==== 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 MEMBRANE PROTEIN 27-JAN-08 3C31 . COMPND 2 MOLECULE: GLUTAMATE RECEPTOR, IONOTROPIC KAINATE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR M.L.MAYER . 510 4 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23336.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 329 64.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 58 11.4 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 . 4 0.8 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 . 21 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 29.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 2 2 0 2 4 0 4 0 0 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 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 0 0 0 PARALLEL BRIDGES PER LADDER . 8 2 4 4 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 . 2 2 2 2 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 4 A R 0 0 174 0, 0.0 46,-2.1 0, 0.0 2,-0.6 0.000 360.0 360.0 360.0 171.0 25.0 20.6 49.4 2 5 A T E -a 47 0A 65 44,-0.2 2,-0.3 46,-0.0 46,-0.3 -0.969 360.0-146.7 -91.0 119.7 23.9 22.8 46.6 3 6 A L E -a 48 0A 0 44,-3.2 46,-2.5 -2,-0.6 2,-0.6 -0.698 6.5-128.6 -87.4 144.0 20.1 22.7 47.1 4 7 A I E -a 49 0A 56 -2,-0.3 76,-2.6 44,-0.2 77,-1.9 -0.840 25.3-162.8 -93.2 125.5 17.9 23.0 44.1 5 8 A V E -ab 50 81A 0 44,-2.8 46,-3.0 -2,-0.6 2,-0.3 -0.928 5.2-154.8-115.3 116.3 15.2 25.7 44.6 6 9 A T E +ab 51 82A 6 75,-2.9 77,-2.0 -2,-0.6 2,-0.3 -0.703 27.8 155.3 -87.8 143.0 12.1 25.9 42.5 7 10 A T E -a 52 0A 4 44,-1.6 46,-2.9 -2,-0.3 2,-0.3 -0.882 30.2-135.4-152.6-177.3 10.5 29.3 42.1 8 11 A I - 0 0 16 75,-0.3 2,-0.4 -2,-0.3 6,-0.1 -0.991 32.2-100.1-147.3 145.4 8.2 31.3 39.8 9 12 A L + 0 0 66 -2,-0.3 2,-0.2 4,-0.1 6,-0.2 -0.554 57.4 146.6 -69.7 124.1 8.4 34.9 38.5 10 13 A E B >> -E 14 0B 39 4,-2.2 4,-2.4 -2,-0.4 3,-1.4 -0.789 49.8 -87.5-160.1 121.1 6.0 37.0 40.6 11 14 A E T 34 S+ 0 0 93 1,-0.3 182,-0.1 -2,-0.2 20,-0.1 -0.550 104.0 1.9 -76.4 137.2 6.6 40.7 41.5 12 15 A P T 34 S+ 0 0 0 0, 0.0 20,-2.5 0, 0.0 -1,-0.3 -0.864 127.1 61.6 -99.1 24.7 8.2 41.7 44.0 13 16 A Y T <4 S+ 0 0 0 -3,-1.4 20,-2.1 1,-0.3 21,-0.8 0.930 120.5 5.4 -77.1 -48.1 9.1 38.2 45.1 14 17 A V B < S+E 10 0B 1 -4,-2.4 -4,-2.2 19,-0.2 2,-0.3 -0.962 78.3 157.2-144.2 118.0 11.1 37.0 42.1 15 18 A M E -F 30 0C 38 15,-2.5 15,-2.3 -2,-0.4 2,-0.4 -0.958 45.3 -99.0-137.6 151.4 11.9 39.3 39.2 16 19 A Y E -F 29 0C 118 -2,-0.3 13,-0.3 13,-0.2 12,-0.1 -0.609 42.1-124.5 -69.1 130.6 14.4 39.5 36.5 17 20 A R - 0 0 69 11,-2.3 2,-0.5 -2,-0.4 6,-0.1 -0.276 23.9-111.9 -64.7 159.2 17.2 41.9 37.3 18 21 A K + 0 0 182 11,-0.0 2,-0.3 2,-0.0 -1,-0.1 -0.863 50.7 144.6-100.0 132.2 18.0 44.8 34.9 19 22 A S - 0 0 58 -2,-0.5 4,-0.1 4,-0.0 0, 0.0 -0.973 54.1-119.6-159.5 156.9 21.3 44.7 33.0 20 23 A D S S+ 0 0 176 -2,-0.3 3,-0.0 2,-0.1 -2,-0.0 