==== 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 OXIDOREDUCTASE 30-APR-02 1LLZ . COMPND 2 MOLECULE: FERREDOXIN-DEPENDENT GLUTAMATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP. PCC 6803; . AUTHOR R.H.VAN DEN HEUVEL,D.FERRARI,R.T.BOSSI,S.RAVASIO,B.CURTI,M.A . 1475 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49479.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 974 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 102 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 114 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 3 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 . 90 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 178 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 377 25.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 1.6 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 5 4 4 8 2 3 3 2 3 2 5 1 0 2 1 0 0 1 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 2 4 3 5 0 0 1 1 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 . 6 3 3 4 5 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 1 2 0 1 0 1 1 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 1 A C 0 0 16 0, 0.0 2,-0.3 0, 0.0 205,-0.2 0.000 360.0 360.0 360.0 153.9 185.5 219.9 0.9 2 2 A G E +A 205 0A 0 203,-1.7 203,-2.4 23,-0.0 2,-0.3 -0.919 360.0 174.3-116.2 152.1 184.3 222.0 -2.1 3 3 A V E +A 204 0A 0 -2,-0.3 363,-2.4 201,-0.2 364,-0.3 -0.983 9.1 138.2-154.3 156.0 182.0 220.6 -4.8 4 4 A G E -AB 203 365A 0 199,-1.3 199,-1.9 -2,-0.3 2,-0.3 -0.976 30.0-129.0-175.8 177.6 180.0 221.5 -7.8 5 5 A F E -AB 202 364A 0 359,-1.4 359,-1.9 -2,-0.3 2,-0.4 -0.961 8.1-156.0-136.1 162.7 178.9 220.6 -11.3 6 6 A I E -AB 201 363A 0 195,-2.1 195,-0.9 -2,-0.3 2,-0.4 -0.988 16.9-171.2-131.5 136.2 178.9 222.4 -14.6 7 7 A A E -AB 200 362A 2 355,-2.2 355,-0.9 -2,-0.4 2,-0.4 -0.965 14.4-164.7-131.6 145.0 176.4 221.4 -17.3 8 8 A N + 0 0 26 191,-1.4 3,-0.2 -2,-0.4 353,-0.1 -0.971 17.1 162.1-130.5 121.8 176.0 222.3 -20.9 9 9 A L + 0 0 16 -2,-0.4 2,-0.9 350,-0.4 387,-0.2 0.840 68.3 51.0-103.8 -47.3 172.8 221.5 -22.6 10 10 A R S S+ 0 0 183 349,-0.6 2,-0.3 2,-0.1 -1,-0.2 -0.517 106.9 44.7-100.3 61.9 172.5 223.6 -25.7 11 11 A G S S- 0 0 30 -2,-0.9 3,-0.1 -3,-0.2 -3,-0.1 -0.925 85.6 -99.8-176.1 170.9 175.9 222.9 -27.4 12 12 A K - 0 0 161 -2,-0.3 186,-0.1 1,-0.2 -2,-0.1 -0.786 67.0 -59.9-104.6 161.3 178.0 219.9 -28.1 13 13 A P + 0 0 59 0, 0.0 2,-0.2 0, 0.0 186,-0.2 0.022 62.5 179.0 -44.3 136.5 181.0 219.1 -25.8 14 14 A D B -G 198 0B 34 184,-0.9 184,-1.4 1,-0.1 4,-0.5 -0.719 37.0-121.2-125.6 176.5 183.5 221.9 -25.7 15 15 A H S > S+ 0 0 33 182,-0.2 4,-2.9 -2,-0.2 3,-0.3 0.817 99.7 77.3 -88.2 -33.7 186.8 222.2 -23.8 16 16 A T H > S+ 0 0 70 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.784 90.2 55.4 -45.0 -39.9 185.8 225.4 -22.0 17 17 A L H > S+ 0 0 0 2,-0.3 4,-3.2 181,-0.2 -1,-0.2 0.983 109.8 45.0 -56.6 -59.8 183.7 223.4 -19.6 18 18 A V H > S+ 0 0 3 -4,-0.5 4,-2.3 -3,-0.3 -2,-0.2 0.951 113.6 52.1 -49.7 -49.9 186.6 221.2 -18.6 19 19 A E H X S+ 0 0 108 -4,-2.9 4,-2.4 1,-0.2 -1,-0.3 0.925 113.0 43.5 -49.9 -49.0 188.6 224.5 -18.4 20 20 A Q H X S+ 0 0 35 -4,-3.4 4,-2.5 1,-0.2 -1,-0.2 0.823 107.8 59.5 -69.2 -31.3 186.0 226.0 -16.1 21 21 A A H X S+ 0 0 1 -4,-3.2 4,-1.5 2,-0.2 -1,-0.2 0.931 109.6 43.9 -62.8 -42.1 185.7 222.9 -14.1 22 22 A L H X S+ 0 0 26 -4,-2.3 4,-1.6 -5,-0.2 3,-0.4 0.945 110.7 51.5 -75.7 -47.7 189.4 223.2 -13.3 23 23 A K H X S+ 0 0 154 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.896 108.7 55.0 -48.7 -43.7 189.4 226.9 -12.5 24 24 A A H X S+ 0 0 0 -4,-2.5 4,-0.5 1,-0.2 3,-0.4 0.866 101.9 54.4 -60.4 -40.9 186.5 226.2 -10.2 25 25 A L H >< S+ 0 0 1 -4,-1.5 3,-1.1 -3,-0.4 -1,-0.2 0.836 101.2 64.5 -62.3 -30.0 188.5 223.5 -8.2 26 26 A G H >< S+ 0 0 18 -4,-1.6 3,-2.0 1,-0.3 -1,-0.2 0.941 100.1 48.3 -55.6 -47.8 191.0 226.3 -7.9 27 27 A C H 3< S+ 0 0 18 -4,-1.1 3,-0.3 -3,-0.4 -1,-0.3 0.543 101.6 64.4 -75.4 -8.7 188.6 228.3 -5.8 28 28 A M T X< S+ 0 0 0 -3,-1.1 3,-1.1 -4,-0.5 -1,-0.3 0.454 71.9 106.8 -85.2 -1.2 187.8 225.3 -3.6 29 29 A E G X S+ 0 0 49 -3,-2.0 3,-1.3 1,-0.3 -1,-0.2 0.833 76.8 48.2 -54.5 -40.7 191.5 225.4 -2.4 30 30 A H G 3 S+ 0 0 35 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.815 102.6 62.9 -67.9 -30.0 190.7 226.7 1.1 31 31 A R G < S+ 0 0 4 -3,-1.1 2,-0.3 -4,-0.2 -1,-0.3 0.383 103.3 73.8 -69.3 6.0 187.9 224.2 1.5 32 32 A G S < S- 0 0 12 -3,-1.3 175,-0.3 -4,-0.2 2,-0.2 -0.842 70.6-132.4-127.1 156.6 190.7 221.5 1.2 33 33 A G - 0 0 6 173,-1.2 9,-2.6 -2,-0.3 10,-0.4 -0.589 8.5-150.3-103.7 168.5 193.6 220.0 3.2 34 34 A C B -H 41 0C 31 7,-0.3 7,-0.3 -2,-0.2 145,-0.0 -0.929 20.9-114.8-131.8 156.9 197.3 219.2 2.5 35 35 A S > - 0 0 1 5,-2.5 3,-2.6 -2,-0.3 4,-0.2 -0.007 49.4 -76.4 -83.2-172.0 199.6 216.5 4.0 36 36 A A T 3 S+ 0 0 23 175,-0.8 176,-0.1 1,-0.3 -1,-0.0 0.779 128.3 68.0 -65.0 -32.3 202.8 216.9 6.1 37 37 A D T 3 S- 0 0 49 174,-0.2 -1,-0.3 81,-0.0 82,-0.1 0.567 103.3-133.5 -29.2 -29.9 204.6 218.0 3.0 38 38 A N S < S+ 0 0 109 -3,-2.6 -2,-0.1 2,-0.1 3,-0.1 0.985 94.1 62.0 41.4 64.7 202.4 221.1 3.0 39 39 A D S S+ 0 0 49 1,-0.7 141,-0.3 -4,-0.2 2,-0.2 0.174 72.3 81.9-175.3 -55.8 201.9 220.3 -0.7 40 40 A S S S- 0 0 1 139,-0.1 -5,-2.5 77,-0.1 -1,-0.7 -0.541 75.2-134.2 -67.0 142.8 200.3 217.1 -1.5 41 41 A G B -H 34 0C 0 137,-0.8 -7,-0.3 -7,-0.3 3,-0.2 -0.636 16.2-116.2-103.7 161.6 196.6 217.5 -1.1 42 42 A D S S- 0 0 2 -9,-2.6 172,-0.2 164,-0.4 2,-0.2 0.592 86.2 -54.8 -71.1 -9.4 193.9 215.5 0.5 43 43 A G - 0 0 0 136,-0.5 163,-2.0 -10,-0.4 2,-0.3 -0.474 45.3-161.0 148.0 148.1 192.4 215.0 -2.9 44 44 A A E +CD 177 205A 0 133,-1.9 133,-2.7 161,-0.2 2,-0.3 -0.967 24.2 171.6-150.2 145.7 191.1 216.7 -6.0 45 45 A G E -CD 176 204A 0 159,-1.7 159,-1.6 -2,-0.3 2,-0.3 -0.967 21.7-158.3-154.7 164.0 188.9 215.2 -8.7 46 46 A V E -CD 175 203A 2 129,-1.3 129,-2.6 -2,-0.3 2,-0.5 -0.947 5.1-159.5-156.4 127.7 186.7 215.5 -11.7 47 47 A M E +CD 174 202A 1 155,-3.1 155,-2.1 -2,-0.3 2,-0.3 -0.924 28.1 155.5 -99.7 131.5 183.9 213.5 -13.3 48 48 A T E -C 173 0A 2 125,-2.4 125,-3.6 -2,-0.5 153,-0.2 -0.929 45.3 -88.2-138.1 171.6 183.2 214.0 -17.0 49 49 A A E -C 172 0A 16 151,-0.4 123,-0.2 -2,-0.3 122,-0.1 -0.257 68.1 -72.1 -64.2 164.3 181.6 212.2 -19.9 50 50 A I - 0 0 24 121,-0.9 2,-2.7 120,-0.2 3,-0.2 -0.511 40.0-132.3 -71.7 124.4 183.9 210.0 -22.0 51 51 A P >> + 0 0 4 0, 0.0 4,-1.9 0, 0.0 3,-1.6 -0.429 37.1 173.9 -78.0 67.5 186.3 212.3 -24.0 52 52 A R T 34 S+ 0 0 139 -2,-2.7 4,-0.5 1,-0.3 144,-0.1 0.771 71.0 55.6 -60.0 -31.0 185.4 210.1 -27.0 53 53 A E T 34 S+ 0 0 117 142,-0.2 4,-0.4 -3,-0.2 -1,-0.3 0.865 107.2 48.3 -60.0 -44.1 187.4 212.5 -29.3 54 54 A L T X4 S+ 0 0 3 -3,-1.6 3,-1.4 141,-0.5 4,-0.4 0.930 109.3 50.9 -70.8 -44.9 190.6 212.2 -27.3 55 55 A L T >X S+ 0 0 3 -4,-1.9 4,-1.5 1,-0.3 3,-0.8 0.683 90.7 85.6 -59.5 -19.6 190.5 208.4 -27.1 56 56 A A H 3> S+ 0 0 22 -4,-0.5 4,-1.9 -5,-0.4 -1,-0.3 0.885 84.5 54.6 -54.0 -36.6 190.0 208.7 -30.9 57 57 A Q H <> S+ 0 0 122 -3,-1.4 4,-2.0 -4,-0.4 -1,-0.3 0.793 99.6 58.6 -73.6 -29.3 193.8 208.8 -31.3 58 58 A W H <> S+ 0 0 15 -3,-0.8 4,-2.0 -4,-0.4 3,-0.2 0.988 109.5 45.0 -56.2 -59.3 194.4 205.6 -29.4 59 59 A F H X>S+ 0 0 2 -4,-1.5 5,-3.2 1,-0.2 4,-0.6 0.844 111.3 53.6 -49.3 -45.4 192.2 203.7 -31.9 60 60 A N H ><5S+ 0 0 128 -4,-1.9 3,-1.4 3,-0.2 -1,-0.2 0.945 108.1 48.6 -57.1 -47.6 193.8 205.4 -34.8 61 61 A T H 3<5S+ 0 0 113 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.851 114.3 45.9 -69.0 -34.9 197.3 204.5 -33.8 62 62 A R H 3<5S- 0 0 123 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.514 112.7-122.5 -85.4 -1.2 196.2 200.9 -33.3 63 63 A N T <<5 + 0 0 147 -3,-1.4 -3,-0.2 -4,-0.6 -2,-0.1 0.924 63.4 144.8 63.6 50.1 194.3 201.0 -36.6 64 64 A L < - 0 0 79 -5,-3.2 2,-0.4 -6,-0.1 -1,-0.2 -0.875 55.6-111.4-129.7 145.4 191.1 200.1 -34.9 65 65 A P - 0 0 104 0, 0.0 -5,-0.0 0, 0.0 0, 0.0 -0.653 32.3-132.9 -79.1 125.7 187.4 200.9 -35.3 66 66 A M - 0 0 61 -2,-0.4 3,-0.1 1,-0.1 6,-0.1 -0.632 24.1-128.2 -80.7 127.2 