NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type
476183 1tf3 cing 1-original 2 AMBER dihedral angle


# 2416 atoms read from pdb file hip.complex.pdb.
# 4 TYR PHI:  (3 ARG C) - (4 TYR N) - (4 TYR CA) - (4 TYR C) -160.0 -80.0
 &rst     iat =    64,    66,    68,    85,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,
	  rk2 =  32.0, rk3 =  32.0,				&end

# 5 ILE PHI:  (4 TYR C) - (5 ILE N) - (5 ILE CA) - (5 ILE C) -160.0 -80.0
 &rst     iat =    85,    87,    89,   104,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 6 CYS PHI:  (5 ILE C) - (6 CYM N) - (6 CYM CA) - (6 CYM C) -90.0 -40.0
 &rst     iat =   104,   106,   108,   114,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 7 SER PHI:  (6 CYM C) - (7 SER N) - (7 SER CA) - (7 SER C) -90.0 -40.0
 &rst     iat =   114,   116,   118,   125,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 13 ALA PHI:  (12 GLY C) - (13 ALA N) - (13 ALA CA) - (13 ALA C) -90.0 -40.0
 &rst     iat =   184,   186,   188,   194,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 14 ALA PHI:  (13 ALA C) - (14 ALA N) - (14 ALA CA) - (14 ALA C) -160.0 -80.0
 &rst     iat =   194,   196,   198,   204,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 15 TYR PHI:  (14 ALA C) - (15 TYR N) - (15 TYR CA) - (15 TYR C) -160.0 -80.0
 &rst     iat =   204,   206,   208,   225,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 17 LYS PHI:  (16 ASN C) - (17 LYS N) - (17 LYS CA) - (17 LYS C) -160.0 -80.0
 &rst     iat =   239,   241,   243,   261,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 21 LEU PHI:  (20 LYS C) - (21 LEU N) - (21 LEU CA) - (21 LEU C) -90.0 -40.0
 &rst     iat =   321,   323,   325,   340,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 24 HIS PHI:  (23 ALA C) - (24 HIS N) - (24 HIS CA) - (24 HIS C) -90.0 -40.0
 &rst     iat =   367,   369,   371,   384,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 25 LEU PHI:  (24 HIS C) - (25 LEU N) - (25 LEU CA) - (25 LEU C) -90.0 -40.0
 &rst     iat =   384,   386,   388,   403,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 26 SER PHI:  (25 LEU C) - (26 SER N) - (26 SER CA) - (26 SER C) -90.0 -40.0
 &rst     iat =   403,   405,   407,   414,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 28 HIS PHI:  (27 LYS C) - (28 HIS N) - (28 HIS CA) - (28 HIS C) -90.0 -40.0
 &rst     iat =   436,   438,   440,   453,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 31 GLU PHI:  (30 GLY C) - (31 GLU N) - (31 GLU CA) - (31 GLU C) -160.0 -80.0
 &rst     iat =   474,   476,   478,   489,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 32 LYS PHI:  (31 GLU C) - (32 LYS N) - (32 LYS CA) - (32 LYS C) -160.0 -80.0
 &rst     iat =   489,   491,   493,   511,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 34 PHE PHI:  (33 PRO C) - (34 PHE N) - (34 PHE CA) - (34 PHE C) -160.0 -80.0
 &rst     iat =   525,   527,   529,   545,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 36 CYS PHI:  (35 PRO C) - (36 CYM N) - (36 CYM CA) - (36 CYM C) -90.0 -40.0
 &rst     iat =   559,   561,   563,   569,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 38 GLU PHI:  (37 LYS C) - (38 GLU N) - (38 GLU CA) - (38 GLU C) -90.0 -40.0
 &rst     iat =   591,   593,   595,   606,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 39 GLU PHI:  (38 GLU C) - (39 GLU N) - (39 GLU CA) - (39 GLU C) -90.0 -40.0
 &rst     iat =   606,   608,   610,   621,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 41 CYS PHI:  (40 GLY C) - (41 CYM N) - (41 CYM CA) - (41 CYM C) -160.0 -80.0
 &rst     iat =   628,   630,   632,   638,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 42 GLU PHI:  (41 CYM C) - (42 GLU N) - (42 GLU CA) - (42 GLU C) -160.0 -80.0
 &rst     iat =   638,   640,   642,   653,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 45 PHE PHI:  (44 GLY C) - (45 PHE N) - (45 PHE CA) - (45 PHE C) -160.0 -80.0
 &rst     iat =   682,   684,   686,   702,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 45 PHE PHI:  (44 GLY C) - (45 PHE N) - (45 PHE CA) - (45 PHE C) -160.0 -80.0
 &rst     iat =   682,   684,   686,   702,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 48 LEU PHI:  (47 SER C) - (48 LEU N) - (48 LEU CA) - (48 LEU C) -90.0 -40.0
 &rst     iat =   727,   729,   731,   746,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 51 LEU PHI:  (50 HIP C) - (51 LEU N) - (51 LEU CA) - (51 LEU C) -90.0 -40.0
 &rst     iat =   781,   783,   785,   800,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 52 THR PHI:  (51 LEU C) - (52 THR N) - (52 THR CA) - (52 THR C) -90.0 -40.0
