==== 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 TRANSPORT PROTEIN 07-JAN-99 1NFT . COMPND 2 MOLECULE: PROTEIN (OVOTRANSFERRIN); . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR K.MIZUTANI,H.YAMASHITA,H.KUROKAWA,B.MIKAMI,M.HIROSE . 329 1 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15224.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 219 66.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 10.9 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 . 1 0.3 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 . 17 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 14.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 23.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.1 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 2 1 0 1 3 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 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 PARALLEL BRIDGES PER LADDER . 0 0 3 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 4 A K 0 0 149 0, 0.0 2,-0.1 0, 0.0 28,-0.0 0.000 360.0 360.0 360.0 143.1 56.7 71.9 79.3 2 5 A S + 0 0 56 26,-0.1 28,-2.3 2,-0.1 2,-0.4 -0.170 360.0 103.9 -87.0 40.5 55.2 68.3 79.0 3 6 A V E -a 30 0A 38 26,-0.2 2,-0.5 -2,-0.1 28,-0.2 -0.959 60.8-154.6-117.3 133.7 51.9 69.9 79.7 4 7 A I E -a 31 0A 0 26,-2.7 28,-1.5 -2,-0.4 2,-0.8 -0.963 8.0-151.4-108.0 128.2 49.3 70.4 76.9 5 8 A R E -a 32 0A 32 -2,-0.5 47,-2.9 26,-0.2 48,-1.2 -0.855 11.4-158.2-100.4 104.8 46.8 73.2 77.7 6 9 A W E -ab 33 53A 5 26,-2.6 28,-2.7 -2,-0.8 2,-0.5 -0.763 12.1-134.7 -81.8 132.9 43.6 72.3 75.8 7 10 A a E -a 34 0A 0 46,-2.5 2,-0.3 -2,-0.5 48,-0.2 -0.725 24.2-171.5 -92.4 127.8 41.3 75.4 75.2 8 11 A T E -a 35 0A 0 26,-3.0 28,-2.5 -2,-0.5 3,-0.1 -0.812 16.8-161.6-117.0 157.2 37.6 74.8 76.0 9 12 A V + 0 0 48 -2,-0.3 2,-0.3 26,-0.2 26,-0.1 0.220 69.3 35.3-129.6 12.5 34.7 77.1 75.3 10 13 A S S > S- 0 0 33 1,-0.1 4,-2.8 28,-0.1 5,-0.2 -0.969 80.7-110.9-155.8 161.3 31.8 76.1 77.5 11 14 A S H > S+ 0 0 75 -2,-0.3 4,-2.6 2,-0.2 5,-0.1 0.927 116.9 51.4 -71.3 -37.1 31.6 74.7 81.0 12 15 A P H > S+ 0 0 37 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.888 113.2 48.2 -58.8 -34.1 30.4 71.1 80.0 13 16 A E H > S+ 0 0 24 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.944 109.4 51.3 -67.7 -44.7 33.4 71.1 77.6 14 17 A E H X S+ 0 0 31 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.905 110.0 51.6 -58.4 -40.6 35.7 