NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
2887 | 1cqg | cing | 1-original | 5 | XPLOR/CNS | dihedral angle |
!remark phi angle constraints !! v2 assign (resid 1 and name c ) (resid 2 and name n ) (resid 2 and name ca) (resid 2 and name c ) 1.0 -125.0 25.0 2 !! k3 assign (resid 2 and name c ) (resid 3 and name n ) (resid 3 and name ca) (resid 3 and name c ) 1.0 -152.0 20.0 2 !! q4 assign (resid 3 and name c ) (resid 4 and name n ) (resid 4 and name ca) (resid 4 and name c ) 1.0 -95.0 20.0 2 !! i5 assign (resid 4 and name c ) (resid 5 and name n ) (resid 5 and name ca) (resid 5 and name c ) 1.0 -105.0 40.0 2 !! e6 assign (resid 5 and name c ) (resid 6 and name n ) (resid 6 and name ca) (resid 6 and name c ) 1.0 -92.0 30.0 2 !! s7 assign (resid 6 and name c ) (resid 7 and name n ) (resid 7 and name ca) (resid 7 and name c ) 1.0 -158.0 20.0 2 !! k8 assign (resid 7 and name c ) (resid 8 and name n ) (resid 8 and name ca) (resid 8 and name c ) 1.0 -60.0 20.0 2 !! t9 assign (resid 8 and name c ) (resid 9 and name n ) (resid 9 and name ca) (resid 9 and name c ) 1.0 -58.0 20.0 2 !! a10 assign (resid 9 and name c ) (resid 10 and name n ) (resid 10 and name ca) (resid 10 and name c ) 1.0 -62.0 20.0 2 !! f11 assign (resid 10 and name c ) (resid 11 and name n ) (resid 11 and name ca) (resid 11 and name c ) 1.0 -60.0 20.0 2 !! q12 assign (resid 11 and name c ) (resid 12 and name n ) (resid 12 and name ca) (resid 12 and name c ) 1.0 -57.0 20.0 2 !! e13 assign (resid 12 and name c ) (resid 13 and name n ) (resid 13 and name ca) (resid 13 and name c ) 1.0 -58.0 20.0 2 !! a14 assign (resid 13 and name c ) (resid 14 and name n ) (resid 14 and name ca) (resid 14 and name c ) 1.0 -69.0 20.0 2 !! l15 assign (resid 14 and name c ) (resid 15 and name n ) (resid 15 and name ca) (resid 15 and name c ) 1.0 -62.0 20.0 2 !! d16 assign (resid 15 and name c ) (resid 16 and name n ) (resid 16 and name ca) (resid 16 and name c ) 1.0 -71.0 20.0 2 !! a17 assign (resid 16 and name c ) (resid 17 and name n ) (resid 17 and name ca) (resid 17 and name c ) 1.0 -73.0 10.0 2 !! a18 assign (resid 17 and name c ) (resid 18 and name n ) (resid 18 and name ca) (resid 18 and name c ) 1.0 -63.0 10.0 2 !! g19 assign (resid 18 and name c ) (resid 19 and name n ) (resid 19 and name ca) (resid 19 and name c ) 1.0 100.0 50.0 2 !! d20 assign (resid 19 and name c ) (resid 20 and name n ) (resid 20 and name ca) (resid 20 and name c ) 1.0 -95.0 25.0 2 !! k21 assign (resid 20 and name c ) (resid 21 and name n ) (resid 21 and name ca) (resid 21 and name c ) 1.0 -77.0 10.0 2 !! l22 assign (resid 21 and name c ) (resid 22 and name n ) (resid 22 and name ca) (resid 22 and name c ) 1.0 -60.0 10.0 2 !! v23 assign (resid 22 and name c ) (resid 23 and name n ) (resid 23 and name ca) (resid 23 and name c ) 1.0 -157.0 30.0 2 !! v24 assign (resid 23 and name c ) (resid 24 and name n ) (resid 24 and name ca) (resid 24 and name c ) 1.0 -95.0 30.0 2 !! v25 assign (resid 24 and name c ) (resid 25 and name n ) (resid 25 and name ca) (resid 25 and name c ) 1.0 -95.0 30.0 2 !! d26 assign (resid 25 and name c ) (resid 26 and name n ) (resid 26 and name ca) (resid 26 and name c ) 1.0 -92.0 30.0 2 !! f27 assign (resid 26 and name c ) (resid 27 and name n ) (resid 27 and name ca) (resid 27 and name c ) 1.0 -90.0 35.0 2 !! s28 assign (resid 27 and name c ) (resid 28 and name n ) (resid 28 and name ca) (resid 28 and name c ) 1.0 -82.0 50.0 2 !! a29 assign (resid 28 and name c ) (resid 29 and name n ) (resid 29 and name ca) (resid 29 and name c ) 1.0 -82.0 30.0 2 !! t30 assign (resid 29 and name c ) (resid 30 and name n ) (resid 30 and name ca) (resid 30 and name c ) 1.0 -78.0 40.0 2 !! w31 assign (resid 30 and name c ) (resid 31 and name n ) (resid 31 and name ca) (resid 31 and name c ) 1.0 -86.0 40.0 2 !! c32 assign (resid 31 and name c ) (resid 32 and name n ) (resid 32 and name ca) (resid 32 and name c ) 1.0 -88.0 60.0 2 !! g33 assign (resid 32 and name c ) (resid 33 and name n ) (resid 33 and name ca) (resid 33 and name c ) 1.0 -85.0 60.0 2 !! p34 assign (resid 33 and name c ) (resid 34 and name n ) (resid 34 and name ca) (resid 34 and name c ) 1.0 -50.0 40.0 2 !! a35 assign (resid 34 and name c ) (resid 35 and name n ) (resid 35 and name ca) (resid 35 and name c ) 1.0 -81.0 20.0 2 !! k36 assign (resid 35 and name c ) (resid 36 and name n ) (resid 36 and name ca) (resid 36 and name c ) 1.0 -53.0 30.0 2 !! m37 assign (resid 36 and name c ) (resid 37 and name n ) (resid 37 and name ca) (resid 37 and name c ) 1.0 -62.0 20.0 2 !! i38 assign (resid 37 and name c ) (resid 38 and name n ) (resid 38 and name ca) (resid 38 and name c ) 1.0 -86.0 20.0 2 !! k39 assign (resid 38 and name c ) (resid 39 and name n ) (resid 39 and name ca) (resid 39 and name c ) 1.0 -50.0 60.0 2 !! p40 assign (resid 39 and name c ) (resid 40 and name n ) (resid 40 and name ca) (resid 40 and name c ) 1.0 -68.0 20.0 2 !! f41 assign (resid 40 and name c ) (resid 41 and name n ) (resid 41 and name ca) (resid 41 and name c ) 1.0 -71.0 50.0 2 !! f42 assign (resid 41 