REM -------------------------------------------------------------------- 3DL0 REM 3DL0 REM STRIDE: Knowledge-based secondary structure assignment 3DL0 REM Please cite: D.Frishman & P.Argos, Proteins XX, XXX-XXX, 1995 3DL0 REM 3DL0 REM Residue accessible surface area calculation 3DL0 REM Please cite: F.Eisenhaber & P.Argos, J.Comp.Chem. 14, 1272-1280, 1993 3DL0 REM F.Eisenhaber et al., J.Comp.Chem., 1994, submitted 3DL0 REM 3DL0 REM ------------------------ General information ----------------------- 3DL0 REM 3DL0 HDR TRANSFERASE 26-JUN-08 3DL0 3DL0 CMP MOL_ID: 1; 3DL0 CMP MOLECULE: ADENYLATE KINASE; 3DL0 CMP CHAIN: A, B; 3DL0 CMP SYNONYM: ATP-AMP TRANSPHOSPHORYLASE, AK, SUPEROXIDE-INDUCIBL 3DL0 CMP 16, SOI16; 3DL0 CMP EC: 2.7.4.3; 3DL0 CMP ENGINEERED: YES 3DL0 SRC MOL_ID: 1; 3DL0 SRC ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; 3DL0 SRC ORGANISM_TAXID: 1423; 3DL0 SRC GENE: ADK; 3DL0 SRC EXPRESSION_SYSTEM: ESCHERICHIA COLI; 3DL0 SRC EXPRESSION_SYSTEM_TAXID: 562; 3DL0 SRC EXPRESSION_SYSTEM_STRAIN: BL21(DE3); 3DL0 SRC EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; 3DL0 SRC EXPRESSION_SYSTEM_PLASMID: PET11 3DL0 AUT R.M.BANNEN,C.M.BIANCHETTI,C.A.BINGMAN,J.G.MCCOY 3DL0 REM 3DL0 REM -------------------- Secondary structure summary ------------------- 3DL0 REM 3DL0 CHN /home/proj/stride/tmp/tmp8H3A7Kpdb A 3DL0 REM 3DL0 REM . . . . . 3DL0 SEQ 1 MNLVLMGLPGAGKGTQGERIVEKYGIPHISTGDMFRAAMKEETPLGLEAK 50 3DL0 STR EEEEE TTTT HHHHHHHHHHHTTT EEEHHHHHHHHHHH HHHHHHH 3DL0 REM 3DL0 REM . . . . . 3DL0 SEQ 51 SYIDKGELVPDEVTIGIVKERLGKDDCERGFLLDGFPRTVAQAEALEEIL 100 3DL0 STR HHHH HHHHHHHHHHHHH GGGTTTEEEETTTT HHHHHHHHHHH 3DL0 REM 3DL0 REM . . . . . 3DL0 SEQ 101 EEMGKPIDYVINIQVDKDVLMERLTGRRICSVCGTTYHLVFNPPKTPGIC 150 3DL0 STR HHH TTEEEEEE GGGHHHHHHHEEEETTTT EEETTTBTTTTTTBT 3DL0 REM 3DL0 REM . . . . . 3DL0 SEQ 151 DKDGGELYQRADDNEETVTKRLEVNMKQTAPLLDFYDEKGYLVNVNGQQD 200 3DL0 STR TTTT BEE TTTT HHHHHHHHHHHHHHHHHHHHHHHHH EEEEETTT 3DL0 REM 3DL0 REM . 3DL0 SEQ 201 IQDVYADLKVLLGGLK 216 3DL0 STR HHHHHHHHHHHHGGG 3DL0 REM 3DL0 CHN /home/proj/stride/tmp/tmp8H3A7Kpdb B 3DL0 REM 3DL0 REM . . . . . 3DL0 SEQ 1 MNLVLMGLPGAGKGTQGERIVEKYGIPHISTGDMFRAAMKEETPLGLEAK 50 3DL0 STR EEEEE TTTT HHHHHHHHHHHTTT EEEHHHHHHHHHHH HHHHHHH 3DL0 REM 3DL0 REM . . . . . 3DL0 SEQ 51 SYIDKGELVPDEVTIGIVKERLGKDDCERGFLLDGFPRTVAQAEALEEIL 100 3DL0 STR HHHHH HHHHHHHHHHHHH GGGTTTEEEETTTT HHHHHHHHHHH 3DL0 REM 3DL0 REM . . . . . 3DL0 SEQ 101 EEMGKPIDYVINIQVDKDVLMERLTGRRICSVCGTTYHLVFNPPKTPGIC 150 3DL0 STR HHH EEEEEE GGGHHHHHHHEEEETTTT EEETTTBTTTBTTBT 3DL0 REM 3DL0 REM . . . . . 3DL0 SEQ 151 DKDGGELYQRADDNEETVTKRLEVNMKQTAPLLDFYDEKGYLVNVNGQQD 200 3DL0 STR TTTT BEE TTTT HHHHHHHHHHHHHHHHHHHHHHHHH EEEEETTT 3DL0 REM 3DL0 REM . 3DL0 SEQ 201 IQDVYADLKVLLGGLK 216 3DL0 STR HHHHHHHHHHHHH 3DL0 REM 3DL0 REM 3DL0 REM 3DL0 LOC AlphaHelix LYS 13 A LYS 23 A 3DL0 LOC AlphaHelix THR 31 A GLU 41 A 3DL0 LOC AlphaHelix PRO 44 A ASP 54 A 3DL0 LOC AlphaHelix ASP 61 A GLY 73 A 3DL0 LOC AlphaHelix VAL 90 A MET 103 A 3DL0 LOC AlphaHelix LEU 120 A GLY 126 A 3DL0 LOC AlphaHelix GLU 165 A LYS 189 A 3DL0 LOC AlphaHelix ILE 201 A LEU 212 A 3DL0 LOC AlphaHelix LYS 13 B LYS 23 B 3DL0 LOC AlphaHelix THR 31 B GLU 41 B 3DL0 LOC AlphaHelix PRO 44 B LYS 55 B 3DL0 LOC AlphaHelix ASP 61 B GLY 73 B 3DL0 LOC AlphaHelix VAL 90 B MET 103 B 3DL0 LOC AlphaHelix LEU 120 B GLY 126 B 3DL0 LOC AlphaHelix GLU 165 B LYS 189 B 3DL0 LOC AlphaHelix ILE 201 B GLY 213 B 3DL0 LOC 310Helix ASP 75 A CYS 77 A 3DL0 LOC 