==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-NOV-09 3AA4 . COMPND 2 MOLECULE: RIBONUCLEASE HI; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.TAKANO . 152 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8363.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 113 74.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 15.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 10 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 45 29.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.0 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 1 0 1 0 0 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 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 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 2 A L 0 0 129 0, 0.0 2,-0.2 0, 0.0 61,-0.2 0.000 360.0 360.0 360.0 150.9 24.1 37.0 13.8 2 3 A K E -a 62 0A 46 59,-0.7 61,-2.9 25,-0.0 2,-0.5 -0.587 360.0-143.0 -67.9 137.1 21.1 39.0 12.8 3 4 A Q E -a 63 0A 91 -2,-0.2 25,-0.4 59,-0.2 2,-0.4 -0.941 23.9-179.9 -99.3 126.4 18.4 39.0 15.4 4 5 A V E -a 64 0A 3 59,-3.0 61,-2.1 -2,-0.5 2,-0.5 -0.963 21.9-145.7-129.1 139.2 14.8 38.9 14.0 5 6 A E E -aB 65 26A 68 21,-2.6 21,-3.0 -2,-0.4 2,-0.4 -0.895 21.1-167.8-101.6 133.0 11.4 38.9 15.7 6 7 A I E -aB 66 25A 0 59,-3.3 61,-3.2 -2,-0.5 2,-0.4 -0.979 9.6-175.6-122.3 138.4 8.8 36.8 13.8 7 8 A F E +aB 67 24A 15 17,-2.2 17,-2.6 -2,-0.4 2,-0.3 -0.982 14.0 178.5-129.6 138.7 5.0 36.7 14.4 8 9 A T E +aB 68 23A 0 59,-2.0 61,-0.5 -2,-0.4 2,-0.3 -0.984 14.7 162.5-140.2 153.0 2.7 34.4 12.6 9 10 A D E + B 0 22A 9 13,-2.6 13,-2.9 -2,-0.3 2,-0.3 -0.971 6.1 175.5-158.0 161.5 -0.9 33.3 12.2 10 11 A G E + B 0 21A 0 -2,-0.3 2,-0.3 11,-0.3 11,-0.2 -0.981 9.4 146.6-161.4 152.7 -3.0 31.3 9.7 11 12 A S E - B 0 20A 20 9,-2.3 9,-2.4 -2,-0.3 2,-0.3 -0.978 35.7-104.6-174.0 172.8 -6.6 30.0 9.3 12 13 A C E - B 0 19A 15 -2,-0.3 7,-0.3 7,-0.3 3,-0.2 -0.897 18.9-133.8-109.5 149.4 -9.5 29.2 7.1 13 14 A L S S+ 0 0 100 5,-1.9 2,-0.3 1,-0.3 -1,-0.1 0.929 106.0 4.3 -64.5 -45.8 -12.9 31.0 6.6 14 15 A G S S- 0 0 41 4,-0.6 -1,-0.3 -3,-0.1 -3,-0.0 -0.984 102.0 -97.5-131.1 149.3 -14.4 27.6 6.9 15 16 A N S S+ 0 0 89 -2,-0.3 2,-0.1 -3,-0.2 27,-0.1 -0.906 110.1 22.9-114.5 116.0 -12.3 24.5 7.7 16 17 A P S S+ 0 0 64 0, 0.0 26,-0.2 0, 0.0 -1,-0.1 