186.0 203.0 -32.5 67 67 A P - 0 0 28 0, 0.0 5,-0.2 0, 0.0 -1,-0.1 -0.229 36.6 -71.5 -70.4 164.6 182.7 201.7 -31.1 68 68 A D >> - 0 0 98 3,-0.1 3,-2.5 1,-0.1 4,-0.5 -0.186 43.6-114.0 -46.8 144.0 179.5 203.7 -30.7 69 69 A G G >4 S+ 0 0 37 1,-0.3 3,-1.0 2,-0.2 4,-0.4 0.907 120.3 50.3 -50.8 -49.0 179.4 206.2 -27.8 70 70 A D G 34 S+ 0 0 91 1,-0.2 71,-0.8 2,-0.1 -1,-0.3 0.562 118.0 41.9 -64.6 -7.3 176.8 204.2 -26.1 71 71 A R G <4 S+ 0 0 81 -3,-2.5 64,-0.4 69,-0.2 -1,-0.2 0.271 88.8 83.2-131.5 12.5 179.0 201.1 -26.5 72 72 A L << - 0 0 4 -3,-1.0 61,-0.5 -4,-0.5 98,-0.1 0.968 60.1-173.7 -84.9 -65.7 182.7 202.0 -25.8 73 73 A G - 0 0 0 -4,-0.4 60,-2.2 97,-0.2 2,-0.4 0.759 7.1-150.8 74.7 120.6 183.2 201.9 -22.0 74 74 A V E -IJ 132 169D 0 95,-3.0 95,-1.9 98,-0.2 2,-0.5 -0.970 8.1-153.3-137.0 128.1 186.3 202.9 -20.2 75 75 A G E -IJ 131 168D 0 56,-2.6 56,-1.8 -2,-0.4 2,-0.7 -0.919 7.5-156.1 -96.6 125.4 188.1 201.9 -17.0 76 76 A M E -IJ 130 167D 0 91,-3.1 90,-2.4 -2,-0.5 91,-0.9 -0.939 29.3-167.4 -93.1 116.9 190.3 204.4 -15.3 77 77 A V E -IJ 129 165D 1 52,-2.8 52,-2.1 -2,-0.7 2,-0.6 -0.923 28.8-154.1-125.2 132.1 192.5 202.2 -13.3 78 78 A F E +IJ 128 164D 0 86,-3.0 86,-1.7 -2,-0.4 50,-0.2 -0.893 32.2 178.7 -90.4 118.7 195.1 202.6 -10.5 79 79 A L E -I 127 0D 0 48,-3.5 48,-3.2 -2,-0.6 84,-0.2 -0.829 35.6 -81.6-123.9 159.6 197.7 199.8 -10.7 80 80 A P - 0 0 10 0, 0.0 -1,-0.1 0, 0.0 9,-0.0 -0.252 30.5-140.7 -50.1 139.4 200.8 198.7 -8.9 81 81 A Q S S+ 0 0 78 4,-0.1 5,-0.0 5,-0.0 44,-0.0 0.854 79.6 92.3 -68.4 -37.5 204.0 200.5 -9.9 82 82 A E S > S- 0 0 102 1,-0.1 4,-2.9 4,-0.0 5,-0.3 -0.459 79.5-135.7 -64.3 115.9 206.1 197.4 -9.7 83 83 A P H > S+ 0 0 89 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.860 100.3 46.1 -41.1 -58.0 206.1 195.8 -13.2 84 84 A S H > S+ 0 0 71 1,-0.2 4,-2.0 2,-0.2 3,-0.3 0.941 117.7 43.8 -57.6 -49.2 205.5 192.2 -12.1 85 85 A A H > S+ 0 0 35 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.830 109.3 57.3 -65.3 -29.8 202.7 193.2 -9.7 86 86 A R H X S+ 0 0 46 -4,-2.9 4,-2.8 2,-0.2 -1,-0.2 0.893 106.6 49.8 -72.0 -29.0 201.2 195.5 -12.2 87 87 A E H X S+ 0 0 97 -4,-2.1 4,-2.8 -5,-0.3 5,-0.2 0.927 108.4 51.2 -73.8 -39.9 200.9 192.7 -14.7 88 88 A V H X S+ 0 0 104 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.950 114.7 45.8 -53.4 -46.6 199.2 190.4 -12.1 89 89 A A H X S+ 0 0 8 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.936 111.8 49.6 -63.3 -45.2 196.9 193.3 -11.5 90 90 A R H X S+ 0 0 27 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.893 109.2 53.4 -63.8 -35.4 196.3 194.0 -15.2 91 91 A A H X S+ 0 0 56 -4,-2.8 4,-2.9 1,-0.2 -1,-0.2 0.877 107.2 51.6 -68.0 -41.6 195.6 