==== 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 SIGNALING PROTEIN 17-DEC-06 2E4V . COMPND 2 MOLECULE: METABOTROPIC GLUTAMATE RECEPTOR 3; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR T.MUTO,D.TSUCHIYA,K.MORIKAWA,H.JINGAMI . 1040 6 16 16 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 47561.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 680 65.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 88 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 90 8.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 74 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 125 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 249 23.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.5 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 2 0 0 0 5 1 0 2 2 4 5 0 1 0 0 0 0 0 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 2 2 4 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 PARALLEL BRIDGES PER LADDER . 0 4 6 4 2 0 2 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 . 10 0 0 0 2 0 2 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 30 A R 0 0 155 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 58.2 44.5 -0.8 43.8 2 31 A R + 0 0 101 2,-0.0 66,-0.5 299,-0.0 2,-0.3 -0.590 360.0 146.1 -91.9 151.4 43.9 -4.1 45.5 3 32 A E - 0 0 50 -2,-0.2 2,-0.6 64,-0.1 64,-0.2 -0.978 43.5-115.2-168.4 166.7 42.2 -7.1 43.9 4 33 A I E +A 66 0A 3 62,-1.9 62,-2.1 -2,-0.3 2,-0.6 -0.956 29.8 180.0-119.7 112.1 42.2 -10.9 43.9 5 34 A K E +A 65 0A 73 -2,-0.6 2,-0.5 60,-0.2 60,-0.2 -0.946 6.2 167.8-115.5 112.9 43.2 -12.5 40.6 6 35 A I E -A 64 0A 58 58,-2.9 58,-1.5 -2,-0.6 -2,-0.0 -0.982 28.6-133.5-126.6 118.4 43.2 -16.3 40.4 7 36 A E + 0 0 147 -2,-0.5 2,-0.3 56,-0.2 3,-0.1 -0.241 35.9 150.1 -68.1 158.0 43.6 -17.9 37.0 8 37 A G - 0 0 27 55,-0.1 54,-0.2 1,-0.1 3,-0.1 -0.966 61.2 -91.9-173.6 170.2 41.4 -20.7 35.9 9 38 A D S S+ 0 0 96 52,-1.1 2,-0.3 -2,-0.3 53,-0.2 0.844 119.9 17.4 -64.3 -30.1 39.9 -22.3 32.8 10 39 A L E S-b 62 0A 19 51,-1.7 53,-2.9 -3,-0.1 2,-0.4 -0.985 82.2-148.0-139.7 141.8 36.9 -20.1 33.4 11 40 A V E -bc 63 94A 7 82,-0.5 84,-3.1 -2,-0.3 85,-0.7 -0.956 4.5-157.4-122.6 136.1 36.8 -17.0 35.6 12 41 A L E -bc 64 96A 0 51,-2.1 53,-1.8 -2,-0.4 85,-0.2 -0.917 15.5-141.7-108.2 128.4 34.1 -15.4 37.8 13 42 A G E -bc 65 97A 0 83,-2.4 85,-3.2 -2,-0.5 2,-0.3 -0.555 19.6-162.6 -83.4 153.8 34.3 -11.8 38.7 14 43 A G E -bc 66 98A 0 51,-2.3 53,-3.0 83,-0.2 2,-0.4 -0.995 10.7-163.3-139.9 147.5 33.1 -10.8 42.2 15 44 A L E +bc 67 