0.558 116.4 65.8 -83.4 151.0 -11.6 22.9 5.2 17 18 A G E S- C 0 41A 7 24,-2.1 24,-2.7 -2,-0.1 21,-0.1 -0.972 90.2 -1.5 170.5-155.6 -11.8 25.5 2.6 18 19 A P E S+ 0 0 49 0, 0.0 -5,-1.9 0, 0.0 -4,-0.6 -0.251 71.3 161.3 -58.1 139.2 -10.2 28.8 1.6 19 20 A G E -BC 12 38A 0 19,-2.4 19,-3.2 -7,-0.3 2,-0.3 -0.904 17.2-177.9-156.0 171.6 -7.5 29.8 4.0 20 21 A G E -BC 11 37A 0 -9,-2.4 -9,-2.3 -2,-0.3 2,-0.3 -0.982 15.2-130.0-165.8 170.2 -4.4 32.0 4.3 21 22 A Y E -BC 10 36A 21 15,-1.9 15,-1.0 -2,-0.3 2,-0.4 -0.932 6.2-158.5-126.9 162.9 -1.6 33.1 6.5 22 23 A G E +BC 9 35A 0 -13,-2.9 -13,-2.6 -2,-0.3 2,-0.3 -0.996 14.7 176.9-136.9 137.6 0.0 36.3 7.8 23 24 A A E -BC 8 34A 0 11,-2.5 11,-2.7 -2,-0.4 2,-0.4 -0.999 13.6-158.9-140.0 148.6 3.5 36.7 9.0 24 25 A I E -BC 7 33A 0 -17,-2.6 -17,-2.2 -2,-0.3 2,-0.5 -0.988 3.0-167.9-129.0 121.8 5.6 39.6 10.2 25 26 A L E -BC 6 32A 10 7,-2.9 7,-2.8 -2,-0.4 2,-0.4 -0.980 9.8-169.2-106.5 130.2 9.4 39.7 10.3 26 27 A R E +BC 5 31A 36 -21,-3.0 -21,-2.6 -2,-0.5 2,-0.4 -0.949 9.4 174.4-126.8 124.9 11.0 42.6 12.2 27 28 A Y E > S- C 0 30A 95 3,-2.6 3,-2.0 -2,-0.4 -23,-0.1 -0.985 72.9 -20.9-135.8 112.5 14.7 43.4 12.1 28 29 A R T 3 S- 0 0 198 -25,-0.4 3,-0.1 -2,-0.4 -1,-0.1 0.854 128.7 -49.2 58.9 36.3 16.1 46.5 13.8 29 30 A G T 3 S+ 0 0 61 1,-0.2 -1,-0.3 0, 0.0 2,-0.3 0.073 115.2 112.4 95.2 -29.3 12.7 48.2 13.9 30 31 A R E < -C 27 0A 167 -3,-2.0 -3,-2.6 1,-0.0 2,-0.4 -0.618 52.6-150.8 -79.6 141.7 11.9 47.5 10.2 31 32 A E E -C 26 0A 65 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.878 13.5-167.5-114.6 143.5 9.1 45.1 9.3 32 33 A K E -C 25 0A 81 -7,-2.8 -7,-2.9 -2,-0.4 2,-0.4 -0.972 16.0-153.4-120.7 136.4 8.4 42.8 6.3 33 34 A T E -C 24 0A 68 -2,-0.4 2,-0.4 -9,-0.2 -9,-0.2 -0.913 8.3-168.8-110.7 140.8 4.9 41.3 6.0 34 35 A F E +C 23 0A 47 -11,-2.7 -11,-2.5 -2,-0.4 2,-0.3 -0.993 15.9 155.7-126.2 140.3 4.1 38.1 4.2 35 36 A S E +C 22 0A 51 -2,-0.4 2,-0.3 -13,-0.2 -13,-0.2 -0.961 5.5 162.8-164.7 135.4 0.6 36.9 3.4 36 37 A A E -C 21 0A 18 -15,-1.0 -15,-1.9 -2,-0.3 2,-0.4 -0.980 24.3-134.2-150.5 154.8 -1.0 34.6 0.8 37 38 A G E -C 20 0A 3 -2,-0.3 108,-2.3 105,-0.3 107,-1.9 -0.914 11.6-153.8-113.4 146.4 -4.4 32.7 0.4 38 39 A Y E -Cd 19 145A 16 -19,-3.2 -19,-2.4 -2,-0.4 3,-0.2 -0.914 16.6-135.7-119.2 141.2 -5.0 29.1 -0.6 