==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-MAY-08 3D2Y . COMPND 2 MOLECULE: N-ACETYLMURAMOYL-L-ALANINE AMIDASE AMID; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR F.KERFF,S.PETRELLA,R.HERMAN,E.SAUVAGE,F.MERCIER,A.LUXEN,J.M. . 260 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14518.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 163 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 15 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 7.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 . 20 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 26.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 1 0 1 0 2 0 0 1 0 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 0 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 PARALLEL BRIDGES PER LADDER . 1 3 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 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 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 5 A E > 0 0 174 0, 0.0 3,-1.5 0, 0.0 2,-1.4 0.000 360.0 360.0 360.0-176.6 46.9 15.1 59.9 2 6 A K T 3 - 0 0 177 1,-0.3 13,-0.1 11,-0.0 3,-0.1 -0.414 360.0 -23.0 -67.9 88.9 47.3 18.5 58.2 3 7 A G T 3 S+ 0 0 26 -2,-1.4 11,-4.0 1,-0.3 12,-0.5 0.656 111.6 124.8 80.6 19.4 44.4 20.4 59.9 4 8 A I E < -A 13 0A 23 -3,-1.5 2,-0.4 9,-0.2 -1,-0.3 -0.944 41.1-165.2-115.2 132.4 42.5 17.2 60.7 5 9 A V E -A 12 0A 61 7,-3.5 7,-3.5 -2,-0.4 2,-0.3 -0.957 12.2-138.8-119.0 131.6 41.3 16.3 64.3 6 10 A E E +A 11 0A 136 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.644 25.9 166.0 -93.4 145.5 40.1 12.7 65.4 7 11 A K - 0 0 102 3,-1.4 2,-0.9 -2,-0.3 3,-0.5 -0.935 48.6 -82.6-144.0 164.8 37.1 12.0 67.7 8 12 A E S S+ 0 0 200 -2,-0.3 3,-0.0 1,-0.2 -2,-0.0 -0.672 119.4 5.8 -69.5 107.3 34.9 9.1 68.8 9 13 A G S S+ 0 0 82 -2,-0.9 2,-0.3 1,-0.0 -1,-0.2 0.121 129.7 22.9 113.0 -20.9 32.4 9.0 65.9 10 14 A Y - 0 0 126 -3,-0.5 -3,-1.4 2,-0.0 2,-0.3 -0.976 64.8-118.3-168.1 162.2 33.7 11.6 63.4 11 15 A Q E -A 6 0A 109 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.887 23.4-142.0-110.0 144.9 36.8 13.5 62.1 12 16 A L E -A 5 0A 71 -7,-3.5 -7,-3.5 -2,-0.3 2,-0.6 -0.938 4.3-156.4-109.2 137.4 37.0 17.4 62.1 13 17 A D E +A 4 0A 101 -2,-0.4 3,-0.3 -9,-0.2 -9,-0.2 -0.954 16.1 173.0-109.4 112.2 38.6 19.2 59.3 14 18 A T + 0 0 74 -11,-4.0 -10,-0.2 -2,-0.6 -11,-0.1 0.248 46.7 107.3-104.5 11.0 39.9 22.6 60.5 15 19 A R S S+ 0 0 116 -12,-0.5 2,-0.7 -13,-0.1 -1,-0.2 0.785 70.4 61.0 -65.0 -32.5 41.7 23.7 57.3 16 20 A R S S- 0 0 218 -3,-0.3 2,-0.4 -13,-0.1 -1,-0.1 -0.889 72.0-165.8-101.3 112.1 39.1 26.3 56.3 17 21 A Q - 0 0 166 -2,-0.7 2,-0.2 4,-0.0 4,-0.1 -0.834 18.3-125.4 -98.7 130.6 38.7 29.1 58.9 18 22 A A - 0 0 75 -2,-0.4 3,-0.0 1,-0.1 -1,-0.0 -0.479 4.1-141.0 -72.3 142.9 35.8 31.6 58.7 19 23 A Q S S+ 0 0 198 1,-0.2 2,-1.4 -2,-0.2 -1,-0.1 0.812 93.8 71.6 -65.9 -35.9 36.3 35.3 58.6 20 24 A A + 0 0 78 2,-0.0 2,-0.3 -3,-0.0 -1,-0.2 -0.655 65.5 122.4 -90.5 81.9 33.4 35.9 60.8 21 25 A A + 0 0 73 -2,-1.4 -4,-0.0 -4,-0.1 0, 0.0 -0.952 30.7 164.0-144.5 126.1 34.7 34.6 64.2 22 26 A Y - 0 0 184 -2,-0.3 115,-0.0 1,-0.0 -2,-0.0 -0.943 40.7 -82.3-145.1 151.4 34.8 36.9 67.2 23 27 A P - 0 0 56 0, 0.0 114,-0.0 0, 0.0 -1,-0.0 -0.175 20.6-143.2 -53.2 149.2 35.1 36.6 71.0 24 28 A R S S+ 0 0 212 2,-0.0 2,-0.5 72,-0.0 113,-0.0 0.684 87.5 80.5 -80.3 -19.8 32.2 35.7 73.2 25 29 A I + 0 0 21 1,-0.1 71,-0.2 71,-0.0 70,-0.1 -0.789 45.0 146.8 -90.7 124.7 33.6 38.2 75.8 26 30 A K + 0 0 111 69,-2.7 114,-0.4 -2,-0.5 2,-0.4 0.488 52.7 62.9-129.6 -13.7 32.8 41.8 75.0 