99A 0 83,-2.2 85,-1.2 -2,-0.3 53,-0.2 -0.994 15.9 164.9-132.7 130.8 32.1 -7.6 43.9 16 45 A F E -b 68 0A 0 51,-1.8 2,-2.4 -2,-0.4 53,-2.3 -0.995 46.1-117.9-144.4 148.1 31.9 -6.9 47.6 17 46 A P + 0 0 1 0, 0.0 20,-0.2 0, 0.0 15,-0.2 -0.427 49.2 158.7 -82.9 65.9 31.7 -3.9 49.8 18 47 A I + 0 0 0 -2,-2.4 14,-3.3 18,-0.3 2,-0.3 0.879 65.3 38.4 -55.5 -39.7 35.0 -4.8 51.4 19 48 A N E S-F 31 0B 10 -3,-0.3 12,-0.2 12,-0.3 11,-0.1 -0.826 87.5-116.4-116.4 155.8 35.4 -1.2 52.5 20 49 A E E - 0 0 44 10,-3.4 9,-2.2 -2,-0.3 52,-0.1 -0.274 55.4 -71.0 -76.1 168.5 32.9 1.3 53.8 21 50 A K E -F 28 0B 54 7,-0.2 9,-0.3 50,-0.2 7,-0.2 -0.405 56.3-112.6 -61.8 137.2 32.2 4.5 51.8 22 51 A G - 0 0 17 5,-2.0 2,-0.4 48,-0.3 7,-0.2 -0.525 29.7-125.5 -72.9 140.5 35.2 6.8 52.0 23 52 A T > - 0 0 109 -2,-0.2 3,-1.2 5,-0.2 2,-0.4 -0.746 66.3 -28.1 -91.3 131.7 34.4 10.0 53.9 24 53 A G T 3 S- 0 0 82 -2,-0.4 -2,-0.1 1,-0.2 178,-0.0 -0.522 133.0 -3.4 72.9-125.0 35.1 13.3 52.2 25 54 A T T 3 S+ 0 0 153 -2,-0.4 -1,-0.2 2,-0.0 2,-0.2 0.667 113.8 90.1 -79.1 -18.7 37.8 13.2 49.5 26 55 A E < - 0 0 96 -3,-1.2 3,-0.1 1,-0.1 -4,-0.0 -0.555 64.6-150.8 -80.9 145.2 38.8 9.6 50.1 27 56 A E S S+ 0 0 93 -2,-0.2 -5,-2.0 1,-0.1 2,-0.3 0.825 77.7 32.1 -84.0 -35.1 37.0 6.9 48.1 28 57 A a E +F 21 0B 38 -7,-0.2 -7,-0.2 -5,-0.1 -5,-0.2 -0.912 64.3 175.3-124.7 151.8 37.2 4.0 50.5 29 58 A G E - 0 0 25 -9,-2.2 -7,-0.2 1,-0.4 -1,-0.1 0.083 45.6 -6.4-122.0-127.3 37.2 3.9 54.3 30 59 A R E S- 0 0 144 -9,-0.3 -10,-3.4 1,-0.1 -1,-0.4 -0.187 77.5 -87.9 -72.2 165.8 37.2 1.3 57.1 31 60 A I E -F 19 0B 7 -12,-0.2 2,-1.1 274,-0.2 -12,-0.3 -0.533 24.4-140.8 -77.9 136.6 36.8 -2.4 56.6 32 61 A N >> - 0 0 11 -14,-3.3 5,-2.4 -2,-0.2 4,-0.7 -0.861 25.8-174.2 -95.9 97.6 33.3 -3.9 56.4 33 62 A E T 4>S+ 0 0 48 -2,-1.1 5,-2.3 3,-0.2 -1,-0.2 0.936 72.1 27.8 -61.6 -54.5 34.2 -7.1 58.4 34 63 A D T 4>S+ 0 0 57 3,-0.2 5,-0.9 1,-0.1 305,-0.2 0.954 131.8 31.4 -78.3 -53.1 31.0 -9.1 58.2 35 64 A R T 45S+ 0 0 2 3,-0.2 -2,-0.1 4,-0.1 -1,-0.1 0.650 133.0 31.9 -83.3 -11.9 29.3 -7.9 55.0 36 65 A G T X5S+ 0 0 0 -4,-0.7 4,-2.2 -18,-0.2 -18,-0.3 0.819 126.9 27.6-104.5 -73.1 32.6 -7.3 53.2 37 66 A I H >X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 3,-1.0 0.957 110.8 47.2 -59.4 -50.0 34.3 -12.2 50.1 41 70 A E H 3X S+ 0 0 0 -4,-2.7 4,-3.5 1,-0.3 -2,-0.2 0.838 103.7 62.2 -62.4 -32.6 35.8 -15.3 51.8 42 71 A A H 3X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.3 0.822 105.3 46.8 -63.0 -30.1 32.5 -17.1 51.3 43 72 A M H X S+ 0 0 40 -4,-2.6 3,-2.1 