==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 13-APR-04 1VK1 . COMPND 2 MOLECULE: CONSERVED HYPOTHETICAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR A.SHAH,Z.J.LIU,W.TEMPEL,L.CHEN,D.LEE,H.YANG,J.CHANG,M.ZHAO,J . 232 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11407.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 162 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 5.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 16.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 1 0.4 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 . 14 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 60 25.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.6 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 0 0 1 0 0 2 2 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 3 2 3 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 0 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 1 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 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 11 A I 0 0 125 0, 0.0 218,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 154.5 -9.2 13.7 11.2 2 12 A P - 0 0 85 0, 0.0 218,-2.6 0, 0.0 2,-0.3 -0.340 360.0-123.2 -72.4 149.2 -13.0 14.5 11.3 3 13 A V E -a 220 0A 85 216,-0.2 2,-0.4 -2,-0.1 216,-0.0 -0.737 33.2-169.3 -83.6 139.6 -14.5 18.0 11.2 4 14 A K E -a 221 0A 69 216,-2.6 218,-2.3 -2,-0.3 2,-0.7 -0.998 25.1-129.7-136.4 129.3 -16.7 18.6 14.2 5 15 A K - 0 0 190 -2,-0.4 2,-0.3 216,-0.2 218,-0.1 -0.715 37.4-172.6 -73.1 116.9 -19.2 21.4 14.9 6 16 A V - 0 0 33 -2,-0.7 2,-0.4 216,-0.2 -2,-0.0 -0.849 27.2-109.6-114.6 150.4 -18.2 22.5 18.4 7 17 A E - 0 0 115 -2,-0.3 2,-0.2 1,-0.0 -2,-0.0 -0.658 37.1-159.3 -78.9 129.6 -19.9 25.0 20.6 8 18 A Y - 0 0 86 -2,-0.4 2,-0.3 70,-0.1 70,-0.2 -0.604 5.7-154.5-102.1 167.4 -18.0 28.2 21.0 9 19 A V E -B 77 0B 78 68,-2.2 68,-2.4 -2,-0.2 2,-0.3 -0.989 24.3-112.7-137.4 143.6 -18.2 30.9 23.6 10 20 A F E -B 76 0B 80 -2,-0.3 2,-0.4 66,-0.2 64,-0.0 -0.648 36.1-172.0 -75.8 133.8 -17.3 34.6 23.4 11 21 A I E -B 75 0B 20 64,-2.0 64,-2.1 -2,-0.3 2,-0.2 -0.986 29.1-107.8-126.5 139.3 -14.3 35.4 25.5 12 22 A E E > -B 74 0B 111 -2,-0.4 3,-2.0 62,-0.2 62,-0.3 -0.447 22.6-134.8 -67.9 132.8 -13.0 38.9 26.2 13 23 A L G > S+ 0 0 2 60,-2.2 3,-1.6 1,-0.3 -1,-0.1 0.806 101.4 65.7 -59.1 -31.7 -9.7 39.5 24.4 14 24 A D G 3 S+ 0 0 85 59,-0.4 -1,-0.3 1,-0.3 60,-0.1 0.508 95.9 58.0 -73.4 -3.9 -8.1 41.1 27.5 15 25 A K G < S+ 0 0 72 -3,-2.0 40,-2.8 39,-0.1 2,-0.4 0.463 87.9 95.7 -97.6 -5.4 -8.3 37.7 29.2 16 26 A M E < -c 55 0B 3 -3,-1.6 40,-0.2 -4,-0.3 30,-0.0 -0.736 58.3-160.2 -95.4 134.8 -6.2 35.9 26.5 17 27 A X E -c 56 0B 103 38,-3.1 40,-2.8 -2,-0.4 2,-0.1 -0.949 11.5-135.9-119.7 126.3 -2.5 35.5 26.9 18 28 A P - 0 0 37 0, 0.0 3,-0.1 0, 0.0 40,-0.1 -0.367 14.6-170.2 -76.2 156.4 -0.1 34.9 24.1 19 29 A H S S+ 0 0 0 38,-0.2 189,-2.8 1,-0.2 2,-0.3 0.364 71.5 37.5-120.6 0.2 2.7 32.3 24.0 20 30 A E B S-f 208 0C 13 187,-0.3 189,-0.2 192,-0.0 -1,-0.2 -0.985 79.0-108.4-148.1 158.2 4.4 33.4 20.8 21 31 A Q - 0 0 67 187,-1.9 190,-0.6 -2,-0.3 2,-0.2 -0.200 39.9-104.1 -76.2 172.4 5.3 36.5 18.8 22 32 A L - 0 0 56 188,-0.2 2,-0.5 39,-0.1 -1,-0.1 -0.632 8.8-132.4-103.5 156.8 3.7 37.6 15.6 23 33 A V > - 0 0 1 -2,-0.2 4,-2.2 1,-0.1 3,-0.3 -0.934 22.5-140.5-100.7 122.5 4.6 37.6 11.9 24 34 A Q H > S+ 0 0 79 -2,-0.5 4,-2.7 1,-0.2 5,-0.2 0.904 99.9 51.5 -55.1 -43.2 3.8 41.0 10.5 25 35 A R H > S+ 0 0 59 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.895 110.1 49.0 -62.5 -40.1 2.5 39.7 7.2 26 36 A E H > S+ 0 0 50 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.879 111.8 49.3 -67.7 -36.8 0.1 37.3 9.0 27 37 A L H X S+ 0 0 25 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.950 114.7 43.7 -64.3 -49.4 -1.2 40.0 11.2 28 38 A E H X S+ 0 0 71 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.894 112.6 52.3 -67.3 -39.0 -1.8 42.4 8.4 29 39 A D H X S+ 0 0 76 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.905 109.2 49.8 -63.0 -42.9 -3.4 39.7 6.2 30 40 A F H X S+ 0 0 31 -4,-2.0 4,-2.8 2,-0.2 5,-0.3 0.939 111.5 48.8 -59.2 -47.9 -5.8 38.7 9.0 31 41 A I H X S+ 0 0 28 -4,-2.2 4,-2.0 1,-0.2 5,-0.3 0.933 112.8 47.9 -60.4 -44.8 -6.8 42.4 9.5 32 42 A E H X S+ 0 0 132 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.905 114.6 46.3 -59.7 -44.6 -7.4 42.8 5.7 33 43 A S H X S+ 0 0 76 -4,-2.5 4,-2.7 2,-0.2 5,-0.4 0.918 113.2 46.1 -67.1 -46.8 -9.4 39.6 5.5 34 44 A V H X S+ 0 0 3 -4,-2.8 4,-1.6 1,-0.2 194,-0.2 0.898 117.7 43.4 -68.7 -37.6 -11.7 40.2 8.5 35 45 A T H < S+ 0 0 71 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.882 116.6 47.5 -74.5 -35.8 -12.4 43.8 7.5 36 46 A G H < S+ 0 0 67 -4,-2.1 -2,-0.2 -5,-0.3 -3,-0.2 0.899 123.6 31.1 -71.2 -41.1 -12.9 43.0 3.8 37 47 A S H < S- 0 0 71 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.712 92.5-142.0 -86.1 -25.1 -15.2 40.0 4.4 38 48 A G < + 0 0 26 -4,-1.6 190,-2.5 -5,-0.4 2,-0.4 0.561 65.5 108.0 71.2 10.6 -16.8 41.2 7.6 39 49 A I E -G 227 0D 46 -6,-0.4 2,-0.6 188,-0.2 188,-0.2 -0.971 56.2-156.7-129.9 