==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-AUG-02 1MG0 . COMPND 2 MOLECULE: ALCOHOL DEHYDROGENASE E CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS; . AUTHOR J.K.RUBACH,B.V.PLAPP . 1496 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 55126.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1008 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 144 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 201 13.4 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 . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 98 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 169 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 272 18.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 41 2.7 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 12 0 3 1 8 1 11 0 4 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 0 4 12 8 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 . 8 8 15 1 4 0 8 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 4 0 4 0 4 0 0 0 0 2 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 S 0 0 135 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -37.7 5.8 -30.1 6.9 2 2 A T > + 0 0 47 72,-0.2 3,-2.4 3,-0.0 73,-0.1 0.438 360.0 127.6 -98.2 -4.9 7.8 -27.9 9.4 3 3 A A T 3 S+ 0 0 59 1,-0.3 3,-0.1 71,-0.1 72,-0.1 -0.203 79.8 6.2 -59.1 138.3 4.6 -26.1 10.5 4 4 A G T 3 S+ 0 0 63 1,-0.2 2,-0.3 27,-0.1 -1,-0.3 0.491 111.1 107.5 71.0 2.6 4.2 -26.1 14.2 5 5 A K S < S- 0 0 122 -3,-2.4 2,-0.2 24,-0.1 -1,-0.2 -0.812 78.6-105.5-112.0 154.5 7.5 -27.8 14.8 6 6 A V - 0 0 81 -2,-0.3 2,-0.4 23,-0.1 23,-0.2 -0.569 40.3-141.1 -66.3 133.1 10.8 -26.5 16.1 7 7 A I E -A 28 0A 11 21,-2.5 21,-3.2 -2,-0.2 2,-0.5 -0.884 7.0-152.0-101.5 136.1 13.2 -26.0 13.2 8 8 A K E +A 27 0A 137 -2,-0.4 2,-0.3 19,-0.2 19,-0.2 -0.946 38.7 137.5-101.1 124.8 16.9 -26.9 13.4 9 9 A C E -A 26 0A 6 17,-2.0 17,-3.1 -2,-0.5 2,-0.3 -0.913 51.9 -82.2-154.5 175.5 18.9 -24.8 11.0 10 10 A K E +A 25 0A 95 -2,-0.3 138,-2.7 15,-0.2 139,-0.3 -0.698 43.5 166.8 -89.2 142.9 22.1 -22.8 10.5 11 11 A A E -AB 24 147A 0 13,-2.0 13,-2.3 -2,-0.3 2,-0.9 -0.970 40.1-114.1-146.5 157.2 22.5 -19.2 11.7 12 12 A A E -A 23 0A 0 134,-2.9 53,-0.5 -2,-0.3 2,-0.4 -0.859 38.2-166.3 -94.2 106.0 25.3 -16.7 12.1 13 13 A V E -A 22 0A 0 9,-2.6 9,-2.8 -2,-0.9 2,-0.7 -0.778 14.4-150.6 -95.4 133.3 25.5 -16.1 15.8 14 