==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 30-MAR-10 3AGE . COMPND 2 MOLECULE: SALT-TOLERANT GLUTAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MICROCOCCUS LUTEUS; . AUTHOR K.YOSHIMUNE,Y.SHIRAKIHARA,I.YUMOTO . 887 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32639.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 625 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 84 9.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.9 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 . 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 . 51 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 97 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 312 35.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 1.9 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 1 1 2 6 0 2 0 8 6 2 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 2 0 0 0 2 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 2 0 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 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 1 A M 0 0 29 0, 0.0 2,-0.4 0, 0.0 801,-0.2 0.000 360.0 360.0 360.0 163.6 57.3 56.8 12.5 2 2 A R - 0 0 168 868,-0.1 868,-0.1 865,-0.0 795,-0.0 -0.828 360.0-111.1-102.5 136.5 58.6 53.3 12.0 3 3 A H > - 0 0 18 -2,-0.4 4,-0.8 1,-0.1 791,-0.0 -0.455 24.4-142.6 -63.7 125.1 56.8 50.2 13.5 4 4 A P H > S+ 0 0 8 0, 0.0 4,-1.9 0, 0.0 3,-0.4 0.823 88.4 69.5 -60.8 -35.5 59.1 48.9 16.3 5 5 A I H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.904 96.6 50.7 -52.1 -50.4 58.5 45.1 15.7 6 6 A P H > S+ 0 0 29 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.872 111.7 49.6 -57.5 -35.9 60.3 45.0 12.3 7 7 A D H X S+ 0 0 36 -4,-0.8 4,-2.1 -3,-0.4 -2,-0.2 0.825 107.3 54.6 -72.0 -31.3 63.3 46.7 13.9 8 8 A Y H X S+ 0 0 37 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.930 109.0 48.6 -64.8 -44.9 63.1 44.2 16.8 9 9 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.913 108.9 52.9 -60.9 -44.2 63.3 41.4 14.2 10 10 A A H X S+ 0 0 39 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.921 109.5 48.1 -58.3 -46.1 66.3 43.0 12.4 11 11 A S H X S+ 0 0 76 -4,-2.1 4,-3.2 1,-0.2 -1,-0.2 0.924 112.1 50.6 -59.1 -45.6 68.2 43.2 15.7 12 12 A L H X S+ 0 0 3 -4,-2.3 4,-2.4 2,-0.2 5,-0.4 0.867 109.5 50.0 -61.1 -40.4 67.4 39.6 16.4 13 13 A V H X S+ 0 0 21 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.933 113.8 45.4 -65.0 -45.0 68.6 38.6 12.9 14 14 A T H < S+ 0 0 109 -4,-2.6 4,-0.2 -5,-0.2 -2,-0.2 0.917 117.0 46.0 -64.0 -43.2 71.8 40.5 13.5 15 15 A E H >< S+ 0 0 104 -4,-3.2 3,-2.3 -5,-0.2 4,-0.3 0.998 119.5 35.5 -63.1 -68.3 72.2 39.0 16.9 16 16 A L H >< S+ 0 0 14 -4,-2.4 3,-1.1 1,-0.3 -1,-0.2 0.771 111.9 66.7 -58.1 -24.8 71.5 35.4 16.3 17 17 A G T 3< S+ 0 0 29 -4,-1.7 -1,-0.3 -5,-0.4 -2,-0.2 0.505 73.5 87.0 -76.0 -4.5 73.2 35.8 12.9 18 18 A A T < S+ 0 0 86 -3,-2.3 2,-0.3 -4,-0.2 -1,-0.2 0.788 99.7 32.3 -64.3 -26.5 76.6 36.4 14.6 19 19 A V < - 0 0 94 -3,-1.1 271,-0.0 -4,-0.3 0, 0.0 -0.799 62.8-162.8-124.6 168.0 77.0 32.6 14.5 20 20 A N + 0 0 34 -2,-0.3 -3,-0.1 2,-0.0 -4,-0.0 -0.325 21.9 176.5-153.9 64.6 75.8 29.9 12.2 21 21 A P + 0 0 72 0, 0.0 269,-0.2 0, 0.0 268,-0.2 -0.047 42.7 30.6 -66.1 166.5 76.0 26.4 13.8 22 22 A G S S- 0 0 39 267,-0.1 2,-0.3 259,-0.1 261,-0.2 -0.305 80.1 -96.2 79.4-166.8 74.9 23.0 12.4 23 23 A E B -A 282 0A 115 259,-1.6 259,-3.3 260,-0.1 3,-0.1 -0.978 30.8 -89.9-150.6 161.6 74.9 22.1 8.7 24 24 A T - 0 0 14 -2,-0.3 257,-0.1 257,-0.3 8,-0.1 -0.326 63.8 -72.7 -71.4 154.4 72.6 21.9 5.7 25 25 A A - 0 0 7 236,-0.7 3,-0.5 255,-0.4 -1,-0.2 -0.222 44.3-165.6 -49.1 118.2 70.6 18.8 4.9 26 26 A Q + 0 0 117 1,-0.2 -1,-0.2 -3,-0.1 6,-0.1 0.661 68.5 86.3 -85.8 -12.7 73.1 16.3 3.7 27 27 A Y S S+ 0 0 74 1,-0.1 -1,-0.2 2,-0.0 -2,-0.1 0.748 97.1 30.9 -61.3 -29.6 70.6 13.8 2.2 28 28 A I S >> S- 0 0 0 -3,-0.5 4,-2.3 1,-0.1 3,-0.7 -0.991 72.5-136.2-134.4 134.0 70.4 15.6 -1.2 29 29 A P H 3> S+ 0 0 75 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.854 102.1 61.3 -52.3 -40.8 73.1 17.6 -3.0 30 30 A V H 34 S+ 0 0 35 1,-0.2 4,-0.3 2,-0.2 126,-0.1 0.929 114.4 34.8 -54.6 -45.5 70.8 20.5 -4.0 31 31 A L H X4 S+ 0 0 16 -3,-0.7 3,-0.7 1,-0.2 -1,-0.2 0.858 115.4 55.9 -80.0 -30.3 70.0 21.2 -0.3 32 32 A A H 3< S+ 0 0 17 -4,-2.3 -8,-0.2 1,-0.2 -2,-0.2 0.783 109.6 47.2 -70.8 -25.5 73.5 20.4 0.9 33 33 A E T 3< S+ 0 0 148 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.438 84.2 122.7 -95.9 -1.1 75.0 22.9 -1.5 34 34 A A S < S- 0 0 40 -3,-0.7 -10,-0.1 -4,-0.3 -3,-0.0 -0.305 80.3 -90.4 -63.4 143.8 72.7 25.8 -0.7 35 35 A D - 0 0 86 1,-0.2 -1,-0.1 2,-0.1 -2,-0.1 -0.365 37.2-162.4 -55.4 115.2 74.2 29.0 0.5 36 36 A P S S+ 0 0 38 0, 0.0 2,-2.4 0, 0.0 245,-0.4 0.795 71.9 86.3 -73.1 -27.9 74.3 28.6 4.3 37 37 A D + 0 0 115 243,-0.1 2,-0.3 242,-0.1 -2,-0.1 -0.422 66.7 106.9 -75.8 70.3 74.8 32.3 4.9 38 38 A R + 0 0 79 -2,-2.4 2,-0.3 2,-0.0 16,-0.0 -0.986 34.1 166.2-148.8 137.1 