132.3 -16.8 37.7 9.0 40 50 A F E +G 226 0D 3 186,-3.2 186,-1.9 -2,-0.4 -6,-0.0 -0.939 26.5 162.5-101.1 116.4 -14.7 36.0 11.7 41 51 A W + 0 0 120 -2,-0.6 183,-2.4 184,-0.2 -1,-0.1 0.505 48.2 70.4-119.1 -6.5 -14.9 32.3 10.9 42 52 A K S S- 0 0 98 181,-0.2 -1,-0.2 34,-0.0 181,-0.1 -0.929 75.7-136.9-120.3 107.8 -12.1 30.5 12.8 43 53 A P - 0 0 6 0, 0.0 34,-0.3 0, 0.0 2,-0.1 -0.205 21.3-108.0 -64.9 149.9 -12.6 30.3 16.5 44 54 A M E -d 77 0B 0 32,-2.5 34,-2.8 16,-0.1 2,-0.5 -0.448 26.3-137.9 -59.8 147.3 -9.8 31.0 19.0 45 55 A L E +dE 78 59B 15 14,-2.5 13,-2.6 32,-0.2 14,-1.8 -0.984 33.9 172.4-109.1 125.0 -8.5 27.9 20.7 46 56 A L E -dE 79 57B 0 32,-2.6 34,-3.2 -2,-0.5 2,-0.3 -0.882 24.0-162.8-129.4 159.7 -7.9 28.6 24.4 47 57 A A E -dE 80 56B 1 9,-1.8 9,-3.2 -2,-0.3 34,-0.1 -0.991 32.0-111.1-141.6 136.0 -7.1 26.8 27.6 48 58 A K E - E 0 55B 90 32,-0.6 7,-0.3 -2,-0.3 34,-0.2 -0.405 25.8-128.9 -67.1 138.1 -7.5 28.2 31.1 49 59 A I > - 0 0 9 5,-2.6 3,-1.7 -2,-0.1 5,-0.4 -0.780 37.2-107.1 -84.1 120.7 -4.3 29.0 33.0 50 60 A P T 3 S+ 0 0 90 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.158 100.6 18.5 -53.8 140.6 -4.6 27.2 36.4 51 61 A G T 3 S+ 0 0 92 1,-0.2 2,-0.3 2,-0.0 -2,-0.0 0.488 117.5 75.5 77.9 4.5 -5.2 29.5 39.4 52 62 A T S < S- 0 0 44 -3,-1.7 -1,-0.2 2,-0.2 0, 0.0 -0.862 78.4-128.5-133.0 171.2 -6.5 32.3 37.2 53 63 A D S S+ 0 0 121 -2,-0.3 2,-0.2 -3,-0.1 -5,-0.0 -0.074 81.2 102.6-106.0 32.2 -9.5 33.4 35.2 54 64 A E - 0 0 73 -5,-0.4 -5,-2.6 -38,-0.0 2,-0.4 -0.701 63.2-132.3-110.0 163.9 -7.2 34.0 32.2 55 65 A Y E -cE 16 48B 34 -40,-2.8 -38,-3.1 -7,-0.3 2,-0.4 -0.948 7.3-130.7-124.5 136.5 -6.6 31.8 29.1 56 66 A L E -cE 17 47B 0 -9,-3.2 -9,-1.8 -2,-0.4 2,-0.7 -0.697 30.2-125.7 -69.2 128.4 -3.6 30.6 27.2 57 67 A I E + E 0 46B 0 -40,-2.8 -11,-0.2 -2,-0.4 -38,-0.2 -0.735 33.7 174.6 -73.9 115.5 -4.0 31.3 23.5 58 68 A V E S+ 0 0 1 -13,-2.6 2,-0.4 -2,-0.7 157,-0.2 0.893 72.0 1.6 -85.3 -51.7 -3.5 27.8 22.0 59 69 A D E S+ E 0 45B 50 -14,-1.8 -14,-2.5 -3,-0.2 -1,-0.4 -0.996 111.1 55.1-140.4 134.0 -4.3 28.9 18.5 60 70 A G > + 0 0 3 -2,-0.4 4,-2.9 -16,-0.2 5,-0.2 0.626 43.8 145.8 120.8 28.5 -5.1 32.3 17.1 61 71 A H H > S+ 0 0 5 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.901 81.4 45.7 -57.1 -44.3 -2.4 34.8 18.1 62 72 A H H > S+ 0 0 17 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.875 113.5 49.8 -71.1 -35.6 -2.8 36.8 14.9 63 73 A R H > S+ 0 0 33 2,-0.2 4,-2.5 3,-0.2 -2,-0.2 0.936 114.0 45.3 -64.1 -46.9 -6.6 36.8 15.2 64 74 A W H X S+ 0 0 37 