==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 27-NOV-06 2O06 . COMPND 2 MOLECULE: SPERMIDINE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.MIN,H.WU,H.ZENG,P.LOPPNAU,J.WEIGELT,M.SUNDSTROM, . 586 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21969.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 411 70.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 8.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 102 17.4 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.0 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 . 34 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 21.5 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+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 8 0 2 0 4 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 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 0 0 PARALLEL BRIDGES PER LADDER . 1 2 0 4 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 0 1 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 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 6 A D 0 0 161 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -34.4 8.7 29.1 30.3 2 7 A G - 0 0 61 1,-0.1 3,-0.1 3,-0.0 2,-0.1 -0.188 360.0 -81.7 -68.9 165.5 5.6 30.1 28.1 3 8 A P - 0 0 120 0, 0.0 -1,-0.1 0, 0.0 170,-0.1 -0.415 53.6-102.0 -69.5 149.2 5.2 28.9 24.5 4 9 A A - 0 0 29 168,-0.3 2,-0.4 -3,-0.1 170,-0.2 -0.380 38.5-159.6 -68.9 147.5 7.1 30.9 21.9 5 10 A A - 0 0 60 -2,-0.1 16,-3.6 -3,-0.1 2,-0.3 -0.993 9.0-163.7-132.3 137.8 5.2 33.4 19.9 6 11 A S B -A 20 0A 26 -2,-0.4 14,-0.3 14,-0.3 57,-0.1 -0.916 35.6-100.9-113.7 148.9 5.8 35.0 16.5 7 12 A G - 0 0 22 12,-1.4 12,-0.3 -2,-0.3 3,-0.1 -0.469 50.9-100.2 -61.6 132.5 4.1 38.1 15.1 8 13 A P - 0 0 119 0, 0.0 -1,-0.1 0, 0.0 54,-0.0 -0.383 49.4 -92.8 -60.7 132.1 1.4 37.0 12.6 9 14 A A + 0 0 12 -2,-0.1 2,-0.3 -3,-0.1 9,-0.1 -0.190 61.7 161.4 -51.0 124.9 2.8 37.4 9.1 10 15 A A - 0 0 37 7,-0.3 7,-0.8 -3,-0.1 2,-0.6 -0.994 35.9-140.8-148.2 142.8 1.8 40.9 7.7 11 16 A I E -B 16 0B 62 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.931 25.8-178.7-104.4 123.4 2.9 43.2 4.9 12 17 A R E > -B 15 0B 116 3,-2.7 3,-1.6 -2,-0.6 -2,-0.0 -0.984 65.2 -17.2-130.3 123.6 2.9 46.8 6.0 13 18 A E T 3 S- 0 0 155 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.825 128.3 -50.8 50.9 40.0 3.8 49.8 3.7 14 19 A G