==== 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 TRANSFERASE(METHYLTRANSFERASE) 24-JAN-94 1TIS . COMPND 2 MOLECULE: THYMIDYLATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTERIA PHAGE T4; . AUTHOR J.FINER-MOORE,R.STROUD . 286 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15071.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 199 69.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 11.5 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 . 2 0.7 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 . 31 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 67 23.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.1 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 1 0 1 0 0 2 1 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 2 0 0 2 0 1 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 . 1 0 0 0 0 1 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 1 A M 0 0 61 0, 0.0 35,-0.1 0, 0.0 40,-0.0 0.000 360.0 360.0 360.0 168.4 23.7 23.3 -15.9 2 2 A K >> + 0 0 136 231,-0.1 3,-1.0 2,-0.0 4,-0.8 0.620 360.0 73.7-134.0 -50.2 21.1 23.3 -13.0 3 3 A Q H 3> S+ 0 0 23 1,-0.2 4,-1.6 2,-0.2 33,-0.0 0.529 84.9 68.1 -61.1 -12.2 21.9 25.4 -9.9 4 4 A Y H 3> S+ 0 0 13 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.960 98.3 51.7 -74.2 -44.4 21.3 28.9 -11.3 5 5 A Q H <> S+ 0 0 24 -3,-1.0 4,-1.1 1,-0.2 -2,-0.2 0.857 109.4 53.0 -52.8 -42.4 17.5 28.3 -11.7 6 6 A D H >X S+ 0 0 84 -4,-0.8 4,-1.7 2,-0.2 3,-1.2 0.988 102.7 54.2 -57.6 -64.8 17.4 27.2 -8.1 7 7 A L H 3X S+ 0 0 16 -4,-1.6 4,-1.6 1,-0.3 3,-0.5 0.829 103.2 56.9 -43.7 -48.5 19.1 30.3 -6.5 8 8 A I H 3X S+ 0 0 14 -4,-1.5 4,-1.2 1,-0.3 3,-0.5 0.853 109.2 45.9 -52.0 -44.4 16.8 32.8 -8.1 9 9 A K H < S+ 0 0 0 -4,-1.6 3,-1.6 -3,-0.5 -1,-0.2 0.916 98.1 62.8 -68.6 -41.2 16.1 34.6 -3.1 12 12 A F H >< S+ 0 0 84 -4,-1.2 3,-0.9 1,-0.3 -2,-0.2 0.943 105.4 41.9 -46.8 -58.5 12.2 34.9 -3.2 13 13 A E T 3< S+ 0 0 144 -4,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.614 87.1 105.4 -67.4 -10.5 11.7 33.2 0.1 14 14 A N T < S- 0 0 26 -3,-1.6 2,-0.7 -4,-0.4 -1,-0.2 0.586 78.3-137.6 -37.1 -34.5 14.7 35.1 1.6 15 15 A G < + 0 0 51 -3,-0.9 2,-1.4 -4,-0.2 -1,-0.2 -0.468 69.0 103.5 103.3 -57.6 12.4 37.5 3.6 16 16 A Y + 0 0 169 -2,-0.7 12,-1.3 12,-0.3 2,-1.3 -0.430 31.0 166.9 -79.6 89.8 14.1 40.8 3.0 17 17 A E E +A 27 0A 145 -2,-1.4 2,-0.3 10,-0.2 10,-0.3 -0.818 44.5 174.1 -87.0 93.0 12.3 42.9 0.5 18 18 A T E -A 26 0A 60 8,-1.7 8,-0.9 -2,-1.3 6,-0.2 -0.797 47.4-115.5-135.2 158.4 14.3 45.8 1.5 19 19 A D + 0 0 126 -2,-0.3 2,-0.2 6,-0.2 6,-0.1 -0.322 41.5 168.4 -66.3 163.6 15.5 49.4 1.2 20 20 A D - 0 0 63 4,-0.3 3,-0.4 1,-0.2 -1,-0.1 -0.551 46.0 -57.1-160.6-154.7 19.1 49.8 0.3 21 21 A R S S+ 0 0 239 1,-0.2 2,-2.6 -2,-0.2 -1,-0.2 0.965 127.2 26.1 -80.3 -78.4 21.4 52.6 -0.8 22 22 A T S S- 0 0 136 -3,-0.1 -1,-0.2 1,-0.0 0, 0.0 -0.427 112.0-143.0 -91.3 70.4 20.1 54.3 -4.0 23 23 A G + 0 0 41 -2,-2.6 2,-0.2 -3,-0.4 -4,-0.1 0.197 61.3 115.1 -49.8 146.8 16.8 53.1 -2.8 24 24 A T S S- 0 0 83 -6,-0.2 2,-0.3 2,-0.0 -4,-0.3 -0.471 78.9 -67.5-167.0-128.8 13.8 51.8 -4.3 25 25 A G - 0 0 8 -2,-0.2 195,-2.2 -6,-0.1 2,-0.3 -0.950 46.7-179.5-138.0 160.7 13.2 48.2 -3.2 26 26 A T E -AB 18 219A 7 -8,-0.9 -8,-1.7 -2,-0.3 2,-0.5 -0.942 26.1-136.7-150.0 154.7 15.0 44.9 -3.9 27 27 A I E +AB 17 218A 42 191,-2.1 191,-2.5 -2,-0.3 2,-0.3 -0.987 47.1 159.4-109.8 132.1 14.4 41.2 -2.8 28 28 A A E - B 0 217A 16 -12,-1.3 2,-0.4 -2,-0.5 -12,-0.3 -0.989 34.0-152.5-155.4 158.7 17.9 40.0 -1.8 29 29 A L E - B 0 216A 49 187,-2.7 187,-1.6 -2,-0.3 2,-0.6 -1.000 16.8-139.2-141.2 131.8 19.7 37.3 0.2 30 30 A F E S+ B 0 215A 158 -2,-0.4 185,-0.2 185,-0.2 184,-0.1 -0.826 76.5 36.2 -93.7 114.8 23.2 37.7 1.8 31 31 A G + 0 0 50 183,-1.9 2,-0.2 -2,-0.6 183,-0.2 0.793 64.9 158.9 116.9 71.8 25.5 34.7 1.5 32 32 A S + 0 0 14 181,-0.3 181,-3.1 -3,-0.1 2,-0.3 -0.739 10.6 176.0-116.7 168.8 25.3 32.6 -1.7 33 33 A K E +C 212 0A 110 179,-0.3 2,-0.3 -2,-0.2 179,-0.2 -0.935 1.9 179.4-162.7 144.6 27.8 30.1 -3.3 34 34 A L E -C 211 0A 9 177,-1.0 177,-1.6 -2,-0.3 2,-0.3 -0.924 15.8-143.5-139.5 168.3 27.4 27.8 -6.4 35 35 A R E -C 210 0A 148 -2,-0.3 2,-0.4 175,-0.2 175,-0.3 -0.993 11.6-165.7-139.1 136.4 29.8 25.3 -8.0 36 36 A W E -C 209 0A 4 173,-2.9 173,-2.6 -2,-0.3 2,-0.8 -0.959 15.0-145.8-121.6 137.9 30.3 24.6 -11.8 37 37 A D E > -C 208 0A 80 -2,-0.4 3,-0.9 171,-0.2 171,-0.2 -0.881 8.5-170.7 -99.1 109.6 32.1 21.7 -13.5 38 38 A L G > S+ 0 0 7 169,-2.0 3,-1.2 -2,-0.8 -1,-0.2 0.704 83.8 72.1 -71.1 -14.6 33.6 23.2 -16.7 39 39 A T G 3 S+ 0 0 71 168,-0.3 -1,-0.2 1,-0.3 3,-0.1 0.833 94.9 51.8 -62.7 -37.8 34.3 19.5 -17.5 40 40 A K G < S- 0 0 159 -3,-0.9 -1,-0.3 1,-0.3 -2,-0.1 -0.103 132.5 -63.2 -94.5 37.4 30.7 19.0 -18.1 41 41 A G < - 0 0 10 -3,-1.2 -1,-0.3 195,-0.0 198,-0.2 -0.250 67.2 -57.4 109.3 166.7 30.5 22.0 -20.5 42 42 A F - 0 0 6 196,-2.4 196,-0.3 1,-0.1 -4,-0.1 -0.715 46.5-148.7 -84.2 107.1 31.1 25.7 -20.5 