27 31 A V E -b 96 0B 6 68,-1.8 70,-2.4 65,-0.1 2,-0.5 -0.939 52.1-160.8-132.1 136.3 32.4 43.5 78.4 28 32 A L E -bc 97 144B 0 115,-2.7 117,-2.7 -2,-0.4 2,-0.5 -0.978 18.2-162.1-115.6 115.3 34.6 44.3 81.4 29 33 A V E -bc 98 145B 0 68,-2.8 70,-2.6 -2,-0.5 2,-0.4 -0.856 4.5-151.0-103.5 126.3 32.6 45.0 84.5 30 34 A I E +bc 99 146B 2 115,-3.1 117,-1.7 -2,-0.5 2,-0.3 -0.805 22.2 171.1 -97.9 132.0 34.2 46.8 87.6 31 35 A H E -b 100 0B 0 68,-2.5 70,-1.7 -2,-0.4 2,-0.3 -0.880 26.7-138.8-125.9 160.1 32.8 46.1 91.1 32 36 A Y E -b 101 0B 19 -2,-0.3 70,-0.2 68,-0.2 125,-0.1 -0.897 14.7-140.7-110.5 162.0 33.7 46.8 94.8 33 37 A T - 0 0 20 68,-2.0 69,-0.1 -2,-0.3 71,-0.1 0.755 14.9-146.8 -87.7 -26.8 33.3 44.1 97.4 34 38 A A S S+ 0 0 58 69,-2.1 2,-0.3 67,-0.4 70,-0.2 0.852 74.5 68.8 49.7 41.8 31.9 46.2 100.3 35 39 A D S S- 0 0 65 68,-0.5 68,-0.3 70,-0.0 -2,-0.2 -0.961 91.3 -79.1-174.3 164.8 33.8 43.9 102.6 36 40 A D > - 0 0 79 -2,-0.3 4,-2.6 66,-0.1 5,-0.3 -0.172 49.7 -99.3 -75.9 169.5 37.3 42.8 103.7 37 41 A F H > S+ 0 0 33 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.929 118.0 43.2 -60.0 -54.8 39.5 40.5 101.7 38 42 A D H > S+ 0 0 122 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.934 117.3 48.1 -59.7 -44.6 39.0 37.2 103.5 39 43 A S H > S+ 0 0 43 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.889 112.8 47.5 -61.8 -41.2 35.2 37.8 103.8 40 44 A S H X S+ 0 0 4 -4,-2.6 4,-3.2 2,-0.2 -1,-0.2 0.913 111.0 51.9 -67.8 -41.7 34.9 38.8 100.1 41 45 A L H X S+ 0 0 42 -4,-3.0 4,-0.6 -5,-0.3 -2,-0.2 0.944 110.3 49.1 -61.4 -43.5 37.0 35.7 99.1 42 46 A A H >< S+ 0 0 56 -4,-2.4 3,-1.0 -5,-0.2 -2,-0.2 0.951 115.1 44.2 -54.9 -50.3 34.7 33.5 101.1 43 47 A T H >< S+ 0 0 69 -4,-2.3 3,-1.6 1,-0.3 6,-0.6 0.917 110.5 52.9 -67.6 -44.9 31.6 35.0 99.5 44 48 A L H 3< S+ 0 0 5 -4,-3.2 7,-0.5 1,-0.3 -1,-0.3 0.462 110.3 48.7 -74.3 -2.5 32.9 35.0 95.9 45 49 A T T << S+ 0 0 89 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.256 97.8 90.9-113.7 8.0 33.7 31.3 96.2 46 50 A D S < S- 0 0 108 -3,-1.6 -3,-0.1 3,-0.4 -4,-0.0 -0.014 93.9 -90.9 -91.2-162.1 30.3 30.3 97.6 47 51 A K S S+ 0 0 168 1,-0.1 3,-0.1 -2,-0.0 -3,-0.1 0.407 111.3 52.7-104.4 8.2 27.2 29.3 95.7 48 52 A Q S S+ 0 0 145 -5,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.765 113.1 8.8-107.8 -39.4 25.4 32.7 95.2 49 53 A V + 0 0 19 -6,-0.6 -3,-0.4 213,-0.1 -1,-0.3 -0.974 56.5 166.9-143.7 154.8 27.9 35.0 93.6 50 54 A S - 0 0 20 29,-1.5 2,-0.3 -2,-0.3 -5,-0.1 -0.962 13.5-156.3-150.4 171.9 31.4 35.0 92.0 51 55 A S - 0 0 0 -7,-0.5 20,-0.3 -2,-0.3 48,-0.1 -0.968 27.6-122.5-143.7 163.9 33.8 37.1 89.9 52 56 A H S S+ 0 0 0 46,-1.1 19,-2.3 -2,-0.3 20,-0.9 0.900 95.4 25.4 -73.1 -39.1 36.8 36.3 87.7 53 57 A Y E -De 70 99B 16 45,-1.8 47,-3.0 17,-0.2 2,-0.4 -0.934 57.4-165.4-129.7 146.5 39.2 38.4 89.6 54 58 A L E -De 69 100B 0 15,-2.6 15,-2.5 -2,-0.3 47,-0.2 -0.970 11.6-164.8-127.1 116.7 39.5 39.8 93.2 55 59 A V E - e 0 101B 0 45,-3.2 47,-2.7 -2,-0.4 13,-0.1 -0.898 17.4-133.2-103.3 117.9 42.0 42.6 93.7 56 60 A P - 0 0 8 0, 0.0 -20,-0.0 0, 0.0 47,-0.0 -0.221 25.9-109.8 -61.1 164.1 43.0 43.4 97.4 57 61 A A S S+ 0 0 16 1,-0.3 65,-0.7 44,-0.1 66,-0.1 0.870 116.4 13.6 -59.9 -42.4 42.9 47.0 98.6 58 62 A V S S- 0 0 94 63,-0.2 -1,-0.3 64,-0.1 64,-0.0 -0.847 94.0-142.4-133.6 96.9 46.7 46.8 98.7 59 63 A P - 0 0 7 0, 0.0 2,-0.1 0, 0.0 9,-0.1 -0.333 19.0-115.7 -62.4 137.4 47.8 43.7 96.9 60 64 A P - 0 0 50 0, 0.0 7,-2.6 0, 0.0 2,-0.4 -0.442 33.4-128.4 -65.3 151.8 50.8 41.9 98.4 61 65 A R E +F 66 0C 172 5,-0.2 2,-0.3 -2,-0.1 3,-0.0 -0.909 