T 3 S+ 0 0 35 1,-0.2 18,-3.3 17,-0.1 2,-0.4 0.561 119.3 101.0 80.8 9.2 5.5 47.4 1.2 15 20 A W E < -BC 12 31B 30 -3,-1.6 -3,-2.7 16,-0.3 2,-0.5 -0.978 58.9-147.7-125.8 140.1 7.7 45.7 3.9 16 21 A F E -BC 11 30B 0 14,-2.5 14,-2.2 -2,-0.4 2,-0.5 -0.934 18.3-161.6 -99.3 127.0 7.4 42.3 5.6 17 22 A R E - C 0 29B 61 -7,-0.8 2,-0.6 -2,-0.5 -7,-0.3 -0.944 7.2-146.0-113.2 123.4 8.8 42.4 9.2 18 23 A E E + C 0 28B 1 10,-3.1 10,-0.7 -2,-0.5 2,-0.3 -0.784 24.2 171.9 -91.0 119.7 9.7 39.2 11.0 19 24 A T + 0 0 31 -2,-0.6 -12,-1.4 -12,-0.3 2,-0.3 -0.966 4.5 160.1-127.4 148.4 9.1 39.1 14.8 20 25 A C B > -A 6 0A 9 6,-0.4 3,-1.9 3,-0.4 -14,-0.3 -0.944 45.5-126.7-162.2 141.0 9.4 36.3 17.3 21 26 A S T 3 S+ 0 0 63 -16,-3.6 -15,-0.1 -2,-0.3 -1,-0.0 0.640 107.0 72.2 -64.5 -15.6 9.7 35.9 21.1 22 27 A L T 3 S+ 0 0 44 -17,-0.3 -1,-0.3 1,-0.3 -16,-0.1 0.565 113.5 25.8 -75.0 -11.9 12.7 33.6 20.4 23 28 A W S X S- 0 0 3 -3,-1.9 3,-1.1 3,-0.1 -3,-0.4 -0.425 93.7-167.6-143.0 70.8 14.6 36.7 19.3 24 29 A P T 3 + 0 0 70 0, 0.0 -3,-0.1 0, 0.0 3,-0.1 -0.201 63.1 17.5 -65.4 145.6 12.9 39.6 21.3 25 30 A G T 3 S+ 0 0 5 1,-0.2 296,-2.2 317,-0.1 2,-0.3 0.541 107.9 84.3 77.6 5.4 13.5 43.3 20.5 26 31 A Q E < - D 0 320B 8 -3,-1.1 -6,-0.4 -6,-0.2 2,-0.3 -0.971 50.6-179.6-136.3 154.3 15.0 42.7 17.0 27 32 A A E - D 0 319B 1 292,-1.8 292,-2.3 -2,-0.3 2,-0.5 -0.968 21.1-145.1-154.1 136.2 13.5 42.3 13.5 28 33 A L E -CD 18 318B 28 -10,-0.7 -10,-3.1 -2,-0.3 2,-0.4 -0.894 20.6-166.3 -92.6 132.6 14.5 41.7 10.0 29 34 A S E -CD 17 317B 2 288,-2.9 288,-1.9 -2,-0.5 2,-0.4 -0.968 4.1-164.0-113.6 138.3 12.3 43.4 7.4 30 35 A L E -CD 16 316B 0 -14,-2.2 -14,-2.5 -2,-0.4 286,-0.2 -0.982 25.4-120.8-118.0 130.6 12.4 42.6 3.6 31 36 A Q E -C 15 0B 61 284,-2.2 21,-2.2 -2,-0.4 2,-0.4 -0.488 29.2-129.6 -72.5 138.3 10.8 45.0 1.1 32 37 A V E +G 51 0C 19 -18,-3.3 19,-0.3 19,-0.3 3,-0.1 -0.749 28.8 176.2 -96.4 131.0 8.1 43.3 -1.0 33 38 A E E S- 0 0 100 17,-3.1 2,-0.3 -2,-0.4 18,-0.2 0.826 78.2 -1.7 -90.4 -48.0 7.9 43.5 -4.7 34 39 A Q E -G 50 0C 102 16,-2.3 16,-3.6 -20,-0.0 -1,-0.3 -0.944 63.4-131.4-152.9 119.1 4.9 41.2 -5.1 35 40 A L E +G 49 0C 84 -2,-0.3 14,-0.2 14,-0.2 3,-0.1 -0.577 30.4 172.9 -60.2 128.7 2.7 39.3 -2.7 36 41 A L E + 0 0 40 12,-2.1 2,-0.3 1,-0.4 13,-0.2 0.706 58.1 1.8-115.1 -35.8 2.5 35.8 -4.2 37 42 A H E +G 48 0C 46 11,-2.4 11,-2.8 94,-0.0 -1,-0.4 -0.968 48.6 167.4-156.5 138.6 0.7 33.6 -1.6 38 43 A H E +G 47 0C 76 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.595 32.0 123.4-154.7 93.6 -0.9 34.1 1.8 39 44 A R E -G 46 0C 179 7,-2.0 7,-2.1 -2,-0.1 2,-0.4 -0.996 54.5-116.7-145.4 149.5 -3.1 31.3 3.2 40 45 A R E -G 45 0C 162 -2,-0.3 5,-0.3 5,-0.2 2,-0.1 -0.701 27.9-155.9 -83.2 134.1 -3.3 29.0 6.2 41 46 A S - 0 0 11 3,-3.2 -1,-0.1 -2,-0.4 80,-0.0 -0.127 44.4 -84.8 -84.8-168.0 -2.8 25.3 5.5 42 47 A R S S+ 0 0 153 1,-0.1 3,-0.1 -2,-0.1 -2,-0.0 0.573 129.8 30.0 -73.8 -9.1 -4.2 22.6 7.9 43 48 A Y S S- 0 0 115 1,-0.3 2,-0.3 131,-0.0 -1,-0.1 0.740 123.3 -8.4-116.6 -39.5 -0.9 23.1 9.8 44 49 A Q - 0 0 15 -5,-0.1 -3,-3.2 130,-0.1 2,-0.5 -0.964 69.8 -83.3-157.4 168.8 0.4 26.6 9.6 45 50 A D E -G 40 0C 22 -2,-0.3 16,-2.3 -5,-0.3 2,-0.6 -0.709 41.0-159.5 -83.9 129.1 0.2 30.1 8.1 46 51 A I E +GH 39 60C 1 -7,-2.1 -7,-2.0 -2,-0.5 2,-0.4 -0.948 13.0 177.4-118.6 117.0 2.1 30.3 4.7 47 52 A L E +GH 38 59C 0 12,-2.8 12,-3.0 -2,-0.6 2,-0.4 -0.975 1.9 178.1-112.0 128.9 3.2 33.6 3.2 48 53 A V E +GH 37 58C 1 -11,-2.8 -11,-2.4 -2,-0.4 -12,-2.1 -1.000 10.0 164.6-125.8 129.8 5.2 33.6 -0.0 49 54 A F E -GH 35 57C 0 8,-1.5 8,-2.8 -2,-0.4 2,-0.7 -0.986 40.3-119.3-140.5 156.4 6.3 36.9 -1.7 50 55 A R E -GH 34 56C 107 -16,-3.6 -17,-3.1 -2,-0.3 -16,-2.3 -0.867 39.6-150.2 -89.4 118.8 8.7 38.2 -4.3 51 56 A S E -G 32 0C 5 4,-2.6 4,-0.4 -2,-0.7 -19,-0.3 -0.519 19.4-118.7 -87.9 160.3 11.1 40.5 -2.5 52 57 A K S S+ 0 0 101 -21,-2.2 -20,-0.1 263,-0.2 -1,-0.1 0.908 106.1 8.0 -57.8 -45.9 12.8 43.5 -4.0 53 58 A T S S+ 0 0 41 -22,-0.4 -1,-0.1 262,-0.3 -21,-0.1 0.494 124.8 52.9-126.1 -0.9 16.3 42.1 -3.4 54 59 A Y S S- 0 0 2 1,-0.4 15,-1.9 261,-0.1 14,-0.5 0.192 91.7-126.1-121.9 16.5 16.3 38.5 -2.2 55 60 A G S S- 0 0 27 -4,-0.4 -4,-2.6 13,-0.2 -1,-0.4 -0.382 70.5 -4.7 69.4-152.1 14.1 36.7 -4.8 56 61 A N E -H 50 0C 16 -6,-0.2 12,-1.7 75,-0.1 2,-0.4 -0.505 69.5-153.4 -77.8 143.6 11.2 34.7 -3.5 57 62 A V E -HI 49 67C 0 -8,-2.8 -8,-1.5 10,-0.2 2,-0.5 -0.967 4.6-154.6-124.2 119.9 10.7 34.4 0.2 58 63 A L E -HI 48 66C 2 8,-2.4 7,-3.2 -2,-0.4 8,-1.2 -0.861 15.0-174.7 -94.7 129.4 8.9 31.5 2.1 59 64 A V E -HI 47 64C 0 -12,-3.0 -12,-2.8 -2,-0.5 2,-0.5 -0.989 7.2-168.5-127.4 125.5 7.5 32.5 5.5 60 65 A L E > S-HI 46 63C 16 3,-2.7 3,-1.9 -2,-0.4 -14,-0.2 -0.975 76.7 -17.6-119.8 122.6 5.9 29.9 