 &rst     iat =   800,   802,   804,   814,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 53 ARG PHI:  (52 THR C) - (53 ARG N) - (53 ARG CA) - (53 ARG C) -90.0 -40.0
 &rst     iat =   814,   816,   818,   838,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 55 LEU PHI:  (54 HIS C) - (55 SER N) - (55 SER CA) - (55 SER C) -90.0 -40.0
 &rst     iat =   855,   857,   859,   866,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 56 SER PHI:  (55 SER C) - (56 LEU N) - (56 LEU CA) - (56 LEU C) -90.0 -40.0
 &rst     iat =   866,   868,   870,   885,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 58 HIS PHI:  (57 THR C) - (58 HIS N) - (58 HIS CA) - (58 HIS C) -160.0 -80.0
 &rst     iat =   899,   901,   903,   916,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 61 GLU PHI:  (60 GLY C) - (61 GLU N) - (61 GLU CA) - (61 GLU C) -90.0 -40.0
 &rst     iat =   937,   939,   941,   952,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 62 LYS PHI:  (61 GLU C) - (62 LYS N) - (62 LYS CA) - (62 LYS C) -160.0 -80.0
 &rst     iat =   952,   954,   956,   974,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 63 ASN PHI:  (62 LYS C) - (63 ASN N) - (63 ASN CA) - (63 ASN C) -160.0 -80.0
 &rst     iat =   974,   976,   978,   988,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 64 PHE PHI:  (63 ASN C) - (64 PHE N) - (64 PHE CA) - (64 PHE C) -160.0 -80.0
 &rst     iat =   988,   990,   992,  1008,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 65 THR PHI:  (64 PHE C) - (65 THR N) - (65 THR CA) - (65 THR C) -160.0 -80.0
 &rst     iat =  1008,  1010,  1012,  1022,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 67 ASP PHI:  (66 CYM C) - (67 ASP N) - (67 ASP CA) - (67 ASP C) -90.0 -40.0
 &rst     iat =  1032,  1034,  1036,  1044,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 69 ASP PHI:  (68 SER C) - (69 ASP N) - (69 ASP CA) - (69 ASP C) -90.0 -40.0
 &rst     iat =  1055,  1057,  1059,  1067,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 71 CYS PHI:  (70 GLY C) - (71 CYM N) - (71 CYM CA) - (71 CYM C) -160.0 -80.0
 &rst     iat =  1074,  1076,  1078,  1084,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 72 ASP PHI:  (71 CYM C) - (72 ASP N) - (72 ASP CA) - (72 ASP C) -90.0 -40.0
 &rst     iat =  1084,  1086,  1088,  1096,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 73 LEU PHI:  (72 ASP C) - (73 LEU N) - (73 LEU CA) - (73 LEU C) -90.0 -40.0
 &rst     iat =  1096,  1098,  1100,  1115,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 74 ARG PHI:  (73 LEU C) - (74 ARG N) - (74 ARG CA) - (74 ARG C) -160.0 -80.0
 &rst     iat =  1115,  1117,  1119,  1139,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 75 PHE PHI:  (74 ARG C) - (75 PHE N) - (75 PHE CA) - (75 PHE C) -160.0 -80.0
 &rst     iat =  1139,  1141,  1143,  1159,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 76 THR PHI:  (75 PHE C) - (76 THR N) - (76 THR CA) - (76 THR C) -90.0 -40.0
 &rst     iat =  1159,  1161,  1163,  1173,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 77 THR PHI:  (76 THR C) - (77 THR N) - (77 THR CA) - (77 THR C) -160.0 -80.0
 &rst     iat =  1173,  1175,  1177,  1187,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 78 LYS PHI:  (77 THR C) - (78 LYS N) - (78 LYS CA) - (78 LYS C) -90.0 -40.0
 &rst     iat =  1187,  1189,  1191,  1209,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 79 ALA PHI:  (78 LYS C) - (79 ALA N) - (79 ALA CA) - (79 ALA C) -90.0 -40.0
 &rst     iat =  1209,  1211,  1213,  1219,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 81 MET PHI:  (80 ASN C) - (81 MET N) - (81 MET CA) - (81 MET C) -90.0 -40.0
 &rst     iat =  1233,  1235,  1237,  1252,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 82 LYS PHI:  (81 MET C) - (82 LYS N) - (82 LYS CA) - (82 LYS C) -90.0 -40.0
 &rst     iat =  1252,  1254,  1256,  1274,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 83 LYS PHI:  (82 LYS C) - (83 LYS N) - (83 LYS CA) - (83 LYS C) -90.0 -40.0
 &rst     iat =  1274,  1276,  1278,  1296,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 84 HIS PHI:  (83 LYS C) - (84 HIS N) - (84 HIS CA) - (84 HIS C) -90.0 -40.0
 &rst     iat =  1296,  1298,  1300,  1313,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 86 ASN PHI:  (85 PHE C) - (86 ASN N) - (86 ASN CA) - (86 ASN C) -90.0 -40.0
 &rst     iat =  1333,  1335,  1337,  1347,
	  r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,	&end

