==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ENDONUCLEASE 24-FEB-98 1A6F . COMPND 2 MOLECULE: RIBONUCLEASE P PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR T.STAMS,D.W.CHRISTIANSON . 113 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6937.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 86 76.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 8.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 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 . 1 0.9 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 . 14 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 36 31.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.9 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 0 0 0 0 1 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 A 0 0 123 0, 0.0 2,-0.2 0, 0.0 70,-0.1 0.000 360.0 360.0 360.0 -43.4 -5.3 58.9 -6.4 2 3 A H - 0 0 145 69,-0.1 2,-0.3 1,-0.0 3,-0.0 -0.668 360.0-102.6-105.5 157.4 -8.3 56.8 -7.7 3 4 A L - 0 0 6 -2,-0.2 65,-0.1 1,-0.1 5,-0.1 -0.613 49.1-106.9 -74.8 134.6 -10.1 53.9 -6.1 4 5 A K > - 0 0 84 -2,-0.3 3,-1.9 1,-0.1 -1,-0.1 -0.340 17.4-121.4 -66.8 147.0 -9.0 50.6 -7.8 5 6 A K G > S+ 0 0 153 1,-0.3 3,-2.4 2,-0.2 -1,-0.1 0.891 113.1 57.4 -48.7 -50.8 -11.3 48.8 -10.2 6 7 A R G 3 S+ 0 0 143 1,-0.3 -1,-0.3 38,-0.1 36,-0.1 0.674 100.4 59.8 -57.9 -19.1 -11.2 45.6 -8.1 7 8 A N G < S+ 0 0 0 -3,-1.9 38,-1.8 37,-0.1 2,-0.5 0.264 91.3 94.0 -95.8 15.7 -12.5 47.7 -5.2 8 9 A R B < -a 45 0A 70 -3,-2.4 2,-0.9 36,-0.3 38,-0.2 -0.924 68.5-141.6-118.7 126.2 -15.7 48.6 -7.2 9 10 A L + 0 0 8 36,-2.2 38,-0.4 -2,-0.5 -3,-0.1 -0.688 34.7 170.4 -78.4 107.0 -19.1 46.9 -7.1 10 11 A K + 0 0 162 -2,-0.9 -1,-0.2 1,-0.1 37,-0.1 0.921 39.8 51.1 -84.8 -81.4 -19.9 47.2 -10.8 11 12 A K S >> S- 0 0 122 1,-0.1 3,-1.6 3,-0.1 4,-0.7 -0.291 76.0-114.8 -77.4 147.0 -23.0 45.3 -12.0 12 13 A N H 3> S+ 0 0 85 1,-0.3 4,-2.9 2,-0.2 5,-0.3 0.633 106.9 66.5 -40.5 -37.9 -26.6 45.2 -10.7 13 14 A E H 3> S+ 0 0 132 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.958 102.4 49.2 -54.3 -48.2 -26.6 41.5 -9.6 14 15 A D H <> S+ 0 0 33 -3,-1.6 4,-1.6 1,-0.2 -1,-0.2 0.837 112.1 49.2 -57.9 -38.5 -24.1 42.4 -6.9 15 16 A F H X S+ 0 0 23 -4,-0.7 4,-3.0 2,-0.2 -1,-0.2 0.953 107.4 52.0 -64.9 -55.8 -26.2 45.3 -5.8 16 17 A Q H X S+ 0 0 61 -4,-2.9 4,-2.3 1,-0.2 5,-0.3 0.836 106.9 56.3 -51.7 -35.5 -29.5 43.3 -5.6 17 18 A K H X S+ 0 0 85 -4,-1.9 4,-2.5 -5,-0.3 5,-0.5 0.968 110.1 43.1 -63.1 -48.1 -27.6 40.9 -3.4 18 19 