==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 19-SEP-00 1E8C . COMPND 2 MOLECULE: UDP-N-ACETYLMURAMOYLALANYL-D-GLUTAMATE--2,6- . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR E.J.GORDON,L.CHANTALA,O.DIDEBERG . 992 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39537.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 697 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 132 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 78 7.9 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 . 9 0.9 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 . 87 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 106 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 248 25.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 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 4 2 4 0 4 0 2 4 6 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 4 2 16 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 0 PARALLEL BRIDGES PER LADDER . 6 1 2 5 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 . 0 2 0 2 2 0 0 0 1 1 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 3 A R 0 0 70 0, 0.0 18,-2.9 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 161.3 -4.9 29.1 89.2 2 4 A N B > -A 18 0A 33 16,-0.2 4,-2.6 1,-0.1 16,-0.2 -0.824 360.0-143.9-102.5 131.4 -3.0 27.5 86.3 3 5 A L H > S+ 0 0 1 14,-2.7 4,-2.2 -2,-0.5 5,-0.2 0.892 102.1 55.2 -52.4 -45.2 0.3 28.7 84.9 4 6 A R H > S+ 0 0 122 11,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.944 113.4 39.0 -54.6 -54.6 -0.8 27.8 81.4 5 7 A D H 4 S+ 0 0 76 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.822 111.1 60.6 -67.4 -33.8 -4.0 29.9 81.5 6 8 A L H < S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.926 116.8 30.0 -59.8 -45.8 -2.3 32.7 83.4 7 9 A L H >X S+ 0 0 0 -4,-2.2 3,-3.4 -5,-0.2 4,-3.1 0.443 83.3 112.2 -96.4 -1.7 0.2 33.3 80.6 8 10 A A T 3< S+ 0 0 51 -4,-0.9 -1,-0.2 1,-0.3 -2,-0.1 0.803 74.5 59.9 -41.2 -40.4 -1.9 32.3 77.6 9 11 A P T 34 S+ 0 0 64 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.598 126.6 12.1 -68.7 -8.6 -2.0 35.9 76.4 10 12 A W T <4 S+ 0 0 98 -3,-3.4 -2,-0.2 1,-0.0 3,-0.1 0.609 133.1 35.7-135.7 -36.3 1.8 36.0 76.1 11 13 A V >< + 0 0 1 -4,-3.1 3,-2.3 -7,-0.2 -4,-0.1 -0.689 57.6 176.2-126.9 77.8 3.4 32.5 76.4 12 14 A P T 3 S+ 0 0 106 0, 0.0 -4,-0.1 0, 0.0 -1,-0.1 0.686 79.9 59.2 -55.5 -18.9 1.0 30.1 74.6 13 15 A D T 3 S+ 0 0 104 58,-0.1 -9,-0.1 -6,-0.1 -5,-0.1 0.395 72.9 134.1 -93.7 3.7 3.5 27.3 75.2 14 16 A A < - 0 0 6 -3,-2.3 3,-0.1 -10,-0.2 -6,-0.0 -0.269 59.6-113.4 -56.6 132.9 3.6 27.6 79.1 15 17 A P - 0 0 33 0, 0.0 2,-0.3 0, 0.0 -11,-0.2 -0.297 32.4 -99.6 -68.6 151.5 3.3 24.2 80.8 16 18 A S + 0 0 61 -13,-0.2 2,-0.3 -12,-0.1 -14,-0.0 -0.527 55.9 149.4 -74.2 133.9 0.3 23.3 82.9 17 19 A R - 0 0 94 -2,-0.3 -14,-2.7 -3,-0.1 2,-0.2 -0.839 43.2-122.6-168.3 