# 88 PHE PHI:  (87 ARG C) - (88 PHE N) - (88 PHE CA) - (88 PHE C) -160.0 -80.0
 &rst     iat =  1371,  1373,  1375,  1391,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 89 HIS PHI:  (88 PHE C) - (89 HIS N) - (89 HIS CA) - (89 HIS C) -160.0 -80.0
 &rst     iat =  1391,  1393,  1395,  1408,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 90 ASN PHI:  (89 HIS C) - (90 ASN N) - (90 ASN CA) - (90 ASN C) -160.0 -80.0
 &rst     iat =  1408,  1410,  1412,  1422,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 91 ILE PHI:  (90 ASN C) - (91 ILE N) - (91 ILE CA) - (91 ILE C) -160.0 -80.0
 &rst     iat =  1422,  1424,  1426,  1441,
	  r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0,	&end

# 2416 atoms read from pdb file hip.complex.pdb.
# 3 ARG CHI1:  (3 ARG N) - (3 ARG CA) - (3 ARG CB) - (3 ARG CG) -90.0 -30.0
 &rst     iat =    42,    44,    46,    49,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 4 TYR CHI1:  (4 TYR N) - (4 TYR CA) - (4 TYR CB) - (4 TYR CG) -90.0 -30.0
 &rst     iat =    66,    68,    70,    73,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,
	  rk2 =  32.0, rk3 =  32.0,				&end

