NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
645423 |
6urp   |
16667 | cing | 1-original | 1 | XPLOR/CNS | dipolar coupling |
# Restraints file 1: Pf1_nh.tbl
!! 4 ASP N 4 ASP H -2.170 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 4 and name N )
( resid 4 and name HN ) -2.1700 0.2000
!! 5 GLU N 5 GLU H 0.770 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 5 and name N )
( resid 5 and name HN ) 0.7700 0.2000
!! 7 CYS N 7 CYS H 14.160 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 7 and name N )
( resid 7 and name HN ) 14.1600 0.2000
!! 8 ARG N 8 ARG H 4.080 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 8 and name N )
( resid 8 and name HN ) 4.0800 0.2000
!! 9 ALA N 9 ALA H 10.550 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 9 and name N )
( resid 9 and name HN ) 10.5500 0.2000
!! 10 ARG N 10 ARG H 23.410 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 10 and name N )
( resid 10 and name HN ) 23.4100 0.2000
!! 11 MET N 11 MET H -7.620 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 11 and name N )
( resid 11 and name HN ) -7.6200 0.2000
!! 12 THR N 12 THR H -13.120 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 12 and name N )
( resid 12 and name HN ) -13.1200 0.2000
!! 14 LYS N 14 LYS H 26.580 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name N )
( resid 14 and name HN ) 26.5800 0.2000
!! 15 GLU N 15 GLU H 10.930 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name N )
( resid 15 and name HN ) 10.9300 0.2000
!! 16 PHE N 16 PHE H 21.110 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name N )
( resid 16 and name HN ) 21.1100 0.2000
!! 17 ASN N 17 ASN H 29.730 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 17 and name N )
( resid 17 and name HN ) 29.7300 0.2000
!! 18 TYR N 18 TYR H 20.470 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 18 and name N )
( resid 18 and name HN ) 20.4700 0.2000
!! 19 LYS N 19 LYS H 14.810 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 19 and name N )
( resid 19 and name HN ) 14.8100 0.2000
!! 20 SER N 20 SER H 26.860 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 20 and name N )
( resid 20 and name HN ) 26.8600 0.2000
!! 21 ASN N 21 ASN H 30.110 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 21 and name N )
( resid 21 and name HN ) 30.1100 0.2000
!! 22 VAL N 22 VAL H 16.250 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 22 and name N )
( resid 22 and name HN ) 16.2500 0.2000
!! 23 CYS N 23 CYS H 18.380 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 23 and name N )
( resid 23 and name HN ) 18.3800 0.2000
!! 24 ASN N 24 ASN H 30.060 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 24 and name N )
( resid 24 and name HN ) 30.0600 0.2000
!! 25 GLY N 25 GLY H 17.290 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 25 and name N )
( resid 25 and name HN ) 17.2900 0.2000
!! 26 CYS N 26 CYS H -6.210 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 26 and name N )
( resid 26 and name HN ) -6.2100 0.2000
!! 27 GLY N 27 GLY H 3.260 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 27 and name N )
( resid 27 and name HN ) 3.2600 0.2000
!! 28 ASP N 28 ASP H -5.220 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 28 and name N )
( resid 28 and name HN ) -5.2200 0.2000
!! 29 GLN N 29 GLN H -12.320 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name N )
( resid 29 and name HN ) -12.3200 0.2000
!! 30 VAL N 30 VAL H 0.650 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name N )
( resid 30 and name HN ) 0.6500 0.2000
!! 31 ALA N 31 ALA H 20.950 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name N )
( resid 31 and name HN ) 20.9500 0.2000
!! 32 ALA N 32 ALA H 7.370 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 32 and name N )
( resid 32 and name HN ) 7.3700 0.2000
!! 33 CYS N 33 CYS H 1.370 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 33 and name N )
( resid 33 and name HN ) 1.3700 0.2000
!! 34 GLU N 34 GLU H 15.350 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 34 and name N )
( resid 34 and name HN ) 15.3500 0.2000
!! 35 ALA N 35 ALA H 13.440 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 35 and name N )
( resid 35 and name HN ) 13.4400 0.2000
!! 36 GLU N 36 GLU H -8.080 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 36 and name N )
( resid 36 and name HN ) -8.0800 0.2000
!! 37 CYS N 37 CYS H -0.210 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 37 and name N )
( resid 37 and name HN ) -0.2100 0.2000
!! 38 PHE N 38 PHE H 13.630 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 38 and name N )
( resid 38 and name HN ) 13.6300 0.2000
!! 39 ARG N 39 ARG H -18.090 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 39 and name N )
( resid 39 and name HN ) -18.0900 0.2000
!! 40 ASN N 40 ASN H -8.600 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name N )
( resid 40 and name HN ) -8.6000 0.2000
!! 41 ASP N 41 ASP H -3.760 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 41 and name N )
( resid 41 and name HN ) -3.7600 0.2000
!! 42 VAL N 42 VAL H -16.570 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 42 and name N )
( resid 42 and name HN ) -16.5700 0.2000
!! 43 TYR N 43 TYR H -18.840 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 43 and name N )
( resid 43 and name HN ) -18.8400 0.2000
!! 44 THR N 44 THR H -15.740 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 44 and name N )
( resid 44 and name HN ) -15.7400 0.2000
!! 45 ALA N 45 ALA H -13.460 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 45 and name N )
( resid 45 and name HN ) -13.4600 0.2000
!! 46 CYS N 46 CYS H -18.110 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 46 and name N )
( resid 46 and name HN ) -18.1100 0.2000
!! 47 HIS N 47 HIS H -16.700 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 47 and name N )
( resid 47 and name HN ) -16.7000 0.2000
!! 48 GLU N 48 GLU H -7.940 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 48 and name N )
( resid 48 and name HN ) -7.9400 0.2000
!! 49 ALA N 49 ALA H -16.220 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 49 and name N )
( resid 49 and name HN ) -16.2200 0.2000
!! 50 GLN N 50 GLN H -7.930 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 50 and name N )
