==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL CYCLE 17-SEP-07 2RAW . COMPND 2 MOLECULE: BACULOVIRAL IAP REPEAT-CONTAINING PROTEIN 5; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.G.HYMOWITZ . 193 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13151.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 135 69.9 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 . 9 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 1 0.5 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 . 4 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 97 50.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 1 2 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 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 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 . 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 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 5 A T 0 0 164 0, 0.0 6,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 145.3 29.2 16.0 17.8 2 6 A L - 0 0 18 1,-0.1 5,-0.1 2,-0.1 0, 0.0 -0.388 360.0 -92.5 -69.7 153.8 26.5 13.4 17.3 3 7 A P >> - 0 0 43 0, 0.0 4,-1.7 0, 0.0 3,-1.6 -0.458 38.6-112.9 -63.5 141.9 26.4 11.2 14.1 4 8 A P T 34 S+ 0 0 106 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.779 118.1 56.3 -47.1 -32.6 24.3 12.8 11.4 5 9 A A T 34 S+ 0 0 53 1,-0.2 4,-0.1 2,-0.1 -3,-0.0 0.829 110.9 41.3 -68.9 -34.6 21.8 10.0 11.8 6 10 A W T X4 S+ 0 0 62 -3,-1.6 3,-1.3 1,-0.2 4,-0.3 0.664 95.5 80.9 -91.0 -16.2 21.3 10.6 15.5 7 11 A Q G >< S+ 0 0 62 -4,-1.7 3,-2.2 1,-0.2 6,-0.3 0.903 82.2 61.9 -53.1 -48.2 21.2 14.4 15.3 8 12 A P G 3 S+ 0 0 18 0, 0.0 -1,-0.2 0, 0.0 46,-0.2 0.595 87.4 73.5 -62.3 -13.2 17.5 14.7 14.2 9 13 A F G < S+ 0 0 0 -3,-1.3 2,-0.5 -4,-0.1 -2,-0.2 0.717 84.6 81.2 -67.1 -24.2 16.3 13.0 17.4 10 14 A L S X> S- 0 0 19 -3,-2.2 4,-1.4 -4,-0.3 3,-0.9 -0.781 79.7-140.4 -91.8 127.5 17.1 16.3 19.2 11 15 A K H 3> S+ 0 0 63 -2,-0.5 4,-1.5 1,-0.3 3,-0.2 0.838 100.9 53.8 -54.9 -42.0 14.5 19.0 18.8 12 16 A D H 3> S+ 0 0 116 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.825 105.5 53.5 -67.4 -31.5 17.0 21.8 18.4 13 17 A H H <4 S+ 0 0 66 -3,-0.9 4,-0.3 -6,-0.3 -1,-0.2 0.827 107.6 52.3 -67.9 -32.8 18.7 20.0 15.5 14 18 A R H >< S+ 0 0 8 -4,-1.4 3,-0.6 -3,-0.2 27,-0.4 0.821 106.8 53.1 -71.1 -32.3 15.2 19.7 13.8 15 19 A I H >< S+ 0 0 45 -4,-1.5 3,-1.2 1,-0.2 -2,-0.2 0.859 103.0 57.3 -69.2 -36.5 14.7 23.5 14.2 16 20 A S T 3< S+ 0 0 94 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.512 91.8 70.3 -78.0 -5.2 18.0 24.4 12.5 17 21 A T T < S+ 0 0 50 -3,-0.6 2,-0.4 -4,-0.3 -1,-0.2 0.595 76.7 104.2 -81.2 -11.5 17.1 22.4 9.3 18 22 A F < - 