NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
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12062 |
1shi   |
275 | cing | 1-original | 1 | XPLOR/CNS | distance | general distance | simple |
!1 ALA assign (resid 1 and name HA) (resid 2 and name HN) 0 -1.78 2.69 assign (resid 1 and name HA) (resid 2 and name HA) 0 -3.99 5.45 assign (resid 1 and name HB#) (resid 21 and name HG#) 0 -1.33 8.29 !2 ALA assign (resid 2 and name HN) (resid 2 and name HA) 0 -2.77 200.00 assign (resid 2 and name HN) (resid 21 and name HG#) 0 -1.33 8.30 assign (resid 2 and name HA) (resid 19 and name HN) 0 -4.00 200.00 assign (resid 2 and name HA) (resid 3 and name HN) 0 -1.33 2.58 assign (resid 2 and name HB#) (resid 17 and name HB#) 0 -0.82 6.31 !3 CYS assign (resid 3 and name HN) (resid 4 and name HA) 0 -4.00 5.33 assign (resid 3 and name HN) (resid 17 and name HA) 0 -4.00 5.90 assign (resid 3 and name HN) (resid 17 and name HB#) 0 -2.75 6.77 assign (resid 3 and name HN) (resid 17 and name HD1#) 0 -2.90 8.10 assign (resid 3 and name HN) (resid 17 and name HD2#) 0 -2.90 8.10 assign (resid 3 and name HN) (resid 17 and name HD#) 0 -1.78 7.73 assign (resid 3 and name HN) (resid 19 and name HN) 0 -2.83 3.89 assign (resid 3 and name HN) (resid 19 and name HA#) 0 -3.12 6.63 assign (resid 3 and name HN) (resid 20 and name HN) 0 -4.00 200.00 assign (resid 3 and name HB1) (resid 21 and name HB) 0 -4.00 6.12 assign (resid 3 and name HB1) (resid 37 and name HE#) 0 -1.78 6.75 assign (resid 3 and name HB2) (resid 37 and name HE#) 0 -1.78 6.75 assign (resid 3 and name HB2) (resid 21 and name HB) 0 -4.00 6.12 assign (resid 3 and name HB#) (resid 21 and name HB) 0 -1.78 5.86 assign (resid 3 and name HB#) (resid 21 and name HG#) 0 -1.78 7.45 !4 LYS assign (resid 4 and name HN) (resid 4 and name HB#) 0 -1.36 4.07 assign (resid 4 and name CB) (resid 4 and name HN) 0 -1.17 200.00 assign (resid 4 and name HG#) (resid 4 and name HA) 0 -1.12 4.02 assign (resid 4 and name CG) (resid 4 and name HA) 0 -0.93 200.00 assign (resid 4 and name HN) (resid 5 and name HN) 0 -3.57 5.06 assign (resid 4 and name HA) (resid 5 and name HN) 0 -2.04 2.68 assign (resid 4 and name HG#) (resid 5 and name HN) 0 -1.37 4.67 assign (resid 4 and name CG) (resid 5 and name HN) 0 -1.18 4.86 assign (resid 4 and name HB#) (resid 5 and name HN) 0 -2.35 5.24 assign (resid 4 and name CB) (resid 5 and name HN) 0 -2.16 200.00 assign (resid 4 and name CD) (resid 5 and name HN) 0 -2.91 7.69 assign (resid 4 and name HD#) (resid 5 and name HN) 0 -3.10 7.50 assign (resid 4 and name HE#) (resid 5 and name HN) 0 -1.78 7.67 assign (resid 4 and name HE2) (resid 5 and name HN) 0 -4.00 200.00 assign (resid 4 and name HN) (resid 17 and name HD#) 0 -2.13 7.37 assign (resid 4 and name HN) (resid 37 and name CG) 0 -1.78 9.08 assign (resid 4 and name HN) (resid 37 and name CZ) 0 -1.78 7.21 assign (resid 4 and name HN) (resid 37 and name HE#) 0 -1.78 7.21 assign (resid 4 and name HN) (resid 37 and name HD#) 0 -1.78 9.08 assign (resid 4 and name HA) (resid 15 and name HB#) 0 -2.34 6.18 assign (resid 4 and name HA) (resid 17 and name HN) 0 -3.87 5.20 assign (resid 4 and name HA) (resid 17 and name HD#) 0 -2.40 7.90 assign (resid 4 and name CB) (resid 17 and name HD#) 0 -0.87 8.35 assign (resid 4 and name HB#) (resid 17 and name HD1#) 0 -1.06 9.73 assign (resid 4 and name HB#) (resid 17 and name HD2#) 0 -1.06 9.73 assign (resid 4 and name HB#) (resid 17 and name HD#) 0 -1.78 7.21 assign (resid 4 and name CG) (resid 16 and name HD#) 0 -1.78 8.72 assign (resid 4 and name CG) (resid 16 and name HD2) 0 -2.91 200.00 assign (resid 4 and name CG) (resid 17 and name HD#) 0 -0.00 9.00 assign (resid 4 and name CG) (resid 18 and name HN) 0 -2.78 7.32 assign (resid 4 and name HG#) (resid 16 and name HD2) 0 -3.10 9.40 assign (resid 4 and name HG#) (resid 16 and name HD1) 0 -0.88 9.40 assign (resid 4 and name HG#) (resid 17 and name HD1#) 0 -0.14 8.18 assign (resid 4 and name HG#) (resid 17 and name HD2#) 0 -0.14 8.18 assign (resid 4 and name HG#) (resid 18 and name HN) 0 -2.97 7.13 assign (resid 4 and name HG#) (resid 16 and name HD#) 0 -1.78 7.58 assign (resid 4 and name HG#) (resid 17 and name HD#) 0 -1.78 5.64 assign (resid 4 and name HE1) (resid 17 and name HD#) 0 -2.90 200.00 assign (resid 4 and name HE2) (resid 17 and name HD#) 0 -2.90 200.00 !5 CYS assign (resid 5 and name HN) (resid 5 and name HB#) 0 -2.68 3.52 assign (resid 5 and name HN) (resid 5 and name HB1) 0 -2.23 200.00 assign (resid 5 and name HN) (resid 5 and name HB2) 0 -2.23 200.00 assign (resid 5 and name HA) (resid 5 and name HB#) 0 -2.30 200.00 assign (resid 5 and name HN) (resid 6 and name HN) 0 -4.00 5.71 assign (resid 5 and name HN) (resid 8 and name HN) 0 -4.00 5.99 assign (resid 5 and name HN) (resid 8 and name HB#) 0 -2.85 7.25 assign (resid 5 and name HN) (resid 15 and name HB#) 0 -2.79 6.92 assign (resid 5 and name HN) (resid 17 and name HN) 0 -4.00 6.58 assign (resid 5 and name HN) (resid 17 and name HA) 0 -3.51 5.20 assign (resid 5 and name HN) (resid 17 and name HB#) 0 -3.12 7.68 assign (resid 5 and name HN) (resid 17 and name HD#) 0 -1.32 9.22 assign (resid 5 and name HN) (resid 18 and name HN) 0 -3.53 5.18 assign (resid 5 and name HN) (resid 18 and name HG2#) 0 -2.90 7.50 assign (resid 5 and name HN) (resid 19 and name HN) 0 -3.57 5.16 assign (resid 5 and name HA) (resid 6 and name HN) 0 -2.43 3.19 assign (resid 5 and name HA) (resid 34 and name HB#) 0 -2.31 5.73 assign (resid 5 and name HB1) (resid 8 and name HG1) 0 -1.78 7.98 assign (resid 5 and name HB1) (resid 8 and name HG2) 0 -1.78 7.98 assign (resid 5 and name HB2) (resid 8 and name HG1) 0 -1.78 7.98 assign (resid 5 and name HB2) (resid 8 and name HG2) 0 -1.78 7.98 assign (resid 5 and name HB#) (resid 7 and name HN) 0 -2.18 4.63 assign (resid 5 and name HB#) (resid 8 and name HA) 0 -3.12 7.62 assign (resid 5 and name HB#) (resid 8 and name HG#) 0 -2.62 6.42 !6 ASP assign (resid 6 and name HN) (resid 6 and name HA) 0 -2.62 200.00 assign (resid 6 and name HN) (resid 7 and name HN) 0 -2.48 3.28 assign (resid 6 and name HB#) (resid 7 and name HN) 0 -2.37 200.00 assign (resid 6 and name HN) (resid 8 and name HN) 0 -4.00 6.42 assign (resid 6 and name HN) (resid 33 and name HA) 0 -3.88 5.52 assign (resid 6 and name HN) (resid 35 and name HN) 0 -4.00 7.36 assign (resid 6 and name HB1) (resid 35 and name HN) 0 -4.00 6.22 assign (resid 6 and name HB2) (resid 35 and name HN) 0 -4.00 6.22 assign (resid 6 and name HB#) (resid 35 and name HN) 0 -1.78 6.06 !7 ASP assign (resid 7 and name HN) (resid 8 and name HN) 0 -2.62 3.40 assign (resid 7 and name HB#) (resid 8 and name HN) 0 -3.12 200.00 assign (resid 7 and name HN) (resid 8 and name HA) 0 -4.00 5.89 assign (resid 7 and name HN) (resid 9 and name HN) 0 -4.00 6.47 assign (resid 7 and name HN) (resid 33 and name HA) 0 -4.00 5.76 !8 GLU assign (resid 8 and name HN) (resid 8 and name HA) 0 -2.62 200.00 assign (resid 8 and name HN) (resid 9 and name HN) 0 -2.37 3.12 assign (resid 8 and name HN) (resid 15 and name HB#) 0 -2.90 7.86 assign (resid 8 and name HA) (resid 9 and name HN) 0 -2.71 3.56 assign (resid 8 and name HB#) (resid 9 and name HN) 0 -2.52 200.00 assign (resid 8 and name HB1) (resid 16 and name HD2) 0 -1.78 6.21 assign (resid 8 and name HB1) (resid 16 and name HD1) 0 -1.78 6.21 assign (resid 8 and name HB2) (resid 16 and name HD2) 0 -1.78 6.21 assign (resid 8 and name HB2) (resid 16 and name HD1) 0 -1.78 6.21 assign (resid 8 and name HB#) (resid 16 and name HD#) 0 -2.05 4.66 assign (resid 8 and name HG#) (resid 9 and name HN) 0 -2.86 6.82 assign (resid 8 and name HG#) (resid 16 and name HD#) 0 -2.13 7.15 !9 GLY assign (resid 9 and name HN) (resid 9 and name HA1) 0 -2.39 200.00 assign (resid 9 and name HN) (resid 9 and name HA2) 0 -2.39 200.00 assign (resid 9 and name HN) (resid 10 and name HD2) 0 -3.59 6.02 assign (resid 9 and name HN) (resid 10 and name HD1) 0 -3.59 6.02 assign (resid 9 and name HN) (resid 10 and name HD#) 0 -3.70 5.80 assign (resid 9 and name HN) (resid 15 and name HB#) 0 -2.90 7.97 !10 PRO assign (resid 10 and name HB#) (resid 11 and name HN) 0 -3.12 200.00 assign (resid 10 and name HD2) (resid 11 and name HN) 0 -2.83 5.09 assign (resid 10 and name HD2) (resid 11 and name HB1) 0 -2.25 8.86 assign (resid 10 and name HD2) (resid 11 and name HB2) 0 -2.25 8.86 assign (resid 10 and name HD1) (resid 11 and name HN) 0 -2.83 5.09 assign (resid 10 and name HD1) (resid 11 and name HB1) 0 -2.25 8.86 assign (resid 10 and name HD1) (resid 11 and name HB2) 0 -2.25 8.86 assign (resid 10 and name HD#) (resid 11 and name HN) 0 -3.00 4.73 assign (resid 10 and name HD#) (resid 11 and name HB#) 0 -3.00 7.72 !11 ASP assign (resid 11 and name HB1) (resid 14 and name HN) 0 -3.04 200.00 assign (resid 11 and name HB2) (resid 14 and name HN) 0 -3.04 200.00 assign (resid 11 and name HB#) (resid 14 and name HN) 0 -3.44 5.02 assign (resid 11 and name HB#) (resid 12 and name HN) 0 -3.12 200.00 !12 ILE assign (resid 12 and name HA) (resid 12 and name HB) 0 -1.78 2.63 assign (resid 12 and name HG2#) (resid 13 and name CD) 0 -1.81 9.06 assign (resid 12 and name HG2#) (resid 13 and name HD#) 0 -2.00 8.87 !13 ARG assign (resid 13 and name HN) (resid 13 and name HA) 0 -2.32 200.00 assign (resid 13 and name HN) (resid 13 and name CD) 0 -2.91 7.46 assign (resid 13 and name HA) (resid 13 and name CD) 0 -2.84 200.00 assign (resid 13 and name HN) (resid 13 and name HD#) 0 -3.10 7.27 assign (resid 13 and name HN) (resid 13 and name HE) 0 -4.00 6.03 assign (resid 13 and name HN) (resid 14 and name HN) 0 -2.21 3.07 assign (resid 13 and name HN) (resid 14 and name HG2#) 0 -2.90 7.88 assign (resid 13 and name HA) (resid 13 and name HD#) 0 -3.03 6.31 assign (resid 13 and name HA) (resid 14 and name HN) 0 -2.82 200.00 assign (resid 13 and name HB#) (resid 14 and name HN) 0 -1.92 4.05 assign (resid 13 and name CG) (resid 14 and name HN) 0 -1.78 6.42 assign (resid 13 and name HG#) (resid 14 and name HN) 0 -2.51 6.23 assign (resid 13 and name CD) (resid 14 and name HG2#) 0 -1.81 9.86 assign (resid 13 and name HD#) (resid 14 and name HG2#) 0 -2.00 9.67 assign (resid 13 and name HD#) (resid 13 and name HE) 0 -1.71 200.00 !15 ALA assign (resid 15 and name HN) (resid 17 and name HD#) 0 -1.32 9.90 assign (resid 15 and name HN) (resid 16 and name HA) 0 -4.00 200.00 assign (resid 15 and name HB#) (resid 16 and name HD#) 0 -2.19 200.00 !16 PRO assign (resid 16 and name HA) (resid 17 and name HD#) 0 -1.32 8.99 assign (resid 16 and name HB1) (resid 17 and name HN) 0 -3.18 4.65 assign (resid 16 and name HB2) (resid 17 and name HN) 0 -3.18 4.65 assign (resid 16 and name HB#) (resid 17 and name HN) 0 -3.27 4.33 assign (resid 16 and name HB#) (resid 18 and name HG2#) 0 -1.20 6.80 assign (resid 16 and name HG#) (resid 17 and name HN) 0 -1.78 5.18 assign (resid 16 and name HD2) (resid 17 and name HN) 0 -2.87 5.14 assign (resid 16 and name HD1) (resid 17 and name HN) 0 -2.87 5.14 assign (resid 16 and name HD#) (resid 17 and name HN) 0 -3.26 4.49 assign (resid 16 and name HD#) (resid 17 and name HD#) 0 -1.78 10.07 assign (resid 16 and name HD#) (resid 18 and name HG2#) 0 -2.02 9.20 !17 LEU assign (resid 17 and name HN) (resid 17 and name HA) 0 -1.78 2.67 assign (resid 17 and name HN) (resid 17 and name HD#) 0 -1.78 6.74 assign (resid 17 and name HN) (resid 17 and name HB#) 0 -2.39 200.00 assign (resid 17 and name HN) (resid 18 and name HN) 0 -3.01 4.07 assign (resid 17 and name HA) (resid 18 and name HN) 0 -1.78 2.96 assign (resid 17 and name HA) (resid 19 and name HN) 0 -3.00 4.04 assign (resid 17 and name HB1) (resid 18 and name HN) 0 -3.26 5.35 assign (resid 17 and name HB2) (resid 18 and name HN) 0 -3.26 5.35 assign (resid 17 and name HB#) (resid 18 and name HN) 0 -3.22 4.92 assign (resid 17 and name HD#) (resid 18 and name HN) 0 -2.90 8.74 !18 THR assign (resid 18 and name HN) (resid 19 and name HN) 0 -2.54 3.43 assign (resid 18 and name HA) (resid 19 and name HN) 0 -2.89 200.00 assign (resid 18 and name HB) (resid 45 and name HD#) 0 -2.50 6.01 assign (resid 18 and name HB) (resid 45 and name HE) 0 -3.97 6.31 assign (resid 18 and name HG2#) (resid 19 and name HN) 0 -2.90 6.94 assign (resid 18 and name HG2#) (resid 45 and name HD#) 0 -1.78 8.36 assign (resid 18 and name HG2#) (resid 45 and name HD1) 0 -2.90 200.00 assign (resid 18 and name HG2#) (resid 45 and name HD2) 0 -2.90 200.00 assign (resid 18 and name HG2#) (resid 45 and name HE) 0 -2.90 200.00 !19 GLY assign (resid 19 and name HN) (resid 20 and name HN) 0 -4.00 5.70 assign (resid 19 and name HA1) (resid 45 and name HG#) 0 -0.88 7.33 assign (resid 19 and name HA2) (resid 45 and name HG#) 0 -0.88 7.33 assign (resid 19 and name HA#) (resid 45 and name CG) 0 -1.78 6.65 !20 THR assign (resid 20 and name HN) (resid 20 and name HG2#) 0 -2.90 200.00 assign (resid 20 and name HN) (resid 21 and name HN) 0 -4.00 200.00 assign (resid 20 and name HN) (resid 30 and name HE3) 0 -4.00 6.56 assign (resid 20 and name HN) (resid 30 and name HZ3) 0 -3.04 5.12 assign (resid 20 and name HN) (resid 44 