==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 19-MAY-06 2DQ4 . COMPND 2 MOLECULE: L-THREONINE 3-DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR R.OMI,T.YAO,M.GOTO,I.MIYAHARA,K.HIROTSU,RIKEN STRUCTURAL . 686 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26367.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 495 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 9.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 92 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 63 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 149 21.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 2.8 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 6 1 3 1 1 3 3 2 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 7 3 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 . 2 6 4 4 2 0 0 2 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 . 3 0 2 0 0 2 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 39 0, 0.0 17,-2.5 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 134.3 77.5 44.5 41.4 2 2 A R E +A 17 0A 60 339,-0.2 121,-1.9 15,-0.2 122,-0.3 -0.636 360.0 165.3 -86.3 140.0 76.7 41.8 38.8 3 3 A A E -AB 16 122A 0 13,-2.1 13,-3.5 -2,-0.3 2,-0.5 -0.975 33.2-130.9-151.8 156.0 73.8 39.4 39.5 4 4 A L E +A 15 0A 0 117,-2.3 57,-1.3 -2,-0.3 2,-0.3 -0.958 37.9 178.5-115.4 117.5 71.8 36.9 37.5 5 5 A A E -AC 14 60A 0 9,-2.5 9,-3.3 -2,-0.5 2,-0.9 -0.899 41.1-130.8-131.4 154.1 68.0 37.4 38.0 6 6 A K E + C 0 59A 2 53,-2.8 53,-2.0 -2,-0.3 7,-0.1 -0.873 36.3 173.3 -92.4 106.9 64.6 36.1 37.0 7 7 A L + 0 0 77 -2,-0.9 -1,-0.2 51,-0.2 6,-0.1 0.728 55.8 16.5 -93.3 -23.8 63.0 39.5 36.2 8 8 A A S S- 0 0 29 2,-0.2 2,-2.4 3,-0.1 -1,-0.1 -0.890 92.6 -81.7-142.2 172.5 59.7 38.5 34.7 9 9 A P S S+ 0 0 99 0, 0.0 2,-0.3 0, 0.0 43,-0.0 -0.376 94.8 85.6 -75.6 67.3 57.3 35.4 34.5 10 10 A E S S- 0 0 110 -2,-2.4 37,-0.2 2,-0.2 -2,-0.2 -0.931 83.7 -73.8-154.4 174.8 59.1 33.7 31.6 11 11 A E S S+ 0 0 150 -2,-0.3 35,-0.2 35,-0.2 34,-0.1 -0.140 87.3 37.7 -68.6 171.9 62.0 31.4 30.8 12 12 A G S S- 0 0 23 33,-1.8 2,-0.3 -6,-0.1 -2,-0.2 -0.024 73.0-109.0 78.8 176.1 65.6 32.6 31.0 13 13 A L - 0 0 8 -7,-0.1 2,-0.5 -6,-0.1 -7,-0.2 -0.929 22.4-129.9-139.8 161.7 67.5 34.8 33.4 14 14 A T E -A 5 0A 64 -9,-3.3 -9,-2.5 -2,-0.3 2,-0.4 -0.959 11.4-130.9-128.3 129.4 68.9 38.3 33.0 15 15 A L E +A 4 0A 59 -2,-0.5 2,-0.3 -11,-0.2 -11,-0.2 -0.577 44.4 171.4 -72.1 125.1 72.4 39.5 33.9 16 16 A V E -A 3 0A 34 -13,-3.5 -13,-2.1 -2,-0.4 2,-0.5 -0.818 35.8-123.5-134.7 170.9 71.9 42.7 35.9 17 17 A D E +A 2 0A 129 -2,-0.3 -15,-0.2 -15,-0.2 -13,-0.0 -0.977 32.9 168.3-117.2 128.9 