==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MUSCLE PROTEIN 09-NOV-95 1VOM . COMPND 2 MOLECULE: MYOSIN; . SOURCE 2 ORGANISM_SCIENTIFIC: DICTYOSTELIUM DISCOIDEUM; . AUTHOR I.RAYMENT,C.A.SMITH . 730 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33665.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 496 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 78 10.7 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 . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 7 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 . 53 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 259 35.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.4 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 3 3 3 4 2 1 1 1 0 2 1 2 0 1 0 1 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 3 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 0 PARALLEL BRIDGES PER LADDER . 1 4 3 4 1 1 1 1 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 4 1 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 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 2 A N >> 0 0 104 0, 0.0 3,-2.7 0, 0.0 4,-1.5 0.000 360.0 360.0 360.0 100.4 84.2 37.0 2.2 2 3 A P T 34 + 0 0 52 0, 0.0 9,-0.4 0, 0.0 6,-0.3 0.705 360.0 65.0 -50.4 -30.6 80.7 38.0 1.1 3 4 A I T 34 S+ 0 0 16 1,-0.2 138,-0.0 7,-0.1 0, 0.0 0.862 113.2 32.9 -64.3 -32.4 80.3 34.6 -0.3 4 5 A H T <4 S+ 0 0 139 -3,-2.7 2,-1.1 1,-0.1 -1,-0.2 0.636 99.2 92.7 -96.4 -16.7 80.6 33.4 3.3 5 6 A D >< - 0 0 67 -4,-1.5 3,-3.2 1,-0.2 6,-0.4 -0.649 59.2-160.6 -86.7 102.0 78.9 36.2 4.9 6 7 A R T 3 S+ 0 0 152 -2,-1.1 -1,-0.2 1,-0.3 9,-0.1 0.607 91.6 61.3 -57.8 -6.0 75.3 35.6 5.3 7 8 A T T 3 S+ 0 0 118 4,-0.1 -1,-0.3 5,-0.0 -2,-0.0 0.523 82.7 107.7 -96.9 -5.2 74.8 39.3 5.8 8 9 A S S <> S- 0 0 15 -3,-3.2 4,-3.3 -6,-0.3 5,-0.1 -0.234 79.2-121.3 -70.2 159.4 76.2 40.2 2.3 9 10 A D H > S+ 0 0 98 2,-0.2 4,-3.9 1,-0.2 5,-0.4 0.870 117.0 60.8 -65.1 -32.1 74.1 41.5 -0.6 10 11 A Y H > S+ 0 0 4 1,-0.2 4,-2.6 2,-0.2 5,-0.4 0.967 109.7 39.0 -57.2 -51.3 75.5 38.4 -2.4 11 12 A H H > S+ 0 0 29 -6,-0.4 4,-1.4 -9,-0.4 -2,-0.2 0.932 117.2 50.9 -65.0 -44.1 73.9 36.2 0.2 12 13 A K H < S+ 0 0 138 -4,-3.3 -2,-0.2 1,-0.2 -1,-0.2 0.943 123.9 24.8 -60.2 -46.5 70.9 38.3 0.3 13 14 A Y H < S+ 0 0 64 -4,-3.9 -2,-0.2 119,-0.1 -1,-0.2 0.603 130.4 34.4 -94.0 -17.4 70.1 38.4 -3.5 14 15 A L H < S+ 0 0 7 -4,-2.6 2,-0.3 -5,-0.4 -3,-0.2 0.473 103.3 72.9-119.2 -5.1 71.8 35.3 -4.9 15 16 A K S < S- 0 0 49 -4,-1.4 2,-0.2 -5,-0.4 3,-0.1 -0.854 84.2-101.7-119.0 153.6 71.4 32.7 -2.2 16 17 A V - 0 0 50 -2,-0.3 