NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type
588687 2rut 11474 cing 1-original 4 AMBER dihedral angle


# 571 atoms read from pdb file leap.pdb.
# 10 PHE PHI:  (9 ILE C)-(10 PHE N)-(10 PHE CA)-(10 PHE C) -139.0 -79.0
 &rst     iat =   107,   109,   111,   127,
   r1 = -140.0, r2 = -139.0, r3 = -79.0, r4 = -78.0,
   rk2 = 60.0, rk3 = 60.0,    &end
# 10 PHE PSI:  (10 PHE N)-(10 PHE CA)-(10 PHE C)-(11 THR N)  80.0 140.0
 &rst     iat =   109,   111,   127,   129,
   r1 =  79.0, r2 =  80.0, r3 = 140.0, r4 = 141.0,
 &end
# 11 THR PHI:  (10 PHE C)-(11 THR N)-(11 THR CA)-(11 THR C) -145.0 -85.0
 &rst     iat =   127,   129,   131,   141,
   r1 = -146.0, r2 = -145.0, r3 = -85.0, r4 = -84.0,
 &end
# 11 THR PSI:  (11 THR N)-(11 THR CA)-(11 THR C)-(12 CYM N) 112.0 172.0
 &rst     iat =   129,   131,   141,   143,
   r1 = 111.0, r2 = 112.0, r3 = 172.0, r4 = 173.0,
 &end
# 18 VAL PHI:  (17 LYS C)-(18 VAL N)-(18 VAL CA)-(18 VAL C) -145.0 -85.0
 &rst     iat =   233,   235,   237,   249,
   r1 = -146.0, r2 = -145.0, r3 = -85.0, r4 = -84.0,
 &end
# 18 VAL PSI:  (18 VAL N)-(18 VAL CA)-(18 VAL C)-(19 PHE N) 112.0 172.0
 &rst     iat =   235,   237,   249,   251,
   r1 = 111.0, r2 = 112.0, r3 = 172.0, r4 = 173.0,
 &end
# 19 PHE PHI:  (18 VAL C)-(19 PHE N)-(19 PHE CA)-(19 PHE C) -146.1 -86.1
 &rst     iat =   249,   251,   253,   269,
   r1 = -147.1, r2 = -146.1, r3 = -86.1, r4 = -85.1,
 &end
# 19 PHE PSI:  (19 PHE N)-(19 PHE CA)-(19 PHE C)-(20 LYS N) 116.3 176.3
 &rst     iat =   251,   253,   269,   271,
   r1 = 115.3, r2 = 116.3, r3 = 176.3, r4 = 177.3,
 &end
# 23 HIS PHI:  (22 LYS C)-(23 HID N)-(23 HID CA)-(23 HID C) -95.8 -35.8
 &rst     iat =   333,   335,   337,   350,
   r1 = -96.8, r2 = -95.8, r3 = -35.8, r4 = -34.8,
 &end
# 23 HIS PSI:  (23 HID N)-(23 HID CA)-(23 HID C)-(24 SER N) -67.7  -7.7
 &rst     iat =   335,   337,   350,   352,
   r1 = -68.7, r2 = -67.7, r3 =  -7.7, r4 =  -6.7,
 &end
# 24 SER PHI:  (23 HID C)-(24 SER N)-(24 SER CA)-(24 SER C) -96.7 -36.7
 &rst     iat =   350,   352,   354,   361,
   r1 = -97.7, r2 = -96.7, r3 = -36.7, r4 = -35.7,
 &end
# 24 SER PSI:  (24 SER N)-(24 SER CA)-(24 SER C)-(25 LEU N) -68.5  -8.5
 &rst     iat =   352,   354,   361,   363,
   r1 = -69.5, r2 = -68.5, r3 =  -8.5, r4 =  -7.5,
 &end
# 25 LEU PHI:  (24 SER C)-(25 LEU N)-(25 LEU CA)-(25 LEU C) -98.4 -38.4
 &rst     iat =   361,   363,   365,   380,
   r1 = -99.4, r2 = -98.4, r3 = -38.4, r4 = -37.4,
 &end
# 25 LEU PSI:  (25 LEU N)-(25 LEU CA)-(25 LEU C)-(26 GLN N) -66.8  -6.8
 &rst     iat =   363,   365,   380,   382,