72.4 80.4 15 18 A K H X S+ 0 0 129 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.909 106.5 51.5 -60.3 -48.3 34.3 69.5 82.6 16 19 A K H X S+ 0 0 21 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.922 109.8 51.6 -56.4 -42.6 35.0 66.7 80.0 17 20 A b H >X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 3,-0.7 0.982 107.2 50.9 -62.7 -51.1 38.6 68.0 79.7 18 21 A N H 3X S+ 0 0 44 -4,-2.2 4,-2.7 1,-0.3 -1,-0.2 0.848 108.7 54.4 -61.3 -27.3 39.2 67.9 83.5 19 22 A N H 3X S+ 0 0 53 -4,-2.0 4,-2.3 2,-0.2 -1,-0.3 0.926 108.4 46.3 -69.3 -39.1 37.9 64.3 83.5 20 23 A L H X S+ 0 0 69 -4,-2.5 4,-1.9 2,-0.2 3,-1.0 0.972 108.8 45.4 -57.4 -54.5 43.0 65.2 82.9 22 25 A D H 3< S+ 0 0 97 -4,-2.7 3,-0.3 1,-0.3 4,-0.3 0.916 114.1 51.8 -55.0 -42.4 42.2 63.1 86.0 23 26 A L H 3< S+ 0 0 69 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.711 119.0 32.9 -71.7 -21.6 42.3 60.0 83.8 24 27 A T H X< S+ 0 0 4 -4,-1.3 3,-2.2 -3,-1.0 -1,-0.2 0.533 81.3 113.5-113.9 2.6 45.7 60.8 82.3 25 28 A Q T 3< S+ 0 0 80 -4,-1.9 -2,-0.1 1,-0.3 -1,-0.1 0.695 77.9 52.2 -40.3 -34.2 47.4 62.4 85.3 26 29 A Q T 3 S+ 0 0 190 -4,-0.3 -1,-0.3 -3,-0.1 2,-0.3 0.048 88.1 97.8 -95.0 21.3 49.9 59.6 85.7 27 30 A E S < S- 0 0 76 -3,-2.2 -3,-0.0 2,-0.1 236,-0.0 -0.739 86.8-114.5 -99.3 159.2 51.0 59.7 82.1 28 31 A R S S+ 0 0 193 -2,-0.3 2,-0.5 1,-0.1 -26,-0.1 0.805 105.9 52.3 -68.1 -31.4 54.3 61.6 81.4 29 32 A I S S- 0 0 18 -5,-0.1 2,-0.2 233,-0.1 -26,-0.2 -0.939 83.9-161.3-100.5 125.8 52.5 64.3 79.2 30 33 A S E -a 3 0A 23 -28,-2.3 -26,-2.7 -2,-0.5 2,-0.3 -0.674 11.1-126.5-112.6 164.8 49.6 65.8 81.1 31 34 A L E -a 4 0A 5 -2,-0.2 2,-0.3 -28,-0.2 -26,-0.2 -0.723 19.8-179.0-106.1 153.5 46.5 67.8 80.2 32 35 A T E -a 5 0A 44 -28,-1.5 -26,-2.6 -2,-0.3 2,-0.5 -0.965 21.3-136.5-151.2 135.1 45.3 71.1 81.7 33 36 A b E -a 6 0A 18 -2,-0.3 2,-0.4 -28,-0.2 -26,-0.2 -0.877 14.4-170.0-106.4 124.8 42.1 72.8 80.5 34 37 A V E -a 7 0A 31 -28,-2.7 -26,-3.0 -2,-0.5 2,-0.5 -0.926 12.3-154.0-106.1 134.3 41.9 76.6 79.8 35 38 A Q E +a 8 0A 84 -2,-0.4 2,-0.2 -28,-0.2 -26,-0.2 -0.961 17.1 174.2-110.9 127.2 38.3 78.0 79.3 36 39 A K - 0 0 70 -28,-2.5 3,-0.1 -2,-0.5 4,-0.0 -0.701 39.1-110.1-120.0 178.9 37.8 81.1 77.2 37 40 A A S S+ 0 0 80 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.905 91.5 8.2 -82.2 -38.9 34.6 82.7 76.1 38 41 A T S > S- 0 0 66 -30,-0.1 4,-1.7 1,-0.1 3,-0.2 -0.882 78.4-104.6-135.9 169.6 34.6 82.1 