==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOSYNTHETIC PROTEIN 01-MAR-10 3LZC . COMPND 2 MOLECULE: DPH2; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR Y.ZHANG,X.ZHU,A.T.TORELLI,M.LEE,B.DZIKOVSKI,R.M.KORALEWSKI,E . 681 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27772.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 466 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 105 15.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 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 . 2 0.3 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 . 62 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 76 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 158 23.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.8 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 2 2 4 2 0 0 4 2 1 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 3 3 8 4 0 2 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 . 3 0 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 0 108 0, 0.0 3,-0.4 0, 0.0 334,-0.0 0.000 360.0 360.0 360.0 -95.0 18.0 10.5 37.8 2 2 A L + 0 0 55 1,-0.2 94,-0.3 3,-0.1 0, 0.0 0.675 360.0 55.3 -82.5 -27.9 20.4 13.3 36.9 3 3 A H S S+ 0 0 66 92,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.476 101.5 46.4-100.6 -4.6 22.4 12.4 33.7 4 4 A E S S- 0 0 103 -3,-0.4 92,-0.0 91,-0.1 0, 0.0 -0.776 101.5 -74.3-123.7 174.3 19.7 11.6 31.1 5 5 A I - 0 0 30 -2,-0.3 2,-2.0 1,-0.1 3,-0.2 -0.615 41.8-137.9 -73.9 119.8 16.5 13.3 30.0 6 6 A P > + 0 0 17 0, 0.0 4,-2.5 0, 0.0 3,-0.4 -0.475 28.2 176.0 -80.7 71.4 13.8 12.7 32.8 7 7 A K H > S+ 0 0 62 -2,-2.0 4,-3.0 1,-0.2 5,-0.2 0.848 75.5 47.6 -43.5 -51.4 10.9 11.9 30.5 8 8 A S H > S+ 0 0 88 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.877 111.4 48.0 -63.9 -44.9 8.5 11.1 33.3 9 9 A E H > S+ 0 0 91 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.932 114.1 48.8 -60.4 -46.1 9.3 14.1 35.5 10 10 A I H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.945 112.1 48.2 -56.7 -51.0 8.9 16.3 32.4 11 11 A L H X S+ 0 0 21 -4,-3.0 4,-2.3 -5,-0.2 -1,-0.2 0.881 110.4 53.5 -55.1 -40.2 5.6 14.6 31.6 12 12 A K H X S+ 0 0 128 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.886 107.5 48.4 -66.9 -40.3 4.5 15.1 35.2 13 13 A E H X S+ 0 0 42 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.824 111.2 51.4 -69.9 -30.9 5.2 18.9 35.2 14 14 A L H X>S+ 0 0 0 -4,-1.8 5,-2.1 -5,-0.2 4,-1.5 0.910 109.1 50.5 -69.1 -44.6 3.3 19.3 31.9 15 15 A K H ><5S+ 0 0 109 -4,-2.3 3,-0.8 1,-0.2 -2,-0.2 0.953 107.3 53.1 -55.4 -51.9 0.3 17.4 33.4 16 16 A