==== 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 HYDROLASE 05-NOV-04 1WSE . COMPND 2 MOLECULE: RIBONUCLEASE HI; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Y.TSUNAKA,K.TAKANO,H.MATSUMURA,Y.YAMAGATA,S.KANAYA . 310 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17613.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 229 73.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 9.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 2 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 . 27 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 28.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 3 0 0 0 2 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 2 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 . 2 0 0 0 0 0 0 2 0 2 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 2 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 0 192 0, 0.0 62,-0.0 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 139.4 35.2 24.3 -23.0 2 2 A L - 0 0 93 59,-0.0 2,-0.3 2,-0.0 61,-0.1 0.661 360.0 -39.4-116.5 -84.0 35.3 26.5 -19.9 3 3 A K - 0 0 73 1,-0.2 61,-3.8 2,-0.1 58,-0.1 -0.849 43.2-145.3-160.0 117.0 37.3 25.6 -16.9 4 4 A Q + 0 0 110 -2,-0.3 60,-0.5 59,-0.2 -1,-0.2 0.949 34.3 158.9 -46.9 -86.5 37.6 22.1 -15.4 5 5 A V - 0 0 6 60,-0.1 61,-0.8 58,-0.1 2,-0.4 0.621 30.7-135.4 62.0 136.5 37.9 22.5 -11.6 6 6 A E E -Ab 27 66A 69 21,-2.8 21,-3.4 59,-0.2 2,-0.4 -0.962 14.5-163.3-124.7 139.4 37.1 19.7 -9.1 7 7 A I E -Ab 26 67A 0 59,-2.5 61,-3.5 -2,-0.4 2,-0.4 -0.987 5.7-172.7-131.7 129.2 35.0 20.1 -5.9 8 8 A F E +Ab 25 68A 8 17,-2.2 17,-2.7 -2,-0.4 2,-0.3 -0.964 14.6 178.8-119.2 130.4 34.8 17.8 -2.9 9 9 A T E +Ab 24 69A 2 59,-2.1 61,-0.5 -2,-0.4 2,-0.3 -0.919 10.4 170.6-133.4 159.5 32.3 18.4 -0.1 10 10 A D E -A 23 0A 8 13,-2.0 13,-3.3 -2,-0.3 2,-0.3 -0.926 12.4-158.3-166.7 141.2 31.1 16.9 3.1 11 11 A G E -A 22 0A 5 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.849 11.8-179.4-119.7 157.4 28.9 17.8 6.1 12 12 A S E -A 21 0A 8 9,-2.4 9,-3.0 -2,-0.3 2,-0.3 -0.984 5.8-173.4-156.9 146.7 28.9 16.5 9.6 13 13 A C E -A 20 0A 23 -2,-0.3 7,-0.3 7,-0.3 31,-0.1 -0.998 23.3-147.3-145.4 141.8 26.9 17.1 12.8 14 14 A L S S+ 0 0 105 5,-3.1 2,-0.2 -2,-0.3 6,-0.1 0.541 84.6 1.4 -84.8 -8.7 27.2 15.8 16.4 15 15 A G S S- 0 0 33 4,-0.4 3,-0.5 3,-0.1 29,-0.4 -0.689 85.9 -81.1-151.5-153.9 23.5 15.8 16.9 16 16 A N S S+ 0 0 134 1,-1.3 27,-0.1 -2,-0.2 2,-0.1 -0.425 129.1 1.1-162.8 77.5 20.1 16.3 15.4 17 17 A P S S+ 0 0 31 0, 0.0 -1,-1.3 0, 0.0 26,-0.2 0.596 116.6 106.3 -86.3 169.0 20.1 19.2 15.8 18 18 A G E S- C 0 42A 9 24,-2.4 24,-2.6 -3,-0.5 -3,-0.1 -0.957 73.6 -33.6-178.0-176.9 23.5 20.0 17.4 19 19 A P E S+ 0 0 48 0, 0.0 -5,-3.1 0, 0.0 -4,-0.4 -0.318 70.1 162.1 -56.7 135.4 27.0 21.5 16.7 20 20 A G E -AC 13 39A 0 19,-2.4 19,-3.3 -7,-0.3 2,-0.3 -0.914 19.6-170.5-149.0 174.3 27.9 20.7 13.1 21 21 A G E -AC 12 38A 0 -9,-3.0 -9,-2.4 -2,-0.3 2,-0.3 -0.959 13.0-133.4-160.0 171.9 30.3 21.7 10.4 22 22 A Y E -AC 11 37A 19 15,-1.6 15,-1.0 -2,-0.3 2,-0.4 -0.949 8.3-157.0-135.1 155.6 31.2 21.3 6.7 23 23 A G E +AC 10 36A 0 -13,-3.3 -13,-2.0 -2,-0.3 2,-0.3 -0.985 16.0 171.1-132.6 142.5 34.3 20.7 4.7 24 24 A A E -AC 9 35A 0 11,-1.9 11,-3.2 -2,-0.4 2,-0.4 -0.982 15.7-159.8-155.9 141.8 35.0 21.5 1.1 25 25 A I E -AC 8 34A 2 -17,-2.7 -17,-2.2 -2,-0.3 2,-0.5 -0.981 3.4-161.4-126.1 133.3 37.9 21.5 -1.3 26 26 A L E -AC 7 33A 9 7,-3.5 7,-3.5 -2,-0.4 2,-0.4 -0.963 15.2-171.6-115.9 118.1 38.2 23.4 -4.5 27 27 A R E +AC 6 32A 53 -21,-3.4 -21,-2.8 -2,-0.5 2,-0.3 -0.931 14.3 166.2-119.2 134.4 40.8 22.2 -6.9 28 28 A Y E > S- C 0 31A 53 3,-2.3 3,-1.3 -2,-0.4 -2,-0.0 -0.911 73.2 -27.1-146.2 113.4 42.1 23.7 -10.2 29 29 A R T 3 S- 0 0 205 -2,-0.3 2,-1.2 1,-0.3 3,-0.1 0.927 126.0 -44.0 45.0 63.1 45.3 22.6 -11.9 30 30 A G T 3 S+ 0 0 69 1,-0.2 -1,-0.3 0, 0.0 0, 0.0 -0.150 116.7 117.1 81.3 -43.7 47.1 21.4 -8.8 31 31 A R E < -C 28 0A 143 -3,-1.3 -3,-2.3 -2,-1.2 2,-0.4 -0.233 48.1-166.5 -55.9 143.3 45.9 24.5 -6.9 32 32 A E E -C 27 0A 95 -5,-0.2 2,-0.4 -3,-0.1 -5,-0.2 -0.989 12.9-166.0-143.0 130.6 43.7 23.7 -4.0 33 33 A K E -C 26 0A 98 -7,-3.5 -7,-3.5 -2,-0.4 2,-0.4 -0.935 11.5-151.1-116.2 141.0 41.4 25.8 -1.9 34 34 A T E -C 25 0A 76 -2,-0.4 2,-0.4 -9,-0.2 -9,-0.2 -0.904 9.0-170.8-115.2 137.3 39.9 24.7 1.4 35 35 A F E +C 24 0A 48 -11,-3.2 -11,-1.9 -2,-0.4 2,-0.3 -0.971 16.2 153.1-125.3 140.5 36.6 25.8 3.0 36 36 A S E +C 23 0A 57 -2,-0.4 2,-0.3 -13,-0.2 -13,-0.2 -0.933 6.7 160.0-167.8 141.2 35.4 25.1 6.5 37 37 A A E -C 22 0A 21 -15,-1.0 -15,-1.6 -2,-0.3 2,-0.4 -0.968 21.7-142.5-161.4 149.6 33.1 26.5 9.2 38 38 A G E -C 21 0A 3 -2,-0.3 108,-1.9 105,-0.2 107,-1.6 -0.936 9.6-156.1-123.2 145.3 31.3 25.2 12.3 39 39 A Y E -Cd 20 146A 27 -19,-3.3 -19,-2.4 -2,-0.4 3,-0.3 -0.943 18.9-135.5-124.4 143.1 27.9 26.0 13.8 40 40 A T E S+ 0 0 60 106,-2.2 2,-0.3 -2,-0.4 107,-0.1 0.799 94.3 14.9 -61.7 -38.6 26.5 25.7 17.3 41 41 A R E S+ 0 0 127 105,-0.2 107,-0.4 -22,-0.1 -1,-0.2 -0.831 88.1 106.6-147.4 106.9 23.1 24.2 16.4 42 42 A T E -C 18 0A 0 -24,-2.6 -24,-2.4 -2,-0.3 2,-0.3 -0.744 54.5 -99.9-154.0-163.0 22.4 22.8 13.0 43 43 A T > - 0 0 9 -26,-0.2 4,-1.9 -2,-0.2 -31,-0.2 -0.893 26.5-113.7-132.7 163.4 21.8 19.4 11.2 44 44 A N H > S+ 0 0 65 -29,-0.4 4,-2.3 -2,-0.3 5,-0.2 0.949 115.2 55.3 -59.2 -50.4 23.9 17.1 9.0 45 45 A N H > S+ 0 0 57 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.865 107.9 46.7 -51.8 -45.0 21.7 17.7 6.0 46 46 A R H > S+ 0 0 2 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.923 111.4 52.6 -67.9 -39.2 22.1 21.5 6.2 47 47 A M H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.868 106.1 53.6 -62.6 -36.0 25.9 21.1 6.6 48 48 A A H X S+ 0 0 1 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.909 112.2 45.1 -64.4 -41.1 26.0 18.9 3.5 49 49 A L H X S+ 0 0 0 -4,-1.7 4,-2.4 -5,-0.2 -2,-0.2 0.935 110.1 54.1 -67.1 -46.6 24.2 21.6 1.5 50 50 A M H X S+ 0 0 15 -4,-2.9 4,-3.1 1,-0.2 5,-0.3 0.931 103.4 55.9 -52.6 -53.3 26.4 24.4 2.9 51 51 A A H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.917 111.2 44.1 -46.4 -51.9 29.6 22.6 1.8 52 52 A A H X S+ 0 0 0 -4,-1.4 4,-2.2 1,-0.2 -1,-0.2 0.898 114.0 50.9 -63.0 -40.8 28.4 22.4 -1.8 53 53 A I H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.909 109.1 49.1 -64.8 -43.0 27.2 26.0 -1.7 54 54 A V H X S+ 0 0 30 -4,-3.1 4,-0.6 2,-0.2 -1,-0.2 0.885 113.4 45.8 -64.7 -41.8 30.4 27.5 -0.3 55 55 A A H >< S+ 0 0 0 -4,-1.7 3,-0.6 -5,-0.3 -2,-0.2 0.941 116.3 45.5 -68.4 -47.8 32.6 25.8 -2.9 56 56 A L H >< S+ 0 0 1 -4,-2.2 3,-2.5 1,-0.2 -2,-0.2 0.944 109.3 52.8 -61.9 -49.9 30.4 26.7 -5.8 57 57 A E H 3< S+ 0 0 84 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.683 98.4 69.4 -61.6 -14.4 29.8 30.3 -4.8 58 58 A A T << S+ 0 0 23 -4,-0.6 2,-0.6 -3,-0.6 -1,-0.3 0.542 76.1 100.7 -80.3 -6.9 33.6 30.6 -4.7 59 59 A L < - 0 0 23 -3,-2.5 4,-0.1 -4,-0.2 -3,-0.0 -0.721 54.0-167.2 -85.4 119.1 33.8 30.2 -8.5 60 60 A K S S+ 0 0 178 -2,-0.6 2,-0.3 2,-0.1 -1,-0.1 0.252 71.2 28.7 -88.4 12.1 34.3 33.5 -10.3 61 61 A E S S- 0 0 117 -58,-0.1 2,-0.2 52,-0.0 -58,-0.0 -0.980 98.4 -75.1-163.2 161.3 33.5 32.1 -13.7 62 62 A H + 0 0 97 -2,-0.3 2,-0.2 52,-0.1 52,-0.2 -0.449 59.3 179.5 -63.5 128.7 31.5 29.4 -15.5 63 63 A C - 0 0 3 50,-0.2 52,-2.6 -2,-0.2 2,-0.4 -0.715 42.6-117.1-127.5 178.4 33.2 26.0 -15.0 64 64 A E - 0 0 49 -61,-3.8 52,-0.1 -60,-0.5 -2,-0.0 -0.608 49.7-166.7-113.1 64.3 33.0 22.3 -15.8 65 65 A V - 0 0 0 -2,-0.4 52,-1.3 -59,-0.1 2,-0.7 -0.204 22.3-157.9 -61.2 137.9 32.7 21.3 -12.1 66 66 A I E -be 6 117A 58 -61,-0.8 -59,-2.5 50,-0.2 2,-0.8 -0.902 17.5-162.1-115.7 96.4 33.1 17.7 -10.9 67 67 A L E -be 7 118A 0 50,-1.1 52,-2.4 -2,-0.7 2,-0.5 -0.748 6.6-170.4 -88.2 109.8 31.2 17.7 -7.6 68 68 A S E +be 8 119A 1 -61,-3.5 -59,-2.1 -2,-0.8 2,-0.3 -0.871 17.6 149.5-102.9 123.4 32.2 14.8 -5.5 69 69 A T E -be 9 120A 1 50,-1.8 52,-2.1 -2,-0.5 -59,-0.1 -0.997 41.2-154.7-152.5 