72.4 39 42 A Y H > S+ 0 0 62 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 0.831 119.7 60.1 -69.5 -29.4 36.7 80.0 70.0 40 43 A L H > S+ 0 0 55 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.938 101.8 50.7 -64.1 -41.2 38.3 83.2 68.8 41 44 A D H > S+ 0 0 63 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.913 109.7 53.0 -65.0 -34.9 39.6 84.0 72.3 42 45 A a H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -1,-0.3 0.889 106.1 51.4 -65.7 -35.3 41.0 80.4 72.2 43 46 A I H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.950 112.5 47.4 -65.6 -43.8 42.8 81.1 68.8 44 47 A K H X S+ 0 0 83 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.945 111.6 50.5 -60.8 -45.6 44.4 84.2 70.4 45 48 A A H <>S+ 0 0 3 -4,-2.6 5,-3.1 2,-0.2 6,-1.1 0.866 112.7 45.4 -61.4 -37.7 45.4 82.3 73.5 46 49 A I H ><5S+ 0 0 0 -4,-2.1 3,-1.9 4,-0.2 -2,-0.2 0.973 113.6 49.8 -72.4 -45.3 47.0 79.5 71.5 47 50 A A H 3<5S+ 0 0 26 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.924 110.9 50.7 -54.7 -43.7 48.8 82.0 69.3 48 51 A N T 3<5S- 0 0 106 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.117 116.7-111.0 -89.0 27.2 50.0 83.8 72.5 49 52 A N T < 5S+ 0 0 92 -3,-1.9 -3,-0.2 2,-0.2 -2,-0.1 0.803 89.3 115.3 50.4 35.7 51.4 80.6 74.1 50 53 A E S - 0 0 61 -2,-0.3 4,-2.6 190,-0.2 3,-0.4 -0.402 47.5 -84.5 -82.1-177.2 35.6 73.3 62.0 58 61 A G H > S+ 0 0 3 187,-0.5 4,-2.1 1,-0.2 5,-0.1 0.853 126.9 47.1 -60.7 -39.8 36.8 74.3 58.5 59 62 A G H > S+ 0 0 18 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.893 114.9 47.5 -70.2 -32.1 35.8 78.0 58.5 60 63 A Q H > S+ 0 0 43 -3,-0.4 4,-2.9 2,-0.2 -2,-0.2 0.879 108.5 54.6 -76.6 -36.0 37.4 78.4 61.9 61 64 A V H X S+ 0 0 1 -4,-2.6 4,-1.1 2,-0.2 -2,-0.2 0.892 106.9 52.3 -61.8 -38.2 40.5 76.6 60.7 62 65 A F H >X S+ 0 0 4 -4,-2.1 3,-1.0 -5,-0.2 4,-0.5 0.972 111.8 46.3 -56.6 -53.9 40.6 79.2 57.8 63 66 A E H >< S+ 0 0 75 -4,-2.1 3,-1.5 1,-0.3 7,-0.2 0.931 110.2 52.5 -55.2 -49.4 40.4 81.9 60.4 64 67 A A H 3< S+ 0 0 0 -4,-2.9 7,-3.0 1,-0.3 -1,-0.3 0.673 106.8 53.4 -63.2 -19.5 43.1 80.4 62.7 65 68 A G H << S+ 0 0 14 -4,-1.1 -1,-0.3 -3,-1.0 -2,-0.2 0.530 90.1 93.0 -96.0 -5.8 45.6 80.1 59.8 66 69 A L S XX S- 0 0 41 -3,-1.5 4,-2.3 -4,-0.5 3,-0.7 -0.403 85.9 -52.4 -82.0 162.7 45.4 83.7 58.8 67 70 A A T 34 S+ 0 0 74 1,-0.3 -1,-0.1 2,-0.2 -2,-0.1 -0.522 117.7 24.1 -68.3 143.0 47.8 86.4 60.1 68 71 A P T 34 S+ 0 0 100 0, 0.0 -1,-0.3 0, 