310Helix LYS 117 A VAL 119 A 3DL0 LOC 310Helix GLY 213 A LEU 215 A 3DL0 LOC 310Helix ASP 75 B CYS 77 B 3DL0 LOC 310Helix LYS 117 B VAL 119 B 3DL0 LOC Strand ASN 2 A MET 6 A 3DL0 LOC Strand HIS 28 A SER 30 A 3DL0 LOC Strand PHE 81 A ASP 84 A 3DL0 LOC Strand TYR 109 A GLN 114 A 3DL0 LOC Strand ARG 127 A CYS 130 A 3DL0 LOC Strand THR 136 A HIS 138 A 3DL0 LOC Strand LEU 157 A TYR 158 A 3DL0 LOC Strand LEU 192 A ASN 196 A 3DL0 LOC Strand ASN 2 B MET 6 B 3DL0 LOC Strand HIS 28 B SER 30 B 3DL0 LOC Strand PHE 81 B ASP 84 B 3DL0 LOC Strand TYR 109 B GLN 114 B 3DL0 LOC Strand ARG 127 B CYS 130 B 3DL0 LOC Strand THR 136 B HIS 138 B 3DL0 LOC Strand LEU 157 B TYR 158 B 3DL0 LOC Strand LEU 192 B ASN 196 B 3DL0 LOC TurnII LEU 8 A ALA 11 A 3DL0 LOC TurnI CYS 77 A GLY 80 A 3DL0 LOC TurnIV LEU 83 A PHE 86 A 3DL0 LOC TurnIV GLY 85 A ARG 88 A 3DL0 LOC TurnVIII ILE 107 A VAL 110 A 3DL0 LOC TurnIV CYS 130 A CYS 133 A 3DL0 LOC TurnI SER 131 A GLY 134 A 3DL0 LOC TurnIV HIS 138 A PHE 141 A 3DL0 LOC TurnIV LEU 139 A ASN 142 A 3DL0 LOC TurnIV VAL 140 A PRO 143 A 3DL0 LOC TurnVIII PRO 144 A PRO 147 A 3DL0 LOC TurnII THR 146 A ILE 149 A 3DL0 LOC TurnIV CYS 150 A ASP 153 A 3DL0 LOC TurnI ASP 151 A GLY 154 A 3DL0 LOC TurnI ARG 160 A ASP 163 A 3DL0 LOC TurnIV ASN 196 A GLN 199 A 3DL0 LOC GammaInv TYR 24 A ILE 26 A 3DL0 LOC TurnII LEU 8 B ALA 11 B 3DL0 LOC TurnI CYS 77 B GLY 80 B 3DL0 LOC TurnIV LEU 83 B PHE 86 B 3DL0 LOC TurnIV GLY 85 B ARG 88 B 3DL0 LOC TurnIV CYS 130 B CYS 133 B 3DL0 LOC TurnI SER 131 B GLY 134 B 3DL0 LOC TurnIV HIS 138 B PHE 141 B 3DL0 LOC TurnIV LEU 139 B ASN 142 B 3DL0 LOC TurnIV VAL 140 B PRO 143 B 3DL0 LOC TurnVIII PRO 144 B PRO 147 B 3DL0 LOC TurnII THR 146 B ILE 149 B 3DL0 LOC TurnIV CYS 150 B ASP 153 B 3DL0 LOC TurnI ASP 151 B GLY 154 B 3DL0 LOC TurnI ARG 160 B ASP 163 B 3DL0 LOC TurnIV ASN 196 B GLN 199 B 3DL0 LOC GammaInv TYR 24 B ILE 26 B 3DL0 REM 3DL0 REM --------------- Detailed secondary structure assignment------------- 3DL0 REM 3DL0 REM |---Residue---| |--Structure--| |-Phi-| |-Psi-| |-Area-| 3DL0 ASG MET A 1 1 C Coil 360.00 98.89 23.2 3DL0 ASG ASN A 2 2 E Strand -115.49 108.34 8.8 3DL0 ASG LEU A 3 3 E Strand -127.76 147.29 0.0 3DL0 ASG VAL A 4 4 E Strand -117.02 132.25 0.0 3DL0 ASG LEU A 5 5 E Strand -102.50 128.92 0.0 3DL0 ASG MET A 6 6 E Strand -126.52 159.97 15.5 3DL0 ASG GLY A 7 7 C Coil 168.78 154.44 12.7 3DL0 ASG LEU A 8 8 T Turn -68.17 157.11 24.0 3DL0 ASG PRO A 9 9 T Turn -47.28 126.40 5.0 3DL0 ASG GLY A 10 10 T Turn 88.95 -0.60 20.8 3DL0 ASG ALA A 11 11 T Turn -66.77 -21.32 3.0 3DL0 ASG GLY A 12 12 C Coil 119.98 21.68 15.3 3DL0 ASG LYS A 13 13 H AlphaHelix -63.10 -45.66 21.4 3DL0 ASG GLY A 14 14 H AlphaHelix -67.68 -37.96 28.6 3DL0 ASG THR A 15 15 H AlphaHelix -64.79 -46.28 40.1 3DL0 ASG GLN A 16 16 H AlphaHelix -74.87 -40.76 5.6 3DL0 ASG GLY A 17 17 H AlphaHelix -58.56 -42.14 0.0 3DL0 ASG GLU A 18 18 H AlphaHelix -60.67 -39.99 103.4 3DL0 ASG ARG A 19 19 H AlphaHelix -67.91 -42.91 84.1 3DL0 ASG ILE A 20 20 H AlphaHelix -55.98 -48.74 0.0 3DL0 ASG VAL A 21 21 H AlphaHelix -77.59 -20.49 40.7 3DL0 ASG GLU A 22 22 H AlphaHelix -64.77 -38.89 166.8 3DL0 ASG LYS A 23 23 H AlphaHelix -89.37 -44.21 97.6 3DL0 ASG TYR A 24 24 T Turn -107.54 137.93 9.9 3DL0 ASG GLY A 25 25 T Turn -81.10 54.77 80.7 3DL0 ASG ILE A 26 26 T Turn -127.51 149.94 14.7 3DL0 ASG PRO A 27 27 C Coil -71.13 142.12 19.1 3DL0 ASG HIS A 28 28 E Strand -90.28 115.49 48.0 3DL0 ASG ILE A 29 29 E Strand -116.34 101.53 3.0 3DL0 