==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-NOV-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/RNA/DNA 10-NOV-11 3ULD . COMPND 2 MOLECULE: RIBONUCLEASE H; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS HALODURANS; . AUTHOR J.H.GAN,R.ABDUR,Z.HUANG . 133 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7544.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 85 63.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 15.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.5 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 . 0 0.0 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 . 1 0.8 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 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 39 29.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.3 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 1 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 1 0 0 1 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 61 A E 0 0 192 0, 0.0 2,-0.3 0, 0.0 121,-0.0 0.000 360.0 360.0 360.0 -72.7 -6.0 0.5 17.9 2 62 A E - 0 0 124 1,-0.0 2,-0.2 124,-0.0 124,-0.0 -0.880 360.0 -93.7-129.1 158.7 -5.3 -2.6 15.7 3 63 A I - 0 0 25 -2,-0.3 2,-1.1 1,-0.1 3,-0.1 -0.372 24.1-140.6 -66.9 126.3 -2.6 -4.4 13.8 4 64 A I - 0 0 77 1,-0.2 24,-0.1 -2,-0.2 -1,-0.1 -0.798 21.0-171.2 -81.9 99.0 -2.2 -3.6 10.1 5 65 A W S S+ 0 0 115 -2,-1.1 2,-1.7 1,-0.2 24,-0.7 0.785 71.9 74.5 -67.4 -29.1 -1.5 -7.2 9.1 6 66 A E S S+ 0 0 125 22,-0.1 2,-0.3 -3,-0.1 -1,-0.2 -0.630 86.1 95.9 -85.2 79.1 -0.6 -6.2 5.5 7 67 A S S S- 0 0 1 -2,-1.7 21,-2.2 60,-0.2 2,-0.5 -0.956 74.5-109.7-160.3 166.3 2.8 -4.8 6.6 8 68 A L E -Ab 27 69A 2 60,-2.5 62,-2.8 -2,-0.3 2,-0.5 -0.955 28.2-155.9-109.5 129.8 6.5 -5.4 7.0 9 69 A S E -Ab 26 70A 0 17,-2.9 17,-2.8 -2,-0.5 2,-0.3 -0.912 9.5-168.5-107.2 132.4 7.9 -5.7 10.6 10 70 A V E +A 25 0A 0 60,-2.5 62,-0.5 -2,-0.5 2,-0.3 -0.897 9.6 169.1-117.0 146.1 11.6 -4.9 11.3 11 71 A D E -A 24 0A 4 13,-1.9 13,-2.1 -2,-0.3 2,-0.3 -0.988 23.3-131.7-152.5 158.6 13.6 -5.6 14.4 12 72 A V E -A 23 0A 16 -2,-0.3 121,-0.4 11,-0.2 2,-0.3 -0.797 13.3-167.3-106.9 148.2 17.2 -5.5 15.6 13 73 A G E +A 22 0A 10 9,-2.1 9,-2.5 -2,-0.3 2,-0.3 -0.975 13.9 177.5-128.5 147.7 19.1 -8.2 17.6 14 74 A S E -A 21 0A 61 -2,-0.3 2,-0.4 7,-0.2 7,-0.2 -0.942 33.6-141.9-141.3 166.4 22.5 -7.6 19.3 15 75 A Q E >S-A 20 0A 148 5,-1.9 5,-1.9 -2,-0.3 2,-0.0 -0.938 89.9 -7.7-124.6 106.5 25.2 -9.2 21.4 16 76 A G E 5S-A 