0.0 -4,-0.1 -0.994 129.4 40.7 -94.8 -3.0 48.6 87.1 62.9 69 72 A Y T <4 - 0 0 63 -3,-0.7 -2,-0.2 -6,-0.2 -4,-0.1 0.917 69.0-179.2 -72.4 -52.3 47.7 83.8 64.4 70 73 A K < + 0 0 125 -4,-2.3 183,-0.4 -7,-0.2 -5,-0.3 0.795 15.6 166.0 51.6 40.0 49.0 81.4 61.7 71 74 A L - 0 0 4 -7,-3.0 242,-0.3 -5,-0.3 181,-0.2 -0.438 20.9-151.7 -76.2 154.4 47.9 78.2 63.4 72 75 A K E -D 251 0B 18 179,-2.4 179,-2.0 -2,-0.1 2,-0.3 -0.920 21.7-104.1-127.5 151.5 48.0 75.0 61.2 73 76 A P E +D 250 0B 0 0, 0.0 177,-0.2 0, 0.0 3,-0.1 -0.629 35.5 175.8 -72.0 136.4 45.8 71.8 61.5 74 77 A I E + 0 0 0 175,-2.8 233,-1.6 1,-0.4 2,-0.3 0.542 64.7 11.7-121.3 -12.9 47.8 68.9 63.0 75 78 A A E -DE 249 306B 0 174,-0.9 174,-2.0 231,-0.3 -1,-0.4 -0.971 67.6-156.5-160.0 155.0 45.2 66.1 63.3 76 79 A A E -DE 248 305B 0 229,-2.4 229,-2.0 -2,-0.3 172,-0.2 -0.982 21.5-105.5-143.7 147.4 41.7 65.7 61.9 77 80 A E E - E 0 304B 1 170,-2.9 2,-0.4 -2,-0.3 227,-0.2 -0.454 23.3-152.9 -71.5 150.7 38.6 63.7 62.7 78 81 A V E - E 0 303B 2 225,-1.9 224,-2.9 -2,-0.1 225,-0.8 -0.928 14.2-165.7-117.1 141.8 37.6 60.7 60.7 79 82 A Y E > > - E 0 301B 2 6,-0.5 3,-0.9 -2,-0.4 5,-0.6 -0.890 28.7-116.6-125.5 162.2 33.8 59.9 60.6 80 83 A E G > 5S+ 0 0 155 220,-0.5 3,-0.6 -2,-0.3 -1,-0.1 0.824 107.7 56.9 -66.6 -35.9 31.9 56.7 59.4 81 84 A H G 3 5S+ 0 0 92 1,-0.2 -1,-0.2 2,-0.1 7,-0.0 0.426 107.5 47.0 -79.8 -6.3 30.0 58.2 56.5 82 85 A T G X 5S- 0 0 11 -3,-0.9 3,-1.2 3,-0.1 -1,-0.2 0.299 101.3-132.4-122.8 8.4 33.1 59.5 54.7 83 86 A E T < 5 - 0 0 140 -3,-0.6 -3,-0.1 -4,-0.3 3,-0.1 0.880 67.7 -30.7 51.4 67.3 35.2 56.4 54.9 84 87 A G T 3 -H 221 0C 67 105,-0.5 3,-1.3 -2,-0.3 125,-0.3 -0.618 46.4-108.7 -77.1 142.4 15.3 68.7 39.1 97 100 A K T 3 S+ 0 0 85 123,-2.7 3,-0.1 1,-0.2 -1,-0.1 -0.406 103.5 34.6 -66.7 143.9 16.1 66.1 36.4 98 101 A G T 3 S+ 0 0 59 1,-0.4 -1,-0.2 -2,-0.1 2,-0.1 0.195 82.6 110.5 97.5 -25.6 14.8 67.3 33.0 99 102 A T < - 0 0 47 -3,-1.3 -1,-0.4 1,-0.1 -4,-0.0 -0.430 59.9-151.4 -70.2 161.6 15.4 71.0 33.4 100 103 A E + 0 0 165 -3,-0.1 -1,-0.1 -2,-0.1 -2,-0.0 0.725 49.4 115.4-115.6 -14.1 18.3 71.7 30.9 101 104 A F - 0 0 20 4,-0.1 2,-0.2 1,-0.1 -2,-0.1 -0.112 45.9-156.9 -55.7 151.1 20.3 74.7 32.2 102 105 A T > - 0 0 38 122,-0.1 3,-1.6 128,-0.0 127,-0.1 -0.514 42.2 -84.5-113.6-173.0 23.9 74.1 33.2 103 106 A V G > S+ 0 0 30 122,-0.5 3,-1.0 1,-0.3 4,-0.2 0.758 127.4 67.1 -66.2 -23.6 26.1 76.2 35.6 104 107 A N G 3 S+ 0 0 