0 0 31 -3,-1.2 2,-0.4 -4,-0.2 24,-0.0 -0.584 47.7-177.8 -83.1 123.7 14.4 25.1 8.4 19 23 A K - 0 0 145 -2,-0.4 -2,-0.0 1,-0.1 -3,-0.0 -0.985 68.4 -12.4-124.7 130.9 15.3 27.6 5.6 20 24 A N S S+ 0 0 142 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.0 0.790 78.6 178.4 51.9 33.1 13.0 30.5 4.4 21 25 A W - 0 0 8 1,-0.2 -1,-0.2 2,-0.1 28,-0.1 -0.544 17.6-155.2 -68.1 115.6 10.1 28.9 6.4 22 26 A P S S+ 0 0 90 0, 0.0 2,-1.0 0, 0.0 -1,-0.2 0.652 71.7 79.4 -75.5 -20.0 7.3 31.4 5.8 23 27 A F + 0 0 39 6,-0.2 2,-0.3 41,-0.1 -2,-0.1 -0.781 66.1 151.5 -94.6 98.4 5.2 30.8 8.9 24 28 A L - 0 0 77 -2,-1.0 2,-1.0 6,-0.2 6,-0.1 -0.877 46.9 -8.5-131.7 158.4 6.9 32.6 11.7 25 29 A E S S+ 0 0 171 -2,-0.3 2,-0.4 1,-0.2 5,-0.1 -0.466 126.4 35.9 62.3 -95.3 6.2 34.4 15.0 26 30 A G S S+ 0 0 82 -2,-1.0 2,-0.3 3,-0.1 -1,-0.2 0.021 96.0 106.7 -85.3 29.7 2.4 34.5 15.3 27 31 A C > - 0 0 35 -2,-0.4 3,-0.5 1,-0.1 39,-0.2 -0.764 69.1-136.4-109.1 153.0 1.6 31.1 13.7 28 32 A A T 3 S+ 0 0 42 37,-1.8 2,-0.4 -2,-0.3 38,-0.2 0.713 107.1 57.2 -71.4 -23.1 0.4 27.8 15.0 29 33 A C T 3 S+ 0 0 0 36,-1.0 -1,-0.2 39,-0.1 -6,-0.2 -0.494 73.5 159.0-108.8 59.9 3.0 26.2 12.7 30 34 A T <> - 0 0 16 -3,-0.5 4,-1.9 -2,-0.4 3,-0.5 -0.434 57.0-109.9 -67.5 153.0 6.2 27.9 13.9 31 35 A P H > S+ 0 0 14 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.784 121.6 55.8 -56.5 -24.9 9.4 26.0 13.0 32 36 A E H > S+ 0 0 109 2,-0.2 4,-1.4 1,-0.2 -17,-0.1 0.824 108.2 44.2 -76.6 -35.4 9.7 25.3 16.7 33 37 A R H > S+ 0 0 96 -3,-0.5 4,-0.7 2,-0.2 -1,-0.2 0.714 113.0 53.9 -80.0 -23.0 6.2 23.6 16.9 34 38 A M H X>S+ 0 0 0 -4,-1.9 5,-2.4 2,-0.2 4,-0.9 0.904 110.1 46.0 -70.8 -46.4 7.0 21.8 13.7 35 39 A A H <5S+ 0 0 0 -4,-2.0 3,-0.3 1,-0.2 -2,-0.2 0.847 110.0 54.9 -62.3 -35.9 10.2 20.4 15.3 36 40 A E H <5S+ 0 0 81 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.707 105.6 52.3 -72.9 -22.0 8.2 19.5 18.4 37 41 A A H <5S- 0 0 0 -4,-0.7 -1,-0.2 -3,-0.4 -2,-0.2 0.682 127.5-102.2 -79.9 -23.6 5.8 17.5 16.2 38 42 A G T <5S+ 0 0 0 -4,-0.9 16,-2.3 1,-0.3 17,-0.3 0.357 72.7 142.1 119.4 0.5 8.8 15.7 14.8 39 43 A F E < -A 53 0A 1 -5,-2.4 2,-0.3 14,-0.2 -1,-0.3 -0.368 31.3-165.3 -81.1 152.2 9.2 17.4 11.4 40 44 A I E -A 52 0A 28 12,-2.0 12,-2.5 -2,-0.1 2,-0.5 -0.946 26.2-118.6-125.2 146.8 12.4 18.3 9.5 41 45 A H E +A 51 0A 14 -27,-0.4 10,-0.2 -2,-0.3 9,-0.1 -0.789 37.2 164.1 -91.2 128.5 12.4 20.7 6.6 42 46 A C - 0 0 41 8,-2.6 -24,-0.1 -2,-0.5 7,-0.1 -0.732 21.7-160.6-143.2 92.5 13.7 19.3 3.2 43 47 A P + 0 0 76 0, 0.0 2,-0.2 0, 0.0 6,-0.1 -0.234 17.2 168.2 -83.3 160.2 12.7 21.5 0.3 44 48 A T - 0 0 73 3,-0.5 6,-0.0 1,-0.1 0, 0.0 -0.420 45.4 -93.0-134.6-144.7 12.4 20.9 -3.5 