==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 05-OCT-12 4HFM . COMPND 2 MOLECULE: ALLYL ALCOHOL DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NICOTIANA TABACUM; . AUTHOR H.S.TOOGOOD,N.S.SCRUTTON . 657 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26822.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 474 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 95 14.5 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 . 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 . 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 . 55 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 94 14.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 109 16.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 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 2 0 1 3 2 2 0 4 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 6 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 . 5 2 2 3 0 0 4 0 2 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 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 2 A A 0 0 93 0, 0.0 33,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 137.4 4.2 37.0 51.7 2 3 A E - 0 0 112 31,-0.5 31,-2.6 30,-0.1 2,-0.5 -0.328 360.0-153.7 -60.3 133.2 3.2 38.8 48.5 3 4 A E E +A 32 0A 123 29,-0.2 2,-0.3 30,-0.1 29,-0.2 -0.967 26.3 159.6-115.2 122.7 -0.4 38.0 47.5 4 5 A V E -A 31 0A 28 27,-2.4 27,-2.7 -2,-0.5 2,-0.2 -0.932 44.1 -99.1-141.5 156.7 -1.1 38.3 43.8 5 6 A S E -A 30 0A 73 -2,-0.3 2,-0.4 25,-0.2 25,-0.2 -0.499 36.1-158.0 -74.1 145.1 -3.6 37.2 41.1 6 7 A N E -A 29 0A 3 23,-3.2 23,-2.0 -2,-0.2 2,-0.2 -0.909 3.2-152.0-132.6 102.6 -2.3 34.2 39.1 7 8 A K E -A 28 0A 59 -2,-0.4 94,-1.8 21,-0.2 2,-0.4 -0.569 20.1-169.8 -71.4 142.4 -3.6 33.5 35.6 8 9 A Q E -AB 27 100A 19 19,-3.1 19,-2.5 92,-0.2 2,-0.8 -0.975 26.5-133.2-134.2 145.3 -3.5 29.9 34.5 9 10 A V E -A 26 0A 0 90,-3.2 62,-2.6 -2,-0.4 2,-0.3 -0.891 34.2-162.7 -97.4 112.8 -4.1 27.9 31.4 10 11 A I E -AC 25 70A 2 15,-3.3 15,-1.8 -2,-0.8 2,-0.7 -0.704 21.2-127.2 -97.0 137.3 -6.4 25.0 32.4 11 12 A L E -A 24 0A 0 58,-2.0 57,-3.1 55,-0.4 58,-0.3 -0.756 24.2-168.2 -78.8 122.0 -7.0 21.8 30.5 12 13 A K - 0 0 88 11,-2.8 2,-0.3 -2,-0.7 -1,-0.2 0.895 61.4 -5.4 -76.6 -40.0 -10.8 21.7 30.2 13 14 A N S S- 0 0 61 10,-0.9 -1,-0.2 54,-0.1 55,-0.0 -0.971 77.8 -90.5-152.9 150.1 -11.2 18.1 28.9 14 15 A Y - 0 0 99 -2,-0.3 2,-0.4 -3,-0.1 46,-0.2 -0.368 54.4-126.1 -59.6 