and name HN) 0 -2.74 3.58 assign (resid 20 and name HN) (resid 44 and name HA) 0 -4.00 5.87 assign (resid 20 and name HN) (resid 45 and name HA) 0 -4.00 200.00 assign (resid 20 and name HN) (resid 45 and name CG) 0 -2.52 6.40 assign (resid 20 and name HN) (resid 45 and name HG#) 0 -2.71 6.21 assign (resid 20 and name HB) (resid 21 and name HN) 0 -4.00 200.00 assign (resid 20 and name HB) (resid 30 and name HE3) 0 -3.42 5.25 assign (resid 20 and name HB) (resid 30 and name HZ3) 0 -1.78 2.66 assign (resid 20 and name HB) (resid 30 and name HZ2) 0 -4.00 6.39 assign (resid 20 and name HB) (resid 45 and name HA) 0 -3.94 4.97 assign (resid 20 and name HG2#) (resid 21 and name HN) 0 -1.59 5.40 assign (resid 20 and name HG2#) (resid 22 and name HN) 0 -2.90 8.84 assign (resid 20 and name HG2#) (resid 30 and name HZ2) 0 -2.90 8.25 !21 VAL assign (resid 21 and name HN) (resid 21 and name HA) 0 -2.56 200.00 assign (resid 21 and name HN) (resid 21 and name HB) 0 -1.78 2.65 assign (resid 21 and name HN) (resid 22 and name HN) 0 -4.00 5.39 assign (resid 21 and name HN) (resid 37 and name HE#) 0 -1.80 9.28 assign (resid 21 and name HN) (resid 37 and name CZ) 0 -1.78 9.28 assign (resid 21 and name HA) (resid 22 and name HN) 0 -1.78 2.49 assign (resid 21 and name HA) (resid 37 and name CG) 0 -1.78 8.69 assign (resid 21 and name HA) (resid 37 and name HD#) 0 -1.80 8.69 assign (resid 21 and name HA) (resid 37 and name HE#) 0 -1.80 7.93 assign (resid 21 and name HA) (resid 37 and name CZ) 0 -1.78 7.93 assign (resid 21 and name HA) (resid 44 and name HN) 0 -3.03 4.18 assign (resid 21 and name HB) (resid 37 and name HE#) 0 -1.80 7.64 assign (resid 21 and name HB) (resid 37 and name CZ) 0 -1.78 7.64 assign (resid 21 and name HG1#) (resid 22 and name HN) 0 -1.78 6.60 assign (resid 21 and name HG1#) (resid 37 and name HD#) 0 -1.78 8.79 assign (resid 21 and name HG1#) (resid 37 and name HE#) 0 -1.78 7.36 assign (resid 21 and name HG2#) (resid 22 and name HN) 0 -1.78 6.60 assign (resid 21 and name HG2#) (resid 37 and name HD#) 0 -1.78 8.79 assign (resid 21 and name HG2#) (resid 37 and name HE#) 0 -1.78 7.36 assign (resid 21 and name HG#) (resid 22 and name HN) 0 -1.83 5.61 assign (resid 21 and name HG#) (resid 23 and name HN) 0 -1.33 9.11 assign (resid 21 and name HG#) (resid 37 and name HD#) 0 -1.78 8.38 assign (resid 21 and name HG#) (resid 37 and name HE#) 0 -1.78 6.88 assign (resid 21 and name HG#) (resid 41 and name HB#) 0 -1.78 7.34 assign (resid 21 and name HG#) (resid 43 and name HB#) 0 -1.78 9.81 !22 ASP assign (resid 22 and name HN) (resid 23 and name HN) 0 -4.00 200.00 assign (resid 22 and name HN) (resid 37 and name HE#) 0 -1.80 8.87 assign (resid 22 and name HN) (resid 37 and name CZ) 0 -1.80 8.87 assign (resid 22 and name HN) (resid 41 and name HB#) 0 -2.42 6.45 assign (resid 22 and name HN) (resid 42 and name HB#) 0 -3.12 6.75 assign (resid 22 and name HB#) (resid 25 and name HN) 0 -2.63 5.71 assign (resid 22 and name HB#) (resid 41 and name HB#) 0 -2.02 9.17 !23 LEU assign (resid 23 and name HN) (resid 23 and name HA) 0 -2.34 200.00 assign (resid 23 and name HN) (resid 24 and name HN) 0 -4.00 5.63 assign (resid 23 and name HN) (resid 41 and name HB#) 0 -2.90 7.28 assign (resid 23 and name HA) (resid 24 and name HN) 0 -1.78 2.44 assign (resid 23 and name HA) (resid 24 and name HA#) 0 -2.80 5.91 assign (resid 23 and name HA) (resid 41 and name HB#) 0 -1.80 4.96 assign (resid 23 and name HD#) (resid 37 and name HE#) 0 -1.78 11.53 assign (resid 23 and name HD#) (resid 37 and name CZ) 0 -1.78 11.53 !24 GLY assign (resid 24 and name HN) (resid 25 and name HN) 0 -3.12 4.17 assign (resid 24 and name HA1) (resid 25 and name HN) 0 -2.29 200.00 assign (resid 24 and name HA2) (resid 25 and name HN) 0 -2.29 200.00 !25 SER assign (resid 25 and name HN) (resid 26 and name HN) 0 -3.76 4.84 assign (resid 25 and name HB1) (resid 26 and name HN) 0 -2.74 5.15 assign (resid 25 and name HB2) (resid 26 and name HN) 0 -2.74 5.15 assign (resid 25 and name HB#) (resid 26 and name HN) 0 -2.97 4.39 !26 CYS assign (resid 26 and name HB#) (resid 30 and name HB#) 0 -1.68 5.30 assign (resid 26 and name HB#) (resid 31 and name HN) 0 -3.12 7.87 assign (resid 26 and name HB#) (resid 45 and name HN) 0 -3.12 7.35 !27 ASN assign (resid 27 and name HN) (resid 27 and name HA) 0 -2.76 200.00 assign (resid 27 and name HN) (resid 27 and name HB#) 0 -1.78 3.51 assign (resid 27 and name HN) (resid 27 and name HD21) 0 -3.96 6.68 assign (resid 27 and name HN) (resid 27 and name HD22) 0 -3.96 6.68 assign (resid 27 and name HN) (resid 27 and name HD2#) 0 -1.78 6.34 assign (resid 27 and name HN) (resid 28 and name HN) 0 -4.00 5.64 assign (resid 27 and name HN) (resid 30 and name HN) 0 -4.00 6.43 assign (resid 27 and name HN) (resid 30 and name HB#) 0 -2.35 5.45 assign (resid 27 and name HN) (resid 30 and name HD1) 0 -4.00 200.00 assign (resid 27 and name HB1) (resid 30 and name HD1) 0 -2.84 200.00 assign (resid 27 and name HB2) (resid 30 and name HD1) 0 -2.84 200.00 assign (resid 27 and name HA) (resid 28 and name HN) 0 -1.78 2.84 assign (resid 27 and name HB1) (resid 28 and name HN) 0 -2.16 4.56 assign (resid 27 and name HB1) (resid 30 and name HE1) 0 -3.26 5.32 assign (resid 27 and name HB2) (resid 28 and name HN) 0 -2.16 4.56 assign (resid 27 and name HB2) (resid 30 and name HE1) 0 -3.26 5.32 assign (resid 27 and name HB#) (resid 27 and name HD2#) 0 -2.97 200.00 assign (resid 27 and name HB#) (resid 28 and name HN) 0 -2.72 3.74 assign (resid 27 and name HB#) (resid 30 and name HN) 0 -3.12 6.68 assign (resid 27 and name HB#) (resid 30 and name HD1) 0 -2.26 5.08 assign (resid 27 and name HB#) (resid 30 and name HE1) 0 -3.40 4.79 assign (resid 27 and name HD2#) (resid 30 and name HD1) 0 -3.13 7.18 !28 ALA assign (resid 28 and name HN) (resid 28 and name HA) 0 -2.61 200.00 assign (resid 28 and name HN) (resid 29 and name HN) 0 -4.00 5.71 assign (resid 28 and name HN) (resid 30 and name HD1) 0 -3.95 5.53 assign (resid 28 and name HA) (resid 29 and name HN) 0 -1.78 2.62 assign (resid 28 and name HA) (resid 30 and name HN) 0 -2.89 3.98 assign (resid 28 and name HA) (resid 30 and name HD1) 0 -4.00 5.91 assign (resid 28 and name HB#) (resid 29 and name HA#) 0 -1.92 7.46 assign (resid 28 and name HB#) (resid 30 and name HD1) 0 -2.90 7.00 !29 GLY assign (resid 29 and name HN) (resid 29 and name HA1) 0 -2.33 200.00 assign (resid 29 and name HN) (resid 29 and name HA2) 0 -2.33 200.00 assign (resid 29 and name HN) (resid 29 and name HA#) 0 -2.35 200.00 assign (resid 