3,-0.1 70,-0.1 -2,-0.1 -0.466 48.7-105.9 -67.5 133.9 68.5 30.6 -0.9 17 18 A K - 0 0 166 -2,-0.2 -1,-0.1 1,-0.1 2,-0.0 -0.330 40.1 -95.6 -64.6 142.2 67.2 32.1 2.4 18 19 A Q - 0 0 127 1,-0.1 -1,-0.1 -3,-0.1 2,-0.1 -0.281 44.2-128.9 -55.1 125.5 68.0 30.1 5.5 19 20 A G - 0 0 33 -3,-0.1 -1,-0.1 1,-0.1 2,-0.0 -0.467 25.1-115.0 -80.9 160.3 65.1 27.9 6.2 20 21 A D > - 0 0 94 -2,-0.1 4,-4.1 1,-0.1 5,-0.2 -0.224 27.3 -91.3 -85.4 175.8 63.4 27.8 9.7 21 22 A S H > S+ 0 0 76 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.907 127.6 45.2 -47.4 -50.6 62.9 25.4 12.7 22 23 A D H > S+ 0 0 95 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.944 111.4 50.2 -63.3 -49.2 59.6 24.3 11.2 23 24 A L H > S+ 0 0 79 1,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.940 107.4 56.1 -57.5 -43.4 61.0 24.0 7.8 24 25 A F H X S+ 0 0 140 -4,-4.1 4,-1.3 1,-0.3 -1,-0.3 0.919 106.2 52.5 -52.8 -41.6 63.7 21.9 9.4 25 26 A K H < S+ 0 0 122 -4,-2.3 3,-0.5 1,-0.2 4,-0.4 0.894 110.1 44.3 -63.0 -41.8 61.0 19.8 10.7 26 27 A L H >< S+ 0 0 107 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.842 108.3 60.9 -71.5 -28.1 59.4 19.2 7.4 27 28 A T H 3< S+ 0 0 51 -4,-2.8 56,-0.3 1,-0.3 -1,-0.2 0.732 106.4 45.0 -67.8 -25.5 62.7 18.6 5.8 28 29 A V T 3< S+ 0 0 87 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.431 86.3 123.8 -99.6 0.4 63.4 15.7 8.1 29 30 A S < - 0 0 50 -3,-0.8 -3,-0.1 -4,-0.4 -4,-0.0 -0.088 58.6-142.8 -55.1 155.1 60.0 14.1 7.7 30 31 A D + 0 0 148 2,-0.1 -1,-0.1 0, 0.0 -3,-0.0 0.323 64.1 118.7-101.9 4.7 59.7 10.6 6.4 31 32 A K - 0 0 101 -5,-0.1 2,-0.4 1,-0.0 21,-0.1 -0.368 53.8-145.6 -70.4 152.9 56.6 11.4 4.4 32 33 A R - 0 0 98 19,-0.5 19,-3.4 49,-0.1 2,-0.3 -0.970 14.6-165.0-126.0 142.1 56.7 10.9 0.7 33 34 A Y E -A 50 0A 70 -2,-0.4 46,-2.7 46,-0.4 2,-0.3 -0.827 10.1-157.2-127.4 162.0 55.0 13.0 -2.0 34 35 A I E -AB 49 78A 3 15,-2.6 15,-2.5 44,-0.3 2,-0.5 -0.951 22.1-124.1-134.3 153.4 54.0 13.1 -5.5 35 36 A W E +AB 48 77A 9 42,-3.8 42,-0.5 -2,-0.3 2,-0.3 -0.849 42.9 172.5 -96.3 128.2 53.2 15.8 -8.0 36 37 A Y E -A 47 0A 9 11,-3.6 11,-3.7 -2,-0.5 3,-0.1 -0.943 36.5-114.7-139.2 164.7 49.8 15.3 -9.5 37 38 A N - 0 0 28 -2,-0.3 9,-0.2 9,-0.3 6,-0.1 -0.846 13.0-167.4-100.3 105.7 47.0 16.9 -11.8 38 39 A P S S+ 0 0 54 0, 0.0 -1,-0.2 0, 0.0 8,-0.1 0.845 93.1 35.7 -56.5 -32.9 43.9 17.6 -9.9 39 40 A D S > S- 0 0 78 6,-0.5 3,-0.7 3,-0.4 6,-0.3 -0.985 75.4-158.8-127.4 111.7 42.5 18.1 -13.4 40 41 A P T 3 S+ 0 0 93 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.483 91.8 64.7 -69.3 -7.1 43.9 15.7 -16.0 41 42 A D T 3 S+ 0 0 110 1,-0.3 