( resid 50 and name HN ) -7.9300 0.2000
# Restraints file 2: Pf1_cn.tbl
!! 3 PRO C 4 ASP N -1.370 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 3 and name C )
( resid 4 and name N ) -11.3299 0.2000
!! 7 CYS C 8 ARG N -1.270 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 7 and name C )
( resid 8 and name N ) -10.5029 0.2000
!! 8 ARG C 9 ALA N -2.010 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 8 and name C )
( resid 9 and name N ) -16.6227 0.2000
!! 9 ALA C 10 ARG N 0.320 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 9 and name C )
( resid 10 and name N ) 2.6464 0.2000
!! 10 ARG C 11 MET N -1.020 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 10 and name C )
( resid 11 and name N ) -8.4354 0.2000
!! 11 MET C 12 THR N -0.960 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 11 and name C )
( resid 12 and name N ) -7.9392 0.2000
!! 13 HIS C 14 LYS N 0.330 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 13 and name C )
( resid 14 and name N ) 2.7291 0.2000
!! 14 LYS C 15 GLU N -1.490 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name C )
( resid 15 and name N ) -12.3223 0.2000
!! 15 GLU C 16 PHE N -2.080 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name C )
( resid 16 and name N ) -17.2016 0.2000
!! 16 PHE C 17 ASN N -0.010 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name C )
( resid 17 and name N ) -0.0827 0.2000
!! 17 ASN C 18 TYR N -0.470 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 17 and name C )
( resid 18 and name N ) -3.8869 0.2000
!! 18 TYR C 19 LYS N -1.570 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 18 and name C )
( resid 19 and name N ) -12.9839 0.2000
!! 19 LYS C 20 SER N -1.370 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 19 and name C )
( resid 20 and name N ) -11.3299 0.2000
!! 20 SER C 21 ASN N -0.060 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 20 and name C )
( resid 21 and name N ) -0.4962 0.2000
!! 21 ASN C 22 VAL N -1.270 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 21 and name C )
( resid 22 and name N ) -10.5029 0.2000
!! 22 VAL C 23 CYS N -2.290 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 22 and name C )
( resid 23 and name N ) -18.9383 0.2000
!! 23 CYS C 24 ASN N -0.200 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 23 and name C )
( resid 24 and name N ) -1.6540 0.2000
!! 24 ASN C 25 GLY N -1.200 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 24 and name C )
( resid 25 and name N ) -9.9240 0.2000
!! 25 GLY C 26 CYS N -1.400 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 25 and name C )
( resid 26 and name N ) -11.5780 0.2000
!! 26 CYS C 27 GLY N -1.340 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 26 and name C )
( resid 27 and name N ) -11.0818 0.2000
!! 27 GLY C 28 ASP N 2.210 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 27 and name C )
( resid 28 and name N ) 18.2767 0.2000
!! 28 ASP C 29 GLN N 1.090 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 28 and name C )
( resid 29 and name N ) 9.0143 0.2000
!! 29 GLN C 30 VAL N -1.000 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name C )
( resid 30 and name N ) -8.2700 0.2000
!! 30 VAL C 31 ALA N 0.680 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name C )
( resid 31 and name N ) 5.6236 0.2000
!! 31 ALA C 32 ALA N 0.060 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name C )
( resid 32 and name N ) 0.4962 0.2000
!! 32 ALA C 33 CYS N -1.410 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 32 and name C )
( resid 33 and name N ) -11.6607 0.2000
!! 33 CYS C 34 GLU N -1.520 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 33 and name C )
( resid 34 and name N ) -12.5704 0.2000
!! 34 GLU C 35 ALA N 1.760 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 34 and name C )
( resid 35 and name N ) 14.5552 0.2000
!! 35 ALA C 36 GLU N -1.560 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 35 and name C )
( resid 36 and name N ) -12.9012 0.2000
!! 36 GLU C 37 CYS N -1.160 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 36 and name C )
( resid 37 and name N ) -9.5932 0.2000
!! 37 CYS C 38 PHE N 2.150 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 37 and name C )
( resid 38 and name N ) 17.7805 0.2000
!! 38 PHE C 39 ARG N -1.870 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 38 and name C )
( resid 39 and name N ) -15.4649 0.2000
!! 39 ARG C 40 ASN N -0.610 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 39 and name C )
( resid 40 and name N ) -5.0447 0.2000
!! 40 ASN C 41 ASP N 2.390 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name C )
( resid 41 and name N ) 19.7653 0.2000
!! 41 ASP C 42 VAL N -1.050 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 41 and name C )
( resid 42 and name N ) -8.6835 0.2000
!! 42 VAL C 43 TYR N 2.000 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 42 and name C )
( resid 43 and name N ) 16.5400 0.2000
!! 43 TYR C 44 THR N -1.650 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 43 and name C )
( resid 44 and name N ) -13.6455 0.2000
!! 44 THR C 45 ALA N 3.660 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 44 and name C )
( resid 45 and name N ) 30.2682 0.2000
!! 45 ALA C 46 CYS N -1.590 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 45 and name C )
( resid 46 and name N ) -13.1493 0.2000
!! 47 HIS C 48 GLU N -0.010 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 47 and name C )
( resid 48 and name N ) -0.0827 0.2000
!! 48 GLU C 49 ALA N 0.510 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 48 and name C )
( resid 49 and name N ) 4.2177 0.2000
!! 49 ALA C 50 GLN N 1.680 0.125 8.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 49 and name C )
( resid 50 and name N ) 13.8936 0.2000
# Restraints file 3: Pf1_caha.tbl
!! 3 PRO HA 3 PRO CA 3.030 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 3 and name HA )
( resid 3 and name CA ) 1.4695 0.2000
!! 4 ASP HA 4 ASP CA -17.360 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 4 and name HA )
( resid 4 and name CA ) -8.4196 0.2000
!! 5 GLU HA 5 GLU CA -11.400 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 5 and name HA )
( resid 5 and name CA ) -5.5290 0.2000