143 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.761 103.6 45.0 -69.1 -19.5 26.8 78.4 32.5 105 108 A D G < S+ 0 0 70 -3,-1.6 -1,-0.2 1,-0.1 -2,-0.1 -0.150 75.6 112.8-113.5 35.6 23.0 79.5 32.6 106 109 A L X + 0 0 2 -3,-1.0 3,-2.4 2,-0.1 -1,-0.1 0.796 45.7 103.6 -83.9 -25.2 22.5 80.2 36.3 107 110 A Q T 3 S+ 0 0 135 1,-0.3 46,-0.2 -3,-0.2 3,-0.1 -0.350 89.1 17.5 -59.6 126.1 22.0 83.9 35.9 108 111 A G T 3 S+ 0 0 41 44,-3.1 -1,-0.3 1,-0.3 45,-0.2 0.413 97.1 120.8 89.8 -1.1 18.4 84.8 36.2 109 112 A K < - 0 0 50 -3,-2.4 45,-2.0 43,-0.2 46,-0.6 -0.361 64.6-115.5 -83.9 169.8 17.3 81.5 37.9 110 113 A T E -i 155 0C 22 43,-0.2 91,-2.4 44,-0.2 92,-0.9 -0.817 35.6-158.8-101.8 153.3 15.6 81.3 41.3 111 114 A S E -ij 156 202C 0 44,-1.3 46,-1.8 -2,-0.3 2,-0.4 -0.946 19.7-144.1-139.9 156.8 17.5 79.6 44.2 112 115 A c E +ij 157 203C 1 90,-2.6 92,-2.6 -2,-0.3 2,-0.3 -0.947 23.7 179.6-117.9 126.2 17.1 77.9 47.6 113 116 A H E - j 0 204C 1 44,-2.0 3,-0.1 -2,-0.4 9,-0.1 -0.921 35.1-125.9-127.8 154.6 19.8 78.3 50.2 114 117 A T S S- 0 0 3 90,-0.6 73,-2.1 -2,-0.3 2,-0.2 0.805 78.4 -53.2 -69.3 -36.3 20.0 76.9 53.7 115 118 A G > - 0 0 0 71,-0.2 3,-1.2 3,-0.1 -1,-0.3 -0.816 66.1 -69.3 169.3 163.0 20.5 80.4 55.3 116 119 A L T 3 S+ 0 0 63 43,-2.8 3,-0.1 1,-0.2 6,-0.1 -0.508 116.1 14.4 -69.9 130.8 22.7 83.5 55.0 117 120 A G T 3 S+ 0 0 44 1,-0.3 -1,-0.2 -2,-0.2 2,-0.2 0.423 92.1 129.8 89.8 -3.2 26.3 82.8 56.3 118 121 A R <>> - 0 0 87 -3,-1.2 5,-2.6 1,-0.1 4,-1.6 -0.613 60.8-123.2 -85.6 148.6 26.1 79.0 56.2 119 122 A S T 4>S+ 0 0 34 -2,-0.2 5,-2.6 3,-0.2 3,-0.5 0.973 100.8 25.8 -54.6 -74.6 28.8 76.9 54.5 120 123 A A T 45S+ 0 0 3 1,-0.2 -1,-0.2 3,-0.2 121,-0.0 0.835 127.7 45.2 -66.9 -34.5 27.1 74.7 51.9 121 124 A G T 45S- 0 0 0 3,-0.1 -1,-0.2 -8,-0.1 83,-0.2 0.673 134.5 -4.2 -85.6 -18.1 24.1 77.0 51.4 122 125 A W T X>S+ 0 0 6 -4,-1.6 4,-1.6 -3,-0.5 5,-0.5 0.560 122.6 51.7-141.2 -51.5 25.8 80.4 51.1 123 126 A N H >5S+ 0 0 3 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.938 121.7 41.0 -57.8 -48.4 28.2 78.6 46.2 126 129 A I H X5S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 5,-0.2 0.927 115.2 49.1 -72.4 -43.8 28.4 82.4 46.3 127 130 A G H XS+ 0 0 9 -4,-2.2 5,-2.1 2,-0.2 6,-1.7 0.859 114.9 47.6 -67.7 -33.3 30.5 82.3 41.6 130 133 A I H ><5S+ 0 0 21 -4,-2.3 3,-2.1 4,-0.2 -2,-0.2 0.975 112.2 49.5 -69.3 -50.4 32.4 85.5 42.8 131 134 A H H 3<5S+ 0 0 85 