73.6 45.4 38.0 18 18 A R - 0 0 64 -17,-2.5 2,-0.1 -2,-0.5 -2,-0.0 -0.917 39.9-100.9-134.1 158.5 72.4 46.0 41.5 19 19 A P - 0 0 112 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.512 52.5 -91.3 -77.9 154.3 73.9 48.0 44.3 20 20 A V - 0 0 68 -2,-0.1 105,-0.1 1,-0.1 0, 0.0 -0.534 49.2-125.1 -66.8 123.1 75.7 46.0 47.0 21 21 A P - 0 0 44 0, 0.0 -1,-0.1 0, 0.0 104,-0.1 -0.119 16.5-129.0 -67.0 162.5 73.2 45.1 49.7 22 22 A E - 0 0 176 104,-0.1 2,-0.4 7,-0.0 104,-0.1 -0.956 15.2-123.7-118.5 135.9 73.7 45.8 53.4 23 23 A P - 0 0 20 0, 0.0 3,-0.1 0, 0.0 6,-0.1 -0.614 25.2-164.0 -80.9 126.8 73.3 43.4 56.2 24 24 A G > - 0 0 24 -2,-0.4 3,-1.5 1,-0.2 49,-0.1 0.031 51.3 -35.5 -85.1-157.4 70.9 44.4 58.9 25 25 A P T 3 S+ 0 0 107 0, 0.0 -1,-0.2 0, 0.0 50,-0.1 -0.398 132.1 11.3 -67.4 137.7 70.7 42.7 62.4 26 26 A G T 3 S+ 0 0 44 48,-0.6 103,-3.5 1,-0.3 104,-0.4 0.510 110.8 103.6 75.9 4.7 71.5 39.1 62.5 27 27 A E E < -D 128 0B 57 -3,-1.5 46,-2.8 101,-0.3 2,-0.3 -0.743 52.1-156.1-118.1 166.6 72.7 39.1 58.9 28 28 A I E -DE 127 72B 0 99,-2.4 99,-1.7 -2,-0.3 2,-0.6 -0.872 18.5-125.1-133.7 165.2 76.1 39.0 57.1 29 29 A L E -DE 126 71B 12 42,-2.9 41,-2.6 -2,-0.3 42,-1.3 -0.968 26.1-160.3-117.2 113.4 77.3 40.2 53.7 30 30 A V E -DE 125 69B 0 95,-2.9 95,-1.9 -2,-0.6 2,-1.0 -0.789 14.5-148.1 -96.8 130.6 79.0 37.4 51.7 31 31 A R E -DE 124 68B 69 37,-3.3 37,-2.5 -2,-0.4 93,-0.3 -0.883 33.3-133.3 -93.5 104.3 81.3 38.2 48.8 32 32 A V E + E 0 67B 0 91,-1.3 35,-0.3 -2,-1.0 3,-0.1 -0.411 31.7 176.3 -64.6 130.3 80.5 35.1 46.8 33 33 A E E + 0 0 30 33,-2.4 2,-0.3 1,-0.4 34,-0.2 0.617 68.9 5.6-106.6 -18.1 83.6 33.3 45.4 34 34 A A E - E 0 66B 0 32,-1.7 32,-2.8 107,-0.1 -1,-0.4 -0.931 59.2-174.4-167.3 140.4 81.8 30.3 43.8 35 35 A A E -FE 339 65B 1 304,-1.6 304,-2.6 -2,-0.3 2,-0.3 -0.914 8.7-155.0-134.6 159.1 78.3 29.1 43.1 36 36 A S E -FE 338 64B 0 28,-3.2 28,-0.7 -2,-0.3 27,-0.4 -0.869 7.9-137.5-132.4 170.0 76.8 26.0 41.6 37 37 A I + 0 0 3 300,-0.7 300,-0.4 -2,-0.3 2,-0.3 -0.956 20.3 170.9-130.3 147.8 73.6 25.0 39.8 38 38 A C >> - 0 0 28 -2,-0.3 4,-1.7 298,-0.1 3,-1.1 -0.864 53.5 -70.0-144.7 178.0 71.2 22.1 40.1 39 39 A G H 3> S+ 0 0 40 1,-0.3 4,-2.9 -2,-0.3 5,-0.2 0.775 124.7 60.0 -39.5 -41.2 67.8 20.8 38.8 40 40 A T H 3> S+ 0 0 48 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.950 105.5 47.6 -56.4 -50.2 66.0 23.4 40.9 41 41 A D H <> S+ 0 0 2 -3,-1.1 4,-2.5 1,-0.2 -1,-0.3 0.854 109.5 55.4 -58.3 -36.2 67.7 26.2 39.1 42 42 A L H X S+ 0 0 25 -4,-1.7 4,-2.4 2,-0.2 5,-0.3 0.949 103.4 53.6 -64.3 -46.8 66.8 24.4 35.9 43 43 A H H <>S+ 0 0 73 -4,-2.9 5,-1.4 1,-0.2 4,-0.4 0.917 112.1 45.2 -52.5 -45.1 63.1 24.4 36.9 44 44 A I H ><5S+ 0 0 1 -4,-2.1 3,-0.7 3,-0.2 -1,-0.2 0.900 110.2 56.5 -65.1 -39.2 63.4 28.2 37.3 45 45 A W H 3<5S+ 0 0 57 -4,-2.5 -33,-1.8 1,-0.3 -2,-0.2 0.978 114.6 35.1 -54.8 -64.2 65.4 28.5 34.0 46 46 A K T 3<5S- 0 0 100 -4,-2.4 -1,-0.3 -35,-0.2 -35,-0.2 0.406 104.9-133.0 -73.0 1.9 62.7 26.8 31.9 47 47 A W T < 5 + 0 0 34 -3,-0.7 -3,-0.2 -4,-0.4 -36,-0.1 0.927 42.3 172.0 44.7 64.1 59.9 28.4 34.0 48 48 A D >< - 0 0 40 -5,-1.4 4,-3.7 1,-0.0 5,-0.2 -0.265 50.5 -77.5 -93.0-174.2 57.9 25.3 34.4 49 49 A A H > S+ 0 0 63 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.945 129.8 51.6 -45.2 -61.5 54.8 24.5 36.6 50 50 A W H > S+ 0 0 95 1,-0.2 4,-0.6 2,-0.2 3,-0.4 0.922 114.4 41.1 -42.0 -65.0 56.9 24.1 39.7 51 51 A A H >> S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 3,-2.0 0.923 111.5 60.2 -51.2 -47.2 58.7 27.5 39.2 52 52 A R H 3< S+ 0 0 139 -4,-3.7 -1,-0.2 1,-0.3 -2,-0.2 0.890 109.1 39.9 -48.3 -50.1 55.4 29.0 38.2 53 53 A G H 3< S+ 0 0 59 -4,-2.6 -1,-0.3 -3,-0.4 -2,-0.2 0.459 128.0 33.1 -84.4 4.8 53.6 28.3 41.5 54 54 A R H << S+ 0 0 78 -3,-2.0 -2,-0.2 -4,-0.6 -3,-0.2 0.755 94.2 78.6-125.0 -44.9 56.7 29.1 43.5 55 55 A I < - 0 0 2 -4,-3.1 61,-0.1 -5,-0.2 -1,-0.1 -0.448 49.3-165.4 -76.2 142.6 59.0 31.9 42.2 56 56 A R - 0 0 170 59,-0.5 -1,-0.0 -2,-0.2 -4,-0.0 -0.775 33.5-111.3-130.8 90.1 58.0 35.6 42.5 57 57 A P S S+ 0 0 40 0, 0.0 -50,-0.2 0, 0.0 2,-0.1 -0.122 91.3 62.3 -54.3 153.0 60.2 37.9 40.2 58 58 A P S S+ 0 0 84 0, 0.0 2,-0.3 0, 0.0 -51,-0.2 0.525 77.6 147.0 -81.9 140.1 62.3 39.9 40.5 59 59 A L E -C 6 0A 6 -53,-2.0 -53,-2.8 58,-0.1 2,-0.7 -0.966 47.1-140.2-149.4 126.5 64.7 37.4 42.1 60 60 A V E -C 5 0A 2 -2,-0.3 59,-2.4 -55,-0.2 -55,-0.2 -0.740 38.5-149.3 -80.2 113.3 68.5 36.8 42.1 61 61 A T + 0 0 1 -57,-1.3 60,-2.3 -2,-0.7 -57,-0.2 -0.040 44.4 93.3 -80.1-175.8 68.8 33.0 41.9 62 62 A G - 0 0 0 52,-0.7 58,-1.7 58,-0.2 59,-0.2 0.453 25.9-178.5 101.3 123.2 71.3 30.5 43.2 63 63 A H + 0 0 9 -27,-0.4 2,-0.6 56,-0.2 26,-0.1 0.338 68.2 76.7-129.6 -0.5 71.4 28.5 46.4 64 64 A E E +E 36 0B 2 -28,-0.7 -28,-3.2 84,-0.1 2,-0.3 -0.853 68.3 125.4-114.9 92.7 74.7 26.6 46.1 65 65 A F E -E 35 0B 3 -2,-0.6 22,-1.3 -30,-0.3 2,-0.3 -0.970 38.1-162.3-148.8 163.2 77.5 29.0 46.9 66 66 A S E +EG 34 86B 0 -32,-2.8 -33,-2.4 -2,-0.3 -32,-1.7 -0.915 28.4 128.9-137.3 161.0 80.5 29.7 49.0 67 67 A G E -EG 32 85B 0 18,-2.2 18,-2.5 -35,-0.3 2,-0.4 -0.941 48.0 -59.9 179.7-156.9 82.4 33.0 49.7 68 68 A V E -EG 31 84B 7 -37,-2.5 -37,-3.3 -2,-0.3 2,-1.2 -0.924 40.7-113.9-123.1 143.7 83.9 35.4 52.2 69 69 A V E +E 30 0B 1 14,-2.6 13,-2.4 -2,-0.4 -39,-0.2 -0.627 36.2 176.1 -76.2 101.4 82.3 37.3 55.0 70 70 A E E - 0 0 74 -41,-2.6 2,-0.3 -2,-1.2 -1,-0.2 0.886 64.1 -17.5 -74.0 -40.9 82.7 40.9 53.7 71 71 A A E -E 29 0B 35 -42,-1.3 -42,-2.9 -3,-0.2 -1,-0.3 -0.975 61.9-131.9-164.1 153.5 80.9 42.5 56.6 72 72 A V E -E 28 0B 50 -2,-0.3 -44,-0.2 -44,-0.2 3,-0.1 -0.778 26.2-106.9-113.9 157.3 78.4 41.7 59.4 73 73 A G > - 0 0 2 -46,-2.8 3,-2.1 -2,-0.3 -49,-0.2 -0.262 57.6 -69.0 -74.1 164.8 75.2 43.3 60.6 74 74 A P T 3 S+ 0 0 92 0, 0.0 -48,-0.6 0, 0.0 -1,-0.2 -0.311 121.4 7.3 -57.7 132.1 75.0 45.3 63.8 75 75 A G T 3 S+ 0 0 61 1,-0.3 2,-0.5 -50,-0.1 -2,-0.1 0.431 89.7 138.1 78.2 -1.8 75.5 43.1 66.8 76 76 A V < + 0 0 22 -3,-2.1 -1,-0.3 1,-0.1 -4,-0.1 -0.670 22.0 172.3 -78.9 125.5 76.3 39.9 64.8 77 77 A R + 0 0 205 -2,-0.5 -1,-0.1 1,-0.3 -2,-0.0 0.505 48.6 83.2-112.2 -8.5 79.2 38.1 66.5 78 78 A R S S+ 0 0 199 2,-0.0 -1,-0.3 0, 0.0 2,-0.2 -0.947 86.2 20.3-149.6 129.8 79.3 34.9 64.4 79 79 A P S S- 0 0 10 0, 0.0 2,-0.3 0, 0.0 50,-0.0 0.511 87.1-137.4 -76.3-160.3 80.6 34.4 61.8 80 80 A Q > - 0 0 128 -2,-0.2 3,-2.8 -8,-0.0 -11,-0.3 -0.895 24.1 -85.2-128.6 155.4 83.3 37.1 61.4 81 81 A V T 3 S+ 0 0 96 -2,-0.3 -11,-0.2 1,-0.3 3,-0.1 -0.310 118.2 28.7 -54.0 128.1 84.7 39.4 58.7 82 82 A G T 3 S+ 0 0 26 -13,-2.4 -1,-0.3 1,-0.4 2,-0.2 0.199 87.9 135.2 102.9 -15.3 87.2 37.4 56.8 83 83 A D < - 0 0 27 -3,-2.8 -14,-2.6 -14,-0.2 2,-0.5 -0.463 52.7-135.0 -72.2 138.3 85.6 34.0 57.4 84 84 A H E +GH 68 135B 32 51,-0.5 51,-3.0 -16,-0.2 2,-0.3 -0.811 38.4 178.0 -88.8 125.9 85.3 31.6 54.4 85 85 A V E -GH 67 134B 0 -18,-2.5 -18,-2.2 -2,-0.5 2,-0.3 -0.921 32.3-150.7-138.4 161.6 81.8 30.1 54.5 86 86 A S E -GH 66 133B 1 47,-2.3 47,-2.9 -2,-0.3 2,-0.4 -0.824 31.5-123.1-116.7 159.6 79.3 27.9 52.8 87 87 A L E - H 0 132B 2 -22,-1.3 2,-0.6 -2,-0.3 -22,-0.2 -0.893 4.0-143.6-116.3 139.5 75.6 28.5 53.0 88 88 A E - 0 0 1 43,-2.5 -24,-0.1 -2,-0.4 25,-0.0 -0.856 19.3-153.9 -89.7 124.0 72.6 26.4 54.2 89 89 A S + 0 0 1 -2,-0.6 24,-2.3 -26,-0.1 2,-0.5 0.759 69.1 87.0 -73.1 -28.7 69.9 27.4 51.7 90 90 A H E -J 112 0C 26 22,-0.2 2,-0.7 20,-0.1 22,-0.2 -0.641 60.9-163.1 -77.9 121.0 67.0 26.6 54.1 91 91 A I E -J 111 0C 16 20,-2.7 20,-2.0 -2,-0.5 2,-0.3 -0.923 19.4-148.4-103.0 111.9 66.1 29.6 56.3 92 92 A V - 0 0 11 -2,-0.7 18,-0.1 18,-0.2 12,-0.1 -0.621 14.9-141.2 -92.6 145.6 64.0 28.1 59.1 93 93 A C - 0 0 42 -2,-0.3 -1,-0.1 11,-0.1 17,-0.0 0.735 18.1-149.1 -70.8 -26.9 61.2 29.8 61.1 94 94 A H S S+ 0 0 97 1,-0.1 -1,-0.1 10,-0.1 -2,-0.0 0.807 79.2 86.3 60.3 25.9 62.0 28.4 64.6 95 95 A A + 0 0 67 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 -0.098 68.4 