!! 7 CYS HA 7 CYS CA -16.000 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 7 and name HA )
( resid 7 and name CA ) -7.7600 0.2000
!! 8 ARG HA 8 ARG CA -39.720 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 8 and name HA )
( resid 8 and name CA ) -19.2642 0.2000
!! 9 ALA HA 9 ALA CA 11.620 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 9 and name HA )
( resid 9 and name CA ) 5.6357 0.2000
!! 10 ARG HA 10 ARG CA 31.710 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 10 and name HA )
( resid 10 and name CA ) 15.3794 0.2000
!! 11 MET HA 11 MET CA -4.830 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 11 and name HA )
( resid 11 and name CA ) -2.3426 0.2000
!! 13 HIS HA 13 HIS CA 32.910 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 13 and name HA )
( resid 13 and name CA ) 15.9613 0.2000
!! 14 LYS HA 14 LYS CA -14.190 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name HA )
( resid 14 and name CA ) -6.8821 0.2000
!! 15 GLU HA 15 GLU CA -37.400 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name HA )
( resid 15 and name CA ) -18.1390 0.2000
!! 16 PHE HA 16 PHE CA 11.230 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name HA )
( resid 16 and name CA ) 5.4466 0.2000
!! 17 ASN HA 17 ASN CA 20.990 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 17 and name HA )
( resid 17 and name CA ) 10.1801 0.2000
!! 18 TYR HA 18 TYR CA -30.050 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 18 and name HA )
( resid 18 and name CA ) -14.5742 0.2000
!! 19 LYS HA 19 LYS CA -24.160 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 19 and name HA )
( resid 19 and name CA ) -11.7176 0.2000
!! 20 SER HA 20 SER CA 19.480 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 20 and name HA )
( resid 20 and name CA ) 9.4478 0.2000
!! 21 ASN HA 21 ASN CA 3.170 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 21 and name HA )
( resid 21 and name CA ) 1.5374 0.2000
!! 22 VAL HA 22 VAL CA -37.290 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 22 and name HA )
( resid 22 and name CA ) -18.0856 0.2000
!! 23 CYS HA 23 CYS CA 4.830 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 23 and name HA )
( resid 23 and name CA ) 2.3426 0.2000
!! 24 ASN HA 24 ASN CA 15.410 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 24 and name HA )
( resid 24 and name CA ) 7.4738 0.2000
!! 25 GLY HA# 25 GLY CA -0.150 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 25 and name HA# )
( resid 25 and name CA ) -0.0727 0.2000
!! 26 CYS HA 26 CYS CA -36.690 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 26 and name HA )
( resid 26 and name CA ) -17.7946 0.2000
!! 27 GLY HA# 27 GLY CA -12.960 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 27 and name HA# )
( resid 27 and name CA ) -6.2856 0.2000
!! 28 ASP HA 28 ASP CA -14.200 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 28 and name HA )
( resid 28 and name CA ) -6.8870 0.2000
!! 29 GLN HA 29 GLN CA 1.210 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name HA )
( resid 29 and name CA ) 0.5868 0.2000
!! 30 VAL HA 30 VAL CA 15.410 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name HA )
( resid 30 and name CA ) 7.4738 0.2000
!! 31 ALA HA 31 ALA CA 41.980 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name HA )
( resid 31 and name CA ) 20.3603 0.2000
!! 32 ALA HA 32 ALA CA -37.890 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 32 and name HA )
( resid 32 and name CA ) -18.3767 0.2000
!! 33 CYS HA 33 CYS CA -28.690 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 33 and name HA )
( resid 33 and name CA ) -13.9146 0.2000
!! 34 GLU HA 34 GLU CA 38.800 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 34 and name HA )
( resid 34 and name CA ) 18.8180 0.2000
!! 35 ALA HA 35 ALA CA -34.880 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 35 and name HA )
( resid 35 and name CA ) -16.9168 0.2000
!! 36 GLU HA 36 GLU CA -35.180 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 36 and name HA )
( resid 36 and name CA ) -17.0623 0.2000
!! 37 CYS HA 37 CYS CA -23.110 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 37 and name HA )
( resid 37 and name CA ) -11.2083 0.2000
!! 38 PHE HA 38 PHE CA 48.620 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 38 and name HA )
( resid 38 and name CA ) 23.5807 0.2000
!! 39 ARG HA 39 ARG CA -27.030 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 39 and name HA )
( resid 39 and name CA ) -13.1096 0.2000
!! 40 ASN HA 40 ASN CA -25.820 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name HA )
( resid 40 and name CA ) -12.5227 0.2000
!! 41 ASP HA 41 ASP CA 29.590 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 41 and name HA )
( resid 41 and name CA ) 14.3511 0.2000
!! 42 VAL HA 42 VAL CA -2.140 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 42 and name HA )
( resid 42 and name CA ) -1.0379 0.2000
!! 43 TYR HA 43 TYR CA -25.520 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 43 and name HA )
( resid 43 and name CA ) -12.3772 0.2000
!! 44 THR HA 44 THR CA 50.730 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 44 and name HA )
( resid 44 and name CA ) 24.6040 0.2000
!! 45 ALA HA 45 ALA CA -30.810 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 45 and name HA )
( resid 45 and name CA ) -14.9428 0.2000
!! 46 CYS HA 46 CYS CA 18.720 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 46 and name HA )
( resid 46 and name CA ) 9.0792 0.2000
!! 47 HIS HA 47 HIS CA -17.960 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 47 and name HA )
( resid 47 and name CA ) -8.7106 0.2000
!! 48 GLU HA 48 GLU CA 41.380 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 48 and name HA )
( resid 48 and name CA ) 20.0693 0.2000
!! 49 ALA HA 49 ALA CA -21.440 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 49 and name HA )
( resid 49 and name CA ) -10.3984 0.2000
!! 50 GLN HA 50 GLN CA 3.930 1.000 0.50
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 50 and name HA )
( resid 50 and name CA ) 1.9061 0.2000
# Restraints file 4: Pf1_cac.tbl
!! 3 PRO CA 3 PRO C -0.850 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 3 and name CA )
( resid 3 and name C ) -4.2500 0.2000
