==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/INHIBITOR 20-JUN-12 4FOC . COMPND 2 MOLECULE: ALK TYROSINE KINASE RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.A.WHITTINGTON,L.F.EPSTEIN,H.CHEN . 296 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14243.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 190 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 42 14.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 3 1.0 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 0.3 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 . 11 3.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 30.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 1 2 0 1 1 0 0 1 0 0 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 1 1 2 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 1093 A N 0 0 150 0, 0.0 2,-0.2 0, 0.0 64,-0.0 0.000 360.0 360.0 360.0 66.3 10.4 37.2 9.9 2 1094 A P - 0 0 37 0, 0.0 11,-0.3 0, 0.0 2,-0.2 -0.466 360.0-136.9 -74.0 136.4 8.8 34.7 12.3 3 1095 A N - 0 0 94 -2,-0.2 2,-0.4 9,-0.1 9,-0.2 -0.612 13.9-157.1 -83.6 151.2 9.9 34.6 15.9 4 1096 A Y E -A 11 0A 2 7,-2.6 7,-3.0 -2,-0.2 2,-0.4 -1.000 4.5-160.6-127.4 133.8 10.5 31.2 17.6 5 1097 A S E +A 10 0A 54 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.949 18.2 158.5-119.4 137.5 10.4 30.7 21.4 6 1098 A F E > S+A 9 0A 20 3,-2.1 3,-1.5 -2,-0.4 141,-0.1 -0.962 72.3 3.6-153.0 132.7 11.9 27.9 23.5 7 1099 A A T 3 S- 0 0 63 139,-0.6 3,-0.1 -2,-0.3 140,-0.1 0.886 130.4 -59.5 57.3 39.6 12.8 27.8 27.2 8 1100 A G T 3 S+ 0 0 86 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.600 114.0 113.5 68.0 13.5 11.3 31.4 27.5 9 1101 A K E < -A 6 0A 137 -3,-1.5 -3,-2.1 2,-0.0 2,-0.5 -0.949 55.5-145.5-123.0 137.4 13.7 32.9 25.0 10 1102 A T E +A 5 0A 77 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.884 20.4 175.8-107.9 131.1 12.7 34.3 21.6 11 1103 A S E -A 4 0A 7 -7,-3.0 -7,-2.6 -2,-0.5 2,-0.3 -0.851 8.0-168.0-129.3 164.2 14.9 34.0 18.5 12 1104 A S >> - 0 0 16 -2,-0.3 3,-2.5 -9,-0.2 4,-0.5 -0.850 48.2 -79.2-141.2 176.5 14.7 34.9 14.9 13 1105 A I G >4 S+ 0 0 73 -11,-0.3 3,-1.6 1,-0.3 -10,-0.0 0.854 123.3 64.7 -49.1 -38.4 16.5 34.3 11.6 14 1106 A S G 34 S+ 0 0 98 1,-0.3 -1,-0.3 3,-0.1 4,-0.1 0.711 95.8 58.9 -62.1 -18.5 19.2 36.9 12.6 15 1107 A D G <4 S+ 0 0 89 -3,-2.5 -1,-0.3 2,-0.1 -2,-0.2 0.657 82.1 102.5 -83.4 -16.7 20.3 34.7 15.5 16 1108 A L S << S- 0 0 18 -3,-1.6 2,-1.1 -4,-0.5 56,-0.1 -0.403 82.9-112.9 -69.3 145.8 21.2 31.7 13.3 17 1109 A K - 0 0 153 -2,-0.1 71,-2.7 72,-0.0 2,-0.5 -0.686 31.0-152.4 -83.6 98.5 24.9 31.3 12.7 18 1110 A