1,-0.2 4,-0.8 0.948 111.1 50.0 -55.9 -51.4 34.9 -26.4 47.2 50 79 A I H >< S+ 0 0 2 -4,-2.8 3,-0.7 1,-0.3 -1,-0.2 0.847 107.2 55.9 -57.3 -33.7 33.7 -26.4 43.6 51 80 A N H 3< S+ 0 0 53 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.608 110.1 45.4 -76.0 -8.9 37.3 -26.9 42.5 52 81 A K H << S+ 0 0 140 -3,-2.1 2,-0.7 -4,-0.6 -1,-0.2 0.421 91.7 102.9-106.1 -5.5 37.5 -30.1 44.7 53 82 A D X< - 0 0 44 -4,-0.8 3,-0.7 -3,-0.7 -4,-0.0 -0.723 51.2-168.6 -88.6 112.0 34.1 -31.4 43.5 54 83 A N T 3 S+ 0 0 127 -2,-0.7 -1,-0.1 1,-0.2 3,-0.1 0.550 87.4 50.2 -74.5 -7.5 34.4 -34.2 40.9 55 84 A Y T 3 S+ 0 0 204 1,-0.2 2,-0.5 2,-0.1 -1,-0.2 0.547 104.7 59.2-106.6 -9.4 30.7 -34.0 40.0 56 85 A L S < S- 0 0 5 -3,-0.7 -3,-0.2 -6,-0.2 -1,-0.2 -0.962 129.4 -25.2-124.4 112.9 30.5 -30.2 39.4 57 86 A L S > S+ 0 0 6 -2,-0.5 3,-1.6 1,-0.1 -1,-0.1 0.912 79.6 179.0 55.5 43.9 32.7 -28.7 36.7 58 87 A P T 3 S+ 0 0 35 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 -0.484 71.9 24.2 -70.6 157.0 35.3 -31.5 37.0 59 88 A G T 3 S+ 0 0 43 -8,-0.1 2,-0.4 -3,-0.1 311,-0.4 0.433 109.3 86.8 71.6 -8.2 38.0 -30.8 34.5 60 89 A V < - 0 0 2 -3,-1.6 2,-0.2 309,-0.2 -1,-0.1 -0.848 67.2-154.3-129.1 98.4 37.2 -27.1 34.5 61 90 A K - 0 0 103 -2,-0.4 -51,-1.7 1,-0.1 -52,-1.1 -0.491 10.5-140.1 -73.7 136.1 38.9 -25.1 37.2 62 91 A L E - b 0 10A 0 -15,-0.2 -51,-0.2 -2,-0.2 2,-0.2 -0.844 21.2-177.2 -99.1 128.7 37.2 -21.9 38.2 63 92 A G E - b 0 11A 0 -53,-2.9 -51,-2.1 -2,-0.5 2,-0.3 -0.472 11.7-138.6-110.1-175.4 39.3 -18.8 38.9 64 93 A V E -Ab 6 12A 1 -58,-1.5 -58,-2.9 -53,-0.2 2,-0.3 -0.978 21.4-162.6-147.4 161.1 38.3 -15.4 40.1 65 94 A H E -Ab 5 13A 2 -53,-1.8 -51,-2.3 -2,-0.3 2,-0.4 -0.824 28.6-176.1-140.1 92.7 38.7 -11.7 39.8 66 95 A I E -Ab 4 14A 0 -62,-2.1 -62,-1.9 -2,-0.3 2,-0.3 -0.838 0.4-174.4-100.4 131.3 37.3 -10.1 42.9 67 96 A L E - b 0 15A 0 -53,-3.0 -51,-1.8 -2,-0.4 2,-0.3 -0.900 26.0-114.6-126.2 154.1 37.1 -6.3 43.4 68 97 A D E - b 0 16A 5 -66,-0.5 11,-0.1 -2,-0.3 -32,-0.0 -0.624 15.9-168.9 -81.9 138.7 36.2 -3.9 46.2 69 98 A T > - 0 0 1 -53,-2.3 3,-2.3 -2,-0.3 7,-0.5 0.541 24.2-144.7-101.5 -12.8 33.1 -1.8 45.6 70 99 A a T 3 - 0 0 0 -54,-0.6 -48,-0.3 1,-0.3 5,-0.1 0.781 59.0 -77.2 49.8 29.9 33.8 0.4 48.6 71 100 A S T 3 S+ 0 0 0 1,-0.1 2,-0.4 -50,-0.1 -1,-0.3 0.729 106.5 115.6 56.9 27.3 30.0 0.6 49.0 72 101 A R <> - 0 0 63 -3,-2.3 4,-3.1 1,-0.1 5,-0.3 -0.975 60.2-148.6-132.3 123.9 29.7 3.1 46.2 73 102 A D H > S+ 0 0 14 -2,-0.4 4,-2.5 1,-0.2 5,-0.2 0.899 100.9 49.7 -53.7 -44.8 27.9 2.5 42.9 74 