and name c ) (resid 42 and name n ) (resid 42 and name ca) (resid 42 and name c ) 1.0 -56.0 30.0 2 !! h43 assign (resid 42 and name c ) (resid 43 and name n ) (resid 43 and name ca) (resid 43 and name c ) 1.0 -66.0 20.0 2 !! s44 assign (resid 43 and name c ) (resid 44 and name n ) (resid 44 and name ca) (resid 44 and name c ) 1.0 -52.0 30.0 2 !! l45 assign (resid 44 and name c ) (resid 45 and name n ) (resid 45 and name ca) (resid 45 and name c ) 1.0 -60.0 20.0 2 !! s46 assign (resid 45 and name c ) (resid 46 and name n ) (resid 46 and name ca) (resid 46 and name c ) 1.0 -58.0 60.0 2 !! e47 assign (resid 46 and name c ) (resid 47 and name n ) (resid 47 and name ca) (resid 47 and name c ) 1.0 -86.0 20.0 2 !! k48 assign (resid 47 and name c ) (resid 48 and name n ) (resid 48 and name ca) (resid 48 and name c ) 1.0 -87.0 10.0 2 !! y49 assign (resid 48 and name c ) (resid 49 and name n ) (resid 49 and name ca) (resid 49 and name c ) 1.0 -120.0 25.0 2 !! s50 assign (resid 49 and name c ) (resid 50 and name n ) (resid 50 and name ca) (resid 50 and name c ) 1.0 -65.0 10.0 2 !! n51 assign (resid 50 and name c ) (resid 51 and name n ) (resid 51 and name ca) (resid 51 and name c ) 1.0 -96.0 15.0 2 !! v52 assign (resid 51 and name c ) (resid 52 and name n ) (resid 52 and name ca) (resid 52 and name c ) 1.0 -101.0 25.0 2 !! i53 assign (resid 52 and name c ) (resid 53 and name n ) (resid 53 and name ca) (resid 53 and name c ) 1.0 -98.0 25.0 2 !! f54 assign (resid 53 and name c ) (resid 54 and name n ) (resid 54 and name ca) (resid 54 and name c ) 1.0 -96.0 25.0 2 !! l55 assign (resid 54 and name c ) (resid 55 and name n ) (resid 55 and name ca) (resid 55 and name c ) 1.0 -120.0 25.0 2 !! e56 assign (resid 55 and name c ) (resid 56 and name n ) (resid 56 and name ca) (resid 56 and name c ) 1.0 -134.0 30.0 2 !! v57 assign (resid 56 and name c ) (resid 57 and name n ) (resid 57 and name ca) (resid 57 and name c ) 1.0 -99.0 35.0 2 !! d58 assign (resid 57 and name c ) (resid 58 and name n ) (resid 58 and name ca) (resid 58 and name c ) 1.0 -88.0 20.0 2 !! v59 assign (resid 58 and name c ) (resid 59 and name n ) (resid 59 and name ca) (resid 59 and name c ) 1.0 -61.0 60.0 2 !! d60 assign (resid 59 and name c ) (resid 60 and name n ) (resid 60 and name ca) (resid 60 and name c ) 1.0 -107.0 25.0 2 !! d61 assign (resid 60 and name c ) (resid 61 and name n ) (resid 61 and name ca) (resid 61 and name c ) 1.0 -110.0 20.0 2 !! a62 assign (resid 61 and name c ) (resid 62 and name n ) (resid 62 and name ca) (resid 62 and name c ) 1.0 -107.0 20.0 2 !! q63 assign (resid 62 and name c ) (resid 63 and name n ) (resid 63 and name ca) (resid 63 and name c ) 1.0 -73.0 40.0 2 !! d64 assign (resid 63 and name c ) (resid 64 and name n ) (resid 64 and name ca) (resid 64 and name c ) 1.0 -73.0 10.0 2 !! v65 assign (resid 64 and name c ) (resid 65 and name n ) (resid 65 and name ca) (resid 65 and name c ) 1.0 -80.0 20.0 2 !! a66 assign (resid 65 and name c ) (resid 66 and name n ) (resid 66 and name ca) (resid 66 and name c ) 1.0 -71.0 25.0 2 !! e67 assign (resid 66 and name c ) (resid 67 and name n ) (resid 67 and name ca) (resid 67 and name c ) 1.0 -66.0 10.0 2 !! e68 assign (resid 67 and name c ) (resid 68 and name n ) (resid 68 and name ca) (resid 68 and name c ) 1.0 -63.0 10.0 2 !! a69 assign (resid 68 and name c ) (resid 69 and name n ) (resid 69 and name ca) (resid 69 and name c ) 1.0 -85.0 30.0 2 !! e70 assign (resid 69 and name c ) (resid 70 and name n ) (resid 70 and name ca) (resid 70 and name c ) 1.0 60.0 30.0 2 !! v71 assign (resid 70 and name c ) (resid 71 and name n ) (resid 71 and name ca) (resid 71 and name c ) 1.0 -81.0 20.0 2 !! k72 assign (resid 71 and name c ) (resid 72 and name n ) (resid 72 and name ca) (resid 72 and name c ) 1.0 -110.0 25.0 2 !! a73 assign (resid 72 and name c ) (resid 73 and name n ) (resid 73 and name ca) (resid 73 and name c ) 1.0 -162.0 25.0 2 !! t74 assign (resid 73 and name c ) (resid 74 and name n ) (resid 74 and name ca) (resid 74 and name c ) 1.0 -120.0 30.0 2 !! p75 assign (resid 74 and name c ) (resid 75 and name n ) (resid 75 and name ca) (resid 75 and name c ) 1.0 -50.0 40.0 2 !! t76 assign (resid 75 and name c ) (resid 76 and name n ) (resid 76 and name ca) (resid 76 and name c ) 1.0 -120.0 35.0 2 !! f77 assign (resid 76 and name c ) (resid 77 and name n ) (resid 77 and name ca) (resid 77 and name c ) 1.0 -120.0 40.0 2 !! q78 assign (resid 77 and name c ) (resid 78 and name n ) (resid 78 and name ca) (resid 78 and name c ) 1.0 -107.0 25.0 2 !! f79 assign (resid 78 and name c ) (resid 79 and name n ) (resid 79 and name ca) (resid 79 and name c ) 1.0 -95.0 40.0 2 !! f80 assign (resid 79 and name c ) (resid 80 and name n ) (resid 80 and name ca) (resid 80 and name c ) 1.0 -120.0 15.0 2 !! k81 assign (resid 80 and name c ) (resid 81 and name n ) (resid 81 and name ca) (resid 81 and name c ) 1.0 -157.0 10.0 2 !! k82 assign (resid 81 and name c ) (resid 82 and name n ) (resid 82 and name ca) (resid 82 and name c ) 1.0 60.0 15.0 2 !! g83 assign (resid 82 and