157.0 -9.2 15.0 27.8 15 16 A V - 0 0 6 44,-3.0 2,-0.3 41,-0.2 46,-0.1 -0.903 26.1-173.8-118.0 138.5 -8.8 15.3 24.0 16 17 A T - 0 0 114 -2,-0.4 2,-0.1 2,-0.2 236,-0.1 -0.962 67.8 -5.2-121.3 146.8 -9.6 12.9 21.2 17 18 A G S S- 0 0 22 -2,-0.3 236,-0.1 234,-0.1 -2,-0.0 -0.425 125.1 -4.4 70.4-147.7 -8.6 13.7 17.6 18 19 A Y S S- 0 0 137 -2,-0.1 -2,-0.2 1,-0.1 2,-0.1 -0.580 76.8-119.1 -79.6 141.0 -7.0 17.1 17.1 19 20 A P - 0 0 7 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.398 30.4-162.1 -71.2 150.6 -6.8 19.5 20.1 20 21 A K > - 0 0 116 1,-0.1 3,-2.1 -2,-0.1 4,-0.2 -0.915 33.5-105.0-127.3 166.1 -8.6 22.9 19.7 21 22 A E G > S+ 0 0 88 -2,-0.3 3,-1.9 1,-0.3 294,-0.1 0.869 117.4 61.8 -55.6 -40.8 -8.3 26.2 21.5 22 23 A S G 3 S+ 0 0 63 1,-0.3 -1,-0.3 292,-0.0 0, 0.0 0.447 84.0 76.7 -70.8 -2.3 -11.6 25.5 23.4 23 24 A D G < S+ 0 0 5 -3,-2.1 -11,-2.8 -11,-0.1 -10,-0.9 0.491 101.2 49.8 -79.6 -6.0 -10.1 22.4 25.0 24 25 A M E < -A 11 0A 8 -3,-1.9 2,-0.3 -13,-0.2 -13,-0.2 -0.901 67.8-172.7-128.0 160.3 -8.3 24.9 27.2 25 26 A E E -A 10 0A 94 -15,-1.8 -15,-3.3 -2,-0.3 2,-0.5 -0.967 25.7-114.6-147.9 160.2 -9.4 28.0 29.3 26 27 A I E -A 9 0A 62 -2,-0.3 2,-0.4 -17,-0.2 -17,-0.2 -0.884 32.0-175.7-100.9 126.8 -7.9 30.8 31.3 27 28 A K E -A 8 0A 98 -19,-2.5 -19,-3.1 -2,-0.5 2,-0.5 -0.925 13.4-148.7-118.8 146.2 -8.5 30.8 35.0 28 29 A N E +A 7 0A 85 -2,-0.4 2,-0.3 -21,-0.2 -21,-0.2 -0.972 21.4 170.2-116.8 127.0 -7.5 33.5 37.6 29 30 A V E -A 6 0A 36 -23,-2.0 -23,-3.2 -2,-0.5 2,-0.5 -0.867 32.0-120.8-125.4 163.0 -6.7 32.6 41.2 30 31 A T E +A 5 0A 91 -2,-0.3 2,-0.3 -25,-0.2 -25,-0.2 -0.878 38.9 172.1 -98.0 135.0 -5.2 34.4 44.1 31 32 A I E -A 4 0A 54 -27,-2.7 -27,-2.4 -2,-0.5 2,-0.5 -0.966 30.6-125.8-136.6 165.8 -2.1 33.0 45.5 32 33 A K E -A 3 0A 127 -2,-0.3 2,-1.7 -29,-0.2 -29,-0.2 -0.920 21.3-133.0-107.7 134.0 0.6 33.8 48.1 33 34 A L + 0 0 7 -31,-2.6 -31,-0.5 -2,-0.5 2,-0.3 -0.608 62.6 120.8 -85.9 79.3 4.3 33.7 47.0 34 35 A K - 0 0 61 -2,-1.7 -2,-0.1 -33,-0.1 47,-0.1 -0.998 65.9-115.7-146.9 139.8 5.6 31.6 49.9 35 36 A V - 0 0 25 -2,-0.3 3,-0.2 1,-0.1 47,-0.1 -0.688 45.2-109.4 -74.7 122.5 7.4 28.3 50.4 36 37 A P > - 0 0 65 0, 0.0 3,-2.3 0, 0.0 5,-0.2 -0.187 54.0 -70.7 -54.8 144.7 5.2 25.9 52.4 37 38 A E T 3 S- 0 0 185 1,-0.3 3,-0.1 3,-0.1 46,-0.0 -0.024 110.4 -13.1 -48.6 128.0 6.4 25.2 55.9 38 39 A G T 3 S+ 0 0 83 1,-0.2 -1,-0.3 -3,-0.2 2,-0.2 0.594 103.2 130.3 53.4 17.5 9.6 23.1 