R H 3<5S+ 0 0 164 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.831 112.7 46.2 -53.1 -36.1 0.3 19.6 36.5 17 17 A I H 3<5S- 0 0 62 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.756 107.9-125.1 -73.3 -31.4 0.2 22.6 34.1 18 18 A G T <<5 + 0 0 58 -4,-1.5 2,-0.4 -3,-0.8 -3,-0.2 0.788 48.5 168.2 77.9 32.3 -2.5 21.2 31.9 19 19 A A < + 0 0 8 -5,-2.1 -1,-0.2 1,-0.1 3,-0.1 -0.658 18.1 171.9 -81.6 128.3 -0.3 21.7 28.8 20 20 A K + 0 0 57 -2,-0.4 27,-3.1 1,-0.3 2,-0.3 0.503 69.1 36.5-112.4 -10.7 -1.6 20.0 25.7 21 21 A R E +a 47 0A 48 25,-0.2 51,-3.1 2,-0.0 52,-1.1 -0.948 68.0 178.6-146.3 125.1 0.9 21.4 23.1 22 22 A V E -ab 48 73A 0 25,-2.5 27,-2.7 -2,-0.3 2,-0.4 -0.902 22.2-140.6-128.9 153.1 4.6 22.1 23.6 23 23 A L E -ab 49 74A 0 50,-1.7 52,-3.0 -2,-0.3 2,-0.6 -0.956 19.2-149.8-108.4 130.2 7.5 23.4 21.7 24 24 A I E -ab 50 75A 0 25,-2.4 27,-3.0 -2,-0.4 2,-0.3 -0.894 7.4-163.9-107.1 117.3 11.0 21.8 22.3 25 25 A Q E + b 0 76A 1 50,-2.9 52,-2.2 -2,-0.6 29,-0.1 -0.759 15.0 177.8 -89.4 143.4 14.2 23.8 21.9 26 26 A S - 0 0 1 27,-0.4 29,-1.9 -2,-0.3 2,-0.1 -0.996 23.6-132.2-147.5 149.8 17.5 22.0 21.6 27 27 A P > - 0 0 19 0, 0.0 3,-1.7 0, 0.0 4,-0.2 -0.409 47.9 -84.9 -86.7 174.4 21.2 22.7 21.0 28 28 A E G > S+ 0 0 65 27,-0.4 3,-1.0 1,-0.3 28,-0.1 0.829 123.3 51.2 -54.3 -45.0 23.4 20.8 18.5 29 29 A G G 3 S+ 0 0 68 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.583 111.1 47.5 -73.3 -7.6 24.3 17.8 20.6 30 30 A L G <> + 0 0 41 -3,-1.7 4,-2.5 1,-0.1 -1,-0.2 0.183 68.8 115.3-121.9 19.2 20.7 17.0 21.6 31 31 A R H <> S+ 0 0 6 -3,-1.0 4,-1.1 1,-0.2 -1,-0.1 0.918 85.1 42.6 -54.5 -47.2 18.9 17.1 18.3 32 32 A R H > S+ 0 0 153 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.858 111.6 54.1 -68.8 -36.4 18.1 13.3 18.4 33 33 A E H > S+ 0 0 82 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.878 102.4 60.1 -64.4 -38.0 17.2 13.4 22.1 34 34 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.900 108.3 43.0 -52.4 -45.3 14.7 16.2 21.3 35 35 A E H X S+ 0 0 22 -4,-1.1 4,-2.8 2,-0.2 -1,-0.2 0.848 110.0 55.5 -77.3 -33.2 12.7 13.9 18.9 36 36 A E H X S+ 0 0 114 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.933 111.2 45.5 -62.3 -45.5 12.9 10.9 21.3 37 37 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.892 111.0 53.4 -61.8 -42.3 11.3 13.1 24.0 38 38 A A H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.2 5,-0.2 0.965 108.9 49.3 -57.2 -51.0 8.7 14.4 21.5 39 39 A G H X S+ 0 0 22 -4,-2.8 4,-1.5 1,-0.2 -1,-0.2 0.893 111.7 49.2 -55.3 -42.1 7.8 10.8 20.5 40 40 A F H < S+ 0 0 44 -4,-2.0 4,-0.5 1,-0.2 3,-0.3 0.944 