19 0A 49 -2,-0.4 3,-0.4 3,-0.2 -1,-0.3 -0.012 86.6 -96.9 83.1 159.5 26.3 -6.4 23.6 17 77 A N T 5S+ 0 0 85 1,-0.8 2,-0.2 -3,-0.1 27,-0.1 -0.704 126.8 26.1-154.6 98.8 25.2 -2.7 23.3 18 78 A P T 5S+ 0 0 80 0, 0.0 -1,-0.8 0, 0.0 2,-0.3 0.454 120.9 93.6 -65.1 144.2 27.3 -1.4 21.7 19 79 A G E 5S-AC 16 43A 12 24,-2.2 24,-1.9 -3,-0.4 2,-0.3 -0.883 79.9 -17.0-171.7-154.3 28.1 -4.8 20.3 20 80 A I E < -A 15 0A 64 -5,-1.9 -5,-1.9 -2,-0.3 2,-0.4 -0.550 66.1-165.2 -73.8 126.8 27.4 -7.1 17.4 21 81 A V E +AC 14 40A 0 19,-2.5 19,-3.3 -2,-0.3 2,-0.3 -0.937 18.2 158.9-122.0 136.8 24.3 -5.9 15.6 22 82 A E E -A 13 0A 53 -9,-2.5 -9,-2.1 -2,-0.4 2,-0.3 -0.909 13.2-166.0-140.8 171.5 22.0 -7.5 13.0 23 83 A Y E -AC 12 37A 17 14,-0.5 14,-2.4 -2,-0.3 2,-0.3 -0.976 2.4-165.2-151.1 169.3 18.4 -6.9 11.8 24 84 A K E -AC 11 36A 21 -13,-2.1 -13,-1.9 -2,-0.3 2,-0.4 -0.979 13.1-140.3-151.4 161.4 15.7 -8.6 9.8 25 85 A G E -AC 10 35A 0 10,-2.3 9,-2.9 -2,-0.3 10,-1.5 -0.980 23.2-176.4-125.5 138.5 12.4 -7.8 8.1 26 86 A V E -AC 9 33A 2 -17,-2.8 -17,-2.9 -2,-0.4 2,-0.4 -0.957 36.3-102.8-133.6 151.4 9.4 -10.1 8.2 27 87 A D E > -A 8 0A 23 5,-2.3 4,-2.3 -2,-0.3 -19,-0.2 -0.642 31.0-144.7 -68.4 123.9 5.9 -10.3 6.8 28 88 A T T 4 S+ 0 0 0 -21,-2.2 -1,-0.2 -2,-0.4 -22,-0.1 0.886 96.1 47.1 -61.9 -36.4 3.7 -9.3 9.8 29 89 A K T 4 S+ 0 0 125 -24,-0.7 -1,-0.2 -22,-0.4 -23,-0.1 0.962 126.7 21.4 -67.4 -55.1 1.0 -11.7 8.6 30 90 A T T 4 S- 0 0 89 2,-0.1 -2,-0.2 1,-0.0 -1,-0.2 0.517 89.6-130.1 -99.2 -11.9 3.1 -14.9 7.9 31 91 A G < + 0 0 32 -4,-2.3 -3,-0.1 1,-0.2 2,-0.1 0.446 52.9 155.2 70.4 0.6 6.2 -14.4 9.9 32 92 A E - 0 0 120 -5,-0.1 -5,-2.3 1,-0.1 2,-0.5 -0.379 49.0-118.8 -62.2 135.0 8.2 -15.2 6.8 33 93 A V E +C 26 0A 69 -7,-0.2 -7,-0.3 1,-0.2 3,-0.1 -0.648 33.0 178.3 -77.6 120.0 11.7 -13.7 6.9 34 94 A L E - 0 0 44 -9,-2.9 2,-0.3 -2,-0.5 -8,-0.2 0.711 66.5 -2.5 -96.4 -28.9 12.0 -11.3 3.9 35 95 A F E -C 25 0A 21 -10,-1.5 -10,-2.3 2,-0.0 -1,-0.4 -0.964 56.7-168.6-159.8 153.2 15.5 -10.0 4.5 36 96 A E E -C 24 0A 106 -2,-0.3 2,-0.4 -12,-0.2 -12,-0.2 -0.959 19.0-135.5-149.4 125.1 18.3 -10.5 7.1 37 97 A R E -C 23 0A 67 -14,-2.4 -14,-0.5 -2,-0.3 3,-0.1 -0.702 26.3-111.5 -86.3 131.7 21.5 -8.4 7.5 38 98 A E E - 0 0 143 -2,-0.4 -17,-0.1 1,-0.1 -1,-0.1 -0.293 53.5 -85.9 -49.3 135.7 24.8 -10.0 8.1 39 99 A P E - 0 0 66 0, 0.0 -17,-0.2 0, 0.0 -1,-0.1 -0.206 36.9-141.6 -54.6 136.9 26.0 -9.2 11.6 40 100 A I E -C 21 0A 0 -19,-3.3 -19,-2.5 1,-0.1 3,-0.1 -0.900 