E B -b 88 0B 63 -2,-1.1 71,-0.2 69,-0.2 -1,-0.0 -0.606 6.5-157.7 -73.6 121.9 25.4 32.0 9.0 19 1111 A V - 0 0 18 69,-3.2 5,-0.1 -2,-0.5 68,-0.0 -0.856 28.7-105.1 -99.9 129.1 28.4 30.1 7.6 20 1112 A P > - 0 0 57 0, 0.0 3,-1.7 0, 0.0 4,-0.2 -0.280 23.2-132.1 -58.7 136.9 30.0 31.5 4.5 21 1113 A R G > S+ 0 0 55 1,-0.3 3,-2.0 2,-0.2 68,-0.0 0.861 104.6 63.0 -60.1 -36.5 29.1 29.4 1.4 22 1114 A K G 3 S+ 0 0 182 1,-0.3 -1,-0.3 21,-0.0 -3,-0.0 0.742 97.7 58.5 -59.4 -23.1 32.7 29.3 0.2 23 1115 A N G < S+ 0 0 49 -3,-1.7 21,-2.3 21,-0.1 2,-0.5 0.501 93.4 82.6 -82.3 -4.8 33.6 27.4 3.5 24 1116 A I E < +C 43 0B 16 -3,-2.0 2,-0.4 -4,-0.2 19,-0.2 -0.898 52.8 179.3-111.9 126.6 31.2 24.5 2.7 25 1117 A T E -C 42 0B 70 17,-2.2 17,-2.1 -2,-0.5 2,-0.3 -0.994 20.8-139.7-124.7 128.1 32.0 21.6 0.5 26 1118 A L E +C 41 0B 70 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.686 18.7 179.8 -82.8 139.2 29.6 18.7 -0.2 27 1119 A I E - 0 0 67 13,-3.4 2,-0.3 1,-0.4 14,-0.2 0.796 57.5 -23.1-107.3 -45.1 31.2 15.2 -0.4 28 1120 A R E -C 40 0B 141 12,-1.0 12,-3.0 0, 0.0 -1,-0.4 -0.978 64.8 -91.5-165.2 156.5 28.4 12.7 -1.1 29 1121 A G E -C 39 0B 42 -2,-0.3 10,-0.2 10,-0.2 3,-0.1 -0.538 25.5-174.2 -71.4 140.8 24.7 12.0 -0.9 30 1122 A L E - 0 0 87 8,-2.8 2,-0.2 1,-0.5 9,-0.2 0.352 52.2 -94.8-113.9 0.5 23.5 10.3 2.3 31 1123 A G E -C 38 0B 31 7,-0.6 7,-3.2 2,-0.0 -1,-0.5 -0.699 48.9 -67.9 114.3-169.5 19.8 9.9 1.2 32 1124 A H E +C 37 0B 151 5,-0.3 5,-0.2 -2,-0.2 4,-0.1 -0.926 37.2 176.2-126.6 151.2 16.8 12.1 1.7 33 1125 A G - 0 0 45 3,-1.4 -1,-0.1 -2,-0.3 140,-0.0 0.068 64.8 -40.2-116.0-131.6 14.6 13.0 4.7 34 1126 A A S S+ 0 0 64 -2,-0.1 3,-0.1 3,-0.0 139,-0.0 0.986 129.9 30.6 -68.4 -60.3 11.6 15.3 5.0 35 1127 A F S S- 0 0 27 1,-0.1 -2,-0.3 2,-0.0 20,-0.1 0.212 116.4 -55.8 -74.1-155.9 13.0 18.1 2.8 36 1128 A G S S- 0 0 20 18,-1.0 -3,-1.4 1,-0.2 -1,-0.1 0.490 89.4 -27.2 -64.4-144.8 15.3 17.3 -0.2 37 1129 A E E -C 32 0B 55 -5,-0.2 17,-1.7 16,-0.1 2,-0.5 -0.291 49.2-141.5 -75.0 151.5 18.6 15.4 0.0 38 1130 A V E -CD 31 53B 33 -7,-3.2 -8,-2.8 15,-0.2 -7,-0.6 -0.961 25.4-165.5-106.7 133.4 20.9 15.2 3.0 39 1131 A Y E -CD 29 52B 74 13,-2.3 13,-3.1 -2,-0.5 2,-0.4 -0.897 24.7-119.2-117.6 149.9 24.6 15.4 2.1 40 1132 A E E +CD 28 51B 36 -12,-3.0 -13,-3.4 -2,-0.3 -12,-1.0 -0.726 50.3 164.9 -74.8 134.7 27.9 14.6 3.8 41 1133 A G E -CD 26 50B 0 9,-2.9 9,-2.6 -2,-0.4 2,-0.3 -0.870 31.6-134.6-142.4 177.1 29.9 17.9 3.9 42 1134 A Q E -CD 25 49B 53 -17,-2.1 -17,-2.2 -2,-0.3 2,-0.4 -0.998 10.7-149.9-139.1 143.9 32.8 19.7 5.5 43 1135 A V E CD 24 48B 15 5,-2.5 5,-2.8 -2,-0.3 -19,-0.2 -0.943 