43 43 A P + 0 0 4 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 0.543 50.2 130.9 -62.5 -8.0 28.6 27.1 -17.9 44 44 A A - 0 0 5 144,-0.1 2,-0.2 1,-0.1 194,-0.2 -0.185 51.4-145.7 -65.9 100.2 27.9 30.6 -19.5 45 45 A V - 0 0 16 -2,-0.8 144,-0.1 1,-0.1 -1,-0.1 -0.392 16.8-160.6 -63.2 120.0 24.2 30.7 -19.4 46 46 A T + 0 0 25 -2,-0.2 3,-0.1 230,-0.0 -1,-0.1 0.290 36.4 126.6 -80.0-144.4 22.8 32.5 -22.5 47 47 A T S S+ 0 0 44 228,-0.2 2,-0.1 230,-0.2 229,-0.0 0.751 75.6 45.0 69.0 114.6 19.4 34.2 -23.1 48 48 A K S S- 0 0 60 230,-1.7 2,-0.9 2,-0.1 -1,-0.1 0.422 120.9 -86.7 87.2 128.2 19.6 37.7 -24.2 49 49 A K - 0 0 153 231,-0.2 2,-0.1 -3,-0.1 227,-0.0 -0.613 58.9-123.9 -65.4 103.2 22.4 37.3 -26.9 50 50 A L - 0 0 21 -2,-0.9 2,-2.6 1,-0.1 3,-0.3 -0.415 7.8-125.9 -51.1 123.3 24.9 37.7 -24.1 51 51 A A + 0 0 57 1,-0.2 4,-0.3 2,-0.1 -1,-0.1 -0.560 55.1 154.4 -76.1 83.3 27.1 40.6 -25.1 52 52 A W >> + 0 0 28 -2,-2.6 4,-2.3 2,-0.2 3,-1.7 0.910 55.0 67.2 -85.0 -44.9 29.9 38.2 -24.5 53 53 A K H 3> S+ 0 0 100 -3,-0.3 4,-1.1 1,-0.3 -1,-0.2 0.808 105.5 46.1 -43.3 -37.7 32.5 39.9 -26.9 54 54 A A H 3> S+ 0 0 10 2,-0.2 4,-0.8 1,-0.2 -1,-0.3 0.622 109.7 54.2 -81.8 -19.7 32.6 42.9 -24.5 55 55 A C H <> S+ 0 0 1 -3,-1.7 4,-1.8 -4,-0.3 -2,-0.2 0.854 109.3 47.8 -75.1 -35.7 32.9 40.5 -21.6 56 56 A I H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.820 112.2 51.1 -71.0 -33.7 35.9 38.9 -23.2 57 57 A A H X S+ 0 0 0 -4,-1.1 4,-1.3 -5,-0.3 -1,-0.2 0.725 106.4 51.6 -80.2 -25.6 37.4 42.3 -23.9 58 58 A E H X S+ 0 0 11 -4,-0.8 4,-3.0 2,-0.2 -2,-0.2 0.922 109.1 52.1 -74.2 -47.0 37.0 43.6 -20.4 59 59 A L H X S+ 0 0 3 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.908 111.1 45.9 -57.7 -45.2 38.8 40.5 -19.1 60 60 A I H X S+ 0 0 0 -4,-1.8 4,-1.0 2,-0.2 -1,-0.2 0.927 114.1 48.3 -64.9 -39.9 41.8 40.9 -21.4 61 61 A W H >X>S+ 0 0 0 -4,-1.3 5,-1.3 2,-0.3 3,-1.2 0.945 109.0 54.0 -61.4 -49.0 42.1 44.6 -20.6 62 62 A F H ><5S+ 0 0 3 -4,-3.0 3,-1.6 1,-0.3 52,-0.2 0.939 108.8 49.4 -46.8 -52.5 41.8 43.8 -16.9 63 63 A L H 3<5S+ 0 0 3 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.3 0.677 101.8 64.6 -66.4 -20.2 44.8 41.4 -17.5 64 64 A S H <<5S- 0 0 46 -3,-1.2 -1,-0.3 -4,-1.0 -2,-0.2 0.626 107.6-120.0 -80.4 -6.3 46.7 44.2 -19.3 65 65 A G T <<5 + 0 0 24 -3,-1.6 -3,-0.2 -4,-0.7 -2,-0.1 0.607 64.9 146.3 80.5 9.3 47.0 46.5 -16.2 66 66 A S < + 0 0 16 -5,-1.3 45,-0.5 1,-0.1 -1,-0.2 -0.237 32.9 172.1 -84.0 167.7 45.1 49.2 -18.0 67 67 A T + 0 0 20 