15.2-133.1-100.3 127.4 27.9 -5.9 11.9 41 101 A P E S+ 0 0 85 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.845 85.1 15.3 -61.3 -40.7 30.8 -6.3 14.4 42 102 A I E S+ 0 0 52 52,-0.2 56,-0.4 -22,-0.1 2,-0.3 -0.981 80.8 117.9-134.1 129.5 30.2 -3.1 16.5 43 103 A G E -C 19 0A 0 -24,-1.9 -24,-2.2 -2,-0.4 2,-0.3 -0.950 52.0-100.1-164.3 177.2 27.1 -0.9 16.5 44 104 A T > - 0 0 13 -2,-0.3 4,-2.4 -26,-0.2 5,-0.2 -0.791 30.7-114.4-106.1 161.2 24.3 0.3 18.8 45 105 A N H > S+ 0 0 55 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.917 117.3 49.0 -52.0 -46.4 20.8 -1.0 19.1 46 106 A N H > S+ 0 0 45 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.876 108.6 51.6 -71.7 -34.3 19.4 2.3 17.8 47 107 A M H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.932 111.5 48.7 -63.3 -43.6 21.7 2.4 14.8 48 108 A G H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.921 110.4 50.8 -60.8 -44.6 20.6 -1.2 13.9 49 109 A E H X S+ 0 0 14 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.866 111.6 48.8 -59.3 -39.9 16.9 -0.2 14.3 50 110 A F H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.932 111.2 47.6 -66.1 -48.4 17.5 2.8 11.9 51 111 A L H X S+ 0 0 10 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.887 109.3 55.7 -63.0 -36.3 19.3 0.7 9.3 52 112 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.895 109.3 45.5 -64.3 -40.0 16.5 -1.9 9.5 53 113 A I H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.956 114.4 47.4 -66.3 -50.1 13.8 0.7 8.7 54 114 A V H X S+ 0 0 3 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.908 111.6 51.0 -60.0 -41.6 15.8 2.3 5.9 55 115 A H H X S+ 0 0 70 -4,-2.7 4,-2.7 -5,-0.2 -1,-0.2 0.910 109.1 51.8 -59.8 -43.5 16.5 -1.2 4.4 56 116 A G H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.3 0.902 108.2 51.3 -57.0 -43.5 12.7 -1.9 4.6 57 117 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.938 112.7 46.0 -57.3 -47.3 11.9 1.3 2.7 58 118 A R H X S+ 0 0 111 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.918 112.7 50.6 -62.3 -43.3 14.4 0.3 0.0 59 119 A Y H X S+ 0 0 38 -4,-2.7 4,-1.1 1,-0.2 -2,-0.2 0.905 114.5 42.3 -64.5 -44.6 13.1 -3.2 -0.1 60 120 A L H <>S+ 0 0 6 -4,-2.6 5,-2.6 2,-0.2 3,-0.3 0.903 112.3 53.6 -70.9 -41.2 9.4 -2.1 -0.5 61 121 A K H ><5S+ 0 0 79 -4,-2.6 3,-1.6 -5,-0.3 -2,-0.2 0.930 107.5 51.7 -58.6 -44.9 10.2 0.7 -3.0 62 122 A E H 3<5S+ 0 0 154 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.802 113.5 44.7 -61.7 -31.3 12.1 -1.8 -5.2 63 123 A R