56.1 39 40 A S < - 0 0 31 -3,-2.3 -1,-0.2 1,-0.1 -4,-0.0 -0.534 62.3-134.6 -93.9 164.4 9.3 22.1 52.5 40 41 A N + 0 0 107 -2,-0.2 44,-0.1 -3,-0.1 -1,-0.1 0.095 59.3 135.0-105.3 24.7 12.1 22.3 49.9 41 42 A D - 0 0 31 -5,-0.2 42,-3.3 42,-0.1 2,-0.4 -0.212 46.9-138.5 -71.1 161.9 9.9 23.8 47.2 42 43 A V E -DE 82 105B 0 63,-2.7 63,-3.2 40,-0.2 2,-0.5 -0.980 6.2-147.5-122.7 131.2 10.8 26.8 45.0 43 44 A V E -DE 81 104B 0 38,-2.9 37,-3.3 -2,-0.4 38,-1.4 -0.887 27.5-178.0 -96.4 126.7 8.4 29.6 44.1 44 45 A V E -DE 79 103B 1 59,-3.1 59,-2.0 -2,-0.5 2,-0.6 -0.907 31.8-135.2-125.8 158.5 8.9 31.0 40.6 45 46 A K E -DE 78 102B 51 33,-2.8 33,-2.5 -2,-0.3 57,-0.2 -0.948 34.6-131.4-105.5 118.7 7.7 33.7 38.3 46 47 A N E +D 77 0B 0 55,-1.9 31,-0.2 -2,-0.6 3,-0.1 -0.498 32.2 169.6 -76.9 136.2 7.3 32.1 34.8 47 48 A L E + 0 0 12 29,-3.1 286,-2.6 1,-0.4 287,-1.2 0.802 65.1 14.8-111.2 -49.3 8.8 34.1 31.9 48 49 A Y E -DF 76 332B 45 28,-1.7 28,-2.5 284,-0.2 -1,-0.4 -0.984 59.7-159.6-132.6 142.9 8.7 31.7 28.9 49 50 A L E -DF 75 331B 0 282,-2.5 282,-2.7 -2,-0.3 2,-0.3 -0.974 15.4-135.2-121.2 140.3 6.8 28.5 28.2 50 51 A S E - F 0 330B 1 24,-2.9 2,-0.7 -2,-0.4 280,-0.2 -0.693 7.2-147.4 -85.4 140.5 7.7 25.9 25.6 51 52 A C - 0 0 2 278,-2.4 278,-0.4 -2,-0.3 22,-0.0 -0.956 27.7-178.3-102.1 115.1 4.9 24.5 23.4 52 53 A D > - 0 0 8 -2,-0.7 3,-1.7 1,-0.1 4,-0.2 -0.926 34.3-131.6-118.8 137.8 6.1 20.9 22.7 53 54 A P G > S+ 0 0 44 0, 0.0 3,-1.8 0, 0.0 4,-0.4 0.781 101.7 70.4 -55.4 -29.1 4.3 18.3 20.6 54 55 A Y G >> S+ 0 0 67 1,-0.3 3,-1.1 2,-0.2 4,-0.9 0.745 80.9 78.5 -63.6 -21.2 4.6 15.5 23.3 55 56 A M G <4 S+ 0 0 0 -3,-1.7 4,-0.4 1,-0.3 3,-0.4 0.799 80.4 67.0 -56.5 -30.2 2.0 17.5 25.3 56 57 A R G X4 S+ 0 0 1 -3,-1.8 3,-1.5 -4,-0.2 -1,-0.3 0.893 96.0 54.8 -57.5 -39.9 -0.7 16.1 23.0 57 58 A S G X4 S+ 0 0 35 -3,-1.1 3,-1.2 -4,-0.4 -1,-0.2 0.828 102.4 57.9 -59.6 -33.1 0.0 12.6 24.5 58 59 A R G 3< S+ 0 0 47 -4,-0.9 7,-3.2 -3,-0.4 -1,-0.3 0.550 92.1 69.4 -79.8 -5.7 -0.6 14.1 27.9 59 60 A M G < S+ 0 0 1 -3,-1.5 -44,-3.0 -4,-0.4 2,-0.3 0.308 86.9 84.5 -90.1 5.4 -4.1 15.2 26.9 60 61 A R < 0 0 79 -3,-1.2 5,-0.1 -46,-0.2 -44,-0.1 -0.803 360.0 360.0-105.0 149.2 -5.3 11.5 26.8 61 62 A K 0 0 133 -2,-0.3 -1,-0.2 -46,-0.1 3,-0.1 0.616 360.0 360.0 -96.3 360.0 -6.5 9.4 29.7 62 ! 