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
4190 1exk 4677 cing 1-original 3 AMBER dihedral angle


# 10 THR PHI:  (9 PRO C) - (10 THR N) - (10 THR CA) - (10 THR C) -180.0 -60.0
 &rst     iat =   149,   151,   153,   163,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0,
   rk2 =  50.0, rk3 =  50.0,    &end

# 11 LEU PHI:  (10 THR C) - (11 LEU N) - (11 LEU CA) - (11 LEU C) -180.0 -60.0
 &rst     iat =   163,   165,   167,   182,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 12 GLU PHI:  (11 LEU C) - (12 GLU N) - (12 GLU CA) - (12 GLU C) -180.0 -60.0
 &rst     iat =   182,   184,   186,   197,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 26 THR PHI:  (25 GLY C) - (26 THR N) - (26 THR CA) - (26 THR C) -180.0 -60.0
 &rst     iat =   355,   357,   359,   369,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 27 GLN PHI:  (26 THR C) - (27 GLN N) - (27 GLN CA) - (27 GLN C) -180.0 -60.0
 &rst     iat =   369,   371,   373,   386,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 29 GLN PHI:  (28 PRO C) - (29 GLN N) - (29 GLN CA) - (29 GLN C) -180.0 -60.0
 &rst     iat =   400,   402,   404,   417,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 34 CYS PHI:  (33 THR C) - (34 CYS N) - (34 CYS CA) - (34 CYS C) -180.0 -60.0
 &rst     iat =   469,   471,   473,   479,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 39 GLN PHI:  (38 GLY C) - (39 GLN N) - (39 GLN CA) - (39 GLN C) -180.0 -60.0
 &rst     iat =   521,   523,   525,   538,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 40 VAL PHI:  (39 GLN C) - (40 VAL N) - (40 VAL CA) - (40 VAL C) -180.0 -60.0
 &rst     iat =   538,   540,   542,   554,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 42 MET PHI:  (41 GLN C) - (42 MET N) - (42 MET CA) - (42 MET C) -180.0 -60.0
 &rst     iat =   571,   573,   575,   590,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 47 PHE PHI:  (46 PHE C) - (47 PHE N) - (47 PHE CA) - (47 PHE C) -180.0 -60.0
 &rst     iat =   658,   660,   662,   678,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 49 VAL PHI:  (48 ALA C) - (49 VAL N) - (49 VAL CA) - (49 VAL C) -180.0 -60.0
 &rst     iat =   688,   690,   692,   704,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 51 GLN PHI:  (50 GLN C) - (51 GLN N) - (51 GLN CA) - (51 GLN C) -180.0 -60.0
 &rst     iat =   721,   723,   725,   738,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 56 CYS PHI:  (55 HIS C) - (56 CYS N) - (56 CYS CA) - (56 CYS C) -180.0 -60.0
 &rst     iat =   793,   795,   797,   803,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 62 LEU PHI:  (61 THR C) - (62 LEU N) - (62 LEU CA) - (62 LEU C) -180.0 -60.0
 &rst     iat =   872,   874,   876,   891,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 65 ASP PHI:  (64 LYS C) - (65 ASP N) - (65 ASP CA) - (65 ASP C) -180.0 -60.0
 &rst     iat =   932,   934,   936,   944,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 75 ARG PHI:  (74 GLY C) - (75 ARG N) - (75 ARG CA) - (75 ARG C) -180.0 -60.0
 &rst     iat =  1062,  1064,  1066,  1086,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 76 VAL PHI:  (75 ARG C) - (76 VAL N) - (76 VAL CA) - (76 VAL C) -180.0 -60.0
 &rst     iat =  1086,  1088,  1090,  1102,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 79 SER PHI:  (78 ARG C) - (79 SER N) - (79 SER CA) - (79 SER C) -180.0 -60.0
 &rst     iat =  1141,  1143,  1145,  1152,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 22 ALA PHI:  (21 GLY C) - (22 ALA N) - (22 ALA CA) - (22 ALA C) -180.0 -60.0
 &rst     iat =   302,   304,   306,   312,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 48 ALA PHI:  (47 PHE C) - (48 ALA N) - (48 ALA CA) - (48 ALA C) -180.0 -60.0
 &rst     iat =   678,   680,   682,   688,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 61 THR PHI:  (60 GLY C) - (61 THR N) - (61 THR CA) - (61 THR C) -180.0 -60.0
 &rst     iat =   858,   860,   862,   872,
   r1 = -190.0, r2 = -180.0, r3 = -60.0, r4 = -50.0, &end

