NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
489853 2l0g cing 1-original 1 AMBER dihedral angle


# 517 atoms read from pdb file ubm_amb.pdb.
# 6 SER PHI:  (5 PRO C)-(6 SER N)-(6 SER CA)-(6 SER C) -99.8 -39.8
 &rst     iat =    76,    78,    80,    87,
   r1 = -100.8, r2 = -99.8, r3 = -39.8, r4 = -38.8,
   rk2 =   2.0, rk3 =   2.0,    &end

# 6 SER PSI:  (6 SER N)-(6 SER CA)-(6 SER C)-(7 ASP N) -49.2  10.8
 &rst     iat =    78,    80,    87,    89,
   r1 = -50.2, r2 = -49.2, r3 =  10.8, r4 =  11.8,
 &end

# 8 ILE PHI:  (7 ASP C)-(8 ILE N)-(8 ILE CA)-(8 ILE C) -139.5 -79.5
 &rst     iat =    99,   101,   103,   118,
   r1 = -140.5, r2 = -139.5, r3 = -79.5, r4 = -78.5,
 &end

# 8 ILE PSI:  (8 ILE N)-(8 ILE CA)-(8 ILE C)-(9 ASP N) 109.8 169.8
 &rst     iat =   101,   103,   118,   120,
   r1 = 108.8, r2 = 109.8, r3 = 169.8, r4 = 170.8,
 &end

# 9 ASP PSI:  (9 ASP N)-(9 ASP CA)-(9 ASP C)-(10 PRO N)  99.4 159.4
 &rst     iat =   120,   122,   130,   132,
   r1 =  98.4, r2 =  99.4, r3 = 159.4, r4 = 160.4,
 &end

# 10 PRO PSI:  (10 PRO N)-(10 PRO CA)-(10 PRO C)-(11 GLN N) -64.1  -4.1
 &rst     iat =   132,   142,   144,   146,
   r1 = -65.1, r2 = -64.1, r3 =  -4.1, r4 =  -3.1,
 &end

# 11 GLN PHI:  (10 PRO C)-(11 GLN N)-(11 GLN CA)-(11 GLN C) -93.2 -33.2
 &rst     iat =   144,   146,   148,   161,
   r1 = -94.2, r2 = -93.2, r3 = -33.2, r4 = -32.2,
 &end

# 11 GLN PSI:  (11 GLN N)-(11 GLN CA)-(11 GLN C)-(12 VAL N) -65.1  -5.1
 &rst     iat =   146,   148,   161,   163,
   r1 = -66.1, r2 = -65.1, r3 =  -5.1, r4 =  -4.1,
 &end

# 12 VAL PHI:  (11 GLN C)-(12 VAL N)-(12 VAL CA)-(12 VAL C) -99.1 -39.0
 &rst     iat =   161,   163,   165,   177,
   r1 = -100.1, r2 = -99.1, r3 = -39.0, r4 = -38.0,
 &end

# 12 VAL PSI:  (12 VAL N)-(12 VAL CA)-(12 VAL C)-(13 PHE N) -68.3  -8.4
 &rst     iat =   163,   165,   177,   179,
   r1 = -69.3, r2 = -68.3, r3 =  -8.4, r4 =  -7.4,
 &end

# 13 PHE PHI:  (12 VAL C)-(13 PHE N)-(13 PHE CA)-(13 PHE C) -95.3 -35.3
 &rst     iat =   177,   179,   181,   197,
   r1 = -96.3, r2 = -95.3, r3 = -35.3, r4 = -34.3,
 &end

# 13 PHE PSI:  (13 PHE N)-(13 PHE CA)-(13 PHE C)-(14 TYR N) -71.0 -11.0
 &rst     iat =   179,   181,   197,   199,
   r1 = -72.0, r2 = -71.0, r3 = -11.0, r4 = -10.0,
 &end

# 14 TYR PHI:  (13 PHE C)-(14 TYR N)-(14 TYR CA)-(14 TYR C) -100.9 -41.0
 &rst     iat =   197,   199,   201,   218,
   r1 = -101.9, r2 = -100.9, r3 = -41.0, r4 = -40.0,
 &end

# 14 TYR PSI:  (14 TYR N)-(14 TYR CA)-(14 TYR C)-(15 GLU N) -47.1  12.9
 &rst     iat =   199,   201,   218,   220,
   r1 = -48.1, r2 = -47.1, r3 =  12.9, r4 =  13.9,
 &end

# 15 GLU PHI:  (14 TYR C)-(15 GLU N)-(15 GLU CA)-(15 GLU C) -129.4 -69.4
 &rst     iat =   218,   220,   222,   233,
   r1 = -130.4, r2 = -129.4, r3 = -69.4, r4 = -68.4,
 &end

