==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE(ENDORIBONUCLEASE) 16-FEB-93 1RBU . COMPND 2 MOLECULE: RIBONUCLEASE H; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.ISHIKAWA,S.KIMURA,S.KANAYA,K.MORIKAWA,H.NAKAMURA . 155 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8744.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 1 0.6 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 . 8 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 28.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.9 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 1 0 0 1 0 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 1 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 0 0 0 0 1 0 1 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 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 1 A M 0 0 183 0, 0.0 29,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 118.1 -17.9 -4.6 18.4 2 2 A L - 0 0 94 27,-0.2 27,-0.1 1,-0.1 4,-0.0 -0.294 360.0-149.6 -61.9 144.4 -16.5 -1.4 19.8 3 3 A K S S+ 0 0 184 2,-0.0 2,-0.3 -2,-0.0 61,-0.2 0.482 81.8 53.4 -92.0 -3.9 -19.0 1.4 20.6 4 4 A Q S S- 0 0 67 59,-0.1 2,-0.4 62,-0.0 61,-0.2 -0.946 88.2-115.4-132.8 145.0 -16.5 4.2 19.8 5 5 A V E -a 65 0A 13 59,-3.2 61,-3.0 -2,-0.3 2,-0.5 -0.731 31.7-152.3 -80.0 130.2 -14.4 4.7 16.7 6 6 A E E -aB 66 27A 51 21,-1.3 21,-3.0 -2,-0.4 2,-0.4 -0.923 14.7-178.2-112.5 129.4 -10.7 4.4 17.5 7 7 A I E -aB 67 26A 1 59,-2.3 61,-3.7 -2,-0.5 2,-0.4 -0.989 6.8-175.2-127.4 136.6 -8.1 6.3 15.4 8 8 A F E -aB 68 25A 12 17,-2.3 17,-2.5 -2,-0.4 2,-0.3 -0.992 12.9-178.3-131.3 135.6 -4.3 6.2 15.7 9 9 A T E + B 0 24A 3 59,-1.6 61,-0.5 -2,-0.4 2,-0.3 -0.982 14.6 167.2-141.5 151.7 -1.9 8.4 13.7 10 10 A D E - B 0 23A 11 13,-2.1 13,-2.3 -2,-0.3 2,-0.3 -0.977 11.4-162.3-154.6 158.1 1.7 9.2 13.0 11 11 A G E - B 0 22A 4 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.971 7.9-171.9-144.0 150.5 3.6 11.1 10.4 12 12 A S E - B 0 21A 15 9,-3.0 9,-2.2 -2,-0.3 2,-0.3 -0.959 6.4-173.7-147.1 156.0 7.3 11.1 9.4 13 13 A C E - B 0 20A 20 -2,-0.3 7,-0.2 7,-0.3 31,-0.1 -0.967 20.3-154.3-155.7 136.6 9.7 13.1 7.2 14 14 A L S S+ 0 0 108 5,-2.6 2,-0.2 -2,-0.3 6,-0.1 0.708 80.8 4.6 -84.0 -21.5 13.3 12.6 6.3 15 15 A G S > S- 0 0 35 4,-0.4 3,-0.7 27,-0.2 29,-0.3 -0.697 82.3 -85.6-146.3-166.6 14.0 16.3 5.5 16 16 A N T 3 S+ 0 0 