REM -------------------------------------------------------------------- 4J3C REM 4J3C REM STRIDE: Knowledge-based secondary structure assignment 4J3C REM Please cite: D.Frishman & P.Argos, Proteins XX, XXX-XXX, 1995 4J3C REM 4J3C REM Residue accessible surface area calculation 4J3C REM Please cite: F.Eisenhaber & P.Argos, J.Comp.Chem. 14, 1272-1280, 1993 4J3C REM F.Eisenhaber et al., J.Comp.Chem., 1994, submitted 4J3C REM 4J3C REM ------------------------ General information ----------------------- 4J3C REM 4J3C HDR TRANSFERASE 05-FEB-13 4J3C 4J3C CMP MOL_ID: 1; 4J3C CMP MOLECULE: RIBOSOMAL RNA SMALL SUBUNIT METHYLTRANSFERASE E; 4J3C CMP CHAIN: A, B; 4J3C CMP EC: 2.1.1.193; 4J3C CMP ENGINEERED: YES 4J3C SRC MOL_ID: 1; 4J3C SRC ORGANISM_SCIENTIFIC: SINORHIZOBIUM MELILOTI; 4J3C SRC ORGANISM_COMMON: ENSIFER MELILOTI; 4J3C SRC ORGANISM_TAXID: 266834; 4J3C SRC STRAIN: 1021; 4J3C SRC GENE: R00771, SMC00826; 4J3C SRC EXPRESSION_SYSTEM: ESCHERICHIA COLI; 4J3C SRC EXPRESSION_SYSTEM_TAXID: 511693; 4J3C SRC EXPRESSION_SYSTEM_STRAIN: BL21; 4J3C SRC EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; 4J3C SRC EXPRESSION_SYSTEM_PLASMID: PET3A 4J3C AUT S.ESWARAMOORTHY,S.CHAMALA,B.EVANS,F.FOTI,A.GIZZI,B.HILLERICH, 4J3C AUT J.LAFLEUR,R.SEIDEL,G.VILLIGAS,W.ZENCHECK,N.AL OBAIDI,S.C.ALM 4J3C AUT S.SWAMINATHAN,NEW YORK STRUCTURAL GENOMICS RESEARCH CONSORTI 4J3C AUT (NYSGRC) 4J3C REM 4J3C REM -------------------- Secondary structure summary ------------------- 4J3C REM 4J3C CHN /home/proj/stride/tmp/tmp2msURNpdb A 4J3C REM 4J3C REM . . . . . 4J3C SEQ 1 QRLFIENALHAGAKHEATREQFNVLRLGEGSSLLVFNGRDGEWRAEIAPS 50 4J3C STR EEE TTTEEEETTTTTTTTTT TTTEEEEEETTTTTEEEEEE TT 4J3C REM 4J3C REM . . . . . 4J3C SEQ 51 RQAVLVAVEQTRPQPAPCDLVYLFAPLKVGRLDYLVQKAVEGAGVLQPVT 100 4J3C STR TT EEEEEEEEE EEEE TTTT HHHHHHHHHH TTEEEE T 4J3C REM 4J3C REM . . . . . 4J3C SEQ 101 QHVQGKIGSLERVRANVIEAAEQCGVLGIPAVEEPRKLEDLLIDWPRDRR 150 4J3C STR TTT HHHHHHHHHHHHHHH EE HHHHHHH TTTEE 4J3C REM 4J3C REM . . . . . 4J3C SEQ 151 IVFCDEGSQNPLPILEGIAERRLALLIGPEGGFSEAERDLLRSRDFVTAI 200 4J3C STR EEEE TTTT HHHHHHH EEEEEE TTTT HHHHHHHHHTTTEEEE 4J3C REM 4J3C REM . . 4J3C SEQ 201 PLGPRILRADTAAVAAAVIQATLGDWR 227 4J3C STR HHHHHHHHHHHHHHH 4J3C REM 4J3C CHN /home/proj/stride/tmp/tmp2msURNpdb B 4J3C REM 4J3C REM . . . . . 4J3C SEQ 1 QRLFIENALHAGAKHEATREQFNYLINVLRLGEGSSLLVFNGRDGEWRAE 50 4J3C STR EEE TTTEEEEE HHHHHHHHHH TTTEEEEEETTTTTEEEEE 4J3C REM 4J3C REM . . . . . 4J3C SEQ 51 IAPSRQAVLVAVEQTRPQPAPCDLVYLFAPLVGRLDYLVQKAVEGAGVLQ 100 4J3C STR EEETTTEEEEEEEEEE EEEE HHHHHHHHHHHHH TTEEE 4J3C REM 4J3C REM . . . . . 4J3C SEQ 101 PVTQHVQGKIGSLERVRANVIEAAEQCGVLGIPAVEEPRKLEDLLIDWPR 150 4J3C STR E TTTT HHHHHHHHHHHHHHH EE HHHHHH TT 4J3C REM 4J3C REM . . . . . 4J3C SEQ 151 DRRIVFCNDSQNPLPILEGIAERRLALLIGPEGGFSEAERDLLRSRDFVT 200 4J3C STR TTEEEE HHHHHHH EEEEE TTTT HHHHHHHHHTTTEE 4J3C REM 4J3C REM . . 4J3C SEQ 201 AIPLGPRILRADTAAVAAAVIQATLGDWR 229 4J3C STR E HHHHHHHHHHHHHHH 4J3C REM 4J3C REM 4J3C REM 4J3C LOC AlphaHelix LEU 95 A GLU 104 A 4J3C LOC AlphaHelix LEU 125 A CYS 139 A 4J3C LOC AlphaHelix LEU 153 A ASP 159 A 4J3C LOC AlphaHelix PRO 178 A GLY 184 A 4J3C LOC AlphaHelix GLU 202 A SER 210 A 4J3C LOC AlphaHelix ALA 226 A LEU 241 A 4J3C LOC AlphaHelix ARG 26 B VAL 35 B 4J3C LOC AlphaHelix VAL 92 B GLU 104 B 4J3C LOC AlphaHelix LEU 125 B CYS 139 B 4J3C LOC AlphaHelix LEU 153 B ILE 158 B 4J3C LOC AlphaHelix PRO 178 B GLY 184 B 4J3C LOC AlphaHelix GLU 202 B SER 210 B 4J3C LOC AlphaHelix ALA 226 B LEU 241 B 4J3C LOC Strand ARG 9 A PHE 11 A 4J3C LOC Strand ALA 20 A GLU 23 