==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRUS/RNA 13-MAY-05 2BS1 . COMPND 2 MOLECULE: MS2 COAT PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTERIOPHAGE MS2; . AUTHOR W.T.HORN,K.TARS,E.GRAHN,C.HELGSTRAND,A.J.BARON,H.LAGO, . 387 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20594.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 273 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 131 33.9 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.3 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 . 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 . 48 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 2 1 0 0 0 0 0 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 4 5 0 0 3 1 0 0 1 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 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 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 A 0 0 142 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0-121.4 65.9 -110.8 32.0 2 2 A S - 0 0 31 245,-0.0 256,-0.1 3,-0.0 260,-0.0 -0.006 360.0-152.1 138.2 113.0 63.2 -108.9 30.1 3 3 A N S S+ 0 0 15 254,-0.1 2,-2.4 1,-0.1 247,-0.1 0.580 70.7 103.0 -84.6 -7.0 59.7 -109.4 31.1 4 4 A F + 0 0 14 257,-0.1 2,-0.3 243,-0.1 -1,-0.1 -0.449 55.6 131.2 -77.6 76.9 58.4 -108.6 27.6 5 5 A T - 0 0 58 -2,-2.4 2,-0.1 16,-0.1 -2,-0.0 -0.828 60.8 -99.7-125.5 162.4 57.8 -112.2 26.6 6 6 A Q + 0 0 122 -2,-0.3 2,-0.3 15,-0.1 15,-0.2 -0.426 43.0 178.4 -78.6 158.5 55.0 -114.2 25.0 7 7 A F E -A 20 0A 8 13,-2.1 13,-3.0 -2,-0.1 2,-0.8 -0.976 37.6 -94.1-154.9 163.4 52.7 -116.2 27.2 8 8 A V E -A 19 0A 44 -2,-0.3 11,-0.3 11,-0.3 3,-0.2 -0.761 33.6-178.0 -87.9 111.8 49.7 -118.4 27.0 9 9 A L E S+ 0 0 0 9,-1.8 231,-0.6 -2,-0.8 2,-0.5 0.872 76.3 31.5 -75.3 -41.0 46.6 -116.2 27.6 10 10 A V E S-A 18 0A 0 8,-2.1 8,-2.9 230,-0.1 2,-0.5 -0.959 78.2-155.4-124.3 113.8 44.1 -119.1 27.4 11 11 A D + 0 0 75 -2,-0.5 6,-0.1 6,-0.2 228,-0.0 -0.770 26.4 159.6 -95.6 129.0 45.1 -122.5 28.6 12 12 A N S S- 0 0 79 -2,-0.5 3,-0.4 224,-0.0 5,-0.1 -0.244 72.4 -77.5-134.9 41.1 43.4 -125.6 27.3 13 13 A G S S- 0 0 54 1,-0.2 2,-3.2 3,-0.1 4,-0.0 0.983 86.4 -47.8 60.3 85.6 46.1 -128.2 28.0 14 14 A G S S+ 0 0 66 2,-0.1 2,-0.4 0, 0.0 3,-0.4 -0.245 129.0 57.4 61.8 -64.2 48.9 -128.0 25.5 15 15 A T S S+ 0 0 123 -2,-3.2 3,-0.1 -3,-0.4 0, 0.0 -0.853 103.9 27.4-105.8 136.9 46.6 -128.0 22.4 16 16 A G S S+ 0 0 58 -2,-0.4 -1,-0.2 1,-0.3 -3,-0.1 0.427 86.1 148.4 96.1 2.6 43.9 -125.4 21.7 17 17 A D - 0 0 44 -3,-0.4 2,-0.8 -5,-0.1 -1,-0.3 -0.377 47.3-135.4 -70.4 145.9 45.8 -122.9 23.8 18 18 A V E -A 10 0A 22 -8,-2.9 -8,-2.1 -3,-0.1 -9,-1.8 -0.902 28.2-175.8-104.7 104.5 45.6 -119.2 23.0 19 19 A T E -A 8 0A 61 -2,-0.8 16,-0.5 -11,-0.3 2,-0.3 -0.832 5.9-161.1-103.5 143.1 49.1 -117.8 23.1 20 20 A V E -AB 7 34A 1 -13,-3.0 -13,-2.1 -2,-0.4 14,-0.2 -0.923 5.6-158.9-124.7 147.0 49.9 -114.1 22.7 21 21 A A E - B 0 33A 28 12,-2.1 12,-2.3 -2,-0.3 23,-0.1 -0.924 31.2 -83.0-133.2 155.6 53.2 -112.4 21.8 22 22 A P E + B 0 32A 40 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.213 51.2 155.7 -50.0 129.8 55.1 -109.0 22.0 23 23 A S E + 0 0 44 8,-2.8 2,-0.3 1,-0.4 9,-0.2 0.558 56.6 4.7-132.9 -26.0 54.0 -106.9 19.0 24 24 A N E + B 0 31A 48 7,-1.3 7,-3.1 1,-0.1 -1,-0.4 -0.992 31.8 178.5-160.8 158.0 54.5 -103.3 19.9 25 25 A F > + 0 0 69 -2,-0.3 3,-1.2 5,-0.2 5,-0.2 0.071 38.4 145.7-148.3 20.4 55.9 -100.9 22.5 26 26 A A G > S+ 0 0 16 1,-0.3 3,-1.3 2,-0.2 260,-0.1 -0.380 70.8 9.1 -67.4 139.1 55.2 -97.6 20.8 27 27 A N G 3 S- 0 0 121 258,-0.4 -1,-0.3 1,-0.2 3,-0.1 0.772 129.1 -67.3 63.2 28.7 54.3 -94.7 23.1 28 28 A G G < S+ 0 0 48 -3,-1.2 2,-0.6 1,-0.2 20,-0.3 0.669 104.6 122.7 69.7 15.0 55.1 -96.6 26.3 29 29 A V < - 0 0 57 -3,-1.3 2,-0.4 18,-0.1 18,-0.2 -0.937 54.7-145.3-113.2 112.3 52.2 -99.1 25.8 30 30 A A E - C 0 46A 0 16,-2.4 16,-2.2 -2,-0.6 2,-0.4 -0.624 20.4-165.0 -77.5 127.3 53.4 -102.7 25.7 31 31 A E E -BC 24 45A 20 -7,-3.1 -8,-2.8 -2,-0.4 -7,-1.3 -0.911 15.3-176.4-119.3 143.5 51.2 -104.7 23.3 32 32 A W E +BC 22 44A 0 12,-2.6 12,-2.7 -2,-0.4 2,-0.3 -0.997 10.0 179.0-132.1 132.8 50.8 -108.5 22.8 33 33 A I E -BC 21 43A 29 -12,-2.3 -12,-2.1 -2,-0.4 10,-0.2 -0.978 27.4-116.3-136.7 152.0 48.6 -110.0 20.1 34 34 A S E -B 20 0A 6 8,-1.9 2,-1.8 -2,-0.3 -14,-0.2 -0.347 47.2 -87.8 -76.8 167.0 47.8 -113.6 19.1 35 35 A S S S+ 0 0 84 -16,-0.5 2,-0.2 -2,-0.1 -1,-0.1 -0.537 88.6 97.0 -81.0 82.6 48.9 -114.8 15.7 36 36 A N S S- 0 0 61 -2,-1.8 2,-0.2 6,-0.1 5,-0.1 -0.816 85.8 -58.2-147.2-173.4 45.9 -113.8 13.5 37 37 A S >> - 0 0 2 -2,-0.2 3,-2.5 1,-0.2 4,-1.3 -0.522 57.6-112.6 -71.0 143.4 44.7 -111.2 11.2 38 38 A R T 34 S+ 0 0 63 318,-0.8 317,-0.2 1,-0.3 -1,-0.2 0.788 119.0 60.6 -50.1 -24.6 44.8 -107.9 13.2 39 39 A S T 34 S+ 0 0 15 315,-2.0 -1,-0.3 1,-0.2 41,-0.2 0.692 113.2 30.9 -79.0 -19.6 41.0 -108.1 12.8 40 40 A Q T <4 S+ 0 0 33 -3,-2.5 -2,-0.2 314,-0.2 -1,-0.2 0.350 93.3 123.3-118.2 3.6 40.5 -111.4 14.7 41 41 A A < - 0 0 5 -4,-1.3 2,-0.3 -3,-0.1 -6,-0.1 -0.311 61.5-125.0 -75.0 148.9 43.4 -111.3 17.1 42 42 A Y - 