39 40 A T E S+ 0 0 75 106,-2.6 2,-0.3 -2,-0.4 107,-0.1 0.864 91.4 10.7 -69.0 -36.4 -8.1 27.8 -2.4 40 41 A R E S+ 0 0 112 105,-0.3 107,-0.3 -22,-0.1 -1,-0.2 -0.890 86.5 113.6-145.9 115.9 -8.6 24.7 -0.2 41 42 A T E -C 17 0A 0 -24,-2.7 -24,-2.1 -2,-0.3 2,-0.3 -0.752 50.8-100.8-157.3-165.5 -6.7 24.0 2.9 42 43 A T > - 0 0 23 -2,-0.2 4,-2.3 -26,-0.2 5,-0.2 -0.902 26.8-110.6-131.9 166.0 -7.2 23.6 6.7 43 44 A N H > S+ 0 0 45 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.949 118.2 48.1 -58.2 -50.3 -6.7 25.7 9.9 44 45 A N H > S+ 0 0 63 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.875 111.3 50.2 -59.4 -45.5 -3.8 23.5 11.1 45 46 A R H > S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.895 112.5 46.1 -63.6 -35.6 -2.1 23.6 7.7 46 47 A M H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.873 109.8 54.3 -75.9 -35.7 -2.3 27.4 7.5 47 48 A E H X S+ 0 0 36 -4,-2.7 4,-0.9 -5,-0.2 -1,-0.2 0.897 115.9 39.4 -57.9 -46.0 -1.1 27.7 11.1 48 49 A L H X S+ 0 0 0 -4,-1.9 4,-2.5 -5,-0.2 3,-0.4 0.907 112.9 55.1 -72.2 -41.5 2.0 25.6 10.2 49 50 A M H X S+ 0 0 4 -4,-3.1 4,-2.9 1,-0.2 5,-0.3 0.876 101.8 59.5 -59.7 -38.1 2.4 27.2 6.7 50 51 A A H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.911 109.1 42.4 -54.3 -49.7 2.6 30.7 8.4 51 52 A V H X S+ 0 0 0 -4,-0.9 4,-2.4 -3,-0.4 5,-0.2 0.921 114.2 52.1 -65.5 -44.9 5.6 29.6 10.4 52 53 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.929 109.9 47.4 -53.5 -54.6 7.2 27.8 7.5 53 54 A V H X S+ 0 0 18 -4,-2.9 4,-1.4 2,-0.2 -1,-0.2 0.913 111.4 51.1 -60.7 -40.8 7.0 30.8 5.1 54 55 A A H X S+ 0 0 0 -4,-1.8 4,-0.7 -5,-0.3 3,-0.5 0.957 114.2 42.8 -60.9 -48.4 8.3 33.3 7.7 55 56 A L H >< S+ 0 0 2 -4,-2.4 3,-1.0 1,-0.2 -1,-0.2 0.871 110.7 55.5 -67.8 -41.7 11.4 31.1 8.4 56 57 A E H 3< S+ 0 0 82 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.791 97.1 67.1 -60.0 -22.7 12.0 30.3 4.7 57 58 A A H 3< S+ 0 0 23 -4,-1.4 2,-0.3 -3,-0.5 -1,-0.2 0.815 77.9 97.3 -68.9 -24.8 12.1 34.1 4.2 58 59 A L << - 0 0 24 -3,-1.0 4,-0.1 -4,-0.7 3,-0.0 -0.456 52.6-173.5 -71.6 126.2 15.3 34.3 6.2 59 60 A K + 0 0 189 -2,-0.3 2,-0.3 2,-0.1 -1,-0.1 0.366 68.0 38.0-105.3 -1.7 18.2 34.3 3.7 60 61 A E S S- 0 0 103 -58,-0.0 2,-0.2 0, 0.0 52,-0.0 -0.957 101.5 -81.9-142.4 161.4 21.0 34.1 6.4 61 62 A H + 0 0 111 -2,-0.3 -59,-0.7 52,-0.1 2,-0.3 -0.468 60.6 179.9 -67.7 127.3 21.4 32.3 9.7 62 63 A C E -a 2 0A 1 50,-0.3 52,-2.4 -2,-0.2 2,-0.5 -0.868 39.9-118.1-122.9 165.6 19.6 34.3 12.4 63 64 A E E -ae 3 114A 71 -61,-2.9 -59,-3.0 -2,-0.3 2,-0.4 -0.902 47.5-166.7 -94.6 124.3 18.7 34.4 16.1 64 65 A V E -ae 4 115A 2 50,-2.8 52,-3.0 -2,-0.5 2,-0.6 -0.962 27.7-162.7-123.4 132.8 14.9 34.3 15.9 65 66 A I E -ae 5 116A 37 -61,-2.1 -59,-3.3 -2,-0.4 2,-0.6 -0.991 24.6-166.5-109.0 110.7 12.2 35.0 18.5 66 67 A L E -ae 6 117A 0 50,-2.8 52,-2.9 -2,-0.6 2,-0.6 -0.935 8.2-166.2-110.7 121.5 9.1 33.4 17.0 67 68 A S E +ae 7 118A 16 -61,-3.2 -59,-2.0 -2,-0.6 2,-0.3 -0.913 20.3 152.4-109.1 119.4 5.6 34.2 18.4 68 69 A T E -ae 8 119A 1 50,-0.9 52,-2.0 -2,-0.6 -59,-0.1 -0.989 36.9-152.7-142.4 145.5 2.7 31.9 17.4 69 70 A D + 0 0 53 -61,-0.5 2,-0.5 -2,-0.3 53,-0.1 0.289 55.5 127.6 -94.5 9.1 -0.6 31.1 19.1 70 71 A S > - 0 0 3 1,-0.2 4,-2.2 -62,-0.1 5,-0.1 -0.539 41.8-169.0 -78.4 118.8 -0.9 27.7 17.4 71 72 A Q H > S+ 0 0 157 -2,-0.5 4,-3.2 2,-0.2 5,-0.3 0.927 91.1 56.5 -66.9 -38.2 -1.4 24.7 19.7 72 73 A Y H > S+ 0 0 45 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.902 112.1 39.5 -57.5 -52.0 -0.8 22.4 16.7 73 74 A V H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.921 115.5 53.7 -65.9 -43.1 2.6 23.9 15.9 74 75 A R H X S+ 0 0 93 -4,-2.2 4,-2.7 1,-0.2 5,-0.3 0.945 112.9 41.4 -58.4 -48.3 3.4 24.2 19.6 75 76 A Q H X>S+ 0 0 64 -4,-3.2 4,-2.3 2,-0.2 5,-1.6 0.884 113.2 53.4 -72.0 -35.8 2.7 20.5 20.3 76 77 A G H <>S+ 0 0 0 -4,-2.3 5,-3.0 -5,-0.3 4,-0.4 0.959 115.8 41.1 -57.4 -41.9 4.4 19.4 17.1 77 78 A I H <5S+ 0 0 26 -4,-2.6 5,-0.2 1,-0.2 -2,-0.2 0.915 125.3 31.8 -75.6 -45.8 7.6 21.3 18.0 78 79 A T H <5S+ 0 0 56 -4,-2.7 -1,-0.2 -5,-0.3 -3,-0.2 0.728 135.6 14.6 -89.9 -25.8 7.7 20.5 21.7 79 80 A Q T <5S+ 0 0 83 -4,-2.3 4,-0.3 -5,-0.3 -3,-0.2 0.736 124.7 31.2-113.7 -45.2 6.2 17.0 21.9 80 81 A W T > S+ 0 0 93 -6,-0.3 4,-1.5 -5,-0.2 -1,-0.2 0.908 115.0 41.0 -59.2 -38.2 11.6 14.4 17.8 83 84 A N H > S+ 0 0 70 -3,-0.5 4,-1.8 -4,-0.3 -2,-0.2 0.846 108.9 58.9 -81.4 -32.4 9.7 11.1 17.9 84 85 A W H <>S+ 0 0 40 -4,-2.4 5,-3.2 1,-0.2 6,-0.5 0.923 107.2 48.3 -55.2 -48.6 8.3 11.4 14.4 85 86 A K H ><5S+ 0 0 96 -4,-2.2 3,-1.7 1,-0.2 -1,-0.2 0.905 108.0 53.6 -61.2 -45.9 11.8 