name c ) (resid 83 and name n ) (resid 83 and name ca) (resid 83 and name c ) 1.0 95.0 30.0 2 !! q84 assign (resid 83 and name c ) (resid 84 and name n ) (resid 84 and name ca) (resid 84 and name c ) 1.0 -120.0 20.0 2 !! k85 assign (resid 84 and name c ) (resid 85 and name n ) (resid 85 and name ca) (resid 85 and name c ) 1.0 -85.0 30.0 2 !! v86 assign (resid 85 and name c ) (resid 86 and name n ) (resid 86 and name ca) (resid 86 and name c ) 1.0 -120.0 15.0 2 !! g87 assign (resid 86 and name c ) (resid 87 and name n ) (resid 87 and name ca) (resid 87 and name c ) 1.0 180.0 40.0 2 !! e88 assign (resid 87 and name c ) (resid 88 and name n ) (resid 88 and name ca) (resid 88 and name c ) 1.0 -172.0 10.0 2 !! f89 assign (resid 88 and name c ) (resid 89 and name n ) (resid 89 and name ca) (resid 89 and name c ) 1.0 -174.0 10.0 2 !! s90 assign (resid 89 and name c ) (resid 90 and name n ) (resid 90 and name ca) (resid 90 and name c ) 1.0 -100.0 25.0 2 !! g91 assign (resid 90 and name c ) (resid 91 and name n ) (resid 91 and name ca) (resid 91 and name c ) 1.0 150.0 40.0 2 !! a92 assign (resid 91 and name c ) (resid 92 and name n ) (resid 92 and name ca) (resid 92 and name c ) 1.0 -81.0 40.0 2 !! n93 assign (resid 92 and name c ) (resid 93 and name n ) (resid 93 and name ca) (resid 93 and name c ) 1.0 -88.0 30.0 2 !! k94 assign (resid 93 and name c ) (resid 94 and name n ) (resid 94 and name ca) (resid 94 and name c ) 1.0 -63.0 10.0 2 !! e95 assign (resid 94 and name c ) (resid 95 and name n ) (resid 95 and name ca) (resid 95 and name c ) 1.0 -66.0 25.0 2 !! k96 assign (resid 95 and name c ) (resid 96 and name n ) (resid 96 and name ca) (resid 96 and name c ) 1.0 -67.0 25.0 2 !! l97 assign (resid 96 and name c ) (resid 97 and name n ) (resid 97 and name ca) (resid 97 and name c ) 1.0 -52.0 10.0 2 !! e98 assign (resid 97 and name c ) (resid 98 and name n ) (resid 98 and name ca) (resid 98 and name c ) 1.0 -67.0 10.0 2 !! a99 assign (resid 98 and name c ) (resid 99 and name n ) (resid 99 and name ca) (resid 99 and name c ) 1.0 -67.0 20.0 2 !! t100 assign (resid 99 and name c ) (resid 100 and name n ) (resid 100 and name ca) (resid 100 and name c ) 1.0 -70.0 10.0 2 !! i101 assign (resid 100 and name c ) (resid 101 and name n ) (resid 101 and name ca) (resid 101 and name c ) 1.0 -64.0 30.0 2 !! n102 assign (resid 101 and name c ) (resid 102 and name n ) (resid 102 and name ca) (resid 102 and name c ) 1.0 -62.0 30.0 2 !! e103 assign (resid 102 and name c ) (resid 103 and name n ) (resid 103 and name ca) (resid 103 and name c ) 1.0 -78.0 10.0 2 !! l104 assign (resid 103 and name c ) (resid 104 and name n ) (resid 104 and name ca) (resid 104 and name c ) 1.0 -100.0 20.0 2 !! v105 assign (resid 104 and name c ) (resid 105 and name n ) (resid 105 and name ca) (resid 105 and name c ) 1.0 -63.0 10.0 2 !remark psi angles constraints !! m1 assign (resid 1 and name n ) (resid 1 and name ca) (resid 1 and name c ) (resid 2 and name n ) 1.0 180.0 50.0 2 !! 2 assign (resid 2 and name n ) (resid 2 and name ca) (resid 2 and name c ) (resid 3 and name n ) 1.0 180.0 50.0 2 !! k3 assign (resid 3 and name n ) (resid 3 and name ca) (resid 3 and name c ) (resid 4 and name n ) 1.0 120.0 50.0 2 !! k3 assign (resid 3 and name n ) (resid 3 and name ca) (resid 3 and name c ) (resid 4 and name n ) 1.0 120.0 50.0 2 !! i5 assign (resid 5 and name n ) (resid 5 and name ca) (resid 5 and name c ) (resid 6 and name n ) 1.0 115.0 90.0 2 !! e6 assign (resid 6 and name n ) (resid 6 and name ca) (resid 6 and name c ) (resid 7 and name n ) 1.0 -10.0 75.0 2 !! s7 assign (resid 7 and name n ) (resid 7 and name ca) (resid 7 and name c ) (resid 8 and name n ) 1.0 -165.0 90.0 2 !! k8 assign (resid 8 and name n ) (resid 8 and name ca) (resid 8 and name c ) (resid 9 and name n ) 1.0 -50.0 50.0 2 !! t9 assign (resid 9 and name n ) (resid 9 and name ca) (resid 9 and name c ) (resid 10 and name n ) 1.0 -45.0 50.0 2 !! a14 assign (resid 14 and name n ) (resid 14 and name ca) (resid 14 and name c ) (resid 15 and name n ) 1.0 0.0 105.0 2 !! l15 assign (resid 15 and name n ) (resid 15 and name ca) (resid 15 and name c ) (resid 16 and name n ) 1.0 -30.0 105.0 2 !! a17 assign (resid 17 and name n ) (resid 17 and name ca) (resid 17 and name c ) (resid 18 and name n ) 1.0 5.0 60.0 2 !! a18 assign (resid 18 and name n ) (resid 18 and name ca) (resid 18 and name c ) (resid 19 and name n ) 1.0 0.0 85.0 2 !! g19 assign (resid 19 and name n ) (resid 19 and name ca) (resid 19 and name c ) (resid 20 and name n ) 1.0 -85.0 90.0 2 !! d20 assign (resid 20 and name n ) (resid 20 and name ca) (resid 20 and name c ) (resid 21 and name n ) 1.0 0.0 85.0 2 !! k21 assign (resid 21 and name n ) (resid 21 and name ca) (resid 21 and name c ) (resid 22 and name n ) 1.0 110.0 85.0 2 !! l22 assign (resid 22 and name n ) (resid 22 and name ca) (resid 22 and name c ) (resid 23 and name n ) 1.0 110.0 85.0 2 !! v24 assign (resid 24 and name n ) (resid 24 and name ca) (resid 24 and name c ) (resid 25 and name n ) 1.0 115.0 90.0 2 !! d26 assign (resid 26 and name