29 and name HN) (resid 30 and name HN) 0 -2.36 3.00 assign (resid 29 and name HN) (resid 30 and name HB#) 0 -3.12 8.00 assign (resid 29 and name HN) (resid 30 and name HD1) 0 -4.00 5.70 assign (resid 29 and name HN) (resid 30 and name HE1) 0 -4.00 200.00 assign (resid 29 and name HA1) (resid 47 and name HD#) 0 -0.88 7.46 assign (resid 29 and name HA2) (resid 47 and name HD#) 0 -0.88 7.46 assign (resid 29 and name HA#) (resid 47 and name CD) 0 -1.78 6.78 !30 TRP assign (resid 30 and name HN) (resid 30 and name HD1) 0 -2.47 3.20 assign (resid 30 and name HN) (resid 30 and name HE1) 0 -4.00 6.24 assign (resid 30 and name HN) (resid 31 and name HN) 0 -4.00 5.73 assign (resid 30 and name HB1) (resid 31 and name HN) 0 -2.20 4.39 assign (resid 30 and name HB2) (resid 31 and name HN) 0 -2.20 4.39 assign (resid 30 and name HB#) (resid 31 and name HN) 0 -2.38 3.99 assign (resid 30 and name HB#) (resid 44 and name HA) 0 -3.12 7.14 assign (resid 30 and name HB#) (resid 45 and name HN) 0 -2.88 6.65 assign (resid 30 and name HB#) (resid 46 and name HA) 0 -2.64 6.25 assign (resid 30 and name HD1) (resid 31 and name HN) 0 -4.00 6.94 assign (resid 30 and name HE3) (resid 31 and name HN) 0 -3.58 5.34 assign (resid 30 and name HE3) (resid 44 and name HN) 0 -4.00 200.00 assign (resid 30 and name HE3) (resid 44 and name HA) 0 -3.77 5.21 assign (resid 30 and name HE3) (resid 45 and name HN) 0 -2.89 3.88 assign (resid 30 and name HE3) (resid 45 and name HA) 0 -2.51 3.32 assign (resid 30 and name HE3) (resid 46 and name HN) 0 -2.56 3.62 assign (resid 30 and name HE3) (resid 46 and name HA) 0 -2.75 3.78 assign (resid 30 and name HE3) (resid 46 and name HB#) 0 -3.12 6.01 assign (resid 30 and name HE1) (resid 46 and name HN) 0 -4.00 7.13 assign (resid 30 and name HE1) (resid 46 and name HA) 0 -4.00 6.17 assign (resid 30 and name HE1) (resid 46 and name HB1) 0 -4.00 6.91 assign (resid 30 and name HE1) (resid 46 and name HB2) 0 -4.00 6.91 assign (resid 30 and name HE1) (resid 46 and name HB#) 0 -1.78 6.67 assign (resid 30 and name HE1) (resid 46 and name HG1) 0 -3.54 6.55 assign (resid 30 and name HE1) (resid 46 and name HG2) 0 -3.54 6.55 assign (resid 30 and name HE1) (resid 46 and name HG#) 0 -1.78 6.28 assign (resid 30 and name HE1) (resid 46 and name CE) 0 -2.35 6.60 assign (resid 30 and name HE1) (resid 46 and name HE#) 0 -2.54 6.41 assign (resid 30 and name HE1) (resid 47 and name HN) 0 -4.00 7.16 assign (resid 30 and name HZ3) (resid 44 and name HN) 0 -4.00 200.00 assign (resid 30 and name HZ3) (resid 44 and name HA) 0 -4.00 6.84 assign (resid 30 and name HZ3) (resid 45 and name HN) 0 -4.00 5.95 assign (resid 30 and name HZ3) (resid 45 and name HA) 0 -2.39 3.52 assign (resid 30 and name HZ3) (resid 45 and name HD#) 0 -3.12 7.14 assign (resid 30 and name HZ3) (resid 46 and name HN) 0 -2.40 3.17 assign (resid 30 and name HZ3) (resid 46 and name HA) 0 -3.45 4.86 assign (resid 30 and name HZ2) (resid 46 and name HN) 0 -4.00 5.89 assign (resid 30 and name HZ2) (resid 46 and name HB#) 0 -2.68 6.38 assign (resid 30 and name HZ2) (resid 46 and name HG1) 0 -3.54 6.64 assign (resid 30 and name HZ2) (resid 46 and name HG2) 0 -3.54 6.64 assign (resid 30 and name HZ2) (resid 46 and name HG#) 0 -3.67 200.00 assign (resid 30 and name HZ2) (resid 46 and name CD) 0 -1.78 6.21 assign (resid 30 and name HZ2) (resid 46 and name HD#) 0 -1.79 6.02 !31 GLU assign (resid 31 and name HN) (resid 31 and name HB#) 0 -2.33 200.00 assign (resid 31 and name HN) (resid 31 and name HG#) 0 -2.00 5.08 assign (resid 31 and name HN) (resid 32 and name HN) 0 -4.00 200.00 assign (resid 31 and name HN) (resid 44 and name HA) 0 -3.85 5.16 assign (resid 31 and name HN) (resid 45 and name HN) 0 -2.48 3.20 assign (resid 31 and name HN) (resid 46 and name HA) 0 -3.30 4.78 assign (resid 31 and name HN) (resid 47 and name HN) 0 -3.26 4.54 assign (resid 31 and name HN) (resid 47 and name HG1) 0 -3.44 6.43 assign (resid 31 and name HN) (resid 47 and name HG2) 0 -3.44 6.43 assign (resid 31 and name HN) (resid 47 and name HG#) 0 -3.63 5.79 assign (resid 31 and name HB#) (resid 32 and name HN) 0 -2.29 200.00 assign (resid 31 and name HG#) (resid 32 and name HN) 0 -3.12 6.78 assign (resid 31 and name HG#) (resid 45 and name HN) 0 -2.74 6.26 assign (resid 31 and name HG#) (resid 47 and name HA) 0 -2.30 5.35 assign (resid 31 and name HG#) (resid 47 and name HG#) 0 -1.82 7.39 !32 LYS assign (resid 32 and name HN) (resid 32 and name HA) 0 -2.44 200.00 assign (resid 32 and name HN) (resid 32 and name HB#) 0 -1.78 3.79 assign (resid 32 and name HN) (resid 33 and name HN) 0 -3.64 5.35 assign (resid 32 and name HN) (resid 44 and name HA) 0 -4.00 5.84 assign (resid 32 and name HA) (resid 33 and name HN) 0 -1.78 2.42 assign (resid 32 and name HA) (resid 33 and name HA) 0 -3.87 5.11 assign (resid 32 and name HA) (resid 34 and name HN) 0 -3.12 4.57 assign (resid 32 and name HA) (resid 42 and name HB#) 0 -3.12 6.64 assign (resid 32 and name HA) (resid 44 and name HA) 0 -2.09 2.78 assign (resid 32 and name HA) (resid 44 and name HB#) 0 -3.12 7.14 assign (resid 32 and name HB#) (resid 34 and name HN) 0 -2.66 6.42 assign (resid 32 and name HG1) (resid 33 and name HA) 0 -3.50 5.58 assign (resid 32 and name HG1) (resid 44 and name HA) 0 -4.00 7.01 assign (resid 32 and name HG2) (resid 33 and name HA) 0 -3.50 5.58 assign (resid 32 and name HG2) (resid 44 and name HA) 0 -4.00 7.01 assign (resid 32 and name HG#) (resid 33 and name HN) 0 -2.53 6.22 assign (resid 32 and name HG#) (resid 33 and name HA) 0 -1.78 5.33 assign (resid 32 and name HG#) (resid 34 and name HN) 0 -2.42 6.19 assign (resid 32 and name HG#) (resid 42 and name HB#) 0 -1.90 7.65 assign (resid 32 and name HG#) (resid 44 and name HA) 0 -1.78 6.51 assign (resid 32 and name HD1) (resid 42 and name HB1) 0 -1.78 8.71 assign (resid 32 and name HD1) (resid 42 and name HB2) 0 -1.78 8.71 assign (resid 32 and name HD2) (resid 42 and name HB1) 0 -1.78 8.71 assign (resid 32 and name HD2) (resid 42 and name HB2) 0 -1.78 8.71 assign (resid 32 and name HD#) (resid 42 and name HB#) 0 -2.35 7.17 assign (resid 32 and name HE1) (resid 35 and name HA) 0 -2.85 5.31 assign (resid 32 and name HE2) (resid 35 and name HA) 0 -2.85 5.31 assign (resid 32 and name HE#) (resid 35 and name HA) 0 -2.92 200.00 !33 CYS assign (resid 33 and name HN) (resid 33 and name HA) 0 -2.79 200.00 assign (resid 33 and name HN) (resid 34 and name HN) 0 -2.01 2.71 assign (resid 33 and name HN) (resid 43 and name HB#) 0 -2.76 6.03 assign (resid 33 and name HA) (resid 34 