45 49 A E S S+ 0 0 159 -2,-0.2 -1,-0.1 2,-0.1 0, 0.0 0.817 111.9 50.5-104.8 -56.5 11.0 22.8 -6.4 46 50 A N S S+ 0 0 142 1,-0.3 0, 0.0 2,-0.1 0, 0.0 0.871 131.8 12.9 -53.4 -47.5 7.4 21.6 -6.9 47 51 A E > - 0 0 73 1,-0.1 3,-0.9 14,-0.0 -3,-0.5 -0.891 68.2-175.8-134.1 97.7 6.5 22.1 -3.2 48 52 A P T 3 S+ 0 0 84 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 0.498 78.9 67.0 -78.7 -2.3 9.1 24.1 -1.4 49 53 A D T 3 + 0 0 29 -6,-0.1 2,-0.5 -7,-0.1 14,-0.1 0.024 69.5 150.2-100.0 26.5 7.4 23.7 2.0 50 54 A L < + 0 0 15 -3,-0.9 -8,-2.6 11,-0.1 2,-0.3 -0.451 20.2 179.4 -69.8 112.9 8.1 20.0 2.1 51 55 A A E -AB 41 60A 0 9,-2.9 9,-3.0 -2,-0.5 2,-0.4 -0.832 7.5-164.1-112.3 158.3 8.5 18.7 5.7 52 56 A Q E -AB 40 59A 42 -12,-2.5 -12,-2.0 -2,-0.3 2,-0.3 -0.997 25.0-117.6-147.3 127.3 9.2 15.2 6.8 53 57 A C E > -A 39 0A 0 5,-2.0 4,-1.4 -2,-0.4 -14,-0.2 -0.534 22.2-145.4 -65.9 130.2 8.9 13.4 10.1 54 58 A F T 4 S+ 0 0 1 -16,-2.3 -1,-0.2 -2,-0.3 -15,-0.1 0.751 94.2 42.1 -69.7 -24.1 12.4 12.3 11.1 55 59 A F T 4 S+ 0 0 0 -17,-0.3 52,-0.2 -47,-0.1 -1,-0.2 0.885 129.4 19.8 -93.7 -45.3 11.1 9.1 12.7 56 60 A C T 4 S- 0 0 19 2,-0.1 -2,-0.2 51,-0.1 -1,-0.1 0.512 92.3-132.9-106.7 -9.8 8.4 7.7 10.4 57 61 A F < + 0 0 16 -4,-1.4 2,-0.5 1,-0.2 -3,-0.1 0.680 43.7 161.9 72.5 21.2 9.5 9.6 7.2 58 62 A K - 0 0 73 19,-0.1 -5,-2.0 1,-0.0 2,-0.4 -0.661 29.6-144.4 -78.0 122.4 6.0 10.8 6.3 59 63 A E E -B 52 0A 79 -2,-0.5 2,-0.4 -7,-0.2 -7,-0.2 -0.751 19.2-177.4 -89.9 135.2 6.3 13.7 3.9 60 64 A L E +B 51 0A 13 -9,-3.0 -9,-2.9 -2,-0.4 2,-0.2 -0.999 4.2 173.1-134.7 137.9 3.8 16.5 4.1 61 65 A E + 0 0 105 -2,-0.4 -11,-0.1 -11,-0.2 -14,-0.0 -0.621 50.6 58.6-127.1-177.6 3.6 19.6 1.8 62 66 A G - 0 0 50 -2,-0.2 2,-0.2 1,-0.1 -1,-0.2 0.932 67.9-172.7 57.4 55.1 1.1 22.5 1.4 63 67 A W - 0 0 13 -3,-0.1 -1,-0.1 -14,-0.1 -13,-0.0 -0.529 9.8-157.5 -81.4 147.0 1.2 23.9 5.0 64 68 A E > - 0 0 112 -2,-0.2 3,-1.1 1,-0.0 -41,-0.1 -0.792 26.9-115.9-116.6 162.1 -1.0 26.7 6.3 65 69 A P T 3 S+ 0 0 56 0, 0.0 -37,-1.8 0, 0.0 -36,-1.0 0.781 112.3 53.8 -70.8 -30.1 -0.5 29.1 9.3 66 70 A D T 3 S+ 0 0 119 -38,-0.2 2,-0.3 -39,-0.2 -39,-0.0 0.187 84.1 122.4 -90.1 15.9 -3.4 27.8 11.4 67 71 A D < - 0 0 15 -3,-1.1 3,-0.1 -38,-0.0 -4,-0.0 -0.618 56.2-147.3 -81.2 135.2 -2.1 24.2 11.2 68 72 A D >> - 0 0 58 -2,-0.3 4,-1.6 1,-0.1 3,-1.2 -0.913 10.0-155.7 -97.3 103.2 -1.2 22.2 14.3 69 73 A P H 3> S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.758 91.3 57.6 -49.2 -32.2 1.7 20.0 13.2 70 74 A I H 3> S+ 0 0 38 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.859 107.4 46.4 -69.6 -36.0 0.9 17.5 15.9 71 75 A E H <> S+ 0 0 105 -3,-1.2 4,-2.1 2,-0.2 -1,-0.2 0.765 111.2 