==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 10-FEB-98 1ELX . COMPND 2 MOLECULE: ALKALINE PHOSPHATASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR B.STEC,M.HEHIR,C.BRENNAN,M.NOLTE,E.R.KANTROWITZ . 898 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27497.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 604 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 93 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 78 8.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 54 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 204 22.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 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 3 2 3 5 1 2 1 4 0 0 0 0 0 0 0 0 0 0 0 0 2 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 0 2 6 0 5 1 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 . 8 6 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 ANTIPARALLEL BRIDGES PER LADDER . 2 2 0 2 0 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 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 T 0 0 131 0, 0.0 2,-0.8 0, 0.0 359,-0.0 0.000 360.0 360.0 360.0 176.1 34.0 11.5 51.2 2 2 A P - 0 0 113 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.502 360.0-140.5 -59.5 102.4 32.2 14.8 50.1 3 3 A E - 0 0 110 -2,-0.8 354,-0.1 1,-0.1 32,-0.0 -0.539 3.2-138.9 -72.0 131.9 35.3 16.5 48.6 4 4 A M - 0 0 15 -2,-0.3 32,-0.2 32,-0.1 29,-0.1 -0.820 27.1-118.0 -92.3 118.6 35.6 20.2 49.3 5 5 A P - 0 0 54 0, 0.0 2,-0.5 0, 0.0 -1,-0.0 -0.228 17.7-151.0 -57.5 143.7 36.9 22.0 46.2 6 6 A V - 0 0 10 72,-0.1 72,-0.2 73,-0.1 71,-0.1 -0.986 40.4 -96.4-118.5 113.4 40.2 23.8 46.2 7 7 A L - 0 0 28 70,-0.8 3,-0.2 -2,-0.5 874,-0.0 -0.022 44.3-176.2 -35.0 103.2 40.2 26.8 43.8 8 8 A E + 0 0 154 1,-0.2 2,-0.3 2,-0.0 -1,-0.2 0.892 65.2 14.9 -75.7 -45.6 41.9 25.3 40.7 9 9 A N + 0 0 85 1,-0.1 -1,-0.2 15,-0.1 17,-0.1 -0.832 48.0 150.2-141.1 106.9 42.0 28.4 38.5 10 10 A R + 0 0 8 -2,-0.3 2,-0.2 -3,-0.2 15,-0.1 -0.099 49.0 119.5-114.3 25.8 41.6 32.0 39.3 11 11 A A S S- 0 0 19 13,-0.2 59,-0.2 1,-0.2 60,-0.1 -0.511 82.3 -77.2 -78.3 166.2 44.0 33.0 36.6 12 12 A A - 0 0 22 57,-2.5 12,-0.2 -2,-0.2 10,-0.2 -0.332 37.1-131.7 -62.4 144.5 42.5 35.3 33.8 13 13 A Q - 0 0 77 10,-1.4 9,-0.2 8,-0.2 2,-0.1 0.790 67.4 -58.4 -71.2 -28.1 40.4 33.3 31.4 14 14 A G S S+ 0 0 47 7,-3.0 2,-0.7 9,-0.1 7,-0.1 -0.503 103.5 27.6-172.1-121.8 42.1 34.8 28.3 15 15 A D > - 0 0 91 1,-0.2 3,-1.2 -2,-0.1 6,-0.2 -0.638 52.6-158.2 -74.0 116.3 42.9 38.0 26.5 16 16 A I T 3 S+ 0 0 32 -2,-0.7 548,-0.6 5,-0.3 6,-0.3 0.740 90.8 56.4 -69.9 -16.5 43.1 40.7 29.2 17 17 A T T 3 S+ 0 0 20 4,-0.1 557,-0.3 546,-0.1 -1,-0.2 0.595 99.1 75.5 -87.5 -12.0 42.5 43.4 26.6 18 18 A A S X> S- 0 0 32 -3,-1.2 3,-1.9 1,-0.1 4,-0.6 -0.632 99.0 -82.8 -98.9 159.5 39.3 41.8 25.5 19 19 A P T 34 S+ 0 0 68 0, 0.0 544,-0.3 0, 0.0 -4,-0.1 -0.431 116.6 3.4 -60.2 121.8 35.8 41.8 27.2 20 20 A G T 34 S+ 0 0 16 