A V H X S+ 0 0 0 -4,-1.6 4,-3.0 3,-0.2 -2,-0.2 0.913 114.4 50.7 -63.8 -47.0 -26.6 43.6 -1.0 19 20 A F H < S+ 0 0 54 -4,-3.0 -1,-0.2 2,-0.2 -2,-0.2 0.954 115.8 39.6 -54.6 -58.3 -30.1 45.2 -0.9 20 21 A K H < S+ 0 0 145 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.904 136.7 14.0 -62.4 -44.3 -32.0 42.0 -0.3 21 22 A H H < S+ 0 0 147 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.625 103.6 93.4-112.6 -13.2 -29.6 40.5 2.2 22 23 A G S < S- 0 0 18 -4,-3.0 13,-0.3 -5,-0.5 2,-0.2 -0.011 73.5-101.8 -72.6 179.1 -27.2 43.1 3.3 23 24 A T E -B 34 0A 81 11,-2.8 11,-2.2 12,-0.1 2,-0.4 -0.673 32.9-150.1-102.5 158.9 -27.3 45.3 6.4 24 25 A S E +B 33 0A 52 -2,-0.2 2,-0.3 9,-0.2 9,-0.2 -0.986 22.9 169.3-140.1 147.3 -28.4 49.0 6.5 25 26 A V E -B 32 0A 20 7,-0.9 7,-1.7 -2,-0.4 2,-0.3 -0.898 23.2-156.6-139.7 147.0 -27.8 52.2 8.4 26 27 A A E -B 31 0A 61 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.966 9.4-169.2-134.7 157.5 -29.1 55.6 7.1 27 28 A N - 0 0 23 3,-2.3 74,-0.0 -2,-0.3 75,-0.0 -0.782 45.7-101.0-129.9 176.2 -28.2 59.2 7.6 28 29 A R S S+ 0 0 198 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.839 128.6 31.5 -71.1 -25.3 -29.9 62.5 6.6 29 30 A Q S S+ 0 0 42 1,-0.2 58,-3.1 59,-0.1 2,-0.3 0.837 124.7 19.7-100.5 -38.6 -27.3 62.3 3.8 30 31 A F E - C 0 86A 0 56,-0.2 -3,-2.3 71,-0.1 2,-0.5 -0.965 48.2-146.0-138.9 158.1 -26.6 58.7 3.0 31 32 A V E -BC 26 85A 28 54,-2.6 54,-2.7 -2,-0.3 2,-0.7 -0.981 23.8-160.7-120.3 114.9 -27.9 55.1 3.2 32 33 A L E -BC 25 84A 0 -7,-1.7 -7,-0.9 -2,-0.5 2,-0.6 -0.889 4.7-168.7-102.8 109.0 -25.0 52.6 3.6 33 34 A Y E -BC 24 83A 58 50,-3.1 50,-2.5 -2,-0.7 2,-0.5 -0.851 5.5-175.7 -96.2 122.1 -25.8 49.0 2.7 34 35 A T E +BC 23 82A 3 -11,-2.2 -11,-2.8 -2,-0.6 48,-0.2 -0.966 6.4 175.7-122.4 115.3 -23.1 46.5 3.7 35 36 A L - 0 0 35 46,-1.8 2,-0.2 -2,-0.5 -12,-0.1 0.553 29.6-123.2 -80.1-118.2 -23.4 42.9 2.8 36 37 A D - 0 0 85 44,-0.1 44,-0.1 -14,-0.1 3,-0.1 -0.631 22.6-172.8 166.9 122.8 -20.5 40.6 3.7 37 38 A Q > - 0 0 30 42,-0.4 3,-1.2 -2,-0.2 -2,-0.0 -0.927 6.3-174.9-133.7 108.9 -18.2 38.3 1.6 38 39 A P T 3 S+ 0 0 120 0, 0.0 -1,-0.1 0, 0.0 41,-0.0 0.732 88.8 61.5 -73.9 -16.5 -15.8 36.1 3.6 39 40 A E T 3 S+ 0 0 132 -3,-0.1 2,-0.5 2,-0.0 -3,-0.0 0.126 86.8 90.2 -91.2 9.4 -14.4 35.0 0.2 40 41 A N < - 0 0 33 -3,-1.2 -3,-0.1 39,-0.2 39,-0.1 -0.962 54.7-167.7-112.5 129.4 -13.3 38.6 -0.7 41 42 A D S S+ 0 0 152 -2,-0.5 2,-0.3 1,-0.1 -1,-0.1 0.573 77.0 37.1 -91.8 -10.8 -9.8 39.8 0.3 42 43 A E S S- 0 