0.629 95.4 37.8 -75.9 -16.4 22.7 45.6 29.6 21 24 A K S S- 0 0 149 1,-0.1 -2,-0.0 -3,-0.0 0, 0.0 -0.838 103.3 -65.6-132.2 168.6 23.8 42.1 28.7 22 25 A P - 0 0 93 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.288 49.3-147.5 -56.1 134.8 22.6 38.5 29.2 23 26 A L - 0 0 37 -6,-0.1 2,-0.3 -4,-0.1 5,-0.1 -0.768 12.0-158.3-103.1 158.0 22.5 37.3 32.8 24 27 A Y > - 0 0 172 -2,-0.3 3,-1.1 0, 0.0 4,-0.1 -0.938 43.2 -14.0-138.3 151.2 23.1 33.7 34.0 25 28 A G G > S- 0 0 34 -2,-0.3 3,-1.9 1,-0.3 4,-0.2 -0.177 122.2 -15.8 61.4-147.2 22.4 31.5 36.9 26 29 A N G > S+ 0 0 52 1,-0.3 3,-2.0 2,-0.2 -1,-0.3 0.780 126.3 75.3 -63.6 -24.1 21.1 33.0 40.2 27 30 A D G < S+ 0 0 88 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.580 78.6 75.1 -65.2 -12.7 22.2 36.5 38.9 28 31 A R G < S+ 0 0 71 -3,-1.9 -11,-2.3 -4,-0.1 -1,-0.3 0.776 96.1 59.1 -63.6 -25.7 19.2 36.5 36.6 29 32 A F E < +F 16 0C 9 -3,-2.0 2,-0.3 -13,-0.3 -13,-0.2 -0.731 50.1 165.4-117.7 153.6 16.9 37.2 39.6 30 33 A E E +F 15 0C 74 -15,-2.3 -15,-2.5 -2,-0.3 2,-0.2 -0.961 28.1 89.8-147.3 168.2 16.2 39.6 42.4 31 34 A G S > S- 0 0 0 -2,-0.3 4,-2.5 -17,-0.2 3,-0.4 -0.761 83.7 -47.2 138.1-174.5 13.4 40.3 44.9 32 35 A Y H > S+ 0 0 2 -20,-2.5 4,-2.5 1,-0.3 -19,-0.2 0.872 130.2 49.5 -56.6 -42.4 12.1 39.5 48.3 33 36 A C H > S+ 0 0 2 -20,-2.1 4,-2.5 2,-0.2 -1,-0.3 0.829 108.7 52.0 -72.2 -31.0 12.5 35.7 47.8 34 37 A L H > S+ 0 0 19 -21,-0.8 4,-2.2 -3,-0.4 -1,-0.2 0.895 111.6 47.9 -69.1 -39.4 16.1 36.0 46.6 35 38 A D H X S+ 0 0 31 -4,-2.5 4,-2.3 -22,-0.2 -2,-0.2 0.902 111.1 50.8 -62.6 -42.6 16.8 38.1 49.7 36 39 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 -2,-0.2 0.932 109.9 49.8 -59.7 -47.4 15.1 35.5 51.9 37 40 A L H X S+ 0 0 4 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.900 109.2 52.8 -59.5 -39.7 17.2 32.7 50.3 38 41 A K H X S+ 0 0 115 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.944 111.9 44.3 -61.1 -46.1 20.3 34.7 50.9 39 42 A E H X S+ 0 0 36 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.893 113.7 50.3 -68.2 -38.9 19.4 35.1 54.6 40 43 A L H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 5,-0.3 0.919 111.4 48.4 -62.0 -44.4 18.4 31.4 55.0 41 44 A S H X S+ 0 0 15 -4,-2.8 4,-2.6 -5,-0.2 5,-0.5 0.871 108.4 55.1 -67.4 -34.9 21.6 30.3 53.4 42 45 A N H < S+ 0 0 99 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.962 115.4 38.3 -59.0 -47.2 23.6 32.6 55.7 43 46 A I H < S+ 0 0 57 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.923 127.9 32.1 -71.7 -42.2 22.0 31.0 58.8 44 47 A L H < S- 0 0 56 -4,-3.0 -3,-0.2 -5,-0.2 -1,-0.2 0.624 99.2-128.2 -96.3 -17.9 22.0 27.4 57.6 45 48 A G < + 0 0 68 -4,-2.6 2,-0.4 -5,-0.3 -3,-0.2 0.969 55.0 137.4 71.0 53.1 25.1 27.3 55.4 46 49 A F - 0 0 11 -5,-0.5 2,-0.2 -6,-0.1 -1,-0.2 -0.960 46.7-135.2-123.4 154.1 23.9 25.9 52.1 47 50 A L E -a 2 0A 119 -46,-2.1 -44,-3.2 -2,-0.4 