542,-2.6 3,-0.3 -2,-0.2 -7,-0.2 0.487 102.0 111.6 75.7 4.9 35.6 39.0 29.8 21 21 A G T <4 S+ 0 0 8 -3,-1.9 -7,-3.0 -6,-0.2 -5,-0.3 0.834 72.6 50.5 -78.8 -34.1 39.3 38.2 29.1 22 22 A A S < S+ 0 0 1 -4,-0.6 -1,-0.2 -6,-0.3 865,-0.2 0.430 84.0 123.9 -84.1 0.4 40.6 39.3 32.5 23 23 A R - 0 0 57 -3,-0.3 -10,-1.4 539,-0.2 -9,-0.1 -0.334 43.0-169.3 -67.8 141.2 38.1 37.4 34.5 24 24 A R S S+ 0 0 1 -12,-0.2 2,-0.2 860,-0.2 -13,-0.2 0.748 70.3 77.1 -97.9 -25.0 39.2 34.9 37.1 25 25 A L + 0 0 6 859,-0.1 -12,-0.1 1,-0.1 3,-0.1 -0.589 49.3 179.2 -86.7 148.8 35.7 33.4 37.5 26 26 A T - 0 0 101 -2,-0.2 2,-0.2 1,-0.1 -1,-0.1 0.602 68.2 -7.3-117.7 -25.9 34.3 31.1 35.1 27 27 A G S S- 0 0 42 851,-0.0 2,-0.4 0, 0.0 -1,-0.1 -0.743 92.9 -49.9-149.9-163.2 30.9 30.4 36.7 28 28 A D > - 0 0 67 -2,-0.2 4,-0.5 1,-0.1 3,-0.3 -0.661 36.3-156.0 -83.9 136.7 28.8 31.0 39.8 29 29 A Q H >> + 0 0 22 -2,-0.4 4,-2.1 1,-0.2 3,-1.2 0.950 67.9 93.9 -78.9 -44.8 30.3 30.2 43.1 30 30 A T H 3> S+ 0 0 0 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.598 94.0 37.8 -12.4 -60.2 27.3 29.6 45.3 31 31 A A H 3> S+ 0 0 45 -3,-0.3 4,-2.9 2,-0.2 -1,-0.3 0.959 118.5 47.6 -67.7 -49.0 27.3 25.8 44.9 32 32 A A H << S+ 0 0 41 -3,-1.2 -2,-0.2 -4,-0.5 -1,-0.2 0.827 114.9 47.2 -60.8 -35.6 31.1 25.4 44.9 33 33 A L H >X S+ 0 0 3 -4,-2.1 3,-2.2 2,-0.2 4,-0.7 0.897 108.7 55.1 -72.6 -39.9 31.3 27.5 48.0 34 34 A R H >< S+ 0 0 97 -4,-2.3 3,-2.1 -5,-0.4 -2,-0.2 0.966 103.3 56.4 -56.4 -45.8 28.5 25.5 49.5 35 35 A D T 3< S+ 0 0 104 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.390 102.5 57.0 -69.1 3.5 30.5 22.4 48.9 36 36 A S T <4 S+ 0 0 4 -3,-2.2 2,-0.7 -32,-0.2 387,-0.3 0.550 83.0 97.4-107.9 -14.8 33.3 23.9 50.9 37 37 A L << + 0 0 11 -3,-2.1 2,-0.4 -4,-0.7 -4,-0.0 -0.630 45.4 150.1 -82.6 113.9 31.4 24.5 54.1 38 38 A S - 0 0 7 -2,-0.7 387,-3.0 385,-0.4 389,-0.4 -0.997 37.0-168.2-145.3 140.8 31.8 21.8 56.7 39 39 A D + 0 0 88 -2,-0.4 -1,-0.1 385,-0.2 3,-0.1 0.006 51.0 130.6-110.6 20.2 31.8 21.8 60.5 40 40 A K S S- 0 0 89 1,-0.1 2,-0.3 383,-0.0 -2,-0.1 -0.356 70.9 -97.6 -61.5 157.7 33.2 18.3 60.5 41 41 A P - 0 0 81 0, 0.0 2,-0.2 0, 0.0 405,-0.2 -0.628 33.2-117.4 -87.2 137.2 36.1 18.2 62.9 42 42 A A - 0 0 7 403,-0.5 320,-0.2 -2,-0.3 3,-0.1 -0.562 14.4-159.7 -72.5 134.7 39.6 18.6 61.5 43 43 A K S S+ 0 0 67 318,-3.2 2,-0.3 -2,-0.2 319,-0.2 0.858 81.3 4.5 -73.8 -43.8 41.8 15.6 62.2 44 44 A N E -a 362 0A 4 317,-1.3 319,-0.8 272,-0.2 2,-0.3 -0.804 66.1-150.0-133.4 175.5 44.8 17.8 61.6 45 45 A I E -ab 363 318A 0 272,-0.8 274,-2.2 -2,-0.3 2,-0.4 -0.971 2.8-166.5-151.9 135.0 45.7 21.5 60.9 46 46 A I E -ab 364 319A 0 317,-2.7 319,-1.6 -2,-0.3 2,-0.5 -0.994 10.8-162.1-126.1 121.9 48.5 23.2 59.0 47 47 A L E -ab 365 320A 0 272,-2.6 274,-2.9 -2,-0.4 2,-0.7 -0.957 1.5-160.2-112.1 116.5 49.0 26.9 59.6 48 48 A L E -ab 366 321A 0 317,-3.8 319,-2.5 -2,-0.5 2,-0.6 -0.863 6.7-171.2-101.7 113.8 51.0 28.9 57.0 49 49 A I E -ab 367 322A 