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.948 116.4 44.8 -60.6 -49.2 -6.4 38.0 18.8 65 75 A A H X S+ 0 0 15 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.882 113.5 50.4 -67.9 -37.8 -3.8 40.6 18.0 66 76 A G H X S+ 0 0 0 -4,-2.4 4,-2.0 -5,-0.2 -1,-0.2 0.922 111.2 48.4 -65.4 -42.9 -5.6 41.8 14.9 67 77 A L H X>S+ 0 0 0 -4,-2.5 5,-2.6 2,-0.2 4,-0.6 0.897 111.4 50.0 -63.4 -42.0 -8.9 42.1 16.7 68 78 A Q H ><5S+ 0 0 84 -4,-2.5 3,-1.3 1,-0.2 -2,-0.2 0.934 109.7 51.3 -61.4 -43.4 -7.2 44.1 19.6 69 79 A K H 3<5S+ 0 0 143 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.865 108.7 51.8 -61.7 -35.8 -5.6 46.4 17.0 70 80 A L H 3<5S- 0 0 58 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.567 120.3-110.5 -76.3 -10.1 -9.0 47.0 15.4 71 81 A G T <<5 + 0 0 52 -3,-1.3 -3,-0.2 -4,-0.6 -2,-0.1 0.624 64.1 152.2 88.5 18.2 -10.5 47.9 18.8 72 82 A A < - 0 0 14 -5,-2.6 160,-0.3 -6,-0.2 -1,-0.2 -0.228 35.6-153.4 -74.8 170.3 -12.7 44.8 19.3 73 83 A K + 0 0 38 158,-3.1 -60,-2.2 1,-0.2 -59,-0.4 0.675 64.5 18.0-115.3 -30.8 -13.6 43.4 22.7 74 84 A R E -B 12 0B 83 157,-1.8 -62,-0.2 -62,-0.3 -1,-0.2 -0.914 52.4-157.3-143.6 164.2 -14.3 39.7 22.3 75 85 A A E -B 11 0B 0 -64,-2.1 -64,-2.0 -2,-0.3 2,-0.2 -0.990 32.5-104.1-145.4 144.3 -13.8 36.7 20.1 76 86 A P E -B 10 0B 0 0, 0.0 -32,-2.5 0, 0.0 2,-0.3 -0.479 51.2-177.9 -64.7 134.4 -15.6 33.3 19.7 77 87 A S E -Bd 9 44B 1 -68,-2.4 -68,-2.2 -34,-0.3 2,-0.5 -0.953 33.0-140.0-141.3 149.7 -13.5 30.6 21.3 78 88 A V E - d 0 45B 12 -34,-2.8 -32,-2.6 -2,-0.3 2,-0.5 -0.969 26.1-143.3-109.7 127.1 -13.3 26.9 21.9 79 89 A I E - d 0 46B 75 -2,-0.5 2,-0.3 -34,-0.2 -32,-0.2 -0.837 22.1-171.4 -98.1 121.2 -12.1 26.1 25.5 80 90 A L E - d 0 47B 23 -34,-3.2 2,-0.9 -2,-0.5 -32,-0.6 -0.715 33.1-120.5-107.3 154.8 -9.8 23.1 25.7 81 91 A D > - 0 0 109 -2,-0.3 3,-1.7 1,-0.2 6,-0.2 -0.905 31.5-155.3 -88.3 108.1 -8.3 21.0 28.5 82 92 A Y T 3 S+ 0 0 5 -2,-0.9 -1,-0.2 1,-0.3 5,-0.1 0.829 85.8 51.0 -60.9 -33.6 -4.7 21.7 27.5 83 93 A F T 3 S+ 0 0 84 -3,-0.1 -1,-0.3 3,-0.1 2,-0.2 0.312 77.0 120.8 -96.6 12.9 -3.3 18.5 29.1 84 94 A D S X S- 0 0 86 -3,-1.7 3,-1.8 1,-0.1 -4,-0.0 -0.544 73.1-125.5 -64.4 137.2 -5.8 16.2 27.6 85 95 A E T 3 S+ 0 0 177 1,-0.3 -1,-0.1 -2,-0.2 -3,-0.0 0.713 106.9 68.5 -62.0 -22.7 -3.8 13.6 25.5 86 96 A G T 3 S+ 0 0 23 2,-0.0 2,-0.6 131,-0.0 -1,-0.3 0.690 82.8 82.4 -69.0 -21.8 -5.8 14.5 22.4 87 97 A V < - 0 0 9 -3,-1.8 2,-0.4 -6,-0.2 130,-0.2 -0.791 65.8-178.1 -86.9 116.3 -4.2 18.0 22.3 88 98 A K E -H 216 0E 29 128,-2.9 128,-2.7 -2,-0.6 2,-0.4 -0.912 13.9-151.4-117.1 