29.9 171.3-116.0 136.3 53.9 41.8 96.1 62 66 A Y E > S+F 65 0C 119 3,-2.3 3,-2.3 -2,-0.4 0, 0.0 -0.985 75.8 5.9-135.6 141.4 56.0 38.9 95.0 63 67 A N T 3 S- 0 0 145 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.824 132.9 -62.2 51.7 30.2 58.7 39.0 92.3 64 68 A G T 3 S+ 0 0 61 1,-0.2 -1,-0.3 -3,-0.0 -3,-0.0 0.602 116.4 108.1 75.8 14.6 58.2 42.8 92.3 65 69 A K E < S-F 62 0C 130 -3,-2.3 -3,-2.3 0, 0.0 -1,-0.2 -0.956 73.4-110.7-129.2 141.3 54.5 42.4 91.1 66 70 A P E -F 61 0C 43 0, 0.0 2,-0.5 0, 0.0 -5,-0.2 -0.454 33.8-130.9 -68.9 139.9 51.1 42.8 92.8 67 71 A R - 0 0 114 -7,-2.6 2,-0.3 -2,-0.1 58,-0.1 -0.827 24.5-173.7 -96.3 129.3 49.3 39.5 93.4 68 72 A I - 0 0 44 -2,-0.5 2,-0.4 -13,-0.1 -13,-0.2 -0.930 22.7-122.5-120.0 145.1 45.6 39.4 92.2 69 73 A W E -D 54 0B 76 -15,-2.5 -15,-2.6 -2,-0.3 2,-0.5 -0.745 17.1-160.0 -93.9 128.4 43.3 36.4 92.9 70 74 A Q E +D 53 0B 104 -2,-0.4 -17,-0.2 -17,-0.2 -18,-0.1 -0.968 16.2 170.0-107.8 124.2 41.6 34.6 89.9 71 75 A L + 0 0 42 -19,-2.3 -19,-0.2 -2,-0.5 -18,-0.1 0.621 62.7 33.7-106.9 -21.4 38.5 32.7 90.9 72 76 A V S S- 0 0 18 -20,-0.9 -1,-0.3 4,-0.1 6,-0.1 -0.996 84.3-109.5-145.6 126.9 36.9 31.7 87.6 73 77 A P > - 0 0 56 0, 0.0 3,-1.8 0, 0.0 -2,-0.0 -0.374 30.2-126.4 -56.6 140.6 38.5 30.8 84.2 74 78 A E T 3 S+ 0 0 20 1,-0.3 4,-0.1 -22,-0.1 -22,-0.1 0.751 108.2 66.8 -64.9 -26.6 37.7 33.6 81.8 75 79 A Q T 3 S+ 0 0 165 2,-0.1 -1,-0.3 -50,-0.0 2,-0.3 0.695 100.2 62.2 -64.2 -23.2 36.3 31.0 79.4 76 80 A E S < S- 0 0 113 -3,-1.8 2,-0.2 1,-0.0 -4,-0.1 -0.725 90.3-111.5-104.4 152.2 33.5 30.5 81.9 77 81 A L - 0 0 80 -2,-0.3 2,-0.3 20,-0.1 17,-0.1 -0.605 24.6-150.3 -80.3 147.5 30.9 33.0 83.2 78 82 A A - 0 0 0 15,-0.4 2,-1.2 18,-0.3 3,-0.4 -0.779 25.1-114.2-109.7 155.7 31.0 34.2 86.8 79 83 A W S S+ 0 0 105 -2,-0.3 -29,-1.5 1,-0.2 -2,-0.0 -0.618 80.3 109.4 -91.5 69.6 27.9 35.2 88.8 80 84 A H + 0 0 0 -2,-1.2 180,-2.6 -31,-0.2 -1,-0.2 0.675 67.6 46.9-115.3 -34.3 28.8 39.0 89.1 81 85 A A S S- 0 0 0 -3,-0.4 -2,-0.1 179,-0.2 11,-0.1 0.816 75.2-179.8 -84.1 -37.0 26.5 41.1 87.0 82 86 A G + 0 0 3 178,-0.1 10,-0.4 2,-0.1 11,-0.4 -0.259 61.5 4.4 64.0-154.3 23.1 39.7 87.9 83 87 A I S S+ 0 0 135 177,-0.4 2,-0.3 8,-0.1 71,-0.1 -0.542 97.0 152.2 -61.7 121.2 19.9 41.1 86.2 84 88 A S - 0 0 8 -2,-0.3 7,-0.9 67,-0.1 2,-0.3 -0.960 37.4-162.2-159.4 159.4 21.6 43.5 83.8 85 89 A A E +G 90 0D 12 65,-2.3 124,-0.4 -2,-0.3 2,-0.3 -0.960 12.5 167.6-154.8 130.5 21.5 45.4 80.5 86 90 A W E > -G 89 0D 7 3,-1.6 3,-2.3 -2,-0.3 122,-0.2 -0.882 68.8 -26.0-150.7 119.2 24.2 47.2 78.4 87 91 A R T 3 S- 0 0 30 120,-1.3 121,-0.1 -2,-0.3 3,-0.1 0.823 129.2 -38.0 55.1 40.5 24.0 48.5 74.9 88 92 A G T 3 S+ 0 0 86 119,-0.3 -1,-0.3 1,-0.3 2,-0.2 0.126 118.4 105.1 102.0 -22.8 21.3 46.2 73.7 89 93 A A E < -G 86 0D 40 -3,-2.3 -3,-1.6 118,-0.1 -1,-0.3 -0.520 44.8-171.2 -92.5 156.5 22.5 43.0 75.6 90 94 A T E +G 85 0D 93 -5,-0.2 -5,-0.2 1,-0.2 4,-0.1 -0.786 64.3 48.1-128.5-179.6 21.0 41.5 78.8 91 95 A R > - 0 0 178 -7,-0.9 3,-2.3 -2,-0.2 4,-0.4 0.951 66.0-172.5 52.5 55.3 22.4 38.6 81.1 92 96 A L G >> S+ 0 0 0 -10,-0.4 3,-0.8 1,-0.3 4,-0.8 0.708 72.4 75.2 -58.4 -18.7 25.8 40.4 81.2 93 97 A N G >4 S+ 0 0 5 -11,-0.4 3,-0.7 1,-0.2 -15,-0.4 0.868 90.4 60.9 -53.3 -38.5 27.3 37.4 83.0 94 98 A D G <4 S+ 0 0 86 -3,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.802 117.9 23.3 -63.1 -39.0 27.2 35.6 79.6 95 99 A T G <4 S+ 0 0 31 -3,-0.8 -69,-2.7 -4,-0.4 -68,-1.8 0.192 109.6 80.5-117.4 14.7 29.5 38.1 77.8 96 100 A S E << -b 27 0B 4 -4,-0.8 2,-0.4 -3,-0.7 -18,-0.3 -0.831 60.0-138.2-126.2 