103 A T H > S+ 0 0 50 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.904 113.5 46.4 -64.2 -39.1 30.2 4.9 41.0 75 104 A Y H > S+ 0 0 36 2,-0.2 4,-2.7 -6,-0.2 -2,-0.2 0.935 112.3 49.5 -66.9 -45.2 33.3 3.2 42.4 76 105 A A H X S+ 0 0 0 -4,-3.1 4,-2.9 -7,-0.5 -2,-0.2 0.915 110.4 53.3 -59.8 -40.3 31.9 -0.4 41.7 77 106 A L H X S+ 0 0 6 -4,-2.5 4,-0.9 -5,-0.3 -1,-0.2 0.918 109.5 45.6 -60.9 -48.0 31.1 0.7 38.2 78 107 A E H >< S+ 0 0 66 -4,-2.0 3,-0.9 1,-0.2 4,-0.4 0.927 113.1 51.3 -63.8 -42.8 34.6 2.0 37.4 79 108 A Q H >< S+ 0 0 22 -4,-2.7 3,-2.3 1,-0.2 -2,-0.2 0.931 103.7 59.1 -57.3 -46.6 36.0 -1.2 39.0 80 109 A S H >X S+ 0 0 0 -4,-2.9 3,-2.4 1,-0.3 4,-0.7 0.691 82.2 79.3 -58.5 -22.6 33.7 -3.3 36.8 81 110 A L H XX S+ 0 0 0 -3,-0.9 4,-1.9 -4,-0.9 3,-0.9 0.835 85.2 67.7 -54.4 -27.7 35.2 -1.9 33.6 82 111 A E H <> S+ 0 0 50 -3,-2.3 4,-0.7 -4,-0.4 -1,-0.3 0.816 93.5 55.6 -61.0 -32.3 37.9 -4.4 34.5 83 112 A F H <4 S+ 0 0 0 -3,-2.4 11,-0.5 -4,-0.2 -1,-0.2 0.718 113.2 39.4 -74.7 -21.9 35.5 -7.2 33.8 84 113 A V H X< S+ 0 0 0 -3,-0.9 3,-0.5 -4,-0.7 -2,-0.2 0.670 103.3 62.1-103.0 -22.8 34.7 -6.0 30.2 85 114 A R H >< S+ 0 0 63 -4,-1.9 3,-1.0 1,-0.2 -2,-0.1 0.820 96.0 71.5 -68.3 -27.2 38.1 -4.9 29.0 86 115 A A T 3< S+ 0 0 12 -4,-0.7 2,-0.6 -5,-0.3 -1,-0.2 0.850 86.1 60.5 -52.2 -43.9 38.8 -8.6 29.7 87 116 A S T < 0 0 43 -3,-0.5 -1,-0.3 -4,-0.2 -2,-0.1 -0.072 360.0 360.0 -81.4 36.3 36.7 -9.6 26.6 88 117 A L < 0 0 114 -3,-1.0 -1,-0.2 -2,-0.6 -2,-0.2 0.666 360.0 360.0-122.2 360.0 39.0 -7.7 24.3 89 ! 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 90 138 A I 0 0 184 0, 0.0 2,-0.2 0, 0.0 -4,-0.1 0.000 360.0 360.0 360.0 -56.4 47.1 -9.6 32.1 91 139 A P - 0 0 81 0, 0.0 2,-0.4 0, 0.0 -8,-0.1 -0.466 360.0-137.8 -74.4 139.3 43.3 -9.3 31.8 92 140 A L - 0 0 24 -2,-0.2 2,-0.2 -10,-0.2 -6,-0.2 -0.823 16.9-120.5-100.2 132.0 41.1 -12.3 32.7 93 141 A L - 0 0 94 -2,-0.4 2,-0.6 -7,-0.2 -82,-0.5 -0.503 29.4-138.3 -69.0 129.8 38.0 -13.1 30.6 94 142 A I E -c 11 0A 10 -11,-0.5 -82,-0.2 -2,-0.2 3,-0.1 -0.830 22.8-176.6-100.9 120.6 34.9 -13.0 32.8 95 143 A A E S- 0 0 11 -84,-3.1 2,-0.3 -2,-0.6 -83,-0.2 0.865 73.8 -24.1 -76.1 -39.8 32.3 -15.7 32.4 96 144 A G E -c 12 0A 0 -85,-0.7 -83,-2.4 22,-0.2 2,-0.4 -0.967 62.5-118.0-167.1 160.7 29.9 -14.1 34.9 97 145 A V E -cd 13 120A 0 22,-2.8 24,-2.7 -2,-0.3 2,-0.7 -0.921 10.9-156.5-117.0 136.4 30.0 -11.8 37.9 98 146 A I E +cd 14 121A 0 -85,-3.2 -83,-2.2 -2,-0.4 2,-0.3 -0.921 51.9 38.7-106.1 110.9 28.9 -12.6 41.5 99 147 A G E +c 15 0A 0 22,-1.9 -83,-0.2 -2,-0.7 2,-0.1 -0.825 11.8 144.2 153.7 173.8 28.0 -9.4 43.2 100 148 A G - 0 0 0 -85,-1.2 23,-0.7 -2,-0.3 25,-0.6 0.224 21.4-169.0 107.3 124.3 26.8 -6.2 44.3 101 149 A S S S+ 0 0 1 23,-0.2 25,-0.2 1,-0.2 2,-0.2 0.724 76.0 60.8-100.3 -58.6 25.6 -6.0 47.9 102 150 A Y S > S- 0 0 2 1,-0.1 4,-2.5 23,-0.1 3,-0.4 -0.432 84.5-133.8 -69.5 134.0 24.0 -2.6 47.6 103 151 A S H > S+ 0 0 0 940,-1.8 4,-2.7 1,-0.2 5,-0.2 0.865 104.5 58.9 -55.5 -37.3 21.2 -2.4 45.0 104 152 A S H > S+ 0 0 7 939,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.911 108.7 43.4 -63.4 -39.7 22.6 0.8 43.6 105 153 A V H > S+ 0 0 0 -3,-0.4 4,-2.8 2,-0.2 5,-0.3 0.930 113.6 50.9 -71.9 -39.8 26.0 -0.8 42.8 106 154 A S H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.901 111.4 49.9 -61.4 -38.5 24.3 -4.0 41.4 107 155 A I H X S+ 0 0 6 -4,-2.7 4,-2.3 -5,-0.2 5,-0.2 0.982 113.8 42.1 -63.2 -58.9 22.1 -1.8 39.2 108 156 A Q H X S+ 0 0 45 -4,-2.1 4,-1.2 1,-0.2 -2,-0.2 0.926 116.6 48.8 -56.4 -45.8 24.9 0.4 37.8 109 157 A V H X S+ 0 0 0 -4,-2.8 4,-3.1 1,-0.2 3,-0.5 0.908 109.3 54.4 -60.7 -39.2 27.1 -2.7 37.3 110 158 A A H X S+ 0 0 4 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.2 0.887 102.2 56.3 -61.5 -39.7 24.2 -4.4 35.6 111 159 A N H < S+ 0 0 28 -4,-2.3 4,-0.4 1,-0.2 -1,-0.2 0.800 114.7 40.6 -65.0 -25.0 23.8 -1.6 33.1 112 160 A L H >X S+ 0 0 0 -4,-1.2 3,-0.9 -3,-0.5 4,-0.6 0.911 111.7 51.8 -86.3 -49.6 27.4 -2.1 32.1 113 161 A L H ><>S+ 0 0 1 -4,-3.1 5,-2.2 1,-0.2 3,-1.2 0.831 102.2 61.1 -58.8 -33.0 27.6 -6.0 32.1 114 162 A R G ><5S+ 0 0 55 -4,-1.9 3,-1.5 1,-0.3 -1,-0.2 0.825 93.1 65.3 -65.0 -30.7 24.5 -6.3 29.9 115 163 A L G <45S+ 0 0 7 -3,-0.9 -1,-0.3 -4,-0.4 -2,-0.2 0.778 112.3 34.6 -62.7 -23.6 26.3 -4.4 27.2 116 164 A F G <<5S- 0 0 23 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.144 114.0-113.3-118.1 20.1 28.7 -7.3 27.0 117 165 A Q T < 5 + 0 0 81 -3,-1.5 -3,-0.2 1,-0.2 266,-0.1 0.875 60.3 156.4 51.7 45.8 26.3 -10.1 27.7 118 166 A I < - 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0 0 42 -3,-1.2 -1,-0.2 3,-0.0 2,-0.2 -0.642 16.3-165.0 -85.1 138.2 25.6 13.2 54.5 204 252 A I >> - 0 0 116 -2,-0.3 4,-1.3 31,-0.0 3,-0.8 -0.472 42.3 -75.0-109.9-176.3 27.3 14.3 57.7 205 253 A R H >> S+ 0 0 152 1,-0.2 4,-3.3 2,-0.2 3,-1.4 0.923 126.2 56.7 -43.5 -62.9 26.1 14.4 61.3 206 254 A K H 3> S+ 0 0 176 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.805 102.8 55.6 -41.5 -41.7 24.0 17.5 60.9 207 255 A S H <> S+ 0 0 42 -3,-0.8 4,-0.6 2,-0.2 -1,-0.3 0.902 116.8 36.4 -61.8 -40.4 22.0 15.8 58.1 208 256 A Y H XX S+ 0 0 4 -3,-1.4 4,-2.2 -4,-1.3 3,-0.7 0.898 114.0 54.6 -78.8 -43.1 21.2 13.0 60.5 209 257 A D H 3X S+ 0 0 41 -4,-3.3 4,-2.3 1,-0.3 -2,-0.2 0.917 107.5 53.9 -54.9 -42.0 20.8 15.2 63.6 210 258 A S H 3X S+ 0 0 32 -4,-2.6 4,-1.7 -5,-0.3 -1,-0.3 0.798 105.5 52.7 -62.3 -30.8 18.3 17.1 61.6 211 259 A V H < S+ 0 0 0 -4,-1.8 3,-1.5 1,-0.2 -1,-0.2 0.898 107.6 53.5 -71.2 -37.9 11.2 12.7 64.1 216 264 A L H 3< S+ 0 0 79 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.772 94.5 69.3 -66.2 -26.0 10.9 14.3 67.6 217 265 A Q T 3< S+ 0 0 127 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.383 96.5 56.4 -74.7 5.8 8.6 16.9 66.2 218 266 A K X + 0 0 73 -3,-1.5 3,-1.6 3,-0.2 -1,-0.3 -0.499 67.4 167.8-134.2 60.8 6.0 14.1 65.8 219 267 A P T 3 S+ 0 0 97 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.774 72.3 59.7 -45.3 -39.6 5.9 12.8 69.4 220 268 A N T 3 S+ 0 0 70 1,-0.2 2,-1.6 241,-0.1 240,-0.3 0.834 89.1 76.1 -64.0 -33.0 2.8 10.7 68.8 221 269 A A < + 0 0 1 -3,-1.6 -1,-0.2 1,-0.2 -3,-0.2 -0.655 55.3 158.5 -80.5 90.4 4.6 8.7 66.1 222 270 A R + 0 0 111 -2,-1.6 26,-2.8 236,-0.3 2,-0.5 0.592 55.7 71.7 -90.5 -13.5 6.7 6.6 68.5 223 271 A V E -hi 165 248C 0 -59,-0.5 -57,-1.6 24,-0.2 2,-0.5 -0.919 67.1-166.1-106.9 123.3 7.3 3.9 65.9 224 272 A V E -hi 166 249C 0 24,-2.4 26,-2.1 -2,-0.5 2,-0.4 -0.941 11.2-143.9-116.3 119.5 9.7 4.8 63.0 225 273 A V E -hi 167 250C 0 -59,-2.8 -57,-2.0 -2,-0.5 2,-0.5 -0.647 17.5-161.1 -81.9 128.4 10.0 2.7 59.9 226 274 A L E +hi 168 251C 0 24,-3.3 26,-1.7 -2,-0.4 2,-0.3 -0.942 25.4 168.8-117.9 128.4 13.5 2.4 58.4 227 275 A F E +h 169 0C 0 -59,-1.7 -57,-1.8 -2,-0.5 2,-0.3 -0.715 40.6 140.8-130.2 75.8 14.4 1.3 54.9 228 276 A M - 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0 0 13 -3,-1.2 3,-0.6 1,-0.2 4,-0.4 -0.759 39.7-164.5 -88.0 126.1 24.0 -6.8 62.4 259 307 A E G >> S+ 0 0 66 -2,-0.5 4,-1.3 1,-0.2 3,-1.1 0.825 84.8 72.9 -76.4 -28.3 25.2 -6.1 65.9 260 308 A S G 34 S+ 0 0 66 1,-0.3 -1,-0.2 2,-0.2 -2,-0.0 0.697 89.2 60.8 -56.4 -24.4 27.8 -3.6 64.4 261 309 A I G <4 S+ 0 0 2 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.2 0.852 110.7 37.5 -73.1 -35.7 25.0 -1.2 63.7 262 310 A V T X4 S+ 0 0 0 -3,-1.1 3,-2.3 -4,-0.4 -2,-0.2 0.608 82.8 127.0 -93.3 -14.7 24.0 -0.8 67.3 263 311 A K T 3< S+ 0 0 121 -4,-1.3 -3,-0.0 1,-0.3 -4,-0.0 -0.198 82.2 12.9 -48.8 121.7 27.5 -0.9 68.9 264 312 A G T 3 S+ 0 0 49 -23,-0.0 -1,-0.3 -26,-0.0 -2,-0.1 0.570 129.6 54.2 86.4 9.8 27.9 2.1 71.1 265 313 A S X> + 0 0 8 -3,-2.3 3,-1.4 -25,-0.0 4,-1.2 0.032 62.6 135.6-159.7 26.0 24.2 3.1 71.1 266 314 A E H 3> S+ 0 0 52 1,-0.3 4,-0.7 2,-0.2 3,-0.2 0.806 70.2 55.2 -52.1 -39.3 22.7 -0.2 72.2 267 315 A H H 34 S+ 0 0 114 1,-0.2 -1,-0.3 2,-0.2 -5,-0.0 0.729 106.2 53.5 -70.6 -21.1 20.2 1.5 74.7 268 316 A V H <4 S+ 0 0 3 -3,-1.4 -21,-0.5 -6,-0.2 -1,-0.2 0.777 114.4 39.4 -82.2 -30.4 18.9 3.7 71.9 269 317 A A H >< S+ 0 0 0 -4,-1.2 3,-2.2 -3,-0.2 154,-0.2 0.435 85.6 131.8 -98.8 -1.6 18.1 0.7 69.6 270 318 A Y T 3< S+ 0 0 53 -4,-0.7 -21,-0.2 1,-0.3 154,-0.2 -0.193 73.7 18.4 -52.5 140.2 16.9 -1.5 72.4 271 319 A G T 3 S+ 0 0 0 152,-2.5 181,-0.3 1,-0.2 -1,-0.3 0.424 89.8 153.5 78.0 -1.7 13.6 -3.2 71.5 272 320 A A < - 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0 0 128 -2,-0.4 3,-0.1 -3,-0.1 -4,-0.0 -0.938 43.2-103.1-149.2 123.4 29.3 -15.1 64.0 338 386 A Q - 0 0 18 -2,-0.3 -304,-0.1 1,-0.1 -52,-0.0 -0.185 43.5-108.8 -49.9 128.8 28.4 -16.1 60.4 339 387 A E > - 0 0 9 -305,-0.2 3,-1.8 1,-0.1 4,-0.3 -0.322 27.4-116.4 -61.4 141.1 27.0 -13.1 58.5 340 388 A S T 3 S+ 0 0 35 1,-0.3 3,-0.4 2,-0.1 4,-0.1 0.814 109.4 44.6 -49.9 -40.0 23.3 -13.5 57.8 341 389 A K T >> S+ 0 0 0 1,-0.2 4,-1.3 2,-0.1 3,-1.0 0.370 75.3 107.7 -93.7 9.0 23.5 -13.6 54.0 342 390 A I H <> S+ 0 0 0 -3,-1.8 4,-2.3 1,-0.3 3,-0.5 0.881 75.1 61.4 -50.5 -42.2 26.5 -15.9 53.6 343 391 A M H 3> S+ 0 0 26 -3,-0.4 4,-2.6 -4,-0.3 -1,-0.3 0.878 102.7 50.4 -52.1 -42.1 24.2 -18.7 52.4 344 392 A F H <> S+ 0 0 16 -3,-1.0 4,-1.6 2,-0.2 -1,-0.2 0.820 107.1 53.4 -70.2 -31.2 23.1 -16.5 49.4 345 393 A V H X S+ 0 0 0 -4,-1.3 4,-2.0 -3,-0.5 -1,-0.2 0.935 111.5 46.3 -66.9 -47.3 26.7 -15.8 48.4 346 394 A V H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.934 114.3 46.3 -62.6 -46.6 27.5 -19.5 48.4 347 395 A N H X S+ 0 0 11 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.801 108.4 56.8 -69.3 -25.0 24.4 -20.4 46.4 348 396 A A H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.943 110.6 43.9 -68.5 -45.6 25.0 -17.5 43.9 349 397 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.926 114.8 49.0 -63.8 -46.1 28.4 -18.9 43.1 350 398 A Y H X S+ 0 0 5 -4,-2.5 4,-3.5 1,-0.2 5,-0.2 0.865 107.5 56.0 -63.2 -33.3 27.1 -22.5 42.9 351 399 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.947 108.8 46.4 -62.8 -46.7 24.3 -21.3 40.6 352 400 A M H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.926 114.2 49.4 -61.0 -43.7 26.8 -19.9 38.2 353 401 A A H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.951 110.0 48.8 -61.3 -51.1 28.9 -23.1 38.4 354 402 A H H X S+ 0 0 37 -4,-3.5 4,-2.3 1,-0.2 -1,-0.2 0.870 111.2 52.5 -58.2 -34.5 25.9 -25.4 37.8 355 403 A A H X S+ 0 0 0 -4,-2.2 4,-1.6 -5,-0.2 -1,-0.2 0.879 112.1 44.1 -69.1 -37.4 25.0 -23.2 34.8 356 404 A L H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.892 112.2 53.8 -73.0 -39.4 28.4 -23.5 33.3 357 405 A H H X S+ 0 0 38 -4,-3.0 4,-2.6 2,-0.2 5,-0.2 0.938 109.4 46.3 -59.2 -50.3 28.6 -27.2 34.1 358 406 A K H X S+ 0 0 81 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.910 113.1 51.2 -61.3 -41.0 25.3 -27.9 32.2 359 407 A M H X S+ 0 0 3 -4,-1.6 4,-2.1 -5,-0.2 5,-0.3 0.892 110.6 48.4 -65.1 -37.1 26.5 -25.7 29.4 360 408 A Q H X S+ 0 0 6 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.881 110.3 50.5 -71.2 -35.4 29.8 -27.7 29.2 361 409 A R H < S+ 0 0 130 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.893 115.0 46.2 -66.7 -35.5 28.0 -31.0 29.3 362 410 A T H < S+ 0 0 88 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.832 124.0 28.6 -74.9 -37.0 25.8 -29.8 26.4 363 411 A L H < S+ 0 0 75 -4,-2.1 10,-0.2 1,-0.2 -3,-0.2 0.699 125.1 45.2 -98.2 -23.8 28.5 -28.3 24.2 364 412 A d >< + 0 0 3 -4,-2.3 3,-0.9 -5,-0.3 -1,-0.2 -0.463 63.5 157.0-118.4 60.3 31.4 -30.5 25.1 365 413 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.715 70.5 52.9 -56.8 -25.1 29.9 -34.0 25.1 366 414 A Q T 3 S+ 0 0 193 -3,-0.1 2,-0.3 3,-0.1 -5,-0.1 0.707 113.7 23.4 -88.6 -21.8 33.2 -35.8 24.6 367 415 A T < - 0 0 75 -3,-0.9 4,-0.1 2,-0.2 -3,-0.1 -0.887 63.5-126.9-138.8 171.7 35.4 -34.4 27.4 368 416 A T S S+ 0 0 72 -2,-0.3 2,-0.2 2,-0.1 -7,-0.1 0.415 85.1 95.2 -95.0 -2.1 35.2 -32.7 30.8 369 417 A K S S- 0 0 141 1,-0.1 2,-1.2 -5,-0.1 -2,-0.2 -0.488 95.4 -90.6 -92.7 160.3 37.4 -29.9 29.5 370 418 A L - 0 0 28 -311,-0.4 -1,-0.1 -2,-0.2 -2,-0.1 -0.550 54.9-157.6 -67.6 96.7 36.5 -26.6 28.1 371 419 A d > - 0 0 29 -2,-1.2 3,-2.4 -4,-0.1 4,-0.2 -0.327 30.7 -97.7 -76.4 165.4 36.3 -27.7 24.4 372 420 A D G >> S+ 0 0 124 1,-0.3 3,-2.7 2,-0.2 4,-0.5 0.852 120.7 67.0 -50.3 -41.0 36.7 -25.3 21.5 373 421 A A G 34 S+ 0 0 68 1,-0.3 -1,-0.3 -10,-0.2 3,-0.1 0.684 108.7 39.5 -56.2 -19.2 32.9 -25.0 21.1 374 422 A M G <4 S+ 0 0 2 -3,-2.4 -1,-0.3 1,-0.1 3,-0.3 0.246 83.5 105.7-111.8 7.5 32.9 -23.2 24.5 375 423 A K T <4 S+ 0 0 121 -3,-2.7 2,-0.6 1,-0.3 -2,-0.2 0.901 91.4 32.6 -53.8 -43.8 36.1 -21.3 23.9 376 424 A I S < S- 0 0 146 -4,-0.5 -1,-0.3 -3,-0.1 -4,-0.0 -0.910 95.1-138.9-118.8 103.4 34.0 -18.1 23.4 377 425 A L - 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