190.3 -15.8 92 92 A Y H X S+ 0 0 59 -4,-2.2 4,-2.5 -5,-0.2 5,-0.3 0.935 106.1 53.3 -58.3 -47.9 192.9 190.3 -13.0 93 93 A V H X S+ 0 0 1 -4,-2.2 4,-2.6 1,-0.2 3,-0.2 0.969 116.2 39.3 -52.4 -52.7 191.1 193.2 -14.5 94 94 A E H X S+ 0 0 45 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.872 108.7 62.7 -65.3 -40.7 190.9 191.5 -17.8 95 95 A E H X S+ 0 0 94 -4,-2.9 4,-0.7 1,-0.2 -1,-0.2 0.913 115.4 32.9 -48.4 -50.7 190.2 188.1 -16.2 96 96 A V H X S+ 0 0 4 -4,-2.5 4,-0.9 -3,-0.2 -2,-0.2 0.781 112.4 59.2 -81.7 -29.2 187.0 189.6 -14.7 97 97 A V H <>S+ 0 0 0 -4,-2.6 5,-0.7 -5,-0.3 -2,-0.2 0.840 110.4 47.0 -68.4 -27.0 186.2 191.9 -17.6 98 98 A R H <5S+ 0 0 128 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.733 96.1 73.2 -74.4 -32.4 186.1 188.8 -19.7 99 99 A L H <5S+ 0 0 121 -4,-0.7 2,-0.5 -5,-0.2 -2,-0.2 0.733 93.1 58.0 -66.0 -26.1 184.0 186.9 -17.1 100 100 A E T <5S- 0 0 31 -4,-0.9 2,-8.0 -3,-0.2 47,-0.0 -0.924 124.1 -95.6 -87.8 132.8 181.0 189.0 -18.2 101 101 A K T 5S+ 0 0 127 -2,-0.5 36,-0.4 34,-0.1 2,-0.2 0.106 85.9 134.3 -49.3 48.6 180.9 188.2 -21.9 102 102 A L < - 0 0 6 -2,-8.0 2,-0.4 -5,-0.7 33,-0.2 -0.693 48.1-136.8-103.5 159.9 183.0 191.4 -22.6 103 103 A T E -K 134 0D 63 31,-3.5 31,-2.1 -2,-0.2 2,-0.7 -0.916 9.1-136.4-122.8 135.6 186.0 192.0 -24.8 104 104 A V E -K 133 0D 36 -2,-0.4 29,-0.2 29,-0.2 3,-0.1 -0.789 13.9-175.2 -97.0 108.5 189.2 194.0 -24.0 105 105 A L E - 0 0 46 27,-2.1 2,-0.2 -2,-0.7 28,-0.2 0.694 56.6 -99.6 -75.5 -16.3 190.3 196.2 -26.9 106 106 A G E -K 132 0D 17 26,-1.2 26,-3.1 -3,-0.1 2,-0.3 -0.753 40.8 -57.1 129.7-176.3 193.3 197.1 -24.8 107 107 A W E -K 131 0D 27 -2,-0.2 2,-0.5 24,-0.2 24,-0.2 -0.797 25.9-154.5-113.1 147.7 194.9 199.7 -22.5 108 108 A R E -K 130 0D 26 22,-3.2 22,-3.2 -2,-0.3 2,-0.3 -0.978 19.9-135.3-113.1 129.8 195.8 203.3 -22.8 109 109 A E E -K 129 0D 131 -2,-0.5 20,-0.2 20,-0.2 18,-0.0 -0.688 23.8-125.9 -79.9 142.7 198.5 204.7 -20.7 110 110 A V - 0 0 4 18,-1.6 18,-0.2 -2,-0.3 79,-0.1 -0.805 19.2-123.5-100.9 113.5 197.5 208.0 -19.2 111 111 A P + 0 0 51 0, 0.0 78,-1.3 0, 0.0 79,-0.6 -0.202 44.8 168.4 -54.8 127.0 199.9 210.9 -19.8 112 112 A V B -L 188 0E 49 76,-0.2 2,-0.4 77,-0.1 76,-0.2 -0.969 37.8-144.3-141.1 159.0 201.0 212.3 -16.5 113 113 A N > + 0 0 65 74,-1.5 3,-1.8 -2,-0.3 4,-0.1 -0.770 15.9 178.6-122.2 89.3 203.6 214.6 -15.0 114 114 A S G > + 0 0 38 -2,-0.4 3,-1.9 1,-0.3 -1,-0.1 0.676 69.2 84.3 -68.4 -15.3 204.6 213.2 -11.6 115 115 A D G 3 S+ 0 0 130 1,-0.3 -1,-0.3 -3,-0.1 72,-0.1 0.519 86.6 52.7 -60.8 -11.1 207.1 216.1 -11.3 116 116 A V G < S+ 0 0 41 -3,-1.8 -1,-0.3 70,-0.1 -2,-0.2 0.383 85.8 102.1-107.3 5.5 204.3 218.3 -9.9 117 117 A L S < S- 0 0 11 -3,-1.9 2,-0.3 -4,-0.1 -77,-0.1 -0.417 80.5-109.0 -81.4 161.6 203.2 216.0 -7.2 118 118 A G >> - 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0 0 10 18,-0.1 2,-3.3 -71,-0.1 -1,-0.1 -0.452 19.0-178.3-128.9 66.2 175.4 202.8 18.3 712 731 A I + 0 0 8 -5,-0.3 -229,-1.6 -2,-0.2 2,-0.3 -0.190 48.3 89.2 -74.6 60.5 176.3 206.3 19.3 713 732 A F E -S 482 0I 3 -2,-3.3 18,-0.4 -231,-0.2 2,-0.4 -0.884 61.9-141.7-141.0 165.5 178.1 205.5 22.5 714 733 A E E -S 481 0I 2 -233,-1.7 -233,-1.8 -2,-0.3 18,-0.2 -0.980 26.8-141.1-127.5 121.4 181.6 204.7 23.8 715 734 A A E -S 480 0I 1 16,-1.9 2,-0.4 -2,-0.4 18,-0.3 -0.481 11.2-160.8 -85.3 153.0 181.7 202.0 26.5 716 735 A I S S+ 0 0 8 -237,-3.0 -248,-0.4 16,-0.1 3,-0.1 -0.921 74.6 6.2-134.4 116.5 184.1 202.3 29.5 717 736 A G S S+ 0 0 0 1,-0.5 20,-3.6 -2,-0.4 2,-0.1 0.283 90.0 122.4 92.5 -11.1 184.9 199.2 31.6 718 737 A L B -b 737 0N 0 -239,-0.3 18,-1.4 18,-0.3 -1,-0.5 -0.525 59.1-125.9 -69.5 156.1 183.0 196.7 29.5 719 738 A G > - 0 0 4 18,-1.7 4,-2.7 16,-0.4 5,-0.3 -0.556 19.8 -88.5-105.3 169.7 185.4 194.0 28.3 720 739 A A H > S+ 0 0 66 1,-0.2 4,-1.8 -2,-0.2 5,-0.1 0.862 121.6 27.7 -28.4 -66.6 186.6 192.3 25.1 721 740 A E H > S+ 0 0 126 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.779 115.5 60.7 -83.3 -29.6 183.9 189.5 24.9 722 741 A L H >>S+ 0 0 2 15,-0.3 4,-2.8 2,-0.2 5,-0.5 0.990 109.7 43.2 -61.5 -54.9 181.2 191.2 26.7 723 742 A V H X5S+ 0 0 13 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.907 113.8 50.5 -52.8 -48.9 181.3 193.9 24.0 724 743 A E H <5S+ 0 0 109 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.912 114.5 45.2 -59.9 -40.6 181.6 191.5 21.1 725 744 A Y H <5S+ 0 0 41 -4,-2.6 -116,-0.2 2,-0.1 3,-0.2 0.952 133.2 11.4 -67.2 -53.8 178.6 189.4 22.4 726 745 A A H <5S+ 0 0 0 -4,-2.8 2,-0.4 -5,-0.2 -118,-0.2 0.837 135.7 30.0 -98.6 -35.6 176.2 192.2 23.2 727 746 A F S >< + 0 0 25 -2,-0.3 3,-0.8 -18,-0.2 2,-0.3 -0.645 4.6 178.2-133.9 89.1 186.0 200.2 24.9 733 752 A R T 3 S+ 0 0 53 -18,-0.3 459,-0.5 1,-0.2 458,-0.1 0.274 78.2 50.7 -77.3 24.4 189.6 201.0 25.1 734 753 A V T 3 S- 0 0 2 -2,-0.3 455,-3.4 -16,-0.3 -1,-0.2 0.627 88.9-153.1-135.3 -24.2 189.8 200.1 28.7 735 754 A G < + 0 0 12 -3,-0.8 454,-0.6 -17,-0.3 -16,-0.4 0.948 33.8 133.9 57.0 95.0 188.3 196.7 28.9 736 755 A G + 0 0 9 -18,-1.4 -18,-0.3 1,-0.2 -17,-0.2 0.461 32.3 74.1-124.6 -88.1 186.7 195.4 32.1 737 756 A L B -b 718 0N 1 -20,-3.6 -18,-1.7 -18,-0.1 -15,-0.3 -0.018 48.9-158.7 -50.7 127.3 183.4 193.6 32.8 738 757 A T > - 0 0 60 -20,-0.1 4,-2.3 -16,-0.1 5,-0.3 -0.641 38.4-103.5 -91.0 156.0 182.8 190.0 31.9 739 758 A I H > S+ 0 0 16 -2,-0.2 4,-2.3 1,-0.2 -182,-0.1 0.881 