A 4J3C LOC Strand SER 42 A PHE 47 A 4J3C LOC Strand GLU 53 A ILE 58 A 4J3C LOC Strand VAL 67 A ARG 75 A 4J3C LOC Strand VAL 84 A PHE 87 A 4J3C LOC Strand VAL 109 A PRO 112 A 4J3C LOC Strand ALA 146 A VAL 147 A 4J3C LOC Strand ARG 164 A CYS 169 A 4J3C LOC Strand ARG 189 A ILE 194 A 4J3C LOC Strand VAL 214 A ILE 217 A 4J3C LOC Strand ARG 9 B PHE 11 B 4J3C LOC Strand ALA 20 B ALA 24 B 4J3C LOC Strand SER 42 B PHE 47 B 4J3C LOC Strand GLU 53 B PRO 61 B 4J3C LOC Strand ALA 66 B ARG 75 B 4J3C LOC Strand VAL 84 B PHE 87 B 4J3C LOC Strand VAL 109 B PRO 112 B 4J3C LOC Strand ALA 146 B VAL 147 B 4J3C LOC Strand ARG 165 B PHE 168 B 4J3C LOC Strand LEU 190 B ILE 194 B 4J3C LOC Strand VAL 214 B ALA 216 B 4J3C LOC TurnII HIS 17 A ALA 20 A 4J3C LOC TurnII ALA 24 A GLU 27 A 4J3C LOC TurnIV THR 25 A GLN 28 A 4J3C LOC TurnIV PHE 29 A LEU 36 A 4J3C LOC TurnVIb ASN 34 A ARG 37 A 4J3C LOC TurnII GLY 39 A SER 42 A 4J3C LOC TurnIV ASN 48 A ASP 51 A 4J3C LOC TurnIV GLY 49 A GLY 52 A 4J3C LOC TurnIV PRO 61 A GLN 65 A 4J3C LOC TurnVIII LEU 90 A GLY 93 A 4J3C LOC TurnVIII ALA 107 A LEU 110 A 4J3C LOC TurnI THR 115 A VAL 118 A 4J3C LOC TurnI PRO 161 A ARG 164 A 4J3C LOC TurnIV GLU 171 A GLN 176 A 4J3C LOC TurnI PRO 196 A GLY 199 A 4J3C LOC TurnI ARG 211 A VAL 214 A 4J3C LOC TurnII HIS 17 B ALA 20 B 4J3C LOC TurnII GLY 39 B SER 42 B 4J3C LOC TurnIV ASN 48 B ASP 51 B 4J3C LOC TurnIV GLY 49 B GLY 52 B 4J3C LOC TurnIV PRO 61 B GLN 65 B 4J3C LOC TurnVIII ALA 107 B LEU 110 B 4J3C LOC TurnI THR 115 B VAL 118 B 4J3C LOC TurnI PRO 161 B ARG 164 B 4J3C LOC TurnI PRO 196 B GLY 199 B 4J3C LOC TurnI ARG 211 B VAL 214 B 4J3C REM 4J3C REM --------------- Detailed secondary structure assignment------------- 4J3C REM 4J3C REM |---Residue---| |--Structure--| |-Phi-| |-Psi-| |-Area-| 4J3C ASG GLN A 8 1 C Coil 360.00 149.56 75.1 4J3C ASG ARG A 9 2 E Strand -125.17 126.79 60.9 4J3C ASG LEU A 10 3 E Strand -117.60 130.39 35.7 4J3C ASG PHE A 11 4 E Strand -82.53 129.75 46.9 4J3C ASG ILE A 12 5 C Coil -127.22 162.55 3.2 4J3C ASG GLU A 13 6 C Coil -79.91 -30.80 115.7 4J3C ASG ASN A 14 7 C Coil -66.28 147.33 61.2 4J3C ASG ALA A 15 8 C Coil -53.57 146.06 46.7 4J3C ASG LEU A 16 9 C Coil -122.20 124.45 7.8 4J3C ASG HIS A 17 10 T Turn -161.38 170.55 105.0 4J3C ASG ALA A 18 11 T Turn -57.89 120.29 71.0 4J3C ASG GLY A 19 12 T Turn 95.36 -8.71 37.1 4J3C ASG ALA A 20 13 E Strand -59.85 137.48 10.0 4J3C ASG LYS A 21 14 E Strand -114.86 143.53 148.1 4J3C ASG HIS A 22 15 E Strand -142.78 123.70 5.0 4J3C ASG GLU A 23 16 E Strand -86.92 126.04 113.5 4J3C ASG ALA A 24 17 T Turn -53.51 104.07 24.2 4J3C ASG THR A 25 18 T Turn -82.23 92.37 76.5 4J3C ASG ARG A 26 19 T Turn 56.18 -24.18 107.8 4J3C ASG GLU A 27 20 T Turn -70.42 22.79 58.7 4J3C ASG GLN A 28 21 T Turn -51.79 7.36 53.1 4J3C ASG PHE A 29 22 T Turn 144.35 360.00 93.2 4J3C ASG ASN A 34 23 T Turn 360.00 -109.45 102.0 4J3C ASG VAL A 35 24 T Turn -99.99 143.96 107.5 4J3C ASG LEU A 36 25 T Turn -82.60 34.58 103.2 4J3C ASG ARG A 37 26 T Turn 58.34 35.05 76.1 4J3C ASG LEU A 38 27 C Coil -85.15 144.58 61.5 4J3C ASG GLY A 39 28 T Turn -110.20 -167.65 37.6 4J3C ASG GLU A 40 29 T Turn -60.70 133.48 174.8 4J3C ASG GLY A 41 30 T Turn 87.45 -10.13 46.4 4J3C ASG SER A 42 31 E Strand -66.05 148.50 30.2 4J3C ASG SER A 43 32 E Strand -105.57 143.29 53.4 4J3C ASG LEU A 44 33 E Strand -141.81 171.32 14.0 4J3C ASG LEU A 45 34 E Strand -98.62 135.09 45.1 4J3C ASG VAL A 46 35 E Strand -123.34 152.65 2.6 4J3C ASG PHE A 47 36 E Strand -152.82 161.77 0.0 4J3C ASG ASN A 48 37 T Turn -137.05 4.90 7.1 4J3C ASG GLY