0 0 29 -23,-0.1 -8,-1.9 22,-0.1 2,-0.4 -0.667 37.3-159.5 -80.1 143.5 43.3 -111.5 20.9 43 43 A K E -CD 33 63A 57 20,-1.7 20,-2.7 -2,-0.3 2,-0.4 -0.983 19.6-176.8-135.1 144.4 45.1 -108.4 22.3 44 44 A V E -CD 32 62A 0 -12,-2.7 -12,-2.6 -2,-0.4 2,-0.4 -0.998 7.4-177.9-137.4 131.8 46.7 -107.5 25.6 45 45 A T E -CD 31 61A 27 16,-2.4 16,-2.3 -2,-0.4 2,-0.3 -0.979 0.4-178.4-132.5 145.9 48.2 -104.1 26.5 46 46 A C E +CD 30 60A 3 -16,-2.2 -16,-2.4 -2,-0.4 2,-0.3 -0.993 5.9 164.5-143.8 147.1 49.9 -102.8 29.6 47 47 A S E - D 0 59A 33 12,-1.0 12,-2.5 -2,-0.3 2,-0.4 -0.982 18.8-147.3-160.2 151.4 51.4 -99.5 30.8 48 48 A V E + D 0 58A 46 -20,-0.3 2,-0.3 -2,-0.3 10,-0.2 -0.979 15.8 178.8-127.3 140.1 52.6 -97.9 34.0 49 49 A R E - D 0 57A 115 8,-2.1 8,-3.5 -2,-0.4 2,-1.7 -0.971 39.5-122.2-139.2 151.1 52.5 -94.3 35.1 50 50 A Q + 0 0 103 -2,-0.3 6,-0.2 6,-0.3 5,-0.1 -0.488 41.0 179.2 -87.8 63.3 53.5 -92.3 38.2 51 51 A S + 0 0 46 -2,-1.7 -1,-0.2 3,-0.1 2,-0.2 0.717 60.7 13.2 -35.8 -43.3 49.8 -91.1 38.4 52 52 A S S S- 0 0 58 3,-1.4 3,-0.2 -3,-0.2 5,-0.1 -0.596 88.6 -95.9-125.8-172.1 50.4 -89.0 41.5 53 53 A A S S+ 0 0 82 -2,-0.2 -2,-0.1 1,-0.2 -1,-0.0 0.750 129.9 24.6 -78.0 -25.1 53.4 -87.7 43.5 54 54 A Q S S+ 0 0 96 39,-0.0 40,-1.4 40,-0.0 41,-0.3 0.067 116.7 74.1-128.4 26.6 53.0 -90.7 45.7 55 55 A N E - E 0 93A 32 38,-0.2 -3,-1.4 -3,-0.2 2,-0.4 -0.986 51.6-159.9-142.8 150.1 51.2 -93.2 43.4 56 56 A R E - E 0 92A 36 36,-2.2 36,-2.4 -2,-0.3 2,-0.4 -0.965 16.6-157.4-125.8 142.1 51.9 -95.4 40.5 57 57 A K E -DE 49 91A 45 -8,-3.5 -8,-2.1 -2,-0.4 2,-0.4 -0.981 4.8-157.5-130.1 126.8 49.1 -96.7 38.2 58 58 A Y E -DE 48 90A 1 32,-3.0 32,-2.7 -2,-0.4 2,-0.5 -0.820 5.6-162.3 -98.6 138.2 49.0 -99.7 36.0 59 59 A T E +DE 47 89A 19 -12,-2.5 -12,-1.0 -2,-0.4 2,-0.4 -0.966 13.9 178.8-123.3 113.7 46.5 -99.8 33.1 60 60 A I E -DE 46 88A 4 28,-2.8 28,-3.0 -2,-0.5 2,-0.3 -0.933 4.3-178.4-119.4 140.0 45.9 -103.3 31.7 61 61 A K E -DE 45 87A 110 -16,-2.3 -16,-2.4 -2,-0.4 2,-0.4 -0.997 6.7-172.3-138.7 140.5 43.5 -104.3 28.9 62 62 A V E -DE 44 86A 6 24,-2.2 24,-2.6 -2,-0.3 2,-0.5 -0.992 7.3-159.9-131.7 139.6 42.6 -107.6 27.3 63 63 A E E -DE 43 85A 44 -20,-2.7 -20,-1.7 -2,-0.4 22,-0.2 -0.951 5.2-170.9-123.8 110.9 40.4 -108.1 24.1 64 64 A V E - E 0 84A 10 20,-2.0 20,-2.7 -2,-0.5 2,-0.2 -0.894 15.2-157.3-103.0 116.9 38.8 -111.5 23.6 65 65 A P E - E 0 83A 10 0, 0.0 2,-0.7 0, 0.0 18,-0.2 -0.551 19.7-140.7 -95.4 159.4 37.2 -111.8 20.1 66 66 A K E - E 0 82A 80 16,-2.1 15,-3.0 -2,-0.2 16,-0.7 -0.912 34.8-142.3-114.0 