==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING, TRANSFERASE 02-AUG-09 3IIJ . COMPND 2 MOLECULE: COILIN-INTERACTING NUCLEAR ATPASE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.E.ZOGRAPHOS,C.E.DRAKOU,D.D.LEONIDAS . 175 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10439.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 124 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 9 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 41.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.3 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 0 0 1 1 1 0 2 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 PARALLEL BRIDGES PER LADDER . 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 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 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 P > 0 0 141 0, 0.0 3,-1.5 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 3.3 13.2 -59.1 5.4 2 -1 A E T 3 + 0 0 151 1,-0.3 3,-0.1 3,-0.0 0, 0.0 -0.252 360.0 5.2 -57.1 133.8 10.3 -57.0 6.6 3 0 A F T 3 S+ 0 0 186 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.796 98.1 125.2 56.5 33.9 10.8 -55.7 10.2 4 1 A M < - 0 0 86 -3,-1.5 2,-0.4 2,-0.0 -1,-0.2 -0.989 62.2-128.1-114.2 130.7 14.3 -57.1 10.5 5 2 A L - 0 0 108 -2,-0.4 168,-0.1 168,-0.2 70,-0.1 -0.666 33.4-166.0 -69.8 128.5 17.2 -54.8 11.4 6 3 A L - 0 0 37 -2,-0.4 70,-0.5 68,-0.4 71,-0.1 -0.907 13.3-119.8-123.2 148.0 19.9 -55.3 8.8 7 4 A P - 0 0 0 0, 0.0 69,-0.6 0, 0.0 2,-0.4 -0.335 14.6-132.7 -82.2 163.1 23.6 -54.3 8.8 8 5 A N - 0 0 4 68,-0.2 85,-2.2 67,-0.2 86,-1.0 -0.964 21.3-163.6-111.8 139.9 25.5 -52.1 6.4 9 6 A I E -ab 78 94A 0 68,-2.4 70,-3.0 -2,-0.4 2,-0.5 -0.963 8.1-151.5-126.1 133.5 28.9 -53.2 5.0 10 7 A L E -ab 79 95A 0 84,-2.0 86,-3.0 -2,-0.4 2,-0.6 -0.922 5.7-166.4-104.1 130.1 31.6 -51.2 3.3 11 8 A L E +ab 80 96A 0 68,-3.1 70,-2.0 -2,-0.5 2,-0.2 -0.977 24.4 160.4-110.9 115.6 33.9 -52.9 0.8 12 9 A T E + b 0 97A 0 84,-3.0 86,-2.7 -2,-0.6 2,-0.2 -0.710 8.1 109.4-129.2 179.9 36.8 -50.7 0.0 13 10 A G - 0 0 0 68,-0.4 86,-0.1 84,-0.2 3,-0.1 -0.590 68.9 -40.3 131.0 163.8 40.3 -51.1 -1.4 14 11 A T S > S- 0 0 1 84,-0.4 3,-1.9 -2,-0.2 5,-0.3 -0.149 74.5 -86.4 -55.9 145.5 42.3 -50.2 -4.5 15 12 A P T 3 S+ 0 0 17 0, 0.0 -1,-0.1 0, 0.0 94,-0.1 -0.332 116.3 29.9 -52.0 137.6 40.5 -50.5 -7.9 16 13 A G T 3 S+ 0 0 7 -3,-0.1 -2,-0.1 92,-0.1 92,-0.1 0.222 83.5 109.3 96.6 -12.2 40.9 -54.1 -9.2 17 14 A V S < S- 0 0 0 -3,-1.9 82,-0.1 81,-0.1 84,-0.1 0.751 96.1 -94.8 -71.3 -25.0 41.1 -55.9 -5.8 18 15 A G S > S+ 0 0 14 -4,-0.2 4,-2.3 80,-0.1 5,-0.2 0.609 76.0 137.9 124.1 20.4 37.7 -57.5 -6.2 19 16 A K H > S+ 0 0 13 -5,-0.3 4,-3.0 2,-0.2 5,-0.2 0.914 77.7 44.5 -62.1 -46.4 35.1 -55.3 -4.5 20 17 A T H > S+ 0 0 47 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.925 113.2 51.3 -67.3 -42.8 32.4 -55.5 -7.2 21 18 A T H > S+ 0 0 84 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.938 116.5 40.6 -56.7 -49.2 32.8 -59.3 -7.6 22 19 A L H X S+ 0 0 2 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.919 114.8 51.0 -67.4 -46.0 32.5 -59.8 -3.8 23 20 A G H X S+ 0 0 0 -4,-3.0 4,-2.3 -5,-0.2 -2,-0.2 0.877 110.4 48.3 -61.4 -41.6 29.7 -57.3 -3.3 24 21 A K H X S+ 0 0 115 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.876 112.8 48.3 -68.6 -37.4 27.5 -58.7 -6.1 25 22 A E H X S+ 0 0 55 -4,-1.6 4,-2.0 -5,-0.3 -2,-0.2 0.934 111.7 50.2 -67.0 -44.7 28.0 -62.3 -4.8 26 23 A L H X S+ 0 0 0 -4,-2.8 4,-0.8 1,-0.2 6,-0.4 0.898 110.3 50.3 -57.5 -43.9 27.2 -61.1 -1.2 27 24 A A H >X S+ 0 0 18 -4,-2.3 4,-2.4 1,-0.2 3,-0.6 0.918 111.2 47.8 -61.8 -46.0 24.0 -59.4 -2.4 28 25 A S H 3< S+ 0 0 107 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.878 117.4 42.5 -60.6 -38.0 22.8 -62.5 -4.3 29 26 A K H 3< S+ 0 0 124 -4,-2.0 -1,-0.2 1,-0.1 -2,-0.2 0.454 126.4 29.1 -95.0 -2.3 23.5 -64.7 -1.4 30 27 A S H << S- 0 0 41 -4,-0.8 -2,-0.2 -3,-0.6 -3,-0.2 0.532 93.9-124.1-127.3 -20.4 22.1 -62.5 1.4 31 28 A G < + 0 0 68 -4,-2.4 -4,-0.1 1,-0.3 -3,-0.1 0.430 65.0 138.3 79.4 -0.2 19.4 -60.4 -0.2 32 29 A L - 0 0 12 -6,-0.4 2,-0.4 -5,-0.1 -1,-0.3 -0.380 62.0-102.0 -70.1 157.7 21.2 -57.2 1.0 33 30 A K E -c 77 0A 104 43,-2.6 45,-3.4 -3,-0.1 2,-0.5 -0.723 30.5-146.1 -87.2 129.0 21.3 -54.4 -1.6 34 31 A Y E -c 78 0A 31 -2,-0.4 2,-0.5 43,-0.2 45,-0.2 -0.820 14.9-172.3 -95.8 132.0 24.5 -53.9 -3.4 35 32 A I E -c 79 0A 10 43,-3.1 45,-2.6 -2,-0.5 2,-0.7 -0.971 13.9-159.9-126.9 118.5 25.6 -50.4 -4.4 36 33 A N E > -c 80 0A 26 -2,-0.5 4,-2.5 43,-0.2 5,-0.2 -0.865 11.9-155.6 -90.1 114.6 28.5 -49.6 -6.6 37 34 A V H > S+ 0 0 0 43,-2.5 4,-2.6 -2,-0.7 5,-0.2 0.895 91.9 50.7 -64.5 -40.9 29.3 -45.9 -5.7 38 35 A G H > S+ 0 0 16 42,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.919 112.7 46.8 -59.5 -44.1 30.9 -45.2 -9.1 39 36 A D H > S+ 0 0 67 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.882 