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.870 111.9 47.8 -54.9 -43.2 35.8 83.7 42.3 132 135 A R T 3<5S- 0 0 133 -4,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.424 118.0-112.8 -78.2 -0.8 34.9 82.6 38.8 133 136 A G T < 5S+ 0 0 38 -3,-2.1 -3,-0.2 2,-0.3 -2,-0.1 0.607 86.3 117.1 82.8 7.7 33.7 86.0 37.9 134 137 A A S - 0 0 17 4,-0.1 4,-0.8 1,-0.1 -1,-0.3 -0.930 64.5 -64.5 167.1 172.8 34.3 94.2 48.8 140 143 A I T 4 S+ 0 0 119 -2,-0.3 2,-1.5 2,-0.2 -1,-0.1 0.752 115.7 71.1 -54.9 -31.9 32.2 95.3 51.8 141 144 A E T 4 S+ 0 0 185 1,-0.2 -1,-0.1 -3,-0.1 -3,-0.0 -0.863 94.3 56.2 -92.6 93.7 32.3 99.1 50.8 142 145 A S T 4 S- 0 0 66 -2,-1.5 2,-0.3 -4,-0.1 -1,-0.2 -0.625 122.6-119.0-180.0 -58.8 30.1 98.2 48.0 143 146 A G < - 0 0 19 -4,-0.8 -4,-0.1 4,-0.0 5,-0.0 -0.924 57.8 -5.3 136.7-162.1 27.8 96.9 50.7 144 147 A S >> - 0 0 35 -2,-0.3 3,-1.0 1,-0.1 4,-0.8 -0.164 56.9-124.3 -61.3 149.3 26.5 93.5 51.5 145 148 A V H 3> S+ 0 0 14 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.727 107.2 79.4 -63.3 -22.1 27.1 90.5 49.2 146 149 A E H 3> S+ 0 0 5 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.890 91.2 49.7 -56.3 -36.1 23.2 90.4 49.3 147 150 A Q H <> S+ 0 0 71 -3,-1.0 4,-0.6 2,-0.2 -1,-0.2 0.935 110.8 47.4 -69.6 -40.7 23.1 93.2 46.8 148 151 A A H >< S+ 0 0 11 -4,-0.8 3,-1.4 1,-0.2 4,-0.2 0.948 111.9 51.2 -64.2 -44.4 25.6 91.5 44.4 149 152 A V H >X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.3 3,-1.2 0.807 103.4 60.0 -64.8 -28.3 23.6 88.2 44.7 150 153 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147.7 36.8 51.8 74.8 276 279 A K + 0 0 206 -6,-0.3 -1,-0.1 3,-0.0 -5,-0.1 0.274 68.7 101.7-102.0 0.5 35.4 49.8 77.7 277 280 A S S S- 0 0 41 -7,-0.4 -2,-0.0 2,-0.2 -6,-0.0 -0.312 80.9-124.2 -77.3 170.5 36.0 52.9 79.9 278 281 A D S S+ 0 0 150 -2,-0.1 2,-0.4 2,-0.0 -1,-0.1 0.828 93.8 77.3 -86.7 -26.8 33.1 55.2 81.0 279 282 A F - 0 0 17 -260,-0.1 2,-0.5 -259,-0.0 -2,-0.2 -0.613 68.0-164.9 -80.7 130.0 34.9 58.3 79.6 280 283 A H - 0 0 49 -2,-0.4 3,-0.2 3,-0.3 -8,-0.2 -0.974 18.3-155.6-115.5 130.8 34.6 58.5 75.8 281 284 A L S S+ 0 0 0 -10,-2.8 2,-0.6 -2,-0.5 16,-0.3 0.874 93.0 44.1 -65.1 -36.8 36.9 60.8 73.9 282 285 A F S S- 0 0 11 -11,-0.5 -1,-0.2 -3,-0.1 17,-0.2 -0.909 106.3-104.4-115.9 102.1 34.2 60.9 71.1 283 286 A G - 0 0 10 -2,-0.6 -3,-0.3 14,-0.3 17,-0.1 -0.370 25.0-119.8 62.8-120.7 30.6 61.2 72.3 284 287 A P - 0 0 56 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 