n ) (resid 26 and name ca) (resid 26 and name c ) (resid 27 and name n ) 1.0 100.0 155.0 2 !! f27 assign (resid 27 and name n ) (resid 27 and name ca) (resid 27 and name c ) (resid 28 and name n ) 1.0 110.0 135.0 2 !! s28 assign (resid 28 and name n ) (resid 28 and name ca) (resid 28 and name c ) (resid 29 and name n ) 1.0 180.0 50.0 2 !! a29 !! g33 assign (resid 33 and name n ) (resid 33 and name ca) (resid 33 and name c ) (resid 34 and name n ) 1.0 -85.0 90.0 2 !! p34 assign (resid 34 and name n ) (resid 34 and name ca) (resid 34 and name c ) (resid 35 and name n ) 1.0 -5.0 75.0 2 !! a35 assign (resid 35 and name n ) (resid 35 and name ca) (resid 35 and name c ) (resid 36 and name n ) 1.0 -5.0 60.0 2 !! k36 assign (resid 36 and name n ) (resid 36 and name ca) (resid 36 and name c ) (resid 37 and name n ) 1.0 -40.0 50.0 2 !! m37 assign (resid 37 and name n ) (resid 37 and name ca) (resid 37 and name c ) (resid 38 and name n ) 1.0 85.0 170.0 2 !! i38 assign (resid 38 and name n ) (resid 38 and name ca) (resid 38 and name c ) (resid 39 and name n ) 1.0 65.0 130.0 2 !! n39 assign (resid 39 and name n ) (resid 39 and name ca) (resid 39 and name c ) (resid 40 and name n ) 1.0 -35.0 50.0 2 !! p40 assign (resid 40 and name n ) (resid 40 and name ca) (resid 40 and name c ) (resid 41 and name n ) 1.0 -40.0 50.0 2 !! f41 assign (resid 41 and name n ) (resid 41 and name ca) (resid 41 and name c ) (resid 42 and name n ) 1.0 -50.0 50.0 2 !! f42 assign (resid 42 and name n ) (resid 42 and name ca) (resid 42 and name c ) (resid 43 and name n ) 1.0 -50.0 50.0 2 !! h43 assign (resid 43 and name n ) (resid 43 and name ca) (resid 43 and name c ) (resid 44 and name n ) 1.0 -50.0 50.0 2 !! s44 assign (resid 44 and name n ) (resid 44 and name ca) (resid 44 and name c ) (resid 45 and name n ) 1.0 85.0 170.0 2 !! l45 assign (resid 45 and name n ) (resid 45 and name ca) (resid 45 and name c ) (resid 46 and name n ) 1.0 -30.0 50.0 2 !! s46 assign (resid 46 and name n ) (resid 46 and name ca) (resid 46 and name c ) (resid 47 and name n ) 1.0 -45.0 50.0 2 !! e47 assign (resid 47 and name n ) (resid 47 and name ca) (resid 47 and name c ) (resid 48 and name n ) 1.0 -15.0 90.0 2 !! k48 assign (resid 48 and name n ) (resid 48 and name ca) (resid 48 and name c ) (resid 49 and name n ) 1.0 -25.0 70.0 2 !! v52 assign (resid 52 and name n ) (resid 52 and name ca) (resid 52 and name c ) (resid 53 and name n ) 1.0 140.0 115.0 2 !! i53 assign (resid 53 and name n ) (resid 53 and name ca) (resid 53 and name c ) (resid 54 and name n ) 1.0 115.0 90.0 2 !! f54 assign (resid 54 and name n ) (resid 54 and name ca) (resid 54 and name c ) (resid 55 and name n ) 1.0 115.0 90.0 2 !! l55 assign (resid 55 and name n ) (resid 55 and name ca) (resid 55 and name c ) (resid 56 and name n ) 1.0 110.0 135.0 2 !! v57 assign (resid 57 and name n ) (resid 57 and name ca) (resid 57 and name c ) (resid 58 and name n ) 1.0 115.0 90.0 2 !! d58 assign (resid 58 and name n ) (resid 58 and name ca) (resid 58 and name c ) (resid 59 and name n ) 1.0 85.0 90.0 2 !! v59 assign (resid 59 and name n ) (resid 59 and name ca) (resid 59 and name c ) (resid 60 and name n ) 1.0 85.0 160.0 2 !! d60 assign (resid 60 and name n ) (resid 60 and name ca) (resid 60 and name c ) (resid 61 and name n ) 1.0 -50.0 50.0 2 !! d61 assign (resid 61 and name n ) (resid 61 and name ca) (resid 61 and name c ) (resid 62 and name n ) 1.0 0.0 85.0 2 !! a62 assign (resid 62 and name n ) (resid 62 and name ca) (resid 62 and name c ) (resid 63 and name n ) 1.0 110.0 135.0 2 !! q63 assign (resid 63 and name n ) (resid 63 and name ca) (resid 63 and name c ) (resid 64 and name n ) 1.0 25.0 60.0 2 !! d64 assign (resid 64 and name n ) (resid 64 and name ca) (resid 64 and name c ) (resid 65 and name n ) 1.0 -40.0 50.0 2 !! 66 assign (resid 66 and name n ) (resid 66 and name ca) (resid 66 and name c ) (resid 67 and name n ) 1.0 -40.0 50.0 2 !! 67 assign (resid 67 and name n ) (resid 67 and name ca) (resid 67 and name c ) (resid 68 and name n ) 1.0 -60.0 50.0 2 !! e68 assign (resid 68 and name n ) (resid 68 and name ca) (resid 68 and name c ) (resid 69 and name n ) 1.0 0.0 50.0 2 !! a69 assign (resid 69 and name n ) (resid 69 and name ca) (resid 69 and name c ) (resid 70 and name n ) 1.0 0.0 50.0 2 !! e70 assign (resid 70 and name n ) (resid 70 and name ca) (resid 70 and name c ) (resid 71 and name n ) 1.0 50.0 50.0 2 !! v71 assign (resid 71 and name n ) (resid 71 and name ca) (resid 71 and name c ) (resid 72 and name n ) 1.0 115.0 50.0 2 !! k72 assign (resid 72 and name n ) (resid 72 and name ca) (resid 72 and name c ) (resid 73 and name n ) 1.0 -20.0 65.0 2 !! t76 assign (resid 76 and name n ) (resid 76 and name ca) (resid 76 and name c ) (resid 77 and name n ) 1.0 140.0 115.0 2 !! f77 assign (resid 77 and name n ) (resid 77 and name ca) (resid 77 and name c ) (resid 78 and name n ) 1.0 120.0 75.0 2 !! q78 assign (resid 78 and name n ) (resid 78 and name ca) (resid 78 and name c ) (resid 79 and name n ) 1.0 120.0 75.0 2 !! f79 assign (resid 79 and name n ) (resid 79 and