!! 4 ASP CA 4 ASP C 3.920 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 4 and name CA )
( resid 4 and name C ) 19.6000 0.2000
!! 5 GLU CA 5 GLU C 0.010 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 5 and name CA )
( resid 5 and name C ) 0.0500 0.2000
!! 7 CYS CA 7 CYS C 2.170 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 7 and name CA )
( resid 7 and name C ) 10.8500 0.2000
!! 8 ARG CA 8 ARG C 4.550 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 8 and name CA )
( resid 8 and name C ) 22.7500 0.2000
!! 9 ALA CA 9 ALA C -1.530 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 9 and name CA )
( resid 9 and name C ) -7.6500 0.2000
!! 10 ARG CA 10 ARG C -3.240 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 10 and name CA )
( resid 10 and name C ) -16.2000 0.2000
!! 11 MET CA 11 MET C 0.280 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 11 and name CA )
( resid 11 and name C ) 1.4000 0.2000
!! 13 HIS CA 13 HIS C -2.930 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 13 and name CA )
( resid 13 and name C ) -14.6500 0.2000
!! 14 LYS CA 14 LYS C 2.390 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name CA )
( resid 14 and name C ) 11.9500 0.2000
!! 15 GLU CA 15 GLU C 3.690 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name CA )
( resid 15 and name C ) 18.4500 0.2000
!! 16 PHE CA 16 PHE C -0.760 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name CA )
( resid 16 and name C ) -3.8000 0.2000
!! 17 ASN CA 17 ASN C -1.760 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 17 and name CA )
( resid 17 and name C ) -8.8000 0.2000
!! 18 TYR CA 18 TYR C 4.610 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 18 and name CA )
( resid 18 and name C ) 23.0500 0.2000
!! 19 LYS CA 19 LYS C 2.270 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 19 and name CA )
( resid 19 and name C ) 11.3500 0.2000
!! 20 SER CA 20 SER C -0.560 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 20 and name CA )
( resid 20 and name C ) -2.8000 0.2000
!! 21 ASN CA 21 ASN C 0.610 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 21 and name CA )
( resid 21 and name C ) 3.0500 0.2000
!! 22 VAL CA 22 VAL C 3.960 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 22 and name CA )
( resid 22 and name C ) 19.8000 0.2000
!! 23 CYS CA 23 CYS C -0.260 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 23 and name CA )
( resid 23 and name C ) -1.3000 0.2000
!! 24 ASN CA 24 ASN C -1.670 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 24 and name CA )
( resid 24 and name C ) -8.3500 0.2000
!! 25 GLY CA 25 GLY C 2.590 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 25 and name CA )
( resid 25 and name C ) 12.9500 0.2000
!! 26 CYS CA 26 CYS C 4.880 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 26 and name CA )
( resid 26 and name C ) 24.4000 0.2000
!! 27 GLY CA 27 GLY C -2.610 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 27 and name CA )
( resid 27 and name C ) -13.0500 0.2000
!! 28 ASP CA 28 ASP C -1.780 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 28 and name CA )
( resid 28 and name C ) -8.9000 0.2000
!! 29 GLN CA 29 GLN C 3.830 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name CA )
( resid 29 and name C ) 19.1500 0.2000
!! 30 VAL CA 30 VAL C -3.130 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name CA )
( resid 30 and name C ) -15.6500 0.2000
!! 31 ALA CA 31 ALA C -2.190 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name CA )
( resid 31 and name C ) -10.9500 0.2000
!! 32 ALA CA 32 ALA C 3.930 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 32 and name CA )
( resid 32 and name C ) 19.6500 0.2000
!! 33 CYS CA 33 CYS C 2.280 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 33 and name CA )
( resid 33 and name C ) 11.4000 0.2000
!! 34 GLU CA 34 GLU C -3.260 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 34 and name CA )
( resid 34 and name C ) -16.3000 0.2000
!! 35 ALA CA 35 ALA C 2.800 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 35 and name CA )
( resid 35 and name C ) 14.0000 0.2000
!! 36 GLU CA 36 GLU C 3.950 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 36 and name CA )
( resid 36 and name C ) 19.7500 0.2000
!! 37 CYS CA 37 CYS C -3.710 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 37 and name CA )
( resid 37 and name C ) -18.5500 0.2000
!! 38 PHE CA 38 PHE C -2.490 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 38 and name CA )
( resid 38 and name C ) -12.4500 0.2000
!! 39 ARG CA 39 ARG C 5.060 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 39 and name CA )
( resid 39 and name C ) 25.3000 0.2000
!! 40 ASN CA 40 ASN C -3.250 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name CA )
( resid 40 and name C ) -16.2500 0.2000
!! 41 ASP CA 41 ASP C -1.560 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 41 and name CA )
( resid 41 and name C ) -7.8000 0.2000
!! 42 VAL CA 42 VAL C 2.650 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 42 and name CA )
( resid 42 and name C ) 13.2500 0.2000
!! 43 TYR CA 43 TYR C -3.010 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 43 and name CA )
( resid 43 and name C ) -15.0500 0.2000
!! 44 THR CA 44 THR C -0.330 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 44 and name CA )
( resid 44 and name C ) -1.6500 0.2000
!! 45 ALA CA 45 ALA C -2.470 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 45 and name CA )
( resid 45 and name C ) -12.3500 0.2000
!! 46 CYS CA 46 CYS C 3.160 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 46 and name CA )
( resid 46 and name C ) 15.8000 0.2000
!! 47 HIS CA 47 HIS C -3.510 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 47 and name CA )
( resid 47 and name C ) -17.5500 0.2000
!! 48 GLU CA 48 GLU C -0.280 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 48 and name CA )
( resid 48 and name C ) -1.4000 0.2000
!! 49 ALA CA 49 ALA C -0.520 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 49 and name CA )
( resid 49 and name C ) -2.6000 0.2000
!! 50 GLN CA 50 GLN C 1.220 0.200 5.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 50 and name CA )
( resid 50 and name C ) 6.1000 0.2000
# Restraints file 5: pf1_cbhb.tbl
!! 3 P CB 3 P HB# -6.870 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 3 and name CB )