# 6 CYS CHI1:  (6 CYM N) - (6 CYM CA) - (6 CYM CB) - (6 CYM SG) 150.0 210.0
 &rst     iat =   106,   108,   110,   113,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 8 PHE CHI1:  (8 PHE N) - (8 PHE CA) - (8 PHE CB) - (8 PHE CG) -90.0 -30.0
 &rst     iat =   127,   129,   131,   134,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 10 ASP CHI1:  (10 ASP N) - (10 ASP CA) - (10 ASP CB) - (10 ASP CG) -90.0 -30.0
 &rst     iat =   157,   159,   161,   164,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 11 CYS CHI1:  (11 CYM N) - (11 CYM CA) - (11 CYM CB) - (11 CYM SG) 150.0 210.0
 &rst     iat =   169,   171,   173,   176,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 15 TYR CHI1:  (15 TYR N) - (15 TYR CA) - (15 TYR CB) - (15 TYR CG) -90.0 -30.0
 &rst     iat =   206,   208,   210,   213,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 17 LYS CHI1:  (17 LYS N) - (17 LYS CA) - (17 LYS CB) - (17 LYS CG) -90.0 -30.0
 &rst     iat =   241,   243,   245,   248,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 18 ASN CHI1:  (18 ASN N) - (18 ASN CA) - (18 ASN CB) - (18 ASN CG) 150.0 210.0
 &rst     iat =   263,   265,   267,   270,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 21 LEU CHI1:  (21 LEU N) - (21 LEU CA) - (21 LEU CB) - (21 LEU CG) 150.0 210.0
 &rst     iat =   323,   325,   327,   330,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 22 GLN CHI1:  (22 GLN N) - (22 GLN CA) - (22 GLN CB) - (22 GLN CG) -90.0 -30.0
 &rst     iat =   342,   344,   346,   349,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 24 HIS CHI1:  (24 HIS N) - (24 HIS CA) - (24 HIS CB) - (24 HIS CG) 150.0 210.0
 &rst     iat =   369,   371,   373,   376,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 25 LEU CHI1:  (25 LEU N) - (25 LEU CA) - (25 LEU CB) - (25 LEU CG) -90.0 -30.0
 &rst     iat =   386,   388,   390,   393,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 26 SER CHI1:  (26 SER N) - (26 SER CA) - (26 SER CB) - (26 SER OG)  30.0  90.0
 &rst     iat =   405,   407,   409,   412,
	  r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0,	&end

# 27 LYS CHI1:  (27 LYS N) - (27 LYS CA) - (27 LYS CB) - (27 LYS CG) -90.0 -30.0
 &rst     iat =   416,   418,   420,   423,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 28 HIS CHI1:  (28 HIS N) - (28 HIS CA) - (28 HIS CB) - (28 HIS CG) -90.0 -30.0
 &rst     iat =   438,   440,   442,   445,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 29 THR CHI1:  (29 THR N) - (29 THR CA) - (29 THR CB) - (29 THR OG1)  30.0  90.0
 &rst     iat =   455,   457,   459,   465,
	  r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0,	&end