name ca) (resid 79 and name c ) (resid 80 and name n ) 1.0 130.0 75.0 2 !! f80 assign (resid 80 and name n ) (resid 80 and name ca) (resid 80 and name c ) (resid 81 and name n ) 1.0 125.0 80.0 2 !! k81 assign (resid 81 and name n ) (resid 81 and name ca) (resid 81 and name c ) (resid 82 and name n ) 1.0 135.0 120.0 2 !! k85 assign (resid 85 and name n ) (resid 85 and name ca) (resid 85 and name c ) (resid 86 and name n ) 1.0 110.0 85.0 2 !! v86 assign (resid 86 and name n ) (resid 86 and name ca) (resid 86 and name c ) (resid 87 and name n ) 1.0 -15.0 90.0 2 !! g87 assign (resid 87 and name n ) (resid 87 and name ca) (resid 87 and name c ) (resid 88 and name n ) 1.0 150.0 50.0 2 !! e88 assign (resid 88 and name n ) (resid 88 and name ca) (resid 88 and name c ) (resid 89 and name n ) 1.0 -175.0 60.0 2 !! f89 assign (resid 89 and name n ) (resid 89 and name ca) (resid 89 and name c ) (resid 90 and name n ) 1.0 110.0 135.0 2 !! s90 assign (resid 90 and name n ) (resid 90 and name ca) (resid 90 and name c ) (resid 91 and name n ) 1.0 165.0 50.0 2 !! g91 assign (resid 91 and name n ) (resid 91 and name ca) (resid 91 and name c ) (resid 92 and name n ) 1.0 95.0 90.0 2 !! a92 assign (resid 92 and name n ) (resid 92 and name ca) (resid 92 and name c ) (resid 93 and name n ) 1.0 110.0 85.0 2 !! n93 assign (resid 93 and name n ) (resid 93 and name ca) (resid 93 and name c ) (resid 94 and name n ) 1.0 80.0 50.0 2 !! k94 assign (resid 94 and name n ) (resid 94 and name ca) (resid 94 and name c ) (resid 95 and name n ) 1.0 -15.0 80.0 2 !! e95 assign (resid 95 and name n ) (resid 95 and name ca) (resid 95 and name c ) (resid 96 and name n ) 1.0 0.0 85.0 2 !! k96 assign (resid 96 and name n ) (resid 96 and name ca) (resid 96 and name c ) (resid 97 and name n ) 1.0 -25.0 70.0 2 !! e98 assign (resid 98 and name n ) (resid 98 and name ca) (resid 98 and name c ) (resid 99 and name n ) 1.0 0.0 105.0 2 !! i101 assign (resid 101 and name n ) (resid 101 and name ca) (resid 101 and name c ) (resid 102 and name n ) 1.0 -95.0 70.0 2 !remark chi angles constraints !! v2 assign (resid 2 and name n ) (resid 2 and name ca) (resid 2 and name cb) (resid 2 and name cg1) 1.0 180.0 20.0 2 !! k3 assign (resid 3 and name n ) (resid 3 and name ca) (resid 3 and name cb) (resid 3 and name cg) 1.0 180.0 20.0 2 !! q4 assign (resid 4 and name n ) (resid 4 and name ca) (resid 4 and name cb) (resid 4 and name cg) 1.0 180.0 20.0 2 !! i5 assign (resid 5 and name n ) (resid 5 and name ca) (resid 5 and name cb) (resid 5 and name cg1) 1.0 -60.0 20.0 2 !! e6 assign (resid 6 and name n ) (resid 6 and name ca) (resid 6 and name cb) (resid 6 and name cg) 1.0 -60.0 20.0 2 !! s7 assign (resid 7 and name n ) (resid 7 and name ca) (resid 7 and name cb) (resid 7 and name og) 1.0 60.0 20.0 2 !! k8 assign (resid 8 and name n ) (resid 8 and name ca) (resid 8 and name cb) (resid 8 and name cg) 1.0 180.0 20.0 2 !! t9 assign (resid 9 and name n ) (resid 9 and name ca) (resid 9 and name cb) (resid 9 and name og1) 1.0 -60.0 20.0 2 !! f11 assign (resid 11 and name n ) (resid 11 and name ca) (resid 11 and name cb) (resid 11 and name cg) 1.0 180.0 20.0 2 !! e13 assign (resid 13 and name n ) (resid 13 and name ca) (resid 13 and name cb) (resid 13 and name cg) 1.0 -60.0 20.0 2 !! l15 assign (resid 15 and name n ) (resid 15 and name ca) (resid 15 and name cb) (resid 15 and name cg) 1.0 -60.0 20.0 2 !! d16 assign (resid 16 and name n ) (resid 16 and name ca) (resid 16 and name cb) (resid 16 and name cg) 1.0 -180.0 20.0 2 !! d20 assign (resid 20 and name n ) (resid 20 and name ca) (resid 20 and name cb) (resid 20 and name cg) 1.0 -120.0 135.0 2 !! k21 assign (resid 21 and name n ) (resid 21 and name ca) (resid 21 and name cb) (resid 21 and name cg) 1.0 -60.0 20.0 2 !! v23 assign (resid 23 and name n ) (resid 23 and name ca) (resid 23 and name cb) (resid 23 and name cg1) 1.0 180.0 20.0 2 !! v24 assign (resid 24 and name n ) (resid 24 and name ca) (resid 24 and name cb) (resid 24 and name cg1) 1.0 180.0 20.0 2 !! v25 assign (resid 25 and name n ) (resid 25 and name ca) (resid 25 and name cb) (resid 25 and name cg1) 1.0 180.0 20.0 2 !! d26 assign (resid 26 and name n ) (resid 26 and name ca) (resid 26 and name cb) (resid 26 and name cg) 1.0 180.0 20.0 2 !! f27 assign (resid 27 and name n ) (resid 27 and name ca) (resid 27 and name cb) (resid 27 and name cg) 1.0 -60.0 20.0 2 !! s28 assign (resid 28 and name n ) (resid 28 and name ca) (resid 28 and name cb) (resid 28 and name og) 1.0 -60.0 20.0 2 !! t30 assign (resid 30 and name n ) (resid 30 and name ca) (resid 30 and name cb) (resid 30 and name og1) 1.0 180.0 20.0 2 !! w31 assign (resid 31 and name n ) (resid 31 and name ca) (resid 31 and name cb) (resid 31 and name cg) 1.0 60.0 20.0 2 !! c32 assign (resid 32 and name n ) (resid 32 and name ca) (resid 32 and name cb) (resid 32 and name sg) 1.0 180.0 20.0 2 !! p34 assign (resid 34 and name n ) (resid 34 and name ca) (resid 34 and name cb) (resid 34 and name cg) 1.0 0.0 20.0 2 !! a35 !! k36 assign (resid 36 and name n ) (resid 36 and name ca) (resid 