43,-0.2 38,-1.5 1,-0.1 2,-0.6 0.171 50.8 103.6-153.6 4.6 42.7 51.6 -16.5 68 68 A N B >> -G 104 0B 34 36,-0.2 3,-0.9 1,-0.1 4,-0.7 -0.930 63.5-145.0-105.8 129.8 42.2 53.8 -19.5 69 69 A V H >> S+ 0 0 1 34,-2.2 4,-2.0 -2,-0.6 3,-0.8 0.782 94.5 62.8 -59.2 -45.6 38.9 53.2 -21.2 70 70 A N H 3> S+ 0 0 32 1,-0.3 4,-2.5 2,-0.2 -1,-0.3 0.829 97.8 59.6 -56.1 -29.9 40.2 53.9 -24.8 71 71 A D H <> S+ 0 0 61 -3,-0.9 4,-1.9 2,-0.2 -1,-0.3 0.932 103.7 49.4 -63.0 -40.0 42.5 50.9 -24.4 72 72 A L H - 0 0 14 -9,-0.0 3,-2.3 -31,-0.0 4,-0.4 -0.965 35.5 -95.9-165.2 150.3 31.8 49.9 -24.2 86 86 A V T 3 S+ 0 0 60 -2,-0.3 -2,-0.0 1,-0.3 -31,-0.0 0.528 118.6 43.7 -42.0 -27.6 30.8 48.6 -20.8 87 87 A W T 3> S+ 0 0 14 -18,-0.1 4,-2.1 1,-0.1 -1,-0.3 0.526 88.0 94.3-104.4 -1.4 32.6 51.3 -18.7 88 88 A D H <> S+ 0 0 9 -3,-2.3 4,-2.7 1,-0.3 2,-2.0 0.939 86.2 42.7 -54.7 -61.0 31.7 54.4 -20.8 89 89 A E H 4 S+ 0 0 143 -4,-0.4 -1,-0.3 1,-0.2 -5,-0.0 -0.694 116.3 53.1 -88.8 78.7 28.6 55.6 -19.0 90 90 A N H 4>S+ 0 0 13 -2,-2.0 5,-1.9 -3,-0.2 3,-0.3 -0.208 110.7 43.3-175.2 -41.7 30.5 54.9 -15.7 91 91 A Y H <>S+ 0 0 13 -4,-2.1 5,-2.5 -3,-0.5 2,-0.5 0.970 106.0 65.0 -75.2 -61.2 33.5 57.0 -16.6 92 92 A E T <5S+ 0 0 89 -4,-2.7 -1,-0.2 -5,-0.2 -3,-0.1 0.402 125.2 7.7 -45.6 -5.2 31.2 59.8 -18.0 93 93 A N T >5S+ 0 0 79 -2,-0.5 4,-3.0 -3,-0.3 5,-0.2 0.157 132.7 38.0-139.1 -74.1 29.9 60.4 -14.6 94 94 A Q T 45S+ 0 0 102 1,-0.2 -3,-0.2 2,-0.2 4,-0.1 0.852 126.5 36.4 -53.1 -48.9 31.6 58.6 -11.6 95 95 A A T >>XS+ 0 0 0 -5,-1.9 3,-2.4 1,-0.2 5,-1.1 0.953 118.6 48.1 -68.7 -47.5 35.1 58.9 -12.9 96 96 A K G >4 - 0 0 136 1,-0.1 3,-1.4 0, 0.0 -1,-0.1 -0.986 48.5 -23.2-138.9 150.8 39.8 63.2 -18.2 102 102 A S T 3 S+ 0 0 95 -2,-0.4 2,-0.1 1,-0.3 -1,-0.1 0.597 128.3 4.0 14.7 76.8 39.7 61.4 -21.4 103 103 A G T 3 S+ 0 0 1 1,-0.2 -34,-2.2 -3,-0.1 -1,-0.3 -0.525 91.5 105.5 135.3 -60.0 40.7 58.1 -20.4 104 104 A E B < +G 68 0B 87 -3,-1.4 -1,-0.2 -36,-0.2 -36,-0.2 -0.278 26.0 176.2 -72.0 140.8 41.2 57.3 -16.7 105 105 A L - 0 0 0 -38,-1.5 47,-2.1 1,-0.4 48,-0.2 0.434 52.8-114.9-103.3 -13.6 38.9 55.4 -14.5 106 106 A G - 0 0 2 -39,-0.3 2,-3.1 45,-0.2 -1,-0.4 -0.538 68.2 -22.0 98.9-176.1 41.3 55.6 -11.5 107 107 A P S S+ 0 0 19 0, 0.0 5,-0.3 0, 0.0 44,-0.1 -0.114 86.4 168.7 -73.1 61.0 43.1 52.5 -9.9 108 108 A I >> - 0 0 1 -2,-3.1 4,-1.3 42,-0.2 3,-1.0 0.031 51.9 -73.2 -65.8 162.3 40.6 50.0 -11.1 109 109 A Y H 3> S+ 0 0 7 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.743 125.9 