360.0 360.0-114.7 131.5 33.1 23.2 6.8 44 1136 A S 0 0 102 -21,-2.3 -21,-0.1 -2,-0.4 -1,-0.1 0.369 360.0 360.0-111.5 360.0 36.4 25.2 6.7 45 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 46 1143 A S 0 0 162 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 76.1 41.1 20.0 9.9 47 1144 A P - 0 0 68 0, 0.0 2,-0.5 0, 0.0 -3,-0.2 -0.299 360.0-110.1 -68.7 158.8 37.7 20.7 8.4 48 1145 A L E -D 43 0B 94 -5,-2.8 -5,-2.5 -4,-0.0 2,-0.4 -0.794 29.3-135.3 -89.8 127.4 34.5 20.1 10.4 49 1146 A Q E +D 42 0B 75 -2,-0.5 52,-0.8 -7,-0.2 2,-0.3 -0.717 35.4 168.1 -86.9 132.4 32.5 17.1 9.1 50 1147 A V E -DE 41 100B 0 -9,-2.6 -9,-2.9 -2,-0.4 2,-0.4 -0.893 40.1-120.2-138.7 161.6 28.8 17.8 8.9 51 1148 A A E -DE 40 99B 14 48,-2.8 48,-3.3 -2,-0.3 2,-0.6 -0.911 32.3-150.1 -96.6 137.2 25.4 16.6 7.5 52 1149 A V E -DE 39 98B 0 -13,-3.1 -13,-2.3 -2,-0.4 2,-0.5 -0.945 5.7-160.1-115.4 111.2 23.9 19.2 5.2 53 1150 A K E -DE 38 97B 17 44,-2.8 44,-2.3 -2,-0.6 2,-0.3 -0.800 19.1-154.3 -87.2 130.2 20.2 19.4 4.9 54 1151 A T E - E 0 96B 13 -17,-1.7 -18,-1.0 -2,-0.5 42,-0.2 -0.818 13.7-142.2-112.9 149.3 19.1 21.1 1.7 55 1152 A L - 0 0 2 40,-2.1 40,-0.4 -2,-0.3 4,-0.1 -0.929 32.5-116.5-102.7 122.0 16.1 23.1 0.6 56 1153 A P - 0 0 49 0, 0.0 39,-0.1 0, 0.0 7,-0.0 -0.316 12.4-137.6 -56.8 138.4 15.0 22.5 -3.0 57 1154 A E S S+ 0 0 123 1,-0.2 2,-1.0 37,-0.1 -2,-0.0 0.805 99.1 66.5 -66.3 -29.4 15.3 25.6 -5.1 58 1155 A V S S+ 0 0 137 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.821 82.7 113.5 -91.0 96.2 11.9 24.7 -6.6 59 1156 A C - 0 0 41 -2,-1.0 2,-0.1 -4,-0.1 -4,-0.0 -0.968 62.4 -95.0-158.7 168.1 9.7 25.0 -3.6 60 1157 A S > - 0 0 56 -2,-0.3 4,-2.0 1,-0.1 5,-0.1 -0.361 36.1-107.8 -86.7 167.9 6.8 27.1 -2.1 61 1158 A E H > S+ 0 0 163 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.868 124.0 52.9 -56.9 -39.1 6.9 30.1 0.2 62 1159 A Q H > S+ 0 0 92 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.867 104.1 53.7 -68.3 -39.6 5.6 27.7 2.9 63 1160 A D H > S+ 0 0 62 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.911 109.8 50.2 -57.6 -44.2 8.4 25.2 2.3 64 1161 A E H X S+ 0 0 58 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.931 111.8 45.6 -58.5 -51.4 10.8 28.1 2.8 65 1162 A L H X S+ 0 0 59 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.901 111.4 53.6 -63.8 -39.2 9.2 29.2 6.1 66 1163 A D H X S+ 0 0 21 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.915 109.1 48.8 -56.6 -45.1 9.1 25.5 7.2 67 1164 A F H X S+ 0 0 1 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.892 110.8 50.3 -64.7 -43.6 12.9 25.2 6.5 68 1165 A L H X S+ 0 0 