==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 12-OCT-98 1JDX . COMPND 2 MOLECULE: PROTEIN (L-ARGININE:GLYCINE AMIDINOTRANSFERASE); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.FRITSCHE,A.HUMM,R.HUBER . 361 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13667.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 241 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 45 12.5 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 30 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 17.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.7 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 2 0 2 1 0 2 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 2 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 PARALLEL BRIDGES PER LADDER . 6 0 2 3 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 . 1 3 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 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 64 A C 0 0 109 0, 0.0 143,-0.1 0, 0.0 139,-0.1 0.000 360.0 360.0 360.0 67.2 52.5 41.4 15.8 2 65 A P + 0 0 5 0, 0.0 2,-0.5 0, 0.0 142,-0.1 0.805 360.0 68.4 -64.0 -30.9 53.6 44.5 17.7 3 66 A V + 0 0 1 137,-0.2 347,-0.2 111,-0.2 2,-0.1 -0.806 53.9 128.7 -98.8 130.4 51.3 46.7 15.7 4 67 A S B +a 350 0A 21 345,-2.8 347,-2.6 -2,-0.5 2,-0.3 -0.487 14.4 143.2-178.9 100.8 47.5 46.5 16.0 5 68 A S B +D 113 0B 0 108,-1.6 108,-2.0 345,-0.2 110,-0.2 -0.935 12.6 171.0-149.8 122.0 45.2 49.5 16.7 6 69 A Y + 0 0 40 -2,-0.3 193,-2.1 106,-0.2 2,-0.3 0.513 68.3 2.0-107.7 -9.7 41.7 50.0 15.2 7 70 A N B S-E 198 0C 0 191,-0.2 191,-0.2 106,-0.1 -1,-0.1 -0.904 76.3 -92.4-159.4-173.7 40.4 53.0 17.2 8 71 A E S S+ 0 0 5 189,-0.9 293,-0.6 -2,-0.3 190,-0.1 0.423 108.3 42.5 -94.4 1.6 41.2 55.6 19.8 9 72 A W S S+ 0 0 1 291,-0.1 3,-0.2 293,-0.1 295,-0.1 0.637 71.1 112.7-126.7 -19.1 39.9 53.8 23.0 10 73 A D S S- 0 0 16 293,-0.2 343,-0.1 1,-0.2 2,-0.1 -0.185 90.0 -63.3 -56.3 155.7 40.8 50.0 23.2 11 74 A P - 0 0 33 0, 0.0 341,-2.9 0, 0.0 292,-0.2 -0.172 60.6-129.3 -47.0 109.8 43.2 49.1 26.1 12 75 A L E +B 351 0A 8 290,-2.8 339,-0.3 339,-0.2 3,-0.1 -0.388 39.2 161.5 -66.5 131.4 46.4 50.8 25.2 13 76 A E E + 0 0 52 337,-3.1 64,-2.5 1,-0.4 2,-0.4 0.627 63.5 19.8-122.2 -29.7 49.5 48.5 25.2 14 77 A E E +Bc 350 77A 10 336,-1.8 335,-1.8 62,-0.2 336,-1.6 -0.996 62.0 171.1-147.3 141.9 52.2 50.3 23.3 15 78 A V E -Bc 348 78A 0 62,-2.6 64,-2.1 -2,-0.4 2,-0.4 -0.961 27.0-134.7-148.8 154.2 52.7 53.9 22.3 16 79 A I E -Bc 347 79A 0 331,-2.1 331,-1.6 -2,-0.3 2,-0.4 -0.959 23.7-160.1-109.6 135.9 55.3 56.1 20.7 17 80 A V E -B 346 0A 0 62,-2.5 329,-0.2 -2,-0.4 87,-0.1 -0.969 15.4-122.3-121.7 131.2 55.8 59.5 