14 A L B +E 63 0B 0 49,-3.0 49,-2.1 -2,-0.4 7,-0.1 -0.920 19.9 173.2 -98.9 108.6 27.5 -13.2 17.3 15 15 A W + 0 0 56 -2,-0.7 2,-0.3 5,-0.3 -1,-0.1 0.823 64.3 6.9 -83.5 -34.0 28.6 -14.3 20.7 16 16 A E S > S- 0 0 117 4,-0.2 3,-0.8 47,-0.1 -1,-0.2 -0.975 85.6 -87.0-146.2 155.0 30.9 -11.4 21.6 17 17 A E T 3 S+ 0 0 53 -2,-0.3 37,-0.2 1,-0.2 36,-0.1 -0.249 105.9 17.7 -57.4 149.5 31.9 -8.0 20.2 18 18 A K T 3 S+ 0 0 142 35,-2.7 -1,-0.2 1,-0.2 36,-0.1 0.747 100.3 113.9 60.4 30.6 34.8 -7.8 17.7 19 19 A K S < S- 0 0 113 -3,-0.8 -1,-0.2 34,-0.1 3,-0.1 -0.892 73.0 -95.1-125.5 156.4 34.6 -11.5 16.8 20 20 A P - 0 0 87 0, 0.0 -5,-0.3 0, 0.0 -4,-0.2 -0.313 48.6 -97.8 -60.2 153.5 33.7 -13.3 13.6 21 21 A F - 0 0 6 -7,-0.1 2,-0.6 -6,-0.1 -7,-0.2 -0.484 36.0-133.9 -64.0 144.8 30.2 -14.6 13.3 22 22 A S E -A 13 0A 36 -9,-2.8 -9,-2.6 -2,-0.1 2,-0.8 -0.942 9.2-146.6-107.0 117.0 29.9 -18.3 14.2 23 23 A I E +A 12 0A 53 -2,-0.6 2,-0.3 -11,-0.2 -11,-0.2 -0.731 43.2 138.2 -82.1 110.8 27.9 -20.3 11.8 24 24 A E E -A 11 0A 28 -13,-2.3 -13,-2.0 -2,-0.8 2,-0.3 -0.923 55.9 -72.4-148.2 174.1 26.1 -23.0 13.8 25 25 A E E +A 10 0A 106 -2,-0.3 108,-0.4 -15,-0.2 2,-0.3 -0.510 48.1 177.7 -68.8 129.1 23.0 -25.0 14.5 26 26 A V E -A 9 0A 2 -17,-3.1 -17,-2.0 -2,-0.3 2,-0.5 -0.864 26.6-127.2-123.0 163.3 20.2 -23.0 16.2 27 27 A E E -AC 8 131A 76 104,-2.8 104,-1.9 -2,-0.3 2,-0.6 -0.973 19.3-160.6-111.2 125.8 16.7 -24.0 17.1 28 28 A V E -AC 7 130A 0 -21,-3.2 -21,-2.5 -2,-0.5 102,-0.2 -0.927 13.7-139.4-110.7 112.6 13.8 -21.8 15.8 29 29 A A - 0 0 30 100,-2.6 -23,-0.1 -2,-0.6 -24,-0.1 -0.243 29.1 -97.5 -60.9 153.8 10.5 -22.1 17.7 30 30 A P - 0 0 38 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 -0.398 53.5 -86.3 -64.8 154.6 7.2 -22.1 15.7 31 31 A P - 0 0 18 0, 0.0 47,-0.2 0, 0.0 3,-0.1 -0.401 39.8-146.6 -64.1 138.7 5.5 -18.7 15.5 32 32 A K > - 0 0 118 1,-0.2 3,-1.6 45,-0.1 45,-0.2 -0.188 54.0 -40.8 -86.6-171.9 3.1 -17.7 18.3 33 33 A A T 3 S+ 0 0 60 1,-0.3 -1,-0.2 44,-0.2 46,-0.2 -0.265 133.1 6.5 -54.6 135.3 -0.0 -15.6 17.8 34 34 A H T 3 S+ 0 0 98 44,-2.2 120,-2.6 1,-0.2 2,-0.3 0.793 106.1 118.7 59.8 29.7 0.5 -12.7 15.3 35 35 A E E < -G 153 0C 5 -3,-1.6 42,-3.1 118,-0.3 2,-0.4 -0.889 49.1-153.4-122.1 159.2 4.0 -14.0 14.5 36 36 A V E -GH 152 76C 0 116,-2.8 116,-2.6 -2,-0.3 2,-0.5 -0.997 5.5-147.7-138.6 125.0 5.4 -15.2 11.2 37 37 A R E -GH 151 