ASG SER A 30 30 E Strand -109.04 119.76 10.3 3DL0 ASG THR A 31 31 H AlphaHelix -64.83 -37.87 4.4 3DL0 ASG GLY A 32 32 H AlphaHelix -58.71 -46.86 15.5 3DL0 ASG ASP A 33 33 H AlphaHelix -65.49 -41.07 81.8 3DL0 ASG MET A 34 34 H AlphaHelix -57.75 -48.42 49.6 3DL0 ASG PHE A 35 35 H AlphaHelix -64.12 -43.88 12.2 3DL0 ASG ARG A 36 36 H AlphaHelix -68.30 -34.98 64.0 3DL0 ASG ALA A 37 37 H AlphaHelix -62.94 -40.76 52.1 3DL0 ASG ALA A 38 38 H AlphaHelix -63.38 -40.01 8.7 3DL0 ASG MET A 39 39 H AlphaHelix -66.07 -44.22 35.1 3DL0 ASG LYS A 40 40 H AlphaHelix -57.44 -43.24 148.8 3DL0 ASG GLU A 41 41 H AlphaHelix -88.42 -0.75 124.6 3DL0 ASG GLU A 42 42 C Coil 56.43 42.90 43.2 3DL0 ASG THR A 43 43 C Coil -84.95 164.15 49.3 3DL0 ASG PRO A 44 44 H AlphaHelix -54.03 -37.62 116.3 3DL0 ASG LEU A 45 45 H AlphaHelix -60.18 -42.12 47.7 3DL0 ASG GLY A 46 46 H AlphaHelix -60.81 -43.77 0.6 3DL0 ASG LEU A 47 47 H AlphaHelix -65.06 -38.81 46.8 3DL0 ASG GLU A 48 48 H AlphaHelix -68.21 -45.90 110.0 3DL0 ASG ALA A 49 49 H AlphaHelix -67.24 -32.60 0.6 3DL0 ASG LYS A 50 50 H AlphaHelix -57.34 -44.94 19.4 3DL0 ASG SER A 51 51 H AlphaHelix -60.18 -29.05 56.3 3DL0 ASG TYR A 52 52 H AlphaHelix -83.08 -51.60 72.6 3DL0 ASG ILE A 53 53 H AlphaHelix -59.56 -44.18 22.9 3DL0 ASG ASP A 54 54 H AlphaHelix -59.91 -27.62 16.3 3DL0 ASG LYS A 55 55 C Coil -92.94 -8.91 51.4 3DL0 ASG GLY A 56 56 C Coil 83.98 13.07 5.2 3DL0 ASG GLU A 57 57 C Coil -89.80 160.90 66.8 3DL0 ASG LEU A 58 58 C Coil -75.04 140.90 42.3 3DL0 ASG VAL A 59 59 C Coil -66.43 139.83 9.4 3DL0 ASG PRO A 60 60 C Coil -51.66 149.69 53.8 3DL0 ASG ASP A 61 61 H AlphaHelix -59.40 -40.93 54.8 3DL0 ASG GLU A 62 62 H AlphaHelix -55.62 -56.87 177.7 3DL0 ASG VAL A 63 63 H AlphaHelix -66.10 -36.58 31.9 3DL0 ASG THR A 64 64 H AlphaHelix -64.54 -46.80 4.4 3DL0 ASG ILE A 65 65 H AlphaHelix -61.90 -40.47 33.1 3DL0 ASG GLY A 66 66 H AlphaHelix -59.11 -47.44 39.2 3DL0 ASG ILE A 67 67 H AlphaHelix -71.00 -30.29 28.6 3DL0 ASG VAL A 68 68 H AlphaHelix -73.05 -42.37 0.0 3DL0 ASG LYS A 69 69 H AlphaHelix -57.03 -47.90 105.1 3DL0 ASG GLU A 70 70 H AlphaHelix -62.84 -40.99 120.0 3DL0 ASG ARG A 71 71 H AlphaHelix -63.53 -42.05 49.7 3DL0 ASG LEU A 72 72 H AlphaHelix -70.98 -15.74 4.9 3DL0 ASG GLY A 73 73 H AlphaHelix -78.67 -10.55 48.2 3DL0 ASG LYS A 74 74 C Coil -71.90 153.66 85.7 3DL0 ASG ASP A 75 75 G 310Helix -59.14 -26.85 139.4 3DL0 ASG ASP A 76 76 G 310Helix -72.08 -8.57 84.1 3DL0 ASG CYS A 77 77 G 310Helix -94.63 0.10 4.9 3DL0 ASG GLU A 78 78 T Turn -60.02 -23.26 112.8 3DL0 ASG ARG A 79 79 T Turn -113.84 11.93 204.1 3DL0 ASG GLY A 80 80 T Turn 132.85 -179.14 0.2 3DL0 ASG PHE A 81 81 E Strand -166.68 154.69 2.4 3DL0 ASG LEU A 82 82 E Strand -118.34 105.03 0.0 3DL0 ASG LEU A 83 83 E Strand -84.59 126.26 0.2 3DL0 ASG ASP A 84 84 E Strand -122.02 113.79 6.6 3DL0 ASG GLY A 85 85 T Turn 82.21 11.03 3.3 3DL0 ASG PHE A 86 86 T Turn -144.69 134.22 0.2 3DL0 ASG PRO A 87 87 T Turn -67.31 154.57 1.7 3DL0 ASG ARG A 88 88 T Turn -117.69 -11.85 60.0 3DL0 ASG THR A 89 89 C Coil -134.28 159.39 8.6 3DL0 ASG VAL A 90 90 H AlphaHelix -59.39 -41.86 36.2 3DL0 ASG ALA A 91 91 H AlphaHelix -59.65 -42.13 45.7 3DL0 ASG GLN A 92 92 H AlphaHelix -61.44 -41.47 6.0 3DL0 ASG ALA A 93 93 H AlphaHelix -64.56 -42.26 0.2 3DL0 ASG GLU A 94 94 H AlphaHelix -63.70 -40.44 110.5 3DL0 ASG ALA A 95 95 H AlphaHelix -64.79 -40.10 29.0 3DL0 ASG LEU A 96 96 H AlphaHelix -68.37 -37.98 0.0 3DL0 ASG GLU A 97 97 H AlphaHelix -50.12 -49.20 61.3 