111.7 46.9 -65.9 -47.4 7.4 9.9 24.2 41 41 A L H ><>S+ 0 0 0 -4,-2.7 5,-1.7 1,-0.2 3,-0.9 0.839 108.9 55.4 -63.8 -33.0 5.2 12.9 25.0 42 42 A E H ><5S+ 0 0 51 -4,-2.4 3,-1.5 1,-0.3 -1,-0.2 0.828 99.9 59.7 -69.7 -31.3 3.0 12.3 22.0 43 43 A E T 3<5S+ 0 0 150 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.665 105.2 53.2 -64.0 -16.5 2.4 8.8 23.2 44 44 A N T < 5S- 0 0 48 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 -0.030 126.7 -97.2-113.2 28.2 1.0 10.6 26.2 45 45 A N T < 5S+ 0 0 142 -3,-1.5 2,-0.5 1,-0.2 -3,-0.2 0.773 82.0 128.7 67.6 30.1 -1.5 12.8 24.4 46 46 A I < - 0 0 5 -5,-1.7 2,-0.4 -8,-0.1 -25,-0.2 -0.977 56.8-132.6-114.2 126.6 0.6 16.0 24.2 47 47 A E E -a 21 0A 51 -27,-3.1 -25,-2.5 -2,-0.5 2,-0.5 -0.659 28.3-160.5 -76.8 126.9 1.1 17.6 20.8 48 48 A V E -a 22 0A 1 -2,-0.4 558,-0.5 -27,-0.2 2,-0.4 -0.946 15.8-175.3-117.7 127.2 4.8 18.3 20.3 49 49 A F E -a 23 0A 3 -27,-2.7 -25,-2.4 -2,-0.5 2,-0.4 -0.915 20.5-137.0-107.2 145.9 6.4 20.7 17.8 50 50 A L E -ac 24 607A 0 556,-2.1 558,-2.7 -2,-0.4 2,-0.5 -0.800 16.5-123.1 -96.5 142.6 10.2 20.9 17.5 51 51 A H E - c 0 608A 11 -27,-3.0 -25,-0.3 -2,-0.4 558,-0.2 -0.752 19.5-158.1 -82.9 125.5 12.1 24.2 17.3 52 52 A G + 0 0 0 556,-3.3 557,-0.2 -2,-0.5 -1,-0.1 0.722 63.7 89.0 -82.6 -23.6 14.1 24.1 14.0 53 53 A E S S- 0 0 28 555,-0.6 2,-0.7 1,-0.1 -27,-0.4 -0.256 85.7-111.8 -64.8 160.0 16.6 26.8 14.9 54 54 A I - 0 0 45 -29,-0.1 2,-0.2 2,-0.0 -1,-0.1 -0.881 34.0-140.9 -96.7 119.1 19.8 25.7 16.7 55 55 A N - 0 0 4 -29,-1.9 -27,-0.4 -2,-0.7 3,-0.1 -0.563 21.9-177.7 -84.4 143.1 19.8 27.0 20.2 56 56 A Y - 0 0 184 1,-0.3 2,-0.2 -2,-0.2 -1,-0.1 0.237 61.1 -18.1-122.6 15.5 22.9 28.4 21.9 57 57 A G > - 0 0 10 3,-0.2 3,-1.9 1,-0.1 -1,-0.3 -0.776 64.5 -92.3 155.6 156.7 21.8 29.3 25.4 58 58 A A T 3 S+ 0 0 8 1,-0.3 24,-0.3 -2,-0.2 -1,-0.1 0.588 110.7 80.1 -70.1 -9.7 19.0 30.1 27.8 59 59 A C T 3 S+ 0 0 17 1,-0.2 181,-3.0 180,-0.1 182,-0.3 0.571 96.1 48.5 -67.5 -7.2 19.6 33.8 26.9 60 60 A D S < S+ 0 0 26 -3,-1.9 -1,-0.2 179,-0.2 -3,-0.2 -0.491 74.2 173.3-136.2 65.4 17.5 32.9 23.8 61 61 A P - 0 0 1 0, 0.0 3,-0.4 0, 0.0 2,-0.3 -0.483 32.8-136.2 -72.9 147.1 14.3 31.1 24.8 62 62 A A > + 0 0 0 1,-0.2 4,-2.2 -2,-0.1 5,-0.1 -0.233 65.0 124.9 -95.8 42.8 11.8 30.4 22.0 63 63 A D H > + 0 0 0 -2,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.852 68.5 51.4 -79.5 -35.2 8.9 31.5 24.1 64 64 A R H > S+ 0 0 46 -3,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.945 112.9 47.8 -61.2 -45.3 7.5 34.2 21.8 65 65 A E H > S+ 0 0 31 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.902 108.0 