A 49 38 T Turn 87.42 -4.04 25.0 4J3C ASG ARG A 50 39 T Turn -139.67 -25.82 129.9 4J3C ASG ASP A 51 40 T Turn -106.13 15.63 51.2 4J3C ASG GLY A 52 41 T Turn 76.54 -152.19 0.0 4J3C ASG GLU A 53 42 E Strand -114.21 140.33 4.6 4J3C ASG TRP A 54 43 E Strand -135.52 145.26 29.9 4J3C ASG ARG A 55 44 E Strand -86.54 130.03 59.7 4J3C ASG ALA A 56 45 E Strand -118.69 156.25 0.6 4J3C ASG GLU A 57 46 E Strand -120.45 147.51 70.6 4J3C ASG ILE A 58 47 E Strand -88.21 135.07 20.6 4J3C ASG ALA A 59 48 C Coil -106.99 360.00 64.7 4J3C ASG PRO A 61 49 T Turn 360.00 -57.50 104.7 4J3C ASG SER A 62 50 T Turn -106.83 125.18 58.4 4J3C ASG ARG A 63 51 T Turn -74.06 360.00 147.2 4J3C ASG GLN A 65 52 T Turn 360.00 168.25 133.9 4J3C ASG ALA A 66 53 C Coil -134.20 128.66 26.5 4J3C ASG VAL A 67 54 E Strand -113.85 128.64 16.0 4J3C ASG LEU A 68 55 E Strand -91.24 115.67 12.0 4J3C ASG VAL A 69 56 E Strand -107.38 109.65 43.3 4J3C ASG ALA A 70 57 E Strand -63.64 130.91 2.4 4J3C ASG VAL A 71 58 E Strand -107.06 -55.41 65.1 4J3C ASG GLU A 72 59 E Strand -139.15 142.50 98.0 4J3C ASG GLN A 73 60 E Strand -81.20 127.89 96.8 4J3C ASG THR A 74 61 E Strand -104.18 -23.87 70.2 4J3C ASG ARG A 75 62 E Strand -150.57 142.08 87.9 4J3C ASG PRO A 76 63 C Coil -84.28 164.53 91.6 4J3C ASG GLN A 77 64 C Coil -65.39 121.89 55.9 4J3C ASG PRO A 78 65 C Coil -67.91 168.22 66.3 4J3C ASG ALA A 79 66 C Coil -66.23 146.83 82.8 4J3C ASG PRO A 80 67 C Coil -55.93 148.90 116.7 4J3C ASG CYS A 81 68 C Coil -68.22 134.73 38.1 4J3C ASG ASP A 82 69 C Coil -87.41 -24.74 71.5 4J3C ASG LEU A 83 70 C Coil -59.86 128.96 29.3 4J3C ASG VAL A 84 71 E Strand -97.11 130.82 13.6 4J3C ASG TYR A 85 72 E Strand -110.34 114.30 13.0 4J3C ASG LEU A 86 73 E Strand -101.27 115.23 3.4 4J3C ASG PHE A 87 74 E Strand -140.60 142.83 2.6 4J3C ASG ALA A 88 75 C Coil -90.58 136.33 2.6 4J3C ASG PRO A 89 76 C Coil -67.03 154.46 9.2 4J3C ASG LEU A 90 77 T Turn -113.65 143.01 18.7 4J3C ASG LYS A 91 78 T Turn -75.51 -37.64 142.1 4J3C ASG VAL A 92 79 T Turn -118.58 107.05 89.2 4J3C ASG GLY A 93 80 T Turn 124.33 104.87 22.4 4J3C ASG ARG A 94 81 C Coil -45.05 135.54 138.3 4J3C ASG LEU A 95 82 H AlphaHelix -77.15 -35.10 46.6 4J3C ASG ASP A 96 83 H AlphaHelix -59.02 -45.33 44.1 4J3C ASG TYR A 97 84 H AlphaHelix -60.59 -43.88 14.2 4J3C ASG LEU A 98 85 H AlphaHelix -60.21 -43.82 6.7 4J3C ASG VAL A 99 86 H AlphaHelix -72.16 -49.52 0.6 4J3C ASG GLN A 100 87 H AlphaHelix -59.46 -40.96 5.4 4J3C ASG LYS A 101 88 H AlphaHelix -67.73 -37.63 14.3 4J3C ASG ALA A 102 89 H AlphaHelix -55.43 -45.32 14.6 4J3C ASG VAL A 103 90 H AlphaHelix -63.60 -50.74 0.5 4J3C ASG GLU A 104 91 H AlphaHelix -57.10 360.00 7.6 4J3C ASG GLY A 106 92 C Coil 360.00 13.11 11.3 4J3C ASG ALA A 107 93 T Turn -69.14 130.62 6.1 4J3C ASG GLY A 108 94 T Turn -88.63 -19.22 11.9 4J3C ASG VAL A 109 95 E Strand -140.38 132.20 37.1 4J3C ASG LEU A 110 96 E Strand -112.45 113.24 0.2 4J3C ASG GLN A 111 97 E Strand -122.76 103.26 17.2 4J3C ASG PRO A 112 98 E Strand -66.97 139.14 2.0 4J3C ASG VAL A 113 99 C Coil -120.37 360.00 10.5 4J3C ASG THR A 115 100 T Turn 360.00 169.78 28.9 4J3C ASG GLN A 116 101 T Turn -51.95 -44.55 135.2 4J3C ASG HIS A 117 102 T Turn -95.66 12.57 75.8 4J3C ASG VAL A 118 103 T Turn -64.88 132.05 41.9 4J3C ASG GLN A 119 104 C Coil -114.94 -35.31 133.1 4J3C ASG GLY A 120 105 C Coil -68.61 170.83 12.6 4J3C ASG LYS A 121 106 C Coil -128.04 154.32 188.9 4J3C ASG ILE A 122 107 C Coil -74.50 -37.00 18.2 4J3C ASG GLY A 123 108 C Coil 72.96 -157.69 59.3 4J3C ASG SER A 124 109 C Coil -72.55 124.05 51.6 4J3C ASG LEU A 125 