134 1,-1.1 2,-0.1 -2,-0.2 27,-0.1 -0.614 132.9 6.8-148.7 80.5 12.6 19.8 5.6 17 17 A P T 3 S+ 0 0 46 0, 0.0 -1,-1.1 0, 0.0 26,-0.2 0.552 117.1 124.3 -84.1 163.7 11.3 19.6 3.1 18 18 A G E < - C 0 42A 7 24,-2.9 24,-3.5 -3,-0.7 2,-0.1 -0.937 65.2 -55.4-162.9 179.5 11.9 15.9 2.3 19 19 A P E + 0 0 49 0, 0.0 -5,-2.6 0, 0.0 -4,-0.4 -0.452 66.8 167.1 -64.5 134.2 10.3 12.6 1.4 20 20 A G E -BC 13 39A 0 19,-3.1 19,-3.7 -7,-0.2 2,-0.3 -0.930 18.8-175.4-149.0 173.5 7.7 11.8 4.0 21 21 A G E -BC 12 38A 0 -9,-2.2 -9,-3.0 -2,-0.3 2,-0.3 -0.971 12.6-135.9-161.1 174.6 4.7 9.6 4.9 22 22 A Y E -BC 11 37A 16 15,-1.7 15,-0.9 -2,-0.3 2,-0.4 -0.927 3.1-157.6-135.2 162.0 2.0 8.8 7.3 23 23 A G E +BC 10 36A 0 -13,-2.3 -13,-2.1 -2,-0.3 2,-0.3 -0.997 15.5 176.3-139.8 134.3 0.4 5.8 9.0 24 24 A A E -BC 9 35A 0 11,-2.0 11,-2.4 -2,-0.4 2,-0.5 -0.994 14.2-159.4-142.5 142.7 -3.2 5.7 10.4 25 25 A I E -BC 8 34A 0 -17,-2.5 -17,-2.3 -2,-0.3 2,-0.4 -0.990 11.1-171.5-124.9 127.9 -5.2 2.9 12.0 26 26 A L E -BC 7 33A 0 7,-3.0 7,-3.7 -2,-0.5 2,-0.7 -0.999 13.7-159.7-125.3 124.9 -9.0 3.1 12.1 27 27 A R E +BC 6 32A 52 -21,-3.0 -21,-1.3 -2,-0.4 2,-0.4 -0.938 36.3 152.0-105.3 101.8 -11.3 0.8 14.0 28 28 A Y E > - C 0 31A 13 3,-2.1 3,-2.3 -2,-0.7 2,-0.2 -1.000 55.3 -17.7-140.4 142.8 -14.7 1.3 12.3 29 29 A R T 3 S- 0 0 173 -2,-0.4 -27,-0.2 1,-0.3 -2,-0.0 -0.551 128.0 -37.2 58.2-123.8 -17.8 -0.8 11.7 30 30 A G T 3 S+ 0 0 67 -2,-0.2 -1,-0.3 -29,-0.1 2,-0.2 0.330 121.5 83.5-112.5 13.2 -16.4 -4.3 12.3 31 31 A R E < -C 28 0A 181 -3,-2.3 -3,-2.1 2,-0.0 2,-0.6 -0.633 67.2-133.7-112.6 168.6 -12.9 -3.7 10.8 32 32 A E E -C 27 0A 79 -2,-0.2 2,-0.4 -5,-0.2 -5,-0.2 -0.987 30.4-166.3-117.1 107.2 -9.5 -2.4 11.3 33 33 A K E -C 26 0A 66 -7,-3.7 -7,-3.0 -2,-0.6 2,-0.5 -0.868 2.3-159.1-101.7 139.2 -8.5 -0.2 8.3 34 34 A T E -C 25 0A 64 -2,-0.4 2,-0.4 -9,-0.2 -9,-0.2 -0.993 6.0-170.6-119.5 128.2 -4.9 0.8 7.7 35 35 A F E +C 24 0A 53 -11,-2.4 -11,-2.0 -2,-0.5 2,-0.3 -0.931 13.5 158.5-118.6 139.6 -3.9 3.8 5.6 36 36 A S E +C 23 0A 51 -2,-0.4 2,-0.3 -13,-0.2 -13,-0.2 -0.958 1.9 159.6-158.5 136.7 -0.3 4.6 4.6 37 37 A A E -C 22 0A 17 -15,-0.9 -15,-1.7 -2,-0.3 2,-0.3 -0.971 25.6-139.3-153.4 150.1 1.2 6.7 1.7 38 38 A G E -C 21 0A 2 105,-0.3 108,-2.3 -2,-0.3 107,-2.0 -0.893 12.6-152.5-116.1 145.3 4.6 8.5 1.1 39 39 A Y E -Cd 20 146A 21 -19,-3.7 -19,-3.1 -2,-0.3 