111.6 51.6 -65.4 -39.9 28.0 -46.7 -10.9 40 37 A L H X S+ 0 0 30 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.916 108.9 49.8 -62.8 -45.0 25.5 -44.7 -8.8 41 38 A A H X>S+ 0 0 0 -4,-2.6 5,-2.2 1,-0.2 4,-0.7 0.873 112.9 48.3 -61.6 -37.4 27.4 -41.4 -9.5 42 39 A R H <5S+ 0 0 141 -4,-1.8 3,-0.3 3,-0.2 -2,-0.2 0.928 114.2 45.1 -66.5 -48.1 27.2 -42.3 -13.2 43 40 A E H <5S+ 0 0 146 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.878 122.9 35.3 -64.7 -40.8 23.5 -43.1 -13.2 44 41 A E H <5S- 0 0 88 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.410 107.1-123.4 -99.0 0.9 22.5 -40.1 -11.1 45 42 A Q T <5 + 0 0 151 -4,-0.7 2,-1.5 -3,-0.3 -3,-0.2 0.882 46.4 167.4 62.2 45.2 25.1 -37.8 -12.7 46 43 A L < + 0 0 2 -5,-2.2 14,-2.2 -6,-0.2 2,-0.3 -0.500 26.2 123.7 -94.2 68.0 26.8 -36.9 -9.3 47 44 A Y E -E 59 0B 76 -2,-1.5 2,-0.3 12,-0.2 12,-0.2 -0.946 35.8-175.4-126.7 148.0 29.9 -35.2 -10.6 48 45 A D E - 0 0 116 10,-2.9 13,-0.1 -2,-0.3 -2,-0.0 -0.860 58.6 -12.9-144.0 108.8 31.5 -31.8 -10.1 49 46 A G E - 0 0 44 -2,-0.3 9,-3.0 8,-0.1 2,-0.4 -0.020 69.0 -99.8 90.4 163.9 34.6 -30.8 -12.0 50 47 A Y E -E 57 0B 137 7,-0.3 2,-0.6 -3,-0.1 -1,-0.0 -0.969 23.5-130.9-123.9 139.5 37.2 -32.6 -14.0 51 48 A D E >> -E 56 0B 46 5,-3.0 4,-1.0 -2,-0.4 5,-1.0 -0.816 11.8-160.9 -94.0 122.6 40.6 -33.8 -12.9 52 49 A E T 45S+ 0 0 174 -2,-0.6 -1,-0.1 3,-0.2 0, 0.0 0.859 85.0 45.0 -69.5 -40.5 43.4 -32.8 -15.4 53 50 A E T 45S+ 0 0 107 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.926 122.9 31.1 -74.6 -48.7 46.1 -35.3 -14.3 54 51 A Y T 45S- 0 0 103 2,-0.1 -1,-0.2 64,-0.0 -2,-0.2 0.591 101.5-129.4 -87.0 -13.3 44.1 -38.5 -14.0 55 52 A D T <5 + 0 0 105 -4,-1.0 -3,-0.2 1,-0.2 -2,-0.0 0.989 63.4 114.6 58.3 68.3 41.6 -37.6 -16.8 56 53 A C E - 0 0 31 -14,-2.2 4,-2.1 1,-0.2 5,-0.2 -0.747 26.4-172.9 -84.2 94.6 30.6 -35.0 -5.9 61 58 A E H > S+ 0 0 87 -2,-1.2 4,-2.4 1,-0.2 -1,-0.2 0.875 77.7 52.6 -63.6 -41.0 31.0 -36.5 -2.4 62 59 A D H > S+ 0 0 126 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.904 111.4 47.3 -61.7 -42.0 28.3 -34.4 -0.7 63 60 A R H > S+ 0 0 119 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.854 109.5 53.3 -70.0 -36.2 25.7 -35.3 -3.3 64 61 A V H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.924 110.7 47.4 -60.2 -45.4 26.6 -39.0 -3.1 65 62 A V H X S+ 0 0 21 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.934 113.5 47.8 -62.4 -45.6 26.1 -38.9 