110 H AlphaHelix -60.78 -28.95 16.4 4J3C ASG GLU A 126 111 H AlphaHelix -56.52 -44.19 158.5 4J3C ASG ARG A 127 112 H AlphaHelix -73.71 -37.19 170.4 4J3C ASG VAL A 128 113 H AlphaHelix -57.37 -52.54 5.8 4J3C ASG ARG A 129 114 H AlphaHelix -56.13 -35.36 115.4 4J3C ASG ALA A 130 115 H AlphaHelix -70.87 -40.10 59.4 4J3C ASG ASN A 131 116 H AlphaHelix -61.14 -42.16 32.7 4J3C ASG VAL A 132 117 H AlphaHelix -54.81 -48.43 1.4 4J3C ASG ILE A 133 118 H AlphaHelix -63.54 -44.19 37.7 4J3C ASG GLU A 134 119 H AlphaHelix -59.72 -46.27 91.2 4J3C ASG ALA A 135 120 H AlphaHelix -59.95 -44.63 0.0 4J3C ASG ALA A 136 121 H AlphaHelix -58.35 -44.73 0.0 4J3C ASG GLU A 137 122 H AlphaHelix -65.81 -39.05 37.0 4J3C ASG GLN A 138 123 H AlphaHelix -77.30 -32.30 123.2 4J3C ASG CYS A 139 124 H AlphaHelix -114.99 10.03 4.0 4J3C ASG GLY A 140 125 C Coil 77.99 15.76 5.9 4J3C ASG VAL A 141 126 C Coil -76.53 124.02 10.1 4J3C ASG LEU A 142 127 C Coil -94.99 -23.47 4.1 4J3C ASG GLY A 143 128 C Coil -83.07 125.61 22.3 4J3C ASG ILE A 144 129 C Coil -82.61 118.09 57.8 4J3C ASG PRO A 145 130 C Coil -65.97 145.67 9.3 4J3C ASG ALA A 146 131 E Strand -77.15 146.36 43.9 4J3C ASG VAL A 147 132 E Strand -114.79 124.78 10.3 4J3C ASG GLU A 148 133 C Coil -98.94 155.96 81.6 4J3C ASG GLU A 149 134 C Coil -57.77 140.37 131.2 4J3C ASG PRO A 150 135 C Coil -62.05 148.59 61.9 4J3C ASG ARG A 151 136 C Coil -133.74 152.46 95.5 4J3C ASG LYS A 152 137 C Coil -69.83 137.02 135.6 4J3C ASG LEU A 153 138 H AlphaHelix -51.15 -54.25 3.2 4J3C ASG GLU A 154 139 H AlphaHelix -58.79 -35.30 72.0 4J3C ASG ASP A 155 140 H AlphaHelix -63.71 -46.58 87.7 4J3C ASG LEU A 156 141 H AlphaHelix -56.46 -45.54 11.8 4J3C ASG LEU A 157 142 H AlphaHelix -66.11 -32.64 4.0 4J3C ASG ILE A 158 143 H AlphaHelix -65.52 -43.36 124.4 4J3C ASG ASP A 159 144 H AlphaHelix -103.03 27.03 102.4 4J3C ASG TRP A 160 145 C Coil -76.21 131.48 19.7 4J3C ASG PRO A 161 146 T Turn -62.56 126.26 65.1 4J3C ASG ARG A 162 147 T Turn -75.26 -18.32 136.7 4J3C ASG ASP A 163 148 T Turn -68.30 -4.19 77.4 4J3C ASG ARG A 164 149 E Strand -121.31 119.27 23.5 4J3C ASG ARG A 165 150 E Strand -81.99 130.80 34.3 4J3C ASG ILE A 166 151 E Strand -90.40 127.36 1.8 4J3C ASG VAL A 167 152 E Strand -100.90 131.16 0.0 4J3C ASG PHE A 168 153 E Strand -128.97 164.56 2.8 4J3C ASG CYS A 169 154 E Strand -98.55 125.12 37.2 4J3C ASG ASP A 170 155 C Coil -149.68 148.59 45.1 4J3C ASG GLU A 171 156 T Turn -61.24 135.22 180.7 4J3C ASG GLY A 172 157 T Turn -85.12 360.00 66.8 4J3C ASG SER A 175 158 T Turn 360.00 135.88 112.7 4J3C ASG GLN A 176 159 T Turn -113.10 16.15 73.5 4J3C ASG ASN A 177 160 C Coil -93.61 114.51 20.6 4J3C ASG PRO A 178 161 H AlphaHelix -68.41 -25.94 0.0 4J3C ASG LEU A 179 162 H AlphaHelix -57.30 -51.43 18.8 4J3C ASG PRO A 180 163 H AlphaHelix -62.38 -28.98 79.8 4J3C ASG ILE A 181 164 H AlphaHelix -74.51 -43.92 64.3 4J3C ASG LEU A 182 165 H AlphaHelix -59.62 -35.75 0.2 4J3C ASG GLU A 183 166 H AlphaHelix -63.17 -28.67 124.5 4J3C ASG GLY A 184 167 H AlphaHelix -78.90 -4.02 66.2 4J3C ASG ILE A 185 168 C Coil -80.00 120.09 16.7 4J3C ASG ALA A 186 169 C Coil -89.30 -28.73 91.1 4J3C ASG GLU A 187 170 C Coil -61.02 138.66 50.4 4J3C ASG ARG A 188 171 C Coil -80.33 -12.09 230.6 4J3C ASG ARG A 189 172 E Strand -121.11 140.96 108.4 4J3C ASG LEU A 190 173 E Strand -132.44 157.29 15.1 4J3C ASG ALA A 191 174 E Strand -142.58 140.45 0.0 4J3C ASG LEU A 192 175 E Strand -106.50 128.97 9.4 4J3C ASG LEU A 193 176 E Strand -112.02 122.97 1.6 4J3C ASG ILE A 194 177 E Strand -122.39 130.69 13.0 4J3C ASG GLY A 195 