22.5 18 81 A G - 0 0 0 327,-2.5 2,-0.4 85,-0.5 85,-0.3 0.084 17.1-124.2 -62.9 179.3 57.5 62.5 20.8 19 82 A R B -H 102 0D 47 83,-1.8 83,-0.7 2,-0.1 85,-0.1 -0.979 10.2-161.4-129.3 143.8 60.5 64.6 21.7 20 83 A A > + 0 0 2 -2,-0.4 3,-1.5 37,-0.1 83,-0.1 0.540 54.6 125.4 -97.4 -11.5 60.9 68.3 22.3 21 84 A E T 3 S- 0 0 49 1,-0.2 63,-0.3 81,-0.1 81,-0.2 -0.236 81.2 -5.2 -56.3 131.6 64.7 68.1 21.8 22 85 A N T 3 S+ 0 0 52 1,-0.2 64,-0.6 63,-0.1 -1,-0.2 0.613 83.5 171.1 59.9 20.6 66.3 70.4 19.2 23 86 A A < - 0 0 0 -3,-1.5 29,-2.1 62,-0.1 2,-0.4 -0.337 17.1-153.5 -59.9 137.6 62.9 71.7 18.0 24 87 A C B -I 51 0E 0 76,-2.7 27,-0.3 27,-0.3 24,-0.1 -0.932 21.0-112.5-120.7 143.8 63.3 74.7 15.6 25 88 A V - 0 0 0 25,-3.0 24,-2.8 22,-0.4 25,-0.1 -0.534 46.8-119.5 -68.3 126.7 61.0 77.6 14.8 26 89 A P - 0 0 0 0, 0.0 22,-0.1 0, 0.0 24,-0.1 -0.431 31.8 -91.1 -72.1 148.2 60.1 76.9 11.2 27 90 A P - 0 0 34 0, 0.0 2,-2.0 0, 0.0 5,-0.2 -0.302 45.8-107.8 -55.5 143.0 61.0 79.4 8.5 28 91 A F + 0 0 35 16,-0.3 2,-0.2 4,-0.1 -3,-0.0 -0.477 61.5 152.2 -78.7 74.5 58.1 81.9 8.0 29 92 A T >> - 0 0 45 -2,-2.0 4,-2.6 1,-0.0 3,-1.3 -0.558 61.8 -87.5 -98.9 168.6 56.7 80.7 4.7 30 93 A I H 3> S+ 0 0 23 1,-0.3 4,-2.0 2,-0.2 5,-0.1 0.816 125.6 49.2 -43.2 -47.4 53.1 81.0 3.4 31 94 A E H 34 S+ 0 0 5 2,-0.2 4,-0.5 1,-0.2 -1,-0.3 0.785 112.9 47.5 -69.9 -26.5 51.9 77.8 4.9 32 95 A V H X> S+ 0 0 0 -3,-1.3 3,-1.7 2,-0.2 4,-1.6 0.943 110.7 52.1 -76.6 -46.5 53.4 78.6 8.3 33 96 A K H 3< S+ 0 0 63 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.843 102.5 60.2 -55.8 -37.9 51.9 82.1 8.2 34 97 A A T 3< S+ 0 0 1 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.760 111.3 40.2 -61.8 -27.3 48.5 80.6 7.5 35 98 A N T <4 S+ 0 0 6 -3,-1.7 2,-0.3 -4,-0.5 -1,-0.2 0.699 97.1 96.1 -94.0 -22.9 48.7 78.7 10.8 36 99 A T S < S- 0 0 10 -4,-1.6 2,-0.2 1,-0.1 254,-0.1 -0.542 71.3-127.6 -81.0 131.9 50.2 81.4 13.0 37 100 A Y > - 0 0 110 -2,-0.3 3,-3.3 252,-0.3 4,-0.5 -0.526 27.4-117.9 -72.7 134.9 48.2 83.8 15.2 38 101 A E G > S+ 0 0 95 1,-0.3 3,-1.4 -2,-0.2 -1,-0.1 0.808 111.8 71.7 -39.3 -40.3 49.1 87.5 14.5 39 102 A K G 3 S+ 0 0 125 1,-0.3 -1,-0.3 2,-0.1 4,-0.2 0.773 103.9 38.8 -50.4 -30.9 50.3 87.6 18.1 40 103 A Y G <> S+ 0 0 23 -3,-3.3 4,-2.2 1,-0.1 3,-0.5 0.464 81.4 102.4-105.6 0.8 53.3 85.5 17.2 41 104 A W H <> S+ 0 0 36 -3,-1.4 4,-2.9 -4,-0.5 5,-0.2 0.882 83.0 50.4 -52.8 -44.8 54.3 86.7 13.8 42 105 A P H > S+ 0 0 81 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.879 109.0 53.3 -61.7 -37.5 57.3 88.8 15.1 43 106 A F H > S+ 0 0 43 -3,-0.5 4,-3.2 2,-0.2 5,-0.3 0.951 113.5 42.3 -60.1 -49.5 58.5 85.7 17.0 44 107 A Y H X S+ 0 0 1 -4,-2.2 4,-1.9 1,-0.2 -16,-0.3 0.877 112.3 55.4 -66.0 -37.7 58.4 83.6 13.8 45 108 A Q H < S+ 0 0 117 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.860 120.1 29.7 -64.0 -36.9 59.9 86.5 11.8 46 109 A K H < S+ 0 0 169 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.788 125.5 43.1 -93.7 -30.3 62.9 86.8 14.1 47 110 A Q H >< S+ 0 0 61 -4,-3.2 3,-2.9 -5,-0.2 -22,-0.4 0.648 75.3 127.8 -91.2 -19.6 63.3 83.2 15.3 48 111 A G T 3< S+ 0 0 22 -4,-1.9 3,-0.1 -5,-0.3 -4,-0.0 -0.078 79.8 18.7 -43.2 129.3 62.7 81.2 12.1 49 112 A G T 3 S+ 0 0 26 -24,-2.8 -1,-0.3 1,-0.3 2,-0.2 0.262 110.7 94.1 91.2 -13.3 65.6 78.8 11.6 50 113 A H S < S- 0 0 109 -3,-2.9 -25,-3.0 1,-0.1 -1,-0.3 -0.697 84.6 -85.0-108.7 165.7 66.7 78.9 15.2 51 114 A Y B -I 24 0E 56 -27,-0.3 -27,-0.3 -2,-0.2 3,-0.2 -0.249 45.1-103.4 -67.2 151.9 65.7 76.7 18.2 52 115 A F S S- 0 0 1 -29,-2.1 5,-0.1 1,-0.2 -1,-0.1 -0.381 70.3 -61.1 -66.6 155.4 62.6 77.3 20.2 53 116 A P >> - 0 0 33 0, 0.0 4,-2.4 0, 0.0 3,-0.8 -0.189 51.5-147.1 -44.0 112.4 63.5 79.0 23.6 54 117 A K H 3> S+ 0 0 134 1,-0.3 4,-2.3 2,-0.2 5,-0.1 0.799 95.9 57.0 -57.2 -33.1 65.8 76.4 25.2 55 118 A D H 3> S+ 0 0 106 2,-0.2 4,-1.0 1,-0.2 -1,-0.3 0.876 111.6 45.3 -65.6 -34.2 64.7 77.3 28.8 56 119 A H H <> S+ 0 0 14 -3,-0.8 4,-1.9 2,-0.2 3,-0.4 0.911 109.4 53.8 -75.0 -41.5 61.2 76.5 27.6 57 120 A L H X S+ 0 0 12 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.888 103.7 57.8 -60.9 -38.1 62.3 73.3 25.8 58 121 A K H X S+ 0 0 163 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.868 106.1 47.8 -60.5 -38.6 63.9 72.1 29.0 59 122 A K H X S+ 0 0 98 -4,-1.0 4,-2.3 -3,-0.4 -1,-0.2 0.875 112.2 49.7 -69.6 -38.9 60.6 72.3 30.9 60 123 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 274,-0.2 5,-0.2 0.910 107.6 54.7 -64.9 -43.1 58.8 70.4 28.1 61 124 A V H X S+ 0 0 38 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.942 110.6 45.9 -55.1 -48.2 61.5 67.7 28.2 62 125 A A H X S+ 0 0 61 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.924 111.7 51.4 -61.5 -47.3 60.8 67.2 32.0 63 126 A E H X S+ 0 0 22 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.895 111.1 47.4 -57.7 -42.8 57.0 67.2 31.5 64 127 A I H X S+ 0 0 2 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.827 107.9 55.5 -72.3 -30.3 57.2 64.5 28.7 65 128 A E H X S+ 0 0 67 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.926 109.6 47.1 -66.5 -40.1 59.6 62.3 30.8 66 129 A E H X S+ 0 0 100 -4,-2.0 4,-3.0 2,-0.2 5,-0.2 0.940 109.5 52.8 -64.6 -47.6 57.0 62.4 33.6 67 130 A M H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.915 109.8 50.5 -53.2 -42.7 54.2 61.5 31.2 68 131 A C H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.907 