and name HN) 0 -2.94 200.00 assign (resid 33 and name HA) (resid 44 and name HA) 0 -4.00 6.33 assign (resid 33 and name HA) (resid 45 and name HB#) 0 -3.12 6.53 assign (resid 33 and name HB#) (resid 34 and name HN) 0 -2.98 6.09 assign (resid 33 and name HB#) (resid 44 and name HA) 0 -2.55 5.36 !34 ALA assign (resid 34 and name HN) (resid 35 and name HN) 0 -4.00 5.48 assign (resid 34 and name HN) (resid 43 and name HN) 0 -4.00 6.01 assign (resid 34 and name HN) (resid 43 and name HB1) 0 -3.09 200.00 assign (resid 34 and name HN) (resid 43 and name HB2) 0 -3.09 200.00 assign (resid 34 and name HN) (resid 43 and name HB#) 0 -3.47 5.12 assign (resid 34 and name HN) (resid 44 and name HA) 0 -4.00 5.46 assign (resid 34 and name HB#) (resid 35 and name HN) 0 -2.47 200.00 assign (resid 34 and name HB#) (resid 37 and name HB#) 0 -1.98 7.78 assign (resid 34 and name HB#) (resid 37 and name CG) 0 -0.59 8.97 assign (resid 34 and name HB#) (resid 37 and name HD#) 0 -1.89 7.67 assign (resid 34 and name HB#) (resid 43 and name HB#) 0 -1.78 5.17 !35 SER assign (resid 35 and name HN) (resid 35 and name HA) 0 -2.56 200.00 assign (resid 35 and name HN) (resid 35 and name HB2) 0 -1.24 3.80 assign (resid 35 and name HN) (resid 36 and name HN) 0 -2.67 4.24 !36 TYR assign (resid 36 and name HN) (resid 36 and name HB#) 0 -1.78 3.67 assign (resid 36 and name HA) (resid 36 and name HD#) 0 -1.78 5.86 assign (resid 36 and name HB1) (resid 36 and name HE#) 0 -1.78 7.58 assign (resid 36 and name HB2) (resid 36 and name HE#) 0 -1.78 7.58 assign (resid 36 and name HB#) (resid 36 and name HD#) 0 -1.78 5.31 assign (resid 36 and name HB#) (resid 36 and name HE#) 0 -1.78 7.40 assign (resid 36 and name HB#) (resid 36 and name HD#) 0 -1.78 5.31 assign (resid 36 and name CG) (resid 39 and name HN) 0 -1.78 8.69 assign (resid 36 and name CG) (resid 39 and name HA) 0 -1.78 8.86 assign (resid 36 and name HD#) (resid 39 and name HN) 0 -1.78 8.69 assign (resid 36 and name HD#) (resid 39 and name HA) 0 -1.78 6.66 assign (resid 36 and name HE#) (resid 37 and name HN) 0 -1.78 200.00 assign (resid 36 and name HE#) (resid 39 and name HN) 0 -1.78 7.53 assign (resid 36 and name HE#) (resid 39 and name HA) 0 -1.78 6.04 assign (resid 36 and name HE#) (resid 39 and name HB) 0 -1.78 8.36 assign (resid 36 and name HE#) (resid 39 and name HG1#) 0 -1.78 9.32 assign (resid 36 and name HE#) (resid 39 and name HD1#) 0 -1.78 9.78 assign (resid 36 and name CZ) (resid 39 and name HN) 0 -1.78 7.53 assign (resid 36 and name CZ) (resid 39 and name HA) 0 -1.78 6.04 assign (resid 36 and name CZ) (resid 39 and name HB) 0 -1.78 8.36 assign (resid 36 and name CZ) (resid 39 and name HG1#) 0 -1.78 9.32 assign (resid 36 and name CZ) (resid 39 and name HD1#) 0 -1.78 9.78 !37 TYR assign (resid 37 and name HN) (resid 38 and name HN) 0 -2.76 3.80 assign (resid 37 and name HN) (resid 38 and name HG2#) 0 -2.90 200.00 assign (resid 37 and name HN) (resid 42 and name HA) 0 -4.00 200.00 assign (resid 37 and name HB1) (resid 38 and name HN) 0 -2.02 4.39 assign (resid 37 and name HB1) (resid 43 and name HB1) 0 -1.78 6.50 assign (resid 37 and name HB1) (resid 43 and name HB2) 0 -1.78 6.50 assign (resid 37 and name HB2) (resid 38 and name HN) 0 -2.02 4.39 assign (resid 37 and name HB2) (resid 43 and name HB1) 0 -1.78 6.50 assign (resid 37 and name HB2) (resid 43 and name HB2) 0 -1.78 6.50 assign (resid 37 and name HB#) (resid 37 and name HD#) 0 -1.78 5.55 assign (resid 37 and name HB#) (resid 38 and name HN) 0 -2.49 3.56 assign (resid 37 and name HB#) (resid 38 and name HG2#) 0 -1.78 8.44 assign (resid 37 and name HB1) (resid 38 and name HG2#) 0 -2.90 200.00 assign (resid 37 and name HB2) (resid 38 and name HG2#) 0 -2.90 200.00 assign (resid 37 and name HB#) (resid 42 and name HB#) 0 -2.45 7.85 assign (resid 37 and name HB#) (resid 43 and name HN) 0 -2.35 5.20 assign (resid 37 and name HB#) (resid 43 and name HB#) 0 -2.19 5.14 assign (resid 37 and name CG) (resid 42 and name HN) 0 -1.78 7.70 assign (resid 37 and name CG) (resid 42 and name HA) 0 -1.78 6.97 assign (resid 37 and name CG) (resid 42 and name HB#) 0 -1.78 9.20 assign (resid 37 and name CG) (resid 43 and name HN) 0 -1.78 7.48 assign (resid 37 and name CG) (resid 43 and name HB#) 0 -1.78 6.69 assign (resid 37 and name HD#) (resid 38 and name HG2#) 0 -1.78 7.68 assign (resid 37 and name HD#) (resid 41 and name HB#) 0 -1.78 6.51 assign (resid 37 and name HD#) (resid 42 and name HN) 0 -1.78 5.50 assign (resid 37 and name HD#) (resid 42 and name HA) 0 -1.78 4.77 assign (resid 37 and name HD#) (resid 42 and name HB#) 0 -1.78 7.00 assign (resid 37 and name HD#) (resid 43 and name HN) 0 -1.78 5.28 assign (resid 37 and name HD#) (resid 43 and name HB#) 0 -1.78 4.49 assign (resid 37 and name HE#) (resid 38 and name HG2#) 0 -1.78 5.00 assign (resid 37 and name HE#) (resid 41 and name HB#) 0 -1.78 5.41 assign (resid 37 and name HE#) (resid 42 and name HA) 0 -1.78 7.16 assign (resid 37 and name HE#) (resid 43 and name HN) 0 -1.78 7.51 assign (resid 37 and name HE#) (resid 43 and name HB#) 0 -1.78 5.66 assign (resid 37 and name CZ) (resid 42 and name HA) 0 -1.78 9.36 assign (resid 37 and name CZ) (resid 43 and name HN) 0 -1.78 9.71 assign (resid 37 and name CZ) (resid 43 and name HB#) 0 -1.78 7.86 !38 THR assign (resid 38 and name HN) (resid 38 and name HA) 0 -2.71 200.00 assign (resid 38 and name HN) (resid 38 and name HG2#) 0 -2.16 200.00 assign (resid 38 and name HN) (resid 39 and name HN) 0 -3.56 4.64 assign (resid 38 and name HN) (resid 42 and name HN) 0 -4.00 6.03 assign (resid 38 and name HN) (resid 42 and name HA) 0 -4.00 5.75 assign (resid 38 and name HN) (resid 43 and name HN) 0 -4.00 6.76 assign (resid 38 and name HN) (resid 43 and name HB#) 0 -1.78 7.68 assign (resid 38 and name HN) (resid 43 and name HB1) 0 -4.00 200.00 assign (resid 38 and name HN) (resid 43 and name HB2) 0 -4.00 200.00 assign (resid 38 and name HB) (resid 40 and name HN) 0 -3.28 4.24 assign (resid 38 and name HG2#) (resid 39 and name HN) 0 -2.90 200.00 assign (resid 38 and name HG2#) (resid 39 and name HA) 0 -2.90 200.00 assign (resid 38 and name HG2#) (resid 39 and name HB) 0 -2.90 200.00 assign (resid 38 and name HG2#) (resid 40 and name HN) 0 -2.85 200.00 assign (resid 38 and name HG2#) (resid 40 and name HB) 0 -2.90 200.00 !39 ILE assign (resid 39 and name HN) (resid 39 and name HA) 0 -2.43 200.00 assign (resid 39 and name HN) (resid 39 and name HG2#) 0 -1.78 4.57 assign (resid 39 and name HN) (resid 39 and name HG1#) 0 -2.09 3.76 assign (resid 39 and