160.1 31.5 39.8 80.5 97 101 A I E -b 28 0B 0 -70,-2.4 -68,-2.8 -2,-0.3 2,-0.5 -0.932 27.7-147.6-104.2 139.4 34.5 39.5 82.7 98 102 A G E -b 29 0B 0 -2,-0.4 -45,-1.8 -70,-0.2 -46,-1.1 -0.939 11.0-168.1-115.7 126.7 34.0 40.7 86.3 99 103 A I E -be 30 53B 0 -70,-2.6 -68,-2.5 -2,-0.5 2,-0.5 -0.982 7.5-157.3-112.4 123.2 36.7 42.3 88.4 100 104 A E E -be 31 54B 4 -47,-3.0 -45,-3.2 -2,-0.5 2,-0.5 -0.859 3.7-158.8-102.7 131.7 36.0 42.8 92.1 101 105 A L E -be 32 55B 0 -70,-1.7 -68,-2.0 -2,-0.5 2,-0.6 -0.935 23.2-122.5-111.2 121.0 38.0 45.4 94.0 102 106 A E + 0 0 41 -47,-2.7 2,-0.3 -2,-0.5 -66,-0.1 -0.531 60.4 133.4 -65.6 113.5 38.3 45.2 97.8 103 107 A N - 0 0 13 -2,-0.6 -69,-2.1 -68,-0.3 -68,-0.5 -0.939 62.2-122.4-164.3 144.8 36.8 48.5 98.9 104 108 A R - 0 0 133 -2,-0.3 2,-0.2 1,-0.2 -68,-0.1 0.621 39.8-158.7 -70.6 -14.6 34.3 49.4 101.6 105 109 A G - 0 0 0 11,-0.2 11,-0.8 53,-0.1 2,-0.3 -0.490 47.7 -13.9 67.3-140.5 31.8 51.2 99.2 106 110 A W E -H 115 0E 93 9,-0.2 2,-0.4 -2,-0.2 9,-0.2 -0.682 50.8-174.7 -98.8 149.0 29.4 53.6 100.8 107 111 A Q E -H 114 0E 119 7,-2.3 7,-2.4 -2,-0.3 2,-0.5 -0.984 29.9-122.4-138.6 130.6 28.4 54.2 104.5 108 112 A K E -H 113 0E 136 -2,-0.4 2,-0.5 5,-0.2 5,-0.3 -0.647 31.7-179.2 -78.4 119.6 25.7 56.6 105.5 109 113 A S E > S-H 112 0E 70 3,-2.5 3,-0.8 -2,-0.5 -2,-0.0 -0.910 75.2 -18.9-129.2 98.8 27.2 59.2 107.8 110 114 A A T 3 S- 0 0 102 -2,-0.5 2,-0.8 1,-0.2 -1,-0.2 0.937 126.7 -56.0 59.4 52.1 24.7 61.8 109.1 111 115 A G T 3 S+ 0 0 71 1,-0.2 2,-0.7 -3,-0.1 -1,-0.2 -0.036 116.3 117.0 75.8 -34.1 22.4 60.8 106.2 112 116 A V E < -H 109 0E 79 -2,-0.8 -3,-2.5 -3,-0.8 2,-0.6 -0.568 66.7-137.1 -71.7 106.9 25.2 61.6 103.7 113 117 A K E -H 108 0E 65 -2,-0.7 2,-0.4 -5,-0.3 -5,-0.2 -0.566 27.5-165.8 -60.7 111.0 26.1 58.4 101.8 114 118 A Y E -H 107 0E 141 -7,-2.4 -7,-2.3 -2,-0.6 2,-0.2 -0.920 5.0-148.5-109.9 131.9 29.9 58.7 101.9 115 119 A F E -H 106 0E 22 -2,-0.4 -9,-0.2 -9,-0.2 44,-0.0 -0.575 17.5-113.4 -97.4 165.2 32.1 56.5 99.6 116 120 A A - 0 0 2 -11,-0.8 -11,-0.2 -2,-0.2 45,-0.1 -0.810 28.9-116.5-102.3 133.4 35.6 55.2 100.3 117 121 A P - 0 0 90 0, 0.0 2,-0.5 0, 0.0 -13,-0.2 -0.301 30.9-112.4 -63.0 149.9 38.6 56.3 98.3 118 122 A F - 0 0 22 43,-0.5 -15,-0.1 -15,-0.1 5,-0.0 -0.752 29.2-115.1 -86.9 126.2 40.5 53.7 96.2 119 123 A E > - 0 0 88 -2,-0.5 4,-1.7 1,-0.2 3,-0.4 -0.298 18.4-135.0 -51.3 124.5 44.0 52.8 97.3 120 124 A P H > S+ 0 0 99 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.856 104.7 61.9 -55.2 -30.0 46.4 53.9 94.6 121 125 A A H > S+ 0 0 43 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.908 104.2 50.1 -60.4 -40.6 48.2 50.5 94.9 122 126 A Q H > S+ 0 0 0 -65,-0.7 4,-2.6 -3,-0.4 -1,-0.2 0.930 110.5 47.1 -62.8 -48.0 45.0 48.8 93.9 123 127 A I H X S+ 0 0 3 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.929 110.2 54.5 -61.3 -40.9 44.5 51.0 90.8 124 128 A Q H < S+ 0 0 115 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.859 111.3 44.5 -61.8 -36.1 48.1 50.4 89.9 125 129 A A H X S+ 0 0 2 -4,-1.8 4,-0.9 -5,-0.2 -1,-0.2 0.869 111.5 54.8 -71.5 -42.1 47.5 46.6 90.0 126 130 A L H X S+ 0 0 1 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.856 94.8 68.1 -59.1 -42.6 44.2 46.9 88.1 127 131 A I H X S+ 0 0 10 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.915 102.4 40.9 -52.9 -56.6 45.7 48.8 85.1 128 132 A P H > S+ 0 0 66 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.824 116.5 50.8 -64.7 -29.0 47.9 46.0 83.6 129 133 A L H X S+ 0 0 22 -4,-0.9 4,-2.5 2,-0.2 -2,-0.2 0.950 112.5 45.4 -71.8 -48.4 45.2 43.3 84.2 