36 and name cb) (resid 36 and name cg) 1.0 180.0 20.0 2 !! i38 assign (resid 38 and name n ) (resid 38 and name ca) (resid 38 and name cb) (resid 38 and name cg1) 1.0 -60.0 20.0 2 !! k39 assign (resid 39 and name n ) (resid 39 and name ca) (resid 39 and name cb) (resid 39 and name cg) 1.0 60.0 20.0 2 !! p40 assign (resid 40 and name n ) (resid 40 and name ca) (resid 40 and name cb) (resid 40 and name cg) 1.0 0.0 20.0 2 !! f41 assign (resid 41 and name n ) (resid 41 and name ca) (resid 41 and name cb) (resid 41 and name cg) 1.0 -60.0 20.0 2 !! f42 assign (resid 42 and name n ) (resid 42 and name ca) (resid 42 and name cb) (resid 42 and name cg) 1.0 180.0 20.0 2 !! h43 assign (resid 43 and name n ) (resid 43 and name ca) (resid 43 and name cb) (resid 43 and name cg) 1.0 180.0 25.0 2 !! l45 assign (resid 45 and name n ) (resid 45 and name ca) (resid 45 and name cb) (resid 45 and name cg) 1.0 -60.0 20.0 2 !! s46 assign (resid 46 and name n ) (resid 46 and name ca) (resid 46 and name cb) (resid 46 and name og) 1.0 -60.0 20.0 2 !! e47 assign (resid 47 and name n ) (resid 47 and name ca) (resid 47 and name cb) (resid 47 and name cg) 1.0 -60.0 20.0 2 !! k48 assign (resid 48 and name n ) (resid 48 and name ca) (resid 48 and name cb) (resid 48 and name cg) 1.0 180.0 20.0 2 !! y49 assign (resid 49 and name n ) (resid 49 and name ca) (resid 49 and name cb) (resid 49 and name cg) 1.0 -60.0 20.0 2 !! s50 assign (resid 50 and name n ) (resid 50 and name ca) (resid 50 and name cb) (resid 50 and name og) 1.0 60.0 20.0 2 !! n51 assign (resid 51 and name n ) (resid 51 and name ca) (resid 51 and name cb) (resid 51 and name cg) 1.0 -170.0 25.0 2 !! v52 assign (resid 52 and name n ) (resid 52 and name ca) (resid 52 and name cb) (resid 52 and name cg1) 1.0 180.0 20.0 2 !! i53 assign (resid 53 and name n ) (resid 53 and name ca) (resid 53 and name cb) (resid 53 and name cg1) 1.0 -60.0 20.0 2 !! f54 assign (resid 54 and name n ) (resid 54 and name ca) (resid 54 and name cb) (resid 54 and name cg) 1.0 -60.0 20.0 2 !! l55 assign (resid 55 and name n ) (resid 55 and name ca) (resid 55 and name cb) (resid 55 and name cg) 1.0 -60.0 20.0 2 !! v57 assign (resid 57 and name n ) (resid 57 and name ca) (resid 57 and name cb) (resid 57 and name cg1) 1.0 180.0 20.0 2 !! d58 assign (resid 58 and name n ) (resid 58 and name ca) (resid 58 and name cb) (resid 58 and name cg) 1.0 180.0 20.0 2 !! v59 assign (resid 59 and name n ) (resid 59 and name ca) (resid 59 and name cb) (resid 59 and name cg1) 1.0 -60.0 20.0 2 !! d60 assign (resid 60 and name n ) (resid 60 and name ca) (resid 60 and name cb) (resid 60 and name cg) 1.0 -60.0 20.0 2 !! d61 assign (resid 61 and name n ) (resid 61 and name ca) (resid 61 and name cb) (resid 61 and name cg) 1.0 -60.0 20.0 2 !! d64 assign (resid 64 and name n ) (resid 64 and name ca) (resid 64 and name cb) (resid 64 and name cg) 1.0 60.0 20.0 2 !! v65 assign (resid 65 and name n ) (resid 65 and name ca) (resid 65 and name cb) (resid 65 and name cg1) 1.0 180.0 20.0 2 !! e68 assign (resid 68 and name n ) (resid 68 and name ca) (resid 68 and name cb) (resid 68 and name cg) 1.0 180.0 20.0 2 !! v71 assign (resid 71 and name n ) (resid 71 and name ca) (resid 71 and name cb) (resid 71 and name cg1) 1.0 180.0 20.0 2 !! k72 assign (resid 72 and name n ) (resid 72 and name ca) (resid 72 and name cb) (resid 72 and name cg) 1.0 -60.0 20.0 2 !! t74 assign (resid 74 and name n ) (resid 74 and name ca) (resid 74 and name cb) (resid 74 and name og1) 1.0 60.0 20.0 2 !! p75 assign (resid 75 and name n ) (resid 75 and name ca) (resid 75 and name cb) (resid 75 and name cg) 1.0 0.0 25.0 2 !! t76 assign (resid 76 and name n ) (resid 76 and name ca) (resid 76 and name cb) (resid 76 and name og1) 1.0 -60.0 20.0 2 !! f77 assign (resid 77 and name n ) (resid 77 and name ca) (resid 77 and name cb) (resid 77 and name cg) 1.0 -60.0 20.0 2 !! n78 assign (resid 78 and name n ) (resid 78 and name ca) (resid 78 and name cb) (resid 78 and name cg) 1.0 -60.0 20.0 2 !! f79 assign (resid 79 and name n ) (resid 79 and name ca) (resid 79 and name cb) (resid 79 and name cg) 1.0 -60.0 20.0 2 !! f80 assign (resid 80 and name n ) (resid 80 and name ca) (resid 80 and name cb) (resid 80 and name cg) 1.0 -60.0 20.0 2 !! k81 assign (resid 81 and name n ) (resid 81 and name ca) (resid 81 and name cb) (resid 81 and name cg) 1.0 180.0 20.0 2 !! k82 assign (resid 82 and name n ) (resid 82 and name ca) (resid 82 and name cb) (resid 82 and name cg) 1.0 -60.0 20.0 2 !! n84 assign (resid 84 and name n ) (resid 84 and name ca) (resid 84 and name cb) (resid 84 and name cg) 1.0 -60.0 20.0 2 !! k85 assign (resid 85 and name n ) (resid 85 and name ca) (resid 85 and name cb) (resid 85 and name cg) 1.0 180.0 20.0 2 !! v86 assign (resid 86 and name n ) (resid 86 and name ca) (resid 86 and name cb) (resid 86 and name cg1) 1.0 -60.0 20.0 2 !! f89 assign (resid 89 and name n ) (resid 89 and name ca) (resid 89 and name cb) (resid 89 and name cg) 1.0 60.0 20.0 2 !! s90 assign (resid 90 and name n ) (resid 90 and name ca) (resid 90 and name