0 272,-2.5 274,-2.8 -2,-0.7 2,-0.9 -0.895 12.0-164.7-106.5 119.1 52.4 32.2 58.2 50 50 A G E > - b 0 323A 0 317,-2.9 3,-2.3 -2,-0.6 319,-0.3 -0.955 34.9-126.0 -99.2 101.6 54.0 34.4 55.6 51 51 A D T 3 S- 0 0 2 272,-1.8 276,-1.0 -2,-0.9 277,-0.1 -0.392 88.2 -7.8 -52.4 110.2 55.7 36.7 58.1 52 52 A G T 3 S+ 0 0 0 -2,-0.3 2,-1.7 1,-0.2 -1,-0.3 0.584 93.0 145.8 75.2 13.8 54.5 40.2 57.1 53 53 A M < + 0 0 3 -3,-2.3 -1,-0.2 314,-0.2 -3,-0.2 -0.525 19.2 159.8 -87.5 77.2 52.8 38.9 53.9 54 54 A G >> - 0 0 3 -2,-1.7 4,-1.5 -3,-0.1 3,-0.9 -0.323 59.9 -79.4 -87.4-179.3 49.9 41.2 53.7 55 55 A D H 3> S+ 0 0 8 1,-0.3 4,-2.5 2,-0.2 811,-0.7 0.736 130.6 53.9 -54.9 -32.7 47.8 41.9 50.5 56 56 A S H 3> S+ 0 0 18 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.899 109.7 49.2 -70.5 -36.0 50.4 44.3 49.0 57 57 A E H <> S+ 0 0 4 -3,-0.9 4,-1.0 2,-0.2 -2,-0.2 0.774 112.0 48.8 -71.9 -30.5 53.1 41.6 49.5 58 58 A I H X S+ 0 0 3 -4,-1.5 4,-2.7 2,-0.2 5,-0.3 0.959 113.0 45.5 -74.4 -51.1 50.8 39.1 47.8 59 59 A T H X S+ 0 0 4 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.944 111.3 52.3 -57.7 -52.1 50.0 41.3 44.8 60 60 A A H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.863 114.0 44.0 -52.9 -38.4 53.6 42.4 44.3 61 61 A A H X S+ 0 0 0 -4,-1.0 4,-3.3 -3,-0.2 5,-0.4 0.922 114.6 46.3 -75.4 -45.0 54.8 38.8 44.2 62 62 A R H X>S+ 0 0 0 -4,-2.7 4,-1.4 2,-0.2 5,-1.0 0.902 113.7 53.0 -63.2 -37.5 52.0 37.4 41.9 63 63 A N H X5S+ 0 0 3 -4,-3.1 4,-0.7 -5,-0.3 330,-0.5 0.955 116.6 35.7 -62.2 -53.2 52.6 40.4 39.7 64 64 A Y H <5S+ 0 0 23 -4,-2.0 329,-1.4 -5,-0.3 -2,-0.2 0.920 128.0 33.8 -69.3 -46.6 56.3 39.8 39.3 65 65 A A H <5S+ 0 0 21 -4,-3.3 -3,-0.2 -5,-0.2 -2,-0.2 0.968 136.8 13.3 -77.4 -56.8 56.2 36.0 39.3 66 66 A E H <5S- 0 0 80 -4,-1.4 -3,-0.2 -5,-0.4 -2,-0.1 0.421 107.7-110.3-101.1 -1.2 53.0 35.0 37.6 67 67 A G ><< - 0 0 0 -5,-1.0 3,-2.3 -4,-0.7 -1,-0.2 0.113 39.8 -74.3 85.5 153.6 52.0 38.3 36.0 68 68 A A T 3 S+ 0 0 0 1,-0.3 -1,-0.1 -5,-0.2 469,-0.1 0.837 136.6 42.9 -55.2 -40.9 49.0 40.5 37.1 69 69 A G T 3 S+ 0 0 14 -6,-0.1 -57,-2.5 -3,-0.1 -1,-0.3 0.284 100.5 107.7 -86.2 8.4 46.4 38.2 35.5 70 70 A G < - 0 0 11 -3,-2.3 2,-0.3 -59,-0.2 -3,-0.1 -0.139 60.3-140.5 -73.7-176.6 48.4 35.3 37.0 71 71 A F - 0 0 16 -5,-0.1 2,-0.6 -9,-0.1 -60,-0.1 -0.986 11.1-128.1-153.8 129.7 47.3 33.0 39.9 72 72 A F - 0 0 2 -2,-0.3 5,-0.5 1,-0.1 4,-0.3 -0.744 17.2-149.7 -79.5 119.1 49.2 31.5 42.9 73 73 A K S S+ 0 0 137 -2,-0.6 -1,-0.1 3,-0.2 274,-0.0 0.702 93.1 23.8 -63.1 -23.3 48.4 27.8 42.9 74 74 A G S > S+ 0 0 0 2,-0.1 3,-1.8 3,-0.1 4,-0.5 0.725 128.1 37.5-102.1 -79.7 48.8 27.7 46.7 75 75 A I G > S+ 0 0 0 1,-0.3 3,-0.9 2,-0.2 -2,-0.1 0.833 126.3 38.4 -41.2 -54.3 48.3 31.2 48.2 76 76 A D G 3 S+ 0 0 1 -4,-0.3 806,-0.5 1,-0.2 -1,-0.3 0.630 103.5 73.1 -76.0 -15.8 45.5 32.1 45.8 77 77 A A G < + 0 0 2 -3,-1.8 -70,-0.8 -5,-0.5 -1,-0.2 0.462 62.4 108.6 -78.7 -8.9 43.8 28.7 45.7 78 78 A L < - 0 0 0 -3,-0.9 343,-0.1 -4,-0.5 344,-0.1 -0.672 59.8-149.6 -75.6 113.6 42.2 28.6 49.2 79 79 A P S S+ 0 0 2 0, 0.0 2,-0.5 0, 0.0 343,-0.2 0.845 73.7 63.3 -45.4 -55.0 38.4 28.9 48.7 80 80 A L E +C 421 0A 0 341,-1.5 341,-2.4 800,-0.1 2,-0.3 -0.695 68.1 177.4 -86.5 128.6 37.3 30.7 51.9 81 81 A T E +C 420 0A 0 -2,-0.5 350,-0.8 450,-0.5 450,-0.5 -0.915 11.5 141.8-133.5 155.8 38.6 34.2 52.6 82 82 A G E -Cd 419 431A 0 337,-1.2 337,-1.6 -2,-0.3 2,-0.4 -0.915 39.8-101.4-167.8-177.2 38.5 37.2 55.0 83 83 A Q E -Cd 418 432A 1 348,-1.5 350,-1.5 -2,-0.3 2,-0.3 -0.989 31.8-164.9-124.2 133.8 40.3 40.0 56.7 84 84 A Y E -Cd 417 433A 0 333,-2.5 333,-1.4 -2,-0.4 2,-0.4 -0.769 16.1-125.5-120.5 160.7 41.5 39.9 60.3 85 85 A T E + d 0 434A 4 348,-1.4 350,-2.9 -2,-0.3 351,-0.2 -0.857 21.0 177.0-104.0 140.9 42.8 42.4 62.9 86 86 A H + 0 0 3 -2,-0.4 14,-0.3 328,-0.3 19,-0.1 0.009 18.3 153.6-135.0 29.6 46.1 42.0 64.7 87 87 A Y - 0 0 10 431,-0.1 11,-0.2 12,-0.1 12,-0.1 -0.207 30.4-145.6 -62.4 150.7 46.6 45.0 66.9 88 88 A A E -J 97 0B 3 9,-2.9 9,-1.8 26,-0.1 2,-0.4 -0.158 17.2-100.9 -98.9-159.0 48.8 44.5 69.9 89 89 A L E -Jk 96 116B 1 26,-1.5 28,-0.7 7,-0.3 2,-0.3 -0.944 17.2-122.0-130.7 147.6 48.6 46.1 73.4 90 90 A N > - 0 0 57 5,-3.5 4,-0.8 -2,-0.4 7,-0.1 -0.698 25.6-142.9 -78.0 140.7 50.4 48.8 75.2 91 91 A K T 4 S+ 0 0 85 -2,-0.3 -1,-0.2 2,-0.2 25,-0.0 0.935 93.7 46.2 -73.4 -46.4 51.9 47.2 78.3 92 92 A K T 4 S+ 0 0 200 1,-0.2 -1,-0.1 -3,-0.1 -2,-0.0 0.952 129.2 20.5 -60.8 -53.1 51.4 50.1 80.7 93 93 A T T 4 S- 0 0 92 2,-0.1 -1,-0.2 3,-0.0 -2,-0.2 0.514 90.6-129.5 -98.2 -8.8 47.7 50.9 79.8 94 94 A G < + 0 0 12 -4,-0.8 -3,-0.1 1,-0.2 372,-0.1 0.821 63.8 141.4 62.6 24.2 46.6 47.7 78.2 95 95 A K - 0 0 79 1,-0.1 -5,-3.5 750,-0.1 -1,-0.2 -0.535 63.2 -78.9 -91.4 163.3 45.4 50.0 75.4 96 96 A P E -J 89 0B 8 0, 0.0 2,-0.7 0, 0.0 -7,-0.3 -0.423 32.1-156.5 -69.4 134.3 45.6 49.0 71.7 97 97 A D E -J 88 0B 42 -9,-1.8 -9,-2.9 -2,-0.1 3,-0.1 -0.967 15.9-148.4-103.2 109.1 49.1 49.4 70.2 98 98 A Y S S+ 0 0 8 -2,-0.7 2,-0.5 749,-0.4 -12,-0.2 0.684 79.9 52.1 -59.4 -16.5 48.0 49.6 66.6 99 99 A V S S- 0 0 12 -12,-0.1 -1,-0.2 728,-0.1 -12,-0.1 -0.827 72.7-166.6-129.7 100.2 51.1 48.0 65.2 100 100 A T - 0 0 1 -2,-0.5 2,-0.1 -14,-0.3 313,-0.1 -0.231 10.5-138.4 -74.1 164.6 52.2 44.6 66.6 101 101 A D > - 0 0 23 311,-0.1 4,-1.0 269,-0.0 5,-0.2 -0.294 41.9 -83.8-106.5-167.2 55.5 42.9 66.1 102 102 A A H > S+ 0 0 5 2,-0.1 4,-2.0 1,-0.1 5,-0.2 0.877 122.2 54.7 -69.4 -37.4 56.1 39.2 65.5 103 103 A A H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.1 18,-0.3 0.950 107.8 40.7 -62.9 -62.5 56.0 38.3 69.2 104 104 A A H > S+ 0 0 3 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.944 117.5 49.5 -55.5 -50.5 52.7 39.7 70.4 105 105 A S H X S+ 0 0 1 -4,-1.0 4,-2.0 2,-0.2 5,-0.3 0.908 109.1 50.3 -52.4 -56.1 50.8 38.5 67.2 106 106 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.944 111.5 50.9 -46.8 -51.4 52.1 35.0 