7.9 61 66 A D T 3 S- 0 0 42 -16,-2.3 -1,-0.2 -2,-0.5 -15,-0.1 0.866 129.9 -51.6 45.8 46.9 3.9 31.3 10.9 62 67 A G T 3 S+ 0 0 1 -17,-0.3 2,-0.5 1,-0.2 -43,-0.3 0.401 116.4 116.8 78.8 -2.6 5.6 34.7 10.5 63 68 A V E < -I 60 0C 6 -3,-1.9 -3,-2.7 -45,-0.1 2,-0.2 -0.877 68.6-122.5-105.5 124.9 9.1 33.1 10.4 64 69 A I E +I 59 0C 1 -2,-0.5 -5,-0.3 -5,-0.2 3,-0.1 -0.417 29.9 176.4 -60.8 123.9 11.3 33.3 7.3 65 70 A Q E - 0 0 23 -7,-3.2 2,-0.3 1,-0.4 -1,-0.2 0.795 61.1 -18.8 -97.0 -40.0 12.3 29.8 6.1 66 71 A C E -I 58 0C 0 -8,-1.2 -8,-2.4 8,-0.0 -1,-0.4 -0.982 44.9-155.1-164.8 155.1 14.2 30.7 3.0 67 72 A T E >> -I 57 0C 0 -2,-0.3 4,-1.9 -10,-0.2 3,-0.6 -0.975 29.4-125.9-130.1 146.5 15.0 33.2 0.4 68 73 A E T 34 S+ 0 0 69 -12,-1.7 4,-0.3 -14,-0.5 -13,-0.2 0.832 106.3 58.2 -57.4 -34.9 16.2 32.4 -3.1 69 74 A R T 34 S+ 0 0 82 -15,-1.9 -1,-0.2 1,-0.2 -14,-0.1 0.818 123.4 15.0 -68.1 -35.1 19.3 34.8 -2.7 70 75 A D T X> S+ 0 0 0 -3,-0.6 3,-1.6 -16,-0.3 4,-0.6 0.478 90.0 104.4-126.2 2.6 20.8 33.1 0.4 71 76 A E H 3X + 0 0 9 -4,-1.9 4,-2.4 1,-0.3 5,-0.2 0.783 69.3 73.3 -57.1 -32.8 19.2 29.7 0.7 72 77 A F H 3> S+ 0 0 18 -4,-0.3 4,-2.2 1,-0.2 5,-0.3 0.743 89.3 60.5 -58.7 -26.7 22.3 27.9 -0.6 73 78 A S H <> S+ 0 0 0 -3,-1.6 4,-2.2 2,-0.2 5,-0.2 0.992 113.2 32.7 -63.3 -61.8 24.3 28.5 2.6 74 79 A Y H X S+ 0 0 1 -4,-0.6 4,-2.9 1,-0.2 5,-0.3 0.912 121.1 51.7 -60.5 -44.4 21.9 26.7 5.0 75 80 A Q H X S+ 0 0 1 -4,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.919 112.8 43.0 -62.2 -48.9 21.0 24.1 2.4 76 81 A E H X S+ 0 0 2 -4,-2.2 4,-2.8 -5,-0.2 5,-0.2 0.893 117.6 45.9 -65.8 -41.4 24.5 23.2 1.4 77 82 A M H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.3 -2,-0.2 0.922 109.6 50.9 -71.9 -43.8 25.8 23.1 5.0 78 83 A I H < S+ 0 0 0 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.834 119.4 40.3 -64.5 -30.4 22.9 21.1 6.6 79 84 A A H X S+ 0 0 0 -4,-1.3 4,-1.9 -5,-0.3 -2,-0.2 0.930 121.3 38.1 -77.7 -53.8 23.4 18.5 3.8 80 85 A N H X S+ 0 0 0 -4,-2.8 4,-2.7 -5,-0.2 5,-0.2 0.783 102.6 67.6 -79.1 -26.9 27.3 18.4 3.5 81 86 A L H < S+ 0 0 0 -4,-2.4 4,-0.3 -5,-0.2 -1,-0.2 0.976 114.5 30.0 -58.6 -54.5 28.3 18.7 7.2 82 87 A P H >4 S+ 0 0 0 0, 0.0 3,-1.0 0, 0.0 -2,-0.2 0.934 121.2 51.9 -70.1 -42.3 26.8 15.2 8.0 83 88 A L H >< S+ 0 0 0 -4,-1.9 3,-1.3 1,-0.3 -2,-0.2 0.907 112.1 45.1 -60.6 -45.3 27.4 13.6 4.6 84 89 A C T 