# 10 THR PSI:  (10 THR N) - (10 THR CA) - (10 THR C) - (11 LEU N)  60.0 180.0
 &rst     iat =   151,   153,   163,   165,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 11 LEU PSI:  (11 LEU N) - (11 LEU CA) - (11 LEU C) - (12 GLU N)  60.0 180.0
 &rst     iat =   165,   167,   182,   184,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 22 ALA PSI:  (22 ALA N) - (22 ALA CA) - (22 ALA C) - (23 LYS N)  60.0 180.0
 &rst     iat =   304,   306,   312,   314,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 26 THR PSI:  (26 THR N) - (26 THR CA) - (26 THR C) - (27 GLN N)  60.0 180.0
 &rst     iat =   357,   359,   369,   371,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 27 GLN PSI:  (27 GLN N) - (27 GLN CA) - (27 GLN C) - (28 PRO N)  60.0 180.0
 &rst     iat =   371,   373,   386,   388,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 29 GLN PSI:  (29 GLN N) - (29 GLN CA) - (29 GLN C) - (30 THR N)  60.0 180.0
 &rst     iat =   402,   404,   417,   419,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 39 GLN PSI:  (39 GLN N) - (39 GLN CA) - (39 GLN C) - (40 VAL N)  60.0 180.0
 &rst     iat =   523,   525,   538,   540,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 40 VAL PSI:  (40 VAL N) - (40 VAL CA) - (40 VAL C) - (41 GLN N)  60.0 180.0
 &rst     iat =   540,   542,   554,   556,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 42 MET PSI:  (42 MET N) - (42 MET CA) - (42 MET C) - (43 ARG N)  60.0 180.0
 &rst     iat =   573,   575,   590,   592,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 47 PHE PSI:  (47 PHE N) - (47 PHE CA) - (47 PHE C) - (48 ALA N)  60.0 180.0
 &rst     iat =   660,   662,   678,   680,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 48 ALA PSI:  (48 ALA N) - (48 ALA CA) - (48 ALA C) - (49 VAL N)  60.0 180.0
 &rst     iat =   680,   682,   688,   690,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 49 VAL PSI:  (49 VAL N) - (49 VAL CA) - (49 VAL C) - (50 GLN N)  60.0 180.0
 &rst     iat =   690,   692,   704,   706,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 51 GLN PSI:  (51 GLN N) - (51 GLN CA) - (51 GLN C) - (52 THR N)  60.0 180.0
 &rst     iat =   723,   725,   738,   740,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 61 THR PSI:  (61 THR N) - (61 THR CA) - (61 THR C) - (62 LEU N)  60.0 180.0
 &rst     iat =   860,   862,   872,   874,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 62 LEU PSI:  (62 LEU N) - (62 LEU CA) - (62 LEU C) - (63 ILE N)  60.0 180.0
 &rst     iat =   874,   876,   891,   893,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 65 ASP PSI:  (65 ASP N) - (65 ASP CA) - (65 ASP C) - (66 PRO N)  60.0 180.0
 &rst     iat =   934,   936,   944,   946,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 75 ARG PSI:  (75 ARG N) - (75 ARG CA) - (75 ARG C) - (76 VAL N)  60.0 180.0
 &rst     iat =  1064,  1066,  1086,  1088,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 76 VAL PSI:  (76 VAL N) - (76 VAL CA) - (76 VAL C) - (77 GLU N)  60.0 180.0
 &rst     iat =  1088,  1090,  1102,  1104,
   r1 =  50.0, r2 =  60.0, r3 = 180.0, r4 = 190.0, &end