76.8-150.4 46.9 58.2 28.6 65.2 96 96 A C S > S- 0 0 7 1,-0.1 4,-2.4 478,-0.0 5,-0.2 -0.936 87.4 -98.2-148.9 167.8 56.5 25.4 63.9 97 97 A P H > S+ 0 0 35 0, 0.0 4,-2.2 0, 0.0 6,-0.2 0.907 121.6 55.7 -57.4 -38.3 56.0 21.7 64.9 98 98 A A H 4>S+ 0 0 0 1,-0.2 5,-3.3 2,-0.2 9,-0.1 0.901 110.3 42.1 -61.9 -44.3 58.9 20.8 62.6 99 99 A C H >45S+ 0 0 5 3,-0.2 3,-1.7 2,-0.2 5,-0.2 0.908 112.0 54.0 -70.9 -41.4 61.5 23.2 64.2 100 100 A R H 3<5S+ 0 0 186 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.950 109.2 49.6 -55.2 -47.4 60.4 22.4 67.8 101 101 A T T 3<5S- 0 0 69 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.472 120.9-110.7 -70.4 -5.0 60.9 18.7 67.1 102 102 A G T < 5S+ 0 0 20 -3,-1.7 2,-0.5 -4,-0.1 3,-0.2 0.689 83.2 125.6 81.5 17.5 64.3 19.4 65.7 103 103 A N > < + 0 0 20 -5,-3.3 3,-1.8 -6,-0.2 -3,-0.1 -0.492 20.4 151.7-106.1 60.6 63.3 18.6 62.1 104 104 A Y G > + 0 0 71 -2,-0.5 3,-1.6 1,-0.3 -1,-0.2 0.725 60.9 73.8 -60.9 -27.2 64.4 22.0 60.7 105 105 A H G 3 S+ 0 0 9 1,-0.3 -1,-0.3 -3,-0.2 519,-0.1 0.633 106.0 37.5 -65.1 -12.0 65.1 20.4 57.3 106 106 A V G < S+ 0 0 11 -3,-1.8 -1,-0.3 492,-0.1 -2,-0.2 0.011 78.1 159.5-129.5 29.9 61.3 20.3 56.9 107 107 A C X - 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0 0 71 -41,-2.2 2,-0.3 -2,-0.8 -1,-0.2 0.680 63.4 -2.7 -93.1 -23.8 50.6 -32.2 76.5 415 71 B A E -B 373 0H 31 -42,-1.5 -42,-3.8 -3,-0.1 -1,-0.3 -0.970 60.6-149.7-164.0 151.9 53.7 -33.9 75.1 416 72 B V E -B 372 0H 46 -2,-0.3 -44,-0.3 -44,-0.3 3,-0.1 -0.885 26.5-109.1-125.8 159.6 57.1 -33.0 73.8 417 73 B G > - 0 0 3 -46,-3.0 3,-2.3 -2,-0.3 -49,-0.2 -0.353 54.8 -64.9 -84.4 167.5 59.2 -34.7 71.2 418 74 B P T 3 S+ 0 0 92 0, 0.0 -48,-0.7 0, 0.0 -1,-0.2 -0.255 122.2 8.3 -51.9 129.5 62.5 -36.6 71.9 419 75 B G T 3 S+ 0 0 51 1,-0.2 2,-0.8 -50,-0.1 3,-0.1 0.361 83.1 143.1 81.9 -3.8 65.1 -34.2 73.2 420 76 B V < - 0 0 21 -3,-2.3 -1,-0.2 1,-0.2 -4,-0.0 -0.601 24.2-178.6 -74.6 109.8 62.9 -31.1 73.6 421 77 B R + 0 0 176 -2,-0.8 -1,-0.2 1,-0.3 -2,-0.1 0.813 55.0 71.8 -75.4 -31.5 64.2 -29.5 76.8 422 78 B R S S+ 0 0 189 -3,-0.1 -1,-0.3 2,-0.1 2,-0.2 -0.991 81.3 22.7-158.2 148.3 61.6 -26.7 76.7 423 79 B P S S- 0 0 9 0, 0.0 2,-0.3 0, 0.0 6,-0.0 0.509 83.3-137.2 -66.2-165.3 58.8 -25.9 77.0 424 80 B Q > - 0 0 123 -2,-0.2 3,-2.8 1,-0.1 -11,-0.3 -0.902 22.3 -84.1-127.9 153.9 57.6 -28.7 79.3 425 81 B V T 3 S+ 0 0 96 -2,-0.3 -11,-0.2 1,-0.3 3,-0.1 -0.219 117.9 25.9 -50.2 131.8 54.6 -30.9 79.7 426 82 B G T 3 S+ 0 0 26 -13,-3.4 -1,-0.3 1,-0.3 -12,-0.1 0.136 88.2 134.0 98.5 -22.5 52.0 -29.0 81.7 427 83 B D < - 0 0 26 -3,-2.8 -14,-2.6 -14,-0.1 2,-0.5 -0.315 55.3-129.9 -63.4 