127.9 0.7 23.7 86.6 18 20 A A B -A 2 0A 84 -2,-0.3 2,-0.4 -16,-0.2 -16,-0.2 -0.504 29.3-162.1 -72.9 138.8 -1.6 24.5 89.5 19 21 A L - 0 0 7 -18,-2.9 14,-0.2 -2,-0.2 3,-0.1 -0.949 14.7-168.1-124.4 143.2 -0.5 27.6 91.5 20 22 A R - 0 0 175 12,-2.4 2,-0.3 -2,-0.4 13,-0.2 0.912 68.5 -4.5 -93.4 -64.6 -1.6 28.6 95.0 21 23 A E - 0 0 83 9,-0.1 13,-3.1 11,-0.1 2,-0.5 -0.884 61.4-130.7-130.2 162.3 -0.4 32.2 95.6 22 24 A X E +b 34 0B 4 -2,-0.3 2,-0.3 11,-0.2 13,-0.2 -0.958 32.2 168.1-116.3 129.2 1.6 34.7 93.7 23 25 A T E -b 35 0B 12 11,-2.4 13,-2.8 -2,-0.5 6,-0.0 -0.995 37.7-157.3-144.7 150.0 4.5 36.6 95.4 24 26 A L S S+ 0 0 41 -2,-0.3 2,-0.6 11,-0.2 14,-0.3 0.437 82.2 76.6 -97.6 -5.1 7.5 38.8 94.6 25 27 A D > - 0 0 49 1,-0.1 3,-1.5 12,-0.1 -1,-0.1 -0.935 62.7-159.5-114.9 117.6 9.3 38.0 97.8 26 28 A S G > S+ 0 0 8 -2,-0.6 3,-1.6 1,-0.3 -1,-0.1 0.812 89.1 70.4 -60.9 -31.1 11.1 34.6 98.1 27 29 A R G 3 S+ 0 0 198 1,-0.3 -1,-0.3 3,-0.0 -2,-0.0 0.700 109.9 32.4 -60.7 -21.6 11.0 34.8 101.9 28 30 A V G < S+ 0 0 99 -3,-1.5 2,-0.8 2,-0.1 -1,-0.3 0.089 87.1 117.1-123.4 21.7 7.2 34.3 101.9 29 31 A A < - 0 0 2 -3,-1.6 28,-0.1 4,-0.1 2,-0.1 -0.832 48.5-168.6 -91.9 112.2 6.9 32.0 98.8 30 32 A A > - 0 0 54 -2,-0.8 3,-2.0 1,-0.2 28,-0.2 -0.338 36.3 -58.9 -94.8 178.7 5.5 28.7 100.1 31 33 A A T 3 S+ 0 0 54 1,-0.3 26,-0.3 26,-0.1 -1,-0.2 -0.341 124.4 15.6 -59.2 129.3 5.2 25.3 98.6 32 34 A G T 3 S+ 0 0 17 24,-2.5 -12,-2.4 1,-0.3 -1,-0.3 0.431 98.1 125.4 87.9 -2.0 3.0 25.5 95.4 33 35 A D < - 0 0 12 -3,-2.0 25,-2.5 -14,-0.2 26,-1.4 -0.267 63.6-115.4 -84.0 174.3 3.2 29.2 95.0 34 36 A L E -bc 22 59B 0 -13,-3.1 -11,-2.4 24,-0.2 2,-0.5 -0.965 27.3-154.9-110.4 117.7 4.4 31.2 92.0 35 37 A F E -bc 23 60B 2 24,-2.3 26,-1.9 -2,-0.6 2,-0.6 -0.852 2.4-156.5 -97.4 128.2 7.5 33.2 92.7 36 38 A V E - c 0 61B 0 -13,-2.8 2,-0.7 -2,-0.5 26,-0.2 -0.918 6.4-160.1-107.0 116.9 8.0 36.4 90.5 37 39 A A E + c 0 62B 0 24,-2.5 26,-2.1 -2,-0.6 2,-0.2 -0.851 19.6 163.9-104.8 109.4 11.7 37.5 90.2 38 40 A V - 0 0 24 -2,-0.7 7,-2.9 -14,-0.3 2,-0.6 -0.752 41.9-104.2-119.6 165.9 12.3 41.1 89.2 39 41 A V B -F 44 0C 24 -2,-0.2 5,-0.2 5,-0.2 2,-0.1 -0.781 45.3-173.4 -89.9 123.1 15.2 43.5 89.2 40 42 A G - 0 0 31 3,-2.9 -1,-0.0 -2,-0.6 48,-0.0 -0.251 40.3 -91.0-103.8-165.2 14.8 46.1 92.0 41 43 A H S S+ 0 0 113 -2,-0.1 3,-0.1 1,-0.1 -2,-0.0 0.724 122.3 18.3 -79.3 -24.4 16.5 49.3 93.2 42 44 A Q S S+ 0 0 157 1,-0.2 2,-0.3 0, 0.0 -1,-0.1 0.727 127.4 15.5-117.0 -35.6 18.8 47.4 95.5 43 45 A A - 0 0 51 -5,-0.1 -3,-2.9 3,-0.0 2,-0.6 -0.828 66.9-111.1-137.5 175.4 18.8 43.7 94.6 44 46 A D B > -F 39 0C 15 -2,-0.3 3,-1.8 -5,-0.2 -5,-0.2 -0.938 17.0-155.1-112.5 112.0 18.0 41.2 91.8 45 47 A G G > S+ 0 0 17 -7,-2.9 3,-2.0 -2,-0.6 4,-0.2 0.775 89.2 71.3 -55.4 -28.7 15.1 38.9 92.7 46 48 A R G > S+ 0 0 41 1,-0.3 3,-1.6 2,-0.2 -1,-0.3 0.775 84.7 68.0 -60.4 -26.3 