   r1 = -67.8, r2 = -66.8, r3 =  -6.8, r4 =  -5.8,
 &end
# 26 GLN PHI:  (25 LEU C)-(26 GLN N)-(26 GLN CA)-(26 GLN C) -91.0 -31.0
 &rst     iat =   380,   382,   384,   397,
   r1 = -92.0, r2 = -91.0, r3 = -31.0, r4 = -30.0,
 &end
# 26 GLN PSI:  (26 GLN N)-(26 GLN CA)-(26 GLN C)-(27 ALA N) -71.1 -11.1
 &rst     iat =   382,   384,   397,   399,
   r1 = -72.1, r2 = -71.1, r3 = -11.1, r4 = -10.1,
 &end
# 27 ALA PHI:  (26 GLN C)-(27 ALA N)-(27 ALA CA)-(27 ALA C) -94.0 -34.0
 &rst     iat =   397,   399,   401,   407,
   r1 = -95.0, r2 = -94.0, r3 = -34.0, r4 = -33.0,
 &end
# 27 ALA PSI:  (27 ALA N)-(27 ALA CA)-(27 ALA C)-(28 HID N) -71.7 -11.7
 &rst     iat =   399,   401,   407,   409,
   r1 = -72.7, r2 = -71.7, r3 = -11.7, r4 = -10.7,
 &end
# 28 HIS PHI:  (27 ALA C)-(28 HID N)-(28 HID CA)-(28 HID C) -94.1 -34.1
 &rst     iat =   407,   409,   411,   424,
   r1 = -95.1, r2 = -94.1, r3 = -34.1, r4 = -33.1,
 &end
# 28 HIS PSI:  (28 HID N)-(28 HID CA)-(28 HID C)-(29 LEU N) -68.5  -8.5
 &rst     iat =   409,   411,   424,   426,
   r1 = -69.5, r2 = -68.5, r3 =  -8.5, r4 =  -7.5,
 &end
# 29 LEU PHI:  (28 HID C)-(29 LEU N)-(29 LEU CA)-(29 LEU C) -93.8 -33.8
 &rst     iat =   424,   426,   428,   443,
   r1 = -94.8, r2 = -93.8, r3 = -33.8, r4 = -32.8,
 &end
# 29 LEU PSI:  (29 LEU N)-(29 LEU CA)-(29 LEU C)-(30 ARG N) -69.7  -9.7
 &rst     iat =   426,   428,   443,   445,
   r1 = -70.7, r2 = -69.7, r3 =  -9.7, r4 =  -8.7,
 &end
# 30 ARG PHI:  (29 LEU C)-(30 ARG N)-(30 ARG CA)-(30 ARG C) -93.9 -33.9
 &rst     iat =   443,   445,   447,   467,
   r1 = -94.9, r2 = -93.9, r3 = -33.9, r4 = -32.9,
 &end
# 30 ARG PSI:  (30 ARG N)-(30 ARG CA)-(30 ARG C)-(31 ILE N) -68.0  -8.0
 &rst     iat =   445,   447,   467,   469,
   r1 = -69.0, r2 = -68.0, r3 =  -8.0, r4 =  -7.0,
 &end
# 31 ILE PHI:  (30 ARG C)-(31 ILE N)-(31 ILE CA)-(31 ILE C) -102.0 -42.0
 &rst     iat =   467,   469,   471,   486,
   r1 = -103.0, r2 = -102.0, r3 = -42.0, r4 = -41.0,
 &end
# 31 ILE PSI:  (31 ILE N)-(31 ILE CA)-(31 ILE C)-(32 HID N) -63.0  -3.0
 &rst     iat =   469,   471,   486,   488,
   r1 = -64.0, r2 = -63.0, r3 =  -3.0, r4 =  -2.0,
 &end
# 32 HIS PHI:  (31 ILE C)-(32 HID N)-(32 HID CA)-(32 HID C) -113.8 -53.8
 &rst     iat =   486,   488,   490,   503,
   r1 = -114.8, r2 = -113.8, r3 = -53.8, r4 = -52.8,
 &end
# 32 HIS PSI:  (32 HID N)-(32 HID CA)-(32 HID C)-(33 THR N) -50.6   9.4
 &rst     iat =   488,   490,   503,   505,
   r1 = -51.6, r2 = -50.6, r3 =   9.4, r4 =  10.4,
 &end


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