cb) (resid 90 and name og) 1.0 60.0 20.0 2 !! n93 assign (resid 93 and name n ) (resid 93 and name ca) (resid 93 and name cb) (resid 93 and name cg) 1.0 180.0 20.0 2 !! k94 assign (resid 94 and name n ) (resid 94 and name ca) (resid 94 and name cb) (resid 94 and name cg) 1.0 60.0 20.0 2 !! e95 assign (resid 95 and name n ) (resid 95 and name ca) (resid 95 and name cb) (resid 95 and name cg) 1.0 -60.0 20.0 2 !! k96 assign (resid 96 and name n ) (resid 96 and name ca) (resid 96 and name cb) (resid 96 and name cg) 1.0 180.0 20.0 2 !! l97 assign (resid 97 and name n ) (resid 97 and name ca) (resid 97 and name cb) (resid 97 and name cg) 1.0 -60.0 20.0 2 !! e98 assign (resid 98 and name n ) (resid 98 and name ca) (resid 98 and name cb) (resid 98 and name cg) 1.0 180.0 40.0 2 !! t100 assign (resid 100 and name n ) (resid 100 and name ca) (resid 100 and name cb) (resid 100 and name og1) 1.0 -60.0 20.0 2 !! i101 assign (resid 101 and name n ) (resid 101 and name ca) (resid 101 and name cb) (resid 101 and name cg1) 1.0 -60.0 20.0 2 !! n102 assign (resid 102 and name n ) (resid 102 and name ca) (resid 102 and name cb) (resid 102 and name cg) 1.0 180.0 20.0 2 !! e103 assign (resid 103 and name n ) (resid 103 and name ca) (resid 103 and name cb) (resid 103 and name cg) 1.0 180.0 20.0 2 !! l104 assign (resid 104 and name n ) (resid 104 and name ca) (resid 104 and name cb) (resid 104 and name cg) 1.0 -60.0 20.0 2 !! v105 assign (resid 105 and name n ) (resid 105 and name ca) (resid 105 and name cb) (resid 105 and name cg1) 1.0 60.0 60.0 2 !remark chi2 angles constraints !! q4 assign (resid 4 and name ca) (resid 4 and name cb) (resid 4 and name cg) (resid 4 and name cd) 1.0 180.0 20.0 2 !! i5 assign (resid 5 and name ca) (resid 5 and name cb) (resid 5 and name cg1) (resid 5 and name cd1) 1.0 -60.0 20.0 2 !! k8 assign (resid 8 and name ca) (resid 8 and name cb) (resid 8 and name cg) (resid 8 and name cd) 1.0 180.0 20.0 2 !! f11 assign (resid 11 and name ca) (resid 11 and name cb) (resid 11 and name cg) (resid 11 and name cd1) 1.0 90.0 20.0 2 !! l15 assign (resid 15 and name ca) (resid 15 and name cb) (resid 15 and name cg) (resid 15 and name cd1) 1.0 180.0 20.0 2 !! k21 assign (resid 21 and name ca) (resid 21 and name cb) (resid 21 and name cg) (resid 21 and name cd) 1.0 180.0 20.0 2 !! l22 assign (resid 22 and name ca) (resid 22 and name cb) (resid 22 and name cg) (resid 22 and name cd1) 1.0 180.0 20.0 2 !! f27 assign (resid 27 and name ca) (resid 27 and name cb) (resid 27 and name cg) (resid 27 and name cd1) 1.0 -90.0 20.0 2 !! k36 assign (resid 36 and name ca) (resid 36 and name cb) (resid 36 and name cg) (resid 36 and name cd) 1.0 180.0 20.0 2 !! i38 assign (resid 38 and name ca) (resid 38 and name cb) (resid 38 and name cg1) (resid 38 and name cd1) 1.0 180.0 20.0 2 !! k39 assign (resid 39 and name ca) (resid 39 and name cb) (resid 39 and name cg) (resid 39 and name cd) 1.0 180.0 20.0 2 !! f41 assign (resid 41 and name ca) (resid 41 and name cb) (resid 41 and name cg) (resid 41 and name cd1) 1.0 -90.0 20.0 2 !! f42 assign (resid 42 and name ca) (resid 42 and name cb) (resid 42 and name cg) (resid 42 and name cd1) 1.0 90.0 20.0 2 !! h43 assign (resid 43 and name ca) (resid 43 and name cb) (resid 43 and name cg) (resid 43 and name cd2) 1.0 -60.0 20.0 2 !! l45 assign (resid 45 and name ca) (resid 45 and name cb) (resid 45 and name cg) (resid 45 and name cd1) 1.0 180.0 20.0 2 !! y49 assign (resid 49 and name ca) (resid 49 and name cb) (resid 49 and name cg) (resid 49 and name cd1) 1.0 90.0 20.0 2 !! i53 assign (resid 53 and name ca) (resid 53 and name cb) (resid 53 and name cg1) (resid 53 and name cd1) 1.0 -60.0 20.0 2 !! f54 assign (resid 54 and name ca) (resid 54 and name cb) (resid 54 and name cg) (resid 54 and name cd1) 1.0 90.0 20.0 2 !! l55 assign (resid 55 and name ca) (resid 55 and name cb) (resid 55 and name cg) (resid 55 and name cd1) 1.0 60.0 20.0 2 !! f77 assign (resid 77 and name ca) (resid 77 and name cb) (resid 77 and name cg) (resid 77 and name cd1) 1.0 -90.0 20.0 2 !! q78 assign (resid 78 and name ca) (resid 78 and name cb) (resid 78 and name cg) (resid 78 and name cd) 1.0 180.0 20.0 2 !! f79 assign (resid 79 and name ca) (resid 79 and name cb) (resid 79 and name cg) (resid 79 and name cd1) 1.0 -90.0 20.0 2 !! f80 assign (resid 80 and name ca) (resid 80 and name cb) (resid 80 and name cg) (resid 80 and name cd1) 1.0 -90.0 20.0 2 !! k82 assign (resid 82 and name ca) (resid 82 and name cb) (resid 82 and name cg) (resid 82 and name cd) 1.0 180.0 20.0 2 !! k85 assign (resid 85 and name ca) (resid 85 and name cb) (resid 85 and name cg) (resid 85 and name cd) 1.0 180.0 20.0 2 !! f89 assign (resid 89 and name ca) (resid 89 and name cb) (resid 89 and name cg) (resid 89 and name cd1) 1.0 90.0 20.0 2 !! k96 assign (resid 96 and name ca) (resid 96 and name cb) (resid 96 and name cg) (resid 96 and name cd) 1.0 180.0 20.0 2 !! l97 assign (resid 97 and name ca) (resid 97 and name cb) (resid 97 and name cg) (resid 97 and name cd1) 1.0 180.0 20.0 2 !! i101 assign (resid 101 and name