130 134 A A H X S+ 0 0 1 -4,-3.0 4,-3.0 1,-0.2 5,-0.2 0.929 112.7 52.2 -57.7 -44.1 42.5 45.4 82.5 131 135 A K H X S+ 0 0 92 -4,-2.6 4,-2.6 -5,-0.3 -1,-0.2 0.910 110.3 47.7 -59.2 -42.7 44.9 46.2 79.6 132 136 A D H X S+ 0 0 95 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.940 114.0 46.9 -66.4 -43.9 45.6 42.5 79.1 133 137 A I H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 6,-0.2 0.940 112.4 48.9 -62.0 -49.1 41.9 41.6 79.2 134 138 A I H X>S+ 0 0 29 -4,-3.0 5,-1.6 1,-0.2 4,-0.8 0.887 114.6 46.3 -57.9 -43.9 41.0 44.4 76.8 135 139 A A H <5S+ 0 0 66 -4,-2.6 3,-0.4 -5,-0.2 -1,-0.2 0.906 108.3 56.0 -60.5 -46.1 43.8 43.3 74.4 136 140 A R H <5S+ 0 0 123 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.873 124.0 21.9 -58.2 -40.1 42.9 39.7 74.6 137 141 A Y H <5S- 0 0 44 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.311 102.0-118.7-112.0 2.2 39.2 40.2 73.5 138 142 A H T <5 - 0 0 163 -4,-0.8 -3,-0.2 -3,-0.4 2,-0.2 0.919 41.3-167.3 51.5 47.5 39.5 43.5 71.7 139 143 A I < - 0 0 11 -5,-1.6 -1,-0.2 -6,-0.2 -112,-0.1 -0.484 17.3-125.4 -68.4 129.9 37.1 45.0 74.2 140 144 A K > - 0 0 95 -114,-0.4 3,-1.9 -2,-0.2 34,-0.1 -0.519 21.4-113.2 -78.6 149.3 35.9 48.5 73.0 141 145 A P G > S+ 0 0 54 0, 0.0 3,-1.8 0, 0.0 33,-0.9 0.854 114.3 57.4 -53.0 -43.5 36.4 51.4 75.4 142 146 A E G 3 S+ 0 0 8 1,-0.3 112,-0.0 31,-0.2 -3,-0.0 0.642 97.4 65.6 -64.7 -11.3 32.6 52.0 76.0 143 147 A N G < S+ 0 0 11 -3,-1.9 -115,-2.7 -117,-0.1 2,-0.7 0.230 73.6 93.9-100.7 15.7 32.3 48.4 77.2 144 148 A V E < +c 28 0B 2 -3,-1.8 30,-0.4 -117,-0.2 2,-0.3 -0.932 68.7 165.8 -97.4 110.0 34.5 48.9 80.3 145 149 A V E -c 29 0B 1 -117,-2.7 -115,-3.1 -2,-0.7 2,-0.3 -0.809 42.9-111.9-133.7 161.6 31.7 49.6 82.7 146 150 A A E >> -c 30 0B 5 -2,-0.3 4,-0.9 -117,-0.2 3,-0.5 -0.632 32.4-121.9 -80.8 149.5 30.5 50.0 86.2 147 151 A H H >> S+ 0 0 0 -117,-1.7 4,-1.8 10,-0.3 3,-0.7 0.883 117.5 59.2 -55.4 -38.2 28.1 47.4 87.7 148 152 A A H 34 S+ 0 0 2 9,-2.4 -1,-0.2 1,-0.3 7,-0.2 0.836 98.6 59.6 -61.5 -30.2 25.9 50.5 88.3 149 153 A D H <4 S+ 0 0 0 -3,-0.5 60,-0.5 8,-0.3 -1,-0.3 0.846 112.6 36.3 -64.7 -34.2 26.0 51.2 84.6 150 154 A I H << S+ 0 0 0 -4,-0.9 -65,-2.3 -3,-0.7 -2,-0.2 0.615 133.6 25.4-100.9 -14.5 24.5 47.7 83.8 151 155 A A S >X S+ 0 0 7 -4,-1.8 4,-2.2 -67,-0.2 3,-1.8 -0.452 70.5 163.6-139.8 62.3 22.1 47.5 86.8 152 156 A P T 34 S+ 0 0 2 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 0.744 74.6 52.7 -61.2 -25.8 21.4 51.2 87.7 153 157 A Q T 34 S+ 0 0 73 1,-0.1 3,-0.1 69,-0.0 -5,-0.1 0.639 120.4 32.5 -79.4 -17.1 18.3 50.5 89.8 154 158 A R T <4 S+ 0 0 89 -3,-1.8 2,-0.3 1,-0.2 -1,-0.1 0.671 115.2 40.0-111.4 -29.2 20.1 47.9 91.9 155 159 A K < - 0 0 54 -4,-2.2 -1,-0.2 -7,-0.2 -4,-0.1 -0.944 34.7-175.4-135.1 151.5 23.8 48.8 92.3 156 160 A D > + 0 0 12 -2,-0.3 3,-1.4 -3,-0.1 -8,-0.1 0.483 43.6 163.6-111.1 -17.7 26.1 51.8 92.8 157 161 A D T 3 + 0 0 7 1,-0.3 -9,-2.4 -125,-0.1 -10,-0.3 -0.264 59.7 12.7 -68.4 145.8 29.5 50.0 92.5 158 162 A P T 3 S- 0 0 1 0, 0.0 -1,-0.3 0, 0.0 3,-0.3 -0.974 101.7-160.4 -86.2 7.6 32.3 51.0 92.0 159 163 A G X - 0 0 4 -3,-1.4 3,-1.5 1,-0.2 -2,-0.1 0.080 34.5 -54.3 87.7 172.8 30.9 54.4 92.8 160 164 A P T 3 S+ 0 0 10 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.574 125.4 60.0 -73.2 -9.9 31.8 58.1 92.3 161 165 A L T 3 S+ 0 0 81 -3,-0.3 -43,-0.5 -45,-0.1 -2,-0.1 0.528 76.7 111.6 -93.4 -6.6 35.3 57.8 93.9 162 166 A F S < S- 0 0 8 -3,-1.5 2,-2.0 66,-0.1 3,-0.2 -0.535 76.0-126.1 -67.3 125.2 36.4 55.3 91.3 163 167 A P > + 0 0 31 0, 0.0 4,-1.7 0, 0.0 5,-0.2 -0.407 47.3 