0 72 37,-0.1 -1,-0.1 -36,-0.1 37,-0.1 -0.992 88.4-104.0-140.9 151.4 -10.6 43.4 -0.5 43 44 A L - 0 0 2 -2,-0.3 2,-0.4 31,-0.2 38,-0.2 -0.136 26.1-147.2 -72.8 160.5 -13.6 45.6 -0.0 44 45 A R E - d 0 81A 62 36,-2.0 38,-3.0 -36,-0.1 2,-0.5 -0.990 4.0-157.0-133.2 140.1 -16.0 46.8 -2.7 45 46 A V E -ad 8 82A 6 -38,-1.8 -36,-2.2 -2,-0.4 2,-0.4 -0.973 6.0-171.7-122.3 129.3 -17.9 50.0 -3.1 46 47 A G E - d 0 83A 0 36,-2.3 38,-2.2 -2,-0.5 2,-0.5 -0.949 12.6-148.7-117.1 138.5 -21.1 50.5 -5.1 47 48 A L E + d 0 84A 35 -2,-0.4 2,-0.5 -38,-0.4 38,-0.2 -0.927 17.9 176.0-118.4 128.5 -22.6 53.9 -5.7 48 49 A S E - d 0 85A 46 36,-2.9 38,-2.6 -2,-0.5 2,-0.7 -0.982 13.2-163.5-124.9 112.1 -26.3 54.8 -6.1 49 50 A V E - d 0 86A 16 -2,-0.5 4,-0.2 36,-0.2 38,-0.1 -0.912 31.4-116.8-105.7 111.2 -26.9 58.6 -6.4 50 51 A S - 0 0 40 36,-1.9 -1,-0.1 -2,-0.7 37,-0.1 0.470 27.4-149.9 -5.0 -44.7 -30.6 59.6 -5.8 51 52 A K S > S+ 0 0 130 1,-0.1 3,-1.1 35,-0.1 -1,-0.2 0.294 79.1 101.4 72.2 -4.3 -30.9 60.9 -9.4 52 53 A K T 3 S+ 0 0 142 1,-0.3 -1,-0.1 2,-0.1 -2,-0.1 -0.195 70.1 70.9 -94.0 32.8 -33.4 63.3 -7.9 53 54 A I T 3 S- 0 0 21 -4,-0.2 2,-2.0 38,-0.0 -1,-0.3 0.068 77.7-174.3-133.1 10.0 -30.3 65.6 -8.2 54 55 A G < + 0 0 59 -3,-1.1 2,-0.5 4,-0.1 -2,-0.1 0.125 50.1 100.4 25.0 -56.7 -30.5 65.8 -12.1 55 56 A N >> - 0 0 108 -2,-2.0 4,-1.8 1,-0.2 3,-0.8 -0.482 64.3-152.1 -57.1 111.2 -27.3 67.7 -12.8 56 57 A A H 3> S+ 0 0 64 -2,-0.5 4,-3.7 1,-0.2 5,-0.3 0.883 96.1 61.0 -52.1 -36.5 -24.9 64.9 -13.9 57 58 A V H 3> S+ 0 0 92 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.832 103.5 45.7 -59.8 -39.9 -22.2 67.2 -12.5 58 59 A M H <> S+ 0 0 54 -3,-0.8 4,-2.2 -5,-0.3 -1,-0.2 0.852 117.3 46.0 -73.3 -33.9 -23.6 67.3 -9.0 59 60 A R H X S+ 0 0 61 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.926 113.6 46.0 -74.3 -46.7 -24.0 63.5 -9.1 60 61 A N H X S+ 0 0 85 -4,-3.7 4,-2.4 2,-0.2 -2,-0.2 0.929 113.6 52.8 -62.2 -42.5 -20.6 62.8 -10.6 61 62 A R H X S+ 0 0 81 -4,-2.0 4,-2.0 -5,-0.3 -2,-0.2 0.962 109.5 45.8 -56.5 -58.3 -19.2 65.2 -8.0 62 63 A I H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.840 110.4 55.1 -56.5 -34.0 -20.8 63.5 -5.0 63 64 A K H X S+ 0 0 64 -4,-2.0 4,-3.2 1,-0.2 3,-0.3 0.955 107.2 50.2 -65.3 -45.6 -19.7 60.1 -6.4 64 65 A R H X S+ 0 0 122 -4,-2.4 4,-3.1 1,-0.3 5,-0.3 0.870 108.1 52.8 -59.3 -40.9 -16.1 61.2 -6.5 65 66 A L H X S+ 0 0 13 -4,-2.0 4,-1.8 2,-0.2 -1,-0.3 0.836 112.7 43.6 -65.0 -36.9 -16.2 62.5 -2.9 66 67 A I H X S+ 0 0 0 -4,-1.6 4,-2.3 -3,-0.3 -2,-0.2 0.933 115.4 48.4 -75.0 -43.9 -17.6 59.2 -1.7 67 68 A R H X S+ 0 0 56 -4,-3.2 4,-2.2 1,-0.2 -2,-0.2 0.954 116.7 42.4 -59.1 -48.6 -15.1 57.2 -3.7 68 69 A Q H X S+ 0 0 53 -4,-3.1 4,-1.9 1,-0.2 -1,-0.2 0.893 110.4 57.2 -67.3 -35.6 -12.2 59.3 -2.6 69 70 A A H X S+ 0 0 2 -4,-1.8 4,-0.7 -5,-0.3 -1,-0.2 0.886 108.2 48.8 -61.7 -36.3 -13.6 59.3 1.0 70 71 A F H >X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 3,-0.8 0.898 103.6 58.7 -68.4 -43.7 -13.4 55.5 0.8 71 72 A L H 3< S+ 0 0 38 -4,-2.2 4,-0.3 1,-0.3 -2,-0.2 0.911 103.6 53.1 -51.7 -44.5 -9.8 55.6 -0.5 72 73 A E H 3< S+ 0 0 88 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.812 121.2 33.6 -61.1 -27.7 -8.9 57.5 2.7 73 74 A E H XX S+ 0 0 23 -3,-0.8 3,-1.7 -4,-0.7 4,-1.2 0.605 79.2 108.2-107.2 -10.0 -10.5 54.6 4.6 74 75 A K T 3< S+ 0 0 35 -4,-2.6 -31,-0.2 1,-0.3 -1,-0.1 0.716 84.6 52.2 -39.5 -29.1 -9.9 51.5 2.6 75 76 A E T 34 S+ 0 0 124 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.803 110.6 41.3 -81.1 -37.8 -7.4 50.4 5.3 76 77 A R T <4 S+ 0 0 158 -3,-1.7 37,-2.2 -4,-0.1 2,-0.4 0.445 100.3 93.2 -89.8 -2.9 -9.5 50.7 8.4 77 78 A L B < S-E 112 0B 0 -4,-1.2 35,-0.2 35,-0.2 -34,-0.2 -0.763 80.2-112.8 -98.1 138.4 -12.6 49.2 6.7 78 79 A K - 0 0 62 33,-1.7 2,-1.8 -2,-0.4 -1,-0.1 -0.172 36.7-104.5 -59.7 155.2 -13.7 45.6 6.8 79 80 A E S S+ 0 0 71 -36,-0.1 -42,-0.4 -39,-0.1 -39,-0.2 -0.384 77.3 119.8 -86.5 66.6 -13.5 43.7 3.5 80 81 A K S S- 0 0 41 -2,-1.8 -36,-2.0 -44,-0.1 2,-0.5 -0.231 70.5 -88.1-109.8-165.8 -17.2 43.6 2.7 81 82 A D E - d 0 44A 0 -38,-0.2 -46,-1.8 -2,-0.1 2,-0.4 -0.957 43.1-164.0-109.9 128.5 -19.4 44.9 -0.0 82 83 A Y E -Cd 34 45A 0 -38,-3.0 -36,-2.3 -2,-0.5 2,-0.4 -0.937 13.7-172.0-117.1 143.8 -20.7 48.5 0.4 83 84 A I E -Cd 33 46A 0 -50,-2.5 -50,-3.1 -2,-0.4 2,-0.5 -0.994 7.8-167.3-130.9 124.4 -23.5 50.3 -1.3 84 85 A I E -Cd 32 47A 0 -38,-2.2 -36,-2.9 -2,-0.4 2,-0.5 -0.996 3.0-163.0-115.5 122.9 -23.8 54.0 -0.6 85 86 A I E -Cd 31 48A 36 -54,-2.7 -54,-2.6 -2,-0.5 2,-0.7 -0.952 16.7-139.9-105.8 124.3 -27.0 55.7 -1.7 86 87 A A E -Cd 30 49A 0 -38,-2.6 -36,-1.9 -2,-0.5 -56,-0.2 -0.855 16.0-147.7 -91.6 116.1 -26.6 59.4 -1.8 87 88 A R > - 0 0 102 -58,-3.1 3,-1.6 -2,-0.7 4,-0.5 -0.481 29.3 -99.5 -81.3 154.8 -29.7 61.2 -0.5 88 89 A K G > S+ 0 0 128 1,-0.3 3,-1.8 2,-0.2 2,-0.5 0.844 119.7 59.8 -37.5 -54.7 -30.9 64.7 -1.7 89 90 A P G 3 S+ 0 0 63 0, 0.0 -1,-0.3 0, 0.0 -59,-0.1 0.127 95.4 65.5 -67.9 21.9 -29.3 66.5 1.3 90 91 A A G X S+ 0 0 0 -3,-1.6 3,-2.1 -2,-0.5 -2,-0.2 0.574 73.1 91.0-113.4 -21.5 -25.8 65.2 0.3 91 92 A S T < S+ 0 0 13 -3,-1.8 -29,-0.1 -4,-0.5 -3,-0.1 0.725 90.6 42.9 -47.8 -31.0 -25.6 67.1 -3.0 92 93 A Q T 3 S+ 0 0 160 -4,-0.2 -1,-0.3 2,-0.0 2,-0.1 0.083 84.3 123.5-111.9 29.4 -24.0 70.1 -1.4 93 94 A L < - 0 0 23 -3,-2.1 2,-0.3 4,-0.0 -28,-0.1 -0.455 52.5-134.6 -87.0 154.6 -21.4 68.6 0.9 94 95 A T > - 0 0 71 -2,-0.1 4,-2.5 1,-0.1 3,-0.3 -0.712 35.5 -98.8-101.7 162.0 -17.7 69.3 0.8 95 96 A Y H > S+ 0 0 47 -2,-0.3 4,-2.8 1,-0.2 3,-0.4 0.921 125.9 50.5 -43.3 -58.0 -15.2 66.4 1.1 96 97 A E H > S+ 0 0 130 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.881 112.6 47.4 -48.0 -47.0 -14.7 67.1 4.8 97 98 A E H > S+ 0 0 92 -3,-0.3 4,-1.2 2,-0.2 -1,-0.3 0.842 111.7 49.3 -65.8 -38.4 -18.4 67.0 5.3 98 99 A T H X S+ 0 0 0 -4,-2.5 4,-2.8 -3,-0.4 -2,-0.2 0.927 110.6 50.9 -66.0 -44.7 -18.9 63.8 3.3 99 100 A K H X S+ 0 0 49 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.864 108.4 50.9 -62.3 -39.7 -16.1 62.1 5.2 100 101 A K H < S+ 0 0 122 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.853 113.3 47.8 -67.7 -31.9 -17.6 63.0 8.6 101 102 A S H >X S+ 0 0 5 -4,-1.2 4,-1.6 2,-0.2 3,-1.3 0.901 109.4 49.9 -73.3 -48.7 -20.9 61.6 7.4 102 103 A L H 3X S+ 0 0 2 -4,-2.8 4,-3.0 1,-0.3 5,-0.2 0.939 108.7 54.5 -59.0 -41.3 -19.6 58.4 6.0 103 104 A Q H 3X S+ 0 0 52 -4,-2.1 4,-0.9 2,-0.2 -1,-0.3 0.557 100.6 60.8 -69.9 -8.8 -17.8 57.8 9.3 104 105 A H H <> S+ 0 0 100 -3,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.938 112.3 36.9 -78.0 -51.6 -21.1 58.2 11.1 105 106 A L H X S+ 0 0 1 -4,-1.6 4,-3.3 2,-0.2 -2,-0.2 0.897 115.3 54.5 -64.5 -45.1 -22.5 55.3 9.3 106 107 A F H <>S+ 0 0 2 -4,-3.0 5,-1.8 1,-0.2 6,-0.3 0.872 112.3 44.6 -57.6 -40.0 -19.2 53.3 9.4 107 108 A R H ><5S+ 0 0 210 -4,-0.9 3,-1.0 -5,-0.2 -1,-0.2 0.856 114.2 51.8 -74.5 -30.4 -19.1 53.7 13.1 108 109 A K H 3<5S+ 0 0 134 -4,-1.9 2,-0.5 1,-0.3 -2,-0.2 0.998 114.6 38.5 -67.1 -61.3 -22.8 52.8 13.2 109 110 A S T 3<5S- 0 0 23 -4,-3.3 -1,-0.3 1,-0.1 -2,-0.1 -0.017 108.9-124.9 -81.0 31.2 -22.5 49.6 11.2 110 111 A S T < 5 + 0 0 82 -3,-1.0 -3,-0.2 -2,-0.5 -4,-0.1 0.633 54.5 154.8 30.3 43.3 -19.2 48.8 13.0 111 112 A L < + 0 0 0 -5,-1.8 -33,-1.7 -6,-0.2 2,-0.5 0.087 35.7 110.1 -86.4 31.2 -17.2 48.4 9.8 112 113 A Y B E 77 0B 67 -6,-0.3 -35,-0.2 -35,-0.2 -36,-0.1 -0.902 360.0 360.0-114.0 123.8 -13.9 49.3 11.5 113 114 A K 0 0 145 -37,-2.2 -36,-0.1 -2,-0.5 -1,-0.1 0.448 360.0 360.0 -70.5 360.0 -11.1 46.9 12.1