19 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.936 110.3 49.6 -58.4 -48.8 13.5 28.4 8.5 69 1166 A M H X S+ 0 0 3 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.900 108.2 53.8 -60.5 -39.7 11.5 27.1 11.4 70 1167 A E H X S+ 0 0 12 -4,-2.3 4,-2.3 2,-0.2 5,-0.3 0.919 108.6 49.8 -59.0 -43.1 13.4 23.9 11.4 71 1168 A A H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.932 111.9 47.4 -60.9 -46.2 16.7 25.8 11.6 72 1169 A L H X S+ 0 0 2 -4,-2.3 4,-1.2 2,-0.2 -2,-0.2 0.930 111.6 51.0 -63.2 -45.4 15.4 27.9 14.5 73 1170 A I H >X S+ 0 0 2 -4,-2.8 3,-0.8 1,-0.2 4,-0.7 0.968 115.2 40.0 -56.3 -56.7 14.1 24.8 16.4 74 1171 A I H >< S+ 0 0 11 -4,-2.3 3,-0.9 1,-0.2 11,-0.3 0.884 109.6 60.0 -66.8 -35.4 17.3 22.8 16.2 75 1172 A S H 3< S+ 0 0 39 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.784 103.3 52.2 -64.7 -26.0 19.7 25.7 16.8 76 1173 A K H << S+ 0 0 73 -4,-1.2 -1,-0.2 -3,-0.8 2,-0.2 0.615 87.4 95.4 -92.6 -9.7 18.2 26.4 20.2 77 1174 A F << - 0 0 16 -3,-0.9 8,-0.2 -4,-0.7 2,-0.2 -0.544 50.1-171.5 -74.3 149.1 18.5 22.9 21.7 78 1175 A N + 0 0 112 -2,-0.2 2,-0.3 6,-0.1 5,-0.1 -0.738 36.1 114.1-141.4 85.8 21.5 22.1 23.8 79 1176 A H > - 0 0 23 3,-0.3 3,-1.6 -2,-0.2 60,-0.1 -0.978 64.3-126.9-158.0 143.4 21.7 18.4 24.7 80 1177 A Q T 3 S+ 0 0 107 -2,-0.3 4,-0.1 1,-0.3 59,-0.1 0.698 110.0 52.7 -67.3 -20.6 24.1 15.5 23.9 81 1178 A N T 3 S+ 0 0 8 89,-0.1 90,-2.8 57,-0.1 2,-0.4 0.134 98.1 73.8-103.6 21.5 21.2 13.3 22.7 82 1179 A I B < S-g 171 0C 2 -3,-1.6 -3,-0.3 88,-0.3 90,-0.2 -0.999 96.4-103.9-126.8 130.5 19.9 15.9 20.2 83 1180 A V - 0 0 5 88,-2.1 2,-0.1 -2,-0.4 -6,-0.1 -0.212 39.6-120.5 -54.7 135.4 21.9 16.4 17.0 84 1181 A R - 0 0 99 -4,-0.1 16,-2.7 -6,-0.1 2,-0.6 -0.444 11.8-135.5 -74.2 151.9 23.9 19.7 17.1 85 1182 A C E - F 0 99B 31 -11,-0.3 14,-0.3 -8,-0.2 3,-0.1 -0.952 14.2-172.1-107.7 113.3 23.4 22.5 14.6 86 1183 A I E - 0 0 53 12,-1.6 2,-0.3 -2,-0.6 13,-0.2 0.843 59.1 -82.6 -68.5 -37.2 26.8 23.8 13.4 87 1184 A G E - F 0 98B 1 11,-1.5 11,-2.8 -3,-0.1 2,-0.3 -0.981 44.5 -88.1 163.5-161.1 25.0 26.7 11.6 88 1185 A V E -bF 18 97B 1 -71,-2.7 -69,-3.2 -2,-0.3 2,-0.3 -0.924 4.5-152.1-137.7 160.3 23.2 27.6 8.4 89 1186 A S E + F 0 96B 0 7,-2.5 7,-2.4 -2,-0.3 3,-0.2 -0.778 38.7 145.0-131.3 88.0 23.8 28.9 4.9 90 1187 A L + 0 0 17 -2,-0.3 5,-0.1 5,-0.2 -1,-0.1 0.545 58.4 70.7-100.1 -10.6 20.5 30.7 4.0 91 1188 A Q S S+ 0 0 156 -3,-0.1 2,-0.3 3,-0.1 -1,-0.1 0.295 97.8 52.1 -95.5 6.7 22.0 33.6 2.0 92 1189 A S S S- 0 0 49 -3,-0.2 4,-0.2 2,-0.1 -3,-0.1 -0.943 95.6 -79.5-134.0 159.0 23.0 31.3 -1.0 93 1190 A L S S+ 0 0 93 -2,-0.3 2,-0.1 