128.2 52.5 -46.3 -40.8 179.3 188.4 31.5 740 759 A A H > S+ 0 0 60 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.993 106.8 51.2 -54.4 -60.8 180.0 187.0 34.9 741 760 A D H > S+ 0 0 40 1,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.797 109.7 48.1 -53.6 -38.7 180.8 190.4 36.4 742 761 A V H X S+ 0 0 3 -4,-2.3 4,-2.2 2,-0.2 3,-0.5 0.947 111.2 52.3 -67.3 -44.6 177.6 192.0 35.0 743 762 A A H X S+ 0 0 19 -4,-2.3 4,-1.5 -5,-0.3 -2,-0.2 0.940 107.0 53.2 -47.4 -52.6 175.8 189.0 36.5 744 763 A G H X S+ 0 0 40 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.775 107.6 51.2 -59.3 -33.0 177.4 189.7 39.9 745 764 A E H X S+ 0 0 21 -4,-1.4 4,-1.3 -3,-0.5 3,-0.4 0.952 104.3 53.5 -69.4 -55.1 176.3 193.3 39.9 746 765 A V H X S+ 0 0 36 -4,-2.2 4,-1.1 1,-0.2 -2,-0.2 0.817 107.7 56.6 -50.6 -29.1 172.6 192.6 39.2 747 766 A M H >X S+ 0 0 69 -4,-1.5 4,-3.1 -5,-0.2 3,-0.5 0.935 93.9 65.9 -66.8 -46.5 172.9 190.2 42.2 748 767 A V H 3< S+ 0 0 75 -4,-1.4 4,-0.3 -3,-0.4 -2,-0.2 0.883 114.8 29.0 -48.7 -45.1 174.1 193.0 44.4 749 768 A F H 3< S+ 0 0 36 -4,-1.3 -313,-0.3 2,-0.2 -1,-0.3 0.547 112.0 63.8-101.8 5.6 170.8 194.7 44.2 750 769 A H H X< S+ 0 0 9 -4,-1.1 3,-1.1 -3,-0.5 4,-0.3 0.823 97.7 61.9 -67.6 -39.8 168.7 191.6 43.6 751 770 A G G ><>S+ 0 0 13 -4,-3.1 5,-1.0 1,-0.2 3,-0.6 0.777 97.8 60.8 -52.6 -26.1 169.9 190.7 47.1 752 771 A M G 3 5S+ 0 0 57 -4,-0.3 -1,-0.2 -5,-0.2 -2,-0.1 0.079 100.2 42.8-108.9 26.6 168.2 193.8 48.5 753 772 A A G < 5S+ 0 0 15 -3,-1.1 -1,-0.2 -320,-0.1 -2,-0.1 0.249 125.4 25.4-135.8 0.1 164.5 193.5 47.8 754 773 A F T < 5S+ 0 0 45 -3,-0.6 -2,-0.2 -4,-0.3 -3,-0.1 0.682 116.3 43.5-141.7 -68.6 164.1 189.8 48.7 755 774 A P T 5S+ 0 0 87 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 0.981 126.5 28.4 -54.0 -55.2 166.5 188.1 51.1 756 775 A E S - 0 0 5 -2,-0.8 4,-1.8 -3,-0.3 5,-0.2 -0.636 51.2-113.0 -98.3 156.6 182.9 217.6 49.4 780 799 A P H > S+ 0 0 41 0, 0.0 4,-1.1 0, 0.0 -1,-0.1 0.732 119.5 49.1 -59.5 -19.2 181.7 220.7 51.5 781 800 A E H > S+ 0 0 50 2,-0.2 4,-2.2 3,-0.1 5,-0.2 0.937 104.2 51.2 -87.6 -54.5 184.5 219.6 53.9 782 801 A M H > S+ 0 0 1 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.865 115.9 47.8 -44.6 -41.2 187.5 219.1 51.6 783 802 A S H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.862 106.3 51.1 -79.3 -40.2 186.8 222.5 50.3 784 803 A K H X S+ 0 0 95 -4,-1.1 4,-2.5 2,-0.2 -1,-0.2 0.896 113.3 50.1 -59.9 -39.8 186.3 224.5 53.5 785 804 A S H X S+ 0 0 3 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.877 112.8 44.5 -68.0 -38.8 189.7 223.0 54.6 786 805 A L H X S+ 0 0 0 -4,-1.6 4,-1.9 -5,-0.2 -2,-0.2 0.873 111.2 55.5 -69.9 -33.8 191.3 224.0 51.4 787 