# 15 GLU PSI:  (15 GLU N)-(15 GLU CA)-(15 GLU C)-(16 LEU N) -40.4  19.6
 &rst     iat =   220,   222,   233,   235,
   r1 = -41.4, r2 = -40.4, r3 =  19.6, r4 =  20.6,
 &end

# 16 LEU PHI:  (15 GLU C)-(16 LEU N)-(16 LEU CA)-(16 LEU C) -96.2 -36.2
 &rst     iat =   233,   235,   237,   252,
   r1 = -97.2, r2 = -96.2, r3 = -36.2, r4 = -35.2,
 &end

# 16 LEU PSI:  (16 LEU N)-(16 LEU CA)-(16 LEU C)-(17 PRO N) 110.5 170.5
 &rst     iat =   235,   237,   252,   254,
   r1 = 109.5, r2 = 110.5, r3 = 170.5, r4 = 171.5,
 &end

# 17 PRO PSI:  (17 PRO N)-(17 PRO CA)-(17 PRO C)-(18 GLU N) 114.4 174.4
 &rst     iat =   254,   264,   266,   268,
   r1 = 113.4, r2 = 114.4, r3 = 174.4, r4 = 175.4,
 &end

# 18 GLU PHI:  (17 PRO C)-(18 GLU N)-(18 GLU CA)-(18 GLU C) -83.7 -23.7
 &rst     iat =   266,   268,   270,   281,
   r1 = -84.7, r2 = -83.7, r3 = -23.7, r4 = -22.7,
 &end

# 18 GLU PSI:  (18 GLU N)-(18 GLU CA)-(18 GLU C)-(19 ALA N) -74.0 -14.0
 &rst     iat =   268,   270,   281,   283,
   r1 = -75.0, r2 = -74.0, r3 = -14.0, r4 = -13.0,
 &end

# 19 ALA PHI:  (18 GLU C)-(19 ALA N)-(19 ALA CA)-(19 ALA C) -89.2 -29.2
 &rst     iat =   281,   283,   285,   291,
   r1 = -90.2, r2 = -89.2, r3 = -29.2, r4 = -28.2,
 &end

# 19 ALA PSI:  (19 ALA N)-(19 ALA CA)-(19 ALA C)-(20 VAL N) -70.6 -10.6
 &rst     iat =   283,   285,   291,   293,
   r1 = -71.6, r2 = -70.6, r3 = -10.6, r4 =  -9.6,
 &end

# 20 VAL PHI:  (19 ALA C)-(20 VAL N)-(20 VAL CA)-(20 VAL C) -97.2 -37.2
 &rst     iat =   291,   293,   295,   307,
   r1 = -98.2, r2 = -97.2, r3 = -37.2, r4 = -36.2,
 &end

# 20 VAL PSI:  (20 VAL N)-(20 VAL CA)-(20 VAL C)-(21 GLN N) -75.5 -15.5
 &rst     iat =   293,   295,   307,   309,
   r1 = -76.5, r2 = -75.5, r3 = -15.5, r4 = -14.5,
 &end

# 21 GLN PHI:  (20 VAL C)-(21 GLN N)-(21 GLN CA)-(21 GLN C) -94.0 -34.0
 &rst     iat =   307,   309,   311,   324,
   r1 = -95.0, r2 = -94.0, r3 = -34.0, r4 = -33.0,
 &end

# 21 GLN PSI:  (21 GLN N)-(21 GLN CA)-(21 GLN C)-(22 LYS N) -73.2 -13.2
 &rst     iat =   309,   311,   324,   326,
   r1 = -74.2, r2 = -73.2, r3 = -13.2, r4 = -12.2,
 &end

# 22 LYS PHI:  (21 GLN C)-(22 LYS N)-(22 LYS CA)-(22 LYS C) -92.4 -32.4
 &rst     iat =   324,   326,   328,   346,
   r1 = -93.4, r2 = -92.4, r3 = -32.4, r4 = -31.4,
 &end

# 22 LYS PSI:  (22 LYS N)-(22 LYS CA)-(22 LYS C)-(23 GLU N) -69.8  -9.8
 &rst     iat =   326,   328,   346,   348,
   r1 = -70.8, r2 = -69.8, r3 =  -9.8, r4 =  -8.8,
 &end

# 23 GLU PHI:  (22 LYS C)-(23 GLU N)-(23 GLU CA)-(23 GLU C) -95.8 -35.8
 &rst     iat =   346,   348,   350,   361,
   r1 = -96.8, r2 = -95.8, r3 = -35.8, r4 = -34.8,
 &end