155.3 -81.9 68.9 39.0 57.0 89.0 164 168 A W H > S+ 0 0 8 -2,-2.0 4,-2.2 1,-0.2 5,-0.1 0.880 73.4 51.8 -58.2 -44.7 37.5 56.4 85.5 165 169 A Q H > S+ 0 0 96 -3,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.912 107.8 52.1 -61.7 -44.9 39.3 59.4 83.9 166 170 A Q H > S+ 0 0 78 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.882 112.2 46.3 -54.1 -42.2 42.7 58.2 85.3 167 171 A L H ><>S+ 0 0 0 -4,-1.7 5,-2.6 1,-0.2 3,-0.9 0.872 107.9 56.5 -70.4 -36.6 42.0 54.8 83.7 168 172 A A H ><5S+ 0 0 23 -4,-2.2 3,-1.5 1,-0.3 -2,-0.2 0.843 101.4 56.7 -65.4 -34.6 40.9 56.4 80.4 169 173 A Q H 3<5S+ 0 0 140 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.700 105.0 53.0 -67.9 -21.1 44.3 58.2 80.2 170 174 A Q T <<5S- 0 0 89 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.234 129.5 -98.9 -92.0 7.8 45.9 54.7 80.4 171 175 A G T < 5S+ 0 0 59 -3,-1.5 2,-0.7 1,-0.2 -3,-0.2 0.644 86.2 128.1 82.6 16.6 43.7 53.5 77.5 172 176 A I < - 0 0 1 -5,-2.6 -1,-0.2 -8,-0.1 -2,-0.2 -0.873 64.6 -19.8-109.9 105.0 41.2 51.8 79.8 173 177 A G S S- 0 0 8 -2,-0.7 -31,-0.2 -5,-0.1 2,-0.2 -0.096 85.7 -52.0 89.2 170.3 37.5 52.8 79.2 174 178 A A + 0 0 2 -33,-0.9 -6,-0.1 -30,-0.4 76,-0.1 -0.476 46.8 167.0 -84.1 140.2 35.5 55.6 77.5 175 179 A W - 0 0 52 -2,-0.2 2,-0.1 -7,-0.1 -33,-0.0 -0.934 33.2-116.1-152.0 139.3 36.0 59.3 78.2 176 180 A P - 0 0 10 0, 0.0 2,-0.5 0, 0.0 74,-0.1 -0.354 33.0-105.4 -71.9 148.3 34.6 62.3 76.2 177 181 A D >> - 0 0 79 72,-0.2 4,-1.8 1,-0.1 3,-0.7 -0.677 28.2-137.0 -73.8 124.9 36.9 64.8 74.5 178 182 A A H 3> S+ 0 0 69 -2,-0.5 4,-2.3 1,-0.3 5,-0.2 0.823 101.7 53.6 -55.5 -40.1 36.8 68.0 76.7 179 183 A Q H 3> S+ 0 0 157 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.853 109.7 49.4 -64.9 -34.1 36.5 70.4 73.7 180 184 A R H <> S+ 0 0 83 -3,-0.7 4,-2.5 2,-0.2 -2,-0.2 0.855 107.2 53.3 -74.3 -32.9 33.5 68.4 72.4 181 185 A V H X S+ 0 0 18 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.949 112.0 47.0 -63.4 -46.3 31.8 68.5 75.9 182 186 A N H X S+ 0 0 102 -4,-2.3 4,-1.0 2,-0.2 5,-0.4 0.856 109.5 54.3 -58.5 -37.0 32.3 72.3 75.8 183 187 A F H >< S+ 0 0 115 -4,-1.7 3,-0.6 1,-0.2 -2,-0.2 0.940 112.0 42.9 -63.7 -46.6 30.9 72.3 72.2 184 188 A Y H 3< S+ 0 0 54 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.700 98.8 71.5 -74.1 -23.0 27.7 70.5 73.3 185 189 A L H >< S- 0 0 17 -4,-1.7 3,-1.8 -5,-0.2 -1,-0.2 0.872 83.6-168.0 -58.3 -35.2 27.4 72.7 76.4 186 190 A A T << - 0 0 77 -4,-1.0 -3,-0.1 -3,-0.6 -2,-0.1 0.824 64.9 -44.4 51.1 44.3 26.5 75.3 73.8 187 191 A G T 3 S+ 0 0 83 -5,-0.4 -1,-0.3 1,-0.3 2,-0.2 0.365 104.2 129.2 90.4 -2.0 26.7 78.3 76.1 188 192 A R < - 0 0 77 -3,-1.8 -1,-0.3 1,-0.1 -3,-0.0 -0.525 65.5-110.0 -85.0 150.5 24.9 76.9 79.1 189 193 A A > - 0 0 60 -2,-0.2 3,-2.3 1,-0.1 52,-0.4 -0.552 40.3-110.4 -64.2 145.3 26.2 76.9 82.7 190 194 A P T 3 S+ 0 0 57 0, 0.0 52,-3.0 0, 0.0 53,-0.4 0.864 116.4 46.0 -51.3 -42.6 27.0 73.3 83.6 191 195 A H T 3 S+ 0 0 110 50,-0.2 3,-0.0 49,-0.2 -2,-0.0 0.221 76.4 135.3 -88.7 13.8 24.1 73.0 86.1 192 196 A T < - 0 0 48 -3,-2.3 49,-1.7 1,-0.1 50,-0.1 -0.498 66.3-108.0 -59.2 124.3 21.5 74.6 83.8 193 197 A P B -I 240 0F 112 0, 0.0 2,-0.3 0, 0.0 47,-0.3 -0.356 39.6-164.7 -60.4 132.2 18.4 72.2 84.1 194 198 A V - 0 0 25 45,-2.1 2,-0.3 -2,-0.1 45,-0.2 -0.821 34.1 -82.4-118.1 157.5 17.7 70.1 81.0 195 199 A D > - 0 0 99 -2,-0.3 4,-1.9 1,-0.1 3,-0.2 -0.408 36.5-146.0 -60.7 119.8 14.6 68.2 79.9 196 200 A T H > S+ 0 0 45 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.920 94.7 53.1 -57.6 -48.7 14.8 64.8 81.7 197 201 A A H > S+ 0 