.5 -2,-0.4 2,-0.2 -0.782 26.7-160.2 -82.0 117.4 -12.9 -7.8 -2.4 99 101 A S > - 0 0 27 -2,-0.7 4,-2.1 -9,-0.2 5,-0.2 -0.509 31.0-110.4 -92.7 164.9 -10.3 -5.1 -1.9 100 102 A A H > S+ 0 0 20 32,-0.3 4,-2.8 1,-0.2 5,-0.2 0.907 121.3 54.4 -57.3 -43.6 -7.3 -4.4 -4.1 101 103 A A H > S+ 0 0 38 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.915 108.1 47.8 -58.8 -43.5 -5.1 -5.6 -1.2 102 104 A E H > S+ 0 0 14 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.922 112.6 48.3 -64.8 -41.9 -7.0 -9.0 -1.0 103 105 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.923 110.4 52.2 -65.6 -40.5 -6.8 -9.5 -4.8 104 106 A R H X S+ 0 0 73 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.936 109.6 50.3 -56.5 -47.9 -3.1 -8.7 -4.7 105 107 A H H X S+ 0 0 98 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.921 111.6 46.1 -57.5 -47.3 -2.6 -11.3 -1.9 106 108 A V H X S+ 0 0 4 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.931 112.8 50.4 -64.9 -46.0 -4.4 -14.1 -3.8 107 109 A M H X>S+ 0 0 1 -4,-2.6 5,-2.2 1,-0.2 4,-0.8 0.920 111.6 48.5 -55.3 -45.0 -2.5 -13.2 -7.0 108 110 A T H ><5S+ 0 0 92 -4,-2.8 3,-1.1 1,-0.2 -2,-0.2 0.924 109.0 52.3 -62.1 -43.7 0.8 -13.4 -5.1 109 111 A N H 3<5S+ 0 0 102 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.859 108.1 53.5 -60.4 -36.1 -0.2 -16.8 -3.5 110 112 A L H 3<5S- 0 0 4 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.659 119.9-111.8 -71.9 -17.5 -0.9 -18.0 -7.1 111 113 A G T <<5 + 0 0 51 -3,-1.1 2,-0.7 -4,-0.8 -3,-0.2 0.493 68.7 145.0 96.2 6.4 2.5 -17.0 -8.2 112 114 A E < - 0 0 22 -5,-2.2 2,-1.3 -6,-0.2 -1,-0.3 -0.723 43.0-146.5 -82.2 114.1 1.2 -14.2 -10.5 113 115 A K + 0 0 200 -2,-0.7 2,-0.4 -3,-0.1 -1,-0.1 -0.629 32.8 165.5 -86.5 89.8 3.6 -11.3 -10.5 114 116 A L - 0 0 31 -2,-1.3 -6,-0.0 -10,-0.1 2,-0.0 -0.873 33.9-124.3-110.9 136.7 1.3 -8.2 -10.9 115 117 A T > - 0 0 56 -2,-0.4 4,-2.2 1,-0.1 5,-0.2 -0.330 30.4-111.1 -67.4 157.4 2.0 -4.5 -10.4 116 118 A D H > S+ 0 0 87 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.905 121.1 53.7 -52.9 -41.9 -0.1 -2.5 -7.9 117 119 A E H > S+ 0 0 130 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.848 105.9 51.6 -63.2 -39.1 -1.5 -0.7 -11.0 118 120 A E H > S+ 0 0 48 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.905 110.5 48.7 -67.3 -40.4 -2.4 -3.9 -12.7 119 121 A V H X S+ 0 0 1 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.937 110.1 50.6 -64.3 -43.4 -4.3 -5.0 -9.6 120 122 A D H X S+ 0 0 61 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.885 107.7 55.2 -59.2 -40.1 -6.1 -1.7 -9.4 121 123 A E H X S+ 0 0 76 -4,-2.1 4,-2.0 2,-0.2 28,-1.0 0.866 107.2 50.2 -56.9 -43.2 -7.1 -2.1 -13.1 122 124 A M H X S+ 0 0 2 -4,-1.7 4,-1.6 26,-0.2 -2,-0.2 0.920 110.8 47.6 -66.5 -44.9 -8.6 -5.5 -12.2 123 125 A I H X S+ 0 0 7 -4,-2.4 4,-2.1 1,-0.2 3,-0.3 0.958 111.9 51.5 -60.1 -46.6 -10.7 -4.0 -9.4 124 126 A R H < S+ 0 0 154 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.859 105.7 55.5 -57.1 -40.9 -11.8 -1.1 -11.6 125 127 A E H < S+ 0 0 93 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.893 117.3 34.3 -60.8 -39.1 -13.0 -3.5 -14.4 126 128 A A H < S+ 0 0 6 -4,-1.6 2,-0.4 -3,-0.3 -1,-0.2 0.698 94.6 99.0 -90.6 -18.9 -15.2 -5.4 -12.0 127 129 A D < + 0 0 26 -4,-2.1 7,-0.1 -5,-0.2 -4,-0.0 -0.560 40.4 167.8 -74.2 120.2 -16.3 -2.4 -9.8 128 130 A I S S+ 0 0 117 -2,-0.4 -1,-0.2 1,-0.0 6,-0.1 0.827 72.6 46.5 -96.9 -45.4 -19.7 -1.3 -11.0 129 131 A D S S- 0 0 93 4,-0.2 -2,-0.1 1,-0.1 5,-0.1 0.673 103.4-122.9 -79.1 -15.3 -20.8 1.1 -8.3 130 132 A G S S+ 