67.2 107 107 A T H X>S+ 0 0 0 -4,-2.1 4,-2.0 12,-0.3 5,-0.9 0.819 105.6 57.6 -57.6 -36.2 51.0 34.9 70.9 108 108 A A H X5S+ 0 0 3 -4,-1.9 4,-1.3 -3,-0.2 -1,-0.2 0.977 111.4 37.6 -63.9 -53.3 47.6 36.1 69.9 109 109 A W H <5S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.746 121.4 47.4 -72.4 -22.2 46.8 33.2 67.4 110 110 A S H <5S+ 0 0 0 -4,-1.9 22,-1.6 -5,-0.3 -1,-0.2 0.719 127.3 17.9 -93.0 -24.5 48.5 30.6 69.6 111 111 A T H <5S- 0 0 9 -4,-2.0 -3,-0.2 20,-0.2 -2,-0.1 0.660 95.7-124.1-113.8 -31.3 47.1 31.3 73.2 112 112 A G S < -k 89 0B 20 -2,-0.3 3,-1.9 -28,-0.2 2,-0.2 -0.608 56.7 -86.7 -88.8 151.5 52.3 43.6 74.3 117 117 A N T 3 S+ 0 0 51 -28,-0.7 -1,-0.1 1,-0.2 3,-0.1 -0.367 113.2 28.2 -56.0 128.6 55.0 43.7 71.5 118 118 A G T 3 S+ 0 0 10 1,-0.4 48,-0.5 -2,-0.2 -1,-0.2 0.190 91.3 120.5 103.4 -12.3 58.0 41.6 72.4 119 119 A A < - 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0 0 0 -4,-2.2 2,-0.4 2,-0.0 -1,-0.1 -0.851 51.1-160.5-113.3 149.6 29.6 58.3 29.3 612 162 B H + 0 0 9 -2,-0.3 2,-0.3 27,-0.2 -41,-0.2 -0.934 32.3 146.3-130.8 103.4 32.0 57.0 26.7 613 163 B V B -G 570 0L 0 -43,-2.4 -43,-2.3 -2,-0.4 -41,-0.3 -0.945 53.4-129.3-141.2 159.4 35.0 59.1 26.2 614 164 B T S S+ 0 0 31 -2,-0.3 2,-0.3 -45,-0.2 -1,-0.1 0.702 98.3 24.2 -77.8 -28.7 38.7 58.7 25.4 615 165 B S S > S- 0 0 26 -46,-0.1 3,-0.9 1,-0.1 -46,-0.2 -0.972 70.6-133.6-134.2 154.5 39.8 60.9 28.4 616 166 B R T 3 S+ 0 0 58 -48,-0.4 25,-0.1 -2,-0.3 -1,-0.1 0.817 99.1 74.3 -80.2 -22.0 38.1 61.7 31.7 617 167 B K T 3 + 0 0 135 1,-0.2 2,-1.4 -49,-0.1 -1,-0.2 0.507 67.4 100.9 -67.2 -2.2 38.9 65.3 31.4 618 168 B c < + 0 0 0 -3,-0.9 23,-2.7 1,-0.2 -1,-0.2 -0.322 44.4 151.2 -83.9 53.9 36.1 65.6 28.8 619 169 B Y - 0 0 41 -2,-1.4 23,-2.6 21,-0.2 22,-0.7 0.944 61.3 -25.1 -47.3 -84.5 33.6 67.0 31.2 620 170 B G S > S- 0 0 0 -3,-0.2 4,-1.7 20,-0.2 21,-0.2 -0.247 95.9 -48.0-117.8-155.8 31.3 69.2 29.2 621 171 B P H > S+ 0 0 7 0, 0.0 4,-1.9 0, 0.0 3,-0.2 0.926 122.2 45.2 -40.7 -77.0 31.5 71.1 25.8 622 172 B S H > S+ 0 0 65 1,-0.2 4,-1.3 2,-0.2 3,-0.1 0.837 116.4 42.1 -43.2 -57.9 34.8 73.1 25.9 623 173 B A H 4 S+ 0 0 25 1,-0.2 5,-0.4 2,-0.2 -1,-0.2 0.901 113.1 54.8 -62.0 -42.2 37.1 70.5 27.2 624 174 B T H >X S+ 0 0 2 -4,-1.7 4,-2.6 -3,-0.2 3,-1.2 0.869 102.9 54.5 -59.7 -41.4 35.7 67.7 25.0 625 175 B S H 3< S+ 0 0 31 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.929 118.6 35.6 -59.6 -41.9 36.1 69.6 21.7 626 176 B E T 3< S+ 0 0 133 -4,-1.3 -1,-0.2 2,-0.1 -2,-0.2 0.040 132.1 26.1-103.3 29.1 39.8 70.0 22.6 627 177 B K T <4 S+ 0 0 85 -3,-1.2 -3,-0.2 -12,-0.0 -2,-0.2 0.427 129.8 31.3-155.9 -29.1 40.5 66.7 24.3 628 178 B c >X + 0 0 0 -4,-2.6 3,-2.4 -5,-0.4 4,-2.0 -0.404 64.5 158.7-135.7 58.4 38.1 64.2 22.9 629 179 B P T 34 S+ 0 0 65 0, 0.0 8,-0.4 0, 0.0 6,-0.2 0.871 75.2 58.5 -48.4 -47.8 37.4 65.4 19.3 630 180 B G T 34 S+ 0 0 65 1,-0.3 8,-0.2 -3,-0.1 -5,-0.1 0.665 114.8 39.1 -57.7 -20.5 36.2 62.0 