3,-0.3 -0.915 15.0-135.1-120.6 137.7 5.0 11.9 -0.5 40 40 A T E S+ 0 0 81 106,-1.9 2,-0.3 -2,-0.4 107,-0.1 0.790 91.5 14.9 -62.7 -37.1 8.1 13.0 -2.4 41 41 A R E S+ 0 0 124 -22,-0.1 107,-0.3 -21,-0.1 -1,-0.3 -0.867 89.3 109.1-148.0 105.3 8.6 16.4 -0.9 42 42 A T E -C 18 0A 0 -24,-3.5 -24,-2.9 -2,-0.3 2,-0.3 -0.754 54.4-100.4-154.5-165.2 6.8 17.4 2.3 43 43 A T > - 0 0 16 -2,-0.2 4,-1.7 -26,-0.2 3,-0.3 -0.885 29.2-112.6-130.6 160.0 7.3 18.2 6.0 44 44 A N H > S+ 0 0 60 -29,-0.3 4,-2.1 -2,-0.3 5,-0.1 0.834 116.6 52.9 -59.6 -45.4 6.8 16.2 9.2 45 45 A N H > S+ 0 0 50 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.761 107.3 50.9 -62.8 -36.2 4.0 18.5 10.4 46 46 A R H > S+ 0 0 1 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.900 111.7 47.6 -72.1 -38.4 2.1 18.1 7.1 47 47 A M H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.865 108.7 54.3 -66.7 -41.5 2.3 14.3 7.3 48 48 A E H X S+ 0 0 22 -4,-2.1 4,-1.0 1,-0.2 -1,-0.2 0.880 113.5 42.6 -62.5 -35.1 1.1 14.4 11.0 49 49 A L H X S+ 0 0 0 -4,-1.5 4,-2.1 1,-0.2 -2,-0.2 0.866 110.3 57.3 -75.2 -40.5 -2.0 16.4 9.9 50 50 A M H X S+ 0 0 10 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.845 99.8 59.0 -59.0 -38.4 -2.5 14.2 6.8 51 51 A A H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.917 109.9 41.5 -55.9 -52.7 -2.7 11.1 9.0 52 52 A A H X S+ 0 0 0 -4,-1.0 4,-2.2 1,-0.2 -1,-0.2 0.860 113.0 56.1 -61.8 -42.2 -5.7 12.4 11.0 53 53 A I H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.925 107.9 45.1 -55.4 -57.7 -7.3 13.8 7.8 54 54 A V H X S+ 0 0 26 -4,-2.3 4,-0.7 1,-0.2 -1,-0.2 0.905 113.3 50.4 -58.4 -44.5 -7.4 10.5 5.9 55 55 A A H < S+ 0 0 0 -4,-1.7 3,-0.5 -5,-0.2 4,-0.4 0.884 113.8 44.7 -62.7 -43.6 -8.7 8.5 8.9 56 56 A L H >< S+ 0 0 2 -4,-2.2 3,-1.6 1,-0.2 -1,-0.2 0.905 106.8 58.4 -68.4 -42.5 -11.6 11.0 9.5 57 57 A E H 3< S+ 0 0 81 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.704 95.6 65.9 -64.5 -14.9 -12.5 11.3 5.8 58 58 A A T 3< S+ 0 0 30 -4,-0.7 2,-0.5 -3,-0.5 -1,-0.3 0.711 80.5 97.1 -77.5 -21.2 -13.1 7.5 5.8 59 59 A L < - 0 0 11 -3,-1.6 4,-0.1 -4,-0.4 -3,-0.0 -0.592 53.4-173.6 -77.2 118.7 -16.0 8.0 8.2 60 60 A K + 0 0 176 -2,-0.5 2,-0.3 2,-0.1 -1,-0.1 0.437 65.5 31.7 -94.9 -2.9 -19.3 8.1 6.3 61 61 A E S S- 0 0 81 0, 0.0 2,-0.4 0, 0.0 52,-0.1 -0.907 101.3 -74.2-145.6 170.9 -21.7 9.1 9.2 62 62 A H + 0 0 125 -2,-0.3 