2,-0.3 -0.657 28.3-161.1 -93.1 160.0 24.5 26.8 48.5 48 51 A Y E -a 3 0A 50 -46,-0.3 2,-0.5 -2,-0.2 -44,-0.2 -0.996 21.7-152.8-149.5 150.0 21.6 26.9 46.1 49 52 A D E -a 4 0A 50 -46,-2.5 -44,-2.8 -2,-0.3 2,-0.4 -0.991 22.7-144.2-122.1 116.8 20.6 26.9 42.4 50 53 A V E -a 5 0A 1 -2,-0.5 2,-0.4 -46,-0.2 -44,-0.2 -0.726 20.6-179.3 -87.4 128.9 17.4 28.7 41.6 51 54 A K E -a 6 0A 97 -46,-3.0 -44,-1.6 -2,-0.4 2,-0.1 -0.984 26.8-125.2-132.3 122.9 15.3 27.2 38.8 52 55 A L E -a 7 0A 60 -2,-0.4 -44,-0.2 -46,-0.2 -46,-0.1 -0.395 39.5-102.1 -62.7 138.3 12.0 28.5 37.4 53 56 A V > - 0 0 7 -46,-2.9 3,-1.7 1,-0.1 -1,-0.1 -0.395 30.8-133.7 -66.3 125.2 9.3 25.9 37.6 54 57 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.840 100.7 43.6 -58.0 -35.0 9.0 24.6 34.0 55 58 A D T 3 S- 0 0 76 2,-0.1 3,-0.1 3,-0.0 -2,-0.1 0.441 104.1-126.6 -87.9 -1.7 5.1 24.7 33.7 56 59 A G < + 0 0 42 -3,-1.7 2,-0.3 1,-0.2 -48,-0.1 0.790 66.0 127.9 63.5 30.8 5.0 28.2 35.4 57 60 A K - 0 0 107 1,-0.1 13,-1.4 3,-0.0 -1,-0.2 -0.849 58.3-144.5-120.1 154.3 2.4 27.0 38.0 58 61 A Y - 0 0 15 -2,-0.3 13,-1.7 11,-0.3 12,-0.3 0.932 64.8 -77.3 -78.0 -52.1 2.2 27.2 41.8 59 62 A G + 0 0 4 10,-0.2 2,-0.3 11,-0.2 10,-0.1 -0.022 61.8 150.5 146.1 105.7 0.5 23.8 42.4 60 63 A A - 0 0 24 6,-0.1 8,-1.1 -2,-0.0 2,-0.4 -0.921 40.2-103.3-142.2 168.9 -3.1 22.7 42.0 61 64 A Q B -G 67 0D 99 -2,-0.3 6,-0.2 6,-0.2 2,-0.1 -0.801 25.5-142.7 -98.2 137.9 -4.9 19.4 41.3 62 65 A N > - 0 0 75 4,-2.2 3,-2.2 -2,-0.4 -1,-0.0 -0.201 45.0 -80.3 -80.8-176.5 -6.5 18.5 37.9 63 66 A D T 3 S+ 0 0 175 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.654 133.3 49.9 -61.4 -20.9 -9.8 16.5 37.5 64 67 A K T 3 S- 0 0 163 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.363 120.8-105.8 -98.9 0.2 -7.9 13.3 38.1 65 68 A G S < S+ 0 0 35 -3,-2.2 2,-0.2 1,-0.3 -2,-0.1 0.486 70.8 145.1 90.0 2.7 -6.2 14.5 41.3 66 69 A E - 0 0 101 1,-0.1 -4,-2.2 -5,-0.0 -1,-0.3 -0.559 41.5-133.4 -79.1 139.8 -2.7 15.0 39.7 67 70 A W B -G 61 0D 33 -2,-0.2 2,-0.2 -6,-0.2 -6,-0.2 -0.569 22.9-179.2 -93.8 153.3 -0.5 17.9 40.9 68 71 A N > + 0 0 55 -8,-1.1 4,-1.8 -2,-0.2 3,-0.4 -0.632 40.5 33.4-127.9-170.8 1.4 20.4 38.9 69 72 A G H > S- 0 0 1 1,-0.2 4,-1.9 2,-0.2 -11,-0.3 -0.034 114.5 -24.1 65.9-160.2 3.7 23.4 39.4 70 73 A M H > S+ 0 0 0 -13,-1.4 4,-1.9 -12,-0.3 -1,-0.2 0.857 135.2 59.7 -59.5 -37.8 6.2 23.9 42.2 71 74 A V H > S+ 0 0 0 -13,-1.7 4,-2.7 -3,-0.4 -1,-0.2 0.941 105.8 47.8 -57.6 -45.4 4.2 21.5 44.5 72 75 A K H X S+ 0 0 65 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.874 105.8 58.5 -65.5 -34.0 4.7 18.7 41.9 73 76 A E H <>S+ 0 0 29 -4,-1.9 5,-2.8 1,-0.2 6,-1.0 0.894 110.8 43.2 -58.5 -40.5 8.5 19.5 41.7 74 77 A L H ><5S+ 0 0 0 -4,-1.9 3,-1.8 3,-0.2 -2,-0.2 0.918 110.8 53.4 -72.0 -44.5 8.7 18.8 45.4 75 78 A I H 3<5S+ 0 0 53 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.914 