18.2 631 181 B N T <4 S+ 0 0 18 -3,-2.4 8,-2.2 -7,-0.3 -1,-0.3 0.708 87.4 118.3 -98.2 -33.5 33.6 62.4 20.9 632 182 B A <> - 0 0 0 -4,-2.0 5,-3.2 -8,-0.5 7,-0.1 -0.031 64.2-136.3 -38.4 131.4 32.8 66.1 20.4 633 183 B L T > 5S+ 0 0 42 1,-0.2 3,-2.5 3,-0.2 35,-0.2 0.976 105.4 48.0 -59.4 -52.7 29.2 66.7 19.5 634 184 B E T 3 5S+ 0 0 69 1,-0.3 -1,-0.2 2,-0.2 -2,-0.1 0.875 107.4 57.1 -57.8 -35.2 30.1 69.2 16.8 635 185 B K T 3 5S- 0 0 119 -6,-0.2 -1,-0.3 1,-0.1 -2,-0.2 0.296 129.2 -97.4 -79.1 12.2 32.7 66.8 15.5 636 186 B G T < 5S+ 0 0 72 -3,-2.5 -3,-0.2 1,-0.3 -2,-0.2 0.412 85.3 125.7 90.1 -2.1 30.1 64.2 15.0 637 187 B G S - 0 0 0 -2,-0.2 4,-3.3 -3,-0.1 -21,-0.2 -0.150 63.5-103.7 -64.8 167.1 30.9 65.4 26.5 641 191 B I H > S+ 0 0 0 -23,-2.7 4,-2.2 -22,-0.7 -21,-0.2 0.954 122.7 48.2 -60.5 -50.6 30.5 63.4 29.8 642 192 B T H >> S+ 0 0 0 -23,-2.6 4,-2.6 2,-0.2 3,-0.9 0.972 113.9 46.4 -53.9 -56.8 27.8 65.8 31.0 643 193 B E H 3> S+ 0 0 9 1,-0.3 4,-1.9 -24,-0.3 5,-0.2 0.942 113.5 49.0 -51.4 -55.0 26.0 65.7 27.7 644 194 B Q H 3X S+ 0 0 12 -4,-3.3 4,-1.7 1,-0.2 -1,-0.3 0.750 108.7 54.1 -55.6 -31.3 26.2 61.9 27.6 645 195 B L H + 0 0 27 52,-2.3 3,-2.3 53,-0.4 4,-0.2 0.965 62.7 63.6 -70.4 -45.7 26.9 72.0 39.0 659 209 B K G > S+ 0 0 97 52,-1.0 3,-2.4 1,-0.3 4,-0.4 0.763 90.4 62.5 -50.7 -35.4 29.4 74.2 37.1 660 210 B T G > S+ 0 0 5 51,-0.4 3,-0.6 1,-0.3 -1,-0.3 0.711 96.1 64.9 -67.6 -14.9 29.9 71.9 34.1 661 211 B F G < S+ 0 0 4 -3,-2.3 15,-1.7 -4,-0.3 -1,-0.3 0.499 84.4 74.4 -79.7 -7.4 26.2 72.5 33.5 662 212 B A G < S+ 0 0 69 -3,-2.4 -1,-0.2 -4,-0.2 -2,-0.2 0.706 76.4 99.0 -78.3 -16.4 26.9 76.2 32.8 663 213 B E S < S- 0 0 54 -3,-0.6 12,-3.2 -4,-0.4 2,-0.4 -0.357 71.9-133.0 -71.3 150.0 28.4 75.4 29.5 664 214 B T B -I 674 0N 65 10,-0.3 10,-0.3 11,-0.1 -42,-0.1 -0.840 24.1-110.3-103.1 140.9 26.2 75.8 26.4 665 215 B A - 0 0 4 8,-2.4 7,-2.9 5,-0.5 3,-0.1 -0.347 22.8-161.5 -68.1 153.2 26.0 73.1 23.8 666 216 B T S S+ 0 0 69 5,-0.2 -1,-0.1 6,-0.1 2,-0.1 0.832 72.8 18.1-101.3 -56.2 27.7 73.8 20.4 667 217 B A S S+ 0 0 26 4,-0.1 5,-0.1 3,-0.1 -33,-0.1 -0.172 96.5 61.4 -98.6-160.5 26.1 71.3 18.0 668 218 B G S > S- 0 0 42 -35,-0.2 3,-1.5 1,-0.1 -34,-0.0 0.213 98.1 -56.8 69.4 171.9 22.9 69.3 18.6 669 219 B E T 3 S+ 0 0 145 1,-0.3 -1,-0.1 0, 0.0 0, 0.0 0.898 134.5 46.1 -52.9 -43.7 19.2 70.0 19.1 670 220 B W T > S+ 0 0 63 2,-0.1 3,-1.4 3,-0.0 -5,-0.5 0.113 79.3 154.2 -96.2 25.7 20.0 72.2 22.2 671 221 B Q T < + 0 0 128 -3,-1.5 -5,-0.2 1,-0.2 -3,-0.1 -0.182 64.6 23.9 -53.4 136.2 22.8 74.2 20.6 672 222 B G T 3 S+ 0 0 51 -7,-2.9 -1,-0.2 1,-0.2 2,-0.2 -0.163 102.2 97.9 100.1 -41.5 23.2 77.6 22.2 673 223 B K S < S- 0 0 73 -3,-1.4 -8,-2.4 1,-0.1 -1,-0.2 -0.578 80.5-101.2 -88.6 147.8 21.6 76.8 25.6 674 224 B T B > -I 664 0N 34 -10,-0.3 4,-2.3 -2,-0.2 -10,-0.3 -0.188 32.6-114.4 -59.2 147.0 23.4 75.8 28.8 675 225 B L H > S+ 0 0 0 -12,-3.2 4,-1.6 -14,-0.2 -13,-0.2 0.826 115.4 63.6 -54.9 -24.7 23.5 