2,-0.3 52,-0.1 52,-0.2 -0.581 61.2 178.4 -74.2 123.3 -21.4 11.1 12.4 63 63 A C - 0 0 9 -2,-0.4 52,-2.5 50,-0.1 2,-0.6 -0.819 37.0-117.7-124.4 166.0 -19.4 9.1 14.9 64 64 A E E - e 0 115A 95 -2,-0.3 -59,-3.2 50,-0.2 2,-0.4 -0.897 47.1-170.8-102.7 117.0 -18.1 9.3 18.5 65 65 A V E -ae 5 116A 2 50,-3.5 52,-2.5 -2,-0.6 2,-0.5 -0.894 29.9-161.1-122.4 149.4 -14.3 9.1 18.1 66 66 A I E -ae 6 117A 37 -61,-3.0 -59,-2.3 -2,-0.4 2,-0.5 -0.999 19.2-165.8-123.8 119.2 -11.3 8.7 20.2 67 67 A L E -ae 7 118A 0 50,-2.7 52,-2.7 -2,-0.5 2,-0.5 -0.964 0.7-164.0-113.2 126.4 -8.1 9.8 18.3 68 68 A S E +ae 8 119A 2 -61,-3.7 -59,-1.6 -2,-0.5 2,-0.3 -0.949 23.1 141.0-115.8 126.8 -4.7 8.9 19.7 69 69 A T E - e 0 120A 1 50,-1.9 52,-1.0 -2,-0.5 -59,-0.1 -0.972 46.9-144.7-160.5 147.8 -1.4 10.5 18.6 70 70 A D + 0 0 55 -61,-0.5 2,-0.5 -2,-0.3 53,-0.2 0.146 58.1 134.3 -96.2 11.9 1.9 11.8 20.0 71 71 A S > - 0 0 2 -62,-0.2 4,-1.7 1,-0.2 5,-0.1 -0.595 38.5-168.9 -74.5 117.4 1.9 14.7 17.5 72 72 A Q H > S+ 0 0 135 -2,-0.5 4,-2.9 2,-0.2 5,-0.2 0.869 86.6 54.4 -70.5 -39.2 2.8 17.9 19.3 73 73 A Y H > S+ 0 0 15 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.858 109.7 45.0 -64.5 -42.5 1.9 20.0 16.2 74 74 A V H > S+ 0 0 1 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.930 114.7 49.8 -68.7 -42.3 -1.6 18.6 16.0 75 75 A R H X S+ 0 0 127 -4,-1.7 4,-2.7 1,-0.2 5,-0.3 0.923 111.3 48.5 -61.1 -45.4 -2.1 19.0 19.7 76 76 A Q H X>S+ 0 0 53 -4,-2.9 4,-3.0 2,-0.2 5,-1.0 0.910 112.8 47.4 -60.4 -47.1 -0.9 22.6 19.6 77 77 A G H X>S+ 0 0 0 -4,-2.1 5,-2.8 3,-0.2 4,-1.0 0.944 116.5 44.0 -60.5 -50.8 -3.2 23.5 16.7 78 78 A I H <5S+ 0 0 37 -4,-2.7 5,-0.2 3,-0.2 -2,-0.2 0.843 123.9 33.5 -62.1 -43.9 -6.2 21.8 18.4 79 79 A T H <5S+ 0 0 83 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.760 135.4 14.0 -91.1 -29.5 -5.6 23.2 21.9 80 80 A Q H <5S+ 0 0 102 -4,-3.0 -3,-0.2 -5,-0.3 4,-0.2 0.684 126.1 30.9-121.8 -25.4 -4.1 26.6 21.2 81 81 A W T >X S+ 0 0 126 -6,-0.3 4,-0.9 1,-0.2 -1,-0.2 0.901 114.5 41.5 -51.7 -48.9 -10.2 28.4 17.8 84 84 A N H <> S+ 0 0 85 -3,-0.8 4,-1.3 1,-0.2 -1,-0.2 0.689 110.0 58.5 -73.0 -30.4 -8.5 31.8 17.3 85 85 A W H <>S+ 0 0 33 -4,-1.7 5,-3.8 2,-0.2 6,-0.3 0.818 104.5 50.0 -72.4 -36.4 -7.7 31.1 13.6 86 86 A K H ><5S+ 0 0 99 -4,-2.1 3,-0.5 2,-0.2 -2,-0.2 0.803 110.6 50.5 -71.0 -32.5 -11.5 30.6 12.8 87 87 A K H 3<5S+ 