178 C Coil -87.21 -165.97 7.4 4J3C ASG PRO A 196 179 T Turn -81.89 176.42 6.0 4J3C ASG GLU A 197 180 T Turn -50.95 -37.12 69.1 4J3C ASG GLY A 198 181 T Turn -84.02 10.70 50.7 4J3C ASG GLY A 199 182 T Turn 60.57 -165.62 26.2 4J3C ASG PHE A 200 183 C Coil -91.15 145.45 16.0 4J3C ASG SER A 201 184 C Coil -64.20 169.35 19.4 4J3C ASG GLU A 202 185 H AlphaHelix -62.77 -42.45 104.9 4J3C ASG ALA A 203 186 H AlphaHelix -61.70 -43.66 71.0 4J3C ASG GLU A 204 187 H AlphaHelix -60.80 -42.22 5.6 4J3C ASG ARG A 205 188 H AlphaHelix -59.37 -44.94 84.0 4J3C ASG ASP A 206 189 H AlphaHelix -67.09 -38.19 93.0 4J3C ASG LEU A 207 190 H AlphaHelix -67.17 -45.06 53.4 4J3C ASG LEU A 208 191 H AlphaHelix -57.17 -54.05 0.2 4J3C ASG ARG A 209 192 H AlphaHelix -57.75 -28.17 125.4 4J3C ASG SER A 210 193 H AlphaHelix -73.93 -11.97 66.4 4J3C ASG ARG A 211 194 T Turn -89.75 133.36 69.1 4J3C ASG ASP A 212 195 T Turn -65.55 -27.49 149.5 4J3C ASG PHE A 213 196 T Turn -98.16 5.88 7.1 4J3C ASG VAL A 214 197 E Strand -107.39 129.23 14.6 4J3C ASG THR A 215 198 E Strand -122.14 126.89 32.8 4J3C ASG ALA A 216 199 E Strand -74.65 138.29 38.8 4J3C ASG ILE A 217 200 E Strand -130.00 145.55 0.2 4J3C ASG PRO A 218 201 C Coil -85.34 158.57 5.0 4J3C ASG LEU A 219 202 C Coil -132.91 56.02 16.8 4J3C ASG GLY A 220 203 C Coil 88.91 -172.18 14.6 4J3C ASG PRO A 221 204 C Coil -92.40 -12.48 60.6 4J3C ASG ARG A 222 205 C Coil -109.14 146.03 33.1 4J3C ASG ILE A 223 206 C Coil -68.95 132.09 94.4 4J3C ASG LEU A 224 207 C Coil -103.62 141.38 30.1 4J3C ASG ARG A 225 208 C Coil -67.45 157.81 44.5 4J3C ASG ALA A 226 209 H AlphaHelix -53.22 -40.79 15.3 4J3C ASG ASP A 227 210 H AlphaHelix -71.42 -31.15 13.6 4J3C ASG THR A 228 211 H AlphaHelix -74.08 -45.74 5.4 4J3C ASG ALA A 229 212 H AlphaHelix -61.69 -37.67 7.2 4J3C ASG ALA A 230 213 H AlphaHelix -60.02 -52.92 16.4 4J3C ASG VAL A 231 214 H AlphaHelix -67.66 -44.08 18.8 4J3C ASG ALA A 232 215 H AlphaHelix -61.23 -47.71 2.8 4J3C ASG ALA A 233 216 H AlphaHelix -63.84 360.00 3.5 4J3C ASG ALA A 235 217 H AlphaHelix 360.00 -52.83 11.6 4J3C ASG VAL A 236 218 H AlphaHelix -65.85 -36.37 0.0 4J3C ASG ILE A 237 219 H AlphaHelix -64.17 -47.61 3.4 4J3C ASG GLN A 238 220 H AlphaHelix -67.61 -38.87 18.8 4J3C ASG ALA A 239 221 H AlphaHelix -68.95 -32.09 1.2 4J3C ASG THR A 240 222 H AlphaHelix -87.24 -45.58 15.5 4J3C ASG LEU A 241 223 H AlphaHelix -125.81 -10.80 37.5 4J3C ASG GLY A 242 224 C Coil -111.86 -145.60 12.2 4J3C ASG ASP A 243 225 C Coil -93.09 14.56 53.2 4J3C ASG TRP A 244 226 C Coil -87.23 -8.82 11.4 4J3C ASG ARG A 245 227 C Coil -67.73 360.00 176.2 4J3C ASG GLN B 8 1 C Coil 360.00 155.83 92.1 4J3C ASG ARG B 9 2 E Strand -131.69 127.14 56.3 4J3C ASG LEU B 10 3 E Strand -124.59 134.13 9.6 4J3C ASG PHE B 11 4 E Strand -84.60 129.08 30.4 4J3C ASG ILE B 12 5 C Coil -122.91 151.75 4.9 4J3C ASG GLU B 13 6 C Coil -98.05 -20.05 151.8 4J3C ASG ASN B 14 7 C Coil -62.65 153.13 81.4 4J3C ASG ALA B 15 8 C Coil -64.25 152.13 45.8 4J3C ASG LEU B 16 9 C Coil -125.75 130.27 8.3 4J3C ASG HIS B 17 10 T Turn -169.68 170.73 97.0 4J3C ASG ALA B 18 11 T Turn -59.34 124.43 70.3 4J3C ASG GLY B 19 12 T Turn 92.01 -7.25 35.1 4J3C ASG ALA B 20 13 E Strand -63.25 133.92 5.8 4J3C ASG LYS B 21 14 E Strand -113.03 143.93 144.1 4J3C ASG HIS B 22 15 E Strand -133.29 114.55 22.0 4J3C ASG GLU B 23 16 E Strand -70.08 120.71 152.9 4J3C ASG ALA B 24 17 E Strand -60.00 128.36 14.7 4J3C ASG THR B 25 18 C Coil -69.95 168.66 76.1 4J3C ASG ARG B 26 19 H AlphaHelix -47.73 -47.20 93.5 4J3C ASG GLU B 27 20 H AlphaHelix -62.38 -45.14 74.5 4J3C