71.1 33.2 4.9 39 39 A F + 0 0 10 -2,-0.3 16,-1.2 240,-0.1 2,-0.3 -0.782 9.0 159.1-158.2 107.2 68.7 34.2 7.7 40 40 A G E -CD 54 278B 0 238,-2.2 238,-3.0 15,-0.4 2,-0.3 -0.888 12.0-172.7-129.2 160.6 65.3 35.7 7.4 41 41 A I E -CD 53 277B 2 12,-2.5 12,-2.4 -2,-0.3 2,-0.3 -0.993 2.0-178.1-153.9 145.8 62.2 36.1 9.6 42 42 A A E -CD 52 276B 0 234,-2.6 234,-2.3 -2,-0.3 2,-0.4 -0.996 11.9-157.4-147.2 149.1 58.6 37.3 9.2 43 43 A L E -CD 51 275B 3 8,-3.1 8,-1.7 -2,-0.3 2,-0.5 -0.997 7.0-161.7-128.6 131.2 55.5 37.7 11.4 44 44 A A E -CD 50 274B 0 230,-2.7 230,-2.9 -2,-0.4 6,-0.2 -0.972 14.9-156.4-115.9 119.4 52.0 37.9 9.9 45 45 A T > - 0 0 1 4,-1.9 3,-0.8 -2,-0.5 228,-0.2 -0.581 27.0-120.5 -97.7 156.9 49.4 39.4 12.2 46 46 A P T 3 S+ 0 0 24 0, 0.0 782,-0.1 0, 0.0 -1,-0.1 0.823 112.6 65.3 -61.4 -30.6 45.6 39.0 12.3 47 47 A T T 3 S- 0 0 26 780,-0.1 781,-0.1 1,-0.1 779,-0.1 0.865 123.9-101.5 -60.9 -36.2 45.3 42.7 11.8 48 48 A G S < S+ 0 0 8 -3,-0.8 2,-0.2 1,-0.3 -1,-0.1 0.621 76.1 130.7 120.8 24.3 46.9 42.4 8.4 49 49 A R - 0 0 61 -4,-0.1 -4,-1.9 2,-0.0 2,-0.3 -0.684 41.8-154.7-106.1 161.8 50.5 43.4 8.9 50 50 A L E -C 44 0B 32 -2,-0.2 2,-0.4 -6,-0.2 -6,-0.2 -0.777 13.5-175.1-138.2 89.1 53.7 41.7 7.8 51 51 A H E +C 43 0B 12 -8,-1.7 -8,-3.1 -2,-0.3 2,-0.3 -0.732 20.3 154.0 -87.8 131.4 56.7 42.6 10.0 52 52 A C E -C 42 0B 32 -2,-0.4 2,-0.3 -10,-0.3 -10,-0.2 -0.987 25.0-170.8-155.7 165.1 60.0 41.1 8.8 53 53 A A E +C 41 0B 12 -12,-2.4 -12,-2.5 -2,-0.3 -46,-0.1 -0.960 52.8 13.5-150.7 162.5 63.8 41.3 8.7 54 54 A G E S-C 40 0B 52 -2,-0.3 2,-2.1 -14,-0.2 -14,-0.3 -0.313 120.1 -10.3 71.2-151.1 66.7 39.6 6.9 55 55 A D S > S+ 0 0 53 -16,-1.2 3,-1.1 1,-0.2 -15,-0.4 -0.313 81.8 143.2 -80.4 55.6 66.4 37.3 3.9 56 56 A A T 3 + 0 0 4 -2,-2.1 146,-1.6 1,-0.2 147,-0.2 0.479 68.3 50.3 -75.4 -1.5 62.6 37.2 4.4 57 57 A D T 3 S+ 0 0 113 -3,-0.2 2,-0.6 144,-0.2 -1,-0.2 0.219 78.0 112.2-122.2 14.9 62.1 37.1 0.6 58 58 A V < - 0 0 37 -3,-1.1 143,-0.4 220,-0.0 141,-0.1 -0.797 64.4-129.9 -91.9 124.0 64.4 34.3 -0.5 59 59 A E + 0 0 95 -2,-0.6 2,-0.3 141,-0.1 141,-0.2 -0.356 34.5 162.7 -71.9 152.5 62.5 31.3 -1.8 60 60 A F E -G 199 0C 14 139,-2.1 139,-3.0 137,-0.1 2,-0.3 -0.960 46.9 -82.2-161.3 159.1 63.3 27.8 -0.6 61 61 A T E -G 198 0C 5 -2,-0.3 203,-0.3 137,-0.2 201,-0.3 -0.563 31.5-145.3 -73.2 129.9 61.5 24.5 -0.6 62 62 A I > + 0 0 3 135,-2.5 3,-2.4 -2,-0.3 4,-0.2 0.671 33.0 172.8 -68.7 -20.2 58.9 24.2 2.2 63 63 A Q G > - 0 0 0 132,-2.3 