T 3<5S- 0 0 144 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.293 110.7-119.7 -96.1 8.3 9.0 -4.2 -5.2 64 124 A N T < 5 + 0 0 154 -3,-1.6 2,-0.4 -4,-0.2 -3,-0.2 0.871 59.7 156.7 50.2 41.5 6.5 -1.4 -5.8 65 125 A S < - 0 0 30 -5,-2.6 -1,-0.2 -6,-0.1 51,-0.1 -0.817 37.4-165.4 -97.7 137.7 4.8 -2.3 -2.4 66 126 A R + 0 0 187 -2,-0.4 -1,-0.1 49,-0.1 -5,-0.1 0.319 45.1 133.6-100.9 7.0 2.7 0.3 -0.5 67 127 A K - 0 0 63 49,-0.1 -60,-0.2 1,-0.1 2,-0.1 -0.191 57.5-117.9 -55.3 140.6 2.8 -1.8 2.7 68 128 A P - 0 0 15 0, 0.0 -60,-2.5 0, 0.0 2,-0.4 -0.385 22.1-126.1 -70.8 165.9 3.6 0.1 6.0 69 129 A I E -bd 8 118A 0 48,-2.5 50,-3.4 -62,-0.2 2,-0.5 -0.955 16.3-151.3-112.4 131.7 6.6 -0.7 8.0 70 130 A Y E +bd 9 119A 7 -62,-2.8 -60,-2.5 -2,-0.4 2,-0.3 -0.910 19.7 169.7 -98.7 134.2 6.3 -1.5 11.8 71 131 A S E - d 0 120A 0 48,-2.1 50,-2.4 -2,-0.5 -60,-0.1 -0.984 31.0-149.9-133.7 147.2 9.2 -0.7 14.1 72 132 A N S S+ 0 0 34 -62,-0.5 2,-0.8 -2,-0.3 48,-0.1 0.390 70.0 105.1 -89.9 4.9 9.2 -0.8 18.0 73 133 A S > - 0 0 8 1,-0.2 4,-2.4 -24,-0.1 5,-0.2 -0.762 46.1-175.8-104.6 102.1 11.8 1.9 18.1 74 134 A Q H > S+ 0 0 168 -2,-0.8 4,-2.0 1,-0.2 -1,-0.2 0.907 91.1 49.8 -49.5 -46.3 10.8 5.4 19.0 75 135 A T H > S+ 0 0 49 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.955 111.4 44.6 -64.0 -54.0 14.3 6.6 18.4 76 136 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.872 110.0 55.4 -64.8 -37.2 14.8 5.0 14.9 77 137 A I H X S+ 0 0 35 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.938 111.4 45.6 -58.5 -45.6 11.4 6.2 13.7 78 138 A K H X S+ 0 0 120 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.939 110.3 53.1 -64.9 -43.8 12.4 9.7 14.6 79 139 A W H X>S+ 0 0 22 -4,-2.6 5,-2.1 1,-0.2 4,-0.7 0.884 109.7 48.5 -60.0 -40.0 15.8 9.4 13.0 80 140 A V H ><5S+ 0 0 0 -4,-2.3 3,-1.0 2,-0.2 -1,-0.2 0.952 110.6 50.6 -65.0 -45.1 14.2 8.2 9.7 81 141 A K H 3<5S+ 0 0 166 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.895 116.6 42.1 -57.0 -41.2 11.7 11.1 9.8 82 142 A D H 3<5S- 0 0 73 -4,-2.4 -1,-0.3 2,-0.2 -2,-0.2 0.558 103.3-132.6 -79.0 -13.5 14.6 13.6 10.3 83 143 A K T <<5S+ 0 0 70 -3,-1.0 2,-0.3 -4,-0.7 -3,-0.2 0.823 77.5 104.8 54.7 36.6 16.9 11.8 7.8 84 144 A K < - 0 0 112 -5,-2.1 2,-1.1 -6,-0.2 -2,-0.2 -0.877 63.0-152.7-152.6 109.1 19.4 12.1 10.6 85 145 A A - 0 0 4 -2,-0.3 2,-1.9 17,-0.1 -9,-0.1 -0.740 12.8-162.6 -86.3 98.7 20.7 9.3 12.9 86 146 A K + 0 0 172 -2,-1.1 2,-0.2 2,-0.0 -1,-0.1 -0.353 26.3 163.9 -81.5 55.7 21.7 