75C 0 38,-2.2 37,-2.9 -2,-0.4 38,-1.5 -0.858 20.9-162.9 -99.7 131.0 8.2 -17.6 10.5 38 38 A I E -GH 150 73C 0 112,-2.7 112,-2.2 -2,-0.5 2,-0.7 -0.937 20.6-141.3-120.0 130.6 10.2 -16.9 7.4 39 39 A K E -GH 149 72C 92 33,-3.2 33,-2.6 -2,-0.4 110,-0.2 -0.844 36.9-127.5 -84.7 116.2 12.6 -19.1 5.3 40 40 A M E + H 0 71C 0 108,-2.1 31,-0.3 -2,-0.7 3,-0.1 -0.460 33.3 174.2 -71.7 136.7 15.3 -16.6 4.3 41 41 A V E - 0 0 44 29,-2.4 333,-1.8 1,-0.4 2,-0.3 0.786 66.5 -2.6-105.7 -44.8 16.2 -16.3 0.6 42 42 A A E -IH 373 70C 0 28,-2.1 28,-2.4 331,-0.2 -1,-0.4 -0.999 56.3-174.1-151.4 145.5 18.7 -13.4 0.6 43 43 A T E -IH 372 69C 0 329,-2.2 329,-3.4 -2,-0.3 26,-0.2 -0.996 15.4-140.5-144.1 135.3 20.2 -10.9 2.9 44 44 A G E -I 371 0C 0 24,-2.3 2,-0.8 -2,-0.4 24,-0.5 -0.546 20.4-119.9 -87.4 157.3 22.5 -7.9 2.4 45 45 A I - 0 0 2 325,-1.5 325,-0.3 -2,-0.2 2,-0.3 -0.875 34.4-170.8 -97.9 109.6 25.4 -6.9 4.6 46 46 A C >> - 0 0 4 -2,-0.8 3,-1.4 1,-0.1 4,-1.2 -0.741 34.4-119.8 -97.7 147.9 24.6 -3.4 5.9 47 47 A R H 3> S+ 0 0 96 -2,-0.3 4,-2.0 1,-0.3 3,-0.2 0.859 113.0 65.2 -52.6 -33.6 27.2 -1.2 7.7 48 48 A S H 3> S+ 0 0 29 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.842 96.8 54.1 -61.1 -31.3 24.8 -1.2 10.7 49 49 A D H <> S+ 0 0 0 -3,-1.4 4,-1.2 1,-0.2 3,-0.4 0.902 108.4 49.4 -68.0 -36.5 25.2 -5.0 11.1 50 50 A D H X S+ 0 0 11 -4,-1.2 4,-2.8 1,-0.2 -2,-0.2 0.837 101.6 63.0 -69.1 -31.9 29.0 -4.3 11.3 51 51 A H H X>S+ 0 0 19 -4,-2.0 6,-2.0 1,-0.2 5,-1.2 0.798 99.9 54.7 -59.7 -31.5 28.3 -1.6 13.9 52 52 A V H <5S+ 0 0 3 -4,-1.1 3,-0.4 -3,-0.4 -1,-0.2 0.924 110.1 45.7 -66.0 -44.0 26.9 -4.4 16.1 53 53 A V H <5S+ 0 0 6 -4,-1.2 -35,-2.7 1,-0.2 -2,-0.2 0.947 116.3 44.9 -61.5 -49.1 30.2 -6.3 15.7 54 54 A S H <5S- 0 0 38 -4,-2.8 -1,-0.2 -37,-0.2 -2,-0.2 0.555 110.4-118.7 -75.3 -9.3 32.3 -3.2 16.4 55 55 A G T <5S+ 0 0 17 -4,-0.7 242,-0.3 -3,-0.4 -3,-0.2 0.563 82.9 119.2 78.7 8.4 30.2 -2.1 19.4 56 56 A T S - 0 0 6 -42,-3.1 3,-1.4 -2,-0.3 -44,-0.2 -0.294 51.9 -69.9 -75.2 168.1 0.8 -17.9 14.0 78 78 A E T 3 S+ 0 0 171 1,-0.2 -44,-2.2 -47,-0.2 -1,-0.2 -0.348 118.5 20.6 -57.9 136.7 -2.9 -17.7 15.0 79 79 A G T 3 S+ 0 0 43 1,-0.3 -1,-0.2 -46,-0.2 2,-0.2 0.298 81.1 141.7 88.7 -8.8 -4.6 -14.5 14.1 80 80 A V < + 0 0 14 -3,-1.4 -1,-0.3 -45,-0.2 -4,-0.1 -0.457 14.6 164.1 -62.7 134.1 -2.1 -13.4 11.4 81 81 A T + 0 0 117 -2,-0.2 -1,-0.1 -3,-0.1 -2,-0.0 