16.5 36.3 90.3 47 49 A R G < S+ 0 0 92 -3,-1.8 -1,-0.3 1,-0.3 4,-0.2 0.584 97.3 54.5 -70.9 -8.2 19.3 35.6 92.7 48 50 A Y G <> S+ 0 0 97 -3,-2.0 4,-2.5 -4,-0.2 -1,-0.3 0.372 77.2 98.4-104.4 2.3 16.8 34.1 95.1 49 51 A I H <> S+ 0 0 9 -3,-1.6 4,-2.8 1,-0.2 5,-0.3 0.911 79.5 55.2 -56.6 -43.9 15.3 31.7 92.6 50 52 A P H > S+ 0 0 72 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.915 110.5 45.7 -56.1 -43.9 17.5 28.8 94.0 51 53 A Q H > S+ 0 0 99 2,-0.2 4,-1.5 -4,-0.2 -2,-0.2 0.901 110.7 52.8 -65.8 -42.2 16.0 29.4 97.5 52 54 A A H <>S+ 0 0 0 -4,-2.5 5,-1.7 2,-0.2 4,-0.4 0.932 111.5 46.2 -60.6 -45.4 12.5 29.7 96.1 53 55 A I H ><5S+ 0 0 17 -4,-2.8 3,-1.7 1,-0.2 -1,-0.2 0.916 109.4 54.1 -63.6 -41.6 12.8 26.3 94.4 54 56 A A H 3<5S+ 0 0 89 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.799 105.4 56.3 -61.8 -26.3 14.3 24.8 97.5 55 57 A Q T 3<5S- 0 0 77 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.548 122.3-107.9 -82.1 -9.1 11.2 26.1 99.3 56 58 A G T < 5 + 0 0 34 -3,-1.7 -24,-2.5 -4,-0.4 -3,-0.2 0.691 52.2 171.3 93.5 20.3 9.0 24.2 96.9 57 59 A V < - 0 0 4 -5,-1.7 -23,-0.2 -26,-0.3 -1,-0.2 -0.236 32.2-136.8 -60.1 155.8 7.4 26.8 94.7 58 60 A A S S- 0 0 20 -25,-2.5 2,-0.3 -28,-0.2 -24,-0.2 0.802 74.5 -6.1 -84.4 -32.5 5.4 25.5 91.8 59 61 A A E -c 34 0B 0 -26,-1.4 -24,-2.3 20,-0.2 2,-0.4 -0.976 57.2-141.1-158.0 166.5 6.7 27.9 89.1 60 62 A I E -cd 35 81B 0 20,-2.0 22,-2.9 -2,-0.3 2,-0.5 -0.999 2.2-164.5-139.6 137.5 8.7 31.0 88.5 61 63 A I E -cd 36 82B 1 -26,-1.9 -24,-2.5 -2,-0.4 2,-0.3 -0.994 26.1-176.8-119.2 121.8 8.3 34.0 86.2 62 64 A A E -cd 37 83B 0 20,-2.9 22,-2.6 -2,-0.5 -24,-0.2 -0.901 32.8 -97.1-126.8 153.2 11.6 35.9 85.9 63 65 A E E - d 0 84B 10 -26,-2.1 22,-0.2 -2,-0.3 20,-0.0 -0.393 28.0-150.1 -62.4 136.8 12.9 39.1 84.2 64 66 A A >> + 0 0 4 20,-1.9 4,-2.6 3,-0.1 3,-2.5 0.683 49.2 131.2 -84.7 -21.6 14.5 38.2 80.9 65 67 A K T 34 S- 0 0 90 19,-0.3 4,-0.1 1,-0.3 -2,-0.0 -0.026 86.3 -11.9 -41.0 125.4 17.0 41.1 80.8 66 68 A D T 34 S+ 0 0 33 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.459 134.8 63.7 61.5 3.5 20.6 39.9 80.0 67 69 A E T <4 S- 0 0 62 -3,-2.5 2,-0.3 1,-0.4 -2,-0.2 0.711 102.8 -6.7-126.5 -33.2 19.5 36.3 80.5 68 70 A A < - 0 0 9 -4,-2.6 -1,-0.4 823,-0.1 2,-0.2 -0.975 68.7 -84.7-159.6 171.0 17.0 35.1 78.0 69 71 A T > - 0 0 37 -2,-0.3 3,-2.3 1,-0.1 14,-0.2 -0.529 61.2 -85.4 -82.0 150.7 14.6 35.9 75.2 70 72 A D T 3 S+ 0 0 85 1,-0.3 14,-0.2 -2,-0.2 -1,-0.1 -0.336 117.2 14.7 -57.7 125.3 11.1 37.2 76.0 71 73 A G T 3 S+ 0 0 17 12,-2.8 -1,-0.3 1,-0.3 13,-0.2 0.540 87.6 158.6 87.0 6.9 8.8 34.2 76.6 72 74 A E < - 0 0 46 -3,-2.3 11,-2.6 11,-0.4 2,-0.5 -0.414 29.0-148.8 -68.0 138.7 11.6 31.7 77.0 73 75 A I E +E 82 0B 48 9,-0.2 2,-0.2 -2,-0.1 9,-0.2 -0.943 24.8 161.3-114.2 124.5 10.7 28.6 78.9 74 76 A R E -E 81 0B 75 7,-2.7 7,-2.9 -2,-0.5 2,-0.4 -0.780 26.8-135.0-130.4 