806 A H H X S+ 0 0 23 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.945 109.2 45.5 -66.9 -44.1 189.7 227.5 51.6 788 807 A K H X S+ 0 0 111 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.809 108.7 58.3 -69.2 -27.4 191.1 228.1 55.1 789 808 A A H >X S+ 0 0 2 -4,-1.3 4,-1.1 -5,-0.2 3,-0.6 0.948 109.5 41.9 -64.4 -48.0 194.6 226.8 53.9 790 809 A V H 3< S+ 0 0 1 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.841 106.9 64.1 -66.9 -34.8 194.9 229.4 51.1 791 810 A A H 3< S+ 0 0 58 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.760 103.9 47.1 -63.9 -30.0 193.5 232.1 53.4 792 811 A A H << 0 0 79 -4,-1.0 -2,-0.2 -3,-0.6 -1,-0.1 0.989 360.0 360.0 -73.4 -68.6 196.5 231.9 55.7 793 812 A Y < 0 0 209 -4,-1.1 -3,-0.2 347,-0.0 -2,-0.1 0.228 360.0 360.0 174.7 360.0 199.6 231.9 53.4 794 ! 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 0.0 795 824 A Y > 0 0 214 0, 0.0 4,-1.1 0, 0.0 -6,-0.1 0.000 360.0 360.0 360.0 -72.9 198.9 224.0 56.3 796 825 A D H > + 0 0 116 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.662 360.0 60.7 -71.4 -25.5 197.0 221.9 58.8 797 826 A H H > S+ 0 0 64 2,-0.2 4,-5.1 1,-0.2 -1,-0.2 0.792 98.2 53.8 -75.3 -28.8 194.3 222.3 56.2 798 827 A Y H >>S+ 0 0 24 2,-0.2 4,-3.1 3,-0.2 5,-0.8 0.900 105.3 55.7 -64.2 -43.3 196.5 220.6 53.6 799 828 A E H X5S+ 0 0 103 -4,-1.1 4,-3.2 2,-0.2 -2,-0.2 0.978 119.0 31.8 -41.7 -78.3 196.7 217.7 56.2 800 829 A L H X5S+ 0 0 62 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.937 123.7 50.6 -38.3 -63.8 192.9 217.6 56.2 801 830 A Y H X5S+ 0 0 1 -4,-5.1 4,-1.3 1,-0.2 -3,-0.2 0.914 116.9 35.3 -51.5 -66.5 192.8 218.6 52.5 802 831 A R H X5S+ 0 0 109 -4,-3.1 4,-1.7 1,-0.2 3,-0.4 0.898 112.7 65.9 -52.9 -43.5 195.3 216.1 51.0 803 832 A Q H >X S- 0 0 8 -347,-0.2 3,-1.0 -343,-0.1 -1,-0.6 -0.716 84.0 -98.1-124.5-179.1 189.6 208.2 37.5 813 842 A L G > S+ 0 0 1 1,-0.3 3,-2.1 -2,-0.2 4,-0.4 0.870 115.9 66.6 -72.8 -35.1 192.0 206.2 35.3 814 843 A R G > S+ 0 0 1 1,-0.3 3,-1.1 2,-0.2 -1,-0.3 0.776 91.9 67.2 -55.0 -20.2 195.1 208.1 36.4 815 844 A D G < S+ 0 0 7 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.796 91.8 58.2 -73.0 -26.3 194.5 206.6 39.8 816 845 A L G < S+ 0 0 13 -3,-2.1 361,-2.9 -4,-0.3 -1,-0.3 0.514 102.1 79.0 -75.6 -4.2 195.3 203.1 38.4 817 846 A L E < +C 1176 0O 1 -3,-1.1 2,-0.3 -4,-0.4 359,-0.2 -0.500 53.6 174.7-108.0 172.8 198.6 204.5 37.5 818 847 A D E -C 1175 0O 60 357,-1.2 357,-2.2 -2,-0.2 2,-0.1 -0.957 35.3 -83.8-168.7 161.5 201.9 205.3 39.3 819 848 A F E -C 1174 0O 17 -2,-0.3 355,-0.2 355,-0.2 2,-0.1 -0.415 22.8-170.7 -84.0 159.7 205.4 206.5 38.5 820 849 A N - 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