3,-2.5 1,-0.3 4,-0.2 -0.068 68.5 -1.2 44.8-139.7 59.6 20.5 2.7 64 64 A S G > S+ 0 0 0 1,-0.3 3,-1.5 2,-0.2 -1,-0.3 0.584 118.8 80.0 -56.2 -11.1 57.7 19.0 5.7 65 65 A A G < S+ 0 0 0 -3,-2.4 -1,-0.3 1,-0.3 4,-0.3 0.564 83.2 67.6 -73.2 -4.0 56.3 22.5 6.5 66 66 A S G X> S+ 0 0 0 -3,-2.5 4,-2.0 -4,-0.2 3,-0.6 0.669 79.3 83.5 -84.3 -19.4 53.9 21.5 3.8 67 67 A K H <> S+ 0 0 2 -3,-1.5 4,-1.9 1,-0.2 5,-0.2 0.867 83.7 52.3 -55.3 -46.7 52.4 18.8 6.0 68 68 A P H 3> S+ 0 0 0 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.842 113.3 46.3 -63.7 -26.7 49.9 20.9 8.0 69 69 A F H <> S+ 0 0 0 -3,-0.6 4,-2.5 -4,-0.3 -2,-0.2 0.876 110.4 47.9 -82.8 -40.3 48.4 22.4 4.8 70 70 A T H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.880 112.1 54.4 -66.2 -33.8 48.0 19.2 2.7 71 71 A Y H X S+ 0 0 0 -4,-1.9 4,-1.7 -5,-0.3 -1,-0.2 0.863 107.1 49.3 -65.6 -38.7 46.4 17.7 5.9 72 72 A A H X S+ 0 0 0 -4,-1.0 4,-2.4 -5,-0.2 3,-0.3 0.965 109.4 51.8 -65.5 -49.9 44.0 20.6 6.0 73 73 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.867 107.8 52.9 -53.4 -40.6 43.1 20.1 2.3 74 74 A A H X S+ 0 0 0 -4,-2.1 4,-3.3 2,-0.2 5,-0.5 0.906 108.7 48.8 -63.6 -42.2 42.4 16.4 2.9 75 75 A L H X S+ 0 0 5 -4,-1.7 4,-1.9 -3,-0.3 -2,-0.2 0.895 113.9 47.0 -64.8 -40.3 40.0 17.2 5.8 76 76 A V H < S+ 0 0 67 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.924 119.8 38.9 -67.0 -44.5 38.2 19.7 3.6 77 77 A D H < S+ 0 0 57 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.838 131.9 22.6 -76.7 -34.1 38.0 17.4 0.6 78 78 A R H < S- 0 0 66 -4,-3.3 4,-0.5 -5,-0.2 -3,-0.2 0.673 100.1-122.9-110.0 -19.7 37.3 14.1 2.5 79 79 A G X - 0 0 31 -4,-1.9 4,-1.8 -5,-0.5 5,-0.2 0.078 35.4 -77.1 89.9 154.1 35.8 15.0 5.8 80 80 A F H > S+ 0 0 57 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.863 125.6 52.8 -56.3 -44.0 37.0 14.0 9.3 81 81 A A H > S+ 0 0 60 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.957 109.9 47.8 -58.5 -53.0 35.8 10.4 9.3 82 82 A A H 4 S+ 0 0 19 -4,-0.5 4,-0.4 1,-0.2 -1,-0.2 0.865 119.3 39.2 -56.6 -41.5 37.5 9.5 6.0 83 83 A V H >X S+ 0 0 0 -4,-1.8 4,-2.6 1,-0.2 3,-1.9 0.939 111.5 55.4 -76.5 -47.3 40.8 11.1 7.0 84 84 A D H 3< S+ 0 0 37 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.666 99.7 63.9 -59.9 -17.2 40.8 9.9 10.6 85 85 A R T 3< S+ 0 0 156 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.777 118.4 24.0 -76.7 -25.2 40.4 6.4 9.3 86 86 A Q T <4 S+ 0 0 46 -3,-1.9 2,-0.5 -4,-0.4 -2,-0.2 0.585 122.2 52.5-113.9 -18.1 43.8 