3DL0 ASG GLU A 98 98 H AlphaHelix -67.32 -46.81 105.8 3DL0 ASG ILE A 99 99 H AlphaHelix -51.30 -49.78 8.0 3DL0 ASG LEU A 100 100 H AlphaHelix -75.69 -28.24 3.6 3DL0 ASG GLU A 101 101 H AlphaHelix -56.99 -53.17 131.7 3DL0 ASG GLU A 102 102 H AlphaHelix -66.78 -28.42 132.2 3DL0 ASG MET A 103 103 H AlphaHelix -76.48 -9.31 70.7 3DL0 ASG GLY A 104 104 C Coil 58.36 34.74 58.1 3DL0 ASG LYS A 105 105 C Coil -126.73 59.53 47.1 3DL0 ASG PRO A 106 106 C Coil -69.76 153.30 80.1 3DL0 ASG ILE A 107 107 T Turn -58.41 135.21 10.5 3DL0 ASG ASP A 108 108 T Turn -88.96 -48.60 59.1 3DL0 ASG TYR A 109 109 E Strand -138.51 134.94 63.5 3DL0 ASG VAL A 110 110 E Strand -95.79 113.21 0.0 3DL0 ASG ILE A 111 111 E Strand -96.04 109.48 0.0 3DL0 ASG ASN A 112 112 E Strand -88.66 108.70 13.2 3DL0 ASG ILE A 113 113 E Strand -81.75 100.71 2.2 3DL0 ASG GLN A 114 114 E Strand -78.80 118.00 94.8 3DL0 ASG VAL A 115 115 C Coil -138.94 123.60 12.1 3DL0 ASG ASP A 116 116 C Coil -42.95 125.25 68.1 3DL0 ASG LYS A 117 117 G 310Helix -50.98 -31.05 125.7 3DL0 ASG ASP A 118 118 G 310Helix -63.82 -20.34 122.1 3DL0 ASG VAL A 119 119 G 310Helix -104.46 -0.15 41.6 3DL0 ASG LEU A 120 120 H AlphaHelix -79.81 -30.43 0.0 3DL0 ASG MET A 121 121 H AlphaHelix -57.31 -46.46 51.9 3DL0 ASG GLU A 122 122 H AlphaHelix -62.84 -39.80 102.0 3DL0 ASG ARG A 123 123 H AlphaHelix -58.38 -41.02 54.4 3DL0 ASG LEU A 124 124 H AlphaHelix -84.99 -43.66 2.0 3DL0 ASG THR A 125 125 H AlphaHelix -68.32 -25.76 45.1 3DL0 ASG GLY A 126 126 H AlphaHelix -88.04 -8.28 5.0 3DL0 ASG ARG A 127 127 E Strand -62.75 137.83 42.5 3DL0 ASG ARG A 128 128 E Strand -136.52 142.78 48.7 3DL0 ASG ILE A 129 129 E Strand -129.09 140.32 14.4 3DL0 ASG CYS A 130 130 E Strand -73.63 126.24 2.3 3DL0 ASG SER A 131 131 T Turn -61.15 -18.85 19.6 3DL0 ASG VAL A 132 132 T Turn -102.29 -49.53 95.5 3DL0 ASG CYS A 133 133 T Turn -115.55 -7.44 58.7 3DL0 ASG GLY A 134 134 T Turn 78.26 6.25 37.1 3DL0 ASG THR A 135 135 C Coil -59.50 140.00 22.5 3DL0 ASG THR A 136 136 E Strand -105.78 136.03 47.9 3DL0 ASG TYR A 137 137 E Strand -124.83 171.67 13.8 3DL0 ASG HIS A 138 138 E Strand -134.78 130.96 15.8 3DL0 ASG LEU A 139 139 T Turn -45.43 -41.16 89.3 3DL0 ASG VAL A 140 140 T Turn -105.70 -48.91 97.0 3DL0 ASG PHE A 141 141 T Turn -83.25 -20.51 103.0 3DL0 ASG ASN A 142 142 B Bridge -159.09 64.91 68.6 3DL0 ASG PRO A 143 143 T Turn -84.03 158.13 68.8 3DL0 ASG PRO A 144 144 T Turn -76.81 171.58 17.4 3DL0 ASG LYS A 145 145 T Turn -66.53 -48.30 166.6 3DL0 ASG THR A 146 146 T Turn -104.71 125.67 82.8 3DL0 ASG PRO A 147 147 T Turn -56.96 137.38 114.4 3DL0 ASG GLY A 148 148 T Turn 78.56 0.70 38.4 3DL0 ASG ILE A 149 149 B Bridge -128.84 133.23 60.7 3DL0 ASG CYS A 150 150 T Turn -71.42 139.31 2.8 3DL0 ASG ASP A 151 151 T Turn -66.00 -33.91 68.1 3DL0 ASG LYS A 152 152 T Turn -76.77 -49.82 152.2 3DL0 ASG ASP A 153 153 T Turn -132.55 11.68 74.8 3DL0 ASG GLY A 154 154 T Turn 70.30 7.62 42.6 3DL0 ASG GLY A 155 155 C Coil -57.35 149.17 6.3 3DL0 ASG GLU A 156 156 B Bridge -71.35 136.54 41.3 3DL0 ASG LEU A 157 157 E Strand -88.28 148.98 14.2 3DL0 ASG TYR A 158 158 E Strand -135.74 169.88 50.5 3DL0 ASG GLN A 159 159 C Coil -104.21 130.21 74.3 3DL0 ASG ARG A 160 160 T Turn -58.50 141.52 30.2 3DL0 ASG ALA A 161 161 T Turn -62.48 -23.43 49.4 3DL0 ASG ASP A 162 162 T Turn -97.07 4.12 14.4 3DL0 ASG ASP A 163 163 T Turn -94.17 36.03 0.2 3DL0 ASG ASN A 164 164 C Coil -105.91 157.18 57.9 3DL0 ASG GLU A 165 165 H AlphaHelix -48.32 -48.20 140.7 