name HN) (resid 40 and name HN) 0 -2.43 3.15 assign (resid 39 and name HN) (resid 40 and name HD1#) 0 -2.90 200.00 assign (resid 39 and name HN) (resid 41 and name HN) 0 -3.72 5.23 assign (resid 39 and name HA) (resid 40 and name HN) 0 -3.00 200.00 assign (resid 39 and name HB) (resid 40 and name HN) 0 -3.39 4.49 assign (resid 39 and name HG1#) (resid 40 and name HN) 0 -3.10 6.39 !40 ILE assign (resid 40 and name HN) (resid 40 and name HB) 0 -2.99 4.05 assign (resid 40 and name HN) (resid 40 and name HG1#) 0 -1.85 5.24 assign (resid 40 and name HN) (resid 41 and name HN) 0 -2.06 2.70 assign (resid 40 and name HB) (resid 41 and name HN) 0 -3.43 4.83 assign (resid 40 and name HG2#) (resid 41 and name HN) 0 -2.79 4.83 !41 ALA assign (resid 41 and name HB#) (resid 42 and name HA) 0 -2.90 7.22 !42 ASP assign (resid 42 and name HN) (resid 42 and name HA) 0 -2.86 200.00 assign (resid 42 and name HA) (resid 42 and name HB1) 0 -2.28 200.00 assign (resid 42 and name HA) (resid 42 and name HB2) 0 -2.28 200.00 assign (resid 42 and name HA) (resid 42 and name HB#) 0 -2.43 200.00 assign (resid 42 and name HA) (resid 43 and name HN) 0 -2.40 3.39 assign (resid 42 and name HA) (resid 43 and name HB1) 0 -3.41 5.60 assign (resid 42 and name HA) (resid 43 and name HB2) 0 -3.41 5.60 assign (resid 42 and name HA) (resid 43 and name HB#) 0 -3.52 5.42 assign (resid 42 and name HB#) (resid 43 and name HN) 0 -1.89 4.16 assign (resid 42 and name HB#) (resid 44 and name HA) 0 -3.12 7.29 !43 CYS assign (resid 43 and name HN) (resid 43 and name HB#) 0 -1.78 3.90 assign (resid 43 and name HN) (resid 44 and name HA) 0 -4.00 6.17 !45 ARG assign (resid 45 and name HN) (resid 45 and name HA) 0 -2.97 200.00 assign (resid 45 and name HN) (resid 46 and name HN) 0 -3.93 5.24 assign (resid 45 and name HN) (resid 46 and name HA) 0 -4.00 5.60 assign (resid 45 and name HA) (resid 45 and name HD1) 0 -4.00 200.00 assign (resid 45 and name HA) (resid 45 and name HD2) 0 -4.00 200.00 assign (resid 45 and name HA) (resid 46 and name HB1) 0 -4.00 200.00 assign (resid 45 and name HA) (resid 46 and name HB2) 0 -4.00 200.00 assign (resid 45 and name HA) (resid 45 and name HG#) 0 -0.88 3.84 assign (resid 45 and name HA) (resid 45 and name HG2) 0 -1.78 2.94 assign (resid 45 and name HA) (resid 46 and name HB#) 0 -1.78 7.54 assign (resid 45 and name HB#) (resid 45 and name HE) 0 -1.90 4.56 assign (resid 45 and name HD#) (resid 46 and name HN) 0 -2.46 5.09 !46 LYS assign (resid 46 and name HA) (resid 46 and name HG1) 0 -2.52 200.00 assign (resid 46 and name HA) (resid 46 and name HG2) 0 -2.52 200.00 assign (resid 46 and name HA) (resid 46 and name HG#) 0 -2.52 200.00 assign (resid 46 and name HN) (resid 46 and name HB#) 0 -1.78 3.71 assign (resid 46 and name HA) (resid 46 and name HD#) 0 -2.09 5.80 assign (resid 46 and name HA) (resid 47 and name HA) 0 -3.91 5.68 assign (resid 46 and name HA) (resid 47 and name HG#) 0 -3.12 7.32 assign (resid 46 and name HA) (resid 48 and name HN) 0 -4.00 200.00 assign (resid 46 and name HB1) (resid 46 and name HE#) 0 -1.35 200.00 assign (resid 46 and name HB2) (resid 46 and name HE#) 0 -1.35 200.00 assign (resid 46 and name HB#) (resid 46 and name CE) 0 -2.52 200.00 !47 LYS assign (resid 47 and name HA) (resid 47 and name HG1) 0 -2.21 4.12 assign (resid 47 and name HA) (resid 47 and name HG2) 0 -2.21 4.12 assign (resid 47 and name HA) (resid 47 and name HG#) 0 -2.26 3.63 assign (resid 47 and name HA) (resid 47 and name CE) 0 -2.91 7.40 assign (resid 47 and name HA) (resid 47 and name HE#) 0 -3.10 7.21 assign (resid 47 and name HG1) (resid 47 and name HE#) 0 -2.10 200.00 assign (resid 47 and name HG2) (resid 47 and name HE#) 0 -2.10 200.00 assign (resid 47 and name HA) (resid 48 and name HN) 0 -1.78 2.52 assign (resid 47 and name HG1) (resid 48 and name HN) 0 -3.29 6.17 assign (resid 47 and name HG2) (resid 48 and name HN) 0 -3.29 6.17 assign (resid 47 and name HG#) (resid 48 and name HN) 0 -3.56 5.37 !48 LYS assign (resid 48 and name HN) (resid 48 and name HA) 0 -2.43 200.00 assign (resid 48 and name HN) (resid 48 and name H1) 0 -2.77 6.27 assign (resid 48 and name HA) (resid 48 and name H1) 0 -1.78 4.43 assign (resid 48 and name HA) (resid 48 and name H2) 0 -2.38 5.39 assign (resid 48 and name H1) (resid 48 and name H2) 0 -1.78 2.90 !1 ALA assign (resid 1 and name HB#) (resid 21 and name HN) 0 -1.78 6.10 assign (resid 1 and name HB#) (resid 21 and name HG#) 0 -1.78 8.76 assign (resid 1 and name HB#) (resid 37 and name HE#) 0 -1.78 8.30 assign (resid 1 and name HB#) (resid 37 and name CZ) 0 -1.78 8.30 assign (resid 1 and name HB#) (resid 38 and name HG2#) 0 -1.78 7.20 !2 ALA assign (resid 2 and name HN) (resid 20 and name HG2#) 0 -1.78 6.10 assign (resid 2 and name HA) (resid 20 and name HG2#) 0 -1.78 6.10 assign (resid 2 and name HA) (resid 21 and name HN) 0 -1.78 5.00 assign (resid 2 and name HB#) (resid 17 and name HA) 0 -1.78 6.10 assign (resid 2 and name HB#) (resid 17 and name HD1#) 0 -1.78 7.20 assign (resid 2 and name HB#) (resid 17 and name HD2#) 0 -1.78 7.20 !3 CYS assign (resid 3 and name HN) (resid 17 and name HB#) 0 -1.78 5.88 assign (resid 3 and name HN) (resid 21 and name HG#) 0 -1.78 7.66 assign (resid 3 and name HB1) (resid 21 and name HG1#) 0 -1.78 7.85 assign (resid 3 and name HB1) (resid 21 and name HG2#) 0 -1.78 7.85 assign (resid 3 and name HB2) (resid 21 and name HG1#) 0 -1.78 7.85 assign (resid 3 and name HB2) (resid 21 and name HG2#) 0 -1.78 7.85 assign (resid 3 and name HB#) (resid 4 and name HN) 0 -1.78 5.88 assign (resid 3 and name HB#) (resid 21 and name HN) 0 -1.78 5.88 assign (resid 3 and name HB#) (resid 21 and name HA) 0 -1.78 5.88 assign (resid 3 and name HB#) (resid 21 and name HG#) 0 -1.78 6.33 !4 LYS assign (resid 4 and name HN) (resid 17 and name HB#) 0 -1.78 5.88 assign (resid 4 and name HA) (resid 17 and name HA) 0 -1.78 5.00 assign (resid 4 and name HA) (resid 18 and name HN) 0 -1.78 5.00 assign (resid 4 and name HA) (resid 18 and name HG2#) 0 -1.78 6.10 assign (resid 4 and name HA) (resid 19 and name HN) 0 -1.78 5.00 assign (resid 4 and name CB) (resid 8 and name HN) 0 -1.78 6.09 assign (resid 4 and name HB#) (resid 4 and name HE#) 0 -1.78 6.78 assign (resid 4 and name HB#) (resid 8 and name HN) 0 -1.78 5.90 assign (resid 4 and name CG) (resid 8 and name HN) 0 -1.78 6.09 assign (resid 4 and name CG) (resid 17 and name HN) 0 -1.78 6.09 assign (resid 4 and name CG) (resid 17 and name HA) 0 -1.78 6.09 assign (resid 4 and name HG#) (resid 8 and name HN) 0 -1.78 5.90 assign (resid 