2,-1.1 2,-0.1 3,-0.1 0.842 99.7 54.9 -80.7 -37.4 42.9 18.0 -18.7 42 43 A E X + 0 0 113 -3,-0.7 3,-1.3 1,-0.2 -3,-0.4 -0.733 68.5 171.9 -99.1 79.8 45.3 20.5 -17.3 43 44 A R T 3 S+ 0 0 182 -2,-1.1 -1,-0.2 -3,-0.3 -2,-0.1 0.502 74.4 56.9 -68.0 -8.7 48.5 18.5 -17.3 44 45 A D T 3 S+ 0 0 25 1,-0.1 2,-0.7 -3,-0.1 -1,-0.3 0.453 88.6 82.3-102.6 -5.5 50.6 21.4 -16.4 45 46 A S < + 0 0 44 -3,-1.3 -6,-0.5 -6,-0.3 2,-0.3 -0.898 65.6 178.1-105.9 107.1 48.7 22.3 -13.2 46 47 A Y - 0 0 30 -2,-0.7 2,-0.3 -9,-0.2 -9,-0.3 -0.785 18.5-163.0-113.1 158.6 49.9 20.1 -10.5 47 48 A E E -A 36 0A 95 -11,-3.7 -11,-3.6 -2,-0.3 2,-0.5 -0.814 26.9-110.6-129.4 167.5 49.3 19.6 -6.8 48 49 A C E -A 35 0A 37 -2,-0.3 2,-0.4 -13,-0.2 -13,-0.2 -0.855 35.7-178.5-103.5 131.0 51.3 17.9 -4.1 49 50 A G E -A 34 0A 3 -15,-2.5 -15,-2.6 -2,-0.5 2,-0.4 -0.979 27.0-116.8-131.9 144.7 49.8 14.8 -2.7 50 51 A E E -A 33 0A 58 -2,-0.4 12,-2.4 12,-0.4 2,-0.7 -0.664 24.0-128.3 -83.5 129.2 51.1 12.5 0.1 51 52 A I E +C 61 0B 16 -19,-3.4 -19,-0.5 -2,-0.4 10,-0.3 -0.670 35.2 170.5 -75.7 117.0 51.9 9.0 -0.9 52 53 A V E + 0 0 75 8,-2.2 2,-0.3 -2,-0.7 9,-0.2 0.708 58.4 6.7-100.4 -31.8 49.9 6.9 1.6 53 54 A S E -C 60 0B 61 7,-1.6 7,-2.8 2,-0.0 2,-0.3 -0.951 60.5-162.2-146.9 168.2 50.3 3.4 0.3 54 55 A E E -C 59 0B 100 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.995 6.8-167.0-154.9 153.7 52.1 1.4 -2.4 55 56 A T - 0 0 64 3,-2.5 3,-0.1 -2,-0.3 18,-0.0 -0.649 54.3 -82.9-124.5-179.6 52.1 -1.9 -4.3 56 57 A S S S+ 0 0 115 -2,-0.2 3,-0.0 1,-0.2 17,-0.0 0.827 129.3 19.9 -60.6 -27.6 54.8 -3.3 -6.4 57 58 A D S S+ 0 0 82 16,-0.1 16,-4.0 15,-0.1 17,-0.5 0.472 120.1 51.2-123.0 2.8 53.6 -1.2 -9.3 58 59 A S E - D 0 72B 5 14,-0.3 -3,-2.5 15,-0.2 2,-0.4 -0.913 53.7-144.9-140.8 169.2 51.6 1.6 -7.9 59 60 A F E -CD 54 71B 7 12,-2.0 12,-1.9 -2,-0.3 2,-0.4 -0.961 12.5-152.8-127.8 140.0 51.3 4.5 -5.4 60 61 A T E +CD 53 70B 20 -7,-2.8 -8,-2.2 -2,-0.4 -7,-1.6 -0.955 24.5 179.0-115.1 134.4 48.2 5.5 -3.7 61 62 A F E -CD 51 69B 8 8,-3.4 8,-2.9 -2,-0.4 2,-0.3 -0.938 29.6-116.4-138.4 159.0 48.1 9.2 -2.7 62 63 A K E - D 0 68B 22 -12,-2.4 -12,-0.4 -2,-0.3 6,-0.3 -0.743 30.5-139.9 -91.6 145.8 45.9 11.7 -1.0 63 64 A T > - 0 0 7 4,-3.4 3,-0.6 -2,-0.3 -13,-0.1 -0.500 29.7 -96.8 -97.8 171.4 44.7 14.6 -3.1 64 65 A V T 3 S+ 0 0 68 1,-0.3 -1,-0.1 -2,-0.2 -14,-0.0 0.946 127.3 49.2 -47.7 -65.4 44.4 18.2 -1.9 65 66 A D T 3 S- 0 0 134 1,-0.1 -1,-0.3 -3,-0.0 -3,-0.0 0.760 127.1-106.4 -47.3 -25.4 40.8 18.0 -1.1 66 67 A G S < S+ 0 0 42 -3,-0.6 -1,-0.1 1,-0.2 -2,-0.1 0.054 77.0 131.9 119.0 -24.9 41.9 14.9 0.8 67 68 A