3< S+ 0 0 0 -4,-2.7 175,-2.4 1,-0.2 174,-0.6 0.480 108.1 60.4 -77.4 -3.1 31.1 14.6 4.5 85 90 A S T < S+ 0 0 3 -3,-1.0 -1,-0.2 -4,-0.3 -2,-0.2 0.236 95.8 71.9-101.6 10.2 31.4 13.4 8.1 86 91 A H S < S- 0 0 8 -3,-1.3 110,-0.1 1,-0.1 78,-0.0 -0.988 77.7-139.2-123.7 133.7 30.3 9.8 7.1 87 92 A P S S+ 0 0 78 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.775 93.8 2.3 -65.9 -26.1 32.7 7.6 5.1 88 93 A N S S- 0 0 81 75,-0.1 2,-0.6 23,-0.0 -4,-0.1 -0.418 70.9-169.9-161.1 74.5 30.0 6.2 2.9 89 94 A P + 0 0 0 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.619 19.6 156.9 -78.6 118.3 26.5 7.5 3.4 90 95 A R + 0 0 93 -2,-0.6 23,-2.6 1,-0.3 24,-1.6 0.764 61.0 43.9-108.3 -35.7 24.0 5.4 1.4 91 96 A K E -j 114 0D 54 22,-0.2 72,-2.4 21,-0.2 73,-1.7 -0.970 67.9-174.7-125.0 119.5 20.6 5.8 3.0 92 97 A V E -jk 115 164D 0 22,-2.4 24,-2.6 -2,-0.5 2,-0.4 -0.917 11.4-161.9-122.3 136.3 19.5 9.3 4.1 93 98 A L E -jk 116 165D 0 71,-2.8 73,-3.2 -2,-0.4 2,-0.5 -0.981 5.5-166.4-115.5 131.1 16.4 10.5 6.0 94 99 A I E -jk 117 166D 0 22,-2.8 24,-2.3 -2,-0.4 2,-0.5 -0.976 4.5-159.9-114.3 126.0 15.2 14.1 5.9 95 100 A I E S-jk 118 167D 2 71,-3.3 73,-2.6 -2,-0.5 2,-0.4 -0.929 71.0 -14.0-103.9 126.6 12.7 15.4 8.4 96 101 A G E S+ k 0 168D 13 22,-2.8 73,-0.2 -2,-0.5 -2,-0.1 -0.706 70.6 140.9 83.1-134.7 10.9 18.5 7.2 97 102 A G > + 0 0 2 71,-2.2 3,-2.2 -2,-0.4 6,-0.3 0.844 21.0 167.4 65.9 36.1 12.7 20.2 4.3 98 103 A G T 3 + 0 0 6 70,-0.3 30,-0.2 1,-0.3 -1,-0.1 0.697 67.4 63.0 -58.9 -25.6 9.4 21.2 2.6 99 104 A D T 3 S- 0 0 10 29,-0.1 -1,-0.3 1,-0.1 39,-0.2 0.625 103.6-129.7 -74.2 -15.5 11.1 23.5 0.1 100 105 A G S <> S+ 0 0 0 -3,-2.2 4,-2.0 38,-0.1 -2,-0.1 0.359 74.5 118.7 85.0 -3.9 13.0 20.6 -1.3 101 106 A G H > S+ 0 0 0 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.858 72.8 50.3 -65.3 -38.1 16.4 22.4 -1.1 102 107 A V H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 3,-0.4 0.942 109.5 52.3 -66.3 -43.2 18.0 19.9 1.3 103 108 A L H > S+ 0 0 0 -6,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.904 105.6 56.3 -52.4 -47.7 16.9 17.0 -1.1 104 109 A R H < S+ 0 0 36 -4,-2.0 4,-0.3 31,-0.3 -1,-0.2 0.858 112.6 40.7 -51.9 -41.2 18.6 18.9 -3.9 105 110 A E H >< S+ 0 0 3 -4,-1.4 3,-0.9 -3,-0.4 4,-0.3 0.869 110.9 55.6 -78.8 -38.8 21.9 18.9 -2.1 106 111 A V H >< S+ 0 0 0 -4,-2.6 3,-1.8 1,-0.2 6,-0.2 0.932 101.2 57.9 -63.0 -42.1 21.8 15.4 -0.7 107 112 A V T 3< S+ 0 0 33 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.1 0.622 86.8 77.7 -68.9 -13.9 21.3 13.8 -4.1 108 113 A K T < S+ 0 0 61 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.2 0.624 75.8 88.7 -66.1 -18.1 24.6 15.3 -5.5 109 114 A H X - 0 0 13 -3,-1.8 3,-1.8 -4,-0.3 -1,-0.0 -0.787 68.7-154.7 -85.0 112.4 26.5 12.6 -3.5 110 115 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.811 93.0 65.8 -54.6 -31.7 26.9 9.5 -5.7 111 116 A S T 3 S+ 0 0 27 -3,-0.1 2,-0.5 2,-0.0 -4,-0.1 0.788 82.5 92.9 -58.2 -30.6 27.2 7.4 -2.6 112 117 A V < + 0 0 1 -3,-1.8 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- 0 0 73 0, 0.0 2,-0.4 0, 0.0 -4,-0.0 -0.325 15.8-135.2 -68.0 156.5 49.3 33.6 18.7 551 266 B L - 0 0 25 4,-0.0 15,-0.4 3,-0.0 2,-0.1 -0.941 7.7-133.4-114.3 139.4 47.5 33.9 22.1 552 267 B T > - 0 0 79 -2,-0.4 4,-2.3 1,-0.1 5,-0.2 -0.459 32.0-107.1 -78.5 160.0 47.3 31.2 24.8 553 268 B Q H > S+ 0 0 93 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.870 123.7 56.6 -49.9 -40.9 44.0 30.4 26.4 554 269 B Q H > S+ 0 0 136 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.937 106.1 48.9 -61.7 -44.4 45.4 32.2 29.5 555 270 B Q H > S+ 0 0 76 2,-0.2 4,-2.5 1,-0.2 6,-0.2 0.910 110.5 51.0 -60.2 -42.8 46.1 35.4 27.5 556 271 B V H <>S+ 0 0 3 -4,-2.3 5,-1.8 2,-0.2 4,-0.3 0.911 112.8 46.3 -58.6 -45.3 42.6 35.2 26.1 557 272 B A H ><5S+ 0 0 55 -4,-2.6 3,-1.5 2,-0.2 -2,-0.2 0.951 112.9 48.8 -60.9 -51.0 41.3 34.9 29.6 558 273 B Q H 3<5S+ 0 0 124 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.833 111.4 49.7 -59.8 -34.5 43.5 37.8 30.9 559 274 B M T 3<5S- 0 0 26 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.487 106.3-131.9 -83.2 -3.8 42.4 40.1 28.1 560 275 B Q T < 5 - 0 0 145 -3,-1.5 -3,-0.2 -4,-0.3 -2,-0.1 0.759 37.8-177.6 57.5 28.5 38.8 39.2 28.9 561 276 B L < - 0 0 11 -5,-1.8 -1,-0.2 -6,-0.2 -2,-0.0 -0.351 22.0-175.9 -61.4 132.3 38.1 38.5 25.2 562 277 B K S S+ 0 0 103 -200,-0.1 -274,-2.4 -275,-0.1 -273,-0.2 0.551 82.5 9.5-102.1 -14.2 34.5 37.6 24.3 563 278 B Y S S+ 0 0 8 -276,-0.3 -276,-2.2 -201,-0.2 2,-0.1 0.649 106.2 78.2-128.8 -56.0 35.1 36.9 20.5 564 279 B Y + 0 0 0 -202,-0.2 2,-0.3 -278,-0.2 -1,-0.1 -0.362 40.5 139.6 -71.0 138.0 38.8 36.8 19.5 565 280 B N > - 0 0 17 -2,-0.1 4,-2.2 -3,-0.1 5,-0.1 -0.901 63.4 -92.7-156.6 178.4 41.2 34.0 19.9 