0.587 58.4 64.9-124.2 -20.3 -4.0 -11.7 8.5 82 82 A T S S+ 0 0 57 1,-0.1 2,-0.3 75,-0.0 77,-0.3 0.579 105.5 28.4 -93.0 -13.0 -1.5 -9.8 6.4 83 83 A V - 0 0 2 75,-0.1 -1,-0.1 76,-0.0 6,-0.0 -0.972 62.8-159.5-140.4 159.9 0.6 -12.7 5.0 84 84 A R > - 0 0 178 -2,-0.3 3,-2.2 -48,-0.0 -11,-0.3 -0.916 41.2 -73.4-133.0 159.5 0.2 -16.4 4.2 85 85 A P T 3 S+ 0 0 76 0, 0.0 -11,-0.2 0, 0.0 3,-0.1 -0.254 119.8 24.6 -50.6 136.1 2.5 -19.4 3.8 86 86 A G T 3 S+ 0 0 52 -13,-2.7 -12,-0.1 1,-0.3 2,-0.1 0.157 89.8 132.9 88.4 -17.0 4.4 -19.2 0.5 87 87 A D < - 0 0 30 -3,-2.2 -14,-2.6 -15,-0.1 -1,-0.3 -0.390 60.8-120.2 -62.6 142.8 4.1 -15.4 0.3 88 88 A K E +J 72 0C 49 72,-0.5 72,-2.5 -16,-0.2 2,-0.3 -0.670 44.1 178.5 -77.4 140.0 7.3 -13.5 -0.5 89 89 A V E -JK 71 159C 0 -18,-2.7 -18,-2.3 -2,-0.3 70,-0.2 -0.964 31.0-146.1-144.7 158.0 8.1 -11.0 2.3 90 90 A I E - K 0 158C 0 68,-2.0 68,-1.9 -2,-0.3 -20,-0.2 -0.992 28.1-127.8-126.0 123.5 10.5 -8.4 3.5 91 91 A P E - K 0 157C 0 0, 0.0 2,-0.6 0, 0.0 -22,-0.3 -0.437 20.8-136.7 -65.2 146.0 11.2 -8.1 7.3 92 92 A L - 0 0 3 64,-2.9 -24,-0.1 50,-0.2 4,-0.1 -0.916 16.2-169.6-114.0 106.3 10.8 -4.6 8.6 93 93 A F S S+ 0 0 14 -2,-0.6 22,-0.5 80,-0.4 -1,-0.1 0.735 90.1 50.6 -69.4 -22.0 13.4 -3.4 11.1 94 94 A T S S- 0 0 2 20,-0.1 -1,-0.2 -3,-0.1 230,-0.1 -0.986 95.2-146.0-108.6 113.8 11.2 -0.4 11.7 95 95 A P - 0 0 4 0, 0.0 16,-0.6 0, 0.0 229,-0.4 -0.152 9.6-146.4 -72.5 171.5 7.8 -1.8 12.4 96 96 A Q + 0 0 23 59,-1.9 61,-0.1 227,-0.1 14,-0.1 -0.740 20.3 172.2-136.1 90.8 4.4 -0.3 11.5 97 97 A C - 0 0 20 -2,-0.2 -1,-0.1 1,-0.1 59,-0.1 0.752 32.2-144.7 -70.9 -21.1 1.9 -1.1 14.2 98 98 A G S S+ 0 0 39 1,-0.1 -1,-0.1 57,-0.1 -2,-0.0 0.340 82.2 72.7 76.2 -5.3 -0.6 1.2 12.7 99 99 A K + 0 0 169 4,-0.0 -1,-0.1 5,-0.0 2,-0.0 0.676 69.5 90.3-116.2 -23.4 -1.9 2.2 16.1 100 100 A C S > S- 0 0 22 1,-0.1 4,-2.1 5,-0.0 5,-0.2 -0.243 86.6-104.0 -78.7 167.3 0.6 4.4 17.9 101 101 A R H > S+ 0 0 96 1,-0.2 4,-0.5 2,-0.2 7,-0.1 0.847 122.1 50.5 -59.6 -33.4 0.7 8.2 17.7 102 102 A V H >4 S+ 0 0 0 2,-0.2 3,-0.9 1,-0.2 -1,-0.2 0.932 109.0 48.7 -69.6 -46.9 3.7 8.0 15.4 103 103 A C H 34 S+ 0 0 15 1,-0.3 -2,-0.2 7,-0.1 -1,-0.2 0.835 112.8 50.4 -61.6 -31.6 2.0 5.5 12.9 104 104 A K H 3< S+ 0 0 153 -4,-2.1 -1,-0.3 3,-0.0 -2,-0.2 0.611 91.1 96.0 -83.7 -11.3 -1.1 7.8 12.9 105 105 A H S << S- 0 0 47 -3,-0.9 -5,-0.0 -4,-0.5 -3,-0.0 -0.604 77.4-133.5 -80.3 137.3 1.0 10.9 12.2 106 106 A P S S+ 0 0 106 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.796 104.0 31.6 -60.2 -28.7 1.2 11.9 8.4 107 107 A E S S+ 0 0 102 215,-0.0 -5,-0.1 554,-0.0 -4,-0.1 0.826 98.4 94.7 -98.3 -37.9 5.0 12.4 8.7 108 108 A G + 0 0 0 -6,-0.2 553,-0.1 -7,-0.1 578,-0.1 -0.127 28.0 160.3 -65.4 147.3 6.2 10.0 11.3 109 109 A N + 0 0 9 576,-0.3 2,-2.2 551,-0.2 215,-0.3 0.431 48.1 101.5-134.9 -11.1 7.6 6.5 10.6 110 110 A F - 0 0 1 575,-0.2 -8,-0.1 -8,-0.1 4,-0.1 -0.466 68.1-151.6 -82.7 71.4 9.5 5.7 13.8 111 111 A C > - 0 0 0 -2,-2.2 3,-2.1 -16,-0.6 -15,-0.0 -0.058 16.2-126.0 -47.3 136.6 6.8 3.4 15.2 112 112 A L T 3 S+ 0 0 87 1,-0.3 -1,-0.2 3,-0.1 -2,-0.0 0.624 106.5 67.5 -68.3 -10.1 6.8 3.3 19.0 113 113 A K T 3 S+ 0 0 106 42,-0.1 -1,-0.3 -18,-0.0 -2,-0.1 0.329 75.9 127.0 -85.7 5.7 7.0 -0.5 18.9 114 114 A N < - 0 0 21 -3,-2.1 4,-0.2 1,-0.1 -20,-0.1 -0.176 55.7-148.8 -62.1 156.7 10.6 -0.3 17.5 115 115 A D S S+ 0 0 16 -22,-0.5 26,-0.4 1,-0.1 6,-0.3 -0.017 80.6 83.3-111.8 29.4 13.4 -2.2 19.2 116 116 A L S S+ 0 0 29 3,-0.1 -1,-0.1 2,-0.1 -22,-0.0 0.838 82.8 50.6-102.0 -41.6 16.0 0.4 18.2 117 117 A S S S+ 0 0 54 1,-0.3 -2,-0.1 568,-0.0 -1,-0.0 0.925 130.9 12.6 -67.0 -51.7 15.8 3.2 20.8 118 118 A M S S- 0 0 165 -4,-0.2 -1,-0.3 -59,-0.0 -2,-0.1 -0.726 93.2-145.3-127.5 73.7 16.0 1.0 23.9 119 119 A P + 0 0 44 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.183 33.1 164.2 -55.0 123.7 17.1 -2.3 22.5 120 120 A R - 0 0 117 -5,-0.1 3,-0.1 2,-0.1 19,-0.1 0.590 38.8-139.8-100.1 -26.6 15.7 -5.5 24.2 121 121 A G + 0 0 0 -6,-0.3 18,-2.5 1,-0.2 2,-0.2 0.883 62.0 107.7 63.9 41.4 16.6 -7.9 21.4 122 122 A T S S- 0 0 20 16,-0.2 -1,-0.2 1,-0.1 20,-0.2 -0.771 76.9 -88.2-130.1 175.5 13.4 -9.8 21.7 123 123 A M > - 0 0 1 4,-2.6 3,-1.8 -2,-0.2 -1,-0.1 -0.272 61.4 -88.6 -64.0 172.7 10.1 -10.4 20.0 124 124 A Q T 3 S+ 0 0 51 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.857 129.0 59.9 -56.3 -37.0 7.3 -8.0 20.9 125 125 A D T 3 S- 0 0 79 2,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.381 118.5-109.9 -77.3 4.2 6.3 -10.2 23.9 126 126 A G S < S+ 0 0 33 -3,-1.8 2,-0.2 1,-0.3 -2,-0.1 0.614 84.9 101.3 81.0 13.5 9.8 -9.9 25.4 127 127 A T - 0 0 62 11,-0.0 -4,-2.6 9,-0.0 2,-0.3 -0.769 65.3-121.1-120.4 170.3 10.9 -13.5 24.7 128 128 A S - 0 0 34 -2,-0.2 10,-0.1 -6,-0.2 -6,-0.1 -0.845 6.1-157.0-113.4 151.0 13.1 -15.0 22.0 129 129 A R S S+ 0 0 8 -2,-0.3 -100,-2.6 22,-0.2 2,-0.4 0.369 71.7 88.3-100.5 2.5 12.4 -17.7 19.4 130 130 A F E +CD 28 137A 2 7,-0.6 7,-1.9 -102,-0.2 2,-0.4 -0.871 48.5 179.3-108.9 135.8 16.1 -18.7 19.1 131 131 A T E +CD 27 136A 49 -104,-1.9 -104,-2.8 -2,-0.4 2,-0.3 -0.992 3.0 175.2-128.5 138.6 18.1 -21.2 21.1 132 132 A C E > S- D 0 135A 3 3,-2.8 3,-2.8 -2,-0.4 -106,-0.1 -0.980 73.6 -7.0-142.6 132.9 21.8 -22.1 20.5 133 133 A R T 3 S- 0 0 160 -108,-0.4 -107,-0.1 -2,-0.3 -1,-0.0 0.828 129.8 -59.0 52.3 33.4 23.9 -24.4 22.6 134 134 A G T 3 S+ 0 0 69 1,-0.2 -1,-0.3 -107,-0.0 -108,-0.0 0.463 117.4 113.3 76.1 2.4 20.9 -24.5 25.0 135 135 A K E < S-D 132 0A 106 -3,-2.8 -3,-2.8 1,-0.0 -1,-0.2 -0.817 72.7-112.4-105.9 144.3 21.0 -20.8 25.5 136 136 A P E -D 131 0A 98 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.526 32.7-150.1 -68.8 141.6 18.4 -18.2 24.4 137 137 A I E -D 130 0A 1 -7,-1.9 -7,-0.6 -2,-0.2 -74,-0.2 -0.949 14.8-115.5-119.2 136.4 19.8 -15.9 21.6 138 138 A H B -f 63 0B 50 -76,-2.3 -74,-2.2 -2,-0.4 -16,-0.2 -0.360 19.9-131.3 -71.0 147.9 18.7 -12.3 21.1 139 139 A H - 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0 0 16 -5,-2.2 -1,-0.2 -25,-0.3 -22,-0.2 -0.361 25.4-150.3 -60.1 139.7 -2.5 25.1 18.3 592 217 B A S S+ 0 0 61 -24,-1.7 2,-0.4 1,-0.2 -23,-0.2 0.792 81.2 29.6 -80.2 -32.5 -4.7 23.3 20.9 593 218 B R E -s 569 0D 63 -25,-1.9 -23,-2.9 -7,-0.1 2,-0.4 -0.996 59.8-178.2-134.8 134.5 -2.0 23.5 23.7 594 219 B I E -s 570 0D 3 -2,-0.4 19,-2.0 -25,-0.2 20,-1.3 -0.918 12.3-162.4-137.8 102.2 0.7 26.1 24.3 595 220 B I E -su 571 614D 0 -25,-3.3 -23,-3.0 -2,-0.4 2,-0.3 -0.815 6.6-152.4 -93.7 112.6 2.9 25.4 27.2 596 221 B G E -su 572 615D 0 18,-2.7 20,-3.0 -2,-0.7 2,-0.5 -0.667 8.3-164.3 -83.6 136.4 4.8 28.4 28.5 597 222 B V E +su 573 616D 4 -25,-3.0 -23,-3.2 -2,-0.3 2,-0.3 -0.979 23.4 142.2-125.5 122.2 8.1 27.7 30.2 598 223 B D - 0 0 27 18,-1.7 6,-0.1 -2,-0.5 -2,-0.0 -0.983 47.6-141.3-153.6 146.9 9.9 30.4 32.4 599 224 B I S S+ 0 0 104 -2,-0.3 2,-0.7 18,-0.2 18,-0.1 0.519 94.4 72.8 -84.1 -5.6 11.9 30.5 35.6 600 225 B N > - 0 0 44 1,-0.1 3,-2.1 140,-0.0 4,-0.2 -0.881 66.5-167.0-110.8 102.0 10.2 33.8 36.5 601 226 B K G > S+ 0 0 144 -2,-0.7 3,-2.0 1,-0.3 4,-0.4 0.713 80.5 75.3 -64.7 -21.3 6.6 33.0 37.4 602 227 B D G 3 S+ 0 0 123 1,-0.3 4,-0.3 2,-0.2 -1,-0.3 