==== 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 TRANSFERASE 20-JUN-12 4FNW . COMPND 2 MOLECULE: ALK TYROSINE KINASE RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.A.WHITTINGTON,L.F.EPSTEIN,H.CHEN . 304 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14682.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 195 64.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 12.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 12 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 31.2 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 1 0 2 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 . 0 1 2 1 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 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 1084 A R 0 0 185 0, 0.0 2,-0.2 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -95.6 21.0 35.8 -1.9 2 1085 A T - 0 0 81 1,-0.1 2,-0.4 95,-0.1 95,-0.1 -0.528 360.0-110.7 -76.4 135.2 19.0 36.8 1.2 3 1086 A S > - 0 0 7 93,-0.3 4,-2.3 -2,-0.2 5,-0.2 -0.521 22.6-163.4 -74.4 121.4 15.5 35.2 1.3 4 1087 A T H > S+ 0 0 98 -2,-0.4 4,-2.8 2,-0.2 5,-0.2 0.880 92.6 50.7 -69.9 -38.9 12.7 37.7 0.8 5 1088 A I H > S+ 0 0 30 2,-0.2 4,-2.1 1,-0.2 5,-0.5 0.910 114.3 43.5 -65.6 -41.8 10.1 35.3 2.2 6 1089 A M H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.890 118.2 45.5 -69.1 -40.0 12.2 34.6 5.3 7 1090 A T H < S+ 0 0 74 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.856 116.7 44.5 -71.0 -37.8 13.0 38.3 5.7 8 1091 A D H < S+ 0 0 119 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.960 123.3 33.5 -74.7 -53.8 9.4 39.5 5.1 9 1092 A Y H < S- 0 0 144 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.937 82.7-179.0 -62.6 -49.0 7.6 36.9 7.3 10 1093 A N < - 0 0 69 -4,-1.8 -3,-0.1 -5,-0.5 2,-0.1 0.931 19.9-149.7 45.2 62.6 10.6 36.9 9.8 11 1094 A P - 0 0 24 0, 0.0 11,-0.4 0, 0.0 2,-0.3 -0.395 1.4-139.4 -66.3 133.7 9.0 34.3 12.1 12 1095 A N - 0 0 95 9,-0.1 2,-0.4 -2,-0.1 9,-0.2 -0.703 14.5-158.2 -85.4 143.9 9.8 34.4 15.7 13 1096 A Y E -A 20 0A 3 7,-2.8 7,-3.0 -2,-0.3 2,-0.4 -0.993 2.4-159.4-125.5 128.9 10.4 31.1 17.5 14 1097 A S E +A 19 0A 56 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.918 18.3 160.2-113.6 135.2 10.1 30.7 21.3 15 1098 A F E > S-A 18 0A 21 3,-2.4 3,-1.6 -2,-0.4 138,-0.1 -0.977 70.1 -2.6-149.2 132.0 11.7 27.8 23.3 16 1099 A A T 3 S- 0 0 56 136,-0.5 3,-0.1 -2,-0.3 137,-0.1 0.879 129.8 -55.1 54.8 40.8 12.4 27.7 27.0 17 1100 A G T 3 S+ 0 0 83 1,-0.2 2,-0.4 0, 0.0 -1,-0.3 0.589 116.8 106.0 71.4 13.1 11.1 31.3 27.5 18 1101 A K E < -A 15 0A 159 -3,-1.6 -3,-2.4 2,-0.0 2,-0.4 -0.979 58.3-144.5-128.8 138.9 13.5 32.8 24.9 19 1102 A T E +A 14 0A 77 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.856 19.0 180.0-107.4 133.7 12.6 34.1 21.5 20 1103 A S E -A 13 0A 4 -7,-3.0 -7,-2.8 -2,-0.4 2,-0.3 -0.869 5.5-170.7-127.7 162.7 14.8 33.8 18.5 21 1104 A S >> - 0 0 15 -2,-0.3 3,-2.4 -9,-0.2 4,-0.5 -0.836 49.8 -77.6-140.9 177.8 14.7 34.7 14.8 22 1105 A I G >4 S+ 0 0 39 -11,-0.4 3,-1.5 1,-0.3 -15,-0.1 0.854 124.5 65.1 -49.2 -36.3 16.6 34.2 11.6 23 1106 A S G 34 S+ 0 0 97 1,-0.3 -1,-0.3 3,-0.0 4,-0.1 0.719 95.3 58.7 -63.3 -19.0 19.2 36.8 12.8 24 1107 A D G <4 S+ 0 0 85 -3,-2.4 -1,-0.3 2,-0.1 -2,-0.2 0.625 82.8 100.7 -83.9 -16.3 20.2 34.5 15.7 25 1108 A L S << S- 0 0 17 -3,-1.5 2,-1.0 -4,-0.5 53,-0.1 -0.442 83.2-113.2 -69.3 146.3 21.2 31.6 13.5 26 1109 A K - 0 0 155 -2,-0.1 68,-2.8 69,-0.0 2,-0.5 -0.709 31.0-152.1 -83.9 103.4 25.0 31.1 12.9 27 1110 A E B -b 94 0B 63 -2,-1.0 68,-0.2 66,-0.2 66,-0.0 -0.662 5.9-157.3 -80.9 123.9 25.5 31.9 9.2 28 1111 A V - 0 0 19 66,-3.3 5,-0.1 -2,-0.5 65,-0.0 -0.884 28.5-106.8-101.9 127.3 28.5 30.1 7.8 29 1112 A P > - 0 0 64 0, 0.0 3,-2.0 0, 0.0 4,-0.2 -0.270 23.0-130.7 -58.1 136.0 30.1 31.6 4.7 30 1113 A R G > S+ 0 0 57 1,-0.3 3,-2.2 2,-0.2 65,-0.0 0.864 104.7 64.8 -58.2 -36.4 29.3 29.5 1.7 31 1114 A K G 3 S+ 0 0 173 1,-0.3 -1,-0.3 18,-0.0 -3,-0.0 0.732 97.0 57.6 -57.8 -23.7 32.9 29.5 0.6 32 1115 A N G < S+ 0 0 42 -3,-2.0 18,-2.0 18,-0.1 2,-0.5 0.476 92.9 83.2 -85.0 -1.3 33.8 27.5 3.8 33 1116 A I E < -C 49 0B 16 -3,-2.2 2,-0.4 -4,-0.2 16,-0.2 -0.911 53.3-178.7-113.5 124.9 31.5 24.6 3.0 34 1117 A T E -C 48 0B 68 14,-2.4 14,-2.1 -2,-0.5 2,-0.4 -0.987 20.9-138.7-122.1 128.1 32.4 21.7 0.7 35 1118 A L E +C 47 0B 73 -2,-0.4 12,-0.3 12,-0.2 3,-0.1 -0.718 21.6 177.8 -83.8 135.2 30.0 18.9 -0.2 36 1119 A I E - 0 0 74 10,-3.3 2,-0.3 -2,-0.4 11,-0.2 0.847 56.4 -19.1-104.5 -52.7 31.8 15.5 -0.2 37 1120 A R E -C 46 0B 139 9,-1.1 9,-3.1 0, 0.0 -1,-0.4 -0.989 64.8 -97.8-157.9 153.6 29.1 12.8 -1.0 38 1121 A G E +C 45 0B 50 -2,-0.3 7,-0.2 7,-0.2 5,-0.0 -0.394 27.8 177.9 -68.6 151.6 25.4 12.2 -0.9 39 1122 A L 0 0 91 5,-2.4 6,-0.2 1,-0.4 -1,-0.1 0.366 360.0 360.0-131.2 -4.7 23.9 10.4 2.0 40 1123 A G 0 0 77 4,-0.9 4,-2.1 0, 0.0 -1,-0.4 -0.996 360.0 360.0 132.5 360.0 20.1 10.4 1.2 41 ! 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 42 1128 A G 0 0 86 0, 0.0 2,-0.3 0, 0.0 19,-0.1 0.000 360.0 360.0 360.0-150.2 15.3 17.9 -0.0 43 1129 A E - 0 0 89 17,-0.5 17,-2.6 15,-0.0 2,-0.4 -0.886 360.0-129.5-139.8 165.8 18.5 15.9 0.3 44 1130 A V E - D 0 59B 49 -4,-2.1 -5,-2.4 -2,-0.3 -4,-0.9 -0.956 21.7-174.5-123.8 138.9 21.4 15.3 2.7 45 1131 A Y E -CD 38 58B 50 13,-2.3 13,-3.4 -2,-0.4 2,-0.4 -0.919 30.2-117.2-126.1 152.4 25.1 15.4 2.1 46 1132 A E E +CD 37 57B 30 -9,-3.1 -10,-3.3 -2,-0.3 -9,-1.1 -0.783 50.2 168.5 -76.8 135.1 28.3 14.7 3.9 47 1133 A G E -CD 35 56B 0 9,-3.1 9,-2.7 -2,-0.4 2,-0.3 -0.844 29.8-136.8-139.4 173.2 30.2 18.0 4.0 48 1134 A Q E -CD 34 55B 52 -14,-2.1 -14,-2.4 -2,-0.3 2,-0.4 -0.996 9.5-154.4-135.8 146.0 33.1 19.8 5.6 49 1135 A V E CD 33 54B 16 5,-2.5 5,-3.0 -2,-0.3 -16,-0.2 -0.973 360.0 360.0-119.0 132.0 33.4 23.3 7.0 50 1136 A S 0 0 97 -18,-2.0 -18,-0.1 -2,-0.4 -19,-0.0 -0.249 360.0 360.0-112.6 360.0 36.7 25.2 7.2 51 ! 