# 31 GLU CHI1:  (31 GLU N) - (31 GLU CA) - (31 GLU CB) - (31 GLU CG) -90.0 -30.0
 &rst     iat =   476,   478,   480,   483,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 32 LYS CHI1:  (32 LYS N) - (32 LYS CA) - (32 LYS CB) - (32 LYS CG) -90.0 -30.0
 &rst     iat =   491,   493,   495,   498,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 34 PHE CHI1:  (34 PHE N) - (34 PHE CA) - (34 PHE CB) - (34 PHE CG) -90.0 -30.0
 &rst     iat =   527,   529,   531,   534,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 36 CYS CHI1:  (36 CYM N) - (36 CYM CA) - (36 CYM CB) - (36 CYM SG) 150.0 210.0
 &rst     iat =   561,   563,   565,   568,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 37 LYS CHI1:  (37 LYS N) - (37 LYS CA) - (37 LYS CB) - (37 LYS CG) -90.0 -30.0
 &rst     iat =   571,   573,   575,   578,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 38 GLU CHI1:  (38 GLU N) - (38 GLU CA) - (38 GLU CB) - (38 GLU CG) -90.0 -30.0
 &rst     iat =   593,   595,   597,   600,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 39 GLU CHI1:  (39 GLU N) - (39 GLU CA) - (39 GLU CB) - (39 GLU CG) -90.0 -30.0
 &rst     iat =   608,   610,   612,   615,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 41 CYS CHI1:  (41 CYM N) - (41 CYM CA) - (41 CYM CB) - (41 CYM SG) 150.0 210.0
 &rst     iat =   630,   632,   634,   637,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 42 GLU CHI1:  (42 GLU N) - (42 GLU CA) - (42 GLU CB) - (42 GLU CG) 150.0 210.0
 &rst     iat =   640,   642,   644,   647,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 43 LYS CHI1:  (43 LYS N) - (43 LYS CA) - (43 LYS CB) - (43 LYS CG) -90.0 -30.0
 &rst     iat =   655,   657,   659,   662,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 45 PHE CHI1:  (45 PHE N) - (45 PHE CA) - (45 PHE CB) - (45 PHE CG) -90.0 -30.0
 &rst     iat =   684,   686,   688,   691,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 46 THR CHI1:  (46 THR N) - (46 THR CA) - (46 THR CB) - (46 THR OG1)  30.0  90.0
 &rst     iat =   704,   706,   708,   714,
	  r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0,	&end

# 47 SER CHI1:  (47 SER N) - (47 SER CA) - (47 SER CB) - (47 SER OG)  30.0  90.0
 &rst     iat =   718,   720,   722,   725,
	  r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0,	&end

# 48 LEU CHI1:  (48 LEU N) - (48 LEU CA) - (48 LEU CB) - (48 LEU CG) 150.0 210.0
 &rst     iat =   729,   731,   733,   736,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 51 LEU CHI1:  (51 LEU N) - (51 LEU CA) - (51 LEU CB) - (51 LEU CG) 150.0 210.0
 &rst     iat =   783,   785,   787,   790,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 52 THR CHI1:  (52 THR N) - (52 THR CA) - (52 THR CB) - (52 THR OG1) -90.0 -30.0
 &rst     iat =   802,   804,   806,   812,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 54 HIS CHI1:  (54 HIS N) - (54 HIS CA) - (54 HIS CB) - (54 HIS CG) 150.0 210.0
 &rst     iat =   840,   842,   844,   847,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 56 LEU CHI1:  (56 LEU N) - (56 LEU CA) - (56 LEU CB) - (56 LEU CG) -90.0 -30.0
 &rst     iat =   868,   870,   872,   875,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 57 THR CHI1:  (57 THR N) - (57 THR CA) - (57 THR CB) - (57 THR OG1)  30.0  90.0
 &rst     iat =   887,   889,   891,   897,
	  r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0,	&end

# 58 HIS CHI1:  (58 HIS N) - (58 HIS CA) - (58 HIS CB) - (58 HIS CG) -90.0 -30.0
 &rst     iat =   901,   903,   905,   908,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 59 THR CHI1:  (59 THR N) - (59 THR CA) - (59 THR CB) - (59 THR OG1)  30.0  90.0
 &rst     iat =   918,   920,   922,   928,
	  r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0,	&end