0.487 46.6-108.9 -66.4 167.5 29.1 58.6 72.2 285 288 A P S S+ 0 0 95 0, 0.0 3,-0.1 0, 0.0 15,-0.0 -0.250 90.8 68.6 -65.6 163.1 26.4 59.9 69.8 286 289 A G + 0 0 73 1,-0.4 2,-0.5 -3,-0.0 3,-0.1 0.563 51.6 144.9 103.1 13.2 22.8 60.6 70.9 287 290 A K - 0 0 86 -3,-0.3 -1,-0.4 1,-0.2 12,-0.1 -0.734 29.3-168.6 -78.0 124.5 23.3 63.6 73.2 288 291 A K + 0 0 188 -2,-0.5 -1,-0.2 -3,-0.1 5,-0.1 0.762 59.1 85.1 -86.8 -29.2 20.1 65.6 72.5 289 292 A D S > S- 0 0 78 1,-0.2 3,-1.8 -3,-0.1 4,-0.4 -0.650 70.9-144.9 -81.7 123.4 21.1 68.7 74.3 290 293 A P G > S+ 0 0 98 0, 0.0 3,-2.1 0, 0.0 -1,-0.2 0.854 100.4 55.6 -47.2 -46.5 23.1 71.2 72.2 291 294 A V G 3 S+ 0 0 76 1,-0.3 -278,-0.1 -3,-0.1 -2,-0.1 0.793 111.5 46.6 -64.4 -22.2 25.2 72.3 75.2 292 295 A L G < S+ 0 0 71 -3,-1.8 3,-0.4 -280,-0.1 2,-0.3 0.415 94.5 105.6 -96.0 -0.7 26.1 68.7 75.8 293 296 A K S < S- 0 0 83 -3,-2.1 5,-0.0 -4,-0.4 -5,-0.0 -0.642 84.5 -6.2 -90.2 137.5 27.0 67.9 72.1 294 297 A D S S- 0 0 56 -2,-0.3 2,-0.5 1,-0.2 -1,-0.2 0.860 73.5-172.6 54.8 50.3 30.4 67.5 70.5 295 298 A L S S- 0 0 26 -3,-0.4 2,-1.8 1,-0.2 -12,-0.3 -0.665 70.0 -21.3 -80.0 120.5 32.4 68.4 73.6 296 299 A L S S+ 0 0 11 -2,-0.5 -241,-0.3 -241,-0.1 2,-0.3 -0.385 143.5 20.7 75.0 -52.2 36.1 68.6 72.7 297 300 A F S S- 0 0 6 -2,-1.8 -14,-0.3 -16,-0.3 2,-0.1 -0.874 102.4 -80.8-133.6 164.1 35.6 66.4 69.5 298 301 A K > - 0 0 50 -2,-0.3 3,-1.7 1,-0.1 -5,-0.0 -0.419 33.8-130.4 -65.8 145.2 32.5 65.6 67.4 299 302 A D T 3 S+ 0 0 12 1,-0.3 -1,-0.1 -17,-0.2 -17,-0.1 0.725 108.7 54.6 -67.5 -25.6 30.4 62.9 69.0 300 303 A S T 3 S+ 0 0 52 -16,-0.1 -220,-0.5 -17,-0.1 -1,-0.3 0.444 80.4 115.7 -85.2 -3.2 30.4 61.1 65.6 301 304 A A E < -E 79 0B 3 -3,-1.7 -222,-0.2 1,-0.1 3,-0.1 -0.372 43.2-171.7 -65.6 141.1 34.2 61.1 65.2 302 305 A I E - 0 0 42 -224,-2.9 -29,-0.5 1,-0.4 2,-0.3 0.491 64.9 -23.0-109.2 -4.4 35.6 57.6 65.2 303 306 A M E -E 78 0B 75 -225,-0.8 -225,-1.9 -31,-0.1 -1,-0.4 -0.934 59.1-111.9 176.9 175.8 39.3 58.5 65.4 304 307 A L E -E 77 0B 4 -2,-0.3 2,-0.4 -227,-0.2 -227,-0.2 -0.914 24.5-160.1-124.4 142.7 41.9 61.3 64.7 305 308 A K E -E 76 0B 89 -229,-2.0 -229,-2.4 -2,-0.3 2,-0.2 -0.981 26.4-108.8-127.8 143.9 44.6 61.1 62.0 306 309 A R E -E 75 0B 65 -2,-0.4 -231,-0.3 -231,-0.3 -232,-0.1 -0.560 28.3-131.8 -71.6 130.9 47.7 63.1 61.9 307 310 A V - 0 0 6 -233,-1.6 -1,-0.1 -2,-0.2 9,-0.0 -0.758 37.2 -98.0 -81.5 125.6 47.8 65.8 59.1 