==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 07-JAN-13 4IO4 . COMPND 2 MOLECULE: AVGLUR1 LIGAND BINDING DOMAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ADINETA VAGA; . AUTHOR S.LOMASH,S.CHITTORI,M.L.MAYER . 489 6 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21405.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 342 69.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 13.5 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 . 3 0.6 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 . 1 0.2 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 . 29 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 132 27.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 3.1 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 3 1 0 0 0 5 5 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 0 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 0 PARALLEL BRIDGES PER LADDER . 6 1 0 1 2 1 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 2 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 2 A S 0 0 42 0, 0.0 212,-0.0 0, 0.0 214,-0.0 0.000 360.0 360.0 360.0 -81.3 17.0 41.4 -2.8 2 3 A A - 0 0 71 2,-0.0 2,-0.2 212,-0.0 215,-0.2 0.067 360.0 -50.5 71.6 178.7 17.1 44.2 -5.5 3 4 A R - 0 0 167 1,-0.1 47,-0.1 2,-0.1 46,-0.0 -0.558 22.7-150.1 -99.8 150.6 15.1 44.6 -8.7 4 5 A L > + 0 0 2 45,-0.2 3,-2.4 -2,-0.2 48,-0.2 0.248 48.8 140.5 -96.9 10.9 14.4 42.3 -11.6 5 6 A K T 3 S+ 0 0 163 1,-0.3 46,-0.3 46,-0.1 45,-0.2 -0.378 80.7 4.9 -57.8 122.7 14.1 45.1 -14.1 6 7 A G T 3 S+ 0 0 52 44,-3.2 2,-0.4 1,-0.3 -1,-0.3 0.369 101.7 127.2 84.1 -6.2 15.7 43.9 -17.3 7 8 A I < - 0 0 75 -3,-2.4 45,-3.1 43,-0.0 2,-0.4 -0.690 58.6-127.6 -89.1 133.5 16.3 40.4 -15.9 8 9 A T E -a 52 0A 79 -2,-0.4 2,-0.5 43,-0.2 45,-0.2 -0.667 23.1-165.9 -79.7 128.4 15.1 37.4 -17.9 9 10 A L E -a 53 0A 9 43,-2.9 45,-2.7 -2,-0.4 2,-0.7 -0.973 17.4-141.5-114.5 128.0 13.0 34.9 -15.9 10 11 A R E -a 54 0A 83 -2,-0.5 67,-2.8 43,-0.2 68,-1.8 -0.826 26.8-162.0 -82.0 112.5 12.2 31.4 -17.2 11 12 A I E -ab 55 78A 0 43,-2.6 45,-3.0 -2,-0.7 2,-0.4 -0.898 6.3-148.1-108.6 110.1 8.6 31.0 -16.2 12 13 A G E +ab 56 79A 0 66,-2.9 68,-2.2 -2,-0.6 2,-0.3 -0.613 20.5 178.8 -75.2 132.5 7.2 27.5 -16.1 13 14 A V E -a 57 0A 0 43,-2.5 45,-3.0 -2,-0.4 2,-0.4 -0.917 14.7-149.6-129.6 162.1 3.4 27.2 -16.9 14 15 A I - 0 0 10 66,-0.4 68,-0.2 -2,-0.3 6,-0.1 -0.995 29.1-101.9-137.6 132.3 1.2 24.2 -17.1 15 16 A E + 0 0 94 -2,-0.4 6,-0.2 43,-0.3 2,-0.1 -0.319 57.7 139.3 -61.3 132.4 -1.9 23.7 -19.4 