51.5 -78.5 -30.7 -2.7 17.0 14.6 72 76 A E H X S+ 0 0 52 -4,-1.6 4,-3.9 2,-0.2 5,-0.3 0.960 111.7 47.8 -63.7 -53.9 -1.5 16.7 11.0 73 77 A H H X S+ 0 0 2 -4,-2.3 4,-2.1 1,-0.2 7,-0.2 0.845 111.8 50.7 -51.9 -44.3 1.0 14.0 12.2 74 78 A K H < S+ 0 0 131 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.937 117.3 39.5 -58.8 -50.1 -1.8 12.3 14.1 75 79 A K H < S+ 0 0 152 -4,-2.1 3,-0.4 1,-0.2 -2,-0.2 0.938 123.5 37.4 -67.8 -49.4 -4.0 12.3 11.1 76 80 A H H < S+ 0 0 94 -4,-3.9 -3,-0.2 1,-0.2 -2,-0.2 0.793 136.6 13.9 -78.6 -29.7 -1.4 11.5 8.4 77 81 A S >< + 0 0 25 -4,-2.1 3,-1.2 -5,-0.3 -1,-0.2 -0.561 67.0 162.4-146.6 72.8 0.7 9.0 10.4 78 82 A S T 3 S+ 0 0 96 -3,-0.4 -4,-0.1 1,-0.2 -3,-0.1 0.639 73.1 59.4 -73.5 -13.8 -1.1 7.9 13.5 79 83 A G T 3 S+ 0 0 68 4,-0.0 -1,-0.2 -23,-0.0 2,-0.2 0.347 72.1 128.7-100.1 3.3 1.1 4.8 14.1 80 84 A C X> - 0 0 3 -3,-1.2 4,-0.6 -7,-0.2 3,-0.5 -0.429 57.8-141.0 -60.2 129.4 4.3 6.7 14.4 81 85 A A G >4 S+ 0 0 16 1,-0.2 3,-0.9 2,-0.2 4,-0.4 0.811 98.1 65.8 -63.2 -35.9 6.2 5.7 17.6 82 86 A F G >4 S+ 0 0 21 1,-0.2 3,-1.2 2,-0.2 -1,-0.2 0.884 96.2 56.6 -50.1 -47.5 7.3 9.4 18.2 83 87 A L G <4 S+ 0 0 49 -3,-0.5 -1,-0.2 1,-0.2 -2,-0.2 0.771 107.1 49.8 -56.7 -30.1 3.7 10.3 18.8 84 88 A S G << S+ 0 0 95 -3,-0.9 2,-0.6 -4,-0.6 -1,-0.2 0.413 82.0 102.7 -95.3 -2.3 3.4 7.7 21.6 85 89 A V < - 0 0 46 -3,-1.2 4,-0.1 -4,-0.4 -3,-0.0 -0.778 50.4-168.9 -89.0 120.3 6.5 8.6 23.6 86 90 A K + 0 0 217 -2,-0.6 2,-0.2 2,-0.1 -1,-0.1 0.729 63.0 65.1 -83.9 -28.4 5.4 10.6 26.7 87 91 A K S S- 0 0 70 1,-0.1 5,-0.1 2,-0.0 -2,-0.0 -0.659 95.6 -91.2 -99.7 157.0 8.8 11.8 27.9 88 92 A Q > - 0 0 130 -2,-0.2 3,-1.7 1,-0.1 4,-0.4 -0.305 33.4-118.5 -68.9 150.2 11.1 14.3 26.1 89 93 A F T 3 S+ 0 0 16 1,-0.3 3,-0.3 2,-0.2 -1,-0.1 0.646 112.2 60.7 -68.1 -17.9 13.7 12.8 23.8 90 94 A E T 3 S+ 0 0 93 1,-0.2 99,-0.3 98,-0.1 -1,-0.3 0.674 100.7 58.4 -77.4 -18.3 16.6 14.3 25.7 91 95 A E S < S+ 0 0 117 -3,-1.7 -2,-0.2 96,-0.1 -1,-0.2 0.604 80.4 117.6 -83.2 -20.0 15.4 12.2 28.7 92 96 A L - 0 0 6 -4,-0.4 96,-1.8 -3,-0.3 97,-0.4 -0.117 61.4-128.7 -52.5 146.7 15.6 8.8 26.9 93 97 A T B > -C 187 0B 27 94,-0.3 4,-2.5 95,-0.1 94,-0.2 -0.467 27.5-105.6 -85.6 167.6 18.0 6.2 28.2 94 98 A L H > S+ 0 0 7 92,-2.1 4,-2.4 89,-0.5 5,-0.2 0.892 121.7 49.7 -57.3 -43.4 20.5 4.4 26.0 95 99 A G H > S+ 0 0 19 89,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.873 113.6 45.1 -69.2 -40.1 18.3 1.3 26.0 96 100 A E H > S+ 0 0 83 88,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.858 112.9 51.6 -64.3 -41.7 15.2 3.2 25.1 97 101 A F H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.901 108.2 49.9 -66.7 -43.8 17.0 5.2 22.4 98 102 