2,-0.1 -3,-0.1 -0.881 108.6 35.4-112.5 140.3 20.9 28.9 -3.0 94 1191 A P S S- 0 0 42 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.612 98.1-127.4 -69.5 153.9 20.1 26.1 -2.4 95 1192 A R - 0 0 62 -40,-0.4 -40,-2.1 -2,-0.1 2,-0.4 -0.417 26.3-155.5 -73.4 145.2 19.7 26.9 1.3 96 1193 A F E -EF 54 89B 9 -7,-2.4 -7,-2.5 -42,-0.2 2,-0.4 -0.937 19.1-160.6-121.5 144.5 21.6 24.7 3.8 97 1194 A I E -EF 53 88B 1 -44,-2.3 -44,-2.8 -2,-0.4 2,-0.6 -0.997 23.1-146.0-113.6 132.0 21.2 23.7 7.4 98 1195 A L E +EF 52 87B 0 -11,-2.8 -12,-1.6 -2,-0.4 -11,-1.5 -0.879 25.7 174.1-103.7 118.6 24.5 22.3 8.8 99 1196 A L E -EF 51 85B 21 -48,-3.3 -48,-2.8 -2,-0.6 -14,-0.2 -0.786 41.5 -75.9-124.5 161.5 24.2 19.6 11.4 100 1197 A E E -E 50 0B 41 -16,-2.7 2,-0.4 -2,-0.3 -50,-0.2 -0.339 55.0-116.9 -49.4 121.5 26.2 17.1 13.4 101 1198 A L - 0 0 39 -52,-0.8 2,-0.8 -60,-0.1 -1,-0.1 -0.574 23.9-159.4 -67.1 125.6 27.3 14.3 11.0 102 1199 A M > - 0 0 16 -2,-0.4 3,-2.0 1,-0.1 58,-0.2 -0.833 8.1-174.5-111.6 90.9 25.7 11.0 12.3 103 1200 A A T 3 S+ 0 0 72 58,-1.5 59,-0.3 -2,-0.8 58,-0.2 0.677 78.3 61.3 -66.7 -20.7 27.9 8.4 10.6 104 1201 A G T 3 S- 0 0 16 56,-2.0 -1,-0.3 1,-0.2 57,-0.2 0.475 97.4-146.5 -81.8 -5.2 25.8 5.5 11.8 105 1202 A G E < -H 160 0C 31 -3,-2.0 55,-2.4 55,-0.5 -1,-0.2 -0.156 45.3 -14.8 67.6-164.3 22.7 6.7 9.9 106 1203 A D E > -H 159 0C 45 53,-0.2 4,-2.1 1,-0.1 53,-0.3 -0.431 59.5-125.5 -78.9 151.3 19.1 6.3 11.1 107 1204 A L H > S+ 0 0 0 51,-2.6 4,-2.6 48,-0.8 49,-0.2 0.842 106.2 54.4 -64.5 -39.6 18.2 3.9 13.9 108 1205 A K H > S+ 0 0 38 47,-0.6 4,-2.2 50,-0.3 -1,-0.2 0.951 112.2 44.0 -61.4 -49.9 15.5 2.0 11.9 109 1206 A S H > S+ 0 0 43 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.879 112.9 52.8 -61.2 -41.4 18.0 1.2 9.1 110 1207 A F H X S+ 0 0 12 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.926 109.0 48.4 -59.8 -47.9 20.7 0.3 11.6 111 1208 A L H < S+ 0 0 1 -4,-2.6 4,-0.3 1,-0.2 -2,-0.2 0.923 114.5 45.6 -61.8 -44.0 18.5 -2.1 13.5 112 1209 A R H >< S+ 0 0 110 -4,-2.2 3,-0.6 1,-0.2 -1,-0.2 0.896 118.0 42.8 -65.0 -41.2 17.4 -3.9 10.2 113 1210 A E H 3< S+ 0 0 141 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.722 115.9 47.4 -80.4 -20.9 20.9 -4.0 8.8 114 1211 A T T 3< S+ 0 0 30 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.180 76.5 137.1-111.5 15.1 22.7 -5.1 12.0 115 1212 A R < - 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0 0 58 -2,-0.4 3,-1.3 -55,-0.0 4,-0.8 -0.826 66.0 -83.5-146.3-176.6 1.2 16.9 26.0 204 1308 A S H 3> S+ 0 0 28 1,-0.3 4,-1.7 -2,-0.2 3,-0.2 0.790 126.7 66.7 -68.3 -22.8 4.5 15.3 27.1 205 1309 A