174.7 13.2 26.7 81.0 75 77 A E E -E 80 0B 96 -2,-0.2 2,-0.4 5,-0.2 -2,-0.0 -1.000 13.2-173.6-138.7 134.2 13.2 24.2 83.8 76 78 A X E > S-E 79 0B 64 3,-2.5 3,-2.6 -2,-0.4 -2,-0.0 -0.976 77.1 -21.4-131.2 118.2 15.2 24.0 87.0 77 79 A H T 3 S- 0 0 159 -2,-0.4 -1,-0.1 1,-0.3 0, 0.0 0.899 128.9 -50.7 50.9 43.8 15.0 21.0 89.3 78 80 A G T 3 S+ 0 0 54 1,-0.2 -1,-0.3 0, 0.0 0, 0.0 0.343 114.7 121.2 79.0 -6.9 11.6 20.2 87.7 79 81 A V E < - E 0 76B 17 -3,-2.6 -3,-2.5 -20,-0.0 -1,-0.2 -0.803 64.5-123.5 -97.4 124.5 10.3 23.7 88.2 80 82 A P E - E 0 75B 0 0, 0.0 -20,-2.0 0, 0.0 2,-0.5 -0.390 24.4-167.2 -63.9 132.9 9.1 25.7 85.2 81 83 A V E -dE 60 74B 0 -7,-2.9 -7,-2.7 -22,-0.2 2,-0.5 -0.973 2.2-169.1-127.2 113.6 10.9 29.1 84.8 82 84 A I E -dE 61 73B 0 -22,-2.9 -20,-2.9 -2,-0.5 2,-0.4 -0.911 9.1-149.6-107.8 125.7 9.4 31.5 82.3 83 85 A Y E -d 62 0B 17 -11,-2.6 -12,-2.8 -2,-0.5 -11,-0.4 -0.791 15.6-178.3 -97.9 133.0 11.3 34.7 81.3 84 86 A L E > -d 63 0B 1 -22,-2.6 -20,-1.9 -2,-0.4 3,-0.6 -0.987 22.5-126.8-130.9 140.8 9.5 37.9 80.3 85 87 A S T 3 S+ 0 0 39 -2,-0.4 5,-0.1 1,-0.2 -16,-0.0 -0.541 91.5 13.3 -84.3 152.0 10.9 41.2 79.2 86 88 A Q T >> S+ 0 0 112 -2,-0.2 3,-0.6 1,-0.1 4,-0.5 0.894 78.2 167.1 51.4 44.7 9.9 44.5 80.9 87 89 A L H X> + 0 0 0 -3,-0.6 3,-1.7 1,-0.2 4,-0.6 0.882 64.3 61.3 -58.3 -42.2 8.4 42.4 83.7 88 90 A N H >4 S+ 0 0 62 1,-0.3 3,-0.7 2,-0.2 4,-0.4 0.865 103.7 50.4 -54.7 -38.4 8.0 45.3 86.2 89 91 A E H <4 S+ 0 0 97 -3,-0.6 -1,-0.3 1,-0.2 4,-0.2 0.640 114.0 45.3 -73.9 -12.7 5.7 47.0 83.8 90 92 A R H S+ 0 0 0 97,-0.4 4,-2.2 -4,-0.4 -1,-0.2 0.927 115.4 46.3 -57.3 -46.4 -0.1 44.5 87.7 93 95 A A H > S+ 0 0 35 -4,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.917 114.1 48.3 -62.4 -44.7 -1.6 43.0 84.6 94 96 A L H X S+ 0 0 1 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.932 113.1 46.8 -60.8 -48.4 -0.2 39.6 85.5 95 97 A A H X S+ 0 0 0 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.849 108.8 57.7 -63.3 -33.5 -1.4 39.8 89.1 96 98 A G H <>S+ 0 0 0 -4,-2.2 5,-3.0 -5,-0.3 -1,-0.2 0.920 108.7 43.3 -63.7 -44.3 -4.8 40.9 87.8 97 99 A R H ><5S+ 0 0 58 -4,-2.0 3,-1.0 3,-0.2 -2,-0.2 0.904 112.8 55.0 -67.3 -39.4 -5.3 37.8 85.7 98 100 A F H 3<5S+ 0 0 9 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.917 116.3 35.0 -58.4 -47.2 -4.0 35.7 88.5 99 101 A Y T 3<5S- 0 0 28 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.182 117.4-108.0 -96.3 16.6 -6.5 37.0 91.0 100 102 A H T < 5 - 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0 0 126 28,-0.0 81,-2.1 27,-0.0 2,-0.6 -0.625 50.1-134.0 -90.9 148.1 1.1 80.7 122.9 377 379 A L E -t 457 0F 0 -2,-0.3 27,-1.9 79,-0.2 28,-1.8 -0.892 19.9-163.6-103.9 120.5 1.5 78.2 120.1 378 380 A W E -tu 458 405F 16 79,-3.1 81,-3.0 -2,-0.6 2,-0.5 -0.799 2.9-159.0-102.3 146.6 4.4 75.7 120.4 379 381 A C E -tu 459 406F 0 26,-2.6 28,-2.9 -2,-0.3 2,-0.6 -0.932 6.7-174.2-130.8 109.1 5.7 73.7 117.4 380 382 A V E +tu 460 407F 0 79,-2.9 81,-2.3 -2,-0.5 2,-0.3 -0.904 31.9 130.8-102.4 118.4 7.7 70.6 118.1 381 383 A F E - u 0 408F 2 26,-2.0 28,-2.7 -2,-0.6 2,-0.3 -0.967 29.3-176.2-158.6 172.6 9.1 69.1 114.8 382 384 A G - 0 0 3 79,-0.4 2,-0.3 -2,-0.3 28,-0.2 -0.891 26.3-108.5-158.8-177.4 12.0 67.8 112.8 383 385 A C - 0 0 6 26,-0.4 28,-0.6 -2,-0.3 2,-0.2 -0.942 32.9-102.2-128.4 151.2 12.9 66.5 109.4 384 386 A G - 0 0 10 -2,-0.3 3,-0.5 -27,-0.2 2,-0.1 -0.471 30.8-126.8 -76.3 137.3 13.6 63.1 108.0 385 387 A G S S+ 0 0 0 27,-3.1 29,-0.1 1,-0.2 3,-0.1 -0.379 90.1 29.0 -75.8 158.7 17.2 62.0 107.2 386 388 A D S S+ 0 0 59 1,-0.2 2,-0.3 27,-0.1 -1,-0.2 0.876 107.8 92.8 58.0 41.1 18.1 60.6 103.8 387 389 A R S S- 0 0 101 -3,-0.5 -1,-0.2 -178,-0.0 -4,-0.0 -0.922 88.4 -30.6-151.6 174.7 15.4 62.7 102.2 388 390 A D - 0 0 1 -2,-0.3 3,-0.5 1,-0.2 4,-0.3 0.003 49.5-173.8 -33.9 101.3 14.7 66.0 100.4 389 391 A K S > S+ 0 0 102 1,-0.2 3,-1.2 373,-0.2 -1,-0.2 0.792 74.4 70.3 -72.8 -28.8 17.2 68.3 102.1 390 392 A G T 3> S+ 0 0 26 1,-0.2 4,-0.7 2,-0.2 -1,-0.2 0.781 90.5 57.3 -60.6 -31.8 15.8 71.4 100.4 391 393 A K H 3> S+ 0 0 13 -3,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.678 89.0 79.4 -75.1 -15.6 12.5 71.4 102.3 392 394 A R H <> S+ 0 0 0 -3,-1.2 4,-1.8 -4,-0.3 -1,-0.2 0.936 92.8 45.0 -57.8 -52.1 14.4 71.7 105.6 393 395 A P H > S+ 0 0 43 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.885 111.6 55.1 -61.0 -37.8 15.2 75.4 105.4 394 396 A L H X S+ 0 0 72 -4,-0.7 4,-1.8 1,-0.2 -2,-0.2 0.890 107.3 48.5 -63.0 -41.0 11.6 76.1 104.3 395 397 A X H X S+ 0 0 3 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.874 108.0 53.9 -69.7 -35.6 10.1 74.4 107.3 396 398 A G H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.929 109.7 48.9 -62.3 -42.6 12.3 76.2 109.8 397 399 A A H X S+ 0 0 34 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.873 110.9 50.7 -63.5 -38.5 11.2 79.5 108.3 398 400 A I H X S+ 0 0 20 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.917 110.6 47.3 -66.9 -44.8 7.5 78.3 108.6 399 401 A A H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.943 111.3 51.6 -62.4 -47.0 7.8 77.4 112.2 400 402 A E H < S+ 0 0 51 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.806 117.5 38.9 -59.5 -32.6 9.6 80.6 113.1 401 403 A E H < S+ 0 0 140 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.868 123.9 33.5 -88.7 -39.9 6.9 82.7 111.4 402 404 A F H < S+ 0 0 43 -4,-2.7 2,-0.3 -5,-0.2 -2,-0.2 0.513 112.1 61.9 -97.0 -5.8 3.6 80.9 112.3 403 405 A A < - 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0 0 0 -3,-1.8 2,-0.7 1,-0.1 36,-0.7 -0.419 58.5-135.3 -74.4 146.9 47.9 53.1 89.2 692 197 B K B -o 727 0M 96 -2,-0.1 -87,-0.4 34,-0.1 2,-0.4 -0.900 22.1-160.9-105.5 110.1 46.7 56.5 90.3 693 198 B F - 0 0 10 34,-2.7 -87,-0.2 -2,-0.7 3,-0.1 -0.732 19.3-157.8 -92.9 138.5 43.7 57.6 88.2 694 199 B A S S- 0 0 29 -89,-3.5 36,-2.3 -2,-0.4 2,-0.3 0.824 85.6 -1.3 -78.4 -33.2 42.6 61.2 88.0 695 200 B A E -fi 606 730K 0 -90,-1.2 -88,-2.5 34,-0.3 2,-0.4 -0.987 62.2-148.7-155.4 151.1 39.1 60.0 87.0 696 201 B S E -fi 607 731K 0 34,-2.9 36,-2.3 -2,-0.3 2,-0.4 -0.985 17.0-158.6-129.1 119.4 37.3 56.6 86.5 697 202 B V E -fi 608 732K 0 -90,-3.2 -88,-3.1 -2,-0.4 2,-0.5 -0.805 6.4-160.0-104.2 138.6 34.5 56.4 84.0 698 203 B F E +fi 609 733K 0 34,-2.4 36,-1.5 -2,-0.4 -88,-0.2 -0.964 10.4 177.3-117.1 117.6 31.7 53.8 83.8 699 204 B T - 0 0 0 -90,-2.3 2,-0.3 -2,-0.5 -89,-0.2 0.920 54.3 -59.8 -85.3 -48.9 29.9 53.4 80.5 700 205 B N - 0 0 10 -91,-0.2 -89,-2.3 2,-0.0 2,-0.3 -0.967 36.4-124.8 176.9 172.9 27.5 50.6 81.0 701 206 B L + 0 0 9 -2,-0.3 2,-0.2 -91,-0.2 38,-0.2 -0.946 36.3 146.0-145.0 120.3 27.1 46.9 82.0 702 207 B S - 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0 0 9 -2,-0.4 3,-1.7 3,-0.3 144,-0.1 -0.998 44.0 -95.2-147.3 144.2 29.3 54.2 47.0 843 348 B P T 3 S+ 0 0 121 0, 0.0 -2,-0.0 0, 0.0 108,-0.0 -0.283 107.3 15.9 -60.9 138.3 27.1 54.6 43.9 844 349 B G T 3 S+ 0 0 56 1,-0.2 107,-0.1 107,-0.0 141,-0.0 0.308 114.4 85.7 83.9 -10.0 25.3 51.6 42.7 845 350 B K S < S- 0 0 72 -3,-1.7 -3,-0.3 106,-0.1 -1,-0.2 -0.843 83.0-100.1-123.5 159.3 25.9 49.7 45.9 846 351 B P - 0 0 3 0, 0.0 2,-0.4 0, 0.0 108,-0.2 -0.323 45.7 -98.0 -71.5 159.4 24.2 49.5 49.3 847 352 B T E - q 0 954N 21 106,-1.9 108,-2.6 104,-0.3 2,-0.4 -0.653 42.0-155.3 -78.6 132.0 25.5 51.5 52.3 848 353 B V E -Pq 840 955N 0 -8,-2.6 -8,-3.6 -2,-0.4 2,-0.5 -0.927 8.7-165.0-114.5 135.1 27.7 49.2 54.4 849 354 B V E -Pq 839 956N 0 106,-2.8 108,-2.9 -2,-0.4 2,-0.5 -0.971 3.7-160.0-121.7 121.2 28.3 49.8 58.1 850 355 B V E +Pq 838 957N 0 -12,-2.7 -12,-2.9 -2,-0.5 2,-0.3 -0.874 21.3 168.7-100.4 125.9 31.1 48.0 59.9 851 356 B D E - q 0 958N 15 106,-2.1 108,-1.1 -2,-0.5 110,-0.9 -0.989 41.9-134.0-139.5 150.7 30.8 47.9 63.7 852 357 B Y + 0 0 44 -17,-0.6 -16,-0.1 -2,-0.3 7,-0.1 0.689 55.0 141.8 -72.4 -21.5 32.5 46.1 66.6 853 358 B A + 0 0 4 5,-0.2 -2,-0.1 1,-0.2 108,-0.1 0.113 7.8 151.3 -28.8 110.3 29.1 45.1 68.2 854 359 B H + 0 0 45 104,-0.1 27,-0.2 105,-0.1 -1,-0.2 0.107 48.5 74.0-135.5 19.4 29.6 41.6 69.6 855 360 B T S > S- 0 0 0 1,-0.1 4,-2.5 -151,-0.1 5,-0.2 -0.897 87.4-109.8-128.6 158.9 27.1 41.6 72.5 856 361 B P H > S+ 0 0 15 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.928 118.2 45.0 -54.1 -47.7 23.3 41.4 72.5 857 362 B D H > S+ 0 0 58 -154,-0.3 4,-1.8 1,-0.2 5,-0.1 0.878 113.7 48.2 -66.0 -40.6 22.9 45.0 73.7 858 363 B A H > S+ 0 0 14 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.899 110.4 52.0 -68.1 -40.4 25.5 46.4 71.3 859 364 B L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 5,-0.2 0.910 108.5 50.4 -62.9 -43.3 24.0 44.6 68.3 860 365 