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 63 69 A E 0 0 196 0, 0.0 -5,-0.0 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 -47.6 1.8 11.0 33.4 64 70 A S - 0 0 48 1,-0.1 -5,-0.2 -3,-0.1 -6,-0.1 -0.211 360.0 -98.0 -83.5 167.8 -1.1 12.8 31.8 65 71 A F - 0 0 8 -7,-3.2 -1,-0.1 -10,-0.2 6,-0.1 -0.367 35.3-125.1 -71.1 160.3 -2.6 16.2 32.5 66 72 A A > - 0 0 49 4,-0.3 3,-2.5 -2,-0.1 -55,-0.4 -0.955 22.2-117.4-111.0 123.5 -5.7 16.5 34.8 67 73 A P T 3 S+ 0 0 48 0, 0.0 -55,-0.2 0, 0.0 -54,-0.1 -0.301 104.3 28.4 -52.4 136.3 -8.8 18.2 33.5 68 74 A G T 3 S+ 0 0 42 -57,-3.1 -56,-0.1 1,-0.3 -58,-0.0 0.184 106.9 93.9 89.6 -15.1 -9.5 21.3 35.7 69 75 A S S < S- 0 0 58 -3,-2.5 -58,-2.0 -58,-0.3 -1,-0.3 -0.738 85.8 -84.7-106.1 160.4 -5.8 21.7 36.5 70 76 A P B -C 10 0A 33 0, 0.0 -4,-0.3 0, 0.0 -60,-0.2 -0.270 43.0-115.2 -58.6 139.7 -3.1 23.9 35.0 71 77 A I - 0 0 0 -62,-2.6 28,-2.9 28,-0.2 2,-0.3 -0.382 35.3-154.4 -60.6 150.8 -1.2 22.5 32.0 72 78 A T E + G 0 98B 45 26,-0.3 2,-0.3 -2,-0.1 26,-0.2 -0.941 28.4 129.2-128.8 156.9 2.5 21.9 32.8 73 79 A G E - G 0 97B 0 24,-2.1 24,-2.6 -2,-0.3 22,-0.1 -0.962 58.9 -42.0 179.0-174.8 5.6 21.8 30.6 74 80 A Y E + G 0 96B 42 -2,-0.3 -24,-2.9 22,-0.2 2,-0.3 -0.383 64.3 152.5 -69.6 140.5 9.1 23.2 30.1 75 81 A G E -DG 49 95B 2 20,-2.2 20,-1.6 -26,-0.3 2,-0.4 -0.905 44.0-111.7-153.8 176.3 9.6 26.9 30.8 76 82 A V E +DG 48 94B 0 -28,-2.5 -29,-3.1 -2,-0.3 -28,-1.7 -0.983 43.6 171.6-117.4 134.8 12.1 29.5 31.9 77 83 A A E -DG 46 93B 3 16,-2.9 16,-2.7 -2,-0.4 2,-0.5 -0.923 32.9-124.1-142.7 162.0 11.4 31.1 35.3 78 84 A K E -DG 45 92B 79 -33,-2.5 -33,-2.8 -2,-0.3 2,-0.3 -0.959 31.9-123.2-110.3 129.1 12.8 33.5 37.9 79 85 A V E +D 44 0B 0 12,-3.0 11,-3.2 -2,-0.5 -35,-0.3 -0.513 30.9 172.9 -68.5 127.1 13.1 32.2 41.5 80 86 A L E S- 0 0 18 -37,-3.3 2,-0.3 1,-0.4 -36,-0.2 0.754 70.1 -0.0-101.7 -39.6 11.2 34.3 44.1 81 87 A E E -D 43 0B 88 -38,-1.4 -38,-2.9 7,-0.1 -1,-0.4 -0.982 67.4-161.9-149.7 147.7 11.6 32.2 47.2 82 88 A S E -D 42 0B 36 -2,-0.3 -40,-0.2 -40,-0.2 7,-0.1 -0.989 27.1-173.8-138.6 130.6 13.3 28.9 47.8 83 89 A G S S+ 0 0 24 -42,-3.3 -41,-0.2 -2,-0.4 -42,-0.1 0.320 78.6 85.6 -88.2 4.6 13.2 26.2 50.5 84 90 A D S > S- 0 0 34 -43,-0.3 3,-2.0 3,-0.2 -44,-0.1 -0.930 72.4-148.0-113.0 120.1 16.1 24.6 48.6 85 91 A P T 3 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.800 98.0 65.3 -54.6 -30.9 19.7 25.7 49.3 86 92 A K T 3 S+ 0 0 65 1,-0.1 2,-0.4 -3,-0.1 -3,-0.0 0.750 101.3 57.6 -61.8 -26.6 20.6 25.1 45.6 87 93 A F < - 0 0 15 -3,-2.0 2,-0.3 4,-0.0 -3,-0.2 -0.927 