0 0 171 -4,-0.9 -2,-0.2 -5,-0.2 -1,-0.2 0.842 114.7 45.2 -67.5 -39.9 -12.2 33.9 14.6 88 88 A R T 3<5S- 0 0 130 -4,-1.3 -1,-0.2 3,-0.1 -2,-0.2 0.332 117.3-108.1 -87.3 0.5 -9.5 35.6 12.6 89 89 A G T < 5S- 0 0 45 -3,-0.5 -3,-0.2 -4,-0.2 -4,-0.1 0.783 72.6 -62.2 73.8 27.6 -10.4 34.2 9.1 90 90 A W S - 0 0 44 4,-3.1 3,-1.5 -2,-0.3 6,-0.1 -0.276 42.0 -96.2 -81.1 168.8 -1.5 35.3 11.3 93 93 A A T 3 S+ 0 0 91 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.729 127.5 55.0 -65.0 -22.0 -1.1 38.5 13.4 94 94 A D T 3 S- 0 0 125 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.141 124.6-105.3 -98.3 15.3 0.9 40.0 10.5 95 95 A N S < S+ 0 0 114 -3,-1.5 -2,-0.1 1,-0.2 3,-0.0 0.831 76.3 124.8 71.1 39.9 -2.1 39.3 8.2 96 96 A K - 0 0 114 1,-0.0 -4,-3.1 3,-0.0 -1,-0.2 -0.840 69.9 -85.5-120.1 165.2 -1.1 36.3 6.1 97 97 A P B -F 91 0B 55 0, 0.0 -6,-0.3 0, 0.0 -7,-0.1 -0.362 57.5 -99.5 -60.2 144.4 -2.7 33.0 5.6 98 98 A V > - 0 0 3 -8,-1.9 3,-1.7 1,-0.1 4,-0.2 -0.185 44.6 -87.5 -65.4 155.6 -1.7 30.5 8.4 99 99 A K T 3 S+ 0 0 113 1,-0.3 -1,-0.1 2,-0.1 5,-0.1 -0.505 113.4 4.5 -64.9 127.3 1.0 27.9 7.7 100 100 A N T >> S+ 0 0 15 -2,-0.2 4,-2.5 50,-0.2 3,-0.9 0.716 80.0 156.8 62.7 30.8 -0.6 24.7 6.2 101 101 A V H <> + 0 0 32 -3,-1.7 4,-2.3 1,-0.3 5,-0.3 0.804 67.2 63.0 -50.1 -33.9 -4.0 26.4 6.0 102 102 A D H 3> S+ 0 0 60 -4,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.925 110.8 35.2 -56.7 -51.2 -4.9 24.0 3.3 103 103 A L H <> S+ 0 0 4 -3,-0.9 4,-3.0 2,-0.2 5,-0.2 0.877 116.3 53.4 -73.6 -44.2 -4.6 20.9 5.7 104 104 A W H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.867 111.9 46.2 -61.4 -39.6 -5.9 22.7 8.8 105 105 A Q H X S+ 0 0 88 -4,-2.3 4,-1.8 -5,-0.3 -1,-0.2 0.861 113.4 49.5 -67.9 -39.8 -9.1 23.8 6.9 106 106 A R H X S+ 0 0 106 -4,-1.3 4,-1.4 -5,-0.3 -2,-0.2 0.903 113.6 45.7 -64.8 -46.7 -9.4 20.3 5.5 107 107 A L H X S+ 0 0 0 -4,-3.0 4,-2.3 2,-0.2 -2,-0.2 0.915 109.5 54.7 -61.0 -49.4 -9.0 18.8 9.0 108 108 A D H X S+ 0 0 39 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.855 105.4 54.1 -50.6 -44.5 -11.4 21.3 10.5 109 109 A A H < S+ 0 0 64 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.882 111.1 44.7 -60.9 -42.4 -14.1 20.3 8.0 110 110 A A H >< S+ 0 0 10 -4,-1.4 3,-1.1 1,-0.2 -2,-0.2 0.797 109.1 57.5 -72.6 -34.9 -13.7 16.6 9.0 111 111 A L H >< S+ 0 0 26 -4,-2.3 3,-1.4 1,-0.2 -1,-0.2 0.855 97.3 62.0 -61.6 -42.6 -13.7 17.4 12.7 112 112 A G T 3< S+ 0 0 65 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.341 94.1 62.3 -68.3 -5.7 -17.1 19.1 12.5 113 113 A Q T < S+ 0 0 108 -3,-1.1 -1,-0.3 -4,-0.1 2,-0.3 0.491 106.9 43.6 -97.7 -6.9 -18.9 16.0 11.4 114 114 A H S < S- 0 0 27 -3,-1.4 2,-0.7 -4,-0.2 -50,-0.2 -0.829 77.6-111.5-137.1 169.1 -18.1 14.1 14.7 115 115 A Q E -e 64 0A 128 -52,-2.5 -50,-3.5 -2,-0.3 2,-0.5 -0.925 47.4-163.6-103.1 109.9 -17.8 14.0 18.5 116 116 A I E -e 65 0A 44 -2,-0.7 2,-0.5 -52,-0.2 -50,-0.2 -0.899 24.2-171.5-111.2 132.9 -14.1 13.8 19.2 117 117 A K E -e 66 0A 103 -52,-2.5 -50,-2.7 -2,-0.5 2,-0.4 -0.977 20.8-150.8-117.1 119.2 -12.1 12.9 22.2 118 118 A W E -e 67 0A 52 -2,-0.5 2,-0.5 -52,-0.2 -50,-0.2 -0.820 7.4-163.6 -97.0 135.4 -8.3 13.5 21.7 119 119 A E E -e 68 0A 69 -52,-2.7 -50,-1.9 -2,-0.4 2,-1.1 -0.957 7.1-155.7-126.4 105.1 -5.7 11.4 23.6 120 120 A W E -e 69 0A 70 -2,-0.5 -50,-0.2 -52,-0.2 2,-0.1 -0.705 17.9-172.7 -83.9 94.4 -2.2 12.9 23.6 121 121 A V - 0 0 21 -2,-1.1 2,-0.4 -52,-1.0 5,-0.2 -0.441 24.0-117.7 -89.2 162.3 0.3 10.1 24.1 122 122 A K > - 0 0 147 3,-0.4 3,-2.2 -2,-0.1 -51,-0.1 -0.797 27.7-117.1 -95.5 142.4 4.0 10.5 24.6 123 123 A G G > S+ 0 0 53 -2,-0.4 3,-0.7 1,-0.3 -1,-0.1 0.893 113.3 44.7 -48.4 -48.9 6.2 9.0 21.9 124 124 A H G 3 S+ 0 0 160 1,-0.3 -1,-0.3 -3,-0.0 7,-0.0 0.402 118.5 43.1 -80.9 1.6 7.8 6.5 24.2 125 125 A A G < S+ 0 0 64 -3,-2.2 -3,-0.4 2,-0.0 -1,-0.3 -0.231 79.1 121.6-142.7 49.7 4.6 5.4 25.9 126 126 A G < - 0 0 23 -3,-0.7 -3,-0.0 1,-0.2 -6,-0.0 -0.356 64.8 -87.3 -99.2-178.9 1.8 5.0 23.2 127 127 A H >> - 0 0 72 -2,-0.1 4,-1.8 1,-0.1 3,-0.7 -0.339 44.3 -94.3 -83.1 176.0 -0.2 1.8 22.5 128 128 A P H 3> S+ 0 0 92 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.792 126.3 58.4 -58.1 -32.7 0.8 -0.9 20.1 129 129 A E H 3> S+ 0 0 34 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.868 102.6 51.3 -71.5 -31.3 -1.2 0.9 17.4 130 130 A N H <> S+ 0 0 9 -3,-0.7 4,-1.9 2,-0.2 -1,-0.2 0.921 109.8 49.2 -70.7 -44.4 0.8 4.1 17.7 131 131 A E H X S+ 0 0 118 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.930 109.8 52.8 -57.8 -43.6 4.1 2.2 17.3 132 132 A R H X S+ 0 0 90 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.883 106.9 52.2 -56.2 -42.6 2.7 0.5 14.2 133 133 A C H X S+ 0 0 0 -4,-1.6 4,-3.2 2,-0.2 -1,-0.2 0.925 108.1 51.7 -58.6 -46.1 1.7 3.9 12.7 134 134 A D H X S+ 0 0 59 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.915 109.8 49.1 -59.0 -49.7 5.3 5.1 13.2 135 135 A E H X S+ 0 0 121 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.917 113.8 45.9 -61.0 -44.9 6.6 2.0 11.4 136 136 A L H X S+ 0 0 50 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.924 111.8 51.3 -66.8 -38.4 4.2 2.5 8.5 137 137 A A H X S+ 0 0 0 -4,-3.2 4,-1.9 1,-0.2 -2,-0.2 0.942 112.7 46.7 -61.5 -44.2 5.0 6.3 8.3 138 138 A R H X S+ 0 0 119 -4,-2.5 4,-0.9 2,-0.2 -1,-0.2 0.918 112.2 48.2 -63.4 -48.1 8.7 5.6 8.2 139 139 A A H >< S+ 0 0 64 -4,-2.3 3,-0.6 1,-0.2 4,-0.3 0.881 110.8 53.0 -60.1 -41.3 8.4 2.8 5.5 140 140 A A H >< S+ 0 0 12 -4,-2.4 3,-1.8 1,-0.2 -1,-0.2 0.891 102.5 57.3 -63.0 -40.8 6.2 5.1 3.4 141 141 A A H 3< S+ 0 0 2 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.742 102.8 55.9 -62.3 -23.9 8.7 7.9 3.5 142 142 A M T << S+ 0 0 137 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.547 117.7 33.7 -82.5 -15.0 11.3 5.5 2.0 143 143 A N S < S- 0 0 124 -3,-1.8 -105,-0.3 -4,-0.3 -1,-0.3 -0.480 80.9-178.8-141.9 69.1 9.0 4.8 -1.0 144 144 A P + 0 0 43 0, 0.0 -105,-0.2 0, 0.0 -3,-0.1 -0.455 14.4 164.7 -74.2 135.8 7.0 7.9 -1.8 145 145 A T + 0 0 102 -107,-2.0 2,-0.2 -2,-0.2 -106,-0.2 0.516 52.1 68.1-125.3 -13.6 4.5 7.8 -4.7 146 146 A L B S-d 39 0A 78 -108,-2.3 -106,-1.9 2,-0.0 2,-0.4 -0.709 70.8-122.1-111.5 168.5 2.3 10.9 -4.3 147 147 A E - 0 0 154 -2,-0.2 2,-1.2 -108,-0.2 3,-0.1 -0.882 13.5-139.5-108.6 132.5 2.8 14.6 -4.6 148 148 A D > - 0 0 13 -2,-0.4 3,-1.1 -107,-0.3 -109,-0.0 -0.799 25.0-177.4 -94.3 91.5 2.0 17.0 -1.7 149 149 A T T 3 S+ 0 0 123 -2,-1.2 -1,-0.2 1,-0.3 0, 0.0 0.850 72.8 56.2 -60.2 -42.6 0.3 19.7 -3.8 150 150 A G T 3 S+ 0 0 18 -3,-0.1 2,-0.3 -50,-0.0 -1,-0.3 0.355 77.7 118.8 -79.0 3.6 -0.3 22.2 -0.9 151 151 A Y < + 0 0 38 -3,-1.1 2,-0.4 -110,-0.1 3,-0.1 -0.574 38.4 179.0 -78.1 136.8 3.4 22.4 0.2 152 152 A Q - 0 0 80 -2,-0.3 -52,-0.1 2,-0.1 -2,-0.0 -0.999 36.0-153.6-137.1 133.4 4.9 25.8 -0.0 153 153 A V S S+ 0 0 104 -2,-0.4 -1,-0.1 2,-0.1 -2,-0.0 0.852 98.3 44.1 -62.2 -34.2 8.5 26.9 0.9 154 154 A E 0 0 132 -3,-0.1 -2,-0.1 1,-0.1 -3,-0.0 0.931 360.0 360.0 -60.4-134.1 6.4 30.0 1.3 155 155 A V 0 0 75 -56,-0.1 -2,-0.1 -55,-0.0 -1,-0.1 0.409 360.0 360.0 -31.7 360.0 3.1 31.1 2.7