K H 3> S+ 0 0 50 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.698 91.0 64.3 -70.3 -15.4 2.5 12.2 27.9 206 1310 A T H <> S+ 0 0 1 -3,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.933 103.0 46.4 -64.4 -48.2 2.0 12.1 24.1 207 1311 A D H X S+ 0 0 3 -4,-0.8 4,-2.7 1,-0.2 -2,-0.2 0.840 105.8 60.1 -65.7 -34.6 5.8 11.6 23.7 208 1312 A T H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.947 106.8 47.0 -52.8 -50.1 5.7 8.9 26.5 209 1313 A W H X S+ 0 0 0 -4,-1.6 4,-1.5 1,-0.2 3,-0.4 0.954 112.5 48.4 -56.7 -51.9 3.3 6.9 24.4 210 1314 A S H X S+ 0 0 1 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.884 106.6 57.4 -57.5 -40.0 5.4 7.3 21.3 211 1315 A F H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.879 101.7 56.2 -61.3 -36.9 8.5 6.3 23.2 212 1316 A G H X S+ 0 0 0 -4,-1.8 4,-1.9 -3,-0.4 -1,-0.2 0.917 107.9 47.5 -56.9 -44.0 6.8 3.0 24.1 213 1317 A V H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.905 110.2 52.7 -64.6 -42.5 6.3 2.3 20.4 214 1318 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 -61,-0.3 -2,-0.2 0.906 105.6 54.6 -55.9 -43.9 10.0 3.3 19.8 215 1319 A L H X S+ 0 0 2 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.918 107.7 49.8 -58.0 -43.8 11.0 0.8 22.5 216 1320 A W H X S+ 0 0 16 -4,-1.9 4,-2.0 1,-0.2 7,-0.2 0.938 109.6 51.0 -57.7 -46.9 9.1 -1.9 20.6 217 1321 A E H <>S+ 0 0 0 -4,-2.4 5,-3.0 1,-0.2 6,-0.4 0.898 112.6 47.7 -57.0 -43.2 10.9 -0.9 17.3 218 1322 A I H ><5S+ 0 0 0 -4,-2.7 3,-1.6 3,-0.2 -2,-0.2 0.966 114.4 42.8 -63.2 -53.7 14.2 -1.2 19.1 219 1323 A F H 3<5S+ 0 0 3 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.683 111.8 54.8 -76.2 -15.3 13.6 -4.6 20.7 220 1324 A S T 3<5S- 0 0 12 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.478 115.0-118.3 -82.7 -7.1 12.1 -6.0 17.5 221 1325 A L T < 5S- 0 0 6 -3,-1.6 -3,-0.2 -4,-0.3 -2,-0.1 0.898 76.9 -37.2 62.5 43.8 15.2 -5.0 15.7 222 1326 A G S S- 0 0 6 1,-0.1 3,-2.2 19,-0.1 8,-0.1 0.968 93.8-128.9 49.6 66.5 1.5 -3.4 14.6 227 1331 A P T 3 S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.161 82.9 2.8 -45.8 126.5 2.5 -6.1 12.2 228 1332 A S T 3 S+ 0 0 130 1,-0.2 2,-0.4 -3,-0.1 -2,-0.1 0.427 102.6 119.1 77.5 3.5 -0.0 -6.5 9.3 229 1333 A K < - 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0 0 69 -3,-1.4 6,-0.1 1,-0.1 -3,-0.1 -0.400 56.7-127.6 -62.7 139.6 -1.6 3.3 29.5 264 1368 A H S S+ 0 0 87 4,-0.1 -69,-0.2 -71,-0.1 -1,-0.1 0.915 94.3 60.3 -54.8 -47.4 -4.9 4.6 28.2 265 1369 A Q S > S- 0 0 88 1,-0.1 3,-1.7 -71,-0.1 4,-0.5 -0.735 79.3-141.1 -88.4 129.4 -5.0 7.6 30.4 266 1370 A P G > S+ 0 0 24 