0.599 88.8 64.0 -63.6 -12.7 5.6 36.7 37.2 603 228 B K G <> S+ 0 0 25 -3,-2.1 4,-1.6 1,-0.1 -1,-0.3 0.610 83.7 78.8 -80.8 -15.4 5.7 36.1 33.5 604 229 B F H <> S+ 0 0 30 -3,-2.0 4,-2.3 1,-0.2 5,-0.2 0.848 81.5 59.7 -70.6 -37.1 2.9 33.6 33.5 605 230 B A H > S+ 0 0 66 -4,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.940 111.4 40.2 -58.1 -48.3 -0.2 35.9 33.8 606 231 B K H > S+ 0 0 45 -4,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.882 110.8 58.8 -69.4 -38.6 0.6 37.7 30.5 607 232 B A H <>S+ 0 0 0 -4,-1.6 5,-2.7 1,-0.2 4,-0.4 0.912 109.8 44.1 -53.0 -44.9 1.6 34.5 28.8 608 233 B K H ><5S+ 0 0 115 -4,-2.3 3,-1.3 3,-0.2 -2,-0.2 0.910 107.4 59.4 -67.9 -42.9 -1.9 33.1 29.5 609 234 B E H 3<5S+ 0 0 138 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.875 108.8 44.8 -52.8 -40.1 -3.6 36.3 28.4 610 235 B V T 3<5S- 0 0 15 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.494 138.3 -71.1 -90.0 -1.2 -2.0 36.0 25.0 611 236 B G T < 5S+ 0 0 13 -3,-1.3 -3,-0.2 -4,-0.4 -17,-0.2 0.360 78.3 140.9 137.4 -6.3 -2.8 32.3 24.6 612 237 B A < - 0 0 7 -5,-2.7 -1,-0.3 -6,-0.2 -17,-0.2 -0.428 33.1-160.8 -64.3 133.3 -0.7 29.9 26.8 613 238 B T S S- 0 0 73 -19,-2.0 2,-0.3 1,-0.3 -18,-0.2 0.669 74.2 -0.3 -87.7 -18.0 -2.9 27.1 28.1 614 239 B E E -u 595 0D 50 -20,-1.3 -18,-2.7 -7,-0.1 2,-0.4 -0.963 64.6-147.0-162.3 156.8 -0.5 26.3 30.9 615 240 B C E -u 596 0D 22 -2,-0.3 2,-0.4 -20,-0.2 -18,-0.2 -0.993 9.6-164.1-134.9 144.6 2.8 27.5 32.3 616 241 B V E -u 597 0D 6 -20,-3.0 -18,-1.7 -2,-0.4 3,-0.1 -0.981 11.2-153.3-130.7 139.7 5.6 25.6 34.0 617 242 B N > - 0 0 8 -2,-0.4 3,-2.6 -20,-0.2 4,-0.3 -0.950 11.0-151.0-109.1 110.7 8.6 26.8 36.1 618 243 B P G > S+ 0 0 38 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.794 95.4 67.2 -49.5 -29.8 11.5 24.3 35.9 619 244 B Q G 3 S+ 0 0 137 1,-0.3 -20,-0.1 -3,-0.1 -3,-0.0 0.699 91.2 62.6 -67.1 -18.8 12.5 25.5 39.4 620 245 B D G < S+ 0 0 121 -3,-2.6 2,-0.3 2,-0.0 -1,-0.3 0.621 95.4 74.9 -77.2 -14.3 9.3 23.9 40.8 621 246 B Y < - 0 0 85 -3,-1.5 4,-0.1 -4,-0.3 7,-0.0 -0.774 64.8-149.8-111.3 146.5 10.3 20.4 39.8 622 247 B K S S+ 0 0 206 -2,-0.3 -1,-0.1 2,-0.1 -3,-0.1 0.460 86.7 59.9 -85.1 -2.2 12.8 17.9 41.2 623 248 B K S S- 0 0 104 -5,-0.1 -2,-0.1 1,-0.0 5,-0.1 -0.835 101.1 -79.2-124.7 161.2 13.2 16.5 37.7 624 249 B P >> - 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