113.2 44.7 -54.4 -42.0 6.5 15.7 45.3 76 79 A D T 3<5S- 0 0 62 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.353 112.2-120.3 -84.9 2.6 8.8 14.2 42.6 77 80 A H T < 5S+ 0 0 136 -3,-1.8 -3,-0.2 2,-0.1 -2,-0.1 0.841 74.9 129.5 58.3 36.6 12.0 15.3 44.4 78 81 A R S - 0 0 13 -2,-0.7 4,-2.9 1,-0.1 5,-0.2 -0.885 49.3-111.9-125.9 157.1 -3.3 25.4 52.3 90 93 A Y H > S+ 0 0 61 -2,-0.3 4,-1.4 397,-0.3 398,-0.1 0.928 116.1 48.8 -49.3 -52.4 -4.9 22.2 53.6 91 94 A V H 4 S+ 0 0 42 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.894 115.7 42.7 -65.6 -37.6 -4.7 20.5 50.3 92 95 A R H >> S+ 0 0 5 1,-0.2 3,-1.8 2,-0.2 4,-1.7 0.902 107.9 58.8 -73.0 -37.2 -1.0 21.4 49.7 93 96 A E H 3< S+ 0 0 7 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.772 98.7 61.6 -67.9 -20.7 0.1 20.6 53.3 94 97 A K T 3< S+ 0 0 103 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.745 113.9 33.0 -71.3 -20.8 -1.1 17.1 52.8 95 98 A V T <4 S+ 0 0 40 -3,-1.8 124,-0.5 -4,-0.4 2,-0.3 0.578 124.2 28.0-115.5 -15.8 1.3 16.4 50.0 96 99 A I E < S-D 218 0A 0 -4,-1.7 2,-0.7 122,-0.2 -1,-0.1 -0.869 78.1-112.2-135.6 168.8 4.5 18.5 50.8 97 100 A D E -D 217 0A 16 120,-2.9 120,-1.1 -2,-0.3 2,-0.3 -0.914 33.9-161.1-106.2 105.8 6.1 19.8 54.1 98 101 A F E -D 216 0A 0 -2,-0.7 118,-0.2 118,-0.2 2,-0.0 -0.630 14.3-126.6 -83.4 144.2 5.8 23.5 54.5 99 102 A S - 0 0 0 116,-2.8 3,-0.1 -2,-0.3 126,-0.1 -0.303 47.2 -80.1 -65.4 167.5 8.0 25.6 56.8 100 103 A K S S- 0 0 8 124,-0.3 115,-0.5 1,-0.1 -1,-0.2 -0.308 70.9 -73.1 -63.5 160.6 6.2 27.9 59.1 101 104 A P - 0 0 30 0, 0.0 113,-0.3 0, 0.0 -1,-0.1 -0.299 33.4-170.0 -67.6 135.1 5.2 31.1 57.4 102 105 A F S S+ 0 0 8 111,-2.4 2,-0.3 1,-0.2 112,-0.1 0.576 84.5 25.9 -89.0 -10.4 7.6 33.8 56.5 103 106 A M E S-I 213 0E 13 110,-1.0 110,-2.1 2,-0.0 2,-0.3 -0.984 71.8-148.8-151.2 139.7 4.7 36.2 55.6 104 107 A T E +I 212 0E 48 -2,-0.3 2,-0.3 108,-0.2 108,-0.2 -0.874 32.8 141.6-110.5 146.0 1.1 36.3 57.0 105 108 A L E -I 211 0E 3 106,-2.8 106,-2.9 -2,-0.3 2,-0.3 -0.909 29.5-144.1-164.3-177.5 -1.8 37.6 54.8 106 109 A G - 0 0 0 -2,-0.3 82,-3.0 104,-0.2 2,-0.2 -0.981 34.7 -85.7-155.5 162.9 -5.4 37.0 53.9 107 110 A I E +J 187 0F 0 -2,-0.3 101,-3.0 80,-0.2 102,-0.4 -0.525 56.2 157.5 -68.0 135.7 -7.7 37.2 50.9 108 111 A S E -J 186 0F 0 78,-2.7 78,-2.4 -2,-0.2 2,-0.4 -0.759 39.3 -89.5-143.6-167.4 -9.1 40.7 50.4 109 112 A I E -JK 185 204F 4 95,-0.8 95,-2.4 97,-0.2 2,-0.5 -0.947 21.0-158.0-118.7 128.9 -10.6 42.8 47.6 110 113 A L E +JK 184 203F 0 74,-3.0 74,-2.4 -2,-0.4 2,-0.3 -0.933 33.6 145.7-100.4 125.2 -8.7 45.0 45.1 111 114 A Y E - K 0 202F 3 91,-2.3 91,-2.7 -2,-0.5 72,-0.1 -0.934 52.2 -82.2-150.2 168.2 -11.0 47.7 43.5 112 115 A R E - K 0 201F 89 -2,-0.3 3,-0.4 70,-0.3 89,-0.3 -0.423 52.5-107.4 -71.8 153.1 -10.9 51.3 42.3 113 116 A K S S+ 0 0 109 87,-1.7 -1,-0.1 1,-0.2 89,-0.0 -0.346 90.7 45.0 -71.5 156.5 -11.2 54.0 45.0 114 117 A G S S+ 0 0 87 1,-0.3 -1,-0.2 3,-0.1 -2,-0.0 0.671 80.0 118.2 88.0 26.1 -14.2 56.2 45.5 115 118 A T S S- 0 0 37 -3,-0.4 -1,-0.3 2,-0.2 -4,-0.0 -0.673 72.2-113.6-114.4 169.4 -17.1 53.7 45.3 116 119 A P S S+ 0 0 122 0, 0.0 2,-0.3 0, 0.0 6,-0.0 0.555 78.5 114.3 -75.0 -7.4 -19.8 52.6 47.8 117 120 A I + 0 0 21 1,-0.1 -2,-0.2 5,-0.0 88,-0.1 -0.505 28.2 158.4 -75.7 129.6 -18.4 49.1 48.1 118 121 A D + 0 0 115 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.430 56.0 10.2-129.1 -2.0 -17.1 48.3 51.5 119 122 A S S > S- 0 0 37 86,-0.1 4,-1.1 1,-0.1 3,-0.3 -0.983 76.5 -94.3-168.4 164.5 -17.0 44.5 51.9 120 123 A A H > S+ 0 0 11 -2,-0.3 4,-2.8 1,-0.2 3,-0.4 0.863 120.8 61.9 -56.5 -40.8 -17.4 41.1 50.3 121 124 A D H > S+ 0 0 85 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.889 98.5 56.5 -58.2 -37.5 -21.0 41.1 51.3 122 125 A D H 4 S+ 0 0 35 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.886 112.5 41.0 -60.3 -38.6 -21.6 44.2 49.2 123 126 A L H >< S+ 0 0 0 -4,-1.1 3,-1.6 -3,-0.4 -2,-0.2 0.916 111.7 55.9 -71.1 -42.3 -20.2 42.3 46.1 124 127 A A H 3< S+ 0 0 3 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.812 101.8 57.0 -63.0 -32.6 -22.1 39.1 46.9 125 128 A K T 3< S+ 0 0 133 -4,-1.8 -1,-0.3 -5,-0.2 2,-0.3 0.257 108.0 46.5 -87.1 14.1 -25.5 40.7 47.1 126 129 A Q < - 0 0 41 -3,-1.6 0, 0.0 3,-0.1 0, 0.0 -0.891 56.0-154.6-146.1 172.0 -25.4 42.1 43.5 127 130 A T S S+ 0 0 98 -2,-0.3 -4,-0.1 3,-0.1 -3,-0.0 0.399 76.6 80.2-135.1 0.2 -24.6 41.2 40.0 128 131 A K S S+ 0 0 182 -5,-0.1 2,-0.4 2,-0.1 53,-0.1 0.969 84.9 62.2 -73.8 -53.2 -23.7 44.4 38.2 129 132 A I S S- 0 0 17 -6,-0.1 2,-0.2 53,-0.1 53,-0.2 -0.598 85.0-140.8 -75.4 122.2 -20.1 44.7 39.4 130 133 A E E +l 182 0F 42 51,-1.9 53,-2.2 -2,-0.4 2,-0.3 -0.596 25.2 176.8 -81.6 148.9 -18.1 41.7 38.2 131 134 A Y E +l 183 0F 2 51,-0.2 2,-0.3 -2,-0.2 53,-0.2 -0.993 9.2 137.2-152.3 151.0 -15.6 40.1 40.5 132 135 A G E -l 184 0F 0 51,-1.7 53,-3.3 -2,-0.3 2,-0.3 -0.886 32.2-118.4-168.1-160.7 -13.3 37.1 40.5 133 136 A A - 0 0 0 -2,-0.3 34,-2.0 51,-0.2 2,-0.4 -0.895 47.6 -66.0-150.1 172.2 -9.9 35.6 41.2 134 137 A V B > -m 167 0G 6 51,-0.5 3,-1.9 -2,-0.3 6,-0.5 -0.544 65.3-105.8 -70.3 125.8 -6.9 34.0 39.5 135 138 A R T 3 S+ 0 0 83 32,-3.1 -1,-0.1 -2,-0.4 3,-0.1 -0.274 96.7 2.1 -60.4 132.3 -8.1 30.7 38.0 136 139 A D T 3 S+ 0 0 98 1,-0.2 -1,-0.3 2,-0.1 -77,-0.1 0.407 99.3 126.5 71.6 3.8 -6.9 27.7 40.0 137 140 A G S <> S- 0 0 5 -3,-1.9 4,-2.3 374,-0.1 -1,-0.2 -0.294 79.4 -96.8 -79.5 174.5 -5.0 29.7 42.7 138 141 A S H > S+ 0 0 9 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.811 122.9 57.2 -64.8 -28.0 -5.6 29.3 46.4 139 142 A T H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.967 108.0 46.1 -68.0 -48.4 -8.0 32.2 46.5 140 143 A M H > S+ 0 0 6 -6,-0.5 4,-2.7 1,-0.2 -2,-0.2 0.926 112.4 52.3 -57.1 -42.6 -10.3 30.6 43.9 141 144 A T H X S+ 0 0 42 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.874 103.5 57.4 -64.1 -37.5 -10.0 27.3 45.8 142 145 A F H X S+ 0 0 20 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.946 111.0 42.6 -54.3 -47.7 -11.1 29.0 49.0 143 146 A F H < S+ 0 0 1 -4,-1.9 3,-0.5 1,-0.2 12,-0.2 0.923 111.0 55.2 -67.5 -42.1 -14.3 30.2 47.3 144 147 A K H < S+ 0 0 113 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.868 117.1 36.2 -57.6 -36.8 -14.9 26.9 45.6 145 148 A K H < S+ 0 0 139 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.582 90.6 113.3 -96.7 -9.1 -14.8 25.0 48.9 146 149 A S < - 0 0 5 -4,-1.2 346,-0.1 -3,-0.5 9,-0.1 -0.320 41.5-171.3 -70.6 145.0 -16.4 27.5 51.3 147 150 A K + 0 0 163 345,-0.1 2,-0.5 4,-0.0 -1,-0.1 0.178 51.8 117.7-112.1 10.9 -19.8 26.7 52.9 148 151 A I S > S- 0 0 60 1,-0.1 4,-2.6 2,-0.0 3,-0.3 -0.689 72.1-129.4 -76.4 127.8 -20.1 30.2 54.3 149 152 A S H > S+ 0 0 86 -2,-0.5 4,-2.4 1,-0.2 5,-0.2 0.870 104.1 49.6 -49.3 -49.5 -23.2 31.6 52.6 150 153 A T H > S+ 0 0 35 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.926 115.4 44.2 -56.4 -46.0 -21.7 34.9 51.4 151 154 A Y H > S+ 0 0 45 -3,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.822 110.2 54.0 -76.1 -29.6 -18.7 33.0 49.9 152 155 A E H X S+ 0 0 83 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.886 109.4 49.8 -60.8 -44.0 -20.9 30.3 48.3 153 156 A K H X S+ 0 0 106 -4,-2.4 4,-1.9 -5,-0.3 -2,-0.2 0.930 111.2 48.7 -62.6 -43.5 -22.9 33.0 46.6 154 157 A M H X S+ 0 0 0 -4,-2.2 4,-3.0 1,-0.2 -1,-0.2 0.900 109.9 51.6 -64.1 -42.5 -19.7 34.6 45.4 155 158 A W H X S+ 0 0 44 -4,-2.4 4,-2.3 -12,-0.2 5,-0.2 0.915 107.0 53.2 -60.5 -41.9 -18.4 31.3 44.1 156 159 A A H X S+ 0 0 60 -4,-2.4 4,-0.9 1,-0.2 -2,-0.2 0.920 113.8 43.9 -58.2 -38.8 -21.6 30.7 42.2 157 160 A F H >< S+ 0 0 24 -4,-1.9 3,-0.6 1,-0.2 8,-0.2 0.947 113.6 48.9 -70.0 -50.6 -21.2 34.1 40.6 158 161 A M H 3< S+ 0 0 0 -4,-3.0 7,-0.5 1,-0.2 8,-0.3 0.831 116.1 43.4 -58.6 -35.8 -17.4 33.7 39.8 159 162 A S H 3X S+ 0 0 38 -4,-2.3 4,-0.9 -5,-0.2 3,-0.3 0.618 93.6 102.5 -90.1 -13.2 -17.9 30.3 38.3 160 163 A S H XX S+ 0 0 42 -4,-0.9 3,-0.9 -3,-0.6 4,-0.8 -0.166 74.8 28.3 -63.5 160.8 -21.0 31.2 36.2 161 164 A R H >4 S- 0 0 100 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 0.896 138.9 -53.7 58.1 45.3 -20.9 31.8 32.5 162 165 A Q H 34 S- 0 0 178 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.2 0.805 98.4 -65.8 52.9 40.6 -17.9 29.6 31.9 163 166 A Q H X< S+ 0 0 56 -3,-0.9 3,-1.9 -4,-0.9 -1,-0.3 0.805 82.2 157.2 59.6 33.9 -15.9 31.4 34.6 164 167 A S T << + 0 0 54 -3,-1.1 -3,-0.1 -4,-0.8 -1,-0.1 0.760 69.0 61.1 -60.7 -23.5 -15.8 34.7 32.6 165 168 A A T 3 S+ 0 0 0 -7,-0.5 -1,-0.3 -5,-0.5 2,-0.1 0.591 89.7 86.4 -80.1 -11.0 -15.2 36.5 35.9 166 169 A L < - 0 0 5 -3,-1.9 2,-0.3 -8,-0.3 -32,-0.2 -0.438 