0.7 66 63 A D H < S+ 0 0 127 -4,-2.4 4,-0.5 1,-0.2 -1,-0.2 0.885 110.1 53.3 -60.7 -39.9 22.8 -37.1 0.2 67 64 A E H < S+ 0 0 92 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.871 119.7 31.8 -62.7 -38.8 21.7 -39.6 -2.5 68 65 A L H X S+ 0 0 2 -4,-1.8 4,-2.4 1,-0.1 3,-0.4 0.639 91.4 92.3 -95.5 -19.8 22.3 -42.7 -0.2 69 66 A D H X S+ 0 0 18 -4,-1.9 4,-2.4 1,-0.2 5,-0.2 0.838 85.2 49.9 -55.5 -44.4 21.6 -41.5 3.3 70 67 A N H > S+ 0 0 120 -4,-0.5 4,-1.2 1,-0.2 -1,-0.2 0.924 114.5 45.4 -59.9 -45.3 17.9 -42.5 3.5 71 68 A Q H > S+ 0 0 64 -3,-0.4 4,-0.8 -4,-0.3 -1,-0.2 0.877 111.3 52.5 -65.5 -40.5 18.7 -46.0 2.3 72 69 A M H >< S+ 0 0 4 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.891 104.6 56.6 -64.2 -37.9 21.7 -46.3 4.6 73 70 A R H 3< S+ 0 0 158 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.843 105.0 52.5 -61.3 -32.4 19.5 -45.3 7.6 74 71 A E H 3< S- 0 0 165 -4,-1.2 -68,-0.4 -3,-0.2 -1,-0.2 0.664 107.1-143.6 -80.4 -17.6 17.1 -48.2 6.7 75 72 A G << + 0 0 19 -4,-0.8 -67,-0.2 -3,-0.8 -1,-0.1 0.062 64.7 97.3 85.1 168.9 20.0 -50.7 6.7 76 73 A G + 0 0 6 -69,-0.6 -43,-2.6 -70,-0.5 2,-0.4 0.838 56.3 136.3 81.4 37.2 20.9 -53.8 4.7 77 74 A V E - c 0 33A 2 -70,-0.4 -68,-2.4 -45,-0.2 2,-0.6 -0.958 42.8-156.9-123.5 134.3 23.2 -52.2 2.2 78 75 A I E -ac 9 34A 0 -45,-3.4 -43,-3.1 -2,-0.4 2,-0.4 -0.951 20.5-161.8-105.3 115.0 26.6 -53.3 0.8 79 76 A V E -ac 10 35A 0 -70,-3.0 -68,-3.1 -2,-0.6 2,-0.5 -0.867 5.0-164.1-106.3 133.8 28.5 -50.3 -0.4 80 77 A D E +ac 11 36A 6 -45,-2.6 -43,-2.5 -2,-0.4 -42,-0.4 -0.965 26.4 134.7-120.0 116.6 31.5 -50.6 -2.8 81 78 A Y - 0 0 31 -70,-2.0 -68,-0.4 -2,-0.5 2,-0.1 -0.974 55.6-127.3-158.1 153.5 34.0 -47.8 -3.4 82 79 A H S S+ 0 0 84 -2,-0.3 2,-0.3 -70,-0.2 -70,-0.1 -0.175 97.4 48.0 -89.5 37.8 37.7 -47.1 -3.7 83 80 A G + 0 0 7 -2,-0.1 48,-0.0 -69,-0.1 -2,-0.0 -0.936 50.0 168.3-166.3 156.2 37.4 -44.3 -1.1 84 81 A C > + 0 0 0 -2,-0.3 3,-1.0 -72,-0.0 -1,-0.1 0.466 51.3 96.4-153.5 -6.7 35.8 -44.1 2.3 85 82 A D T 3 S+ 0 0 94 1,-0.2 4,-0.1 54,-0.0 -2,-0.0 0.685 87.1 52.7 -69.0 -17.4 36.8 -40.9 4.2 86 83 A F T 3 S+ 0 0 33 2,-0.1 -1,-0.2 3,-0.0 -21,-0.1 0.547 83.5 100.7 -98.8 -8.3 33.7 -39.0 3.2 87 84 A F S < S- 0 0 10 -3,-1.0 2,-0.1 1,-0.1 5,-0.0 -0.530 87.9 -99.7 -73.5 141.9 31.0 -41.4 4.2 88 85 A P > - 0 0 28 0, 0.0 3,-1.7 0, 0.0 4,-0.4 -0.442 29.7-132.5 -56.9 131.8 29.3 -40.7 7.5 89 86 A E G > S+ 0 0 98 1,-0.3 3,-1.1 2,-0.2 51,-0.1 