Q - 0 0 127 -5,-0.2 -4,-3.4 1,-0.1 2,-0.4 0.186 55.5-111.9 -49.2 173.3 40.5 12.1 -1.6 68 69 A D E -D 62 0B 84 -6,-0.3 2,-0.3 -8,-0.0 -6,-0.2 -0.943 30.1-173.5-122.6 143.5 42.7 9.3 -2.6 69 70 A R E -D 61 0B 82 -8,-2.9 -8,-3.4 -2,-0.4 2,-0.4 -0.935 12.0-144.9-132.7 154.2 44.2 8.4 -6.0 70 71 A Q E +D 60 0B 126 -2,-0.3 2,-0.3 -10,-0.3 -10,-0.2 -0.926 18.8 173.7-120.6 143.9 46.2 5.6 -7.5 71 72 A V E -D 59 0B 30 -12,-1.9 -12,-2.0 -2,-0.4 5,-0.1 -0.997 37.3-102.0-150.2 146.8 49.0 5.7 -10.2 72 73 A K E > -D 58 0B 114 -2,-0.3 3,-1.0 -14,-0.2 4,-0.3 -0.448 31.6-126.3 -67.5 143.1 51.4 3.4 -11.8 73 74 A K G > S+ 0 0 48 -16,-4.0 3,-1.3 1,-0.3 -1,-0.2 0.848 110.4 63.8 -57.2 -27.8 54.7 3.8 -10.4 74 75 A D G 3 S+ 0 0 148 -17,-0.5 -1,-0.3 1,-0.3 -16,-0.1 0.841 104.8 38.9 -65.2 -33.6 55.6 4.3 -13.9 75 76 A D G < S+ 0 0 115 -3,-1.0 2,-0.4 2,-0.0 -1,-0.3 0.235 90.7 125.1-102.2 15.6 53.7 7.3 -14.6 76 77 A A < - 0 0 20 -3,-1.3 2,-1.0 -4,-0.3 -40,-0.1 -0.613 49.0-156.9 -85.0 134.0 54.4 8.8 -11.3 77 78 A N E -B 35 0A 47 -42,-0.5 -42,-3.8 -2,-0.4 20,-0.1 -0.703 24.6-157.3-101.6 82.4 55.9 12.2 -10.9 78 79 A Q E -B 34 0A 32 -2,-1.0 2,-0.4 -44,-0.3 -44,-0.3 -0.292 14.3-121.8 -63.1 142.0 57.5 11.9 -7.5 79 80 A R - 0 0 51 -46,-2.7 -46,-0.4 -30,-0.2 -1,-0.1 -0.629 30.0-118.6 -83.8 133.0 58.2 15.0 -5.5 80 81 A N - 0 0 6 -2,-0.4 5,-0.1 15,-0.2 -1,-0.1 -0.392 39.2 -85.4 -69.6 157.9 61.8 15.4 -4.6 81 82 A P > - 0 0 57 0, 0.0 3,-3.2 0, 0.0 4,-0.3 -0.357 44.6-116.6 -59.6 134.0 62.7 15.6 -0.9 82 83 A I G > S+ 0 0 42 1,-0.3 3,-1.2 2,-0.2 -55,-0.1 0.622 108.6 76.5 -48.5 -23.1 62.4 19.1 0.2 83 84 A K G 3 S+ 0 0 151 -56,-0.3 -1,-0.3 1,-0.3 -56,-0.0 0.721 92.4 59.4 -66.5 -12.8 65.9 19.6 1.0 84 85 A F G X S+ 0 0 25 -3,-3.2 3,-2.4 2,-0.1 -1,-0.3 0.660 74.8 118.0 -84.1 -17.5 66.2 19.9 -2.8 85 86 A D T < S+ 0 0 39 -3,-1.2 19,-0.1 -4,-0.3 20,-0.0 -0.335 85.6 10.2 -55.9 116.6 63.9 22.8 -3.0 86 87 A G T 3 S+ 0 0 4 1,-0.2 -1,-0.3 -2,-0.2 -70,-0.1 0.496 86.8 170.9 91.8 10.6 65.8 25.8 -4.4 87 88 A V < - 0 0 28 -3,-2.4 -1,-0.2 1,-0.1 3,-0.1 -0.208 34.8-137.3 -53.9 141.4 68.9 23.7 -5.5 88 89 A E S S+ 0 0 47 1,-0.2 29,-2.9 28,-0.1 2,-0.5 0.771 92.3 39.2 -71.4 -32.9 71.4 25.6 -7.6 89 90 A D B > -e 117 0C 23 27,-0.2 3,-2.2 29,-0.1 4,-0.2 -0.981 69.1-158.9-123.2 108.0 72.0 22.8 -10.1 90 91 A M G > S+ 0 0 0 27,-2.5 3,-1.0 -2,-0.5 28,-0.1 0.574 84.6 79.8 -68.5 -6.7 69.0 20.8 -11.1 91 92 A S G 3 S+ 0 0 24 1,-0.2 -1,-0.3 26,-0.1 27,-0.1 0.651 84.2 65.5 -72.6 -10.0 71.1 18.0 -12.1 92 93 A E G < S+ 0 0 108 -3,-2.2 -1,-0.2 -8,-0.1 -2,-0.2 0.728 75.1 114.7 -81.4 -17.9 71.3 