94.3 34.5 -114.1 18.8 67 67 A V E + E 0 80A 79 -2,-0.7 2,-0.3 13,-0.3 13,-0.2 -0.198 31.3 156.0 -62.3 151.7 35.9 -114.9 15.3 68 68 A A E - E 0 79A 36 11,-2.6 11,-2.7 9,-0.0 2,-0.6 -0.971 41.0-112.3-165.3 167.2 33.6 -115.2 12.3 69 69 A T E - E 0 78A 92 -2,-0.3 2,-0.4 9,-0.2 11,-0.0 -0.934 32.2-166.5-116.2 111.8 33.6 -115.0 8.5 70 70 A Q E - E 0 77A 109 7,-2.0 7,-2.9 -2,-0.6 2,-0.8 -0.785 15.6-139.8-103.3 142.7 31.6 -112.1 7.1 71 71 A T E + E 0 76A 80 -2,-0.4 2,-0.5 5,-0.2 5,-0.3 -0.855 26.0 175.2-100.6 105.8 30.6 -111.6 3.5 72 72 A V E > S- E 0 75A 75 3,-2.6 3,-1.5 -2,-0.8 -2,-0.0 -0.955 71.5 -9.6-114.2 121.7 31.0 -108.0 2.4 73 73 A G T 3 S- 0 0 80 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.835 129.0 -56.4 63.0 33.1 30.3 -107.1 -1.2 74 74 A G T 3 S+ 0 0 72 1,-0.2 2,-0.4 -3,-0.2 -1,-0.3 0.452 120.1 105.5 79.3 -1.3 30.1 -110.8 -2.2 75 75 A V E < -E 72 0A 89 -3,-1.5 -3,-2.6 2,-0.0 2,-0.4 -0.887 68.0-126.8-114.2 144.9 33.5 -111.4 -0.8 76 76 A E E -E 71 0A 135 -2,-0.4 -5,-0.2 -5,-0.3 -7,-0.0 -0.754 26.7-176.8 -95.2 135.3 34.4 -113.2 2.4 77 77 A L E -E 70 0A 45 -7,-2.9 -7,-2.0 -2,-0.4 2,-0.5 -0.956 32.3-111.5-131.1 146.7 36.7 -111.6 5.1 78 78 A P E +E 69 0A 36 0, 0.0 2,-0.3 0, 0.0 -9,-0.2 -0.643 56.4 152.8 -76.2 121.3 38.1 -112.8 8.4 79 79 A V E -E 68 0A 34 -11,-2.7 -11,-2.6 -2,-0.5 2,-0.6 -0.858 47.2-105.2-143.4 175.0 36.4 -110.7 11.1 80 80 A A E -E 67 0A 22 -2,-0.3 -13,-0.3 -13,-0.2 3,-0.1 -0.937 14.9-152.7-110.4 119.3 35.2 -110.7 14.7 81 81 A A E S- 0 0 57 -15,-3.0 2,-0.3 -2,-0.6 -1,-0.2 0.880 79.3 -31.6 -54.4 -37.7 31.5 -111.1 15.4 82 82 A W E -E 66 0A 41 -16,-0.7 -16,-2.1 -3,-0.1 2,-0.3 -0.959 63.1-125.3-171.5 166.2 32.0 -109.1 18.6 83 83 A R E -E 65 0A 36 -2,-0.3 2,-0.4 -18,-0.2 -20,-0.0 -0.946 6.7-144.4-129.1 149.3 34.6 -108.5 21.2 84 84 A S E -E 64 0A 2 -20,-2.7 -20,-2.0 -2,-0.3 2,-0.4 -0.886 21.6-151.3-107.7 140.0 34.8 -108.7 24.9 85 85 A Y E -EF 63 221A 110 136,-1.8 136,-3.1 -2,-0.4 2,-0.5 -0.958 13.7-171.5-123.0 129.7 36.8 -106.1 26.8 86 86 A L E +EF 62 220A 8 -24,-2.6 -24,-2.2 -2,-0.4 2,-0.5 -0.967 11.4 176.7-114.3 123.6 38.6 -106.3 30.1 87 87 A A E +EF 61 219A 41 132,-2.2 132,-1.7 -2,-0.5 2,-0.4 -0.972 2.1 178.5-131.0 118.8 40.0 -103.0 31.5 88 88 A M E -EF 60 218A 4 -28,-3.0 -28,-2.8 -2,-0.5 2,-0.5 -0.970 14.5-162.3-126.2 138.3 41.7 -102.8 34.9 89 89 A K E -EF 59 217A 85 128,-2.0 128,-2.2 -2,-0.4 2,-0.5 -0.966 10.0-168.4-113.3 127.1 43.4 -99.9 36.7 90 90 A L E -EF 58 216A 3 -32,-2.7 -32,-3.0 -2,-0.5 2,-0.6 -0.960 1.5-166.8-122.2 116.7 