# 13 GLU PHI:  (12 GLU C) - (13 GLU N) - (13 GLU CA) - (13 GLU C) -90.0 -30.0
 &rst     iat =   197,   199,   201,   212,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 14 CYS PHI:  (13 GLU C) - (14 CYS N) - (14 CYS CA) - (14 CYS C) -90.0 -30.0
 &rst     iat =   212,   214,   216,   222,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 23 LYS PHI:  (22 ALA C) - (23 LYS N) - (23 LYS CA) - (23 LYS C) -90.0 -30.0
 &rst     iat =   312,   314,   316,   334,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 30 THR PHI:  (29 GLN C) - (30 THR N) - (30 THR CA) - (30 THR C) -90.0 -30.0
 &rst     iat =   417,   419,   421,   431,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 31 CYS PHI:  (30 THR C) - (31 CYS N) - (31 CYS CA) - (31 CYS C) -90.0 -30.0
 &rst     iat =   431,   433,   435,   441,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 52 THR PHI:  (51 GLN C) - (52 THR N) - (52 THR CA) - (52 THR C) -90.0 -30.0
 &rst     iat =   738,   740,   742,   752,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 53 CYS PHI:  (52 THR C) - (53 CYS N) - (53 CYS CA) - (53 CYS C) -90.0 -30.0
 &rst     iat =   752,   754,   756,   762,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 67 CYS PHI:  (66 PRO C) - (67 CYS N) - (67 CYS CA) - (67 CYS C) -90.0 -30.0
 &rst     iat =   958,   960,   962,   968,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 68 ASN PHI:  (67 CYS C) - (68 ASN N) - (68 ASN CA) - (68 ASN C) -90.0 -30.0
 &rst     iat =   968,   970,   972,   982,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 20 SER PHI:  (19 GLY C) - (20 SER N) - (20 SER CA) - (20 SER C) -90.0 -30.0
 &rst     iat =   284,   286,   288,   295,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 37 SER PHI:  (36 GLY C) - (37 SER N) - (37 SER CA) - (37 SER C) -90.0 -30.0
 &rst     iat =   503,   505,   507,   514,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 59 ARG PHI:  (58 GLY C) - (59 ARG N) - (59 ARG CA) - (59 ARG C) -90.0 -30.0
 &rst     iat =   827,   829,   831,   851,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 73 HIS PHI:  (72 GLY C) - (73 HIS N) - (73 HIS CA) - (73 HIS C) -90.0 -30.0
 &rst     iat =  1038,  1040,  1042,  1055,
   r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end

# 20 SER PSI:  (20 SER N) - (20 SER CA) - (20 SER C) - (21 GLY N) -80.0  20.0
 &rst     iat =   286,   288,   295,   297,
   r1 = -90.0, r2 = -80.0, r3 =  20.0, r4 =  30.0, &end

# 37 SER PSI:  (37 SER N) - (37 SER CA) - (37 SER C) - (38 GLY N) -80.0  20.0
 &rst     iat =   505,   507,   514,   516,
   r1 = -90.0, r2 = -80.0, r3 =  20.0, r4 =  30.0, &end

# 59 ARG PSI:  (59 ARG N) - (59 ARG CA) - (59 ARG C) - (60 GLY N) -80.0  20.0
 &rst     iat =   829,   831,   851,   853,
   r1 = -90.0, r2 = -80.0, r3 =  20.0, r4 =  30.0, &end

# 73 HIS PSI:  (73 HIS N) - (73 HIS CA) - (73 HIS C) - (74 GLY N) -80.0  20.0
 &rst     iat =  1040,  1042,  1055,  1057,
   r1 = -90.0, r2 = -80.0, r3 =  20.0, r4 =  30.0, &end