4 and name HG#) (resid 17 and name HN) 0 -1.78 5.90 assign (resid 4 and name HG#) (resid 17 and name HA) 0 -1.78 5.90 assign (resid 4 and name CD) (resid 16 and name HD#) 0 -1.78 6.97 assign (resid 4 and name HD#) (resid 16 and name HD#) 0 -1.78 6.78 !5 CYS assign (resid 5 and name HN) (resid 8 and name HG1) 0 -1.78 5.00 assign (resid 5 and name HN) (resid 8 and name HG2) 0 -1.78 5.00 assign (resid 5 and name HB1) (resid 8 and name HN) 0 -1.78 5.00 assign (resid 5 and name HB2) (resid 8 and name HN) 0 -1.78 5.00 assign (resid 5 and name HB#) (resid 6 and name HN) 0 -1.78 5.88 assign (resid 5 and name HB#) (resid 7 and name HN) 0 -1.78 5.88 assign (resid 5 and name HB#) (resid 8 and name HG#) 0 -1.78 6.75 !6 ASP assign (resid 6 and name HN) (resid 33 and name HB#) 0 -1.78 5.88 assign (resid 6 and name HN) (resid 34 and name HB#) 0 -1.78 6.10 assign (resid 6 and name HB#) (resid 34 and name HB#) 0 -1.78 6.98 !7 ASP assign (resid 7 and name HN) (resid 8 and name HB#) 0 -1.78 5.88 assign (resid 7 and name HN) (resid 8 and name HG1) 0 -1.78 5.00 assign (resid 7 and name HN) (resid 8 and name HG2) 0 -1.78 5.00 !8 GLU assign (resid 8 and name HN) (resid 8 and name HG#) 0 -1.78 5.88 assign (resid 8 and name HB#) (resid 15 and name HB#) 0 -1.78 6.98 assign (resid 8 and name HG#) (resid 18 and name HG2#) 0 -1.78 6.98 !9 GLY assign (resid 9 and name HA#) (resid 11 and name HN) 0 -1.78 5.88 !10 PRO assign (resid 10 and name HG#) (resid 11 and name HN) 0 -1.78 5.37 !11 ASP assign (resid 11 and name HN) (resid 12 and name HN) 0 -1.78 5.00 assign (resid 11 and name HB1) (resid 13 and name HN) 0 -1.78 5.00 assign (resid 11 and name HB2) (resid 13 and name HN) 0 -1.78 5.00 !12 ILE assign (resid 12 and name HN) (resid 12 and name HG1#) 0 -1.78 5.90 assign (resid 12 and name HG2#) (resid 13 and name HN) 0 -1.78 6.10 assign (resid 12 and name HG2#) (resid 13 and name CG) 0 -1.78 7.19 assign (resid 12 and name HG2#) (resid 13 and name HG#) 0 -1.78 7.00 assign (resid 12 and name HG2#) (resid 14 and name HN) 0 -1.78 6.10 assign (resid 12 and name HG1#) (resid 13 and name HN) 0 -1.78 5.90 !13 ARG assign (resid 13 and name HN) (resid 14 and name HA) 0 -1.78 5.00 assign (resid 13 and name HB#) (resid 13 and name HE) 0 -1.78 5.88 assign (resid 13 and name HB#) (resid 14 and name HG2#) 0 -1.78 6.98 !15 ALA assign (resid 15 and name HB#) (resid 17 and name HN) 0 -1.78 6.10 !16 PRO assign (resid 16 and name HA) (resid 17 and name HA) 0 -1.78 5.00 assign (resid 16 and name HB#) (resid 17 and name HA) 0 -1.78 5.88 assign (resid 16 and name HB#) (resid 18 and name HG2#) 0 -1.78 6.98 assign (resid 16 and name HG1) (resid 18 and name HG2#) 0 -1.78 6.10 assign (resid 16 and name HG2) (resid 18 and name HG2#) 0 -1.78 6.10 assign (resid 16 and name HG#) (resid 17 and name HN) 0 -1.78 5.37 assign (resid 16 and name HD#) (resid 18 and name HG2#) 0 -1.78 6.98 !17 LEU assign (resid 17 and name HN) (resid 17 and name HD#) 0 -1.78 7.67 assign (resid 17 and name HN) (resid 18 and name HG2#) 0 -1.78 6.10 assign (resid 17 and name HN) (resid 19 and name HN) 0 -1.78 5.00 assign (resid 17 and name HA) (resid 18 and name HG2#) 0 -1.78 6.10 assign (resid 17 and name HB1) (resid 19 and name HN) 0 -1.78 5.00 assign (resid 17 and name HB2) (resid 19 and name HN) 0 -1.78 5.00 assign (resid 17 and name HD1#) (resid 19 and name HN) 0 -1.78 6.10 assign (resid 17 and name HD2#) (resid 19 and name HN) 0 -1.78 6.10 !18 THR assign (resid 18 and name HB) (resid 45 and name HD#) 0 -1.78 5.88 !19 GLY assign (resid 19 and name HA#) (resid 44 and name HN) 0 -1.78 5.88 !20 THR assign (resid 20 and name HN) (resid 44 and name HB1) 0 -1.78 5.00 assign (resid 20 and name HN) (resid 44 and name HB2) 0 -1.78 5.00 assign (resid 20 and name HB) (resid 44 and name HN) 0 -1.78 5.00 assign (resid 20 and name HB) (resid 44 and name HB#) 0 -1.78 5.88 assign (resid 20 and name HG2#) (resid 21 and name HG#) 0 -1.78 8.76 assign (resid 20 and name HG2#) (resid 46 and name HN) 0 -1.78 6.10 !21 VAL assign (resid 21 and name HA) (resid 22 and name HB#) 0 -1.78 5.88 assign (resid 21 and name HG#) (resid 22 and name HB#) 0 -1.78 8.54 assign (resid 21 and name HG#) (resid 23 and name HB#) 0 -1.78 8.54 assign (resid 21 and name HG#) (resid 23 and name HD#) 0 -1.78 10.33 assign (resid 21 and name HG#) (resid 40 and name HG2#) 0 -1.78 8.76 assign (resid 21 and name HG#) (resid 41 and name HB#) 0 -1.78 8.76 assign (resid 21 and name HG#) (resid 42 and name HN) 0 -1.78 7.66 !22 ASP assign (resid 22 and name HN) (resid 42 and name HN) 0 -1.78 5.00 assign (resid 22 and name HB1) (resid 23 and name HN) 0 -1.78 5.00 assign (resid 22 and name HB2) (resid 23 and name HN) 0 -1.78 5.00 !23 LEU assign (resid 23 and name HN) (resid 23 and name HD#) 0 -1.78 7.67 assign (resid 23 and name HD#) (resid 24 and name HN) 0 -1.78 7.67 assign (resid 23 and name HD#) (resid 37 and name CG) 0 -1.78 9.87 assign (resid 23 and name HD#) (resid 37 and name HD#) 0 -1.78 9.87 !24 GLY assign (resid 24 and name HN) (resid 41 and name HB#) 0 -1.78 6.10 !26 CYS assign (resid 26 and name HN) (resid 42 and name HB1) 0 -1.78 5.00 assign (resid 26 and name HN) (resid 42 and name HB2) 0 -1.78 5.00 !27 ASN assign (resid 27 and name HB#) (resid 28 and name HB#) 0 -1.78 6.98 assign (resid 27 and name HB#) (resid 30 and name HD1) 0 -1.78 5.88 !28 ALA assign (resid 28 and name HN) (resid 30 and name HN) 0 -1.78 5.00 assign (resid 28 and name HB#) (resid 30 and name HN) 0 -1.78 6.10 !29 GLY assign (resid 29 and name HN) (resid 47 and name CD) 0 -1.78 6.09 assign (resid 29 and name HN) (resid 47 and name HD#) 0 -1.78 5.90 assign (resid 29 and name HA1) (resid 30 and name HD1) 0 -1.78 5.00 assign (resid 29 and name HA2) (resid 30 and name HD1) 0 -1.78 5.00 !30 TRP assign (resid 30 and name HN) (resid 46 and name HA) 0 -1.78 5.00 assign (resid 30 and name HA) (resid 45 and name HN) 0 -1.78 5.00 assign (resid 30 and name HA) (resid 46 and name HA) 0 -1.78 5.00 assign (resid 30 and name HA) (resid 47 and name HN) 0 -1.78 5.00 assign (resid 30 and name HE3) (resid 44 and name HB#) 0 -1.78 5.88 assign (resid 30 and name HZ3) (resid 44 and name HB#) 0 -1.78 5.88 assign (resid 30 and name HZ2) (resid 46 and name CE) 0 -1.78 6.09 assign (resid 30 and name HZ2) (resid 46 and name HE#) 0 -1.78 5.90 !31 GLU assign (resid 31 and name HN) (resid 31 and name HG#) 0 -1.78 5.88 assign (resid 31 and name HN) (resid 44 and name HB#) 0 -1.78 5.88 assign (resid 31 and name HN) (resid 47 and name HA) 0 -1.78 5.00 assign (resid 31 and name HG#) (resid 