16 17 A S B >> -E 20 0B 2 4,-2.9 3,-2.0 143,-0.0 4,-2.0 -0.492 53.8 -98.2-173.2 98.8 -5.1 24.1 -17.5 17 18 A V T 34 S+ 0 0 34 1,-0.3 167,-0.2 2,-0.2 4,-0.1 -0.415 103.0 7.6 -64.0 132.5 -8.1 26.0 -19.0 18 19 A P T 34 S+ 0 0 0 0, 0.0 19,-2.2 0, 0.0 -1,-0.3 -0.874 128.2 56.3-105.9 22.3 -8.6 28.9 -18.4 19 20 A F T <4 S+ 0 0 5 -3,-2.0 19,-2.2 1,-0.3 20,-0.7 0.950 128.8 7.1 -67.0 -54.5 -5.4 29.5 -16.4 20 21 A T B < S-E 16 0B 0 -4,-2.0 -4,-2.9 18,-0.2 2,-0.5 -0.953 75.5-170.3-141.1 112.2 -3.2 28.4 -19.3 21 22 A I E -F 35 0C 38 14,-3.0 14,-1.9 -2,-0.4 2,-0.5 -0.912 5.1-159.6-112.8 126.5 -4.8 27.7 -22.6 22 23 A V E -F 34 0C 43 -2,-0.5 2,-0.4 12,-0.2 12,-0.2 -0.929 9.9-176.8-114.2 120.8 -2.8 26.1 -25.4 23 24 A A E -F 33 0C 48 10,-2.8 10,-2.7 -2,-0.5 2,-0.6 -0.964 16.0-147.3-120.9 138.2 -3.9 26.4 -29.0 24 25 A N E -F 32 0C 119 -2,-0.4 2,-0.3 8,-0.2 8,-0.2 -0.900 19.8-173.4-105.1 125.6 -2.2 24.8 -32.0 25 26 A V E -F 31 0C 47 6,-2.8 6,-2.3 -2,-0.6 2,-0.3 -0.879 5.0-154.0-122.7 148.6 -2.5 26.8 -35.2 26 27 A I E F 30 0C 125 -2,-0.3 4,-0.2 4,-0.2 -2,-0.0 -0.817 360.0 360.0-127.6 160.8 -1.5 25.8 -38.7 27 28 A D 0 0 160 2,-0.8 3,-0.1 -2,-0.3 -2,-0.0 -0.328 360.0 360.0 -77.7 360.0 -0.4 27.3 -42.0 28 ! 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 29 32 A R 0 0 83 0, 0.0 -2,-0.8 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 134.8 3.7 24.5 -40.4 30 33 A N E +F 26 0C 119 -4,-0.2 2,-0.3 -3,-0.1 -4,-0.2 -0.704 360.0 172.8-100.6 140.9 2.6 24.3 -36.7 31 34 A T E -F 25 0C 78 -6,-2.3 -6,-2.8 -2,-0.3 2,-0.4 -0.970 22.2-131.8-141.2 159.2 2.9 26.9 -34.0 32 35 A T E -F 24 0C 79 -2,-0.3 2,-0.4 -8,-0.2 -8,-0.2 -0.896 13.0-161.8-117.8 138.8 1.5 27.1 -30.5 33 36 A K E -F 23 0C 122 -10,-2.7 -10,-2.8 -2,-0.4 2,-0.4 -0.965 4.4-156.5-120.9 137.3 -0.3 30.0 -28.8 34 37 A L E +F 22 0C 49 -2,-0.4 2,-0.3 -12,-0.2 -12,-0.2 -0.935 22.6 153.8-114.2 134.4 -0.7 30.6 -25.0 35 38 A T E +F 21 0C 70 -14,-1.9 -14,-3.0 -2,-0.4 2,-0.2 -0.908 18.4 86.5-143.2 172.4 -3.5 32.6 -23.5 36 39 A G S > S- 0 0 0 -2,-0.3 4,-2.4 -16,-0.2 -17,-0.2 -0.639 84.0 -46.3 128.4 177.0 -5.4 32.8 -20.2 37 40 A Y H > S+ 0 0 2 -19,-2.2 4,-2.5 1,-0.2 -18,-0.2 0.894 130.7 50.4 -48.2 -46.9 -5.4 34.1 -16.6 38 41 A V H > S+ 0 0 0 -19,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.897 108.9 50.4 -66.4 -39.3 -1.8 33.1 -16.1 39 42 A L H > S+ 0 0 30 -20,-0.7 4,-1.8 1,-0.2 -1,-0.2 0.906 112.5 47.0 -67.2 -38.8 -0.6 34.8 -19.3 40 43 A D H X S+ 0 0 36 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.880 110.6 52.9 -67.2 -39.8 -2.4 38.0 -18.3 41 44 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 5,-0.2 0.919 106.5 52.9 -61.4 -44.2 -1.0 37.8 -14.8 42 45 A I H X S+ 0 0 6 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.925 108.4 51.3 -54.6 -46.1 2.5 37.5 -16.2 43 46 A E H X S+ 0 0 82 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.912 110.1 48.2 -58.1 -45.8 1.9 40.7 -18.2 44 47 A Y H X S+ 0 0 96 -4,-2.1 4,-0.8 2,-0.2 -2,-0.2 0.920 114.5 45.6 -61.8 -42.8 0.7 42.6 -15.2 45 48 A L H X S+ 0 0 1 -4,-2.5 4,-3.0 1,-0.2 3,-0.4 0.887 112.6 51.0 -69.8 -39.3 3.7 41.5 -13.1 46 49 A R H X S+ 0 0 77 -4,-2.8 4,-2.9 -5,-0.2 -1,-0.2 0.902 107.9 52.0 -64.4 -41.3 6.1 42.3 -16.0 47 50 A D H < S+ 0 0 104 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.675 118.6 37.8 -72.6 -17.8 4.7 45.8 -16.5 48 51 A K H < S+ 0 0 84 -4,-0.8 -2,-0.2 -3,-0.4 -1,-0.2 0.774 126.9 33.6 -94.4 -36.1 5.2 46.5 -12.7 49 52 A M H < S- 0 0 9 -4,-3.0 -45,-0.2 -5,-0.2 -3,-0.2 0.673 91.7-136.7-102.0 -19.8 8.5 44.7 -12.2 50 53 A G < + 0 0 29 -4,-2.9 -44,-3.2 -5,-0.3 -4,-0.1 0.556 50.1 144.1 75.6 9.8 10.2 45.2 -15.5 51 54 A F - 0 0 6 -46,-0.3 2,-0.6 -6,-0.3 -43,-0.2 -0.226 53.9-114.1 -69.7 166.5 11.6 41.6 -15.9 52 55 A V E -a 8 0A 74 -45,-3.1 -43,-2.9 -48,-0.2 2,-0.5 -0.938 30.7-138.4-104.2 125.3 11.8 39.9 -19.3 53 56 A A E -a 9 0A 35 -2,-0.6 2,-0.6 -45,-0.2 -43,-0.2 -0.687 21.9-178.0 -92.4 123.1 9.5 36.9 -19.5 54 57 A D E -a 10 0A 58 -45,-2.7 -43,-2.6 -2,-0.5 2,-0.5 -0.892 21.8-158.7-114.6 95.5 10.6 33.7 -21.1 55 58 A V E -a 11 0A 42 -2,-0.6 2,-0.5 -45,-0.2 -43,-0.2 -0.662 10.0-172.5 -86.4 126.2 7.4 31.6 -20.8 56 59 A Q E -a 12 0A 91 -45,-3.0 -43,-2.5 -2,-0.5 2,-0.4 -0.973 15.2-143.8-126.8 121.5 7.9 27.9 -21.0 57 60 A L E -a 13 0A 60 -2,-0.5 -43,-0.2 -45,-0.2 -45,-0.1 -0.693 25.6-119.7 -83.1 128.3 5.0 25.5 -21.2 58 61 A A - 0 0 7 -45,-3.0 -43,-0.3 -2,-0.4 3,-0.1 -0.408 40.5 -92.4 -65.7 144.5 5.7 22.2 -19.4 59 62 A P > - 0 0 86 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.065 57.1 -77.8 -53.9 157.3 5.6 19.1 -21.6 60 63 A P T 3 S+ 0 0 120 0, 0.0 3,-0.1 0, 0.0 98,-0.0 -0.232 117.5 18.5 -59.5 146.6 2.2 17.3 -21.9 61 64 A N T 3 S+ 0 0 90 1,-0.3 2,-0.1 -3,-0.1 -3,-0.0 0.487 82.9 150.8 66.8 4.2 1.2 15.1 -19.0 62 65 A T < - 0 0 42 -3,-1.8 -1,-0.3 -4,-0.1 2,-0.1 -0.441 41.6-134.7 -53.1 133.5 3.7 16.9 -16.6 63 66 A S > - 0 0 36 -3,-0.1 4,-2.0 1,-0.1 72,-0.1 -0.455 15.7-110.9 -89.6 171.1 2.2 16.6 -13.2 64 67 A Y H > S+ 0 0 9 71,-0.6 4,-2.3 70,-0.3 72,-0.2 0.930 122.5 46.7 -68.9 -41.4 1.9 19.5 -10.7 65 68 A T H > S+ 0 0 45 70,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.892 110.1 55.8 -63.9 -37.4 4.4 17.9 -8.4 66 69 A G H > S+ 0 0 24 69,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.882 105.8 50.4 -61.8 -40.9 6.6 17.3 -11.5 67 70 A L H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.949 110.9 49.0 -62.9 -46.5 6.5 21.0 -12.3 68 71 A V H X S+ 0 0 1 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.934 112.2 48.2 -57.6 -45.7 7.5 21.8 -8.8 69 72 A L H X S+ 0 0 92 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.882 107.9 55.1 -65.5 -37.7 10.4 19.3 -8.9 70 73 A A H <>S+ 0 0 18 -4,-2.3 5,-2.7 2,-0.2 6,-0.4 0.913 109.4 47.5 -61.1 -40.8 11.5 20.7 -12.3 71 74 A L H ><5S+ 0 0 5 -4,-2.3 3,-2.2 1,-0.2 5,-0.2 0.937 109.2 52.5 -64.7 -44.0 11.8 24.1 -10.8 72 75 A A H 3<5S+ 0 0 53 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.835 107.3 55.1 -60.0 -29.7 13.7 22.7 -7.7 73 76 A N T 3<5S- 0 0 125 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.435 124.6-104.8 -81.9 -3.1 16.0 21.1 -10.3 74 77 A G T < 5S+ 0 0 36 -3,-2.2 -3,-0.2 2,-0.2 -2,-0.1 0.554 84.3 125.5 89.8 12.5 16.7 24.5 -11.9 75 78 A D S - 0 0 5 -2,-0.6 4,-2.3 1,-0.1 5,-0.2 -0.931 44.1-119.5-129.9 157.4 1.4 22.0 0.2 87 90 A S H > S+ 0 0 24 -2,-0.3 4,-0.9 1,-0.2 -1,-0.1 0.910 114.2 50.9 -59.3 -44.5 3.7 21.1 3.1 88 91 A A H >4 S+ 0 0 64 1,-0.2 3,-0.5 2,-0.2 4,-0.4 0.912 112.2 46.4 -63.5 -40.5 5.5 18.5 1.0 89 92 A R H >> S+ 0 0 7 1,-0.2 3,-1.7 2,-0.2 4,-1.6 0.890 104.9 60.7 -68.9 -37.3 6.2 21.0 -1.8 90 93 A R H 3< S+ 0 0 17 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.730 92.0 69.0 -65.7 -19.7 7.3 23.7 0.6 91 94 A E T << S+ 0 0 68 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.822 114.9 24.9 -62.9 -28.2 10.1 21.4 1.8 92 95 A I T <4 S+ 0 0 67 -3,-1.7 118,-0.4 -4,-0.4 2,-0.3 0.553 129.5 22.2-119.8 -12.3 11.8 21.8 -1.6 93 96 A V < - 0 0 0 -4,-1.6 2,-0.2 116,-0.2 -1,-0.2 -0.941 70.0-121.4-144.6 166.7 10.6 25.2 -3.0 94 97 A A E -D 208 0A 13 114,-2.6 114,-2.5 -2,-0.3 2,-0.4 -0.684 22.0-141.9-104.4 165.2 9.2 28.4 -1.6 95 98 A F E -D 207 0A 20 -2,-0.2 112,-0.2 112,-0.2 3,-0.1 -0.978 11.9-124.8-129.2 142.1 5.8 29.9 -2.6 96 99 A S - 0 0 7 110,-2.8 3,-0.1 -2,-0.4 120,-0.1 -0.146 53.2 -68.8 -68.6 172.5 4.8 33.5 -3.1 97 100 A N S S- 0 0 16 1,-0.1 109,-0.5 108,-0.1 -1,-0.2 -0.372 78.5 -75.0 -55.8 156.0 2.0 35.1 -1.2 98 101 A S - 0 0 12 1,-0.1 107,-0.2 107,-0.1 -1,-0.1 -0.160 35.3-166.7 -65.7 138.6 -1.2 33.5 -2.4 99 102 A I S S- 0 0 8 105,-2.8 2,-0.3 1,-0.4 