3DL0 ASG GLU A 166 166 H AlphaHelix -59.33 -50.29 143.7 3DL0 ASG THR A 167 167 H AlphaHelix -74.99 -33.66 16.7 3DL0 ASG VAL A 168 168 H AlphaHelix -62.38 -40.48 0.0 3DL0 ASG THR A 169 169 H AlphaHelix -61.93 -39.67 82.6 3DL0 ASG LYS A 170 170 H AlphaHelix -66.81 -49.54 59.6 3DL0 ASG ARG A 171 171 H AlphaHelix -55.81 -42.18 18.4 3DL0 ASG LEU A 172 172 H AlphaHelix -64.96 -42.36 27.4 3DL0 ASG GLU A 173 173 H AlphaHelix -61.22 -49.03 113.8 3DL0 ASG VAL A 174 174 H AlphaHelix -62.23 -43.02 15.2 3DL0 ASG ASN A 175 175 H AlphaHelix -79.92 -35.94 12.0 3DL0 ASG MET A 176 176 H AlphaHelix -55.48 -44.04 74.9 3DL0 ASG LYS A 177 177 H AlphaHelix -58.26 -33.35 152.7 3DL0 ASG GLN A 178 178 H AlphaHelix -92.23 -12.22 48.7 3DL0 ASG THR A 179 179 H AlphaHelix -68.99 -60.90 34.2 3DL0 ASG ALA A 180 180 H AlphaHelix -56.53 -43.72 58.5 3DL0 ASG PRO A 181 181 H AlphaHelix -60.64 -37.35 59.8 3DL0 ASG LEU A 182 182 H AlphaHelix -73.02 -41.54 6.0 3DL0 ASG LEU A 183 183 H AlphaHelix -58.97 -47.17 35.9 3DL0 ASG ASP A 184 184 H AlphaHelix -56.49 -44.22 114.5 3DL0 ASG PHE A 185 185 H AlphaHelix -56.53 -54.10 31.6 3DL0 ASG TYR A 186 186 H AlphaHelix -70.21 -36.87 0.4 3DL0 ASG ASP A 187 187 H AlphaHelix -59.43 -37.83 104.6 3DL0 ASG GLU A 188 188 H AlphaHelix -69.54 -30.78 147.3 3DL0 ASG LYS A 189 189 H AlphaHelix -70.15 -30.06 81.7 3DL0 ASG GLY A 190 190 C Coil 108.83 -5.29 62.0 3DL0 ASG TYR A 191 191 C Coil -121.08 20.83 43.9 3DL0 ASG LEU A 192 192 E Strand -72.32 129.47 26.0 3DL0 ASG VAL A 193 193 E Strand -123.92 130.35 28.0 3DL0 ASG ASN A 194 194 E Strand -90.83 130.71 76.4 3DL0 ASG VAL A 195 195 E Strand -117.74 142.07 7.2 3DL0 ASG ASN A 196 196 E Strand -74.65 104.38 76.2 3DL0 ASG GLY A 197 197 T Turn -84.51 0.27 2.8 3DL0 ASG GLN A 198 198 T Turn -97.64 62.02 88.4 3DL0 ASG GLN A 199 199 T Turn -144.56 172.12 62.3 3DL0 ASG ASP A 200 200 C Coil -55.85 150.58 106.1 3DL0 ASG ILE A 201 201 H AlphaHelix -51.60 -44.88 41.5 3DL0 ASG GLN A 202 202 H AlphaHelix -60.32 -37.97 125.7 3DL0 ASG ASP A 203 203 H AlphaHelix -77.90 -36.50 71.4 3DL0 ASG VAL A 204 204 H AlphaHelix -60.21 -43.87 4.2 3DL0 ASG TYR A 205 205 H AlphaHelix -64.68 -40.28 35.9 3DL0 ASG ALA A 206 206 H AlphaHelix -58.29 -45.39 44.3 3DL0 ASG ASP A 207 207 H AlphaHelix -58.89 -40.68 69.6 3DL0 ASG LEU A 208 208 H AlphaHelix -64.44 -39.94 0.0 3DL0 ASG LYS A 209 209 H AlphaHelix -58.53 -39.24 82.2 3DL0 ASG VAL A 210 210 H AlphaHelix -60.83 -32.81 122.0 3DL0 ASG LEU A 211 211 H AlphaHelix -82.72 -42.69 44.1 3DL0 ASG LEU A 212 212 H AlphaHelix -74.41 -23.97 0.0 3DL0 ASG GLY A 213 213 G 310Helix -56.84 -28.19 33.8 3DL0 ASG GLY A 214 214 G 310Helix -71.08 -7.32 72.2 3DL0 ASG LEU A 215 215 G 310Helix -119.06 -5.14 50.5 3DL0 ASG LYS A 216 216 C Coil -68.70 360.00 168.6 3DL0 ASG MET B 1 1 C Coil 360.00 97.68 22.3 3DL0 ASG ASN B 2 2 E Strand -112.13 106.47 0.0 3DL0 ASG LEU B 3 3 E Strand -126.22 144.88 0.0 3DL0 ASG VAL B 4 4 E Strand -117.96 132.23 0.0 3DL0 ASG LEU B 5 5 E Strand -102.32 124.84 0.3 3DL0 ASG MET B 6 6 E Strand -120.79 159.35 15.3 3DL0 ASG GLY B 7 7 C Coil 168.16 155.65 13.7 3DL0 ASG LEU B 8 8 T Turn -66.33 157.35 28.3 3DL0 ASG PRO B 9 9 T Turn -47.68 128.54 5.6 3DL0 ASG GLY B 10 10 T Turn 89.46 -2.39 21.4 3DL0 ASG ALA B 11 11 T Turn -65.86 -22.49 3.2 3DL0 ASG GLY B 12 12 C Coil 115.41 23.55 15.9 3DL0 ASG LYS B 13 13 H AlphaHelix -60.57 -51.93 21.7 3DL0 ASG GLY B 14 14 H AlphaHelix -63.73 -41.46 27.4 3DL0 ASG THR B 15 15 H AlphaHelix -58.41 -47.43 49.2 3DL0 ASG