0 67 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.891 108.2 50.6 -55.4 -41.9 13.2 62.8 78.9 198 202 A S H > S+ 0 0 54 -3,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.904 110.9 48.7 -65.1 -44.5 15.7 64.0 76.3 199 203 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.926 108.9 53.6 -60.7 -45.2 18.6 63.1 78.6 200 204 A L H X S+ 0 0 10 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.857 103.5 56.3 -61.1 -35.4 17.2 59.6 79.2 201 205 A E H X S+ 0 0 123 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.956 108.6 47.3 -56.7 -50.0 17.0 59.0 75.5 202 206 A L H X S+ 0 0 32 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.900 113.0 48.3 -59.0 -44.9 20.7 59.7 75.1 203 207 A L H X>S+ 0 0 0 -4,-2.3 5,-2.5 2,-0.2 4,-2.3 0.924 109.5 53.4 -64.4 -40.3 21.6 57.5 78.1 204 208 A A H <5S+ 0 0 15 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.924 111.8 45.0 -54.9 -49.6 19.4 54.7 76.7 205 209 A R H <5S+ 0 0 125 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.820 108.3 55.6 -70.5 -32.2 21.3 54.9 73.4 206 210 A Y H <5S- 0 0 3 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.830 134.3 -87.3 -67.5 -36.0 24.7 55.1 75.1 207 211 A G T <5S+ 0 0 5 -4,-2.3 -120,-1.3 1,-0.2 -119,-0.3 0.317 80.1 135.6 155.5 -2.9 23.7 51.8 76.8 208 212 A Y < - 0 0 5 -5,-2.5 2,-0.6 -122,-0.2 -1,-0.2 -0.316 61.2-108.0 -71.3 148.4 21.7 52.4 80.0 209 213 A D + 0 0 47 -60,-0.5 2,-0.4 -124,-0.4 -1,-0.1 -0.580 48.1 168.0 -76.2 111.0 18.6 50.4 80.8 210 214 A V - 0 0 44 -2,-0.6 9,-0.0 -6,-0.1 4,-0.0 -0.988 16.8-160.3-129.2 120.4 15.7 52.9 80.4 211 215 A K - 0 0 119 -2,-0.4 3,-0.1 1,-0.1 -7,-0.0 -0.750 29.0-111.7-102.4 152.3 12.2 51.5 80.3 212 216 A P S S+ 0 0 132 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 0.799 106.0 38.9 -57.1 -35.5 9.2 53.5 78.8 213 217 A D S S+ 0 0 158 2,-0.0 2,-0.4 -3,-0.0 -2,-0.0 -0.894 75.0 158.1-121.0 106.8 7.4 54.1 82.1 214 218 A M - 0 0 23 -2,-0.6 -4,-0.0 -3,-0.1 0, 0.0 -0.948 40.3-118.6-124.4 145.2 9.7 54.9 85.0 215 219 A T > - 0 0 57 -2,-0.4 4,-2.0 1,-0.1 5,-0.2 -0.402 36.6-106.8 -69.8 158.8 9.0 56.7 88.2 216 220 A P H > S+ 0 0 85 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.895 123.8 56.8 -49.3 -45.1 11.0 59.9 88.8 217 221 A R H > S+ 0 0 147 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.896 108.1 45.0 -48.4 -50.3 13.0 57.8 91.4 218 222 A E H > S+ 0 0 54 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.849 111.8 52.1 -70.0 -33.0 13.9 55.2 88.8 219 223 A Q H X S+ 0 0 58 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.874 108.6 52.8 -71.8 -36.8 14.8 58.0 86.2 220 224 A R H X S+ 0 0 95 -4,-2.6 4,-3.1 2,-0.2 -2,-0.2 0.887 104.4 54.6 -61.7 -44.1 17.1 59.5 88.9 221 225 A R H X S+ 0 0 44 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.900 108.5 49.4 -61.3 -38.4 18.9 56.2 89.5 222 226 A V H X S+ 0 0 0 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.954 115.2 42.4 -64.5 -45.0 19.7 56.0 85.8 223 227 A I H X S+ 0 0 1 -4,-1.8 4,-2.4 14,-0.3 14,-0.2 0.917 114.1 52.5 -72.3 -39.1 21.1 59.5 85.6 224 228 A M H X S+ 0 0 44 -4,-3.1 4,-3.0 2,-0.2 -1,-0.2 0.914 106.3 52.9 -58.3 -48.5 22.9 59.1 88.9 225 229 A A H X S+ 0 0 1 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.912 111.0 47.7 -53.2 -43.2 24.6 55.9 87.6 226 230 A F H X S+ 0 0 0 -4,-1.8 4,-3.2 1,-0.2 5,-0.3 0.908 113.0 47.7 -66.4 -42.8 25.8 57.9 84.6 227 231 A Q H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.880 104.4 59.1 -68.8 -42.0 27.1 60.8 86.7 228 232 A M H < S+ 0 0 6 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.857 