106,-0.2 0.599 76.6 -3.6 -95.5 -10.6 -2.7 34.5 -5.8 100 103 A S E -H 204 0D 13 104,-1.0 104,-2.4 2,-0.0 -1,-0.4 -0.933 67.9-113.9-172.4 147.0 -6.0 32.8 -5.0 101 104 A D E -H 203 0D 68 -2,-0.3 2,-0.3 102,-0.2 102,-0.3 -0.349 41.5-175.4 -75.3 171.0 -7.8 30.8 -2.4 102 105 A N E +H 202 0D 10 100,-1.9 100,-2.4 -2,-0.1 2,-0.3 -0.990 20.7 170.4-159.7 165.4 -8.8 27.3 -3.4 103 106 A S E - 0 0 6 -2,-0.3 75,-2.8 98,-0.2 2,-0.3 -0.928 30.3-110.2-167.7 173.8 -10.6 24.1 -2.4 104 107 A M E -HI 199 177D 2 95,-3.5 95,-2.3 -2,-0.3 2,-0.3 -0.804 20.3-165.5-117.5 157.7 -11.7 20.9 -4.1 105 108 A R E - I 0 176D 54 71,-2.6 71,-2.4 -2,-0.3 2,-0.5 -0.924 30.0-104.9-132.2 157.1 -14.9 19.3 -5.2 106 109 A I E -HI 195 175D 1 89,-1.0 89,-1.8 -2,-0.3 2,-0.4 -0.746 33.1-153.2 -81.6 129.6 -15.9 15.9 -6.3 107 110 A L E +HI 194 174D 0 67,-2.8 67,-1.8 -2,-0.5 2,-0.3 -0.876 26.7 150.3-105.1 137.0 -16.5 15.6 -10.1 108 111 A M E -HI 193 173D 15 85,-2.5 85,-3.2 -2,-0.4 2,-0.2 -0.950 48.6 -79.5-155.0 169.1 -18.8 12.9 -11.5 109 112 A R E > -H 192 0D 62 63,-0.5 3,-1.9 -2,-0.3 83,-0.3 -0.572 60.1 -93.4 -71.4 141.9 -21.2 12.2 -14.4 110 113 A K T 3 S+ 0 0 117 81,-2.4 -1,-0.1 -2,-0.2 3,-0.1 -0.268 111.3 25.9 -50.3 137.9 -24.6 13.8 -14.2 111 114 A G T 3 S+ 0 0 70 1,-0.3 -1,-0.2 3,-0.1 2,-0.1 0.265 82.0 144.7 90.0 -7.6 -27.2 11.6 -12.6 112 115 A T < - 0 0 28 -3,-1.9 2,-1.7 1,-0.1 -1,-0.3 -0.442 54.3-126.8 -68.9 135.3 -24.7 9.6 -10.6 113 116 A L + 0 0 145 -2,-0.1 2,-0.4 -3,-0.1 -1,-0.1 -0.481 66.3 119.5 -91.0 73.0 -26.2 8.7 -7.2 114 117 A I - 0 0 15 -2,-1.7 82,-0.1 1,-0.1 3,-0.1 -0.981 40.5-170.7-130.3 131.9 -23.5 10.0 -4.9 115 118 A D - 0 0 111 -2,-0.4 2,-0.3 1,-0.3 81,-0.2 0.592 59.1 -63.3-103.1 -12.9 -24.2 12.7 -2.3 116 119 A G S > S- 0 0 7 80,-0.1 3,-1.9 1,-0.1 4,-0.5 -0.998 77.0 -31.2 162.7-164.9 -20.7 13.4 -1.3 117 120 A M T >> S+ 0 0 24 -2,-0.3 3,-1.2 1,-0.3 4,-1.0 0.775 115.8 71.2 -57.2 -31.2 -17.4 12.4 0.3 118 121 A D H 3> S+ 0 0 111 1,-0.3 4,-2.1 2,-0.2 3,-0.5 0.842 93.1 57.1 -53.1 -33.5 -19.1 10.0 2.6 119 122 A D H <4>S+ 0 0 10 -3,-1.9 6,-1.0 1,-0.2 5,-0.8 0.724 100.6 56.2 -77.6 -19.9 -19.8 7.7 -0.3 120 123 A L H <45S+ 0 0 1 -3,-1.2 -1,-0.2 -4,-0.5 -2,-0.2 0.725 114.3 40.0 -78.4 -22.5 -16.1 7.4 -1.2 121 124 A K H <5S+ 0 0 94 -4,-1.0 -2,-0.2 -3,-0.5 -3,-0.1 0.786 107.2 59.9 -91.3 -33.8 -15.4 6.2 2.3 122 125 A N T <5S- 0 0 94 -4,-2.1 -2,-0.1 -5,-0.2 -3,-0.1 0.483 111.4-113.0 -78.1 -2.7 -18.3 3.9 2.9 123 126 A G T 5S+ 0 0 51 -4,-0.3 -3,-0.1 2,-0.2 -4,-0.1 0.595 78.0 131.1 80.8 11.4 -17.4 