A L H X S+ 0 0 27 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.861 109.2 52.5 -63.2 -36.6 18.4 2.2 20.7 99 103 A K H X S+ 0 0 136 -4,-1.3 4,-1.6 2,-0.2 -1,-0.2 0.894 112.3 45.2 -66.2 -43.2 15.0 0.5 20.6 100 104 A L H X S+ 0 0 19 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.871 111.4 52.3 -65.4 -41.1 13.4 3.6 19.0 101 105 A D H X S+ 0 0 12 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.868 106.3 55.2 -63.7 -38.1 16.3 3.9 16.5 102 106 A R H X S+ 0 0 35 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.931 108.9 47.2 -56.7 -47.8 15.8 0.2 15.6 103 107 A E H X S+ 0 0 66 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.871 108.8 54.6 -62.6 -40.0 12.2 1.0 14.8 104 108 A R H X S+ 0 0 35 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.901 106.1 51.9 -57.1 -48.7 13.3 4.1 12.8 105 109 A A H X S+ 0 0 25 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.882 110.9 48.5 -53.2 -42.7 15.6 1.9 10.6 106 110 A K H X S+ 0 0 65 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.842 108.0 54.7 -69.0 -35.1 12.5 -0.3 10.0 107 111 A N H X S+ 0 0 34 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.829 106.8 51.7 -63.6 -34.2 10.4 2.7 9.1 108 112 A K H X S+ 0 0 102 -4,-1.8 4,-2.3 2,-0.2 5,-0.2 0.941 110.0 47.5 -66.8 -52.3 13.0 3.7 6.5 109 113 A I H X S+ 0 0 25 -4,-1.9 4,-2.8 1,-0.2 5,-0.2 0.917 112.5 51.4 -46.9 -53.1 13.0 0.2 4.9 110 114 A A H X S+ 0 0 19 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.795 110.2 46.6 -59.7 -38.3 9.2 0.3 4.9 111 115 A K H X S+ 0 0 42 -4,-1.6 4,-2.8 2,-0.2 -1,-0.2 0.910 114.9 46.6 -74.0 -41.0 8.9 3.7 3.2 112 116 A E H X S+ 0 0 93 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.936 114.2 46.7 -64.6 -47.7 11.4 2.8 0.5 113 117 A T H X S+ 0 0 11 -4,-2.8 4,-3.0 -5,-0.2 -1,-0.2 0.889 112.6 52.4 -60.1 -41.8 9.8 -0.6 -0.2 114 118 A N H X S+ 0 0 83 -4,-1.6 4,-2.5 -5,-0.2 -2,-0.2 0.942 108.7 47.9 -57.0 -54.4 6.5 1.2 -0.2 115 119 A N H X S+ 0 0 72 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.896 114.7 48.3 -52.9 -45.8 7.6 3.8 -2.8 116 120 A K H X S+ 0 0 127 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.954 110.4 48.7 -57.6 -58.1 9.1 1.0 -4.9 117 121 A K H X S+ 0 0 61 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.950 114.2 47.7 -50.9 -53.3 6.1 -1.3 -4.8 118 122 A K H X S+ 0 0 137 -4,-2.5 4,-2.1 1,-0.2 5,-0.2 0.892 110.4 49.8 -55.1 -51.0 3.8 1.7 -5.8 119 123 A E H X S+ 0 0 130 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.933 114.5 46.4 -54.4 -47.3 6.0 2.9 -8.7 120 124 A F H X S+ 0 0 63 -4,-2.4 4,-3.0 1,-0.2 -2,-0.2 0.893 112.1 47.8 -62.5 -48.2 6.1 -0.7 -10.1 121 125 A E H X S+ 0 0 88 -4,-2.6 4,-1.3 -5,-0.2 -1,-0.2 0.837 113.7 48.8 -61.6 -38.1 2.4 -1.4 -9.7 122 126 A E H X S+ 0 0 120 -4,-2.1 4,-1.3 -5,-0.2 -2,-0.2 0.852 114.3 45.1 -71.9 -37.8 1.5 2.0 -11.4 123 127 A T H X S+ 0 0 66 -4,-2.0 4,-2.5 -5,-0.2 5,-0.2 0.894 111.1 52.5 -71.6 -45.1 4.0 1.3 -14.2 124 128 A A H X S+ 0 0 13 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.844 110.0 52.0 -52.5 -36.5 2.7 -2.3 -14.7 125 129 A K H X S+ 0 0 142 -4,-1.3 4,-1.6 -5,-0.2 -1,-0.2 0.870 109.8 46.2 -71.2 -38.6 -0.8 -0.7 -14.9 126 130 A K H X S+ 0 0 149 -4,-1.3 4,-1.5 2,-0.2 -2,-0.2 0.893 116.3 45.7 -73.0 -38.8 0.2 1.8 -17.6 127 131 A V H X S+ 0 0 57 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.900 108.4 54.8 -72.8 -47.9 2.0 -0.9 -19.6 128 132 A R H X S+ 0 0 71 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.942 110.9 47.7 -43.9 -52.8 -0.8 -3.5 -19.3 129 133 A R H X S+ 0 0 157 -4,-1.6 4,-2.5 1,-0.2 -2,-0.2 0.853 108.2 53.4 -66.1 -34.9 -3.1 -0.9 -20.7 130 134 A A H X S+ 0 0 52 -4,-1.5 4,-2.1 2,-0.2 -1,-0.2 0.891 106.3 53.6 -67.7 -37.4 -0.8 0.0 -23.6 131 135 A I H X S+ 0 0 30 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.914 109.3 49.6 -59.7 -45.3 -0.6 -3.7 -24.6 132 136 A E H X S+ 0 0 97 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.917 108.8 50.8 -58.1 -48.7 -4.4 -3.6 -24.7 133 137 A Q H < S+ 0 0 112 -4,-2.5 4,-0.3 2,-0.2 -2,-0.2 0.885 112.0 49.7 -57.4 -37.5 -4.5 -0.5 -26.9 134 138 A L H >< S+ 0 0 124 -4,-2.1 3,-1.5 1,-0.2 -2,-0.2 0.953 109.7 48.6 -67.6 -51.0 -2.0 -2.3 -29.2 135 139 A A H 3< S+ 0 0 70 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.790 112.8 50.3 -58.4 -30.0 -4.1 -5.5 -29.4 136 140 A A T 3< 0 0 85 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.376 360.0 360.0 -88.9 2.5 -7.3 -3.4 -30.2 137 141 A M < 0 0 188 -3,-1.5 -3,-0.1 -4,-0.3 -4,-0.0 -0.233 360.0 360.0 -65.8 360.0 -5.8 -1.2 -33.0 138 !* 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 0.0 139 21 B L > 0 0 82 0, 0.0 4,-0.8 0, 0.0 -4,-0.1 0.000 360.0 360.0 360.0 35.0 -2.7 -11.4 -27.0 140 22 B A T 4 + 0 0 91 1,-0.2 3,-0.4 2,-0.2 4,-0.3 0.991 360.0 21.4 -69.6 -63.7 -5.5 -13.2 -25.0 141 23 B S T > S+ 0 0 79 1,-0.2 4,-1.4 2,-0.2 3,-0.3 0.512 109.3 82.6 -82.9 -7.3 -3.5 -15.4 -22.7 142 24 B F H > S+ 0 0 113 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.879 87.3 53.5 -63.8 -41.4 -0.5 -13.1 -23.1 143 25 B L H X S+ 0 0 22 -4,-0.8 4,-2.1 -3,-0.4 -1,-0.2 0.736 102.9 59.3 -65.0 -24.6 -1.9 -10.7 -20.5 144 26 B K H > S+ 0 0 152 -3,-0.3 4,-1.7 -4,-0.3 -1,-0.2 0.895 106.1 46.1 -70.4 -42.8 -2.2 -13.6 -18.0 145 27 B D H X S+ 0 0 107 -4,-1.4 4,-2.5 2,-0.2 5,-0.3 0.918 112.6 51.2 -62.5 -45.8 1.6 -14.3 -18.3 146 28 B F H X S+ 0 0 