B E H X S+ 0 0 60 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.924 112.0 47.4 -62.4 -43.6 20.5 45.9 69.1 861 366 B K H X S+ 0 0 77 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.865 111.1 51.7 -65.8 -35.6 21.7 49.5 69.3 862 367 B A H X S+ 0 0 4 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.918 111.8 46.1 -67.3 -43.2 23.8 49.2 66.1 863 368 B L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.913 110.3 52.2 -65.9 -43.2 20.8 47.9 64.2 864 369 B Q H X S+ 0 0 93 -4,-2.3 4,-0.9 1,-0.2 -1,-0.2 0.865 114.1 45.0 -61.3 -34.9 18.4 50.5 65.5 865 370 B A H X S+ 0 0 11 -4,-1.6 4,-0.7 -5,-0.2 -1,-0.2 0.865 111.4 52.2 -76.5 -37.1 20.9 53.2 64.5 866 371 B A H < S+ 0 0 0 -4,-2.3 3,-0.3 1,-0.2 -2,-0.2 0.843 106.4 54.4 -68.2 -33.3 21.5 51.6 61.1 867 372 B R H >< S+ 0 0 86 -4,-2.4 3,-1.9 1,-0.2 -1,-0.2 0.798 96.5 62.6 -73.4 -28.3 17.8 51.5 60.3 868 373 B L H 3< S+ 0 0 136 -4,-0.9 -1,-0.2 1,-0.3 -2,-0.2 0.836 110.6 42.7 -62.4 -30.5 17.2 55.2 60.9 869 374 B H T 3< S+ 0 0 78 -4,-0.7 2,-0.5 -3,-0.3 -1,-0.3 -0.054 100.1 96.0-103.3 27.9 19.6 55.7 58.0 870 375 B C < + 0 0 18 -3,-1.9 83,-0.1 1,-0.1 4,-0.1 -0.911 38.1 170.2-128.8 108.0 18.0 52.9 56.0 871 376 B A S S+ 0 0 102 -2,-0.5 82,-0.2 81,-0.5 -1,-0.1 0.702 77.6 28.5 -85.2 -22.2 15.3 53.6 53.3 872 377 B G S S- 0 0 18 80,-1.7 2,-0.3 1,-0.2 81,-0.2 0.217 115.2 -27.9-107.9-130.3 15.3 50.0 52.0 873 378 B K - 0 0 121 28,-0.0 81,-2.1 77,-0.0 2,-0.6 -0.736 52.2-136.5 -96.1 140.5 16.0 46.7 53.6 874 379 B L E -r 954 0N 0 -2,-0.3 28,-1.9 79,-0.2 27,-1.9 -0.850 19.2-165.1 -99.6 120.3 18.4 46.3 56.6 875 380 B W E -rs 955 902N 18 79,-3.2 81,-3.0 -2,-0.6 2,-0.5 -0.796 3.8-159.2-103.0 146.6 20.8 43.3 56.4 876 381 B C E -rs 956 903N 0 26,-2.5 28,-3.7 -2,-0.3 2,-0.6 -0.964 5.9-173.2-131.2 113.9 22.8 42.0 59.4 877 382 B V E +rs 957 904N 0 79,-3.3 81,-2.3 -2,-0.5 2,-0.3 -0.933 31.8 131.0-106.6 117.2 25.9 39.9 58.8 878 383 B F E - s 0 905N 2 26,-2.5 28,-2.8 -2,-0.6 2,-0.2 -0.974 28.9-178.5-158.4 171.8 27.2 38.5 62.1 879 384 B G - 0 0 2 79,-0.4 2,-0.4 -2,-0.3 28,-0.2 -0.838 29.1-107.0-156.5-172.7 28.5 35.5 64.0 880 385 B C - 0 0 5 26,-0.4 28,-0.5 -2,-0.2 2,-0.1 -0.983 32.4-103.8-133.0 145.5 29.7 34.8 67.5 881 386 B G - 0 0 12 -2,-0.4 3,-0.5 -27,-0.2 2,-0.1 -0.375 35.3-123.1 -67.9 141.3 33.2 34.1 68.9 882 387 B G S S+ 0 0 0 27,-3.1 3,-0.1 1,-0.2 29,-0.1 -0.427 89.8 28.7 -79.9 159.4 34.1 30.5 69.7 883 388 B D S S+ 0 0 64 1,-0.2 2,-0.2 27,-0.1 -1,-0.2 0.877 108.2 87.5 58.8 40.8 35.2 29.5 73.2 884 389 B R S S- 0 0 103 -3,-0.5 2,-0.2 1,-0.0 -1,-0.2 -0.798 87.7 -18.3-148.9-169.8 33.3 32.3 74.9 885 390 B D - 0 0 4 -2,-0.2 3,-0.5 1,-0.2 4,-0.2 -0.132 54.5-179.3 -41.0 96.3 29.9 33.3 76.4 886 391 B K S > S+ 0 0 124 -2,-0.2 3,-1.3 1,-0.2 -1,-0.2 0.805 72.2 65.8 -73.9 -29.9 27.7 30.7 74.8 887 392 B G T 3> S+ 0 0 32 1,-0.3 4,-0.7 2,-0.2 -1,-0.2 0.751 92.1 