1.7 -0.1 124 127 A K S - 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0 0 8 -2,-0.3 75,-2.9 98,-0.3 2,-0.3 -0.918 31.3-111.7-157.7 179.7 -12.1 39.8 4.4 349 107 B M E -PQ 444 422F 2 95,-2.9 95,-1.9 -2,-0.3 2,-0.3 -0.800 19.5-163.7-117.2 160.7 -13.8 42.8 6.1 350 108 B R E - Q 0 421F 55 71,-2.6 71,-2.2 -2,-0.3 2,-0.5 -0.937 29.4-102.9-136.3 159.3 -17.4 43.8 6.8 351 109 B I E -PQ 440 420F 1 89,-1.0 89,-1.9 -2,-0.3 2,-0.4 -0.737 33.9-155.1 -83.3 129.2 -19.1 47.0 7.7 352 110 B L E +PQ 439 419F 0 67,-2.9 67,-2.0 -2,-0.5 2,-0.3 -0.879 25.6 147.2-108.7 136.2 -20.1 47.3 11.3 353 111 B M E -P 438 0F 12 85,-2.4 85,-2.9 -2,-0.4 2,-0.3 -0.941 48.0 -84.6-153.0 171.1 -22.9 49.5 12.6 354 112 B R E > -P 437 0F 99 63,-0.5 3,-1.8 -2,-0.3 83,-0.3 -0.642 55.7 -98.0 -76.3 144.1 -25.7 49.9 15.2 355 113 B K T 3 S+ 0 0 110 81,-2.5 3,-0.1 -2,-0.3 -1,-0.1 -0.362 111.1 33.7 -57.2 139.0 -29.0 48.2 14.4 356 114 B G T 3 S+ 0 0 71 1,-0.4 2,-0.3 3,-0.1 -1,-0.2 0.196 81.8 132.1 98.2 -16.9 -31.4 50.7 12.9 357 115 B T < - 0 0 26 -3,-1.8 2,-1.9 1,-0.1 -1,-0.4 -0.544 62.8-125.0 -67.1 132.2 -28.8 52.7 11.0 358 116 B L + 0 0 168 -2,-0.3 2,-0.4 -3,-0.1 -1,-0.1 -0.407 63.4 126.5 -86.7 69.8 -29.9 53.3 7.5 359 117 B I - 0 0 12 -2,-1.9 82,-0.1 1,-0.1 3,-0.1 -0.988 34.4-175.9-125.0 129.5 -26.9 51.9 5.6 360 118 B D - 0 0 137 -2,-0.4 81,-0.3 1,-0.3 2,-0.3 0.717 60.0 -63.3 -96.0 -28.8 -27.2 49.2 2.8 361 119 B G S >> S- 0 0 9 80,-0.1 3,-1.2 79,-0.1 4,-0.7 -0.987 75.4 -38.5 168.8-161.7 -23.5 48.6 2.1 362 120 B M H >> S+ 0 0 23 -2,-0.3 4,-2.3 1,-0.3 3,-0.7 0.797 117.8 68.4 -66.1 -29.7 -20.2 50.1 0.9 363 121 B D H 3> S+ 0 0 115 1,-0.3 4,-1.4 2,-0.2 -1,-0.3 0.856 94.6 58.5 -59.2 -32.3 -21.8 52.2 -1.9 364 122 B D H <4>S+ 0 0 28 -3,-1.2 5,-2.3 1,-0.2 6,-0.7 0.880 108.8 44.8 -66.5 -33.9 -23.4 54.4 0.7 365 123 B L H X<5S+ 0 0 0 -3,-0.7 3,-1.0 -4,-0.7 -2,-0.2 0.880 114.1 48.0 -72.3 -40.4 -19.9 55.2 2.0 366 124 B K H 3<5S+ 0 0 83 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.619 110.4 53.2 -77.7 -13.4 -18.5 55.8 -1.4 367 125 B N T 3<5S- 0 0 116 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.227 114.6-111.3-106.4 12.2 -21.4 58.0 -2.4 368 126 B G T < 5S+ 0 0 41 -3,-1.0 -3,-0.2 2,-0.1 -2,-0.1 0.754 73.6 135.4 73.0 25.8 -21.1 60.3 0.6 369 127 B K S - 0 0 70 0, 0.0 3,-2.2 0, 0.0 46,-0.2 -0.319 28.2-123.4 -56.5 141.7 -20.3 62.3 6.7 372 130 B Y G > S+ 0 0 85 1,-0.3 3,-2.1 2,-0.2 27,-0.5 0.897 109.8 59.2 -60.9 -36.5 -16.6 61.3 6.6 373 131 B N G 3 S+ 0 0 102 1,-0.3 -1,-0.3 25,-0.2 25,-0.1 0.465 