GLN B 16 16 H AlphaHelix -77.25 -34.42 4.6 3DL0 ASG GLY B 17 17 H AlphaHelix -63.01 -42.72 0.0 3DL0 ASG GLU B 18 18 H AlphaHelix -61.23 -40.61 104.4 3DL0 ASG ARG B 19 19 H AlphaHelix -68.80 -42.05 83.0 3DL0 ASG ILE B 20 20 H AlphaHelix -58.32 -47.66 0.0 3DL0 ASG VAL B 21 21 H AlphaHelix -75.64 -18.80 41.7 3DL0 ASG GLU B 22 22 H AlphaHelix -65.61 -32.55 169.5 3DL0 ASG LYS B 23 23 H AlphaHelix -99.67 -40.10 98.9 3DL0 ASG TYR B 24 24 T Turn -106.18 137.54 12.3 3DL0 ASG GLY B 25 25 T Turn -80.41 49.77 66.6 3DL0 ASG ILE B 26 26 T Turn -125.61 148.20 13.0 3DL0 ASG PRO B 27 27 C Coil -72.91 142.20 18.9 3DL0 ASG HIS B 28 28 E Strand -85.98 110.15 45.9 3DL0 ASG ILE B 29 29 E Strand -109.59 100.76 2.1 3DL0 ASG SER B 30 30 E Strand -108.23 118.81 11.0 3DL0 ASG THR B 31 31 H AlphaHelix -65.57 -34.83 4.2 3DL0 ASG GLY B 32 32 H AlphaHelix -61.19 -44.30 13.7 3DL0 ASG ASP B 33 33 H AlphaHelix -65.05 -42.50 78.8 3DL0 ASG MET B 34 34 H AlphaHelix -56.69 -49.98 48.8 3DL0 ASG PHE B 35 35 H AlphaHelix -63.61 -43.01 12.4 3DL0 ASG ARG B 36 36 H AlphaHelix -66.16 -35.18 60.4 3DL0 ASG ALA B 37 37 H AlphaHelix -60.81 -43.23 53.0 3DL0 ASG ALA B 38 38 H AlphaHelix -63.41 -41.74 9.4 3DL0 ASG MET B 39 39 H AlphaHelix -62.54 -47.38 40.0 3DL0 ASG LYS B 40 40 H AlphaHelix -55.29 -47.93 143.1 3DL0 ASG GLU B 41 41 H AlphaHelix -80.56 -4.16 131.5 3DL0 ASG GLU B 42 42 C Coil 60.84 43.11 152.6 3DL0 ASG THR B 43 43 C Coil -85.24 162.80 51.8 3DL0 ASG PRO B 44 44 H AlphaHelix -49.08 -44.12 114.6 3DL0 ASG LEU B 45 45 H AlphaHelix -59.20 -45.23 47.1 3DL0 ASG GLY B 46 46 H AlphaHelix -58.78 -44.97 0.2 3DL0 ASG LEU B 47 47 H AlphaHelix -65.37 -38.17 106.8 3DL0 ASG GLU B 48 48 H AlphaHelix -64.95 -45.95 108.6 3DL0 ASG ALA B 49 49 H AlphaHelix -68.12 -33.72 0.4 3DL0 ASG LYS B 50 50 H AlphaHelix -51.50 -45.50 98.6 3DL0 ASG SER B 51 51 H AlphaHelix -62.82 -33.45 50.8 3DL0 ASG TYR B 52 52 H AlphaHelix -76.78 -47.84 73.0 3DL0 ASG ILE B 53 53 H AlphaHelix -64.58 -43.19 22.8 3DL0 ASG ASP B 54 54 H AlphaHelix -58.45 -33.50 61.0 3DL0 ASG LYS B 55 55 H AlphaHelix -87.62 -8.04 112.3 3DL0 ASG GLY B 56 56 C Coil 82.55 13.66 4.9 3DL0 ASG GLU B 57 57 C Coil -92.73 159.56 75.4 3DL0 ASG LEU B 58 58 C Coil -73.28 142.74 41.5 3DL0 ASG VAL B 59 59 C Coil -68.31 138.83 10.1 3DL0 ASG PRO B 60 60 C Coil -50.97 150.62 53.0 3DL0 ASG ASP B 61 61 H AlphaHelix -59.44 -45.75 53.2 3DL0 ASG GLU B 62 62 H AlphaHelix -56.99 -51.30 173.2 3DL0 ASG VAL B 63 63 H AlphaHelix -66.29 -36.77 32.3 3DL0 ASG THR B 64 64 H AlphaHelix -63.57 -48.42 5.0 3DL0 ASG ILE B 65 65 H AlphaHelix -60.68 -41.07 32.1 3DL0 ASG GLY B 66 66 H AlphaHelix -59.22 -45.91 40.2 3DL0 ASG ILE B 67 67 H AlphaHelix -70.49 -29.89 33.1 3DL0 ASG VAL B 68 68 H AlphaHelix -75.87 -40.09 0.0 3DL0 ASG LYS B 69 69 H AlphaHelix -58.31 -45.55 122.4 3DL0 ASG GLU B 70 70 H AlphaHelix -66.67 -42.77 138.5 3DL0 ASG ARG B 71 71 H AlphaHelix -61.20 -41.29 57.7 3DL0 ASG LEU B 72 72 H AlphaHelix -70.40 -18.82 6.8 3DL0 ASG GLY B 73 73 H AlphaHelix -78.93 -5.94 42.9 3DL0 ASG LYS B 74 74 C Coil -73.88 153.38 108.5 3DL0 ASG ASP B 75 75 G 310Helix -59.82 -27.94 137.6 3DL0 ASG ASP B 76 76 G 310Helix -70.24 -8.51 82.5 3DL0 ASG CYS B 77 77 G 310Helix -96.43 0.78 4.5 3DL0 ASG GLU B 78 78 T Turn -63.47 -21.61 120.4 3DL0 ASG ARG B 79 79 T Turn -106.76 7.35 204.4 3DL0 ASG GLY B 80 80 T Turn 128.66 -173.72 0.3 3DL0 ASG PHE B 81 81 E Strand -169.25 159.35 2.4 3DL0 ASG LEU B 82 82 E Strand -122.82 106.22 0.0 3DL0 ASG LEU B 83 83 E Strand -87.04 