45 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.928 110.4 49.4 -53.3 -48.2 2.2 -10.5 -17.8 147 29 B D H X S+ 0 0 56 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.810 110.6 51.4 -65.2 -31.4 -0.1 -10.6 -14.7 148 30 B R H X S+ 0 0 158 -4,-1.7 4,-2.5 2,-0.2 3,-0.3 0.975 111.4 43.5 -68.4 -56.0 1.8 -13.6 -13.3 149 31 B E H X S+ 0 0 144 -4,-2.5 4,-1.4 1,-0.3 -2,-0.2 0.807 112.0 55.7 -66.1 -29.8 5.3 -12.2 -13.6 150 32 B V H X S+ 0 0 26 -4,-2.0 4,-1.7 -5,-0.3 -1,-0.3 0.914 109.6 46.3 -61.0 -44.0 4.1 -8.8 -12.3 151 33 B E H X S+ 0 0 118 -4,-1.4 4,-2.1 -3,-0.3 -2,-0.2 0.893 109.6 52.5 -72.0 -39.9 2.7 -10.6 -9.2 152 34 B I H X S+ 0 0 72 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.810 108.1 54.0 -63.7 -28.7 6.0 -12.7 -8.7 153 35 B R H X S+ 0 0 91 -4,-1.4 4,-2.1 -5,-0.2 -2,-0.2 0.896 106.3 50.4 -70.4 -40.3 7.8 -9.3 -8.8 154 36 B I H X S+ 0 0 30 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.884 110.2 50.2 -63.4 -41.3 5.6 -7.9 -6.0 155 37 B K H X S+ 0 0 154 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.873 108.3 54.0 -59.1 -40.4 6.3 -11.0 -3.9 156 38 B Q H X S+ 0 0 94 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.899 105.5 52.1 -64.3 -43.0 10.0 -10.4 -4.6 157 39 B I H X S+ 0 0 10 -4,-2.1 4,-1.6 1,-0.2 -1,-0.2 0.906 111.8 47.9 -57.1 -41.5 9.8 -6.8 -3.3 158 40 B E H X S+ 0 0 56 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.853 110.4 48.5 -74.6 -36.2 8.2 -8.1 -0.1 159 41 B S H X S+ 0 0 57 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.870 110.5 52.5 -70.8 -35.3 10.6 -10.9 0.6 160 42 B D H X S+ 0 0 76 -4,-2.1 4,-1.6 -5,-0.2 -2,-0.2 0.871 110.7 49.3 -61.6 -38.1 13.5 -8.5 0.1 161 43 B R H X S+ 0 0 48 -4,-1.6 4,-2.6 2,-0.2 3,-0.5 0.973 110.9 47.3 -63.5 -57.1 11.8 -6.1 2.6 162 44 B Q H X S+ 0 0 105 -4,-2.4 4,-2.1 1,-0.3 -2,-0.2 0.858 111.5 52.9 -52.6 -40.5 11.4 -8.9 5.2 163 45 B N H X S+ 0 0 93 -4,-2.2 4,-1.5 2,-0.2 -1,-0.3 0.838 110.3 47.1 -64.3 -35.3 15.0 -9.9 4.6 164 46 B L H X S+ 0 0 79 -4,-1.6 4,-1.2 -3,-0.5 -2,-0.2 0.861 111.5 50.9 -72.2 -36.4 16.1 -6.3 5.3 165 47 B L H X S+ 0 0 28 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.837 109.0 51.6 -69.7 -34.8 13.9 -6.1 8.4 166 48 B K H X S+ 0 0 140 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.893 107.2 52.8 -65.9 -41.1 15.5 -9.3 9.7 167 49 B E H X S+ 0 0 126 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.772 106.9 53.3 -67.3 -25.2 19.0 -7.9 9.2 168 50 B V H X S+ 0 0 18 -4,-1.2 4,-2.5 2,-0.2 5,-0.2 0.924 109.1 48.7 -70.5 -47.4 18.0 -4.8 11.2 169 51 B D H X S+ 0 0 47 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.904 111.6 49.2 -57.7 -47.6 16.9 -7.0 14.1 170 52 B N H