100.1 60.1 -75.2 5.5 -16.1 62.2 10.3 374 132 B R G < S+ 0 0 69 -3,-2.2 43,-2.8 42,-0.1 44,-1.4 0.260 83.3 89.4-110.8 9.3 -18.8 59.7 11.2 375 133 B I B < S-t 418 0I 0 -3,-2.1 24,-2.8 22,-0.2 2,-0.4 -0.933 73.5-149.5-101.9 110.2 -16.9 56.8 9.6 376 134 B G E -u 399 0J 0 42,-2.7 44,-0.4 -2,-0.7 2,-0.4 -0.699 17.4-177.1 -82.8 130.5 -14.7 55.5 12.4 377 135 B I E -u 400 0J 2 22,-3.0 24,-2.2 -2,-0.4 2,-0.6 -0.990 26.0-130.3-132.8 129.5 -11.4 53.9 11.4 378 136 B R E > -u 401 0J 13 -2,-0.4 3,-0.6 42,-0.2 6,-0.5 -0.624 32.7-127.3 -76.1 118.2 -8.8 52.2 13.6 379 137 B I T 3 S+ 0 0 80 22,-1.9 -70,-0.3 -2,-0.6 -69,-0.1 -0.356 88.9 29.8 -66.4 148.1 -5.5 53.8 12.7 380 138 B G T 3 S+ 0 0 9 1,-0.3 -70,-2.3 -72,-0.1 -71,-0.7 0.830 98.4 111.6 69.9 36.2 -2.7 51.4 11.8 381 139 B T S X> S- 0 0 5 -3,-0.6 4,-1.5 -72,-0.2 3,-0.5 -0.918 82.0-112.3-131.7 162.1 -5.0 48.7 10.4 382 140 B A H 3> S+ 0 0 1 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.770 116.9 64.8 -62.2 -27.3 -5.7 47.3 7.0 383 141 B G H 3> S+ 0 0 4 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.898 99.5 52.0 -62.6 -39.5 -9.1 49.0 7.3 384 142 B E H <> S+ 0 0 19 -3,-0.5 4,-2.6 -6,-0.5 -2,-0.2 0.915 108.3 50.6 -60.1 -44.0 -7.3 52.3 7.3 385 143 B D H X S+ 0 0 54 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.931 111.3 48.4 -58.1 -46.5 -5.4 51.4 4.1 386 144 B Y H X>S+ 0 0 17 -4,-2.3 4,-3.3 2,-0.2 5,-0.6 0.950 111.7 49.3 -61.1 -50.8 -8.7 50.4 2.4 387 145 B Y H X>S+ 0 0 0 -4,-2.6 5,-2.2 1,-0.2 4,-2.1 0.946 112.9 46.3 -53.7 -50.6 -10.4 53.6 3.4 388 146 B L H <5S+ 0 0 31 -4,-2.6 6,-1.8 1,-0.2 -1,-0.2 0.833 119.5 41.2 -63.3 -30.0 -7.6 55.8 2.2 389 147 B R H <5S+ 0 0 80 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.885 129.5 21.9 -84.0 -37.9 -7.4 53.9 -1.1 390 148 B E H <5S+ 0 0 73 -4,-3.3 -3,-0.2 -5,-0.2 -2,-0.2 0.681 129.6 27.9-111.3 -24.9 -11.0 53.4 -1.9 391 149 B I T < S- 0 0 28 1,-0.1 4,-1.8 -98,-0.0 -1,-0.1 -0.987 73.6 -95.3-169.5 164.5 -8.7 50.4 19.5 404 162 B R H > S+ 0 0 25 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.897 121.3 58.0 -58.4 -41.8 -11.6 48.1 19.0 405 163 B Q H > S+ 0 0 94 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.891 105.2 49.3 -59.9 -38.7 -13.0 49.2 22.3 406 164 B E H > S+ 0 0 52 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.907 109.4 54.1 -66.1 -36.5 -13.1 52.8 21.2 407 165 B M H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.949 111.5 42.9 -61.9 -50.7 -14.9 51.6 18.0 408 166 B Y H X S+ 0 0 14 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.953 