ASG GLN B 28 21 H AlphaHelix -65.81 -44.14 30.5 4J3C ASG PHE B 29 22 H AlphaHelix -60.52 -49.59 21.4 4J3C ASG ASN B 30 23 H AlphaHelix -59.80 -39.54 95.2 4J3C ASG TYR B 31 24 H AlphaHelix -68.08 -49.93 82.8 4J3C ASG LEU B 32 25 H AlphaHelix -81.06 -23.50 1.8 4J3C ASG ILE B 33 26 H AlphaHelix -114.70 -31.84 61.3 4J3C ASG ASN B 34 27 H AlphaHelix -104.76 -11.50 59.5 4J3C ASG VAL B 35 28 H AlphaHelix -108.41 -37.15 90.9 4J3C ASG LEU B 36 29 C Coil -103.44 -11.70 65.3 4J3C ASG ARG B 37 30 C Coil 52.55 35.20 214.9 4J3C ASG LEU B 38 31 C Coil -70.84 148.02 45.3 4J3C ASG GLY B 39 32 T Turn -128.64 -164.10 34.0 4J3C ASG GLU B 40 33 T Turn -65.93 126.30 170.4 4J3C ASG GLY B 41 34 T Turn 93.69 -9.59 44.9 4J3C ASG SER B 42 35 E Strand -62.30 140.62 32.4 4J3C ASG SER B 43 36 E Strand -96.76 146.16 53.2 4J3C ASG LEU B 44 37 E Strand -148.06 170.12 6.4 4J3C ASG LEU B 45 38 E Strand -95.90 143.85 43.7 4J3C ASG VAL B 46 39 E Strand -138.24 142.97 1.6 4J3C ASG PHE B 47 40 E Strand -154.30 160.68 0.0 4J3C ASG ASN B 48 41 T Turn -137.10 5.46 4.6 4J3C ASG GLY B 49 42 T Turn 87.08 -1.75 24.5 4J3C ASG ARG B 50 43 T Turn -136.62 -29.90 125.1 4J3C ASG ASP B 51 44 T Turn -107.25 19.58 52.6 4J3C ASG GLY B 52 45 T Turn 77.62 -157.41 0.0 4J3C ASG GLU B 53 46 E Strand -117.18 125.75 4.6 4J3C ASG TRP B 54 47 E Strand -115.75 148.17 34.9 4J3C ASG ARG B 55 48 E Strand -86.17 125.64 59.7 4J3C ASG ALA B 56 49 E Strand -114.41 159.39 0.4 4J3C ASG GLU B 57 50 E Strand -119.77 147.94 67.5 4J3C ASG ILE B 58 51 E Strand -85.08 125.73 8.9 4J3C ASG ALA B 59 52 E Strand -115.46 360.00 44.9 4J3C ASG PRO B 61 53 E Strand 360.00 -4.19 116.0 4J3C ASG SER B 62 54 T Turn -154.79 139.22 82.2 4J3C ASG ARG B 63 55 T Turn -58.99 360.00 149.2 4J3C ASG GLN B 65 56 T Turn 360.00 120.51 84.9 4J3C ASG ALA B 66 57 E Strand -126.80 142.86 7.3 4J3C ASG VAL B 67 58 E Strand -123.93 128.33 24.3 4J3C ASG LEU B 68 59 E Strand -93.57 129.68 3.9 4J3C ASG VAL B 69 60 E Strand -118.30 111.88 43.5 4J3C ASG ALA B 70 61 E Strand -68.35 131.08 2.8 4J3C ASG VAL B 71 62 E Strand -103.70 -60.19 59.9 4J3C ASG GLU B 72 63 E Strand -139.70 142.86 98.8 4J3C ASG GLN B 73 64 E Strand -75.00 122.85 85.4 4J3C ASG THR B 74 65 E Strand -94.00 -27.88 63.3 4J3C ASG ARG B 75 66 E Strand -144.47 138.81 94.4 4J3C ASG PRO B 76 67 C Coil -71.45 161.30 92.4 4J3C ASG GLN B 77 68 C Coil -71.47 117.21 55.3 4J3C ASG PRO B 78 69 C Coil -77.98 174.72 64.5 4J3C ASG ALA B 79 70 C Coil -67.21 143.57 82.4 4J3C ASG PRO B 80 71 C Coil -55.07 145.03 115.5 4J3C ASG CYS B 81 72 C Coil -73.94 143.81 47.7 4J3C ASG ASP B 82 73 C Coil -85.82 -22.59 76.8 4J3C ASG LEU B 83 74 C Coil -62.25 125.10 31.2 4J3C ASG VAL B 84 75 E Strand -97.95 133.76 16.6 4J3C ASG TYR B 85 76 E Strand -115.01 110.40 11.6 4J3C ASG LEU B 86 77 E Strand -101.90 113.85 5.8 4J3C ASG PHE B 87 78 E Strand -137.07 144.35 1.6 4J3C ASG ALA B 88 79 C Coil -93.06 135.92 3.5 4J3C ASG PRO B 89 80 C Coil -66.64 141.65 8.4 4J3C ASG LEU B 90 81 C Coil -137.10 360.00 11.9 4J3C ASG VAL B 92 82 H AlphaHelix 360.00 -31.43 50.9 4J3C ASG GLY B 93 83 H AlphaHelix -68.92 -52.05 47.8 4J3C ASG ARG B 94 84 H AlphaHelix -65.86 -23.35 45.1 4J3C ASG LEU B 95 85 H AlphaHelix -70.34 -51.38 1.6 4J3C ASG ASP B 96 86 H AlphaHelix -46.08 -53.19 40.3 4J3C ASG TYR B 97 87 H AlphaHelix -59.28 -46.34 24.5 4J3C ASG LEU B 98 88 H AlphaHelix -54.39 -51.55 5.4 4J3C ASG VAL B 99 89 H AlphaHelix -61.41 -49.82 0.8 4J3C ASG GLN B 100 90 H AlphaHelix -61.92 -41.96 23.9 4J3C ASG LYS B 101 91 H AlphaHelix -64.82 -39.39 15.9 4J3C ASG ALA B 102 92 H AlphaHelix -55.22 -40.87 15.4 4J3C ASG VAL B 103 93 H AlphaHelix -65.05 -42.73 1.1 4J3C ASG GLU B 104 94 H AlphaHelix -64.13 360.00 8.7 4J3C ASG GLY B 106 95 C Coil 360.00 18.71 10.7 4J3C ASG ALA B 107 96 T Turn -65.81 137.95 8.5 4J3C ASG GLY B 108 97 T Turn -99.06 -16.81 12.5 4J3C ASG VAL B 109 98 E Strand -142.60 131.86 38.1 4J3C ASG LEU B 110 99 E Strand -106.36 106.22 0.0 4J3C ASG GLN B 111 100 E Strand -112.95 102.12 17.6 4J3C ASG PRO B 112 101 E Strand -64.96 137.14 0.8 4J3C ASG VAL B 113 102 C Coil -127.70 360.00 11.3 4J3C ASG THR B 115 103 T Turn 360.00 168.91 28.4 4J3C ASG GLN B 116 104 T Turn -49.65 -46.04 134.2 4J3C ASG HIS B 117 105 T Turn -96.18 10.20 73.1 4J3C ASG VAL B 118 106 T Turn -58.40 126.55 38.8 4J3C ASG GLN B 119 107 C Coil -112.12 -45.45 160.8 4J3C ASG GLY B 120 108 C Coil -68.86 174.02 26.7 4J3C ASG LYS B 121 109 C Coil -132.66 155.03 168.0 4J3C ASG ILE B 122 110 C Coil -52.69 -44.13 21.9 4J3C ASG GLY B 123 111 C Coil 84.35 -137.25 65.1 4J3C ASG SER B 124 112 C Coil -112.25 133.57 79.8 4J3C ASG LEU B 125 113 H AlphaHelix -44.18 -26.54 32.5 4J3C ASG GLU B 126 114 H AlphaHelix -53.46 -54.14 165.4 4J3C ASG ARG B 127 115 H AlphaHelix -69.35 -40.14 118.4 4J3C ASG VAL B 128 116 H AlphaHelix -53.73 -44.80 3.1 4J3C ASG ARG B 129 117 H AlphaHelix -67.85 -40.29 100.3 4J3C ASG ALA B 130 118 H AlphaHelix -60.09 -35.88 54.9 4J3C ASG ASN B 131 119 H AlphaHelix -66.32 -37.34 16.4 4J3C ASG VAL B 132 120 H AlphaHelix -61.04 -49.38 1.6 4J3C ASG ILE B 133 121 H AlphaHelix -59.57 -52.05 41.5 4J3C ASG GLU B 134 122 H AlphaHelix -45.92 -52.76 104.0 4J3C ASG ALA B 135 123 H AlphaHelix -61.65 -46.61 0.0 4J3C ASG ALA B 136 124 H AlphaHelix -55.34 -47.46 0.0 4J3C ASG GLU B 137 125 H AlphaHelix -60.83 -40.87 33.7 4J3C ASG GLN B 138 126 H AlphaHelix -74.27 -37.55 91.7 4J3C ASG CYS B 139 127 H AlphaHelix -104.82 1.60 1.9 4J3C ASG GLY B 140 128 C Coil 74.73 26.32 3.4 4J3C ASG VAL B 141 129 C Coil -80.63 113.56 15.9 4J3C ASG LEU B 142 130 C Coil -83.62 -26.58 7.9 4J3C ASG GLY B 143 131 C Coil -88.59 125.10 20.3 4J3C ASG ILE B 144 132 C Coil -84.37 111.00 57.6 4J3C ASG PRO B 145 133 C Coil -60.11 142.75 9.0 4J3C ASG ALA B 146 134 E Strand -76.97 148.69 46.0 4J3C ASG VAL B 147 135 E Strand -112.39 123.53 9.0 4J3C ASG GLU B 148 136 C Coil -97.41 161.22 80.4 4J3C ASG GLU B 149 137 C Coil -65.60 140.07 118.5 4J3C ASG PRO B 150 138 C Coil -55.76 142.55 68.3 4J3C ASG ARG B 151 139 C Coil -139.20 148.76 99.8 4J3C ASG LYS B 152 140 C Coil -65.70 134.39 105.7 4J3C ASG LEU B 153 141 H AlphaHelix -41.13 -50.72 4.4 4J3C ASG GLU B 154 142 H AlphaHelix -67.78 -25.40 80.7 4J3C ASG ASP B 155 143 H AlphaHelix -76.55 -43.18 69.5 4J3C ASG LEU B 156 144 H AlphaHelix -61.62 -31.91 8.2 4J3C ASG LEU B 157 145 H AlphaHelix -75.96 -21.54 2.8 4J3C ASG ILE B 158 146 H AlphaHelix -56.42 -57.27 117.1 4J3C ASG ASP B 159 147 C Coil -115.68 32.55 118.2 4J3C ASG TRP B 160 148 C Coil -63.89 133.30 25.2 4J3C ASG PRO B 161 149 T Turn -62.61 119.71 66.0 4J3C ASG ARG B 162 150 T Turn -51.91 -18.52 141.3 4J3C ASG ASP B 163 151 T Turn -78.90 -29.94 89.1 4J3C ASG ARG B 164 152 T Turn -97.53 111.22 24.7 4J3C ASG ARG B 165 153 E Strand -70.31 129.43 31.5 4J3C ASG ILE B 166 154 E Strand -91.50 123.16 1.8 4J3C ASG VAL B 167 155 E Strand -98.83 127.15 0.0 4J3C ASG PHE B 168 156 E Strand -129.14 158.73 14.4 4J3C ASG CYS B 169 157 C Coil -99.80 360.00 56.0 4J3C ASG ASN B 173 158 C Coil 360.00 144.69 119.1 4J3C ASG ASP B 174 159 C Coil -76.12 -47.98 172.7 4J3C ASG SER B 175 160 C Coil -93.42 -179.70 60.0 4J3C ASG GLN B 176 161 C Coil -114.04 -21.99 