0 0 61 3,-0.2 -1,-0.1 -6,-0.1 -3,-0.1 0.643 72.9 126.3 88.3 11.5 -17.5 3.0 -8.1 131 133 A D S S- 0 0 75 2,-0.3 3,-0.1 1,-0.0 -1,-0.0 0.493 80.5-113.7 -77.9 -5.4 -16.8 2.4 -4.4 132 134 A G S S+ 0 0 42 1,-0.3 -32,-0.3 -9,-0.1 2,-0.3 0.583 86.7 83.8 84.6 9.5 -13.3 1.0 -5.3 133 135 A Q S S- 0 0 63 -34,-0.1 2,-0.6 -10,-0.1 -1,-0.3 -0.891 77.5-115.3-134.8 166.3 -14.1 -2.6 -4.1 134 136 A V E -B 98 0B 0 -36,-2.5 -36,-3.5 -2,-0.3 -7,-0.1 -0.931 29.8-168.2-108.5 110.7 -15.8 -5.7 -5.6 135 137 A N E > -B 97 0B 24 -2,-0.6 4,-2.2 -38,-0.2 5,-0.2 -0.281 40.2 -94.4 -85.5 175.4 -19.0 -6.8 -3.8 136 138 A Y H > S+ 0 0 16 -40,-0.6 4,-3.0 1,-0.2 5,-0.2 0.913 123.9 51.3 -61.1 -44.3 -20.7 -10.2 -4.4 137 139 A E H > S+ 0 0 115 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.892 111.2 49.7 -59.6 -40.3 -23.2 -8.9 -7.0 138 140 A E H > S+ 0 0 6 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.892 110.2 50.2 -66.4 -40.6 -20.2 -7.3 -9.0 139 141 A F H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.946 109.1 51.5 -61.0 -46.0 -18.3 -10.5 -8.8 140 142 A V H X S+ 0 0 32 -4,-3.0 4,-2.7 1,-0.2 5,-0.4 0.943 109.9 50.2 -55.0 -49.7 -21.3 -12.4 -10.1 141 143 A Q H X S+ 0 0 97 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.901 108.8 51.9 -57.7 -43.2 -21.6 -9.9 -13.0 142 144 A M H < S+ 0 0 14 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.907 115.7 41.3 -58.8 -42.9 -18.0 -10.4 -13.8 143 145 A M H < S+ 0 0 6 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.781 125.1 30.6 -75.0 -36.0 -18.4 -14.2 -13.9 144 146 A T H < S+ 0 0 69 -4,-2.7 2,-0.6 -5,-0.2 -3,-0.2 0.580 102.8 82.1-105.7 -14.3 -21.7 -14.6 -15.8 145 147 A A < 0 0 51 -4,-1.9 -1,-0.1 -5,-0.4 0, 0.0 -0.870 360.0 360.0-100.9 119.2 -21.7 -11.5 -18.0 146 148 A K 0 0 124 -2,-0.6 -4,-0.0 -3,-0.0 -3,-0.0 -0.851 360.0 360.0-165.2 360.0 -19.7 -11.8 -21.3 147 !* 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 0.0 148 784 B G 0 0 58 0, 0.0 2,-0.3 0, 0.0 -26,-0.2 0.000 360.0 360.0 360.0 61.8 -9.8 -2.1 -17.1 149 785 B R - 0 0 74 -28,-1.0 2,-0.3 -27,-0.1 -24,-0.2 -0.853 360.0-127.3-144.9 113.9 -8.4 -5.7 -17.0 150 786 B N + 0 0 43 -2,-0.3 3,-0.2 1,-0.1 -28,-0.1 -0.488 26.7 176.6 -72.1 124.6 -10.7 -8.7 -17.1 151 787 B W >> + 0 0 4 -2,-0.3 4,-1.7 -29,-0.2 3,-0.7 0.110 45.8 111.3-107.6 -1.4 -10.0 -11.2 -14.2 152 788 B K H 3> S+ 0 0 19 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.839 72.8 57.5 -52.5 -41.5 -12.8 -13.8 -14.9 153 789 B N H 3> S+ 0 0 5 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.845 109.1 46.3 -64.1 -34.1 -10.4 -16.6 -16.0 154 790 B F H X4 S+ 0 0 8 -3,-0.7 3,-0.7 1,-0.2 -1,-0.2 0.879 108.6 54.5 -72.7 -38.7 -8.6 -16.4 -12.7 155 791 B A H 3< S+ 0 0 0 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.752 106.1 54.8 -66.3 -24.6 -11.9 -16.3 -10.7 156 792 B L H >X S+ 0 0 1 -4,-1.5 3,-2.1 -5,-0.2 4,-0.5 0.698 85.5 84.0 -78.5 -23.2 -12.8 -19.6 -12.5 157 793 B V G X< S+ 0 0 1 -3,-0.7 3,-1.7 -4,-0.6 4,-0.4 0.901 86.4 52.9 -54.1 -47.4 -9.7 -21.4 -11.5 158 794 B P G 34 S+ 0 0 2 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.647 110.0 52.2 -61.1 -11.9 -11.1 -22.5 -8.0 159 795 B L G X4 S+ 0 0 4 -3,-2.1 3,-1.2 1,-0.1 -2,-0.2 0.481 80.6 92.0-100.9 -3.9 -14.1 -23.9 -9.9 160 796 B L T << S+ 0 0 15 -3,-1.7 -1,-0.1 -4,-0.5 -3,-0.1 0.822 79.2 61.8 -63.1 -30.8 -12.1 -26.0 -12.4 161 797 B R T 3 0 0 79 -4,-0.4 -1,-0.3 -3,-0.2 -2,-0.1 0.802 360.0 360.0 -65.9 -31.4 -12.3 -29.0 -10.1 162 798 B D < 0 0 97 -3,-1.2 -2,-0.1 -4,-0.1 -1,-0.1 0.704 360.0 360.0 57.4 360.0 -16.2 -28.7 -10.5