6.6 7.6 87 87 A V S < S- 0 0 0 -4,-2.6 -1,-0.2 20,-0.2 22,-0.1 -0.957 73.6-151.2-127.0 113.9 45.6 9.2 9.6 88 88 A G - 0 0 3 20,-2.1 23,-0.4 -2,-0.5 -3,-0.1 -0.060 15.8-137.8 -74.3 178.2 45.8 8.9 13.4 89 89 A L + 0 0 25 21,-0.2 21,-0.2 -5,-0.1 611,-0.1 0.184 59.4 127.2-120.3 10.5 46.1 11.7 16.0 90 90 A N - 0 0 87 19,-1.5 2,-0.1 18,-0.2 -2,-0.1 -0.574 63.3-119.8 -75.3 123.2 48.7 9.9 18.2 91 91 A P + 0 0 21 0, 0.0 2,-0.3 0, 0.0 149,-0.1 -0.402 49.0 149.2 -66.3 134.5 51.8 12.0 18.9 92 92 A S - 0 0 20 -2,-0.1 151,-0.2 0, 0.0 152,-0.1 -0.991 42.5-115.6-159.9 160.1 55.1 10.5 17.7 93 93 A G - 0 0 13 -2,-0.3 20,-0.1 2,-0.1 148,-0.0 -0.288 47.4 -93.9 -87.4-178.8 58.5 11.3 16.3 94 94 A E S S+ 0 0 54 -2,-0.1 21,-0.2 19,-0.1 -1,-0.0 0.776 89.6 110.6 -71.1 -28.9 59.7 10.3 12.8 95 95 A A - 0 0 88 1,-0.1 2,-0.4 18,-0.0 -2,-0.1 -0.256 67.7-134.3 -49.6 126.9 61.2 7.0 13.8 96 96 A F + 0 0 65 12,-0.0 2,-0.4 3,-0.0 -1,-0.1 -0.772 26.2 179.7 -98.5 130.7 58.9 4.3 12.3 97 97 A N > - 0 0 95 -2,-0.4 3,-1.9 1,-0.1 4,-0.3 -0.983 26.6-142.8-128.3 117.9 57.6 1.2 14.1 98 98 A E G >> S+ 0 0 82 -2,-0.4 3,-1.8 1,-0.3 4,-0.7 0.725 95.0 76.8 -49.7 -25.6 55.3 -1.2 12.2 99 99 A L G >4 S+ 0 0 104 1,-0.3 3,-1.5 2,-0.2 4,-0.5 0.883 80.0 67.0 -55.5 -41.0 53.4 -1.7 15.5 100 100 A S G <4 S+ 0 0 27 -3,-1.9 7,-0.7 1,-0.3 -1,-0.3 0.721 105.3 44.9 -53.6 -21.2 51.7 1.7 15.1 101 101 A L G <4 S+ 0 0 0 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.603 97.1 71.8 -97.8 -16.2 49.9 0.1 12.1 102 102 A E S << S+ 0 0 111 -3,-1.5 -2,-0.2 -4,-0.7 -1,-0.2 0.483 77.0 110.7 -77.9 -2.7 49.1 -3.2 13.8 103 103 A A S S- 0 0 43 -4,-0.5 3,-0.1 -3,-0.2 -3,-0.0 -0.113 89.9 -97.8 -65.2 171.4 46.5 -1.4 15.8 104 104 A E S S+ 0 0 194 1,-0.2 -1,-0.1 2,-0.1 -3,-0.0 0.777 123.3 45.3 -63.5 -29.1 42.8 -1.9 15.3 105 105 A S S S- 0 0 41 2,-0.1 -1,-0.2 -19,-0.0 -4,-0.1 0.775 97.5-140.4 -87.3 -27.5 42.4 1.1 13.1 106 106 A H + 0 0 80 1,-0.2 -5,-0.2 -6,-0.1 -4,-0.1 0.999 50.0 124.4 65.3 77.2 45.5 0.5 10.9 107 107 A R - 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0 0 12 -4,-0.2 3,-0.8 1,-0.1 -1,-0.4 -0.973 58.8 -74.9-177.1 178.5 38.9 12.0 -3.6 127 127 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.858 129.1 33.2 -60.7 -34.8 38.8 8.2 -3.8 128 128 A E T 3 S+ 0 0 173 -3,-0.1 0, 0.0 2,-0.0 0, 0.0 0.294 84.2 134.1-108.2 10.1 39.4 8.3 -7.6 129 129 A A < - 0 0 11 -3,-0.8 2,-0.2 -6,-0.1 -5,-0.0 -0.133 51.2-121.8 -58.3 157.4 41.6 11.3 -8.1 130 130 A S > - 0 0 54 