( resid 3 and name HB# ) -3.3319 0.2000
!! 4 D CB 4 D HB# 10.790 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 4 and name CB )
( resid 4 and name HB# ) 5.2331 0.2000
!! 5 E CB 5 E HB# 25.460 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 5 and name CB )
( resid 5 and name HB# ) 12.3481 0.2000
!! 7 C CB 7 C HB# -16.210 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 7 and name CB )
( resid 7 and name HB# ) -7.8619 0.2000
!! 9 A CB 9 A HB# 10.970 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 9 and name CB )
!! ( resid 9 and name HB# ) 5.3205 0.2000
( resid 9 and name HB# ) 15.9615 0.2000
!! 10 R CB 10 R HB# -0.990 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 10 and name CB )
( resid 10 and name HB# ) -0.4801 0.2000
!! 11 M CB 11 M HB# -46.820 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 11 and name CB )
( resid 11 and name HB# ) -22.7077 0.2000
!! 14 K CB 14 K HB# -7.910 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 14 and name CB )
( resid 14 and name HB# ) -3.8363 0.2000
!! 15 E CB 15 E HB# 6.810 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 15 and name CB )
( resid 15 and name HB# ) 3.3028 0.2000
!! 16 F CB 16 F HB# -2.400 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 16 and name CB )
( resid 16 and name HB# ) -1.1640 0.2000
!! 17 N CB 17 N HB# 9.700 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 17 and name CB )
( resid 17 and name HB# ) 4.7045 0.2000
!! 18 Y CB 18 Y HB# 4.270 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 18 and name CB )
( resid 18 and name HB# ) 2.0709 0.2000
!! 21 N CB 21 N HB# 1.140 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 21 and name CB )
( resid 21 and name HB# ) 0.5529 0.2000
!! 22 V CB 22 V HB -32.160 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 22 and name CB )
( resid 22 and name HB ) -15.5976 0.2000
!! 23 C CB 23 C HB# 60.080 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 23 and name CB )
( resid 23 and name HB# ) 29.1388 0.2000
!! 26 C CB 26 C HB# 26.750 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 26 and name CB )
( resid 26 and name HB# ) 12.9737 0.2000
!! 28 D CB 28 D HB# -44.050 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 28 and name CB )
( resid 28 and name HB# ) -21.3642 0.2000
!! 29 Q CB 29 Q HB# -5.270 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 29 and name CB )
( resid 29 and name HB# ) -2.5559 0.2000
!! 30 V CB 30 V HB -8.660 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 30 and name CB )
( resid 30 and name HB ) -4.2001 0.2000
!! 31 A CB 31 A HB# -4.040 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 31 and name CB )
!! ( resid 31 and name HB# ) -1.9594 0.2000
( resid 31 and name HB# ) -5.8782 0.2000
!! 32 A CB 32 A HB# -9.040 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 32 and name CB )
!! ( resid 32 and name HB# ) -4.3844 0.2000
( resid 32 and name HB# ) -13.1532 0.2000
!! 33 C CB 33 C HB# 2.460 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 33 and name CB )
( resid 33 and name HB# ) 1.1931 0.2000
!! 34 E CB 34 E HB# 38.640 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 34 and name CB )
( resid 34 and name HB# ) 18.7404 0.2000
!! 35 A CB 35 A HB# -12.690 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 35 and name CB )
!! ( resid 35 and name HB# ) -6.1546 0.2000
( resid 35 and name HB# ) -18.4638 0.2000
!! 37 C CB 37 C HB# -30.010 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 37 and name CB )
( resid 37 and name HB# ) -14.5549 0.2000
!! 38 F CB 38 F HB# 16.080 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 38 and name CB )
( resid 38 and name HB# ) 7.7988 0.2000
!! 40 N CB 40 N HB# 26.150 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 40 and name CB )
( resid 40 and name HB# ) 12.6827 0.2000
!! 41 D CB 41 D HB# -6.900 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 41 and name CB )
( resid 41 and name HB# ) -3.3465 0.2000
!! 42 V CB 42 V HB -6.270 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 42 and name CB )
( resid 42 and name HB ) -3.0409 0.2000
!! 43 Y CB 43 Y HB# -58.690 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 43 and name CB )
( resid 43 and name HB# ) -28.4646 0.2000
!! 44 T CB 44 T HB 40.830 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 44 and name CB )
( resid 44 and name HB ) 19.8026 0.2000
!! 45 A CB 45 A HB# -16.870 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 45 and name CB )
!! ( resid 45 and name HB# ) -8.1820 0.2000
( resid 45 and name HB# ) -24.5460 0.2000
!! 46 C CB 46 C HB# -2.900 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 46 and name CB )
( resid 46 and name HB# ) -1.4065 0.2000
!! 47 H CB 47 H HB# -56.600 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 47 and name CB )
( resid 47 and name HB# ) -27.4510 0.2000
!! 48 E CB 48 E HB# 11.650 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 48 and name CB )
( resid 48 and name HB# ) 5.6502 0.2000
!! 49 A CB 49 A HB# -7.110 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 49 and name CB )
( resid 49 and name HB# ) -10.3452 0.2000
!! ( resid 49 and name HB# ) -3.4484 0.2000
!! 50 Q CB 50 Q HB# 2.580 1.000 1.00
assign ( resid 500 and name OO )
( resid 500 and name Z )
( resid 500 and name X )
( resid 500 and name Y )
( resid 50 and name CB )
( resid 50 and name HB# ) 1.2513 0.2000
# Restraints file 6: PEG_nh.tbl
!! 4 ASP N 4 ASP H 3.890 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 4 and name N )
( resid 4 and name HN ) 3.8900 0.2000
!! 5 GLU N 5 GLU H -3.550 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 5 and name N )
( resid 5 and name HN ) -3.5500 0.2000
!! 7 CYS N 7 CYS H 2.900 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 7 and name N )
( resid 7 and name HN ) 2.9000 0.2000
!! 8 ARG N 8 ARG H -2.670 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 8 and name N )
( resid 8 and name HN ) -2.6700 0.2000
!! 9 ALA N 9 ALA H -5.060 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 9 and name N )
( resid 9 and name HN ) -5.0600 0.2000
!! 10 ARG N 10 ARG H 3.510 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 10 and name N )
( resid 10 and name HN ) 3.5100 0.2000