66.4-172.1-117.9 132.7 18.2 27.9 44.6 88 94 A Q > - 0 0 89 -2,-0.4 3,-2.2 -7,-0.1 -9,-0.2 -0.867 39.9 -86.3-117.3 150.2 18.4 31.6 45.6 89 95 A K T 3 S+ 0 0 137 -2,-0.3 -9,-0.2 1,-0.3 3,-0.1 -0.294 117.3 30.0 -50.0 132.3 15.9 34.4 45.1 90 96 A G T 3 S+ 0 0 43 -11,-3.2 -1,-0.3 1,-0.3 -10,-0.1 0.162 86.5 133.8 97.1 -19.3 16.8 36.0 41.7 91 97 A D < - 0 0 29 -3,-2.2 -12,-3.0 -13,-0.1 2,-0.4 -0.323 50.6-136.8 -59.7 142.7 18.1 32.8 40.1 92 98 A L E +G 78 0B 20 21,-0.5 21,-2.7 -14,-0.2 2,-0.3 -0.896 30.9 175.3-101.7 136.4 16.9 32.1 36.5 93 99 A V E -GH 77 112B 2 -16,-2.7 -16,-2.9 -2,-0.4 2,-0.3 -0.918 21.9-153.8-134.6 156.8 16.0 28.4 35.9 94 100 A W E +GH 76 111B 4 17,-2.2 17,-3.2 -2,-0.3 2,-0.3 -0.983 45.0 89.3-130.2 154.4 14.5 26.2 33.3 95 101 A G E S-G 75 0B 2 -20,-1.6 -20,-2.2 -2,-0.3 2,-0.2 -0.948 80.3 -21.2 154.6-167.3 12.7 22.9 33.7 96 102 A M E +G 74 0B 62 13,-0.5 2,-0.3 -2,-0.3 -22,-0.2 -0.503 69.2 150.4 -75.4 135.7 9.1 21.8 34.2 97 103 A T E -G 73 0B 9 -24,-2.6 -24,-2.1 -2,-0.2 2,-0.2 -0.869 43.6 -80.2-149.6 179.6 6.8 24.4 35.5 98 104 A G E -G 72 0B 4 -2,-0.3 2,-2.0 -26,-0.2 -26,-0.3 -0.569 33.9-114.3 -91.3 159.0 3.0 25.4 35.3 99 105 A W S S+ 0 0 0 -28,-2.9 -90,-3.2 -90,-0.2 2,-0.3 -0.567 87.7 89.3 -85.0 77.7 1.2 27.2 32.5 100 106 A E B S-B 8 0A 26 -2,-2.0 -92,-0.2 -92,-0.3 -54,-0.2 -0.963 92.7 -96.7-160.8 173.2 0.6 30.1 34.8 101 107 A E S S+ 0 0 55 -94,-1.8 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-2,-0.5 2,-0.5 -0.813 8.1-132.0 -95.4 137.4 18.5 23.7 35.6 112 119 A K E -H 93 0B 61 -2,-0.4 2,-0.5 -19,-0.2 -19,-0.3 -0.764 18.2-136.5 -90.9 127.8 20.1 27.0 36.8 113 120 A I + 0 0 5 -21,-2.7 -21,-0.5 -2,-0.5 3,-0.1 -0.682 30.8 166.1 -84.7 123.7 20.8 29.5 33.9 114 121 A H + 0 0 147 -2,-0.5 2,-0.8 1,-0.2 -1,-0.2 0.699 59.9 67.4-108.6 -27.3 24.2 31.1 34.1 115 122 A D + 0 0 38 1,-0.1 -1,-0.2 2,-0.1 3,-0.2 -0.869 44.8 161.1-105.3 110.1 24.6 32.7 30.7 116 123 A K + 0 0 115 -2,-0.8 4,-0.1 1,-0.2 -1,-0.1 0.176 54.9 95.4-112.2 12.0 22.1 35.5 30.0 117 124 A D S S+ 0 0 144 2,-0.1 -1,-0.2 3,-0.0 -2,-0.1 0.182 83.9 64.8 -77.9 12.5 24.1 36.9 27.1 118 125 A V S S- 0 0 9 -3,-0.2 174,-0.0 177,-0.0 178,-0.0 -0.931 110.3 -81.6-128.0 159.2 21.8 34.8 25.1 119 126 A P > - 0 0 57 0, 0.0 3,-1.3 0, 0.0 4,-0.3 -0.352 33.6-136.7 -61.1 135.9 18.0 35.3 24.8 120 127 A L G > S+ 0 0 43 1,-0.3 3,-1.8 2,-0.2 4,-0.1 0.853 103.2 66.0 -63.1 -32.8 16.3 33.7 27.8 121 128 A S G > S+ 0 0 6 1,-0.3 