32 and name HN) 0 -1.78 5.88 assign (resid 31 and name HG#) (resid 45 and name HN) 0 -1.78 5.88 assign (resid 31 and name HG#) (resid 47 and name HA) 0 -1.78 5.88 !32 LYS assign (resid 32 and name HN) (resid 32 and name HG1) 0 -1.78 5.00 assign (resid 32 and name HN) (resid 32 and name HG2) 0 -1.78 5.00 assign (resid 32 and name HN) (resid 45 and name HN) 0 -1.78 5.00 assign (resid 32 and name HA) (resid 33 and name HB#) 0 -1.78 5.88 assign (resid 32 and name HA) (resid 45 and name HN) 0 -1.78 5.00 assign (resid 32 and name HB1) (resid 44 and name HA) 0 -1.78 5.00 assign (resid 32 and name HB2) (resid 44 and name HA) 0 -1.78 5.00 assign (resid 32 and name HB#) (resid 33 and name HN) 0 -1.78 5.88 assign (resid 32 and name HG#) (resid 33 and name HN) 0 -1.78 5.88 assign (resid 32 and name HG#) (resid 34 and name HN) 0 -1.78 5.88 assign (resid 32 and name HG#) (resid 35 and name HA) 0 -1.78 5.88 assign (resid 32 and name HD#) (resid 34 and name HN) 0 -1.78 5.88 assign (resid 32 and name HE#) (resid 34 and name HN) 0 -1.78 5.88 !33 CYS assign (resid 33 and name HN) (resid 34 and name HB#) 0 -1.78 6.10 assign (resid 33 and name HN) (resid 43 and name HN) 0 -1.78 5.00 assign (resid 33 and name HN) (resid 44 and name HN) 0 -1.78 5.00 assign (resid 33 and name HN) (resid 44 and name HA) 0 -1.78 5.00 assign (resid 33 and name HN) (resid 44 and name HB#) 0 -1.78 5.88 assign (resid 33 and name HA) (resid 45 and name HN) 0 -1.78 5.00 assign (resid 33 and name HB#) (resid 34 and name HN) 0 -1.78 5.88 assign (resid 33 and name HB#) (resid 45 and name HN) 0 -1.78 5.88 assign (resid 33 and name HB#) (resid 45 and name HE) 0 -1.78 5.88 !34 ALA assign (resid 34 and name HB#) (resid 36 and name HN) 0 -1.78 6.10 assign (resid 34 and name HB#) (resid 37 and name HE#) 0 -1.78 8.30 assign (resid 34 and name HB#) (resid 37 and name CZ) 0 -1.78 8.30 assign (resid 34 and name HB#) (resid 42 and name HA) 0 -1.78 6.10 assign (resid 34 and name HB#) (resid 43 and name HN) 0 -1.78 6.10 !35 SER assign (resid 35 and name CB) (resid 36 and name HB#) 0 -1.78 6.97 assign (resid 35 and name HB#) (resid 36 and name HB#) 0 -1.78 6.78 !36 TYR assign (resid 36 and name HN) (resid 37 and name HN) 0 -1.78 5.00 assign (resid 36 and name HB1) (resid 37 and name HN) 0 -1.78 5.00 assign (resid 36 and name HB2) (resid 37 and name HN) 0 -1.78 5.00 assign (resid 36 and name CG) (resid 37 and name HN) 0 -1.78 7.20 assign (resid 36 and name CG) (resid 38 and name HA) 0 -1.78 7.20 assign (resid 36 and name CG) (resid 41 and name HB#) 0 -1.78 8.30 assign (resid 36 and name HD#) (resid 37 and name HN) 0 -1.78 7.20 assign (resid 36 and name HD#) (resid 38 and name HA) 0 -1.78 7.20 assign (resid 36 and name HD#) (resid 41 and name HB#) 0 -1.78 8.30 assign (resid 36 and name HE#) (resid 41 and name HB#) 0 -1.78 8.30 assign (resid 36 and name CZ) (resid 41 and name HB#) 0 -1.78 8.30 !37 TYR assign (resid 37 and name HN) (resid 37 and name HD#) 0 -1.78 7.20 assign (resid 37 and name HB#) (resid 42 and name HA) 0 -1.78 5.88 assign (resid 37 and name HB#) (resid 43 and name HN) 0 -1.78 5.88 assign (resid 37 and name CG) (resid 38 and name HN) 0 -1.78 7.20 assign (resid 37 and name CG) (resid 38 and name HA) 0 -1.78 7.20 assign (resid 37 and name HD#) (resid 38 and name HN) 0 -1.78 7.20 assign (resid 37 and name HD#) (resid 38 and name HA) 0 -1.78 7.20 assign (resid 37 and name HE#) (resid 38 and name HN) 0 -1.78 7.20 assign (resid 37 and name HE#) (resid 41 and name HN) 0 -1.78 7.20 assign (resid 37 and name CZ) (resid 38 and name HN) 0 -1.78 7.20 assign (resid 37 and name CZ) (resid 41 and name HN) 0 -1.78 7.20 !38 THR assign (resid 38 and name HN) (resid 41 and name HB#) 0 -1.78 6.10 assign (resid 38 and name HA) (resid 39 and name HG1#) 0 -1.78 5.90 assign (resid 38 and name HB) (resid 39 and name HN) 0 -1.78 5.00 assign (resid 38 and name HG2#) (resid 39 and name HG2#) 0 -1.78 7.20 assign (resid 38 and name HG2#) (resid 41 and name HN) 0 -1.78 6.10 assign (resid 38 and name HG2#) (resid 41 and name HB#) 0 -1.78 7.20 !39 ILE assign (resid 39 and name HN) (resid 39 and name HD1#) 0 -1.78 6.10 assign (resid 39 and name HN) (resid 40 and name HG2#) 0 -1.78 6.10 assign (resid 39 and name HA) (resid 41 and name HN) 0 -1.78 5.00 assign (resid 39 and name HG2#) (resid 40 and name HN) 0 -1.78 6.10 assign (resid 39 and name HG2#) (resid 41 and name HN) 0 -1.78 6.10 !40 ILE assign (resid 40 and name HN) (resid 40 and name HG1#) 0 -1.78 5.90 assign (resid 40 and name HN) (resid 40 and name HD1#) 0 -1.78 6.10 assign (resid 40 and name HN) (resid 41 and name HB#) 0 -1.78 6.10 assign (resid 40 and name HG1#) (resid 41 and name HN) 0 -1.78 5.90 !41 ALA assign (resid 41 and name HN) (resid 42 and name HN) 0 -1.78 5.00 !42 ASP assign (resid 42 and name HN) (resid 43 and name HN) 0 -1.78 5.00 assign (resid 42 and name HB#) (resid 43 and name HB#) 0 -1.78 6.75 !43 CYS assign (resid 43 and name HB#) (resid 44 and name HN) 0 -1.78 5.88 !44 CYS assign (resid 44 and name HN) (resid 45 and name HN) 0 -1.78 5.00 assign (resid 44 and name HA) (resid 45 and name HB#) 0 -1.78 5.88 assign (resid 44 and name HB1) (resid 45 and name HN) 0 -1.78 5.00 assign (resid 44 and name HB2) (resid 45 and name HN) 0 -1.78 5.00 !45 ARG assign (resid 45 and name HA) (resid 45 and name HE) 0 -1.78 5.00 assign (resid 45 and name CG) (resid 46 and name HN) 0 -1.78 6.09 assign (resid 45 and name HG#) (resid 46 and name HN) 0 -1.78 5.90 assign (resid 45 and name HD1) (resid 48 and name H2) 0 -1.78 6.80 assign (resid 45 and name HD2) (resid 48 and name H2) 0 -1.78 6.80 !46 LYS assign (resid 46 and name HN) (resid 46 and name HG#) 0 -1.78 5.88 assign (resid 46 and name HB#) (resid 46 and name HE#) 0 -1.78 6.78 assign (resid 46 and name HG1) (resid 47 and name HN) 0 -1.78 5.00 assign (resid 46 and name HG2) (resid 47 and name HN) 0 -1.78 5.00 !47 LYS assign (resid 47 and name HN) (resid 47 and name HG1) 0 -1.78 5.00 assign (resid 47 and name HN) (resid 47 and name HG2) 0 -1.78 5.00 assign (resid 47 and name HN) (resid 47 and name CD) 0 -1.78 6.09 assign (resid 47 and name HN) (resid 47 and name HD#) 0 -1.78 5.90 assign (resid 47 and name HN) (resid 48 and name HN) 0 -1.78 5.00 assign (resid 47 and name HA) (resid 47 and name HD#) 0 -1.78 5.90 assign (resid 47 and name HB#) (resid 47 and name HE#) 0 -1.78 6.78 assign (resid 47 and name HB#) (resid 48 and name HN) 0 -1.78 5.88 !48 LYS assign (resid 48 and name HN) (resid 48 and name HG#) 0 -1.78 5.88
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