!! 11 MET N 11 MET H 1.380 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 11 and name N )
( resid 11 and name HN ) 1.3800 0.2000
!! 12 THR N 12 THR H -2.550 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 12 and name N )
( resid 12 and name HN ) -2.5500 0.2000
!! 14 LYS N 14 LYS H 1.510 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 14 and name N )
( resid 14 and name HN ) 1.5100 0.2000
!! 15 GLU N 15 GLU H -1.470 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 15 and name N )
( resid 15 and name HN ) -1.4700 0.2000
!! 16 PHE N 16 PHE H -3.610 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 16 and name N )
( resid 16 and name HN ) -3.6100 0.2000
!! 17 ASN N 17 ASN H -1.020 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 17 and name N )
( resid 17 and name HN ) -1.0200 0.2000
!! 18 TYR N 18 TYR H 3.390 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 18 and name N )
( resid 18 and name HN ) 3.3900 0.2000
!! 19 LYS N 19 LYS H -1.610 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 19 and name N )
( resid 19 and name HN ) -1.6100 0.2000
!! 20 SER N 20 SER H -2.560 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 20 and name N )
( resid 20 and name HN ) -2.5600 0.2000
!! 21 ASN N 21 ASN H 1.500 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 21 and name N )
( resid 21 and name HN ) 1.5000 0.2000
!! 22 VAL N 22 VAL H 1.910 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 22 and name N )
( resid 22 and name HN ) 1.9100 0.2000
!! 23 CYS N 23 CYS H -1.300 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 23 and name N )
( resid 23 and name HN ) -1.3000 0.2000
!! 24 ASN N 24 ASN H -0.390 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 24 and name N )
( resid 24 and name HN ) -0.3900 0.2000
!! 25 GLY N 25 GLY H 9.820 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 25 and name N )
( resid 25 and name HN ) 9.8200 0.2000
!! 26 CYS N 26 CYS H -10.080 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 26 and name N )
( resid 26 and name HN ) -10.0800 0.2000
!! 27 GLY N 27 GLY H -1.310 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 27 and name N )
( resid 27 and name HN ) -1.3100 0.2000
!! 28 ASP N 28 ASP H -6.660 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 28 and name N )
( resid 28 and name HN ) -6.6600 0.2000
!! 29 GLN N 29 GLN H -7.500 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 29 and name N )
( resid 29 and name HN ) -7.5000 0.2000
!! 30 VAL N 30 VAL H 10.490 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 30 and name N )
( resid 30 and name HN ) 10.4900 0.2000
!! 31 ALA N 31 ALA H 5.850 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 31 and name N )
( resid 31 and name HN ) 5.8500 0.2000
!! 32 ALA N 32 ALA H 5.110 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 32 and name N )
( resid 32 and name HN ) 5.1100 0.2000
!! 33 CYS N 33 CYS H 14.650 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 33 and name N )
( resid 33 and name HN ) 14.6500 0.2000
!! 34 GLU N 34 GLU H 8.630 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 34 and name N )
( resid 34 and name HN ) 8.6300 0.2000
!! 35 ALA N 35 ALA H -2.550 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 35 and name N )
( resid 35 and name HN ) -2.5500 0.2000
!! 36 GLU N 36 GLU H -5.110 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 36 and name N )
( resid 36 and name HN ) -5.1100 0.2000
!! 37 CYS N 37 CYS H 3.410 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 37 and name N )
( resid 37 and name HN ) 3.4100 0.2000
!! 38 PHE N 38 PHE H 0.690 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 38 and name N )
( resid 38 and name HN ) 0.6900 0.2000
!! 39 ARG N 39 ARG H -11.510 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 39 and name N )
( resid 39 and name HN ) -11.5100 0.2000
!! 40 ASN N 40 ASN H -2.290 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 40 and name N )
( resid 40 and name HN ) -2.2900 0.2000
!! 41 ASP N 41 ASP H -3.580 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 41 and name N )
( resid 41 and name HN ) -3.5800 0.2000
!! 42 VAL N 42 VAL H -10.770 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 42 and name N )
( resid 42 and name HN ) -10.7700 0.2000
!! 43 TYR N 43 TYR H -5.430 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 43 and name N )
( resid 43 and name HN ) -5.4300 0.2000
!! 44 THR N 44 THR H -2.130 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 44 and name N )
( resid 44 and name HN ) -2.1300 0.2000
!! 45 ALA N 45 ALA H -8.550 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 45 and name N )
( resid 45 and name HN ) -8.5500 0.2000
!! 46 CYS N 46 CYS H -7.210 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 46 and name N )
( resid 46 and name HN ) -7.2100 0.2000
!! 47 HIS N 47 HIS H 0.080 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 47 and name N )
( resid 47 and name HN ) 0.0800 0.2000
!! 48 GLU N 48 GLU H -4.550 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 48 and name N )
( resid 48 and name HN ) -4.5500 0.2000
!! 49 ALA N 49 ALA H -10.290 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 49 and name N )
( resid 49 and name HN ) -10.2900 0.2000
!! 50 GLN N 50 GLN H 4.220 1.000 1.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 50 and name N )
( resid 50 and name HN ) 4.2200 0.2000
# Restraints file 7: PEG_cn.tbl
!! 3 PRO C 4 ASP N 0.590 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 3 and name C )
( resid 4 and name N ) 4.8793 0.2000
!! 4 ASP C 5 GLU N -0.800 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 4 and name C )
( resid 5 and name N ) -6.6160 0.2000
!! 7 CYS C 8 ARG N 0.420 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 7 and name C )
( resid 8 and name N ) 3.4734 0.2000
!! 8 ARG C 9 ALA N -0.910 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 8 and name C )
( resid 9 and name N ) -7.5257 0.2000
!! 9 ALA C 10 ARG N -0.530 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 9 and name C )
( resid 10 and name N ) -4.3831 0.2000
!! 10 ARG C 11 MET N 1.150 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 10 and name C )
( resid 11 and name N ) 9.5105 0.2000