0.857 101.9 64.6 -56.8 -37.5 30.9 -43.0 10.1 90 87 A R G 3 S+ 0 0 138 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.647 85.4 76.2 -61.1 -20.2 27.5 -44.1 11.4 91 88 A W G < S+ 0 0 3 -3,-1.7 2,-0.4 1,-0.1 -1,-0.2 0.873 87.1 63.1 -60.4 -40.2 26.6 -45.7 8.1 92 89 A F < - 0 0 9 -3,-1.1 -83,-0.2 -4,-0.4 3,-0.1 -0.784 44.8-177.2-109.0 132.3 28.8 -48.8 8.5 93 90 A H S S+ 0 0 69 -85,-2.2 2,-0.3 -2,-0.4 -84,-0.2 0.678 85.7 11.6 -87.6 -21.9 28.7 -51.7 11.0 94 91 A I E -b 9 0A 6 -86,-1.0 -84,-2.0 2,-0.0 2,-0.4 -0.980 65.4-153.9-155.0 149.5 31.8 -53.3 9.5 95 92 A V E -bd 10 144A 0 48,-2.9 50,-2.6 -2,-0.3 2,-0.5 -0.994 6.4-164.6-132.3 124.2 34.4 -52.3 6.9 96 93 A F E -bd 11 145A 3 -86,-3.0 -84,-3.0 -2,-0.4 2,-0.7 -0.944 4.6-160.7-112.0 127.3 36.4 -54.7 4.7 97 94 A V E -bd 12 146A 1 48,-2.8 50,-2.3 -2,-0.5 2,-0.3 -0.921 16.3-147.1-104.2 108.6 39.5 -53.6 2.9 98 95 A L E - d 0 147A 0 -86,-2.7 -84,-0.4 -2,-0.7 2,-0.4 -0.604 15.4-163.5 -77.4 135.3 40.2 -56.0 0.1 99 96 A R E - d 0 148A 47 48,-2.8 50,-2.4 -2,-0.3 2,-0.4 -0.962 8.2-171.3-123.4 139.3 44.0 -56.4 -0.6 100 97 A T - 0 0 3 -2,-0.4 50,-0.1 48,-0.2 -83,-0.1 -0.993 35.1-103.4-131.6 134.4 45.6 -57.9 -3.6 101 98 A D > - 0 0 104 -2,-0.4 4,-2.9 1,-0.1 5,-0.2 -0.290 36.7-119.9 -52.4 139.6 49.3 -58.8 -4.1 102 99 A T H > S+ 0 0 48 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.864 111.2 51.2 -59.2 -40.5 50.8 -56.1 -6.3 103 100 A N H > S+ 0 0 122 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.915 113.4 45.1 -62.1 -43.6 51.9 -58.5 -9.0 104 101 A V H > S+ 0 0 47 -3,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.916 113.6 50.0 -66.4 -43.7 48.4 -60.0 -9.2 105 102 A L H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 5,-0.2 0.899 105.4 56.3 -64.3 -41.8 46.7 -56.6 -9.1 106 103 A Y H X S+ 0 0 85 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.920 106.4 50.1 -55.3 -47.3 48.9 -55.2 -11.9 107 104 A E H X S+ 0 0 119 -4,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.881 110.6 50.3 -61.4 -39.6 47.9 -58.0 -14.3 108 105 A R H X S+ 0 0 72 -4,-1.7 4,-0.6 2,-0.2 -1,-0.2 0.925 115.2 42.0 -62.4 -46.0 44.2 -57.3 -13.5 109 106 A L H <>S+ 0 0 0 -4,-2.5 5,-1.4 1,-0.2 3,-0.4 0.819 110.0 56.8 -75.3 -32.2 44.5 -53.5 -14.2 110 107 A E H ><5S+ 0 0 105 -4,-2.8 3,-1.5 -5,-0.2 -1,-0.2 0.896 104.2 54.2 -61.8 -40.3 46.7 -54.0 -17.2 111 108 A T H 3<5S+ 0 0 122 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.680 