146.8 53.2 -25.5 80.6 428 84 B H E -DE 412 479H 30 51,-0.5 51,-2.4 -16,-0.2 2,-0.3 -0.841 38.3-177.6 -94.0 131.7 50.6 -23.0 79.5 429 85 B V E -DE 411 478H 0 -18,-2.3 -18,-1.6 -2,-0.5 2,-0.3 -0.952 31.6-153.3-140.4 156.8 51.6 -21.5 76.2 430 86 B S E -DE 410 477H 1 47,-2.2 47,-2.6 -2,-0.3 2,-0.4 -0.775 33.2-128.1-111.2 158.4 50.7 -19.0 73.5 431 87 B L E - E 0 476H 3 -22,-1.0 2,-0.5 -2,-0.3 -22,-0.3 -0.948 4.2-139.4-123.0 138.8 52.0 -19.7 70.0 432 88 B E - 0 0 2 43,-1.9 25,-0.1 -2,-0.4 -24,-0.1 -0.781 18.4-150.2 -84.0 127.3 53.9 -17.6 67.5 433 89 B S S S+ 0 0 2 -2,-0.5 24,-2.3 23,-0.1 2,-0.4 0.800 71.5 84.9 -73.7 -28.2 52.2 -18.4 64.1 434 90 B H E -G 456 0I 26 22,-0.2 2,-0.7 20,-0.1 22,-0.2 -0.611 61.2-161.4 -81.8 126.2 55.4 -17.8 62.1 435 91 B I E -G 455 0I 19 20,-3.1 20,-1.7 -2,-0.4 2,-0.2 -0.937 18.4-153.2-107.3 114.1 57.8 -20.7 61.8 436 92 B V - 0 0 12 -2,-0.7 18,-0.1 18,-0.2 13,-0.1 -0.629 15.1-140.5 -93.8 150.5 61.2 -19.3 60.7 437 93 B C - 0 0 41 -2,-0.2 -1,-0.1 11,-0.1 11,-0.0 0.705 15.6-148.9 -81.1 -26.4 63.9 -21.0 58.7 438 94 B H S S+ 0 0 96 1,-0.1 -1,-0.0 10,-0.1 -2,-0.0 0.660 81.9 81.9 65.1 13.4 67.1 -19.8 60.5 439 95 B A S S+ 0 0 77 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 -0.106 71.4 76.6-142.6 38.9 68.9 -20.1 57.1 440 96 B C S > S- 0 0 6 1,-0.0 4,-1.6 13,-0.0 5,-0.1 -0.844 88.4-100.4-137.9 172.3 68.0 -16.9 55.1 441 97 B P H > S+ 0 0 37 0, 0.0 4,-2.2 0, 0.0 6,-0.2 0.862 118.8 55.3 -68.4 -35.2 69.3 -13.3 55.4 442 98 B A H >>S+ 0 0 0 1,-0.2 5,-2.4 2,-0.2 4,-0.9 0.956 110.3 46.2 -61.7 -47.0 66.4 -12.0 57.3 443 99 B C H >45S+ 0 0 5 1,-0.2 3,-0.5 2,-0.2 -1,-0.2 0.868 110.0 54.9 -62.2 -35.2 66.9 -14.6 60.0 444 100 B R H 3<5S+ 0 0 176 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.904 108.7 48.3 -63.3 -41.3 70.6 -13.9 60.0 445 101 B T H 3<5S- 0 0 74 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.605 119.5-108.9 -73.2 -16.1 69.8 -10.2 60.6 446 102 B G T <<5S+ 0 0 23 -4,-0.9 2,-1.1 -3,-0.5 3,-0.3 0.474 83.7 126.9 95.9 1.4 67.4 -11.0 63.5 447 103 B N > < + 0 0 30 -5,-2.4 3,-2.4 -6,-0.2 -4,-0.2 -0.319 21.0 152.2 -88.5 53.2 64.4 -10.0 61.3 448 104 B Y G > + 0 0 68 -2,-1.1 3,-1.7 1,-0.3 -1,-0.2 0.771 59.7 72.8 -53.2 -31.5 62.6 -13.3 61.9 449 105 B H G 3 S+ 0 0 15 -3,-0.3 -1,-0.3 1,-0.3 -169,-0.1 0.623 107.3 35.3 -62.3 -13.0 59.3 -11.6 61.4 450 106 B V G < S+ 0 0 10 -3,-2.4 -1,-0.3 -196,-0.1 -2,-0.2 -0.008 80.9 164.0-131.1 29.9 60.0 -11.4 57.6 451 107 B C X - 0 0 6 -3,-1.7 3,-1.8 1,-0.2 -3,-0.1 -0.203 43.4-129.2 -48.7 132.1 62.0 -14.7 57.1 452 108 B L T 3 S+ 0 0 87 1,-0.3 -1,-0.2 -198,-0.1 -4,-0.0 0.764 108.5 42.3 -58.9 -27.0 