X S+ 0 0 92 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.949 112.8 47.4 -55.0 -51.4 20.1 -9.0 14.0 171 53 B L H X S+ 0 0 106 -4,-1.8 4,-1.5 1,-0.2 -2,-0.2 0.912 116.1 42.8 -60.9 -45.3 22.3 -5.9 14.0 172 54 B Y H X S+ 0 0 43 -4,-2.5 4,-1.1 2,-0.2 -1,-0.2 0.800 110.8 55.7 -75.1 -31.5 20.4 -4.2 16.8 173 55 B N H >X S+ 0 0 67 -4,-2.3 4,-2.4 -5,-0.2 3,-0.7 0.960 107.5 48.5 -62.3 -53.4 20.2 -7.4 18.9 174 56 B I H 3X S+ 0 0 76 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.879 112.1 50.3 -50.9 -42.3 24.0 -7.9 18.8 175 57 B E H 3< S+ 0 0 92 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.703 111.2 47.3 -75.7 -22.0 24.5 -4.3 19.8 176 58 B I H X< S+ 0 0 47 -4,-1.1 3,-1.0 -3,-0.7 -1,-0.2 0.758 109.4 54.6 -85.8 -29.9 22.1 -4.5 22.8 177 59 B L H 3< S+ 0 0 136 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.867 102.8 56.5 -65.5 -37.8 23.7 -7.8 23.9 178 60 B R T 3< S+ 0 0 191 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.1 0.360 95.6 88.0 -75.0 6.9 27.1 -6.0 24.0 179 61 B L S < S- 0 0 18 -3,-1.0 2,-0.1 -5,-0.1 -1,-0.0 -0.936 72.0-139.9-115.6 117.2 25.6 -3.4 26.4 180 62 B P >> - 0 0 78 0, 0.0 4,-2.4 0, 0.0 3,-0.8 -0.363 29.5-109.9 -67.6 153.5 25.6 -3.9 30.2 181 63 B K H 3> S+ 0 0 148 1,-0.2 4,-1.1 2,-0.2 -86,-0.1 0.744 115.7 61.4 -54.1 -29.4 22.4 -2.8 32.2 182 64 B A H 34 S+ 0 0 76 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.894 110.1 38.5 -69.0 -43.3 24.3 0.1 33.7 183 65 B L H X4 S+ 0 0 58 -3,-0.8 3,-1.0 1,-0.2 -89,-0.5 0.889 111.8 59.3 -69.9 -42.7 25.0 1.8 30.3 184 66 B R H 3< S+ 0 0 91 -4,-2.4 -89,-2.2 1,-0.2 -88,-0.4 0.758 108.1 46.3 -55.1 -26.5 21.6 0.7 29.1 185 67 B E T 3< S+ 0 0 118 -4,-1.1 -1,-0.2 -5,-0.2 2,-0.2 0.581 92.4 103.9 -93.9 -13.1 20.1 2.8 32.0 186 68 B M S < S- 0 0 69 -3,-1.0 -92,-2.1 -4,-0.5 -91,-0.1 -0.482 88.3 -97.1 -71.0 133.1 22.3 5.8 31.3 187 69 B N B > -C 93 0B 39 -94,-0.2 4,-2.9 -2,-0.2 -94,-0.3 -0.251 35.1-128.8 -42.6 131.6 20.9 8.9 29.6 188 70 B W H > S+ 0 0 3 -96,-1.8 4,-2.2 1,-0.2 -1,-0.1 0.845 107.9 50.0 -62.2 -35.7 21.9 8.5 26.0 189 71 B L H > S+ 0 0 50 -97,-0.4 4,-1.1 -99,-0.3 -1,-0.2 0.845 111.0 48.8 -71.6 -36.9 23.4 12.0 25.7 190 72 B D H 4 S+ 0 0 94 2,-0.2 3,-0.5 1,-0.2 -2,-0.2 0.925 109.9 54.2 -60.9 -48.1 25.4 11.3 28.9 191 73 B Y H < S+ 0 0 92 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.933 105.5 51.3 -50.5 -51.2 26.5 8.0 27.3 192 74 B F H < S+ 0 0 76 -4,-2.2 2,-1.3 1,-0.2 -1,-0.2 0.776 96.3 73.5 -62.7 -29.2 27.7 9.8 24.2 193 75 B A < 0 0 75 -4,-1.1 -1,-0.2 -3,-0.5 -4,-0.0 -0.740 360.0 360.0 -82.6 93.4 29.8 12.2 26.4 194 76 B L 0 0 210 -2,-1.3 -3,-0.1 0, 0.0 -2,-0.1 -0.187 360.0 360.0 -62.5 360.0 32.5 9.6 27.3