108.5 51.0 -64.5 -39.1 56.4 58.6 30.0 69 132 A N H X S+ 0 0 76 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.936 111.2 48.8 -62.7 -44.6 56.9 57.5 33.6 70 133 A I H X S+ 0 0 31 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.907 108.6 52.7 -62.3 -41.3 53.1 57.6 34.2 71 134 A L H <>S+ 0 0 0 -4,-2.5 5,-2.7 1,-0.2 -1,-0.2 0.920 110.0 48.3 -61.5 -43.7 52.4 55.6 31.0 72 135 A K H ><5S+ 0 0 108 -4,-2.3 3,-1.7 1,-0.2 -1,-0.2 0.901 109.1 53.9 -63.3 -37.5 54.8 52.9 32.1 73 136 A T H 3<5S+ 0 0 112 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.872 105.4 53.9 -61.2 -40.4 53.1 52.9 35.5 74 137 A E T 3<5S- 0 0 64 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.292 127.4-102.2 -78.1 9.1 49.8 52.4 33.7 75 138 A G T < 5S+ 0 0 57 -3,-1.7 2,-0.4 1,-0.3 -3,-0.2 0.599 75.6 140.0 82.0 14.9 51.3 49.3 31.9 76 139 A V < - 0 0 4 -5,-2.7 2,-0.5 -6,-0.2 -1,-0.3 -0.756 50.6-132.3 -95.7 132.9 52.0 51.0 28.6 77 140 A T E -c 14 0A 69 -64,-2.5 -62,-2.6 -2,-0.4 2,-0.4 -0.735 27.2-152.4 -81.6 127.0 55.2 50.2 26.7 78 141 A V E -c 15 0A 21 -2,-0.5 2,-0.3 -64,-0.2 -62,-0.2 -0.878 15.1-174.1-109.7 132.2 56.8 53.5 25.5 79 142 A R E -c 16 0A 66 -64,-2.1 -62,-2.5 -2,-0.4 -65,-0.0 -0.913 10.5-156.4-117.6 147.3 59.0 54.0 22.4 80 143 A R - 0 0 44 -2,-0.3 -62,-0.2 -64,-0.2 56,-0.1 -0.942 19.4-112.8-125.2 144.9 60.7 57.3 21.7 81 144 A P - 0 0 1 0, 0.0 52,-0.2 0, 0.0 51,-0.1 -0.267 45.7 -88.0 -69.8 167.0 61.9 58.7 18.3 82 145 A D - 0 0 61 50,-2.5 2,-0.3 49,-0.1 -63,-0.1 -0.492 44.1-106.0 -75.0 146.3 65.7 59.2 17.8 83 146 A P + 0 0 83 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.541 47.6 174.5 -74.0 135.6 67.2 62.6 18.8 84 147 A I - 0 0 26 -63,-0.3 2,-1.0 -2,-0.3 18,-0.1 -0.974 38.5-117.6-141.4 146.3 68.0 64.7 15.8 85 148 A D > - 0 0 74 -2,-0.3 3,-1.2 1,-0.1 14,-0.1 -0.809 26.3-167.3 -86.9 108.7 69.2 68.2 15.3 86 149 A W T 3 S+ 0 0 13 -2,-1.0 13,-1.9 -64,-0.6 -1,-0.1 0.477 73.0 80.3 -74.9 -0.7 66.3 69.8 13.5 87 150 A S T 3 + 0 0 36 11,-0.2 -1,-0.2 2,-0.1 2,-0.1 0.552 61.3 119.5 -84.3 -8.5 68.3 72.9 12.6 88 151 A L < - 0 0 110 -3,-1.2 11,-0.5 10,-0.1 2,-0.5 -0.387 62.3-135.1 -60.0 129.4 70.1 71.2 9.6 89 152 A K E -J 98 0F 127 9,-0.2 2,-0.3 -2,-0.1 9,-0.3 -0.762 27.0-173.4 -87.9 125.2 69.3 73.0 6.4 90 153 A Y E -J 97 0F 28 7,-3.0 7,-2.4 -2,-0.5 2,-0.4 -0.809 10.7-150.5-117.3 164.8 68.4 70.6 3.6 91 154 A K E -J 96 0F 170 -2,-0.3 5,-0.2 5,-0.2 -2,-0.0 -0.981 10.5-177.2-143.0 120.1 67.7 71.1 -0.1 92 155 A T - 0 0 17 3,-3.1 3,-0.3 -2,-0.4 62,-0.0 -0.627 50.1 -98.2-103.4 170.4 65.5 69.3 -2.5 93 156 A P S S+ 0 0 132 0, 0.0 3,-0.1 0, 0.0 61,-0.0 0.736 125.1 45.1 -62.8 -14.5 65.3 70.2 -6.3 94 157 A