62.1 -15.4 53.4 453 109 B N T 3 S+ 0 0 89 2,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.113 82.1 162.2-110.5 22.5 60.9 -18.9 54.1 454 110 B T < - 0 0 29 -3,-1.8 2,-0.4 -20,-0.1 -18,-0.2 -0.100 18.7-166.7 -45.1 131.3 58.2 -18.1 56.6 455 111 B Q E -G 435 0I 75 -20,-1.7 -20,-3.1 -22,-0.0 2,-0.5 -0.979 10.7-146.3-120.4 135.4 55.6 -20.9 57.1 456 112 B I E >>> -G 434 0I 30 -2,-0.4 4,-2.8 -22,-0.2 3,-2.1 -0.906 12.7-122.8-115.2 124.1 52.4 -20.0 59.1 457 113 B L B 345S+h 461 0J 0 -24,-2.3 6,-0.2 -2,-0.5 5,-0.2 -0.284 101.2 17.5 -55.2 137.5 50.4 -22.3 61.4 458 114 B G T 345S+ 0 0 0 3,-1.9 -52,-0.6 -54,-0.2 -1,-0.3 0.524 129.9 53.1 76.4 3.5 46.8 -22.6 60.2 459 115 B V T <45S+ 0 0 5 -3,-2.1 -59,-0.4 2,-0.4 -2,-0.2 0.573 122.0 16.4-131.9 -53.4 47.8 -21.3 56.8 460 116 B D T <5S+ 0 0 54 -4,-2.8 2,-0.3 1,-0.2 -3,-0.2 0.664 136.2 14.2 -97.5 -24.7 50.6 -23.3 55.4 461 117 B R B -A 371 0H 20 0, 0.0 3,-2.1 0, 0.0 4,-0.3 -0.422 38.0-127.6 -64.0 137.4 57.9 -26.3 66.7 473 129 B A G > S+ 0 0 11 -103,-3.4 3,-1.4 1,-0.3 -102,-0.1 0.866 108.7 58.9 -54.6 -36.0 59.1 -26.3 70.3 474 130 B E G 3 S+ 0 0 94 -104,-0.4 -1,-0.3 1,-0.3 -103,-0.1 0.590 94.7 65.6 -70.8 -9.1 60.8 -22.9 69.7 475 131 B N G < S+ 0 0 3 -3,-2.1 -43,-1.9 -44,-0.0 2,-0.5 0.542 79.8 100.6 -90.7 -6.0 57.4 -21.3 68.8 476 132 B A E < -E 431 0H 17 -3,-1.4 2,-0.6 -4,-0.3 -45,-0.2 -0.683 52.7-164.4 -88.2 125.7 55.9 -21.8 72.3 477 133 B W E -E 430 0H 55 -47,-2.6 -47,-2.2 -2,-0.5 2,-0.4 -0.927 19.8-136.6-108.1 112.6 55.8 -18.8 74.7 478 134 B V E -E 429 0H 67 -2,-0.6 -49,-0.3 -49,-0.2 3,-0.0 -0.543 20.8-161.9 -72.6 124.1 55.1 -20.0 78.3 479 135 B N E -E 428 0H 8 -51,-2.4 -51,-0.5 -2,-0.4 2,-0.1 -0.640 33.7 -85.1-102.7 161.1 52.6 -17.9 80.2 480 136 B P > - 0 0 49 0, 0.0 3,-2.5 0, 0.0 -1,-0.1 -0.443 44.2-118.2 -62.6 139.2 51.9 -17.6 84.0 481 137 B K T 3 S+ 0 0 126 1,-0.3 -52,-0.0 -2,-0.1 -2,-0.0 0.755 112.3 57.6 -54.8 -24.9 49.6 -20.5 84.9 482 138 B D T 3 S+ 0 0 143 2,-0.1 -1,-0.3 3,-0.0 3,-0.0 0.496 76.1 109.5 -88.2 0.7 47.0 -18.0 86.1 483 139 B L S < S- 0 0 20 -3,-2.5 2,-0.2 1,-0.1 -4,-0.1 -0.612 80.7-114.0 -73.4 124.7 46.7 -16.2 82.7 484 140 B P >> - 0 0 70 0, 0.0 4,-2.4 0, 0.0 3,-1.3 -0.440 14.5-132.6 -64.1 129.5 43.3 -17.1 81.3 485 141 B F H 3> S+ 0 0 45 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.878 105.5 64.4 -47.0 -41.8 43.7 -19.2 78.1 486 142 B E H 34 S+ 0 0 82 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.887 108.6 38.6 -49.4 -46.2 41.1 -16.9 76.5 487 143 B V H X4 S+ 0 0 9 -3,-1.3 3,-1.5 1,-0.2 -1,-0.2 0.908 113.2 56.2 -74.9 -39.0 43.5 -13.9 76.8 488 144 B A H >< S+ 0 0 2 -4,-2.4 3,-1.3 