45.7 -100.8 39.5 91 91 A T E +EF 57 215A 30 124,-2.9 124,-1.8 -2,-0.5 -34,-0.2 -0.890 9.3 178.7-107.4 115.2 46.9 -98.0 41.9 92 92 A I E -E 56 0A 1 -36,-2.4 -36,-2.2 -2,-0.6 122,-0.1 -0.928 28.2-121.1-117.1 133.6 49.9 -98.8 44.2 93 93 A P E > -E 55 0A 1 0, 0.0 3,-2.3 0, 0.0 -38,-0.2 -0.441 21.9-122.9 -71.0 145.9 51.5 -96.4 46.6 94 94 A I T 3 S+ 0 0 72 -40,-1.4 -39,-0.1 1,-0.3 117,-0.1 0.651 110.4 67.8 -61.7 -14.8 55.2 -95.8 46.1 95 95 A F T 3 S+ 0 0 94 -41,-0.3 2,-0.3 116,-0.1 -1,-0.3 0.489 74.6 119.2 -83.6 -3.0 55.7 -96.9 49.7 96 96 A A < - 0 0 6 -3,-2.3 116,-0.0 117,-0.1 -4,-0.0 -0.503 57.8-142.2 -71.3 124.7 54.7 -100.5 48.6 97 97 A T > - 0 0 59 -2,-0.3 4,-1.8 1,-0.1 5,-0.1 -0.203 27.0-105.2 -74.7 167.8 57.5 -103.0 49.1 98 98 A N H > S+ 0 0 83 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.927 126.7 49.4 -63.7 -42.4 58.1 -105.8 46.7 99 99 A S H > S+ 0 0 63 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.823 106.8 57.0 -64.2 -30.4 56.5 -108.2 49.1 100 100 A D H > S+ 0 0 4 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.890 109.5 44.7 -66.5 -39.4 53.6 -105.8 49.3 101 101 A C H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.846 105.7 58.9 -73.2 -35.6 53.1 -106.0 45.6 102 102 A E H X S+ 0 0 93 -4,-2.2 4,-2.1 151,-0.3 -1,-0.2 0.836 104.0 56.0 -60.7 -29.6 53.5 -109.8 45.6 103 103 A L H X S+ 0 0 28 -4,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.867 105.0 49.7 -69.0 -39.4 50.5 -109.6 47.9 104 104 A I H X S+ 0 0 5 -4,-1.0 4,-2.0 2,-0.2 -2,-0.2 0.904 110.9 49.7 -67.1 -42.3 48.4 -107.7 45.4 105 105 A V H X S+ 0 0 5 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.912 109.6 50.9 -63.6 -43.2 49.2 -110.2 42.6 106 106 A K H X S+ 0 0 67 -4,-2.1 4,-2.9 1,-0.2 35,-0.3 0.885 108.3 53.6 -61.4 -39.0 48.3 -113.1 44.9 107 107 A A H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.906 109.3 47.0 -63.0 -43.2 45.0 -111.4 45.7 108 108 A M H X S+ 0 0 4 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.873 113.2 49.4 -67.2 -36.2 44.1 -110.9 42.0 109 109 A Q H X S+ 0 0 47 -4,-2.2 4,-0.6 1,-0.2 3,-0.2 0.931 112.2 47.6 -67.4 -44.1 45.0 -114.5 41.3 110 110 A G H >< S+ 0 0 7 -4,-2.9 3,-0.9 29,-0.4 -2,-0.2 0.881 106.1 60.0 -63.0 -37.9 42.9 -115.7 44.2 111 111 A L H 3< S+ 0 0 1 -4,-2.4 -1,-0.2 1,-0.2 7,-0.2 0.881 113.6 34.9 -57.1 -42.2 40.1 -113.5 43.0 112 112 A L H 3< S+ 0 0 4 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.334 85.2 130.7 -98.4 6.4 39.8 -115.3 39.7 113 113 A K X< - 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