148.2 30.2 14.0 -2.3 70 70 A D + 0 0 48 -61,-0.5 2,-0.5 -2,-0.3 54,-0.1 0.261 56.2 128.1-103.0 10.1 29.2 11.0 -0.2 71 71 A S > - 0 0 10 -62,-0.2 4,-1.6 1,-0.2 5,-0.1 -0.557 44.9-163.1 -72.1 117.6 26.1 12.8 1.2 72 72 A Q H > S+ 0 0 123 -2,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.749 88.8 59.1 -70.8 -22.7 23.1 10.6 0.8 73 73 A Y H > S+ 0 0 25 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.936 105.7 44.2 -72.0 -48.6 20.9 13.7 1.4 74 74 A V H > S+ 0 0 2 2,-0.2 4,-3.3 3,-0.2 5,-0.3 0.889 116.7 48.4 -63.4 -41.0 22.3 15.8 -1.5 75 75 A R H X S+ 0 0 118 -4,-1.6 4,-3.3 1,-0.2 5,-0.3 0.997 111.8 45.5 -62.5 -64.4 22.1 12.8 -3.9 76 76 A Q H < S+ 0 0 58 -4,-2.0 5,-0.3 1,-0.2 -1,-0.2 0.693 118.4 49.4 -53.6 -16.7 18.6 11.7 -3.0 77 77 A G H >X>S+ 0 0 0 -4,-0.8 5,-3.2 3,-0.2 4,-1.5 0.908 113.9 39.5 -88.5 -48.5 17.8 15.4 -3.3 78 78 A I H 3<5S+ 0 0 29 -4,-3.3 5,-0.3 1,-0.2 -2,-0.2 0.827 126.4 37.0 -69.8 -33.0 19.4 16.3 -6.6 79 79 A T T 3<5S+ 0 0 74 -4,-3.3 -1,-0.2 -5,-0.3 -3,-0.2 0.268 133.1 20.4-105.4 11.8 18.3 13.0 -8.2 80 80 A Q T <45S+ 0 0 97 -3,-0.6 -3,-0.2 -5,-0.3 -2,-0.2 0.513 129.8 22.7-146.6 -30.7 14.9 12.6 -6.7 81 81 A W T >X5S+ 0 0 71 -4,-1.5 4,-2.0 -5,-0.3 3,-1.1 0.830 99.7 70.7-110.6 -54.5 13.5 15.9 -5.3 82 82 A I H 3> S+ 0 0 154 -5,-0.3 4,-0.8 -6,-0.2 -1,-0.3 0.897 111.4 43.5 -52.2 -47.6 13.2 18.4 -10.3 84 84 A N H X> S+ 0 0 74 -3,-1.1 4,-1.9 1,-0.2 3,-0.8 0.908 107.2 59.9 -67.3 -42.8 9.7 18.2 -8.7 85 85 A W H 3X>S+ 0 0 29 -4,-2.0 5,-3.8 1,-0.3 4,-0.5 0.885 102.9 52.0 -52.5 -43.2 10.3 21.2 -6.4 86 86 A K H 3<5S+ 0 0 110 -4,-1.8 -1,-0.3 3,-0.2 3,-0.2 0.800 109.7 51.3 -65.1 -27.8 10.9 23.5 -9.4 87 87 A A H <<5S+ 0 0 86 -4,-0.8 -1,-0.2 -3,-0.8 -2,-0.2 0.819 115.4 39.0 -78.8 -33.2 7.7 22.3 -10.9 88 88 A R H <5S- 0 0 122 -4,-1.9 -1,-0.2 3,-0.1 -2,-0.2 0.304 118.6-105.1 -99.9 8.3 5.5 23.0 -7.8 89 89 A G T <5S- 0 0 44 -4,-0.5 -3,-0.2 -5,-0.2 -4,-0.1 0.896 74.6 -53.0 71.3 42.7 7.3 26.2 -6.9 90 90 A W S - 0 0 41 4,-4.1 3,-2.1 -2,-0.3 4,-0.2 -0.176 46.7 -92.8 -68.7 171.2 5.5 19.8 -1.0 93 93 A A T 3 S+ 0 0 70 1,-0.3 -1,-0.1 2,-0.2 0, 0.0 0.673 130.0 59.8 -60.0 -13.6 2.7 17.9 -2.7 94 94 A D T 3 S- 0 0 109 2,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.061 123.3-103.8-102.4 23.1 0.5 19.4 0.0 95 95 A K S < S+ 0 0 184 -3,-2.1 -2,-0.2 1,-0.2 0, 0.0 0.819 80.5 139.6 59.4 29.6 1.3 23.0 -0.9 96 96 A K - 0 0 114 -4,-0.2 -4,-4.1 1,-0.1 -1,-0.2 -0.883 61.5 -99.6-109.9 137.3 3.6 23.1 2.1 97 97 A P B -F 91 0B 92 0, 0.0 -6,-0.2 0, 0.0 2,-0.1 -0.170 41.9-117.5 -51.4 139.5 7.0 24.8 2.2 98 98 A V > - 0 0 11 -8,-0.8 3,-1.1 1,-0.1 2,-0.3 -0.455 31.7 -98.9 -79.8 154.8 9.9 22.4 1.7 99 99 A K T 3 S+ 0 0 122 1,-0.2 -1,-0.1 -2,-0.1 5,-0.1 -0.548 103.5 7.9 -77.5 136.3 12.5 21.9 4.4 100 100 A N T >> S+ 0 0 19 -2,-0.3 4,-2.4 50,-0.1 3,-0.9 0.744 78.4 154.7 67.8 25.2 15.8 23.8 4.1 101 101 A V H <> + 0 0 44 -3,-1.1 4,-2.5 1,-0.3 5,-0.4 0.836 64.9 63.5 -52.6 -34.8 14.4 25.7 1.2 102 102 A D H 3> S+ 0 0 64 1,-0.2 4,-1.2 48,-0.2 -1,-0.3 0.909 111.8 33.9 -58.4 -44.5 16.8 28.5 2.0 103 103 A L H <> S+ 0 0 5 -3,-0.9 4,-2.6 2,-0.2 -2,-0.2 0.822 115.4 56.3 -82.7 -31.4 19.9 26.3 1.3 104 104 A W H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.910 111.5 43.1 -66.2 -40.5 18.3 24.2 -1.5 105 105 A Q H X S+ 0 0 80 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.903 114.0 51.2 -70.5 -40.9 17.4 27.3 -3.5 106 106 A R H X S+ 0 0 113 -4,-1.2 4,-1.8 -5,-0.4 -2,-0.2 0.914 112.1 48.2 -60.9 -42.0 20.8 28.8 -2.8 107 107 A L H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.922 111.6 48.2 -64.6 -45.0 22.4 25.6 -4.0 108 108 A D H X S+ 0 0 37 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.803 108.5 54.3 -67.6 -30.4 20.3 25.4 -7.2 109 109 A A H < S+ 0 0 70 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.929 111.3 44.7 -69.6 -42.6 21.1 29.0 -8.1 110 110 A A H >< S+ 0 0 11 -4,-1.8 3,-0.7 -5,-0.2 -2,-0.2 0.820 109.7 59.3 -69.1 -30.2 24.8 28.4 -7.8 111 111 A L H >< S+ 0 0 18 -4,-1.8 3,-2.2 1,-0.2 5,-0.2 0.939 97.9 53.6 -65.1 -51.5 24.4 25.2 -9.8 112 112 A G T 3< S+ 0 0 70 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.566 94.7 75.9 -62.6 -4.7 22.9 26.6 -13.0 113 113 A Q T < S+ 0 0 105 -3,-0.7 -1,-0.3 -4,-0.3 2,-0.3 0.490 106.4 21.9 -83.6 -4.3 25.9 28.9 -13.0 114 114 A H S < S- 0 0 14 -3,-2.2 2,-0.9 -52,-0.2 -50,-0.2 -0.880 89.5 -92.9-149.6 177.0 28.1 26.0 -14.2 115 115 A Q - 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0 0 12 -62,-0.2 4,-2.0 1,-0.2 5,-0.2 -0.477 50.1-162.5 -66.8 120.7 19.8 61.3 61.7 228 72 B Q H > S+ 0 0 136 -2,-0.4 4,-3.2 2,-0.2 5,-0.2 0.815 90.6 60.0 -73.5 -28.4 21.5 58.1 60.8 229 73 B Y H > S+ 0 0 41 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.926 108.4 43.5 -63.4 -44.2 18.4 56.1 61.7 230 74 B V H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.922 116.8 45.5 -67.2 -46.2 16.4 58.0 59.0 231 75 B R H X S+ 0 0 89 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.931 113.1 52.1 -62.5 -44.0 19.2 57.7 56.4 232 76 B Q H < S+ 0 0 73 -4,-3.2 5,-0.5 1,-0.2 -2,-0.2 0.896 111.7 45.2 -59.1 -44.7 19.6 54.0 57.3 233 77 B G H >X>S+ 0 0 1 -4,-2.3 5,-2.9 -5,-0.2 4,-1.4 0.911 117.0 43.5 -68.4 -42.4 16.0 53.2 56.9 234 78 B I H 3<5S+ 0 0 23 -4,-2.3 5,-0.4 1,-0.2 -2,-0.2 0.971 117.2 43.3 -67.0 -56.0 15.5 55.1 53.6 235 79 B T T 3<5S+ 0 0 75 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.356 129.4 25.4 -75.0 9.0 18.7 54.0 51.9 236 80 B Q T <45S+ 0 0 89 -3,-0.6 4,-0.3 -4,-0.2 -3,-0.2 0.651 129.9 4.7-135.3 -53.0 18.2 50.4 53.1 237 81 B W T X5S+ 0 0 106 -4,-1.4 4,-2.5 -5,-0.5 5,-0.2 0.647 89.7 95.6-118.2 -18.9 14.8 49.0 53.9 238 82 B I H > S+ 0 0 142 -5,-0.4 4,-1.6 1,-0.2 3,-0.3 0.974 112.2 44.9 -59.8 -60.9 11.6 49.9 49.7 240 84 B N H > S+ 0 0 68 -4,-0.3 4,-1.2 1,-0.2 -1,-0.2 0.766 109.0 60.0 -57.1 -28.2 11.4 46.2 50.8 241 85 B W H ><>S+ 0 0 38 -4,-2.5 5,-3.1 2,-0.2 3,-0.7 0.968 104.4 46.5 -64.9 -52.2 9.1 47.2 53.7 242 86 B K H ><5S+ 0 0 122 -4,-1.7 3,-0.7 -3,-0.3 -2,-0.2 0.828 115.3 48.8 -59.2 -32.5 6.4 48.6 51.4 243 87 B A H 3<5S+ 0 0 81 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.702 110.3 50.7 -81.9 -19.7 6.7 45.5 49.2 244 88 B R T X<5S- 0 0 130 -4,-1.2 3,-1.1 -3,-0.7 -1,-0.2 0.053 120.2-102.1-105.7 25.5 6.5 43.2 52.2 245 89 B G T < 5 - 0 0 45 -3,-0.7 -3,-0.2 1,-0.2 -2,-0.1 0.836 67.8 -70.5 60.1 33.6 3.4 44.7 53.7 246 90 B W T 3 - 0 0 49 4,-2.7 3,-1.5 -2,-0.3 -1,-0.1 -0.162 46.0 -84.5 -84.3-173.7 9.4 41.6 59.1 249 93 B A T 3 S+ 0 0 83 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.790 131.9 49.8 -64.2 -28.7 10.7 38.2 57.8 250 94 B D T 3 S- 0 0 100 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 -0.011 123.8-102.6-101.1 29.3 8.6 36.4 60.4 251 95 B K S < S+ 0 0 150 -3,-1.5 -2,-0.1 1,-0.2 3,-0.0 0.751 77.8 134.6 59.7 31.0 5.4 38.4 59.5 252 96 B K - 0 0 123 1,-0.1 -4,-2.7 0, 0.0 -1,-0.2 -0.834 65.5 -89.0-111.0 149.5 5.6 40.8 62.5 253 97 B P B -L 247 0D 99 0, 0.0 -6,-0.2 0, 0.0 3,-0.1 -0.268 45.6-118.6 -54.4 130.1 5.0 44.6 62.4 254 98 B V > - 0 0 9 -8,-1.6 3,-1.5 1,-0.1 4,-0.2 -0.429 42.4 -84.6 -70.6 148.5 8.3 46.5 61.8 255 99 B K T 3 S+ 0 0 147 1,-0.3 -1,-0.1 2,-0.1 5,-0.1 -0.216 113.1 3.4 -53.0 139.7 9.4 48.8 64.6 256 100 B N T >> S+ 0 0 24 50,-0.1 4,-2.3 1,-0.1 3,-0.6 0.821 80.1 158.5 50.9 34.4 7.8 52.3 64.3 257 101 B V H <> + 0 0 34 -3,-1.5 4,-2.7 1,-0.2 5,-0.3 0.862 67.1 63.4 -54.5 -35.3 5.7 51.0 61.3 258 102 B D H 3> S+ 0 0 59 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.913 109.2 36.3 -57.7 -46.9 3.3 53.8 62.1 259 103 B L H <> S+ 0 0 6 -3,-0.6 4,-2.5 2,-0.2 -1,-0.2 0.859 116.2 53.0 -78.0 -34.3 5.8 56.6 61.4 260 104 B W H X S+ 0 0 1 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.916 110.3 47.3 -66.9 -42.2 7.6 54.8 58.5 261 105 B Q H X S+ 0 0 82 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.893 113.5 49.7 -64.2 -39.1 4.4 54.2 56.6 262 106 B R H X S+ 0 0 104 -4,-1.3 4,-1.7 -5,-0.3 -2,-0.2 0.910 111.6 48.0 -66.5 -41.1 3.4 57.8 57.2 263 107 B L H X S+ 0 0 0 -4,-2.5 4,-3.3 1,-0.2 -2,-0.2 0.933 110.3 51.7 -64.9 -46.3 6.8 59.1 56.0 264 108 B D H X S+ 0 0 31 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.888 108.9 50.8 -57.1 -41.1 6.6 56.9 52.9 265 109 B A H < S+ 0 0 63 -4,-2.0 4,-0.3 2,-0.2 -1,-0.2 0.863 113.1 45.3 -66.0 -37.6 3.2 58.2 52.0 266 110 B A H >< S+ 0 0 7 -4,-1.7 3,-1.4 2,-0.2 4,-0.2 0.922 111.8 52.7 -72.0 -43.0 4.4 61.8 52.4 267 111 B L H >< S+ 0 0 21 -4,-3.3 3,-2.4 1,-0.3 -2,-0.2 0.919 100.2 60.8 -57.1 -47.5 7.6 61.1 50.4 268 112 B G T 3< S+ 0 0 69 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.634 92.3 70.6 -57.4 -13.7 5.6 59.6 47.5 269 113 B Q T < S+ 0 0 102 -3,-1.4 -1,-0.3 -4,-0.3 2,-0.2 0.617 105.9 27.4 -78.4 -13.1 3.9 63.0 47.1 270 114 B H S < S- 0 0 21 -3,-2.4 2,-1.0 -4,-0.2 -50,-0.2 -0.834 87.5 -89.8-142.7 176.7 7.1 64.7 45.8 271 115 B Q E -k 220 0C 126 -52,-3.3 -50,-3.1 -2,-0.2 2,-0.3 -0.825 51.4-156.5 -91.6 103.2 10.4 64.4 44.0 272 116 B I E +k 221 0C 43 -2,-1.0 2,-0.4 -52,-0.2 -50,-0.2 -0.648 21.8 177.6 -90.1 138.3 12.8 63.7 46.8 273 117 B K E -k 222 0C 115 -52,-2.5 -50,-1.7 -2,-0.3 2,-0.2 -0.909 21.1-148.7-137.8 103.6 16.5 64.4 46.8 274 118 B W E -k 223 0C 53 -2,-0.4 2,-0.3 -52,-0.2 -50,-0.2 -0.498 15.0-174.8 -78.0 142.9 18.2 63.4 50.0 275 119 B E E -k 224 0C 64 -52,-2.8 -50,-0.5 -2,-0.2 2,-0.3 -0.804 15.0-152.1-139.7 91.4 21.3 65.3 51.3 276 120 B W E -k 225 0C 43 -2,-0.3 -50,-0.2 -52,-0.2 -52,-0.1 -0.529 49.4 -81.2 -67.3 123.7 22.7 63.7 54.4 277 121 B V S S+ 0 0 43 -52,-2.1 -1,-0.2 -2,-0.3 4,-0.1 0.065 86.3 130.0 -30.3 88.8 24.4 66.4 56.5 278 122 B K + 0 0 141 2,-0.1 -1,-0.2 -3,-0.1 3,-0.1 0.396 67.5 60.0-122.4 -14.4 27.7 66.5 54.5 279 123 B G S > S- 0 0 38 1,-0.3 3,-1.9 -4,-0.1 -2,-0.1 0.517 91.4-167.9 -90.4 -9.0 27.6 70.3 54.1 280 124 B H G > - 0 0 127 1,-0.3 3,-1.2 2,-0.2 -1,-0.3 -0.245 64.9 -9.8 58.7-139.9 27.6 70.5 57.9 281 125 B A G 3 S+ 0 0 60 1,-0.3 -1,-0.3 -3,-0.1 4,-0.0 0.407 107.7 103.8 -69.5 3.6 26.9 73.9 59.3 282 126 B G G < S+ 0 0 58 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.641 86.0 48.4 -59.8 -10.2 27.2 75.1 55.7 283 127 B H S X> S- 0 0 52 -3,-1.2 3,-2.1 1,-0.1 4,-0.7 -0.843 76.5-166.2-131.2 88.6 23.5 75.1 56.2 284 128 B P H 3> S+ 0 0 72 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.648 82.2 78.6 -51.5 -12.8 22.8 77.0 59.6 285 129 B E H 3> S+ 0 0 13 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.849 86.2 54.0 -66.7 -37.1 19.3 75.4 59.2 286 130 B N H <> S+ 0 0 13 -3,-2.1 4,-1.6 -6,-0.2 -1,-0.2 0.918 113.8 41.9 -64.0 -43.8 20.4 72.0 60.4 287 131 B E H X S+ 0 