97.6 64.9 -70.3 -17.4 43.9 -56.2 -18.8 112 109 A R T 3<5S- 0 0 136 -4,-0.6 -1,-0.3 -3,-0.4 -2,-0.2 0.603 118.0-113.1 -75.3 -14.8 41.4 -53.3 -18.2 113 110 A G T < 5 + 0 0 65 -3,-1.5 -3,-0.2 -4,-0.3 -2,-0.1 0.678 54.7 168.3 88.3 21.0 43.5 -51.3 -20.7 114 111 A Y < - 0 0 47 -5,-1.4 -1,-0.2 1,-0.1 -2,-0.0 -0.429 32.6-124.2 -64.3 135.6 44.8 -48.7 -18.2 115 112 A N > - 0 0 99 -2,-0.1 4,-3.1 1,-0.1 5,-0.2 -0.239 33.7 -91.1 -72.9 172.7 47.6 -46.5 -19.6 116 113 A E H > S+ 0 0 161 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.875 124.4 48.3 -54.6 -46.8 51.0 -46.3 -17.9 117 114 A K H > S+ 0 0 122 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.898 115.7 43.9 -63.9 -43.4 50.2 -43.3 -15.7 118 115 A K H > S+ 0 0 94 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.896 113.6 51.3 -68.9 -42.4 46.9 -44.8 -14.5 119 116 A L H X S+ 0 0 9 -4,-3.1 4,-2.7 2,-0.2 5,-0.2 0.942 112.3 47.1 -56.0 -48.8 48.5 -48.2 -14.0 120 117 A T H X S+ 0 0 58 -4,-2.7 4,-2.6 -5,-0.2 5,-0.2 0.899 111.5 49.5 -64.2 -44.3 51.3 -46.6 -11.9 121 118 A D H X S+ 0 0 63 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.917 115.3 43.7 -60.9 -45.0 48.9 -44.4 -9.8 122 119 A N H X S+ 0 0 16 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.901 113.9 49.5 -68.3 -40.7 46.7 -47.4 -9.0 123 120 A I H X S+ 0 0 24 -4,-2.7 4,-2.4 -5,-0.2 -2,-0.2 0.906 111.6 48.7 -68.7 -37.3 49.6 -49.8 -8.3 124 121 A Q H X S+ 0 0 89 -4,-2.6 4,-2.2 2,-0.2 6,-0.2 0.891 104.6 61.0 -65.9 -38.3 51.2 -47.2 -6.0 125 122 A C H <>S+ 0 0 23 -4,-2.0 5,-2.3 -5,-0.2 6,-0.3 0.918 111.1 40.2 -49.7 -45.7 47.8 -46.8 -4.2 126 123 A E H ><5S+ 0 0 4 -4,-1.6 3,-1.4 3,-0.2 -2,-0.2 0.937 114.2 49.7 -71.8 -47.4 48.0 -50.5 -3.3 127 124 A I H 3<5S+ 0 0 98 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.724 112.8 48.6 -70.9 -20.3 51.7 -50.7 -2.4 128 125 A F T 3<5S- 0 0 118 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.458 107.3-130.3 -90.8 -4.8 51.4 -47.7 -0.2 129 126 A Q T <>5 + 0 0 83 -3,-1.4 4,-2.3 -4,-0.2 5,-0.2 0.856 47.9 161.9 58.1 40.1 48.3 -49.3 1.4 130 127 A V H >< + 0 0 59 -5,-2.3 4,-2.4 -6,-0.2 5,-0.1 0.914 68.2 44.3 -59.3 -49.1 46.4 -46.0 0.9 131 128 A L H > S+ 0 0 8 -6,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.867 111.4 53.3 -69.3 -36.2 42.8 -47.4 1.3 132 129 A Y H > S+ 0 0 69 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.939 112.9 44.5 -60.3 -45.4 43.7 -49.5 4.3 133 130 A E H X S+ 0 0 118 