308 311 A P > - 0 0 86 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.162 32.3-116.2 -41.3 140.6 51.1 65.7 57.1 309 312 A S T 3 S+ 0 0 87 1,-0.3 -2,-0.0 -3,-0.0 0, 0.0 0.693 111.4 56.0 -57.3 -27.8 53.6 68.3 58.3 310 313 A L T 3 S+ 0 0 162 2,-0.0 2,-0.4 5,-0.0 -1,-0.3 0.599 81.8 98.9 -87.7 -3.7 53.6 70.1 55.1 311 314 A M < - 0 0 62 -3,-2.0 2,-0.2 4,-0.1 -4,-0.1 -0.636 51.5-175.2 -81.3 129.0 49.8 70.8 54.9 312 315 A D > - 0 0 69 -2,-0.4 4,-2.8 -240,-0.1 5,-0.2 -0.488 48.4 -80.0-100.7-166.7 49.0 74.2 56.0 313 316 A S H > S+ 0 0 8 -242,-0.3 4,-2.9 1,-0.2 5,-0.3 0.938 130.2 50.5 -64.7 -45.4 45.4 75.5 56.3 314 317 A Q H > S+ 0 0 87 1,-0.2 4,-2.0 2,-0.2 8,-0.2 0.891 114.5 43.6 -54.6 -45.4 45.0 76.2 52.6 315 318 A L H 4 S+ 0 0 100 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.889 114.2 51.0 -71.6 -38.2 46.2 72.7 51.6 316 319 A Y H < S+ 0 0 4 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.926 115.7 40.1 -65.1 -45.1 44.1 71.1 54.4 317 320 A L H < S- 0 0 1 -4,-2.9 4,-0.3 -5,-0.2 -2,-0.2 0.881 111.7-126.4 -76.7 -29.1 40.9 72.8 53.4 318 321 A G X - 0 0 17 -4,-2.0 4,-2.7 -5,-0.3 5,-0.2 0.022 21.1 -83.8 98.1 151.5 41.5 72.4 49.6 319 322 A F H > S+ 0 0 110 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.870 121.9 50.2 -58.6 -46.8 41.5 75.0 46.7 320 323 A E H > S+ 0 0 82 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.953 116.3 40.9 -61.9 -49.8 37.8 75.2 46.0 321 324 A Y H > S+ 0 0 4 -4,-0.3 4,-2.3 -78,-0.2 3,-0.3 0.973 118.0 48.3 -63.9 -50.0 36.8 75.7 49.7 322 325 A Y H X S+ 0 0 36 -4,-2.7 4,-2.6 -8,-0.2 -2,-0.2 0.882 111.7 45.9 -60.1 -46.4 39.6 78.1 50.3 323 326 A S H X S+ 0 0 16 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.799 112.1 54.0 -72.3 -22.3 39.1 80.4 47.3 324 327 A A H X S+ 0 0 0 -4,-1.5 4,-0.5 -5,-0.3 -2,-0.2 0.935 112.2 41.1 -74.2 -43.8 35.4 80.5 47.9 325 328 A I H >< S+ 0 0 14 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.922 112.2 56.5 -71.6 -39.5 35.7 81.7 51.6 326 329 A Q H >< S+ 0 0 68 -4,-2.6 3,-1.0 -5,-0.3 -1,-0.2 0.872 105.3 52.8 -53.8 -38.6 38.5 84.0 50.6 327 330 A S H 3< S+ 0 0 25 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.609 99.2 64.5 -72.3 -15.4 36.1 85.6 48.0 328 331 A M T << 0 0 28 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 0.364 360.0 360.0 -90.6 10.3 33.5 86.2 50.7 329 332 A R < 0 0 160 -3,-1.0 -1,-0.0 -4,-0.1 -4,-0.0 -0.954 360.0 360.0-129.8 360.0 35.6 88.6 52.7