148.4 -0.8 17.6 20.6 89 99 A V E +H 215 0E 24 -2,-0.4 126,-0.2 126,-0.2 2,-0.2 -0.970 22.8 155.1-123.8 135.1 1.8 20.2 19.9 90 100 A Y E -H 214 0E 116 124,-2.2 124,-1.9 -2,-0.4 2,-0.3 -0.494 33.3-112.5-128.5-163.6 4.4 20.4 17.1 91 101 A T - 0 0 1 79,-0.3 2,-0.3 122,-0.3 122,-0.2 -0.799 17.0-113.4-129.4 177.6 6.2 23.3 15.4 92 102 A W - 0 0 57 119,-1.1 98,-0.2 -2,-0.3 78,-0.2 -0.810 20.5-135.7-106.7 156.8 6.4 25.2 12.2 93 103 A Y E -I 169 0F 26 76,-2.8 76,-2.7 -2,-0.3 2,-0.2 -0.911 14.0-146.4-116.3 101.5 9.4 25.2 9.8 94 104 A P E +I 168 0F 1 0, 0.0 94,-3.2 0, 0.0 2,-0.3 -0.491 27.9 173.9 -64.9 131.2 10.2 28.7 8.4 95 105 A A E -IJ 167 187F 0 72,-3.2 72,-2.8 92,-0.2 2,-0.4 -0.944 11.5-152.7-136.7 156.4 11.6 28.3 4.9 96 106 A F E -IJ 166 186F 0 90,-2.2 89,-2.7 -2,-0.3 90,-1.3 -0.974 22.0-143.6-138.9 156.4 12.5 30.8 2.3 97 107 A X E S+I 165 0F 125 68,-2.0 68,-2.2 -2,-0.4 2,-0.3 -0.974 71.3 64.7-105.4 115.3 12.9 31.5 -1.4 98 108 A G S S- 0 0 27 -2,-0.6 2,-0.7 66,-0.2 66,-0.1 -0.980 90.3 -37.7 160.1-169.4 15.9 33.7 -1.7 99 109 A D >> - 0 0 79 64,-0.4 4,-2.0 -2,-0.3 3,-0.8 -0.779 36.3-160.7 -96.3 109.2 19.7 34.1 -1.3 100 110 A V H 3> S+ 0 0 16 -2,-0.7 4,-3.0 1,-0.3 5,-0.2 0.796 91.0 60.8 -60.1 -31.0 21.1 32.3 1.8 101 111 A N H 3> S+ 0 0 115 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.900 106.1 46.3 -65.3 -37.0 24.2 34.5 1.7 102 112 A X H <> S+ 0 0 130 -3,-0.8 4,-2.1 2,-0.2 -2,-0.2 0.919 112.8 49.9 -67.9 -43.0 22.1 37.6 2.1 103 113 A V H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.949 111.2 49.3 -59.5 -47.6 20.1 36.0 4.9 104 114 A I H X S+ 0 0 17 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.913 108.9 52.4 -60.9 -43.3 23.4 34.9 6.7 105 115 A E H X S+ 0 0 59 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.931 111.3 47.0 -57.8 -43.6 24.9 38.4 6.4 106 116 A R H X S+ 0 0 74 -4,-2.1 4,-0.7 2,-0.2 -2,-0.2 0.879 111.2 51.3 -67.1 -37.5 21.7 39.8 8.0 107 117 A L H ><>S+ 0 0 0 -4,-2.4 5,-1.7 1,-0.2 3,-1.1 0.941 110.4 48.6 -62.4 -45.4 21.8 37.2 10.8 108 118 A K H ><5S+ 0 0 119 -4,-2.7 3,-2.0 1,-0.3 -2,-0.2 0.884 104.1 60.5 -64.9 -34.7 25.4 38.0 11.5 109 119 A A H 3<5S+ 0 0 80 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.730 100.8 55.9 -63.5 -22.4 24.6 41.7 11.6 110 120 A E T <<5S- 0 0 69 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.328 128.3 -97.9 -91.1 6.5 22.2 41.0 14.5 111 121 A G T < 5S+ 0 0 63 -3,-2.0 2,-0.2 1,-0.3 -3,-0.2 0.561 79.4 136.3 90.8 11.3 25.0 39.3 16.5 112 122 A L < - 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