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.873 112.2 52.5 -67.0 -37.9 45.1 -46.4 6.0 134 131 A E H X S+ 0 0 41 -4,-2.4 4,-1.2 -5,-0.2 -2,-0.2 0.918 110.8 48.0 -63.0 -43.1 42.1 -44.3 4.9 135 132 A A H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 3,-0.5 0.926 111.6 48.1 -63.3 -46.1 39.7 -46.9 6.4 136 133 A T H < S+ 0 0 53 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.833 112.6 49.8 -67.9 -30.0 41.6 -47.1 9.7 137 134 A A H < S+ 0 0 89 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.744 117.2 41.0 -74.3 -24.1 41.6 -43.3 9.9 138 135 A S H < S+ 0 0 28 -4,-1.2 2,-0.3 -3,-0.5 -2,-0.2 0.655 117.5 36.0-101.6 -21.2 37.9 -43.1 9.2 139 136 A Y S < S- 0 0 7 -4,-1.9 5,-0.1 -5,-0.1 -1,-0.1 -0.908 94.6 -79.0-134.8 157.7 36.4 -46.0 11.3 140 137 A K >> - 0 0 121 -2,-0.3 3,-1.9 1,-0.1 4,-0.5 -0.312 40.0-125.8 -56.2 136.1 37.0 -47.7 14.6 141 138 A E G >4 S+ 0 0 156 1,-0.3 3,-1.3 2,-0.2 -1,-0.1 0.851 106.5 61.9 -50.7 -41.1 39.9 -50.1 14.4 142 139 A E G 34 S+ 0 0 140 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.625 105.8 45.6 -67.4 -15.7 37.8 -53.0 15.8 143 140 A I G <4 S+ 0 0 40 -3,-1.9 -48,-2.9 -49,-0.1 2,-0.5 0.430 93.8 89.3-106.0 -0.8 35.4 -52.8 12.8 144 141 A V E << +d 95 0A 15 -3,-1.3 2,-0.4 -4,-0.5 -48,-0.2 -0.864 53.1 174.9-101.8 126.1 38.0 -52.6 10.0 145 142 A H E -d 96 0A 72 -50,-2.6 -48,-2.8 -2,-0.5 2,-0.4 -0.994 25.0-137.0-134.3 135.2 39.3 -55.9 8.5 146 143 A Q E -d 97 0A 81 -2,-0.4 -48,-0.2 -50,-0.2 -50,-0.0 -0.742 19.9-163.6 -87.9 139.0 41.7 -56.7 5.7 147 144 A L E -d 98 0A 5 -50,-2.3 -48,-2.8 -2,-0.4 2,-0.2 -0.987 19.6-125.0-121.6 131.3 40.7 -59.5 3.4 148 145 A P E +d 99 0A 60 0, 0.0 -48,-0.2 0, 0.0 10,-0.1 -0.521 27.9 179.1 -70.6 138.8 43.0 -61.3 0.9 149 146 A S + 0 0 10 -50,-2.4 -130,-0.0 -2,-0.2 -51,-0.0 -0.440 42.1 106.7-142.3 61.8 41.6 -61.1 -2.6 150 147 A N S S+ 0 0 27 1,-0.2 -1,-0.1 -50,-0.1 -50,-0.1 0.741 75.5 32.6-107.5 -35.6 44.1 -62.9 -4.9 151 148 A K S >> S- 0 0 129 1,-0.1 4,-1.7 -3,-0.1 3,-0.9 -0.855 78.7-111.0-131.0 156.0 42.6 -66.2 -5.8 152 149 A P H 3> S+ 0 0 102 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.851 117.8 59.5 -55.4 -36.6 39.1 -67.7 -6.4 153 150 A E H 3> S+ 0 0 117 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.827 104.6 50.3 -59.3 -34.5 39.5 -69.7 -3.1 154 151 A E H <> S+ 0 0 56 -3,-0.9 4,-2.6 2,-0.2 -1,-0.2 0.875 107.2 52.6 -73.3 -38.9 39.9 -66.5 -1.3 155 152 A L H X S+ 0 0 35 