D S S- 0 0 75 1,-0.2 2,-0.3 60,-0.2 63,-0.3 0.686 123.2 -11.7-100.0 -24.3 62.2 72.1 -5.3 95 158 A F - 0 0 16 -3,-0.3 -3,-3.1 61,-0.1 2,-0.3 -0.987 51.8-126.8-166.6 174.2 63.0 74.1 -2.2 96 159 A E E +J 91 0F 114 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.947 38.0 145.3-132.9 144.9 65.4 74.6 0.7 97 160 A S E -J 90 0F 9 -7,-2.4 -7,-3.0 -2,-0.3 2,-0.3 -0.991 41.8-116.7-170.7 168.0 64.6 74.6 4.4 98 161 A T E -J 89 0F 16 -2,-0.3 -11,-0.2 -9,-0.3 -9,-0.2 -0.717 44.8-105.8-108.3 161.6 65.4 73.8 8.1 99 162 A G - 0 0 2 -13,-1.9 27,-0.2 -11,-0.5 -50,-0.2 -0.135 13.8-146.5 -83.9-176.2 63.4 71.3 10.1 100 163 A L - 0 0 0 25,-0.9 -76,-2.7 1,-0.3 2,-0.3 0.665 45.3 -84.7-112.0 -81.8 60.8 71.5 12.8 101 164 A Y - 0 0 2 -78,-0.2 -1,-0.3 24,-0.1 -81,-0.1 -0.937 16.4-113.7-174.1-174.9 60.8 68.7 15.4 102 165 A S B S+H 19 0D 1 -83,-0.7 -83,-1.8 -2,-0.3 -81,-0.1 -0.272 73.5 118.9-132.9 44.6 59.6 65.2 16.2 103 166 A A + 0 0 0 -85,-0.3 -85,-0.5 1,-0.2 -83,-0.1 0.839 67.5 54.2 -79.9 -32.5 57.4 66.2 19.0 104 167 A M >> + 0 0 1 1,-0.2 3,-1.3 -86,-0.1 4,-0.7 -0.766 50.5 172.3-113.3 92.5 54.1 65.0 17.5 105 168 A P H >> S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 3,-0.7 0.833 82.5 64.9 -63.0 -30.3 54.0 61.4 16.4 106 169 A R H 34 S+ 0 0 12 238,-1.6 239,-0.1 1,-0.2 238,-0.1 0.778 94.0 61.3 -63.3 -26.0 50.3 61.9 15.7 107 170 A D H <4 S+ 0 0 3 -3,-1.3 85,-2.0 237,-0.4 86,-0.5 0.832 120.7 18.8 -71.1 -29.2 51.1 64.4 12.9 108 171 A I H << S+ 0 0 0 -3,-0.7 11,-3.2 -4,-0.7 2,-0.4 0.627 116.3 58.2-118.3 -21.0 53.0 61.9 10.8 109 172 A L E < +K 118 0G 2 -4,-2.6 2,-0.4 9,-0.2 9,-0.2 -0.937 49.0 174.9-121.0 138.9 52.1 58.3 11.8 110 173 A I E -K 117 0G 8 7,-1.8 7,-2.6 -2,-0.4 2,-0.5 -0.993 18.3-147.4-139.2 137.4 48.8 56.6 11.9 111 174 A V E +K 116 0G 1 -2,-0.4 2,-0.5 5,-0.2 5,-0.2 -0.939 15.5 178.1-108.4 123.6 48.1 52.9 12.6 112 175 A V E > -K 115 0G 6 3,-2.4 3,-1.6 -2,-0.5 2,-0.3 -0.947 67.4 -51.1-124.7 102.6 45.2 51.2 10.9 113 176 A G B 3 S-D 5 0B 3 -108,-2.0 -108,-1.6 -2,-0.5 -106,-0.1 -0.510 123.1 -16.5 72.4-124.4 45.1 47.6 11.9 114 177 A N T 3 S+ 0 0 70 -2,-0.3 32,-2.7 -110,-0.2 2,-0.5 0.133 119.2 97.4 -98.6 14.9 48.5 46.0 11.5 115 178 A E E < -Kl 112 146G 24 -3,-1.6 -3,-2.4 30,-0.2 2,-0.5 -0.920 56.2-159.3-118.0 128.4 49.7 48.8 9.3 116 179 A I E -Kl 111 147G 1 30,-2.7 32,-2.6 -2,-0.5 2,-0.4 -0.879 15.9-165.0-103.0 126.3 51.7 51.8 10.1 117 180 A I E -Kl 110 148G 0 -7,-2.6 -7,-1.8 -2,-0.5 2,-0.6 -0.970 11.8-146.8-114.5 127.6 51.4 54.6 7.6 118 181 A E E -Kl 109 149G 7 30,-2.4 32,-2.3 -2,-0.4 -9,-0.2 -0.857 22.3-133.2 -95.1 120.9 53.7 57.6 7.3 119 182 A A - 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