65.5-149.9 -84.0 161.7 -11.9 34.7 36.5 167 170 A V B -m 134 0G 0 -34,-2.0 -32,-3.1 -2,-0.1 3,-0.1 -0.897 18.1-127.4-126.0 162.6 -8.6 35.9 35.2 168 171 A K S S- 0 0 149 -2,-0.3 2,-0.3 -34,-0.2 -34,-0.1 0.767 86.4 -1.3 -80.8 -27.6 -5.5 33.9 34.2 169 172 A N S > S- 0 0 75 1,-0.1 4,-2.0 -36,-0.1 -1,-0.2 -0.971 76.4 -98.2-158.5 167.7 -3.0 35.8 36.3 170 173 A S H > S+ 0 0 10 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.876 116.8 56.9 -65.0 -38.5 -2.8 38.8 38.7 171 174 A D H > S+ 0 0 103 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.907 107.9 49.1 -61.2 -41.9 -1.6 41.3 36.1 172 175 A E H > S+ 0 0 73 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.919 110.8 50.8 -61.4 -44.0 -4.6 40.6 34.0 173 176 A G H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.913 109.4 50.7 -57.0 -45.3 -6.8 41.0 37.1 174 177 A I H X S+ 0 0 14 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.924 110.3 48.5 -63.3 -43.8 -5.2 44.4 37.9 175 178 A Q H X S+ 0 0 112 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.879 110.0 52.4 -62.8 -35.6 -5.7 45.7 34.3 176 179 A R H X S+ 0 0 63 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.914 109.7 48.8 -68.4 -38.6 -9.4 44.6 34.4 177 180 A V H < S+ 0 0 2 -4,-2.3 5,-0.3 1,-0.2 -2,-0.2 0.892 113.2 48.9 -63.6 -39.6 -9.9 46.5 37.8 178 181 A L H < S+ 0 0 49 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.796 122.3 30.5 -71.4 -27.7 -8.3 49.6 36.2 179 182 A T H < S+ 0 0 113 -4,-1.7 2,-0.2 -5,-0.2 -2,-0.2 0.753 119.8 28.0-102.6 -32.5 -10.3 49.6 33.0 180 183 A T S < S- 0 0 65 -4,-2.4 2,-1.7 -5,-0.2 0, 0.0 -0.674 93.4 -79.8-127.7-178.9 -13.7 48.1 33.8 181 184 A D S S+ 0 0 62 -2,-0.2 -51,-1.9 -53,-0.1 2,-0.3 -0.610 82.6 127.5 -88.9 82.7 -16.2 47.7 36.6 182 185 A Y E - l 0 130F 0 -2,-1.7 2,-0.4 -5,-0.3 -70,-0.3 -0.999 46.0-156.3-146.0 137.8 -14.4 44.8 38.2 183 186 A A E - l 0 131F 0 -53,-2.2 -51,-1.7 -2,-0.3 2,-0.5 -0.947 16.0-145.1-115.3 137.9 -13.1 43.8 41.6 184 187 A L E -Jl 110 132F 1 -74,-2.4 -74,-3.0 -2,-0.4 2,-0.6 -0.902 8.5-139.6-107.2 128.8 -10.3 41.2 42.1 185 188 A L E +J 109 0F 2 -53,-3.3 -51,-0.5 -2,-0.5 2,-0.3 -0.769 44.7 161.9 -81.5 120.5 -10.1 38.8 45.0 186 189 A M E -J 108 0F 4 -78,-2.4 -78,-2.7 -2,-0.6 2,-0.1 -0.985 47.0 -89.9-148.3 149.3 -6.4 38.9 45.8 187 190 A E E >> -J 107 0F 2 -2,-0.3 4,-1.9 -80,-0.2 3,-0.9 -0.438 41.4-124.7 -65.8 136.5 -4.0 38.1 48.5 188 191 A S H 3> S+ 0 0 8 -82,-3.0 4,-2.5 1,-0.3 -1,-0.1 0.753 107.1 56.9 -60.3 -31.6 -3.6 41.1 50.8 189 192 A T H 3> S+ 0 0 1 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.874 109.1 48.5 -69.6 -30.6 0.2 41.4 50.5 190 193 A S H <> S+ 0 0 13 -3,-0.9 4,-2.5 2,-0.2 -2,-0.2 0.895 108.9 53.4 -73.7 -37.6 -0.2 41.6 46.7 191 194 A I H X S+ 0 0 1 -4,-1.9 4,-3.0 1,-0.2 5,-0.2 0.933 107.1 51.9 -61.6 -41.9 -2.9 44.3 47.2 192 195 A E H X S+ 0 0 76 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.906 