17.1 -8.4 93 94 A L < - 0 0 3 -3,-1.0 3,-0.1 -4,-0.2 8,-0.0 -0.115 60.4-148.6 -48.2 142.4 67.6 16.4 -8.2 94 95 A S S S+ 0 0 63 1,-0.3 2,-0.7 -13,-0.1 -1,-0.1 0.915 90.3 46.4 -81.3 -39.8 66.8 12.8 -7.4 95 96 A Y S S- 0 0 74 -14,-0.1 2,-0.9 2,-0.1 -1,-0.3 -0.906 71.9-164.9-105.2 110.8 63.5 12.9 -9.4 96 97 A L + 0 0 20 -2,-0.7 2,-0.3 -3,-0.1 -18,-0.1 -0.799 38.6 127.2 -95.8 95.7 63.9 14.5 -12.8 97 98 A N > - 0 0 17 -2,-0.9 4,-2.5 1,-0.1 5,-0.2 -0.956 68.1 -99.2-145.5 167.6 60.3 15.2 -14.0 98 99 A E H > S+ 0 0 58 -2,-0.3 4,-2.8 1,-0.2 5,-0.3 0.933 118.4 42.1 -54.1 -63.9 58.4 18.2 -15.2 99 100 A P H > S+ 0 0 1 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.823 115.2 53.4 -55.5 -35.8 56.6 19.3 -12.1 100 101 A A H > S+ 0 0 3 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.913 111.1 45.2 -67.4 -41.6 59.8 18.8 -10.1 101 102 A V H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.945 115.3 46.3 -67.3 -44.7 61.8 20.9 -12.4 102 103 A F H X S+ 0 0 8 -4,-2.8 4,-3.2 -5,-0.2 -2,-0.2 0.932 110.7 55.4 -61.5 -44.7 59.2 23.6 -12.5 103 104 A H H X S+ 0 0 20 -4,-2.8 4,-3.0 -5,-0.3 5,-0.2 0.957 106.3 48.7 -52.8 -53.7 58.9 23.4 -8.7 104 105 A N H X S+ 0 0 2 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.893 114.1 46.4 -56.3 -38.9 62.6 24.0 -8.2 105 106 A L H X S+ 0 0 4 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.882 111.3 53.0 -71.4 -35.4 62.5 27.0 -10.5 106 107 A R H X S+ 0 0 65 -4,-3.2 4,-2.9 2,-0.2 -2,-0.2 0.920 108.3 50.0 -60.8 -45.8 59.3 28.2 -8.8 107 108 A V H X S+ 0 0 29 -4,-3.0 4,-0.7 1,-0.2 -2,-0.2 0.961 115.2 42.9 -56.9 -55.3 61.0 28.0 -5.3 108 109 A R H ><>S+ 0 0 3 -4,-2.1 5,-2.8 -5,-0.2 3,-1.1 0.919 114.1 50.7 -59.2 -45.2 64.0 30.0 -6.5 109 110 A Y H ><5S+ 0 0 9 -4,-2.8 3,-2.6 1,-0.3 -1,-0.2 0.887 100.5 63.4 -58.6 -45.2 61.8 32.5 -8.5 110 111 A N H 3<5S+ 0 0 113 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.727 108.8 42.0 -55.0 -23.6 59.6 33.2 -5.5 111 112 A Q T <<5S- 0 0 74 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 -0.021 125.3 -99.6-111.4 28.6 62.7 34.5 -3.7 112 113 A D T < 5S+ 0 0 54 -3,-2.6 2,-0.9 1,-0.2 -3,-0.2 0.755 77.5 140.0 62.7 25.3 64.0 36.5 -6.7 113 114 A L < + 0 0 7 -5,-2.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.856 18.1 167.1-102.6 95.8 66.6 33.8 -7.7 114 115 A I + 0 0 4 -2,-0.9 11,-2.4 -3,-0.1 2,-0.5 0.648 52.9 75.9 -85.7 -19.1 66.2 34.0 -11.5 115 116 A Y E + F 0 124C 5 37,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.816 52.8 161.5-101.3 135.5 69.2 32.0 -12.4 116 117 A T E - 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