# 61 GLU CHI1:  (61 GLU N) - (61 GLU CA) - (61 GLU CB) - (61 GLU CG) -90.0 -30.0
 &rst     iat =   939,   941,   943,   946,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 62 LYS CHI1:  (62 LYS N) - (62 LYS CA) - (62 LYS CB) - (62 LYS CG) 150.0 210.0
 &rst     iat =   954,   956,   958,   961,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 63 ASN CHI1:  (63 ASN N) - (63 ASN CA) - (63 ASN CB) - (63 ASN CG) -90.0 -30.0
 &rst     iat =   976,   978,   980,   983,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 64 PHE CHI1:  (64 PHE N) - (64 PHE CA) - (64 PHE CB) - (64 PHE CG) -90.0 -30.0
 &rst     iat =   990,   992,   994,   997,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 65 THR CHI1:  (65 THR N) - (65 THR CA) - (65 THR CB) - (65 THR OG1) -90.0 -30.0
 &rst     iat =  1010,  1012,  1014,  1020,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 66 CYS CHI1:  (66 CYM N) - (66 CYM CA) - (66 CYM CB) - (66 CYM SG) 150.0 210.0
 &rst     iat =  1024,  1026,  1028,  1031,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 68 SER CHI1:  (68 SER N) - (68 SER CA) - (68 SER CB) - (68 SER OG) 150.0 210.0
 &rst     iat =  1046,  1048,  1050,  1053,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 69 ASP CHI1:  (69 ASP N) - (69 ASP CA) - (69 ASP CB) - (69 ASP CG) -90.0 -30.0
 &rst     iat =  1057,  1059,  1061,  1064,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 71 CYS CHI1:  (71 CYM N) - (71 CYM CA) - (71 CYM CB) - (71 CYM SG) 150.0 210.0
 &rst     iat =  1076,  1078,  1080,  1083,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 72 ASP CHI1:  (72 ASP N) - (72 ASP CA) - (72 ASP CB) - (72 ASP CG) -90.0 -30.0
 &rst     iat =  1086,  1088,  1090,  1093,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 73 LEU CHI1:  (73 LEU N) - (73 LEU CA) - (73 LEU CB) - (73 LEU CG) -90.0 -30.0
 &rst     iat =  1098,  1100,  1102,  1105,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 74 ARG CHI1:  (74 ARG N) - (74 ARG CA) - (74 ARG CB) - (74 ARG CG) -90.0 -30.0
 &rst     iat =  1117,  1119,  1121,  1124,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 75 PHE CHI1:  (75 PHE N) - (75 PHE CA) - (75 PHE CB) - (75 PHE CG) -90.0 -30.0
 &rst     iat =  1141,  1143,  1145,  1148,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 76 THR CHI1:  (76 THR N) - (76 THR CA) - (76 THR CB) - (76 THR OG1)  30.0  90.0
 &rst     iat =  1161,  1163,  1165,  1171,
	  r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0,	&end

# 77 THR CHI1:  (77 THR N) - (77 THR CA) - (77 THR CB) - (77 THR OG1)  30.0  90.0
 &rst     iat =  1175,  1177,  1179,  1185,
	  r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0,	&end

# 78 LYS CHI1:  (78 LYS N) - (78 LYS CA) - (78 LYS CB) - (78 LYS CG) -90.0 -30.0
 &rst     iat =  1189,  1191,  1193,  1196,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 83 LYS CHI1:  (83 LYS N) - (83 LYS CA) - (83 LYS CB) - (83 LYS CG) -90.0 -30.0
 &rst     iat =  1276,  1278,  1280,  1283,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 84 HIS CHI1:  (84 HIS N) - (84 HIS CA) - (84 HIS CB) - (84 HIS CG) 150.0 210.0
 &rst     iat =  1298,  1300,  1302,  1305,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 85 PHE CHI1:  (85 PHE N) - (85 PHE CA) - (85 PHE CB) - (85 PHE CG) 150.0 210.0
 &rst     iat =  1315,  1317,  1319,  1322,
	  r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0,	&end

# 86 ASN CHI1:  (86 ASN N) - (86 ASN CA) - (86 ASN CB) - (86 ASN CG) -90.0 -30.0
 &rst     iat =  1335,  1337,  1339,  1342,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 88 PHE CHI1:  (88 PHE N) - (88 PHE CA) - (88 PHE CB) - (88 PHE CG) -90.0 -30.0
 &rst     iat =  1373,  1375,  1377,  1380,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

# 89 HIS CHI1:  (89 HIS N) - (89 HIS CA) - (89 HIS CB) - (89 HIS CG) -90.0 -30.0
 &rst     iat =  1393,  1395,  1397,  1400,
	  r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,	&end

#


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

Contact the webmaster for help, if required. Friday, April 19, 2024 6:31:46 PM GMT (wattos1)