115.8 48.6 -60.4 -50.1 -17.6 49.8 19.9 409 167 B D H X S+ 0 0 84 -4,-2.6 4,-2.0 1,-0.2 6,-0.2 0.883 110.9 50.7 -59.0 -39.1 -18.0 52.7 22.4 410 168 B S H <>S+ 0 0 6 -4,-2.7 5,-2.1 2,-0.2 6,-1.4 0.872 111.7 47.2 -70.7 -36.9 -18.2 55.3 19.6 411 169 B L H ><5S+ 0 0 0 -4,-2.1 3,-1.0 -5,-0.2 -2,-0.2 0.931 113.2 48.3 -64.6 -48.0 -20.9 53.3 17.7 412 170 B L H 3<5S+ 0 0 68 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.814 112.6 47.9 -68.6 -29.2 -22.9 52.8 20.8 413 171 B A T 3<5S- 0 0 70 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.516 112.1-120.4 -86.9 -4.8 -22.7 56.5 21.8 414 172 B G T < 5S+ 0 0 21 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.708 77.5 126.2 74.6 19.5 -23.6 57.5 18.3 415 173 B I S -Q 349 0F 1 -2,-0.3 4,-2.2 -73,-0.2 -73,-0.3 -0.424 43.0-116.2 -63.3 147.7 -12.3 41.6 9.8 423 181 B I H > S+ 0 0 40 -75,-2.9 4,-2.2 1,-0.2 5,-0.2 0.818 106.7 53.7 -62.9 -38.5 -15.0 39.1 9.2 424 182 B G H > S+ 0 0 20 -76,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.956 117.5 34.5 -62.6 -52.8 -14.1 36.5 11.9 425 183 B T H > S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.835 114.4 59.8 -73.0 -32.9 -14.0 38.9 14.8 426 184 B A H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.930 110.2 42.2 -60.5 -46.1 -16.9 41.0 13.4 427 185 B E H X S+ 0 0 91 -4,-2.2 4,-1.3 -5,-0.2 -1,-0.2 0.907 115.5 50.5 -65.7 -41.6 -19.1 37.9 13.4 428 186 B Y H X S+ 0 0 47 -4,-2.0 4,-1.3 -5,-0.2 5,-0.3 0.934 112.8 44.6 -63.9 -43.7 -17.8 36.9 16.9 429 187 B V H X>S+ 0 0 2 -4,-3.1 5,-3.1 1,-0.2 4,-1.6 0.817 115.4 45.6 -73.2 -34.0 -18.4 40.3 18.5 430 188 B T H <5S+ 0 0 17 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.648 118.4 44.9 -85.1 -17.1 -21.9 40.9 17.0 431 189 B N H <5S+ 0 0 49 -4,-1.3 58,-2.3 -5,-0.2 57,-0.9 0.638 128.7 20.4 -96.5 -16.4 -22.9 37.4 17.9 432 190 B N H <5S+ 0 0 25 -4,-1.3 -3,-0.2 56,-0.2 -2,-0.2 0.635 131.5 17.0-128.7 -19.3 -21.5 37.2 21.4 433 191 B I T <5S+ 0 0 77 -4,-1.6 2,-0.9 -5,-0.3 -3,-0.2 0.728 117.0 42.2-124.1 -57.0 -20.9 40.6 22.9 434 192 B Y > < + 0 0 40 -5,-3.1 3,-1.8 1,-0.2 -1,-0.1 -0.721 55.3 173.5-106.3 83.4 -22.6 43.5 21.3 435 193 B b T 3 S+ 0 0 50 -2,-0.9 -1,-0.2 1,-0.3 -5,-0.1 0.646 77.9 57.4 -64.3 -15.4 -26.1 42.4 20.5 436 194 B N T 3 S+ 0 0 96 -3,-0.1 -81,-2.5 -82,-0.0 -1,-0.3 0.404 95.4 76.6-100.6 1.2 -27.2 45.8 19.4 437 195 B L E < + P 0 354F 2 -3,-1.8 2,-0.3 -83,-0.3 -83,-0.2 -0.716 61.3 177.4-103.2 160.6 -24.5 46.1 16.7 438 196 B T E - 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