11.2 16.0 87 147 A S - 0 0 23 -2,-1.9 -2,-0.0 1,-0.1 0, 0.0 -0.498 36.7-153.7 -74.8 146.7 23.9 8.4 17.5 88 148 A T + 0 0 145 -2,-0.2 -1,-0.1 2,-0.1 3,-0.1 0.335 52.4 131.1 -91.1 -4.5 26.4 9.0 20.3 89 149 A L - 0 0 19 1,-0.1 -2,-0.1 6,-0.0 -45,-0.0 -0.339 68.7-106.8 -61.4 130.9 28.5 6.1 19.2 90 150 A V - 0 0 87 1,-0.1 2,-0.8 -2,-0.1 -1,-0.1 -0.229 27.0-134.7 -55.7 138.4 32.2 7.1 18.9 91 151 A R + 0 0 137 -3,-0.1 2,-0.2 3,-0.1 -1,-0.1 -0.902 54.9 117.1-101.7 106.9 33.3 7.4 15.3 92 152 A N S S- 0 0 63 -2,-0.8 3,-0.3 0, 0.0 4,-0.2 -0.778 79.0 -64.6-150.7-168.3 36.6 5.6 15.1 93 153 A E S > S+ 0 0 159 1,-0.2 3,-0.5 -2,-0.2 4,-0.2 0.809 128.1 47.8 -63.9 -35.8 38.4 2.7 13.4 94 154 A E T 3 S+ 0 0 139 1,-0.2 3,-0.3 2,-0.1 -1,-0.2 0.797 117.1 41.6 -74.4 -29.8 36.3 -0.0 15.2 95 155 A T T 3> S+ 0 0 5 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.230 83.1 108.3-100.9 11.4 33.0 1.7 14.4 96 156 A A H <> S+ 0 0 51 -3,-0.5 4,-2.1 -4,-0.2 -1,-0.2 0.881 76.1 50.7 -59.6 -42.8 33.9 2.6 10.8 97 157 A L H > S+ 0 0 75 -3,-0.3 4,-2.5 -4,-0.2 -1,-0.2 0.952 111.1 44.8 -63.5 -54.5 31.5 0.0 9.2 98 158 A I H > S+ 0 0 0 -56,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.915 114.8 50.0 -58.6 -40.0 28.4 0.9 11.1 99 159 A W H X S+ 0 0 23 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.884 109.1 51.2 -68.8 -35.0 29.0 4.6 10.6 100 160 A K H X S+ 0 0 120 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.934 112.1 47.8 -63.4 -44.4 29.5 4.1 6.8 101 161 A L H X S+ 0 0 28 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.886 112.1 48.7 -63.2 -43.6 26.2 2.2 6.7 102 162 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.924 111.7 49.5 -60.3 -47.8 24.4 4.9 8.6 103 163 A D H X S+ 0 0 57 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.911 112.4 48.3 -59.1 -42.0 25.9 7.6 6.4 104 164 A E H X S+ 0 0 91 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.855 109.8 51.8 -66.7 -37.8 24.8 5.6 3.3 105 165 A A H X S+ 0 0 6 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.923 110.5 48.3 -64.8 -43.2 21.3 5.1 4.7 106 166 A E H X S+ 0 0 19 -4,-2.5 4,-1.5 1,-0.2 -2,-0.2 0.905 110.2 53.2 -61.7 -39.5 20.9 8.8 5.4 107 167 A E H < S+ 0 0 114 -4,-2.0 4,-0.5 -5,-0.2 -1,-0.2 0.874 106.6 51.6 -67.0 -34.6 22.2 9.4 1.8 108 168 A W H >X S+ 0 0 20 -4,-2.0 3,-1.5 1,-0.2 4,-0.8 0.938 108.0 52.1 -65.9 -45.7 19.5 7.1 0.4 109 169 A L H 3< S+ 0 0 2 -4,-2.2 3,-0.3 1,-0.3 -1,-0.2 0.818 108.8 51.5 -56.5 -33.0 16.8 9.0 2.3 110 170 