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.944 110.8 48.5 -56.7 -48.9 36.8 -65.0 -2.9 156 153 A E H X S+ 0 0 141 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.912 112.6 47.8 -58.5 -44.2 34.9 -68.1 -1.7 157 154 A N H X S+ 0 0 89 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.877 111.4 50.8 -63.7 -39.5 36.3 -67.7 1.8 158 155 A N H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 5,-0.3 0.922 110.8 47.8 -64.6 -45.4 35.4 -64.0 1.9 159 156 A V H X S+ 0 0 7 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.952 114.4 47.1 -57.6 -50.0 31.8 -64.7 0.8 160 157 A D H X S+ 0 0 69 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.930 113.7 47.3 -58.6 -49.6 31.5 -67.5 3.4 161 158 A Q H X S+ 0 0 78 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.896 115.1 44.7 -59.0 -47.2 33.1 -65.3 6.3 162 159 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.910 110.8 53.1 -70.9 -40.3 30.9 -62.3 5.5 163 160 A L H X S+ 0 0 46 -4,-2.7 4,-2.2 -5,-0.3 -1,-0.2 0.901 110.7 48.6 -59.1 -39.6 27.7 -64.3 5.1 164 161 A K H X S+ 0 0 124 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.2 0.876 110.5 50.8 -67.6 -37.7 28.4 -65.8 8.5 165 162 A W H X S+ 0 0 66 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.912 108.8 52.1 -64.2 -43.4 29.1 -62.4 10.0 166 163 A I H X S+ 0 0 9 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.932 109.1 49.8 -57.5 -48.6 25.7 -61.1 8.6 167 164 A E H X S+ 0 0 145 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.915 113.0 46.1 -59.2 -44.8 23.8 -64.0 10.2 168 165 A Q H X S+ 0 0 95 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.914 112.0 50.4 -65.2 -43.0 25.4 -63.4 13.6 169 166 A W H X S+ 0 0 27 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.922 110.2 50.5 -62.1 -44.8 24.8 -59.6 13.5 170 167 A I H < S+ 0 0 33 -4,-2.6 4,-0.4 1,-0.2 3,-0.3 0.933 111.3 48.4 -58.5 -46.4 21.2 -60.1 12.5 171 168 A K H >< S+ 0 0 145 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.928 113.0 48.4 -57.5 -46.5 20.7 -62.6 15.4 172 169 A D H 3< S+ 0 0 90 -4,-2.6 3,-0.3 1,-0.2 -1,-0.2 0.736 116.5 41.9 -68.0 -25.8 22.4 -60.1 17.9 173 170 A H T 3< S+ 0 0 85 -4,-1.7 -1,-0.2 -3,-0.3 -168,-0.2 0.194 111.3 54.1-113.4 14.7 20.3 -57.1 16.7 174 171 A N < 0 0 48 -3,-1.0 -1,-0.2 -4,-0.4 -2,-0.1 -0.454 360.0 360.0-140.4 61.4 16.9 -58.8 16.5 175 172 A S 0 0 176 -3,-0.3 -3,-0.1 0, 0.0 -2,-0.0 -0.217 360.0 360.0 -68.2 360.0 16.5 -60.3 19.9