72.1 29.6 676 226 B R H >> S+ 0 0 111 -15,-1.7 3,-1.5 -13,-0.3 4,-1.3 0.990 102.6 43.1 -64.7 -63.0 21.3 73.1 32.5 677 227 B E H 3> S+ 0 0 76 1,-0.3 4,-3.4 -16,-0.2 5,-0.3 0.889 109.4 59.2 -51.8 -43.0 18.4 74.3 30.6 678 228 B Q H 3X S+ 0 0 3 -4,-2.3 4,-0.9 2,-0.2 -1,-0.3 0.873 105.4 50.9 -52.1 -40.8 18.7 71.4 28.3 679 229 B A H X<>S+ 0 0 0 -4,-1.6 3,-2.9 -3,-1.5 5,-1.2 0.995 115.7 39.4 -57.0 -72.8 18.2 69.1 31.4 680 230 B Q H ><5S+ 0 0 96 -4,-1.3 3,-2.9 1,-0.3 -2,-0.2 0.878 113.5 56.0 -38.3 -59.2 15.0 71.0 32.5 681 231 B A H 3<5S+ 0 0 71 -4,-3.4 -1,-0.3 1,-0.3 -2,-0.2 0.705 108.0 51.1 -48.6 -27.7 13.8 71.3 28.9 682 232 B R T <<5S- 0 0 57 -3,-2.9 -1,-0.3 -4,-0.9 -2,-0.2 0.293 129.9 -86.7-100.3 12.2 14.1 67.5 28.7 683 233 B G T < 5S+ 0 0 32 -3,-2.9 -3,-0.2 1,-0.3 -2,-0.1 0.139 76.7 144.6 109.9 -23.3 12.1 66.5 31.8 684 234 B Y < - 0 0 11 -5,-1.2 2,-0.5 -6,-0.2 -1,-0.3 -0.298 43.0-142.4 -57.3 128.5 14.8 66.6 34.5 685 235 B Q E -c 705 0J 59 19,-3.5 21,-3.2 -2,-0.1 2,-0.5 -0.750 20.8-150.0 -85.7 130.9 13.7 67.8 38.0 686 236 B L E +c 706 0J 41 -2,-0.5 2,-0.4 19,-0.2 21,-0.2 -0.904 19.4 176.0-109.3 124.9 16.6 69.9 39.3 687 237 B V E -c 707 0J 13 19,-2.2 21,-2.4 -2,-0.5 3,-0.1 -0.984 13.7-178.6-125.5 146.9 17.2 70.0 43.1 688 238 B S + 0 0 76 -2,-0.4 2,-0.3 19,-0.2 19,-0.1 0.295 59.9 29.5-126.6 9.0 20.1 71.7 44.9 689 239 B D S > S- 0 0 45 1,-0.1 4,-3.2 57,-0.1 5,-0.2 -0.997 83.3 -91.2-162.5 167.5 19.7 71.0 48.6 690 240 B A H > S+ 0 0 25 55,-3.5 4,-2.3 -2,-0.3 5,-0.2 0.883 120.4 50.8 -49.0 -49.6 18.4 68.8 51.4 691 241 B A H > S+ 0 0 69 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.933 114.6 39.6 -56.5 -55.1 15.0 70.5 51.4 692 242 B S H 4 S+ 0 0 36 1,-0.2 3,-0.5 2,-0.2 4,-0.4 0.840 111.0 60.4 -67.5 -31.9 14.3 70.3 47.7 693 243 B L H >< S+ 0 0 4 -4,-3.2 3,-1.1 1,-0.2 -1,-0.2 0.936 105.0 49.6 -63.1 -37.1 15.7 66.8 47.7 694 244 B N H 3< S+ 0 0 112 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.691 97.1 67.8 -74.5 -18.4 13.0 65.8 50.2 695 245 B S T 3< S+ 0 0 99 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.546 78.3 103.5 -77.2 -10.1 10.1 67.3 48.3 696 246 B V < + 0 0 6 -3,-1.1 3,-0.1 -4,-0.4 9,-0.0 -0.435 34.5 161.3 -72.9 149.7 10.5 64.7 45.5 697 247 B T + 0 0 110 1,-0.7 2,-0.3 -2,-0.1 -1,-0.1 0.524 65.7 38.9-134.7 -39.3 8.0 61.8 45.4 698 248 B E + 0 0 76 2,-0.1 -1,-0.7 5,-0.0 2,-0.2 -0.779 55.6 171.1-112.6 156.6 8.2 60.4 41.9 699 249 B A + 0 0 7 -2,-0.3 2,-0.3 60,-0.2 -48,-0.1 -0.674 29.8 129.4-170.8 104.1 11.5 60.1 40.0 700 250 B N S > S- 0 0 33 3,-0.4 3,-1.3 -2,-0.2 -2,-0.1 -0.955 73.9 -66.7-156.7 176.2 11.0 58.1 36.8 701 251 B Q T 3 S+ 0 0 61 1,-0.3 -51,-0.0 -2,-0.3 -109,-0.0 0.622 135.1 39.0 -48.8 -20.9 11.7 58.2 33.2 702 252 B Q T 3 S+ 0 0 127 1,-0.2 -1,-0.3 -19,-0.0 -51,-0.0 0.704 128.3 33.4-100.4 -26.6 9.3 61.1 32.7 703 253 B K S < S+ 0 0 84 -3,-1.3 -3,-0.4 -19,-0.1 -2,-0.2 -0.483 80.7 177.3-125.1 58.6 10.3 62.8 35.9 704 254 B P - 0 0 0 0, 0.0 -19,-3.5 0, 0.0 2,-0.6 -0.341 24.7-130.5 -63.9 142.8 14.1 62.0 36.3 705 255 B L E -bc 652 685J 0 -54,-3.1 -52,-2.0 -21,-0.2 2,-0.6 -0.852 20.8-172.9-102.8 127.4 15.8 63.6 39.3 706 256 B L E -bc 653 686J 0 -21,-3.2 -19,-2.2 -2,-0.6 2,-0.6 -0.954 5.5-168.0-118.9 109.6 19.0 65.5 38.9 707 257 B G E +bc 654 687J 0 -54,-2.7 -52,-1.6 -2,-0.6 2,-0.5 -0.906 9.3 177.7-102.7 118.3 20.6 66.7 42.2 708 258 B L E +b 655 0J 12 -21,-2.4 -52,-0.2 -2,-0.6 -51,-0.1 -0.852 8.7 165.6-121.6 93.9 23.4 69.2 41.9 709 259 B F + 0 0 15 -54,-2.6 2,-0.3 -2,-0.5 -53,-0.2 0.381 61.3 23.8 -94.7 -0.4 24.4 69.9 45.4 710 260 B A S S- 0 0 19 -55,-0.3 -52,-2.3 1,-0.2 4,-0.1 -0.982 71.4-120.0-158.3 151.8 27.8 71.7 44.8 711 261 B D S S- 0 0 123 -2,-0.3 -52,-1.0 -54,-0.2 -51,-0.4 0.984 105.1 -11.2 -56.9 -54.5 29.6 73.6 42.0 712 262 B G S S- 0 0 17 1,-0.4 -55,-2.0 -55,-0.2 -54,-0.3 0.196 127.7 -6.1-111.2-127.7 32.3 70.9 42.1 713 263 B N S S- 0 0 63 -57,-0.2 -1,-0.4 1,-0.1 -114,-0.2 -0.358 78.9-101.6 -70.6 149.6 32.7 68.2 44.8 714 264 B M - 0 0 6 -116,-3.3 -1,-0.1 -4,-0.1 -4,-0.1 -0.419 50.4 -91.9 -70.4 140.2 30.5 68.2 47.9 715 265 B P - 0 0 39 0, 0.0 -1,-0.1 0, 0.0 60,-0.1 -0.151 46.3 -98.7 -54.8 148.8 32.2 69.5 51.1 716 266 B V - 0 0 19 1,-0.1 26,-0.3 -3,-0.1 23,-0.1 -0.315 18.3-131.6 -70.4 147.0 34.0 67.2 53.4 717 267 B R S S+ 0 0 53 70,-0.2 22,-2.6 1,-0.1 2,-0.3 0.955 84.6 32.7 -61.3 -55.8 32.5 65.8 56.6 718 268 B W E -J 738 0O 46 69,-0.4 2,-0.2 20,-0.3 -1,-0.1 -0.824 63.2-144.9-117.6 154.7 35.5 66.6 58.9 719 269 B L E +J 737 0O 84 18,-3.0 18,-1.9 -2,-0.3 20,-0.0 -0.660 31.6 142.6-104.3 156.6 38.2 69.1 59.4 720 270 B G - 0 0 11 -2,-0.2 67,-0.2 16,-0.2 16,-0.1 -0.789 52.4 -92.2 173.1 139.7 41.7 68.3 60.6 721 271 B P - 0 0 72 0, 0.0 65,-0.4 0, 0.0 2,-0.2 -0.257 49.4 -97.9 -62.8 167.1 45.1 69.7 59.6 722 272 B K - 0 0 86 62,-0.1 62,-0.2 1,-0.1 61,-0.1 -0.607 41.4 -95.4 -90.6 144.5 47.1 67.9 56.9 723 273 B A - 0 0 0 60,-2.8 2,-0.3 -2,-0.2 115,-0.2 -0.249 48.2-166.8 -56.8 141.7 49.9 65.4 57.6 724 274 B T E > -K 837 0P 49 113,-2.0 113,-2.7 -3,-0.1 3,-1.9 -0.824 32.9 -71.8-132.4 169.4 53.4 66.9 57.6 725 275 B Y E 3 S-K 836 0P 126 1,-0.3 111,-0.2 -2,-0.3 5,-0.1 -0.403 120.4 -10.4 -61.5 121.5 57.1 66.0 57.6 726 276 B H T >> S+ 0 0 30 109,-0.7 4,-3.4 107,-0.3 3,-2.3 0.560 93.9 141.8 61.8 10.0 57.9 64.6 61.1 727 277 B G H <> + 0 0 3 -3,-1.9 4,-1.3 1,-0.3 112,-0.3 0.731 61.6 62.7 -54.4 -26.4 54.5 65.8 62.2 728 278 B N H 34 S+ 0 0 13 -4,-0.3 -1,-0.3 110,-0.2 110,-0.1 0.726 119.8 25.8 -72.1 -22.8 53.9 62.8 64.4 729 279 B I H <4 S+ 0 0 82 -3,-2.3 -2,-0.2 101,-0.1 -1,-0.1 0.755 124.7 45.6-107.1 -40.3 56.9 63.8 66.4 730 280 B D H < S+ 0 0 127 -4,-3.4 -3,-0.2 -5,-0.1 -2,-0.1 0.725 113.3 50.5 -78.1 -20.2 57.2 67.5 66.0 731 281 B K S < S- 0 0 113 -4,-1.3 108,-0.2 -5,-0.4 3,-0.1 -0.795 88.4 -92.3-123.5 160.4 53.5 68.2 66.5 732 282 B P - 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