# 2 VAL PHI:  (1 GLY C) - (2 VAL N) - (2 VAL CA) - (2 VAL C) -180.0   0.0
 &rst     iat =     6,     8,    10,    22,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 3 THR PHI:  (2 VAL C) - (3 THR N) - (3 THR CA) - (3 THR C) -180.0   0.0
 &rst     iat =    22,    24,    26,    36,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 4 LYS PHI:  (3 THR C) - (4 LYS N) - (4 LYS CA) - (4 LYS C) -180.0   0.0
 &rst     iat =    36,    38,    40,    58,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 5 GLU PHI:  (4 LYS C) - (5 GLU N) - (5 GLU CA) - (5 GLU C) -180.0   0.0
 &rst     iat =    58,    60,    62,    73,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 6 ILE PHI:  (5 GLU C) - (6 ILE N) - (6 ILE CA) - (6 ILE C) -180.0   0.0
 &rst     iat =    73,    75,    77,    92,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 7 ARG PHI:  (6 ILE C) - (7 ARG N) - (7 ARG CA) - (7 ARG C) -180.0   0.0
 &rst     iat =    92,    94,    96,   116,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 8 ILE PHI:  (7 ARG C) - (8 ILE N) - (8 ILE CA) - (8 ILE C) -180.0   0.0
 &rst     iat =   116,   118,   120,   135,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 9 PRO PHI:  (8 ILE C) - (9 PRO N) - (9 PRO CA) - (9 PRO C) -180.0   0.0
 &rst     iat =   135,   137,   147,   149,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 15 ASP PHI:  (14 CYS C) - (15 ASP N) - (15 ASP CA) - (15 ASP C) -180.0   0.0
 &rst     iat =   222,   224,   226,   234,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 16 VAL PHI:  (15 ASP C) - (16 VAL N) - (16 VAL CA) - (16 VAL C) -180.0   0.0
 &rst     iat =   234,   236,   238,   250,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 33 THR PHI:  (32 PRO C) - (33 THR N) - (33 THR CA) - (33 THR C) -180.0   0.0
 &rst     iat =   455,   457,   459,   469,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 42 MET PHI:  (41 GLN C) - (42 MET N) - (42 MET CA) - (42 MET C) -180.0   0.0
 &rst     iat =   571,   573,   575,   590,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 43 ARG PHI:  (42 MET C) - (43 ARG N) - (43 ARG CA) - (43 ARG C) -180.0   0.0
 &rst     iat =   590,   592,   594,   614,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 44 GLN PHI:  (43 ARG C) - (44 GLN N) - (44 GLN CA) - (44 GLN C) -180.0   0.0
 &rst     iat =   614,   616,   618,   631,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 46 PHE PHI:  (45 GLY C) - (46 PHE N) - (46 PHE CA) - (46 PHE C) -180.0   0.0
 &rst     iat =   638,   640,   642,   658,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 64 LYS PHI:  (63 ILE C) - (64 LYS N) - (64 LYS CA) - (64 LYS C) -180.0   0.0
 &rst     iat =   910,   912,   914,   932,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 69 LYS PHI:  (68 ASN C) - (69 LYS N) - (69 LYS CA) - (69 LYS C) -180.0   0.0
 &rst     iat =   982,   984,   986,  1004,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 77 GLU PHI:  (76 VAL C) - (77 GLU N) - (77 GLU CA) - (77 GLU C) -180.0   0.0
 &rst     iat =  1102,  1104,  1106,  1117,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 78 SER PHI:  (77 GLU C) - (78 ARG N) - (78 ARG CA) - (78 ARG C) -180.0   0.0
 &rst     iat =  1117,  1119,  1121,  1141,
   r1 = -190.0, r2 = -180.0, r3 =   0.0, r4 =  10.0, &end

# 18 HIS PHI:  (17 CYS C) - (18 HIS N) - (18 HIS CA) - (18 HIS C)  30.0  90.0
 &rst     iat =   260,   262,   264,   277,
   r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0, &end

# 35 HIS PHI:  (34 CYS C) - (35 HIS N) - (35 HIS CA) - (35 HIS C)  30.0  90.0
 &rst     iat =   479,   481,   483,   496,
   r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0, &end

# 57 GLN PHI:  (56 CYS C) - (57 GLN N) - (57 GLN CA) - (57 GLN C)  30.0  90.0
 &rst     iat =   803,   805,   807,   820,
   r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0, &end

# 71 HIS PHI:  (70 CYS C) - (71 HIS N) - (71 HIS CA) - (71 HIS C)  30.0  90.0
 &rst     iat =  1014,  1016,  1018,  1031,
   r1 =  20.0, r2 =  30.0, r3 =  90.0, r4 = 100.0, &end

# 18 HIS PSI:  (18 HIS N) - (18 HIS CA) - (18 HIS C) - (19 GLY N)   0.0  80.0
 &rst     iat =   262,   264,   277,   279,
   r1 = -10.0, r2 =   0.0, r3 =  80.0, r4 =  90.0, &end

# 35 HIS PSI:  (35 HIS N) - (35 HIS CA) - (35 HIS C) - (36 GLY N)   0.0  80.0
 &rst     iat =   481,   483,   496,   498,
   r1 = -10.0, r2 =   0.0, r3 =  80.0, r4 =  90.0, &end