127.22 0.0 3DL0 ASG ASP B 84 84 E Strand -123.98 108.80 6.2 3DL0 ASG GLY B 85 85 T Turn 84.21 12.94 3.0 3DL0 ASG PHE B 86 86 T Turn -145.42 135.06 0.2 3DL0 ASG PRO B 87 87 T Turn -68.86 155.48 2.0 3DL0 ASG ARG B 88 88 T Turn -116.99 -10.39 61.0 3DL0 ASG THR B 89 89 C Coil -132.38 156.86 10.2 3DL0 ASG VAL B 90 90 H AlphaHelix -59.38 -41.87 38.4 3DL0 ASG ALA B 91 91 H AlphaHelix -57.94 -42.67 43.5 3DL0 ASG GLN B 92 92 H AlphaHelix -60.36 -39.49 5.6 3DL0 ASG ALA B 93 93 H AlphaHelix -67.05 -41.49 0.5 3DL0 ASG GLU B 94 94 H AlphaHelix -63.64 -42.41 114.0 3DL0 ASG ALA B 95 95 H AlphaHelix -63.68 -40.79 27.1 3DL0 ASG LEU B 96 96 H AlphaHelix -66.00 -36.12 0.2 3DL0 ASG GLU B 97 97 H AlphaHelix -59.35 -44.64 70.1 3DL0 ASG GLU B 98 98 H AlphaHelix -68.53 -43.37 93.8 3DL0 ASG ILE B 99 99 H AlphaHelix -55.98 -48.29 13.7 3DL0 ASG LEU B 100 100 H AlphaHelix -71.21 -32.72 2.4 3DL0 ASG GLU B 101 101 H AlphaHelix -57.32 -48.20 114.2 3DL0 ASG GLU B 102 102 H AlphaHelix -67.01 -31.86 138.9 3DL0 ASG MET B 103 103 H AlphaHelix -78.94 -11.65 72.4 3DL0 ASG GLY B 104 104 C Coil 58.33 41.01 22.3 3DL0 ASG LYS B 105 105 C Coil -132.77 66.24 24.5 3DL0 ASG PRO B 106 106 C Coil -66.58 152.94 26.1 3DL0 ASG ILE B 107 107 C Coil -61.47 132.74 3.6 3DL0 ASG ASP B 108 108 C Coil -81.09 -53.01 35.5 3DL0 ASG TYR B 109 109 E Strand -138.43 142.05 29.9 3DL0 ASG VAL B 110 110 E Strand -101.85 120.89 0.0 3DL0 ASG ILE B 111 111 E Strand -107.64 114.14 0.0 3DL0 ASG ASN B 112 112 E Strand -96.73 112.24 9.8 3DL0 ASG ILE B 113 113 E Strand -86.10 101.90 1.5 3DL0 ASG GLN B 114 114 E Strand -83.83 118.25 101.5 3DL0 ASG VAL B 115 115 C Coil -137.13 127.82 13.3 3DL0 ASG ASP B 116 116 C Coil -51.30 126.46 70.4 3DL0 ASG LYS B 117 117 G 310Helix -50.65 -27.26 130.3 3DL0 ASG ASP B 118 118 G 310Helix -62.44 -23.39 121.1 3DL0 ASG VAL B 119 119 G 310Helix -107.96 0.41 53.0 3DL0 ASG LEU B 120 120 H AlphaHelix -75.92 -29.98 0.0 3DL0 ASG MET B 121 121 H AlphaHelix -59.75 -46.84 49.3 3DL0 ASG GLU B 122 122 H AlphaHelix -64.94 -38.47 109.7 3DL0 ASG ARG B 123 123 H AlphaHelix -59.95 -37.67 53.4 3DL0 ASG LEU B 124 124 H AlphaHelix -85.50 -45.06 2.2 3DL0 ASG THR B 125 125 H AlphaHelix -65.55 -26.35 42.4 3DL0 ASG GLY B 126 126 H AlphaHelix -88.86 -6.61 5.7 3DL0 ASG ARG B 127 127 E Strand -66.36 137.91 45.7 3DL0 ASG ARG B 128 128 E Strand -136.24 146.33 53.7 3DL0 ASG ILE B 129 129 E Strand -131.86 140.03 12.4 3DL0 ASG CYS B 130 130 E Strand -71.18 126.83 1.5 3DL0 ASG SER B 131 131 T Turn -62.95 -18.42 70.3 3DL0 ASG VAL B 132 132 T Turn -101.58 -52.66 103.5 3DL0 ASG CYS B 133 133 T Turn -111.25 -7.65 56.5 3DL0 ASG GLY B 134 134 T Turn 79.85 2.75 36.2 3DL0 ASG THR B 135 135 C Coil -59.58 141.21 24.6 3DL0 ASG THR B 136 136 E Strand -106.47 134.32 47.0 3DL0 ASG TYR B 137 137 E Strand -123.32 173.35 13.4 3DL0 ASG HIS B 138 138 E Strand -138.43 132.46 15.8 3DL0 ASG LEU B 139 139 T Turn -50.91 -35.94 87.5 3DL0 ASG VAL B 140 140 T Turn -106.76 -51.11 96.9 3DL0 ASG PHE B 141 141 T Turn -80.91 -24.77 117.5 3DL0 ASG ASN B 142 142 B Bridge -154.24 65.69 73.4 3DL0 ASG PRO B 143 143 T Turn -81.82 155.31 68.5 3DL0 ASG PRO B 144 144 T Turn -70.76 166.68 12.1 3DL0 ASG LYS B 145 145 T Turn -65.89 -39.97 168.5 3DL0 ASG THR B 146 146 B Bridge -111.05 123.37 83.2 3DL0 ASG PRO B 147 147 T Turn -53.78 139.90 111.2 3DL0 ASG GLY B 148 148 T Turn 79.32 -0.51 37.3 3DL0 ASG ILE B 149 149 B Bridge -131.31 131.85 62.6 3DL0 ASG CYS B 150 150 T Turn -71.57 137.88 3.5 3DL0 ASG ASP B 151 151 