55.0 -60.8 -42.4 7.6 31.6 19.0 66 66 A A H <>S+ 0 0 0 -4,-2.2 5,-2.5 1,-0.2 3,-0.3 0.948 109.6 48.4 -54.2 -47.7 5.9 29.1 21.3 67 67 A K H ><5S+ 0 0 114 -4,-2.2 3,-1.9 1,-0.2 -2,-0.2 0.937 106.3 55.5 -59.4 -49.1 3.2 31.6 21.8 68 68 A L H 3<5S+ 0 0 80 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.818 110.3 45.5 -56.7 -34.5 2.7 32.4 18.1 69 69 A V T 3<5S- 0 0 2 -4,-1.7 -1,-0.3 -3,-0.3 -2,-0.2 0.216 120.2-103.6 -98.3 15.5 2.0 28.7 17.2 70 70 A G T < 5 + 0 0 45 -3,-1.9 2,-0.2 1,-0.2 -3,-0.2 0.733 62.2 159.4 78.5 24.2 -0.4 28.1 20.1 71 71 A C < - 0 0 10 -5,-2.5 -49,-0.2 -6,-0.2 -1,-0.2 -0.588 36.6-149.8 -82.1 142.7 1.9 26.1 22.4 72 72 A D S S+ 0 0 70 -51,-3.1 2,-0.3 -2,-0.2 -50,-0.2 0.713 77.8 1.6 -78.2 -28.0 1.0 25.9 26.2 73 73 A A E -b 22 0A 0 -52,-1.1 -50,-1.7 15,-0.2 2,-0.4 -0.981 64.7-125.3-155.6 164.0 4.6 25.6 27.3 74 74 A L E -bd 23 90A 0 15,-2.6 17,-2.5 -2,-0.3 2,-0.5 -0.950 12.5-153.8-114.1 134.2 8.2 25.6 26.1 75 75 A I E -bd 24 91A 0 -52,-3.0 -50,-2.9 -2,-0.4 2,-0.7 -0.945 9.8-163.5-102.8 127.1 10.7 22.9 26.9 76 76 A H E > -bd 25 92A 0 15,-3.3 17,-2.4 -2,-0.5 3,-0.6 -0.862 9.9-158.8-113.2 99.7 14.3 24.2 26.8 77 77 A L E 3 + d 0 93A 1 -52,-2.2 -47,-0.1 -2,-0.7 18,-0.1 -0.525 64.0 13.8 -81.4 140.4 16.8 21.3 26.5 78 78 A G E 3 S+ d 0 94A 13 15,-2.5 17,-0.6 -2,-0.2 2,-0.3 0.310 107.7 74.4 91.3 -7.6 20.4 21.5 27.5 79 79 A H < - 0 0 48 -3,-0.6 14,-0.5 15,-0.2 2,-0.2 -0.934 66.9-128.0-136.0 163.0 20.5 24.7 29.5 80 80 A S - 0 0 11 -2,-0.3 -22,-0.2 13,-0.1 256,-0.1 -0.706 42.5 -79.6-108.7 161.9 19.4 26.1 32.9 81 81 A Y - 0 0 41 -2,-0.2 2,-0.3 74,-0.1 251,-0.1 -0.253 37.4-173.9 -64.7 138.8 17.3 29.2 33.7 82 82 A M - 0 0 12 -24,-0.3 2,-0.3 73,-0.0 71,-0.2 -0.962 47.7 -81.0-124.0 151.9 18.6 32.7 33.7 83 83 A K S S+ 0 0 140 69,-2.4 69,-0.0 -2,-0.3 72,-0.0 -0.286 74.2 134.1 -62.8 112.6 16.4 35.6 34.8 84 84 A L - 0 0 19 -2,-0.3 2,-0.2 2,-0.0 156,-0.1 -0.981 58.9-106.5-150.7 145.9 14.2 36.6 31.9 85 85 A P - 0 0 80 0, 0.0 2,-0.4 0, 0.0 256,-0.1 -0.545 40.8-160.0 -68.6 143.7 10.5 37.4 31.4 86 86 A L - 0 0 6 -2,-0.2 256,-1.9 1,-0.1 255,-0.6 -0.993 22.0-151.9-133.9 138.2 8.8 34.5 29.6 87 87 A E S S+ 0 0 73 -2,-0.4 -1,-0.1 254,-0.2 253,-0.0 0.650 84.8 26.9 -85.7 -16.9 5.5 34.4 27.6 88 88 A V S S- 0 0 7 251,-0.0 -15,-0.2 -14,-0.0 251,-0.1 -0.966 100.0 -83.6-138.2 155.2 4.7 30.7 28.3 89 89 A P - 0 0 29 0, 0.0 -15,-2.6 0, 0.0 2,-0.4 -0.401 51.2-157.0 -56.3 135.8 5.6 28.3 31.2 90 90 A T E -dE 74 339A 0 249,-2.7 249,-2.0 -17,-0.2 2,-0.6 -0.978 14.3-154.7-127.8 124.9 9.1 26.9 30.4 91 91 A I E -dE 75 338A 0 -17,-2.5 -15,-3.3 -2,-0.4 2,-0.4 -0.841 15.6-154.2 -91.5 117.9 10.7 23.7 31.6 92 92 A F E -dE 76 337A 3 245,-2.2 245,-1.5 -2,-0.6 -15,-0.2 -0.772 9.0-170.2 -93.4 140.4 14.5 23.9 31.6 93 93 A V E -d 77 0A 9 -17,-2.4 -15,-2.5 -14,-0.5 -13,-0.1 -0.648 12.2-162.4-132.3 75.4 16.4 20.6 31.3 94 94 A P E -d 78 0A 14 0, 0.0 2,-0.4 0, 0.0 -15,-0.2 -0.118 16.4-122.3 -63.6 156.1 20.1 21.3 32.0 95 95 A A - 0 0 49 -17,-0.6 2,-0.5 -18,-0.1 -92,-0.1 -0.857 21.9-166.5-103.7 130.7 22.8 18.8 30.9 96 96 A F - 0 0 14 -2,-0.4 31,-0.2 -94,-0.3 30,-0.1 -0.971 15.1-138.2-121.3 116.9 25.2 17.3 33.5 97 97 A A - 0 0 16 29,-2.0 32,-0.1 -2,-0.5 0, 0.0 -0.348 10.9-136.8 -69.0 155.2 28.3 15.5 32.3 98 98 A R + 0 0 178 -95,-0.1 -1,-0.1 2,-0.1 29,-0.0 0.771 59.9 119.0 -88.2 -28.1 29.2 12.3 34.2 99 99 A V - 0 0 29 1,-0.1 2,-0.5 2,-0.1 103,-0.1 -0.072 65.0-125.3 -50.4 131.0 32.9 12.5 34.7 100 100 A S - 0 0 52 1,-0.1 4,-0.4 101,-0.1 3,-0.2 -0.674 20.2-160.0 -77.3 120.8 34.1 12.6 38.3 101 101 A V S >> S+ 0 0 2 -2,-0.5 4,-1.1 1,-0.2 3,-0.7 0.775 73.2 75.2 -79.1 -27.5 36.2 15.7 38.7 102 102 A V H >> S+ 0 0 20 1,-0.2 4,-3.0 2,-0.2 3,-0.8 0.882 86.4 60.5 -57.8 -46.9 38.3 14.9 41.8 103 103 A E H 3> S+ 0 0 96 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.869 105.3 50.0 -46.2 -44.3 40.7 12.4 40.2 104 104 A A H <> S+ 0 0 0 -3,-0.7 4,-1.0 -4,-0.4 -1,-0.3 0.811 111.4 49.2 -69.4 -30.4 41.9 15.2 37.8 105 105 A L H << S+ 0 0 0 -4,-1.1 4,-0.5 -3,-0.8 3,-0.3 0.921 108.4 52.5 -71.1 -47.3 42.4 17.4 40.9 106 106 A K H >< S+ 0 0 126 -4,-3.0 3,-1.1 1,-0.2 4,-0.3 0.915 106.7 53.9 -53.7 -46.6 44.3 14.8 42.8 107 107 A E H 3< S+ 0 0 124 -4,-2.3 3,-0.3 1,-0.2 -1,-0.2 0.887 118.4 35.0 -53.7 -40.0 46.7 14.4 39.8 108 108 A N T >X S+ 0 0 12 -4,-1.0 4,-2.0 -3,-0.3 3,-0.6 0.187 74.1 122.0-109.3 17.0 47.4 18.1 39.8 109 109 A I H <> S+ 0 0 35 -3,-1.1 4,-1.7 -4,-0.5 -1,-0.2 0.841 74.9 59.2 -48.1 -39.8 47.3 19.0 43.5 110 110 A G H 3> S+ 0 0 41 -3,-0.3 4,-0.7 -4,-0.3 3,-0.3 0.943 107.6 43.2 -53.6 -53.7 50.9 20.2 43.2 111 111 A E H X4 S+ 0 0 40 -3,-0.6 3,-0.6 1,-0.2 -1,-0.2 0.839 109.5 57.6 -63.6 -35.7 50.0 22.8 40.6 112 112 A I H >< S+ 0 0 0 -4,-2.0 3,-1.7 1,-0.2 -1,-0.2 0.840 97.3 63.3 -64.0 -34.3 46.8 23.9 42.4 113 113 A K H >< S+ 0 0 111 -4,-1.7 3,-1.9 -3,-0.3 -1,-0.2 0.814 87.9 70.0 -61.1 -30.7 49.0 24.7 45.5 114 114 A K T << S+ 0 0 135 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.419 84.6 71.4 -71.0 5.0 50.8 27.4 43.5 115 115 A L T < S- 0 0 10 -3,-1.7 -1,-0.3 1,-0.4 2,-0.2 0.602 110.2-110.5 -90.2 -14.3 47.6 29.5 43.6 116 116 A G < - 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