11.6 13.0 86 87 A K H 3<5S+ 0 0 136 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.872 111.0 49.0 -52.1 -38.3 13.0 8.6 15.0 87 88 A R T ><5S- 0 0 167 -4,-1.8 3,-0.6 3,-0.1 -1,-0.3 0.163 121.7-104.4 -92.0 16.5 10.0 6.6 13.5 88 89 A G T < 5S- 0 0 47 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.851 72.3 -64.4 63.7 34.1 10.7 7.7 9.8 89 90 A W T 3 - 0 0 61 4,-2.4 3,-2.0 -2,-0.3 6,-0.1 -0.205 46.9 -82.3 -84.7-177.3 2.7 6.8 13.2 92 93 A A T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.711 130.8 57.9 -61.2 -28.2 2.3 3.5 15.0 93 94 A D T 3 S- 0 0 100 2,-0.1 -1,-0.3 3,-0.0 -2,-0.0 0.250 118.2-113.9 -82.4 7.7 0.0 2.2 12.2 94 95 A K S < S+ 0 0 154 -3,-2.0 -2,-0.1 1,-0.2 3,-0.1 0.464 72.3 137.1 69.4 12.2 2.9 2.9 9.8 95 96 A K - 0 0 127 1,-0.1 -4,-2.4 -5,-0.0 -1,-0.2 -0.515 65.5 -96.1 -81.8 147.2 1.0 5.6 8.0 96 97 A P B -F 90 0B 83 0, 0.0 -6,-0.3 0, 0.0 -1,-0.1 -0.406 51.4 -93.2 -56.1 143.9 2.8 8.8 7.1 97 98 A V > - 0 0 5 -8,-2.3 3,-1.7 1,-0.1 4,-0.2 -0.215 49.3 -98.1 -57.6 133.0 2.3 11.5 9.7 98 99 A K T 3 S+ 0 0 156 1,-0.3 -1,-0.1 2,-0.1 5,-0.1 -0.476 111.0 9.9 -56.1 131.5 -0.6 13.8 8.7 99 100 A N T >> S+ 0 0 21 50,-0.2 4,-2.6 -2,-0.1 3,-0.5 0.778 81.4 154.1 65.1 27.3 0.8 17.0 7.0 100 101 A V H <> + 0 0 32 -3,-1.7 4,-2.7 1,-0.2 5,-0.3 0.870 67.0 61.8 -54.9 -36.5 4.3 15.3 6.9 101 102 A D H 3> S+ 0 0 56 1,-0.2 4,-1.7 -4,-0.2 -1,-0.2 0.925 110.0 38.6 -55.4 -43.6 5.0 17.5 3.9 102 103 A L H <> S+ 0 0 1 -3,-0.5 4,-2.9 1,-0.2 -2,-0.2 0.883 114.7 53.1 -77.0 -39.3 4.7 20.7 6.0 103 104 A W H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.863 111.6 45.4 -63.3 -43.4 6.3 19.2 9.1 104 105 A Q H X S+ 0 0 88 -4,-2.7 4,-2.1 -5,-0.2 -1,-0.2 0.896 111.5 53.4 -65.6 -36.8 9.4 18.2 7.0 105 106 A R H X S+ 0 0 97 -4,-1.7 4,-0.7 -5,-0.3 -2,-0.2 0.945 112.9 44.5 -62.4 -39.3 9.4 21.6 5.4 106 107 A L H >X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 3,-1.1 0.914 108.2 56.5 -67.0 -50.4 9.3 23.2 8.9 107 108 A D H 3X S+ 0 0 42 -4,-2.4 4,-1.3 1,-0.3 -1,-0.2 0.894 105.3 52.4 -50.4 -40.7 12.0 20.8 10.3 108 109 A A H 3< S+ 0 0 69 -4,-2.1 -1,-0.3 2,-0.2 4,-0.3 0.650 111.9 45.7 -71.8 -24.0 14.4 21.9 7.5 109 110 A A H X< S+ 0 0 9 -3,-1.1 3,-1.4 -4,-0.7 4,-0.2 0.896 106.8 58.4 -86.0 -33.4 13.9 25.6 8.4 110 111 A L H >< S+ 0 0 29 -4,-2.8 