566 281 B S H > S+ 0 0 8 -15,-0.4 4,-2.0 -2,-0.3 5,-0.1 0.830 124.1 49.6 -69.9 -31.7 43.9 32.6 17.6 567 282 B D H > S+ 0 0 96 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.899 111.4 50.2 -69.4 -43.6 41.7 29.9 16.1 568 283 B V H > S+ 0 0 7 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.876 108.3 54.2 -56.9 -43.9 39.0 32.5 15.4 569 284 B H H < S+ 0 0 0 -4,-2.2 4,-0.4 2,-0.2 -2,-0.2 0.947 111.2 44.6 -54.3 -52.4 41.7 34.7 13.8 570 285 B R H >< S+ 0 0 76 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.935 114.6 48.6 -58.4 -46.7 42.6 31.8 11.4 571 286 B A H >< S+ 0 0 18 -4,-2.5 3,-2.1 1,-0.2 -1,-0.2 0.785 94.3 74.0 -67.4 -28.4 39.0 31.0 10.6 572 287 B A T 3< S+ 0 0 7 -4,-2.1 -52,-1.8 1,-0.3 -1,-0.2 0.666 94.8 53.7 -60.8 -18.5 38.1 34.6 9.9 573 288 B F T < S+ 0 0 23 -3,-1.2 2,-1.0 -4,-0.4 -1,-0.3 0.480 84.3 97.9 -94.3 -7.1 40.0 34.3 6.6 574 289 B V < - 0 0 40 -3,-2.1 3,-0.1 -4,-0.2 -54,-0.0 -0.736 63.2-166.6 -88.6 102.0 38.0 31.2 5.5 575 290 B L - 0 0 13 -2,-1.0 -297,-0.1 1,-0.1 -298,-0.1 -0.588 27.3 -91.2 -93.6 153.9 35.4 32.5 3.2 576 291 B P >> - 0 0 1 0, 0.0 4,-2.8 0, 0.0 3,-0.8 -0.188 49.1-105.2 -49.0 147.5 32.1 31.0 1.7 577 292 B E H 3> S+ 0 0 2 -304,-2.0 4,-2.7 1,-0.3 -304,-0.3 0.854 119.2 55.5 -54.1 -42.4 32.9 29.4 -1.6 578 293 B F H 3> S+ 0 0 46 -306,-2.5 4,-1.9 1,-0.2 -1,-0.3 0.883 114.5 40.3 -57.0 -38.8 31.2 32.2 -3.6 579 294 B A H <> S+ 0 0 0 -3,-0.8 4,-2.6 -307,-0.2 5,-0.2 0.904 113.0 53.0 -80.1 -42.3 33.4 34.8 -2.0 580 295 B R H X S+ 0 0 44 -4,-2.8 4,-1.9 1,-0.2 5,-0.5 0.922 113.8 45.5 -53.7 -48.4 36.6 32.6 -2.1 581 296 B K H X S+ 0 0 110 -4,-2.7 4,-1.7 -5,-0.3 -2,-0.2 0.925 111.9 50.2 -61.8 -48.2 36.0 32.1 -5.8 582 297 B A H < S+ 0 0 32 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.874 119.6 36.8 -60.4 -39.2 35.3 35.8 -6.5 583 298 B L H < S+ 0 0 15 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.712 131.7 22.5 -87.5 -22.2 38.4 37.0 -4.7 584 299 B N H < S+ 0 0 90 -4,-1.9 -3,-0.2 -5,-0.2 2,-0.2 0.769 100.0 79.5-119.8 -36.8 40.9 34.2 -5.7 585 300 B D < - 0 0 63 -4,-1.7 2,-0.3 -5,-0.5 0, 0.0 -0.491 69.7-124.3 -82.0 150.1 39.9 32.3 -8.8 586 301 B V 0 0 142 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.1 -0.635 360.0 360.0 -89.9 145.0 40.5 33.6 -12.4 587 302 B S 0 0 180 -2,-0.3 -1,-0.1 0, 0.0 -2,-0.0 0.320 360.0 360.0-139.4 360.0 37.7 33.9 -15.1