!! 11 MET C 12 THR N -1.500 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 11 and name C )
( resid 12 and name N ) -12.4050 0.2000
!! 13 HIS C 14 LYS N -0.140 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 13 and name C )
( resid 14 and name N ) -1.1578 0.2000
!! 14 LYS C 15 GLU N 1.180 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 14 and name C )
( resid 15 and name N ) 9.7586 0.2000
!! 15 GLU C 16 PHE N -1.800 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 15 and name C )
( resid 16 and name N ) -14.8860 0.2000
!! 16 PHE C 17 ASN N 0.280 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 16 and name C )
( resid 17 and name N ) 2.3156 0.2000
!! 17 ASN C 18 TYR N 0.500 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 17 and name C )
( resid 18 and name N ) 4.1350 0.2000
!! 19 LYS C 20 SER N -0.610 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 19 and name C )
( resid 20 and name N ) -5.0447 0.2000
!! 20 SER C 21 ASN N -1.060 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 20 and name C )
( resid 21 and name N ) -8.7662 0.2000
!! 21 ASN C 22 VAL N 1.780 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 21 and name C )
( resid 22 and name N ) 14.7206 0.2000
!! 22 VAL C 23 CYS N -1.790 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 22 and name C )
( resid 23 and name N ) -14.8033 0.2000
!! 23 CYS C 24 ASN N 0.930 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 23 and name C )
( resid 24 and name N ) 7.6911 0.2000
!! 24 ASN C 25 GLY N -0.830 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 24 and name C )
( resid 25 and name N ) -6.8641 0.2000
!! 25 GLY C 26 CYS N -0.430 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 25 and name C )
( resid 26 and name N ) -3.5561 0.2000
!! 26 CYS C 27 GLY N 0.840 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 26 and name C )
( resid 27 and name N ) 6.9468 0.2000
!! 27 GLY C 28 ASP N -0.120 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 27 and name C )
( resid 28 and name N ) -0.9924 0.2000
!! 28 ASP C 29 GLN N 0.540 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 28 and name C )
( resid 29 and name N ) 4.4658 0.2000
!! 29 GLN C 30 VAL N 1.350 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 29 and name C )
( resid 30 and name N ) 11.1645 0.2000
!! 32 ALA C 33 CYS N 0.170 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 32 and name C )
( resid 33 and name N ) 1.4059 0.2000
!! 33 CYS C 34 GLU N -0.790 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 33 and name C )
( resid 34 and name N ) -6.5333 0.2000
!! 34 GLU C 35 ALA N 0.090 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 34 and name C )
( resid 35 and name N ) 0.7443 0.2000
!! 37 CYS C 38 PHE N -0.530 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 37 and name C )
( resid 38 and name N ) -4.3831 0.2000
!! 38 PHE C 39 ARG N 0.510 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 38 and name C )
( resid 39 and name N ) 4.2177 0.2000
!! 39 ARG C 40 ASN N -1.000 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 39 and name C )
( resid 40 and name N ) -8.2700 0.2000
!! 40 ASN C 41 ASP N -0.330 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 40 and name C )
( resid 41 and name N ) -2.7291 0.2000
!! 41 ASP C 42 VAL N 0.690 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 41 and name C )
( resid 42 and name N ) 5.7063 0.2000
!! 42 VAL C 43 TYR N -0.070 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 42 and name C )
( resid 43 and name N ) -0.5789 0.2000
!! 43 TYR C 44 THR N 1.150 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 43 and name C )
( resid 44 and name N ) 9.5105 0.2000
!! 44 THR C 45 ALA N 0.230 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 44 and name C )
( resid 45 and name N ) 1.9021 0.2000
!! 45 ALA C 46 CYS N -1.160 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 45 and name C )
( resid 46 and name N ) -9.5932 0.2000
!! 46 CYS C 47 HIS N 1.420 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 46 and name C )
( resid 47 and name N ) 11.7434 0.2000
!! 47 HIS C 48 GLU N -0.080 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 47 and name C )
( resid 48 and name N ) -0.6616 0.2000
!! 48 GLU C 49 ALA N 0.780 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 48 and name C )
( resid 49 and name N ) 6.4506 0.2000
!! 49 ALA C 50 GLN N -0.320 0.125 8.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 49 and name C )
( resid 50 and name N ) -2.6464 0.2000
# Restraints file 8: PEG_caha.tbl
!! 3 PRO HA 3 PRO CA 5.750 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 3 and name HA )
( resid 3 and name CA ) 2.7887 0.2000
!! 4 ASP HA 4 ASP CA 5.800 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 4 and name HA )
( resid 4 and name CA ) 2.8130 0.2000
!! 5 GLU HA 5 GLU CA -1.090 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 5 and name HA )
( resid 5 and name CA ) -0.5287 0.2000
!! 7 CYS HA 7 CYS CA 29.770 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 7 and name HA )
( resid 7 and name CA ) 14.4384 0.2000
!! 8 ARG HA 8 ARG CA -26.330 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 8 and name HA )
( resid 8 and name CA ) -12.7700 0.2000
!! 9 ALA HA 9 ALA CA 3.730 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 9 and name HA )
( resid 9 and name CA ) 1.8091 0.2000
!! 10 ARG HA 10 ARG CA 7.840 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 10 and name HA )
( resid 10 and name CA ) 3.8024 0.2000
!! 11 MET HA 11 MET CA 17.900 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 11 and name HA )
( resid 11 and name CA ) 8.6815 0.2000
!! 13 HIS HA 13 HIS CA -9.300 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 13 and name HA )
( resid 13 and name CA ) -4.5105 0.2000
!! 14 LYS HA 14 LYS CA 34.040 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 14 and name HA )
( resid 14 and name CA ) 16.5094 0.2000
!! 15 GLU HA 15 GLU CA -27.300 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 15 and name HA )
( resid 15 and name CA ) -13.2405 0.2000
!! 16 PHE HA 16 PHE CA 2.360 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 16 and name HA )
( resid 16 and name CA ) 1.1446 0.2000
!! 17 ASN HA 17 ASN CA 2.960 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 17 and name HA )