3,-1.3 1,-0.3 5,-0.2 0.782 99.5 57.7 -60.7 -41.2 14.2 25.1 12.1 111 112 A G T 3< S+ 0 0 62 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.1 0.755 97.8 62.4 -69.1 -18.1 17.7 23.6 11.9 112 113 A Q T < S+ 0 0 102 -3,-1.4 -50,-0.3 -4,-0.3 2,-0.3 0.487 105.1 44.2 -87.3 1.0 19.1 26.7 10.1 113 114 A H S < S- 0 0 28 -3,-1.3 2,-0.9 -4,-0.2 -50,-0.2 -0.921 78.6-114.3-143.1 159.8 18.4 29.2 13.0 114 115 A Q E -e 63 0A 119 -52,-2.4 -50,-2.8 -2,-0.3 2,-0.5 -0.855 48.7-166.1 -97.0 103.3 18.7 29.7 16.8 115 116 A I E -e 64 0A 37 -2,-0.9 2,-0.6 -5,-0.2 -50,-0.2 -0.821 24.8-168.9-106.1 129.4 15.0 29.9 17.6 116 117 A K E -e 65 0A 110 -52,-3.0 -50,-2.8 -2,-0.5 2,-0.5 -0.975 21.2-149.3-107.5 113.2 13.4 31.0 20.8 117 118 A W E -e 66 0A 51 -2,-0.6 2,-0.6 -52,-0.2 -50,-0.2 -0.806 11.1-168.3 -86.0 127.6 9.7 30.1 20.7 118 119 A E E -e 67 0A 75 -52,-2.9 -50,-0.9 -2,-0.5 2,-0.4 -0.921 13.7-152.4-114.4 95.3 7.3 32.4 22.5 119 120 A W E -e 68 0A 59 -2,-0.6 2,-0.4 -52,-0.2 -50,-0.2 -0.608 14.1-153.3 -72.0 123.6 4.0 30.5 22.6 120 121 A V - 0 0 5 -52,-2.0 2,-0.5 -2,-0.4 3,-0.1 -0.801 12.4-162.6-104.1 144.8 1.2 33.1 22.8 121 122 A K - 0 0 172 -2,-0.4 -51,-0.1 1,-0.2 -52,-0.0 -0.976 63.4 -2.4-125.0 106.2 -2.3 32.6 24.3 122 123 A G - 0 0 39 -2,-0.5 -1,-0.2 -53,-0.1 7,-0.1 0.285 68.7-107.9 96.2 143.6 -4.8 35.2 23.1 123 124 A H S > S+ 0 0 46 6,-0.1 3,-2.7 2,-0.1 7,-0.3 0.759 86.2 107.8 -75.3 -23.7 -4.7 38.2 20.9 124 125 A A T 3 S+ 0 0 89 1,-0.3 -3,-0.1 6,-0.0 0, 0.0 -0.320 93.9 7.5 -52.4 122.4 -5.0 40.5 23.9 125 126 A G T 3 S+ 0 0 75 -2,-0.1 -1,-0.3 1,-0.1 -2,-0.1 0.451 113.5 90.2 87.1 -2.2 -1.7 42.1 24.5 126 127 A H <> + 0 0 63 -3,-2.7 4,-2.1 1,-0.1 3,-0.4 -0.583 44.0 165.7-126.0 71.0 -0.3 40.7 21.3 127 128 A P H > S+ 0 0 85 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.836 74.5 55.6 -64.8 -30.3 -1.0 43.2 18.5 128 129 A E H > S+ 0 0 44 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.924 109.0 47.5 -67.8 -39.5 1.3 41.7 15.9 129 130 A N H > S+ 0 0 0 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.904 110.6 52.1 -68.4 -37.4 -0.4 38.3 16.2 130 131 A E H X S+ 0 0 89 -4,-2.1 4,-2.1 -7,-0.3 -1,-0.2 0.927 109.7 49.5 -60.9 -43.5 -3.8 40.0 15.9 131 132 A R H X S+ 0 0 83 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.884 107.4 54.2 -64.3 -36.7 -2.5 41.7 12.8 132 133 A C H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.887 106.6 52.9 -60.5 -40.6 -1.3 38.4 11.4 133 134 A D H X S+ 0 0 27 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.928 108.3 49.9 -62.6 -40.7 -4.8 37.0 12.0 134 135 A E H X S+ 0 0 103 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.897 111.2 48.8 -64.8 -38.0 -6.3 39.9 10.0 135 136 A L H X S+ 0 0 42 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.901 110.9 50.8 -66.4 -44.9 -3.9 39.3 7.1 136 137 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.929 111.9 45.9 -57.7 -50.0 -4.7 35.6 7.1 137 138 A R H X S+ 0 0 114 -4,-2.4 4,-0.7 1,-0.2 -2,-0.2 0.917 113.1 50.6 -67.2 -33.5 -8.4 36.2 6.9 138 139 A A H >X S+ 0 0 48 -4,-2.3 3,-0.8 -5,-0.2 4,-0.7 0.907 110.2 48.8 -67.7 -42.3 -8.0 38.8 4.2 139 140 A A H >< S+ 0 0 16 -4,-2.6 3,-1.1 1,-0.2 -102,-0.2 0.899 105.5 59.4 -64.6 -37.6 -5.8 36.5 2.0 140 141 A A H 3< S+ 0 0 2 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.727 95.7 63.3 -62.2 -23.2 -8.4 33.8 2.5 141 142 A M H << S+ 0 0 121 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.2 0.795 118.7 23.6 -75.2 -26.7 -11.0 36.0 0.9 142 143 A N S << S- 0 0 132 -3,-1.1 -105,-0.3 -4,-0.7 -1,-0.3 -0.552 84.2-175.6-134.9 66.9 -9.1 36.0 -2.4 143 144 A P + 0 0 39 0, 0.0 -105,-0.2 0, 0.0 -3,-0.1 -0.370 13.7 171.5 -71.5 140.3 -6.9 32.9 -2.5 144 145 A T + 0 0 122 -107,-1.9 2,-0.2 -2,-0.0 -106,-0.2 0.461 53.2 74.9-118.6 -12.1 -4.6 32.5 -5.5 145 146 A L B -d 38 0A 72 -108,-2.3 -106,-2.6 2,-0.0 2,-0.5 -0.677 69.8-129.2-107.4 160.1 -2.5 29.5 -4.5 146 147 A E - 0 0 136 -2,-0.2 2,-1.6 -108,-0.2 3,-0.2 -0.914 13.4-139.8-105.4 131.4 -3.1 25.8 -4.4 147 148 A D > - 0 0 13 -2,-0.5 3,-1.4 -107,-0.3 -109,-0.0 -0.648 28.6-178.9 -86.9 81.2 -2.2 23.9 -1.1 148 149 A T T 3 S+ 0 0 110 -2,-1.6 -1,-0.2 1,-0.3 -107,-0.0 0.828 71.3 53.3 -59.2 -34.0 -0.8 21.0 -3.0 149 150 A G T 3 S+ 0 0 23 -3,-0.2 2,-0.4 2,-0.0 -1,-0.3 0.597 80.2 114.0 -78.6 -11.2 0.2 18.8 -0.0 150 151 A Y < - 0 0 38 -3,-1.4 2,-0.5 -110,-0.2 -3,-0.0 -0.488 44.7-175.1 -64.5 122.3 -3.3 19.0 1.5 151 152 A Q 0 0 172 -2,-0.4 -52,-0.1 1,-0.1 -2,-0.0 -0.946 360.0 360.0-124.0 111.7 -5.0 15.5 1.4 152 153 A V 0 0 136 -2,-0.5 -1,-0.1 -136,-0.0 -2,-0.0 0.846 360.0 360.0 -51.6 360.0 -8.6 15.2 2.6