0 118 -4,-0.7 4,-1.9 2,-0.2 -2,-0.2 0.914 113.5 53.1 -68.4 -41.6 21.8 73.5 63.6 288 132 B R H X S+ 0 0 75 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.851 107.5 52.5 -61.3 -35.2 18.8 75.8 63.9 289 133 B C H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.883 104.1 56.0 -68.3 -36.9 16.6 72.7 63.6 290 134 B D H X S+ 0 0 38 -4,-1.6 4,-2.3 1,-0.2 -2,-0.2 0.913 106.8 50.9 -60.4 -41.8 18.6 71.1 66.4 291 135 B E H X S+ 0 0 112 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.946 110.3 47.6 -60.2 -51.1 17.7 74.2 68.5 292 136 B L H X S+ 0 0 44 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.879 112.2 50.7 -58.7 -40.4 14.0 73.9 67.8 293 137 B A H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.898 113.3 44.3 -66.4 -41.9 14.0 70.2 68.5 294 138 B R H X S+ 0 0 144 -4,-2.3 4,-0.8 2,-0.2 -2,-0.2 0.814 110.9 53.9 -74.1 -30.6 15.8 70.6 71.9 295 139 B A H >X S+ 0 0 62 -4,-2.4 3,-0.6 2,-0.2 4,-0.5 0.926 109.4 48.0 -69.6 -41.6 13.6 73.5 72.9 296 140 B A H >< S+ 0 0 13 -4,-1.9 3,-1.0 1,-0.2 -1,-0.2 0.868 107.7 55.6 -64.5 -36.7 10.4 71.5 72.3 297 141 B A H 3< S+ 0 0 3 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.735 105.3 53.6 -68.5 -20.8 11.8 68.6 74.3 298 142 B M H << S+ 0 0 154 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.576 118.9 35.2 -85.8 -14.4 12.3 71.1 77.1 299 143 B N S << S- 0 0 117 -3,-1.0 -105,-0.3 -4,-0.5 -1,-0.2 -0.336 80.2-179.5-136.1 53.8 8.6 72.0 76.9 300 144 B P + 0 0 41 0, 0.0 -105,-0.2 0, 0.0 -3,-0.1 -0.378 11.6 164.0 -60.0 123.2 6.8 68.7 75.9 301 145 B T + 0 0 103 -107,-1.5 2,-0.3 -2,-0.2 -106,-0.2 0.392 55.6 55.8-120.2 -4.8 3.0 69.4 75.5 302 146 B L B S-j 195 0C 90 -108,-1.8 -106,-2.3 2,-0.0 2,-0.4 -0.815 72.7-123.0-127.2 169.9 1.9 66.3 73.7 303 147 B E - 0 0 131 -2,-0.3 2,-1.6 -108,-0.2 3,-0.1 -0.902 17.6-131.3-114.3 140.5 2.1 62.6 74.0 304 148 B D > + 0 0 12 -2,-0.4 3,-2.7 -107,-0.3 -109,-0.0 -0.598 30.4 178.5 -89.5 74.9 3.6 60.2 71.4 305 149 B T T 3 S+ 0 0 127 -2,-1.6 -1,-0.2 1,-0.3 4,-0.1 0.592 75.2 58.5 -53.8 -13.9 0.6 57.9 71.4 306 150 B G T 3 S+ 0 0 20 -3,-0.1 2,-0.8 2,-0.1 -1,-0.3 0.562 72.8 110.1 -95.6 -11.2 2.4 55.8 68.8 307 151 B Y S < S- 0 0 17 -3,-2.7 2,-1.5 -110,-0.2 -3,-0.0 -0.558 74.0-132.4 -68.8 106.7 5.4 55.0 70.8 308 152 B Q - 0 0 166 -2,-0.8 -1,-0.1 1,-0.1 -2,-0.1 -0.444 32.9-134.3 -62.3 90.9 5.0 51.2 71.6 309 153 B V - 0 0 104 -2,-1.5 2,-0.2 -4,-0.1 -1,-0.1 -0.119 27.6-176.0 -54.9 142.6 5.7 51.6 75.3 310 154 B E 0 0 106 -3,-0.0 -1,-0.0 0, 0.0 -3,-0.0 -0.732 360.0 360.0-128.5 176.6 8.0 49.1 77.0 311 155 B V 0 0 194 -2,-0.2 0, 0.0 0, 0.0 0, 0.0 0.150 360.0 360.0 66.8 360.0 9.1 48.7 80.7