# 23 GLU PSI:  (23 GLU N)-(23 GLU CA)-(23 GLU C)-(24 LEU N) -72.1 -12.1
 &rst     iat =   348,   350,   361,   363,
   r1 = -73.1, r2 = -72.1, r3 = -12.1, r4 = -11.1,
 &end

# 24 LEU PHI:  (23 GLU C)-(24 LEU N)-(24 LEU CA)-(24 LEU C) -92.9 -32.9
 &rst     iat =   361,   363,   365,   380,
   r1 = -93.9, r2 = -92.9, r3 = -32.9, r4 = -31.9,
 &end

# 24 LEU PSI:  (24 LEU N)-(24 LEU CA)-(24 LEU C)-(25 LEU N) -71.4 -11.4
 &rst     iat =   363,   365,   380,   382,
   r1 = -72.4, r2 = -71.4, r3 = -11.4, r4 = -10.4,
 &end

# 25 LEU PHI:  (24 LEU C)-(25 LEU N)-(25 LEU CA)-(25 LEU C) -93.5 -33.5
 &rst     iat =   380,   382,   384,   399,
   r1 = -94.5, r2 = -93.5, r3 = -33.5, r4 = -32.5,
 &end

# 25 LEU PSI:  (25 LEU N)-(25 LEU CA)-(25 LEU C)-(26 ALA N) -69.7  -9.7
 &rst     iat =   382,   384,   399,   401,
   r1 = -70.7, r2 = -69.7, r3 =  -9.7, r4 =  -8.7,
 &end

# 26 ALA PHI:  (25 LEU C)-(26 ALA N)-(26 ALA CA)-(26 ALA C) -93.6 -33.6
 &rst     iat =   399,   401,   403,   409,
   r1 = -94.6, r2 = -93.6, r3 = -33.6, r4 = -32.6,
 &end

# 26 ALA PSI:  (26 ALA N)-(26 ALA CA)-(26 ALA C)-(27 GLU N) -71.9 -11.9
 &rst     iat =   401,   403,   409,   411,
   r1 = -72.9, r2 = -71.9, r3 = -11.9, r4 = -10.9,
 &end

# 27 GLU PHI:  (26 ALA C)-(27 GLU N)-(27 GLU CA)-(27 GLU C) -92.1 -32.1
 &rst     iat =   409,   411,   413,   424,
   r1 = -93.1, r2 = -92.1, r3 = -32.1, r4 = -31.1,
 &end

# 27 GLU PSI:  (27 GLU N)-(27 GLU CA)-(27 GLU C)-(28 TRP N) -72.1 -12.1
 &rst     iat =   411,   413,   424,   426,
   r1 = -73.1, r2 = -72.1, r3 = -12.1, r4 = -11.1,
 &end

# 28 TRP PHI:  (27 GLU C)-(28 TRP N)-(28 TRP CA)-(28 TRP C) -100.2 -40.2
 &rst     iat =   424,   426,   428,   448,
   r1 = -101.2, r2 = -100.2, r3 = -40.2, r4 = -39.2,
 &end

# 28 TRP PSI:  (28 TRP N)-(28 TRP CA)-(28 TRP C)-(29 LYS N) -61.8  -1.8
 &rst     iat =   426,   428,   448,   450,
   r1 = -62.8, r2 = -61.8, r3 =  -1.8, r4 =  -0.8,
 &end

# 29 LYS PHI:  (28 TRP C)-(29 LYS N)-(29 LYS CA)-(29 LYS C) -106.3 -46.3
 &rst     iat =   448,   450,   452,   470,
   r1 = -107.3, r2 = -106.3, r3 = -46.3, r4 = -45.3,
 &end

# 29 LYS PSI:  (29 LYS N)-(29 LYS CA)-(29 LYS C)-(30 ARG N) -56.2   3.8
 &rst     iat =   450,   452,   470,   472,
   r1 = -57.2, r2 = -56.2, r3 =   3.8, r4 =   4.8,
 &end

# 30 ARG PHI:  (29 LYS C)-(30 ARG N)-(30 ARG CA)-(30 ARG C) -107.6 -47.6
 &rst     iat =   470,   472,   474,   494,
   r1 = -108.6, r2 = -107.6, r3 = -47.6, r4 = -46.6,
 &end

# 30 ARG PSI:  (30 ARG N)-(30 ARG CA)-(30 ARG C)-(31 THR N) -62.3  -2.3
 &rst     iat =   472,   474,   494,   496,
   r1 = -63.3, r2 = -62.3, r3 =  -2.3, r4 =  -1.3,
 &end



Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Sunday, May 5, 2024 11:36:32 AM GMT (wattos1)