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 52 1143 A S 0 0 162 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 95.4 41.4 19.6 9.8 53 1144 A P - 0 0 54 0, 0.0 2,-0.4 0, 0.0 -3,-0.2 -0.265 360.0 -98.9 -67.8 160.6 38.0 20.8 8.6 54 1145 A L E -D 49 0B 96 -5,-3.0 -5,-2.5 1,-0.0 2,-0.4 -0.687 34.8-134.0 -81.4 128.2 34.8 20.1 10.6 55 1146 A Q E +D 48 0B 73 -2,-0.4 52,-0.7 -7,-0.2 2,-0.3 -0.725 36.7 168.3 -85.7 130.4 32.9 17.1 9.2 56 1147 A V E -DE 47 106B 0 -9,-2.7 -9,-3.1 -2,-0.4 2,-0.4 -0.837 39.8-118.4-135.3 164.8 29.1 17.8 8.9 57 1148 A A E -DE 46 105B 11 48,-2.9 48,-3.3 -2,-0.3 2,-0.6 -0.927 31.5-151.3 -99.2 137.4 25.8 16.6 7.5 58 1149 A V E -DE 45 104B 0 -13,-3.4 -13,-2.3 -2,-0.4 2,-0.5 -0.954 6.5-163.1-116.0 112.7 24.4 19.2 5.1 59 1150 A K E -DE 44 103B 51 44,-3.0 44,-2.2 -2,-0.6 2,-0.3 -0.859 17.0-154.3 -93.5 131.6 20.6 19.3 4.7 60 1151 A T E - E 0 102B 7 -17,-2.6 -17,-0.5 -2,-0.5 42,-0.2 -0.796 13.0-140.2-113.0 146.4 19.6 21.2 1.5 61 1152 A L - 0 0 11 40,-2.4 40,-0.4 -2,-0.3 4,-0.1 -0.917 33.9-115.7 -96.0 124.8 16.4 23.1 0.6 62 1153 A P - 0 0 51 0, 0.0 39,-0.1 0, 0.0 7,-0.0 -0.371 13.7-136.2 -57.9 137.0 15.4 22.5 -3.1 63 1154 A E S S+ 0 0 124 1,-0.2 2,-1.0 -2,-0.0 -2,-0.0 0.810 99.9 65.5 -65.1 -29.6 15.6 25.7 -5.1 64 1155 A V S S+ 0 0 135 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.821 82.2 118.0 -92.2 95.5 12.3 24.8 -6.6 65 1156 A C - 0 0 40 -2,-1.0 2,-0.1 -4,-0.1 -4,-0.0 -0.967 61.6 -97.8-154.9 163.4 10.1 25.0 -3.6 66 1157 A S > - 0 0 55 -2,-0.3 4,-1.8 1,-0.1 5,-0.1 -0.319 35.8-108.2 -82.2 167.8 7.1 26.9 -2.2 67 1158 A E H > S+ 0 0 125 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.887 124.1 54.0 -57.3 -42.2 7.1 29.9 0.2 68 1159 A Q H > S+ 0 0 126 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.874 104.5 53.1 -59.7 -43.1 5.8 27.4 2.8 69 1160 A D H > S+ 0 0 68 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.889 109.1 50.7 -59.6 -42.2 8.7 25.1 2.2 70 1161 A E H X S+ 0 0 24 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.933 112.0 45.0 -60.5 -50.0 11.1 28.0 2.7 71 1162 A L H X S+ 0 0 4 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.901 111.1 55.0 -64.6 -37.0 9.4 29.0 6.0 72 1163 A D H X S+ 0 0 17 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.909 107.9 49.0 -59.6 -42.7 9.4 25.3 7.1 73 1164 A F H X S+ 0 0 7 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.907 111.2 49.7 -65.5 -43.5 13.2 25.1 6.5 74 1165 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.934 109.5 50.9 -59.4 -47.3 13.8 28.2 8.5 75 1166 A M H X S+ 0 0 2 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.888 107.3 53.7 -63.6 -37.3 11.7 27.0 11.4 76 1167 A E H X S+ 0 0 5 -4,-2.1 4,-2.4 2,-0.2 5,-0.3 0.914 109.2 49.6 -58.0 -45.2 13.6 23.6 11.4 77 1168 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.930 111.4 47.9 -60.3 -46.6 16.8 25.6 11.7 78 1169 A L H X S+ 0 0 0 -4,-2.4 4,-1.2 2,-0.2 -2,-0.2 0.925 112.1 50.3 -61.7 -44.4 15.5 27.7 14.6 79 1170 A I H >X S+ 0 0 1 -4,-2.6 4,-0.9 1,-0.2 3,-0.8 0.971 115.5 39.2 -60.3 -55.1 14.2 24.6 16.5 80 1171 A I H >< S+ 0 0 2 -4,-2.4 3,-0.5 1,-0.2 11,-0.3 0.871 109.8 59.9 -69.5 -34.0 17.4 22.6 16.3 81 1172 A S H 3< S+ 0 0 43 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.803 108.2 46.1 -63.7 -26.4 19.7 25.5 16.9 82 1173 A K H << S+ 0 0 94 -4,-1.2 2,-0.3 -3,-0.8 -1,-0.2 0.605 90.9 93.1 -95.0 -13.8 18.1 26.2 20.3 83 1174 A L << - 0 0 11 -4,-0.9 2,-0.3 -3,-0.5 8,-0.2 -0.636 55.3-172.1 -77.0 139.8 18.0 22.6 21.5 84 1175 A N + 0 0 106 -2,-0.3 2,-0.3 6,-0.1 5,-0.1 -0.770 30.9 113.7-140.9 89.1 21.1 21.9 23.7 85 1176 A H > - 0 0 27 3,-0.3 3,-1.7 -2,-0.3 60,-0.1 -0.979 64.8-123.0-158.3 145.5 21.6 18.2 24.7 86 1177 A Q T 3 S+ 0 0 112 -2,-0.3 4,-0.1 1,-0.3 59,-0.1 0.683 111.7 53.3 -66.7 -18.4 24.1 15.5 24.0 87 1178 A N T 3 S+ 0 0 8 89,-0.1 90,-2.7 2,-0.1 2,-0.4 0.106 97.3 76.7-104.2 24.5 21.3 13.2 22.7 88 1179 A I B < S-g 177 0C 2 -3,-1.7 -3,-0.3 88,-0.3 90,-0.2 -1.000 95.0-103.8-130.9 129.7 19.9 15.7 20.2 89 1180 A V - 0 0 5 88,-2.2 2,-0.1 -2,-0.4 -6,-0.1 -0.253 40.1-123.3 -56.2 132.7 21.8 16.3 16.9 90 1181 A R - 0 0 94 -4,-0.1 16,-2.7 -6,-0.1 2,-0.6 -0.447 8.3-137.5 -76.2 149.8 23.8 19.6 17.0 91 1182 A C E - F 0 105B 26 -11,-0.3 14,-0.3 -8,-0.2 3,-0.1 -0.953 12.8-170.2-106.1 114.8 23.3 22.3 14.5 92 1183 A I E - 0 0 52 12,-1.7 2,-0.3 -2,-0.6 13,-0.2 0.829 58.5 -79.3 -70.2 -33.9 26.7 23.7 13.5 93 1184 A G E - F 0 104B 2 11,-1.4 11,-3.0 -3,-0.1 2,-0.3 -0.979 45.3 -89.6 162.0-164.1 25.0 26.5 11.7 94 1185 A V E -bF 27 103B 1 -68,-2.8 -66,-3.3 -2,-0.3 2,-0.2 -0.905 3.9-154.3-135.8 159.4 23.3 27.5 8.5 95 1186 A S E + F 0 102B 0 7,-2.5 7,-2.4 -2,-0.3 3,-0.3 -0.755 38.1 146.2-130.7 86.4 24.0 28.9 5.0 96 1187 A L + 0 0 7 -2,-0.2 -93,-0.3 5,-0.2 5,-0.1 0.516 58.0 71.2 -98.8 -7.2 20.8 30.6 4.1 97 1188 A Q S S+ 0 0 69 -95,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.321 96.6 52.7 -96.3 7.1 22.3 33.5 2.1 98 1189 A S S S- 0 0 31 -3,-0.3 4,-0.2 2,-0.1 -3,-0.1 -0.922 94.9 -79.3-134.1 161.0 23.3 31.3 -0.9 99 1190 A L S S+ 0 0 80 -2,-0.3 2,-0.1 2,-0.1 -3,-0.1 -0.915 110.0 35.2-114.7 138.1 21.3 28.9 -3.0 100 1191 A P S S- 0 0 41 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.590 98.3-129.2 -69.9 153.3 20.5 26.1 -2.4 101 1192 A R - 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