3,-2.2 2,-0.2 4,-0.4 0.789 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16.7 615 294 B Y H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 3,-0.3 0.933 111.5 47.8 -55.6 -50.5 30.7 -19.8 16.5 616 295 B L H X S+ 0 0 32 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.873 107.5 56.5 -58.5 -38.2 32.0 -23.4 15.8 617 296 B E H < S+ 0 0 145 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.834 114.8 39.1 -68.0 -31.5 34.4 -23.1 18.7 618 297 B M H X S+ 0 0 59 -4,-1.6 4,-0.8 -3,-0.3 -2,-0.2 0.921 121.6 39.1 -76.6 -49.7 31.5 -22.3 21.0 619 298 B V H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.748 101.7 64.4 -86.3 -26.3 28.8 -24.7 19.7 620 299 B I H X S+ 0 0 18 -4,-2.1 4,-2.6 -5,-0.3 5,-0.2 0.937 104.0 47.3 -70.0 -42.9 30.6 -27.9 18.8 621 300 B P H > S+ 0 0 75 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.901 112.2 53.1 -59.6 -38.0 31.6 -28.7 22.4 622 301 B Q H <>S+ 0 0 27 -4,-0.8 5,-2.3 2,-0.2 6,-1.1 0.894 110.1 46.6 -64.5 -41.1 28.0 -28.0 23.5 623 302 B I H ><5S+ 0 0 24 -4,-2.4 3,-2.1 4,-0.2 -1,-0.2 0.956 111.8 50.5 -62.7 -50.1 26.6 -30.4 20.9 624 303 B K H 3<5S+ 0 0 109 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.747 111.2 49.5 -62.5 -24.8 29.1 -33.1 21.9 625 304 B A T 3<5S- 0 0 83 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.322 113.9-118.7 -92.3 4.7 28.1 -32.6 25.5 626 305 B G T < 5S+ 0 0 52 -3,-2.1 -3,-0.2 2,-0.2 -2,-0.1 0.633 82.6 119.6 67.7 14.8 24.4 -32.8 24.6 627 306 B K S S- 0 0 6 23,-3.4 3,-1.5 -2,-0.5 4,-0.3 0.312 76.9 -88.7 90.4 151.9 16.5 -38.4 -2.7 638 317 B L G > S+ 0 0 4 23,-0.3 3,-2.0 1,-0.3 -1,-0.1 0.832 120.8 68.8 -60.7 -36.4 16.2 -35.5 -5.2 639 318 B E G 3 S+ 0 0 122 1,-0.3 4,-0.3 2,-0.2 -1,-0.3 0.672 100.6 51.8 -58.3 -15.8 12.9 -36.8 -6.4 640 319 B S G <> S+ 0 0 43 -3,-1.5 4,-2.2 20,-0.1 -1,-0.3 0.588 86.5 85.6 -91.1 -15.1 11.7 -35.7 -3.0 641 320 B A H <> S+ 0 0 0 -3,-2.0 4,-2.2 -4,-0.3 5,-0.2 0.818 83.8 54.2 -63.8 -36.3 13.0 -32.2 -3.1 642 321 B P H > S+ 0 0 13 0, 0.0 4,-2.0 0, 0.0 3,-0.2 0.981 112.5 44.9 -58.6 -52.5 10.1 -30.6 -4.9 643 322 B T H > S+ 0 0 86 -4,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.894 114.3 51.2 -51.0 -45.2 7.7 -31.9 -2.2 644 323 B A H < S+ 0 0 8 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.842 109.4 47.9 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109 -2,-0.2 -2,-0.0 -283,-0.0 -283,-0.0 -0.468 360.0 360.0-178.2 360.0 28.4 -41.4 2.4