110.8 47.9 -57.8 -44.9 -0.5 46.3 49.3 193 196 A Y H < S+ 0 0 22 -4,-1.7 4,-0.5 1,-0.2 -1,-0.2 0.925 114.6 45.3 -62.1 -44.7 2.2 46.1 46.6 194 197 A V H >X S+ 0 0 10 -4,-2.5 3,-1.2 1,-0.2 4,-1.0 0.887 110.6 51.9 -68.2 -42.0 -0.3 47.1 43.9 195 198 A T H 3< S+ 0 0 34 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.731 102.0 61.0 -74.7 -18.6 -1.9 50.0 45.8 196 199 A Q T 3< S+ 0 0 75 -4,-1.3 56,-0.5 -5,-0.2 -1,-0.3 0.728 117.2 32.9 -68.1 -21.9 1.6 51.5 46.5 197 200 A R T <4 S+ 0 0 91 -3,-1.2 2,-0.4 -4,-0.5 -2,-0.2 0.426 116.4 52.3-117.1 -6.0 1.9 51.8 42.7 198 201 A N >< - 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0 0 29 -3,-1.5 0, 0.0 3,-0.1 0, 0.0 -0.929 53.1-160.4-148.6 169.1 10.9 59.2 78.0 382 130 B T S S+ 0 0 113 -2,-0.3 -1,-0.1 3,-0.1 4,-0.1 0.450 75.7 81.7-133.6 -4.9 10.9 58.0 81.6 383 131 B K S S+ 0 0 139 1,-0.1 2,-0.6 2,-0.1 53,-0.1 0.933 88.0 60.3 -70.3 -47.2 7.9 59.5 83.3 384 132 B I S S- 0 0 2 -6,-0.1 53,-0.2 53,-0.0 2,-0.2 -0.749 85.5-144.5 -82.1 119.0 5.5 56.9 82.0 385 133 B E E +y 437 0M 44 51,-2.0 53,-2.2 -2,-0.6 2,-0.3 -0.502 22.1 179.7 -77.7 151.6 6.7 53.4 83.3 386 134 B Y E +y 438 0M 2 51,-0.2 2,-0.3 -2,-0.2 53,-0.2 -0.990 10.3 139.6-152.5 149.7 6.3 50.4 81.0 387 135 B G E -y 439 0M 0 51,-1.6 53,-3.2 -2,-0.3 2,-0.3 -0.859 30.5-123.0-165.7-159.6 7.0 46.7 81.2 388 136 B A - 0 0 0 -2,-0.3 34,-2.1 51,-0.2 2,-0.4 -0.896 45.8 -65.7-152.8 172.3 5.9 43.2 80.4 389 137 B V B > -z 422 0N 6 51,-0.5 3,-1.6 -2,-0.3 6,-0.5 -0.571 64.6-104.4 -69.7 129.9 5.2 39.9 82.1 390 138 B R T 3 S- 0 0 82 32,-3.3 3,-0.1 -2,-0.4 -1,-0.1 -0.258 94.9 -1.9 -61.7 129.5 8.4 38.5 83.5 391 139 B D T 3 S+ 0 0 95 1,-0.2 -1,-0.2 2,-0.1 -77,-0.2 0.432 98.8 124.4 74.8 -0.2 10.0 35.6 81.5 392 140 B G S <> S- 0 0 6 -3,-1.6 4,-2.2 121,-0.1 -1,-0.2 -0.285 81.3 -93.4 -78.3 177.6 7.2 35.4 78.9 393 141 B S H > S+ 0 0 8 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.784 123.2 58.1 -68.9 -25.4 8.0 35.7 75.2 394 142 B T H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.958 107.7 45.9 -69.5 -43.6 7.3 39.5 75.2 395 143 B M H > S+ 0 0 4 -6,-0.5 4,-2.4 1,-0.2 -2,-0.2 0.935 112.5 51.7 -59.9 -43.8 10.0 40.1 77.8 396 144 B T H X S+ 0 0 40 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.863 104.1 57.3 -63.9 -34.2 12.4 37.8 75.9 397 145 B F H X S+ 0 0 22 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.946 110.5 43.9 -60.9 -46.0 11.7 39.7 72.7 398 146 B F H < S+ 0 0 1 -4,-1.9 12,-0.2 1,-0.2 -2,-0.2 0.899 111.7 53.5 -64.7 -40.8 12.9 42.9 74.4 399 147 B K H < S+ 0 0 104 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.849 116.7 37.3 -61.7 -38.4 15.9 41.2 76.0 400 148 B K H < S+ 0 0 116 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.634 89.7 115.5 -92.8 -16.0 17.2 39.8 72.7 401 149 B S < - 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