79.9 4J3C ASG ASN B 177 162 C Coil -93.14 112.28 31.1 4J3C ASG PRO B 178 163 H AlphaHelix -69.64 -19.18 0.0 4J3C ASG LEU B 179 164 H AlphaHelix -59.92 -50.70 11.8 4J3C ASG PRO B 180 165 H AlphaHelix -59.51 -37.12 77.6 4J3C ASG ILE B 181 166 H AlphaHelix -67.88 -51.97 49.7 4J3C ASG LEU B 182 167 H AlphaHelix -57.46 -37.52 0.0 4J3C ASG GLU B 183 168 H AlphaHelix -65.56 -23.20 131.4 4J3C ASG GLY B 184 169 H AlphaHelix -86.84 4.11 64.1 4J3C ASG ILE B 185 170 C Coil -81.82 117.42 6.1 4J3C ASG ALA B 186 171 C Coil -75.95 -34.03 88.1 4J3C ASG GLU B 187 172 C Coil -65.09 156.90 43.8 4J3C ASG ARG B 188 173 C Coil -125.02 9.36 125.0 4J3C ASG ARG B 189 174 C Coil -102.64 124.26 123.9 4J3C ASG LEU B 190 175 E Strand -129.74 156.55 10.5 4J3C ASG ALA B 191 176 E Strand -132.13 148.78 0.0 4J3C ASG LEU B 192 177 E Strand -113.94 131.43 11.0 4J3C ASG LEU B 193 178 E Strand -114.69 125.79 1.8 4J3C ASG ILE B 194 179 E Strand -127.29 132.07 9.5 4J3C ASG GLY B 195 180 C Coil -84.66 -172.65 9.3 4J3C ASG PRO B 196 181 T Turn -82.40 -179.79 7.4 4J3C ASG GLU B 197 182 T Turn -51.33 -40.44 115.6 4J3C ASG GLY B 198 183 T Turn -75.07 -1.85 51.2 4J3C ASG GLY B 199 184 T Turn 73.30 -162.68 26.8 4J3C ASG PHE B 200 185 C Coil -100.27 144.54 29.0 4J3C ASG SER B 201 186 C Coil -66.47 168.01 1.2 4J3C ASG GLU B 202 187 H AlphaHelix -63.65 -39.32 132.8 4J3C ASG ALA B 203 188 H AlphaHelix -62.97 -44.24 69.5 4J3C ASG GLU B 204 189 H AlphaHelix -60.49 -44.52 9.6 4J3C ASG ARG B 205 190 H AlphaHelix -55.83 -47.62 114.0 4J3C ASG ASP B 206 191 H AlphaHelix -59.12 -42.68 90.3 4J3C ASG LEU B 207 192 H AlphaHelix -61.28 -36.34 53.2 4J3C ASG LEU B 208 193 H AlphaHelix -75.46 -45.54 0.2 4J3C ASG ARG B 209 194 H AlphaHelix -67.40 -19.27 167.6 4J3C ASG SER B 210 195 H AlphaHelix -93.06 2.89 78.1 4J3C ASG ARG B 211 196 T Turn -101.20 128.65 60.0 4J3C ASG ASP B 212 197 T Turn -74.48 -18.85 120.0 4J3C ASG PHE B 213 198 T Turn -86.81 14.39 2.2 4J3C ASG VAL B 214 199 E Strand -117.36 138.09 15.8 4J3C ASG THR B 215 200 E Strand -137.41 124.09 34.8 4J3C ASG ALA B 216 201 E Strand -73.94 136.40 34.3 4J3C ASG ILE B 217 202 C Coil -127.00 145.31 0.5 4J3C ASG PRO B 218 203 C Coil -88.52 160.61 10.3 4J3C ASG LEU B 219 204 C Coil -130.66 53.74 17.9 4J3C ASG GLY B 220 205 C Coil 93.19 -178.22 17.5 4J3C ASG PRO B 221 206 C Coil -95.69 4.23 55.8 4J3C ASG ARG B 222 207 C Coil -116.08 140.44 25.7 4J3C ASG ILE B 223 208 C Coil -61.40 122.48 119.1 4J3C ASG LEU B 224 209 C Coil -102.45 141.15 34.9 4J3C ASG ARG B 225 210 C Coil -56.63 147.91 44.7 4J3C ASG ALA B 226 211 H AlphaHelix -53.73 -39.93 15.6 4J3C ASG ASP B 227 212 H AlphaHelix -75.87 -32.09 3.1 4J3C ASG THR B 228 213 H AlphaHelix -63.05 -47.11 4.6 4J3C ASG ALA B 229 214 H AlphaHelix -58.44 -39.31 7.4 4J3C ASG ALA B 230 215 H AlphaHelix -61.47 -48.26 18.2 4J3C ASG VAL B 231 216 H AlphaHelix -69.25 -44.57 16.9 4J3C ASG ALA B 232 217 H AlphaHelix -61.05 -45.35 3.0 4J3C ASG ALA B 233 218 H AlphaHelix -60.15 360.00 3.3 4J3C ASG ALA B 235 219 H AlphaHelix 360.00 -55.99 12.6 4J3C ASG VAL B 236 220 H AlphaHelix -68.18 -29.16 0.0 4J3C ASG ILE B 237 221 H AlphaHelix -71.50 -42.10 5.2 4J3C ASG GLN B 238 222 H AlphaHelix -66.28 -40.42 18.2 4J3C ASG ALA B 239 223 H AlphaHelix -71.02 -33.17 1.4 4J3C ASG THR B 240 224 H AlphaHelix -94.36 -35.21 20.1 4J3C ASG LEU B 241 225 H AlphaHelix -127.24 -15.06 3.3 4J3C ASG GLY B 242 226 C Coil -116.60 -145.94 14.4 4J3C ASG ASP B 243 227 C Coil -93.81 24.05 57.5 4J3C ASG TRP B 244 228 C Coil -99.11 -26.53 10.6 4J3C ASG ARG B 245 229 C Coil -44.67 360.00 143.8 4J3C