1,-0.3 4,-0.3 0.832 99.7 62.5 -59.2 -33.1 46.5 -16.1 76.0 489 145 B A T 3< S+ 0 0 0 -4,-2.8 -109,-0.3 1,-0.2 -1,-0.3 0.709 104.5 46.6 -67.5 -21.6 44.8 -17.1 72.7 490 146 B I T <> S+ 0 0 0 -3,-1.5 4,-1.7 -4,-0.4 -1,-0.2 0.238 78.8 98.4-107.9 16.7 44.8 -13.5 71.5 491 147 B L H <> S+ 0 0 3 -3,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.797 78.2 62.8 -70.9 -26.5 48.4 -12.6 72.3 492 148 B E H > S+ 0 0 11 -4,-0.3 4,-1.1 -3,-0.3 -1,-0.2 0.982 108.5 37.4 -64.6 -56.3 49.4 -13.3 68.7 493 149 B P H > S+ 0 0 0 0, 0.0 4,-1.1 0, 0.0 3,-0.5 0.894 114.3 58.3 -63.8 -31.5 47.1 -10.6 67.2 494 150 B F H >X S+ 0 0 2 -4,-1.7 4,-2.5 1,-0.3 3,-0.6 0.902 98.2 60.5 -59.7 -43.1 48.0 -8.3 70.2 495 151 B G H 3X S+ 0 0 4 -4,-2.5 4,-3.3 1,-0.3 -1,-0.3 0.860 97.3 58.9 -52.5 -40.0 51.6 -8.7 69.2 496 152 B N H 3X S+ 0 0 22 -4,-1.1 4,-2.0 -3,-0.5 -1,-0.3 0.894 108.6 44.7 -56.2 -43.9 50.8 -7.1 65.8 497 153 B A H < S+ 0 0 0 -4,-2.0 3,-0.6 -5,-0.2 -2,-0.2 0.923 114.7 47.5 -59.2 -49.6 53.3 -1.3 65.2 501 157 B V H 3< S+ 0 0 0 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.897 117.2 39.5 -62.7 -44.9 53.1 0.9 68.2 502 158 B Y H 3< S+ 0 0 61 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.392 90.3 108.6 -90.0 2.5 56.7 0.4 69.4 503 159 B A S X< S- 0 0 17 -4,-0.7 3,-2.0 -3,-0.6 100,-0.0 -0.333 84.4 -2.2 -71.7 162.7 58.3 0.5 66.0 504 160 B G T 3 S- 0 0 46 1,-0.3 3,-0.1 3,-0.0 -3,-0.0 -0.291 139.0 -14.0 58.9-131.3 60.4 3.5 65.2 505 161 B S T 3 S- 0 0 58 1,-0.3 -1,-0.3 2,-0.0 3,-0.2 0.348 92.9-133.8 -87.2 4.5 60.3 6.1 67.9 506 162 B G < - 0 0 11 -3,-2.0 -1,-0.3 1,-0.2 -4,-0.1 -0.312 22.9 -89.7 74.2-161.0 57.4 4.6 69.8 507 163 B V > + 0 0 1 24,-0.1 3,-1.8 -3,-0.1 27,-0.3 0.479 69.5 133.0-132.0 -5.3 54.5 6.7 71.1 508 164 B S T 3 S- 0 0 82 1,-0.3 25,-0.2 -3,-0.2 24,-0.2 -0.325 87.9 -2.2 -58.4 118.3 55.4 7.9 74.7 509 165 B G T 3 S+ 0 0 65 23,-2.6 2,-0.3 1,-0.2 -1,-0.3 0.785 111.2 114.6 71.4 30.8 54.6 11.6 75.0 510 166 B K S < S- 0 0 46 -3,-1.8 24,-2.2 22,-0.2 2,-0.2 -0.959 71.4-109.0-134.8 150.7 53.5 12.0 71.3 511 167 B S - 0 0 8 -2,-0.3 67,-1.7 22,-0.2 66,-1.1 -0.556 42.4-166.7 -74.7 137.2 50.4 12.8 69.4 512 168 B V E -rs 536 578E 0 23,-2.2 25,-2.4 -2,-0.2 2,-0.5 -0.974 18.6-162.9-132.3 141.7 49.0 9.7 67.7 513 169 B L E -rs 537 579E 0 65,-2.6 67,-3.1 -2,-0.4 2,-0.5 -0.993 7.6-166.8-123.1 125.4 46.5 9.0 65.0 514 170 B I E -rs 538 580E 0 23,-2.9 25,-2.8 -2,-0.5 2,-0.6 -0.967 4.0-162.0-111.6 121.8 45.2 5.5 64.6 515 171 B T E +rs 539 581E 2 65,-2.3 67,-2.5 -2,-0.5 68,-0.9 -0.926 64.3 38.4-105.1 115.2 43.2 4.8 61.4 516 172 B G - 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