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.839 100.9 62.1 -56.3 -36.1 -2.1 10.1 30.0 267 1371 A E G 3 S+ 0 0 128 1,-0.3 -3,-0.0 -3,-0.0 -2,-0.0 0.732 100.9 53.9 -61.0 -24.8 -2.0 10.6 33.8 268 1372 A D G < S+ 0 0 97 -3,-1.7 -1,-0.3 2,-0.1 -4,-0.1 0.547 89.7 94.2 -89.9 -7.5 -1.2 6.9 34.3 269 1373 A R S < S- 0 0 5 -3,-1.4 -8,-0.2 -4,-0.5 2,-0.1 -0.601 81.9-110.1 -82.2 145.8 1.8 7.0 31.9 270 1374 A P - 0 0 13 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.447 23.5-125.2 -73.1 147.3 5.3 7.5 33.4 271 1375 A N > - 0 0 61 -2,-0.1 4,-2.0 1,-0.1 3,-0.2 -0.233 38.3 -95.6 -73.4 175.3 7.3 10.7 32.8 272 1376 A F H > S+ 0 0 1 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.788 121.6 61.8 -74.6 -23.5 10.8 10.4 31.4 273 1377 A A H > S+ 0 0 39 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.933 109.5 43.5 -60.5 -43.3 12.6 10.4 34.7 274 1378 A I H > S+ 0 0 49 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.905 111.2 53.8 -70.1 -41.6 10.7 7.3 35.6 275 1379 A I H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.937 109.7 48.5 -56.3 -45.4 11.3 5.7 32.2 276 1380 A L H X S+ 0 0 32 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.909 109.2 52.8 -63.2 -41.4 15.1 6.3 32.6 277 1381 A E H X S+ 0 0 128 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.917 112.1 45.7 -56.4 -44.1 15.0 4.7 36.1 278 1382 A R H X S+ 0 0 100 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.904 110.7 51.7 -70.5 -39.6 13.3 1.7 34.7 279 1383 A I H X S+ 0 0 2 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.912 110.0 51.2 -62.3 -41.5 15.7 1.4 31.7 280 1384 A E H X S+ 0 0 101 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.931 108.0 51.4 -60.3 -46.0 18.6 1.6 34.2 281 1385 A Y H X S+ 0 0 184 -4,-2.2 4,-1.3 1,-0.2 3,-0.5 0.934 110.8 48.3 -58.0 -45.5 17.1 -1.2 36.3 282 1386 A C H < S+ 0 0 5 -4,-2.3 7,-0.4 1,-0.2 3,-0.3 0.874 108.6 56.1 -58.7 -38.4 16.8 -3.4 33.2 283 1387 A T H < S+ 0 0 12 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.780 110.4 42.7 -68.2 -29.8 20.4 -2.5 32.3 284 1388 A Q H < S+ 0 0 127 -4,-1.6 -1,-0.2 -3,-0.5 -2,-0.2 0.646 90.9 99.2 -91.6 -15.3 21.7 -3.8 35.6 285 1389 A D >X - 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0 0 110 -180,-0.1 2,-0.4 -3,-0.1 -178,-0.2 -0.894 15.8-139.6 -98.6 125.0 19.1 -14.8 14.8 296 1400 A E - 0 0 50 -180,-3.0 2,-0.1 -2,-0.5 0, 0.0 -0.721 29.8-112.9 -83.7 130.2 17.6 -13.9 11.5 297 1401 A Y 0 0 215 -2,-0.4 -1,-0.1 -180,-0.2 -180,-0.0 -0.450 360.0 360.0 -72.8 137.0 18.3 -16.7 9.0 298 1402 A G 0 0 77 -2,-0.1 -181,-0.0 -3,-0.0 -3,-0.0 -0.982 360.0 360.0-166.0 360.0 20.7 -15.9 6.2