T Turn -66.75 -30.56 67.0 3DL0 ASG LYS B 152 152 T Turn -81.49 -48.33 152.7 3DL0 ASG ASP B 153 153 T Turn -134.32 10.36 74.2 3DL0 ASG GLY B 154 154 T Turn 74.76 6.30 43.1 3DL0 ASG GLY B 155 155 C Coil -60.01 147.55 6.9 3DL0 ASG GLU B 156 156 B Bridge -73.58 136.70 145.0 3DL0 ASG LEU B 157 157 E Strand -86.15 150.82 27.3 3DL0 ASG TYR B 158 158 E Strand -128.14 167.20 84.6 3DL0 ASG GLN B 159 159 C Coil -104.24 130.68 88.5 3DL0 ASG ARG B 160 160 T Turn -60.54 142.05 31.7 3DL0 ASG ALA B 161 161 T Turn -62.60 -28.48 83.3 3DL0 ASG ASP B 162 162 T Turn -91.93 -0.38 15.2 3DL0 ASG ASP B 163 163 T Turn -94.03 48.91 0.6 3DL0 ASG ASN B 164 164 C Coil -116.27 161.29 58.7 3DL0 ASG GLU B 165 165 H AlphaHelix -54.39 -43.28 139.4 3DL0 ASG GLU B 166 166 H AlphaHelix -64.05 -50.23 168.9 3DL0 ASG THR B 167 167 H AlphaHelix -72.59 -36.92 20.1 3DL0 ASG VAL B 168 168 H AlphaHelix -60.33 -43.65 0.0 3DL0 ASG THR B 169 169 H AlphaHelix -56.77 -43.71 80.2 3DL0 ASG LYS B 170 170 H AlphaHelix -64.16 -47.40 67.2 3DL0 ASG ARG B 171 171 H AlphaHelix -57.24 -43.64 19.6 3DL0 ASG LEU B 172 172 H AlphaHelix -63.44 -43.60 27.6 3DL0 ASG GLU B 173 173 H AlphaHelix -64.25 -47.07 104.4 3DL0 ASG VAL B 174 174 H AlphaHelix -59.42 -45.79 20.0 3DL0 ASG ASN B 175 175 H AlphaHelix -77.86 -36.47 12.6 3DL0 ASG MET B 176 176 H AlphaHelix -60.62 -37.74 92.3 3DL0 ASG LYS B 177 177 H AlphaHelix -60.37 -35.22 144.8 3DL0 ASG GLN B 178 178 H AlphaHelix -88.46 -9.48 51.5 3DL0 ASG THR B 179 179 H AlphaHelix -70.42 -60.26 39.0 3DL0 ASG ALA B 180 180 H AlphaHelix -55.62 -44.38 57.9 3DL0 ASG PRO B 181 181 H AlphaHelix -56.12 -40.18 58.9 3DL0 ASG LEU B 182 182 H AlphaHelix -75.71 -37.37 6.6 3DL0 ASG LEU B 183 183 H AlphaHelix -61.19 -44.25 33.1 3DL0 ASG ASP B 184 184 H AlphaHelix -59.11 -42.08 115.4 3DL0 ASG PHE B 185 185 H AlphaHelix -58.90 -49.46 35.1 3DL0 ASG TYR B 186 186 H AlphaHelix -79.45 -27.49 1.6 3DL0 ASG ASP B 187 187 H AlphaHelix -64.77 -36.16 82.0 3DL0 ASG GLU B 188 188 H AlphaHelix -65.76 -37.42 122.2 3DL0 ASG LYS B 189 189 H AlphaHelix -67.71 -34.18 52.2 3DL0 ASG GLY B 190 190 C Coil 107.72 8.27 26.9 3DL0 ASG TYR B 191 191 C Coil -128.98 22.40 15.4 3DL0 ASG LEU B 192 192 E Strand -76.30 129.62 27.0 3DL0 ASG VAL B 193 193 E Strand -129.84 143.29 34.6 3DL0 ASG ASN B 194 194 E Strand -104.10 138.61 78.0 3DL0 ASG VAL B 195 195 E Strand -127.18 139.00 12.4 3DL0 ASG ASN B 196 196 E Strand -73.45 105.59 82.5 3DL0 ASG GLY B 197 197 T Turn -83.39 -2.35 2.2 3DL0 ASG GLN B 198 198 T Turn -96.12 61.33 90.1 3DL0 ASG GLN B 199 199 T Turn -139.97 175.48 62.7 3DL0 ASG ASP B 200 200 C Coil -56.48 148.51 106.2 3DL0 ASG ILE B 201 201 H AlphaHelix -46.00 -53.07 46.1 3DL0 ASG GLN B 202 202 H AlphaHelix -58.12 -35.19 116.6 3DL0 ASG ASP B 203 203 H AlphaHelix -75.34 -33.80 72.6 3DL0 ASG VAL B 204 204 H AlphaHelix -64.29 -44.80 5.2 3DL0 ASG TYR B 205 205 H AlphaHelix -59.42 -46.45 31.9 3DL0 ASG ALA B 206 206 H AlphaHelix -54.70 -41.51 43.2 3DL0 ASG ASP B 207 207 H AlphaHelix -66.08 -35.92 70.8 3DL0 ASG LEU B 208 208 H AlphaHelix -69.03 -37.91 0.2 3DL0 ASG LYS B 209 209 H AlphaHelix -57.02 -44.91 69.6 3DL0 ASG VAL B 210 210 H AlphaHelix -56.72 -42.11 89.3 3DL0 ASG LEU B 211 211 H AlphaHelix -70.76 -38.18 32.9 3DL0 ASG LEU B 212 212 H AlphaHelix -84.97 -6.50 0.6 3DL0 ASG GLY B 213 213 H AlphaHelix -60.69 -31.29 1.6 3DL0 ASG GLY B 214 214 C Coil -73.41 -8.13 25.9 3DL0 ASG LEU B 215 215 C Coil -112.65 -6.33 48.2 3DL0 ASG LYS B 216 216 C Coil -82.51 360.00 117.9 3DL0