118.0 33.9 -53.7 -33.5 28.9 58.5 89.2 229 233 A H H < S+ 0 0 5 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.897 136.9 17.3 -85.1 -46.8 30.9 57.3 86.1 230 234 A F H < S+ 0 0 4 -4,-3.2 -3,-0.2 1,-0.2 -2,-0.2 0.533 134.8 25.8-117.6 -8.2 31.2 60.4 83.9 231 235 A R >< + 0 0 4 -4,-2.7 3,-1.5 -5,-0.3 -1,-0.2 -0.416 64.4 163.0-153.0 62.0 30.4 63.5 86.1 232 236 A P T 3 + 0 0 50 0, 0.0 3,-0.3 0, 0.0 -4,-0.1 0.558 59.9 81.1 -72.0 -8.0 31.2 62.5 89.7 233 237 A T T 3 S+ 0 0 121 1,-0.3 2,-0.3 -6,-0.1 -5,-0.1 0.800 112.6 14.8 -63.2 -29.2 31.3 66.0 91.1 234 238 A L < + 0 0 61 -3,-1.5 -1,-0.3 -7,-0.2 3,-0.1 -0.866 63.0 163.1-150.4 117.2 27.5 65.9 91.2 235 239 A Y + 0 0 77 -2,-0.3 -7,-0.1 -3,-0.3 -11,-0.0 -0.321 31.2 128.3-127.9 40.6 25.5 62.6 91.0 236 240 A N S S- 0 0 78 2,-0.1 -12,-0.2 -13,-0.1 -1,-0.1 0.518 77.2-115.3 -78.0 -6.6 22.1 63.7 92.4 237 241 A G + 0 0 2 1,-0.3 2,-0.4 -14,-0.2 -14,-0.3 0.641 69.7 135.6 85.0 13.5 20.4 62.3 89.3 238 242 A E - 0 0 99 -15,-0.1 2,-0.4 -14,-0.1 -1,-0.3 -0.827 59.0-116.0 -94.2 132.1 19.0 65.6 88.0 239 243 A A + 0 0 7 -2,-0.4 -45,-2.1 -45,-0.2 2,-0.3 -0.514 46.5 162.0 -72.1 120.8 19.3 66.3 84.3 240 244 A D B > -I 193 0F 9 -2,-0.4 4,-2.2 -47,-0.3 -49,-0.2 -0.811 51.5 -99.0-133.0 179.1 21.6 69.3 83.6 241 245 A A H > S+ 0 0 0 -49,-1.7 4,-2.4 -52,-0.4 -50,-0.2 0.855 118.9 50.9 -70.0 -37.6 23.5 70.8 80.6 242 246 A E H > S+ 0 0 45 -52,-3.0 4,-2.3 2,-0.2 -1,-0.2 0.934 111.1 48.3 -65.0 -47.9 26.9 69.3 81.6 243 247 A T H > S+ 0 0 0 -53,-0.4 4,-2.2 1,-0.2 -2,-0.2 0.927 114.0 46.9 -55.5 -50.4 25.5 65.8 82.0 244 248 A Q H X S+ 0 0 28 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.903 110.8 51.9 -57.3 -46.4 23.7 66.1 78.6 245 249 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.875 109.4 50.2 -62.4 -37.4 26.9 67.4 76.9 246 250 A I H X S+ 0 0 9 -4,-2.3 4,-3.2 2,-0.2 -1,-0.2 0.940 111.5 47.7 -64.2 -47.7 28.9 64.5 78.2 247 251 A A H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.896 113.0 49.5 -58.4 -45.4 26.4 62.0 77.0 248 252 A E H X S+ 0 0 49 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.877 112.6 46.4 -62.1 -43.0 26.3 63.8 73.6 249 253 A A H X S+ 0 0 1 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.876 112.0 51.2 -69.4 -42.6 30.2 63.8 73.4 250 254 A L H X>S+ 0 0 0 -4,-3.2 4,-2.9 2,-0.2 5,-0.5 0.932 111.1 48.4 -53.5 -46.7 30.3 60.1 74.4 251 255 A L H X5S+ 0 0 32 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.902 110.9 50.7 -63.9 -42.3 27.7 59.2 71.7 252 256 A E H <5S+ 0 0 86 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.921 118.3 37.6 -57.2 -46.4 29.7 61.2 69.1 253 257 A K H <5S+ 0 0 97 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.878 133.3 19.1 -77.7 -38.2 33.0 59.5 69.9 254 258 A Y H <5S- 0 0 40 -4,-2.9 3,-0.2 1,-0.2 -3,-0.2 0.526 89.4-155.0-115.5 -12.5 31.9 55.9 70.6 255 259 A G << - 0 0 26 -4,-1.7 -1,-0.2 -5,-0.5 -2,-0.1 -0.199 30.4 -85.2 66.6-157.8 28.5 55.5 69.0 256 260 A Q 0 0 105 1,-0.1 -1,-0.2 -49,-0.0 -5,-0.0 0.418 360.0 360.0-129.7 -6.9 25.8 53.0 70.1 257 261 A D 0 0 137 -3,-0.2 -1,-0.1 -169,-0.0 -169,-0.1 -0.589 360.0 360.0 64.7 360.0 26.6 49.8 68.2 258 !* 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 0.0 259 2 B A 0 0 32 0, 0.0 -178,-0.2 0, 0.0 -179,-0.1 0.000 360.0 360.0 360.0 143.3 28.5 41.3 93.0 260 3 B X 0 0 33 -180,-2.6 -177,-0.4 -210,-0.1 -179,-0.2 0.639 360.0 360.0 117.9 360.0 25.1 39.9 91.9 261 ! 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 0.0 262 4 B K 0 0 183 0, 0.0 -182,-0.1 0, 0.0 -169,-0.1 0.000 360.0 360.0 360.0 360.0 23.3 34.7 88.7