58.2 -19.0 -66.2 40.9 46.2 -11.1 110 110 A G H >> S+ 0 0 1 1,-0.2 4,-2.7 2,-0.2 3,-0.9 0.867 108.4 45.4 -45.1 -53.7 43.5 45.9 -13.9 111 111 A K H <> S+ 0 0 35 -3,-1.0 4,-3.5 -45,-0.5 -1,-0.2 0.971 112.0 50.9 -58.0 -52.2 46.0 48.0 -12.0 112 112 A Q H 3< S+ 0 0 0 -4,-1.3 4,-0.4 -5,-0.3 -1,-0.3 0.713 112.6 49.7 -61.6 -12.2 45.3 46.1 -8.7 113 113 A W H << S+ 0 0 3 -4,-1.6 8,-1.0 -3,-0.9 9,-0.5 0.929 124.2 27.3 -84.7 -42.6 45.9 42.9 -10.6 114 114 A R H < S+ 0 0 48 -4,-2.7 -2,-0.2 -52,-0.2 -3,-0.2 0.659 137.0 22.6 -93.4 -14.9 49.1 44.0 -12.2 115 115 A D < + 0 0 71 -4,-3.5 2,-1.8 -5,-0.3 3,-0.2 -0.164 58.9 160.3-150.7 50.0 50.3 46.5 -9.6 116 116 A F B > S-H 119 0C 56 3,-1.7 3,-1.2 -4,-0.4 -4,-0.1 -0.483 96.7 -31.1 -83.4 93.6 49.0 46.1 -6.0 117 117 A G T 3 S- 0 0 70 -2,-1.8 -1,-0.3 1,-0.3 3,-0.1 0.659 124.2 -50.7 76.9 17.6 51.6 48.0 -4.2 118 118 A G T 3 S+ 0 0 55 1,-0.4 2,-0.6 -3,-0.2 -1,-0.3 0.216 108.9 126.0 99.1 -10.9 54.1 47.0 -6.8 119 119 A V B < -H 116 0C 68 -3,-1.2 -3,-1.7 1,-0.1 2,-1.6 -0.713 54.2-150.0 -75.0 117.7 53.2 43.2 -6.5 120 120 A D > - 0 0 46 -2,-0.6 4,-1.9 -5,-0.2 -6,-0.2 -0.717 21.8-178.9 -84.8 90.1 52.4 42.2 -10.1 121 121 A Q H > + 0 0 25 -2,-1.6 4,-0.5 -8,-1.0 -7,-0.2 0.503 67.5 56.1 -77.2 -3.8 49.9 39.6 -8.8 122 122 A I H >> S+ 0 0 3 -9,-0.5 4,-1.5 2,-0.1 3,-1.2 0.897 111.4 42.9 -81.9 -65.3 48.8 38.1 -12.3 123 123 A I H 3> S+ 0 0 32 1,-0.3 4,-0.8 2,-0.2 3,-0.2 0.824 119.3 43.7 -47.5 -37.4 52.3 37.1 -13.4 124 124 A E H 3X S+ 0 0 83 -4,-1.9 4,-1.7 1,-0.2 -1,-0.3 0.746 106.7 56.3 -91.3 -10.6 53.3 35.8 -10.1 125 125 A V H X S+ 0 0 38 -4,-0.8 4,-1.9 -5,-0.3 3,-0.6 0.989 102.3 54.2 -68.0 -54.4 54.1 30.9 -11.1 128 128 A R H 3X S+ 0 0 79 -4,-1.7 4,-2.4 1,-0.3 3,-0.4 0.877 112.4 46.5 -44.4 -43.1 52.8 29.4 -7.7 129 129 A I H 3< S+ 0 0 6 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.879 115.5 45.9 -63.6 -43.0 50.5 27.2 -9.8 130 130 A K H << S+ 0 0 74 -4,-1.7 -1,-0.3 -3,-0.6 -2,-0.2 0.740 130.8 20.3 -67.4 -22.0 53.4 26.4 -12.1 131 131 A K H < S+ 0 0 147 -4,-1.9 -3,-0.2 -3,-0.4 -2,-0.2 0.836 134.0 22.9-128.1 -51.5 55.7 25.7 -9.3 132 132 A L S >< S+ 0 0 100 -4,-2.4 3,-1.4 -5,-0.3 -3,-0.1 -0.184 73.7 170.7-106.2 45.5 54.2 24.9 -5.8 133 133 A P T 3 S+ 0 0 49 0, 0.0 2,-0.4 0, 0.0 31,-0.3 0.655 71.0 51.3 -39.9 -47.6 50.8 23.7 -7.2 134 134 A N T 3 S+ 0 0 92 -3,-0.1 2,-0.2 29,-0.1 -5,-0.1 0.092 85.0 122.9 -82.5 32.1 49.3 22.3 -4.0 135 135 A D < - 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