# 57 GLN PSI:  (57 GLN N) - (57 GLN CA) - (57 GLN C) - (58 GLY N)   0.0  80.0
 &rst     iat =   805,   807,   820,   822,
   r1 = -10.0, r2 =   0.0, r3 =  80.0, r4 =  90.0, &end

# 71 HIS PSI:  (71 HIS N) - (71 HIS CA) - (71 HIS C) - (72 GLY N)   0.0  80.0
 &rst     iat =  1016,  1018,  1031,  1033,
   r1 = -10.0, r2 =   0.0, r3 =  80.0, r4 =  90.0, &end

# 14 CYS CHI1:  (14 CYS N) - (14 CYS CA) - (14 CYS CB) - (14 CYS SG) 140.0 220.0
 &rst     iat =   214,   216,   218,   221,
   r1 = 130.0, r2 = 140.0, r3 = 220.0, r4 = 230.0, &end

# 31 CYS CHI1:  (31 CYS N) - (31 CYS CA) - (31 CYS CB) - (31 CYS SG) 140.0 220.0
 &rst     iat =   433,   435,   437,   440,
   r1 = 130.0, r2 = 140.0, r3 = 220.0, r4 = 230.0, &end

# 53 CYS CHI1:  (53 CYS N) - (53 CYS CA) - (53 CYS CB) - (53 CYS SG) 140.0 220.0
 &rst     iat =   754,   756,   758,   761,
   r1 = 130.0, r2 = 140.0, r3 = 220.0, r4 = 230.0, &end

# 67 CYS CHI1:  (67 CYS N) - (67 CYS CA) - (67 CYS CB) - (67 CYS SG) 140.0 220.0
 &rst     iat =   960,   962,   964,   967,
   r1 = 130.0, r2 = 140.0, r3 = 220.0, r4 = 230.0, &end

# 17 CYS CHI1:  (17 CYS N) - (17 CYS CA) - (17 CYS CB) - (17 CYS SG)  20.0 100.0
 &rst     iat =   252,   254,   256,   259,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 34 CYS CHI1:  (34 CYS N) - (34 CYS CA) - (34 CYS CB) - (34 CYS SG)  20.0 100.0
 &rst     iat =   471,   473,   475,   478,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 56 CYS CHI1:  (56 CYS N) - (56 CYS CA) - (56 CYS CB) - (56 CYS SG)  20.0 100.0
 &rst     iat =   795,   797,   799,   802,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 70 CYS CHI1:  (70 CYS N) - (70 CYS CA) - (70 CYS CB) - (70 CYS SG)  20.0 100.0
 &rst     iat =  1006,  1008,  1010,  1013,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 27 GLN CHI1:  (27 GLN N) - (27 GLN CA) - (27 GLN CB) - (27 GLN CG)  20.0 100.0
 &rst     iat =   371,   373,   375,   378,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 39 GLN CHI1:  (39 GLN N) - (39 GLN CA) - (39 GLN CB) - (39 GLN CG)  20.0 100.0
 &rst     iat =   523,   525,   527,   530,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 44 GLN CHI1:  (44 GLN N) - (44 GLN CA) - (44 GLN CB) - (44 GLN CG)  20.0 100.0
 &rst     iat =   616,   618,   620,   623,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 65 ASP CHI1:  (65 ASP N) - (65 ASP CA) - (65 ASP CB) - (65 ASP CG)  20.0 100.0
 &rst     iat =   934,   936,   938,   941,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 75 ARG CHI1:  (75 ARG N) - (75 ARG CA) - (75 ARG CB) - (75 ARG CG)  20.0 100.0
 &rst     iat =  1064,  1066,  1068,  1071,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 11 LEU CHI1:  (11 LEU N) - (11 LEU CA) - (11 LEU CB) - (11 LEU CG) -100.0 -20.0
 &rst     iat =   165,   167,   169,   172,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 62 LEU CHI1:  (62 LEU N) - (62 LEU CA) - (62 LEU CB) - (62 LEU CG) -100.0 -20.0
 &rst     iat =   874,   876,   878,   881,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 69 LYS CHI1:  (69 LYS N) - (69 LYS CA) - (69 LYS CB) - (69 LYS CG) 140.0 220.0
 &rst     iat =   984,   986,   988,   991,
   r1 = 130.0, r2 = 140.0, r3 = 220.0, r4 = 230.0, &end