1,-0.1 4,-2.1 -5,-0.0 5,-0.2 -0.519 25.0-102.2 -96.4 168.1 44.6 11.0 -10.4 131 131 A R H > S+ 0 0 163 1,-0.2 4,-2.4 2,-0.2 3,-0.2 0.946 122.6 46.1 -52.0 -56.7 48.3 11.7 -9.5 132 132 A K H > S+ 0 0 128 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.821 109.5 56.4 -58.3 -35.2 48.3 15.1 -11.2 133 133 A E H > S+ 0 0 97 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.916 109.4 44.5 -65.2 -43.9 45.0 16.1 -9.5 134 134 A R H X S+ 0 0 4 -4,-2.1 4,-2.5 -3,-0.2 -2,-0.2 0.940 113.8 48.9 -67.5 -46.7 46.4 15.4 -6.0 135 135 A L H X S+ 0 0 31 -4,-2.4 4,-2.6 1,-0.2 5,-0.3 0.958 111.9 50.2 -56.8 -49.1 49.7 17.2 -6.7 136 136 A D H X S+ 0 0 76 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.885 109.7 52.0 -55.4 -39.7 47.7 20.1 -8.1 137 137 A R H X S+ 0 0 28 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.900 108.6 49.2 -65.4 -40.8 45.6 20.1 -5.0 138 138 A A H X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.950 113.0 46.6 -62.7 -49.7 48.6 20.2 -2.7 139 139 A V H X S+ 0 0 28 -4,-2.6 4,-1.8 1,-0.2 11,-0.4 0.846 113.4 52.9 -60.9 -33.8 50.1 23.1 -4.6 140 140 A E H X S+ 0 0 89 -4,-2.0 4,-3.4 -5,-0.3 5,-0.2 0.967 103.9 50.3 -68.4 -55.5 46.7 24.8 -4.5 141 141 A I H X S+ 0 0 4 -4,-2.7 4,-1.6 1,-0.2 5,-0.2 0.909 114.9 46.5 -50.9 -43.9 45.9 24.7 -0.8 142 142 A M H X S+ 0 0 0 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.2 0.897 113.3 48.6 -66.0 -40.3 49.3 26.2 -0.1 143 143 A S H X>S+ 0 0 13 -4,-1.8 4,-2.1 -5,-0.2 5,-1.3 0.906 106.9 56.2 -66.6 -42.2 48.9 28.8 -2.8 144 144 A L H <5S+ 0 0 81 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.896 113.0 40.4 -58.4 -40.9 45.4 29.8 -1.6 145 145 A L H <5S+ 0 0 1 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.810 114.2 51.7 -80.1 -29.3 46.7 30.6 1.9 146 146 A A H <5S- 0 0 0 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.792 108.7-125.9 -75.6 -26.4 49.9 32.2 0.8 147 147 A G T <5S+ 0 0 19 -4,-2.1 2,-0.3 1,-0.2 -3,-0.2 0.614 77.8 67.9 91.5 14.0 47.9 34.5 -1.5 148 148 A R S > - 0 0 45 43,-3.8 4,-1.8 -2,-0.4 3,-0.9 -0.661 24.2-174.1 -82.7 91.2 61.3 23.5 -7.6 154 154 A W H 3> S+ 0 0 130 -2,-1.6 4,-2.6 1,-0.3 5,-0.3 0.748 77.7 65.3 -59.5 -26.4 61.8 20.5 -9.8 155 155 A E H 3> S+ 0 0 137 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.919 108.4 41.4 -62.5 -40.5 65.6 20.6 -9.5 156 156 A T H <> S+ 0 0 6 -3,-0.9 4,-2.2 2,-0.2 -2,-0.2 0.870 111.8 56.9 -71.5 -39.8 65.1 19.8 -5.8 157 157 A Y H X S+ 0 0 35 -4,-1.8 4,-2.8 2,-0.2 3,-0.3 