A N T 3< S+ 0 0 96 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.516 115.3 40.5 -85.8 -4.1 18.1 12.3 0.8 111 171 A T T <4 S+ 0 0 82 -3,-1.5 2,-0.3 -4,-0.5 -1,-0.2 0.337 111.4 54.4-122.6 2.5 18.0 11.0 -2.8 112 172 A H < - 0 0 77 -4,-0.8 2,-0.3 -3,-0.3 -1,-0.0 -0.952 64.3-138.6-138.8 156.5 14.8 9.0 -2.9 113 173 A T + 0 0 104 -2,-0.3 2,-0.3 -3,-0.0 -3,-0.0 -0.762 21.7 175.1-110.6 160.3 11.1 9.5 -2.2 114 174 A Y - 0 0 59 -2,-0.3 -56,-0.0 1,-0.1 -57,-0.0 -0.976 28.2-160.8-156.7 154.8 8.8 7.0 -0.5 115 175 A E + 0 0 120 -2,-0.3 -1,-0.1 2,-0.1 -49,-0.1 0.493 47.9 134.4-113.1 -7.5 5.2 7.0 0.7 116 176 A T - 0 0 9 -51,-0.1 2,-0.3 1,-0.1 -49,-0.1 -0.141 56.7-130.1 -45.7 118.6 5.6 4.0 3.2 117 177 A P - 0 0 61 0, 0.0 -48,-2.5 0, 0.0 2,-0.6 -0.617 15.6-146.1 -69.5 132.9 3.9 4.8 6.4 118 178 A I E -d 69 0A 37 -2,-0.3 2,-0.3 -50,-0.2 -48,-0.2 -0.935 24.1-167.9-105.0 116.1 6.4 4.1 9.2 119 179 A L E -d 70 0A 49 -50,-3.4 -48,-2.1 -2,-0.6 2,-0.5 -0.828 23.9-120.0-114.8 140.7 4.3 2.9 12.2 120 180 A K E -d 71 0A 78 -2,-0.3 2,-0.4 -50,-0.2 -48,-0.2 -0.668 27.6-133.3 -76.5 121.3 5.1 2.4 15.9 121 181 A W - 0 0 6 -50,-2.4 2,-1.5 -2,-0.5 3,-0.2 -0.648 18.0-134.6 -71.7 127.0 4.5 -1.3 16.8 122 182 A Q >> + 0 0 55 -2,-0.4 4,-3.0 1,-0.2 3,-0.9 -0.603 31.7 172.6 -93.2 80.0 2.5 -1.1 20.1 123 183 A T H 3> S+ 0 0 39 -2,-1.5 4,-2.1 1,-0.3 -1,-0.2 0.807 74.2 59.3 -56.2 -36.6 4.3 -3.7 22.2 124 184 A D H 34 S+ 0 0 137 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.851 119.0 29.2 -67.3 -32.9 2.3 -2.9 25.3 125 185 A K H <4 S+ 0 0 136 -3,-0.9 -2,-0.2 2,-0.1 -1,-0.2 0.791 132.8 30.7 -91.8 -34.1 -0.9 -3.8 23.6 126 186 A W H < S- 0 0 47 -4,-3.0 -3,-0.2 1,-0.3 -2,-0.2 0.485 99.5-120.9-111.3 -5.4 0.2 -6.4 21.1 127 187 A G < - 0 0 36 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.1 -0.358 63.7 -13.8 85.4-173.3 3.2 -8.3 22.6 128 188 A E S S- 0 0 108 1,-0.1 4,-0.1 -2,-0.1 -6,-0.1 -0.238 77.7-100.3 -70.2 146.6 6.6 -8.4 21.0 129 189 A I > - 0 0 2 1,-0.1 3,-1.7 -8,-0.1 -1,-0.1 -0.258 29.4-119.2 -61.8 148.8 7.2 -7.4 17.4 130 190 A K T 3 S+ 0 0 83 1,-0.3 -1,-0.1 -104,-0.1 -119,-0.1 0.720 111.8 62.5 -71.2 -17.8 7.5 -10.2 14.9 131 191 A A T 3 S+ 0 0 0 -121,-0.2 -1,-0.3 -105,-0.1 -120,-0.2 0.290 79.9 136.4 -84.1 15.9 11.0 -9.3 13.8 132 192 A D < 0 0 80 -3,-1.7 -119,-0.1 1,-0.1 -121,-0.1 -0.347 360.0 360.0 -63.6 137.6 12.0 -10.1 17.5 133 193 A Y 0 0 104 -121,-0.4 -1,-0.1 -2,-0.0 -120,-0.1 0.599 360.0 360.0 -90.8 360.0 15.2 -12.1 18.0