# 16 VAL CHI1:  (16 VAL N) - (16 VAL CA) - (16 VAL CB) - (16 VAL CG1) 140.0 220.0
 &rst     iat =   236,   238,   240,   242,
   r1 = 130.0, r2 = 140.0, r3 = 220.0, r4 = 230.0, &end

# 55 HIS CHI1:  (55 HIS N) - (55 HIS CA) - (55 HIS CB) - (55 HIS CG) 140.0 220.0
 &rst     iat =   778,   780,   782,   785,
   r1 = 130.0, r2 = 140.0, r3 = 220.0, r4 = 230.0, &end

# 57 GLN CHI1:  (57 GLN N) - (57 GLN CA) - (57 GLN CB) - (57 GLN CG) -100.0 -20.0
 &rst     iat =   805,   807,   809,   812,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 26 THR CHI1:  (26 THR N) - (26 THR CA) - (26 THR CB) - (26 THR OG1) -100.0 -20.0
 &rst     iat =   357,   359,   361,   367,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 12 GLU CHI1:  (12 GLU N) - (12 GLU CA) - (12 GLU CB) - (12 GLU CG) -100.0 -20.0
 &rst     iat =   184,   186,   188,   191,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 20 SER CHI1:  (20 SER N) - (20 SER CA) - (20 SER CB) - (20 SER OG)  20.0 100.0
 &rst     iat =   286,   288,   290,   293,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 29 GLN CHI1:  (29 GLN N) - (29 GLN CA) - (29 GLN CB) - (29 GLN CG) -100.0 -20.0
 &rst     iat =   402,   404,   406,   409,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 35 HIS CHI1:  (35 HIS N) - (35 HIS CA) - (35 HIS CB) - (35 HIS CG) -100.0 -20.0
 &rst     iat =   481,   483,   485,   488,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 47 PHE CHI1:  (47 PHE N) - (47 PHE CA) - (47 PHE CB) - (47 PHE CG) -100.0 -20.0
 &rst     iat =   660,   662,   664,   667,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 49 VAL CHI1:  (49 VAL N) - (49 VAL CA) - (49 VAL CB) - (49 VAL CG1) -100.0 -20.0
 &rst     iat =   690,   692,   694,   696,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 51 GLN CHI1:  (51 GLN N) - (51 GLN CA) - (51 GLN CB) - (51 GLN CG) -100.0 -20.0
 &rst     iat =   723,   725,   727,   730,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 6 ILE CHI1:  (6 ILE N) - (6 ILE CA) - (6 ILE CB) - (6 ILE CG1)  20.0 100.0
 &rst     iat =    75,    77,    79,    85,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 15 ASP CHI1:  (15 ASP N) - (15 ASP CA) - (15 ASP CB) - (15 ASP CG)  20.0 100.0
 &rst     iat =   224,   226,   228,   231,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 10 THR CHI1:  (10 THR N) - (10 THR CA) - (10 THR CB) - (10 THR OG1) -100.0 -20.0
 &rst     iat =   151,   153,   155,   161,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 30 THR CHI1:  (30 THR N) - (30 THR CA) - (30 THR CB) - (30 THR OG1) -100.0 -20.0
 &rst     iat =   419,   421,   423,   429,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 33 THR CHI1:  (33 THR N) - (33 THR CA) - (33 THR CB) - (33 THR OG1) -100.0 -20.0
 &rst     iat =   457,   459,   461,   467,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end

# 61 THR CHI1:  (61 THR N) - (61 THR CA) - (61 THR CB) - (61 THR OG1)  20.0 100.0
 &rst     iat =   860,   862,   864,   870,
   r1 =  10.0, r2 =  20.0, r3 = 100.0, r4 = 110.0, &end

# 40 VAL CHI1:  (40 VAL N) - (40 VAL CA) - (40 VAL CB) - (40 VAL CG1) -100.0 -20.0
 &rst     iat =   540,   542,   544,   546,
   r1 = -110.0, r2 = -100.0, r3 = -20.0, r4 = -10.0, &end


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Contact the webmaster for help, if required. Tuesday, July 17, 2018 6:02:29 PM CDT (wattos1)