61.4 -65.1 -24.6 24.5 32.0 76.4 888 393 B K H 3> S+ 0 0 14 -3,-0.5 4,-1.7 1,-0.2 -1,-0.3 0.645 85.5 80.1 -78.4 -10.8 24.6 35.2 74.4 889 394 B R H <> S+ 0 0 0 -3,-1.3 4,-2.0 -4,-0.2 3,-0.3 0.944 94.4 42.5 -60.5 -51.6 24.4 33.3 71.1 890 395 B P H > S+ 0 0 34 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.879 112.2 56.1 -63.1 -36.8 20.6 32.8 71.3 891 396 B L H X S+ 0 0 17 -4,-0.7 4,-1.5 1,-0.2 -2,-0.2 0.834 109.8 44.7 -64.5 -33.9 20.1 36.3 72.5 892 397 B X H X S+ 0 0 2 -4,-1.7 4,-2.6 -3,-0.3 5,-0.2 0.840 110.6 53.7 -80.1 -32.8 21.9 37.7 69.4 893 398 B G H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.939 110.8 47.1 -64.6 -44.7 20.1 35.4 67.0 894 399 B A H X S+ 0 0 8 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.893 113.1 49.9 -62.3 -40.5 16.8 36.6 68.4 895 400 B I H X S+ 0 0 18 -4,-1.5 4,-2.7 2,-0.2 5,-0.3 0.918 108.6 49.8 -65.0 -47.9 17.9 40.3 68.2 896 401 B A H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.920 111.9 51.2 -58.0 -42.4 19.1 40.0 64.5 897 402 B E H < S+ 0 0 53 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.907 114.7 41.3 -61.2 -45.5 15.8 38.5 63.7 898 403 B E H < S+ 0 0 130 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.899 123.9 32.7 -72.9 -43.9 13.7 41.2 65.3 899 404 B F H < S+ 0 0 59 -4,-2.7 2,-0.3 -5,-0.1 -2,-0.2 0.488 111.6 64.7 -96.0 -3.6 15.6 44.3 64.3 900 405 B A < - 0 0 9 -4,-1.5 3,-0.2 -5,-0.3 -25,-0.2 -0.908 63.8-147.3-121.4 150.2 16.9 43.3 60.9 901 406 B D S S+ 0 0 67 -27,-1.9 2,-0.4 -2,-0.3 -26,-0.2 0.834 93.6 26.8 -79.6 -35.7 15.1 42.4 57.6 902 407 B V E S-s 875 0N 15 -28,-1.9 -26,-2.5 -6,-0.1 2,-0.6 -0.984 73.1-156.0-132.8 121.7 17.6 39.8 56.5 903 408 B A E -s 876 0N 10 -2,-0.4 30,-2.7 28,-0.2 2,-0.7 -0.865 6.0-170.2-102.6 119.7 19.8 37.9 59.0 904 409 B V E -st 877 933N 3 -28,-3.7 -26,-2.5 -2,-0.6 2,-0.5 -0.898 8.0-164.4-110.5 104.5 23.1 36.5 57.6 905 410 B V E +st 878 934N 0 28,-2.3 30,-2.5 -2,-0.7 -26,-0.2 -0.774 26.1 138.9 -93.1 125.7 24.7 34.2 60.2 906 411 B T - 0 0 2 -28,-2.8 -26,-0.4 -2,-0.5 30,-0.2 -0.693 50.3 -57.4-143.9-165.3 28.3 33.3 59.6 907 412 B D + 0 0 25 28,-0.4 -26,-0.1 -2,-0.2 -1,-0.1 -0.427 36.8 172.6 -84.0 160.3 31.6 32.8 61.4 908 413 B D S S- 0 0 9 -28,-0.5 -27,-0.1 -2,-0.1 -1,-0.1 0.176 76.6 -26.1-127.0-109.8 33.4 35.4 63.7 909 414 B N - 0 0 3 1,-0.1 -27,-3.1 57,-0.1 59,-0.1 -0.811 65.5-179.8-114.6 86.6 36.5 34.0 65.5 910 415 B P > + 0 0 5 0, 0.0 3,-2.0 0, 0.0 58,-0.2 0.742 13.5 173.8 -55.8 -29.9 35.6 30.3 65.8 911 416 B R B 3 -u 968 0O 47 56,-2.7 58,-2.8 1,-0.3 60,-0.1 -0.277 68.8 -23.3 51.4-127.5 38.8 29.5 67.6 912 417 B T T 3 S+ 0 0 103 56,-0.2 -1,-0.3 2,-0.1 2,-0.2 0.474 114.2 100.1 -94.2 0.3 38.8 25.9 68.7 913 418 B E S < S- 0 0 28 -3,-2.0 56,-0.2 56,-0.1 -31,-0.1 -0.571 87.6 -95.9 -85.2 148.9 35.0 25.4 68.6 914 419 B E > - 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