0.982 109.1 44.2 -53.6 -64.1 62.3 17.2 -6.7 158 158 A E H X S+ 0 0 117 -4,-2.6 4,-1.3 1,-0.2 -2,-0.2 0.924 110.7 54.5 -46.7 -56.4 64.6 15.2 -9.0 159 159 A S H < S+ 0 0 22 -4,-1.7 3,-0.3 -5,-0.3 -1,-0.2 0.886 115.7 38.6 -47.9 -47.4 67.5 15.3 -6.6 160 160 A E H >< S+ 0 0 2 -4,-2.2 3,-1.5 -3,-0.3 -1,-0.2 0.814 106.7 62.9 -76.7 -32.3 65.4 13.9 -3.8 161 161 A M H >< S+ 0 0 45 -4,-2.8 3,-0.6 1,-0.3 -1,-0.2 0.742 97.7 60.8 -65.2 -19.5 63.4 11.4 -5.9 162 162 A A T 3< S+ 0 0 82 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.642 113.4 35.0 -80.3 -15.8 66.8 9.7 -6.6 163 163 A V T < S+ 0 0 75 -3,-1.5 -1,-0.2 -4,-0.2 3,-0.2 -0.370 78.2 117.9-134.9 55.1 67.3 9.0 -2.9 164 164 A S <> + 0 0 5 -3,-0.6 4,-2.7 1,-0.2 5,-0.3 -0.001 26.4 124.9-110.2 28.2 63.8 8.3 -1.5 165 165 A D H > S+ 0 0 132 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.892 74.6 52.5 -55.0 -40.4 64.3 4.7 -0.4 166 166 A R H > S+ 0 0 114 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.954 113.2 40.5 -63.2 -50.1 63.1 5.6 3.2 167 167 A N H > S+ 0 0 6 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.844 112.9 56.3 -67.2 -31.1 59.9 7.2 2.1 168 168 A L H X S+ 0 0 45 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.857 105.9 53.1 -65.0 -33.9 59.4 4.5 -0.4 169 169 A S H X S+ 0 0 70 -4,-1.8 4,-2.3 -5,-0.3 -2,-0.2 0.923 110.2 45.1 -66.6 -45.8 59.7 2.0 2.5 170 170 A L H X S+ 0 0 5 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.934 112.3 52.1 -64.6 -45.1 57.0 3.8 4.5 171 171 A A H X S+ 0 0 0 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.910 111.1 47.6 -57.6 -43.0 54.7 4.0 1.4 172 172 A H H X S+ 0 0 112 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.914 112.1 48.6 -65.3 -43.6 55.1 0.3 0.8 173 173 A M H X S+ 0 0 51 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.888 110.4 52.2 -64.2 -38.8 54.4 -0.6 4.4 174 174 A L H <>S+ 0 0 0 -4,-2.7 5,-2.9 1,-0.2 6,-0.9 0.848 107.9 51.4 -66.6 -33.6 51.4 1.6 4.4 175 175 A R H ><5S+ 0 0 111 -4,-1.7 3,-2.5 4,-0.2 -1,-0.2 0.923 102.4 60.8 -66.0 -44.1 50.1 -0.1 1.3 176 176 A S H 3<5S+ 0 0 92 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.783 110.1 41.8 -51.9 -31.9 50.6 -3.5 3.0 177 177 A Y T 3<5S- 0 0 49 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.199 119.8-106.1-103.9 14.8 48.1 -2.4 5.7 178 178 A G T < 5S+ 0 0 42 -3,-2.5 -3,-0.2 2,-0.2 -2,-0.1 0.641 88.3 116.8 73.2 15.7 45.6 -0.8 3.3 179 179 A V S - 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