ca) (resid 101 and name cb) (resid 101 and name cg1) (resid 101 and name cd1) 1.0 180.0 20.0 2 !! l104 assign (resid 104 and name ca) (resid 104 and name cb) (resid 104 and name cg) (resid 104 and name cd1) 1.0 180.0 20.0 2 !remark phi angle constraints !! a107 assign (resid 106 and name c ) (resid 107 and name n ) (resid 107 and name ca) (resid 107 and name c ) 1.0 -90.0 80.0 2 !! t108 assign (resid 107 and name c ) (resid 108 and name n ) (resid 108 and name ca) (resid 108 and name c ) 1.0 -100.0 20.0 2 !! l109 assign (resid 108 and name c ) (resid 109 and name n ) (resid 109 and name ca) (resid 109 and name c ) 1.0 -75.0 20.0 2 !! k110 assign (resid 109 and name c ) (resid 110 and name n ) (resid 110 and name ca) (resid 110 and name c ) 1.0 -70.0 20. 2 !! i111 assign (resid 110 and name c ) (resid 111 and name n ) (resid 111 and name ca) (resid 111 and name c ) 1.0 -130.0 20.0 2 !! c112 assign (resid 111 and name c ) (resid 112 and name n ) (resid 112 and name ca) (resid 112 and name c ) 1.0 -90.0 20.0 2 !! s113 assign (resid 112 and name c ) (resid 113 and name n ) (resid 113 and name ca) (resid 113 and name c ) 1.0 -85.0 20.0 2 !! w114 assign (resid 113 and name c ) (resid 114 and name n ) (resid 114 and name ca) (resid 114 and name c ) 1.0 -80.0 20.0 2 !! n115 assign (resid 114 and name c ) (resid 115 and name n ) (resid 115 and name ca) (resid 115 and name c ) 1.0 -50.0 20.0 2 !! v116 assign (resid 115 and name c ) (resid 116 and name n ) (resid 116 and name ca) (resid 116 and name c ) 1.0 -60.0 30.0 2 !! d117 assign (resid 116 and name c ) (resid 117 and name n ) (resid 117 and name ca) (resid 117 and name c ) 1.0 -60.0 30.0 2 !! g118 !remark psi angles constraints !! p106 ! !! a107 ! !! t108 assign (resid 108 and name n ) (resid 108 and name ca) (resid 108 and name c ) (resid 109 and name n ) 1.0 130.0 40.0 2 !! l109 assign (resid 109 and name n ) (resid 109 and name ca) (resid 109 and name c ) (resid 110 and name n ) 1.0 -10.0 50.0 2 !! k110 assign (resid 110 and name n ) (resid 110 and name ca) (resid 110 and name c ) (resid 111 and name n ) 1.0 -10.0 20.0 2 !! i111 assign (resid 111 and name n ) (resid 111 and name ca) (resid 111 and name c ) (resid 112 and name n ) 1.0 130.0 30.0 2 !! c112 assign (resid 112 and name n ) (resid 112 and name ca) (resid 112 and name c ) (resid 113 and name n ) 1.0 130.0 20.0 2 !! s113 assign (resid 113 and name n ) (resid 113 and name ca) (resid 113 and name c ) (resid 114 and name n ) 1.0 140.0 40.0 2 !! w114 assign (resid 114 and name n ) (resid 114 and name ca) (resid 114 and name c ) (resid 115 and name n ) 1.0 -10.0 20.0 2 !! n115 assign (resid 115 and name n ) (resid 115 and name ca) (resid 115 and name c ) (resid 116 and name n ) 1.0 20.0 30.0 2 !! v116 assign (resid 116 and name n ) (resid 116 and name ca) (resid 116 and name c ) (resid 117 and name n ) 1.0 140.0 40.0 2 !! d117 !remark chi angles constraints !! p106 !! a107 !! t108 assign (resid 108 and name n ) (resid 108 and name ca) (resid 108 and name cb) (resid 108 and name cg) 1.0 -60.0 20.0 2 !! l109 assign (resid 109 and name n ) (resid 109 and name ca) (resid 109 and name cb) (resid 109 and name cg) 1.0 -60.0 20.0 2 !! k110 assign (resid 110 and name n ) (resid 110 and name ca) (resid 110 and name cb) (resid 110 and name cg) 1.0 -60.0 20.0 2 !! i111 assign (resid 111 and name n ) (resid 111 and name ca) (resid 111 and name cb) (resid 111 and name cg1) 1.0 -60.0 20.0 2 !! c112 assign (resid 112 and name n ) (resid 112 and name ca) (resid 112 and name cb) (resid 112 and name sg) 1.0 -60.0 20.0 2 !! s113 assign (resid 113 and name n ) (resid 113 and name ca) (resid 113 and name cb) (resid 113 and name og) 1.0 -60.0 20.0 2 !! w114 assign (resid 114 and name n ) (resid 114 and name ca) (resid 114 and name cb) (resid 114 and name cg) 1.0 -60.0 20.0 2 !! n115 assign (resid 115 and name n ) (resid 115 and name ca) (resid 115 and name cb) (resid 115 and name cg) 1.0 -60.0 20.0 2 !! v116 assign (resid 116 and name n ) (resid 116 and name ca) (resid 116 and name cb) (resid 116 and name cg) 1.0 -60.0 20.0 2 !remark chi2 angles constraints !! l109 assign (resid 109 and name ca) (resid 109 and name cb) (resid 109 and name cg) (resid 109 and name cd1) 1.0 180.0 20.0 2 !! k110 assign (resid 110 and name ca) (resid 110 and name cb) (resid 110 and name cg) (resid 110 and name cd) 1.0 -60.0 20.0 2 !! i111 assign (resid 111 and name ca) (resid 111 and name cb) (resid 111 and name cg1) (resid 111 and name cd1) 1.0 -60.0 20.0 2 !! w114 assign (resid 114 and name ca) (resid 114 and name cb) (resid 114 and name cg) (resid 114 and name cd1) 1.0 60.0 15.0 2 !! n115 assign (resid 115 and name ca ) (resid 115 and name cb ) (resid 115 and name cg) (resid 115 and name od1 ) 1.0 180.0 20.0 2 !disulfide assign (resid 32 and name ca) (resid 32 and name cb) (resid 32 and name sg) (resid 112 and name sg) 1.0 180.0 40.0 2 assign (resid 32 and name sg) (resid 112 and name sg) (resid 112 and name cb) (resid 112 and name ca) 1.0 -90.0 40.0 2
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