( resid 17 and name CA ) 1.4356 0.2000
!! 18 TYR HA 18 TYR CA 11.880 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 18 and name HA )
( resid 18 and name CA ) 5.7618 0.2000
!! 19 LYS HA 19 LYS CA -22.000 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 19 and name HA )
( resid 19 and name CA ) -10.6700 0.2000
!! 20 SER HA 20 SER CA -0.290 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 20 and name HA )
( resid 20 and name CA ) -0.1406 0.2000
!! 21 ASN HA 21 ASN CA 23.950 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 21 and name HA )
( resid 21 and name CA ) 11.6157 0.2000
!! 22 VAL HA 22 VAL CA -17.530 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 22 and name HA )
( resid 22 and name CA ) -8.5021 0.2000
!! 23 CYS HA 23 CYS CA -6.420 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 23 and name HA )
( resid 23 and name CA ) -3.1137 0.2000
!! 24 ASN HA 24 ASN CA -11.100 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 24 and name HA )
( resid 24 and name CA ) -5.3835 0.2000
!! 25 GLY HA# 25 GLY CA 10.899 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 25 and name HA# )
( resid 25 and name CA ) 5.2860 0.2000
!! 26 CYS HA 26 CYS CA -27.590 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 26 and name HA )
( resid 26 and name CA ) -13.3811 0.2000
!! 27 GLY HA# 27 GLY CA 7.160 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 27 and name HA# )
( resid 27 and name CA ) 3.4726 0.2000
!! 28 ASP HA 28 ASP CA 0.890 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 28 and name HA )
( resid 28 and name CA ) 0.4316 0.2000
!! 29 GLN HA 29 GLN CA -12.210 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 29 and name HA )
( resid 29 and name CA ) -5.9219 0.2000
!! 30 VAL HA 30 VAL CA -6.360 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 30 and name HA )
( resid 30 and name CA ) -3.0846 0.2000
!! 31 ALA HA 31 ALA CA -9.950 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 31 and name HA )
( resid 31 and name CA ) -4.8257 0.2000
!! 32 ALA HA 32 ALA CA -10.110 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 32 and name HA )
( resid 32 and name CA ) -4.9033 0.2000
!! 33 CYS HA 33 CYS CA 14.580 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 33 and name HA )
( resid 33 and name CA ) 7.0713 0.2000
!! 34 GLU HA 34 GLU CA -6.100 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 34 and name HA )
( resid 34 and name CA ) -2.9585 0.2000
!! 35 ALA HA 35 ALA CA -17.350 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 35 and name HA )
( resid 35 and name CA ) -8.4147 0.2000
!! 36 GLU HA 36 GLU CA -24.520 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 36 and name HA )
( resid 36 and name CA ) -11.8922 0.2000
!! 37 CYS HA 37 CYS CA 29.540 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 37 and name HA )
( resid 37 and name CA ) 14.3269 0.2000
!! 38 PHE HA 38 PHE CA 9.780 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 38 and name HA )
( resid 38 and name CA ) 4.7433 0.2000
!! 39 ARG HA 39 ARG CA -21.870 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 39 and name HA )
( resid 39 and name CA ) -10.6069 0.2000
!! 40 ASN HA 40 ASN CA 20.230 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 40 and name HA )
( resid 40 and name CA ) 9.8116 0.2000
!! 41 ASP HA 41 ASP CA -3.310 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 41 and name HA )
( resid 41 and name CA ) -1.6054 0.2000
!! 42 VAL HA 42 VAL CA -15.530 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 42 and name HA )
( resid 42 and name CA ) -7.5320 0.2000
!! 43 TYR HA 43 TYR CA 31.810 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 43 and name HA )
( resid 43 and name CA ) 15.4278 0.2000
!! 44 THR HA 44 THR CA -3.880 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 44 and name HA )
( resid 44 and name CA ) -1.8818 0.2000
!! 45 ALA HA 45 ALA CA -16.980 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 45 and name HA )
( resid 45 and name CA ) -8.2353 0.2000
!! 46 CYS HA 46 CYS CA 5.220 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 46 and name HA )
( resid 46 and name CA ) 2.5317 0.2000
!! 47 HIS HA 47 HIS CA 18.900 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 47 and name HA )
( resid 47 and name CA ) 9.1665 0.2000
!! 48 GLU HA 48 GLU CA -2.870 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 48 and name HA )
( resid 48 and name CA ) -1.3920 0.2000
!! 49 ALA HA 49 ALA CA -15.730 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 49 and name HA )
( resid 49 and name CA ) -7.6291 0.2000
!! 50 GLN HA 50 GLN CA 13.830 1.000 0.50
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 50 and name HA )
( resid 50 and name CA ) 6.7075 0.2000
# Restraints file 9: PEG_cac.tbl
!! 3 PRO CA 3 PRO C -1.100 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 3 and name CA )
( resid 3 and name C ) -5.5000 0.2000
!! 4 ASP CA 4 ASP C -0.220 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 4 and name CA )
( resid 4 and name C ) -1.1000 0.2000
!! 5 GLU CA 5 GLU C 2.340 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 5 and name CA )
( resid 5 and name C ) 11.7000 0.2000
!! 7 CYS CA 7 CYS C -1.010 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 7 and name CA )
( resid 7 and name C ) -5.0500 0.2000
!! 8 ARG CA 8 ARG C 1.160 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 8 and name CA )
( resid 8 and name C ) 5.8000 0.2000
!! 9 ALA CA 9 ALA C 1.190 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 9 and name CA )
( resid 9 and name C ) 5.9500 0.2000
!! 10 ARG CA 10 ARG C -2.340 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 10 and name CA )
( resid 10 and name C ) -11.7000 0.2000
!! 11 MET CA 11 MET C 0.640 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 11 and name CA )
( resid 11 and name C ) 3.2000 0.2000
!! 13 HIS CA 13 HIS C -2.170 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 13 and name CA )
( resid 13 and name C ) -10.8500 0.2000
!! 14 LYS CA 14 LYS C 0.260 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 14 and name CA )
( resid 14 and name C ) 1.3000 0.2000
!! 15 GLU CA 15 GLU C 0.190 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 15 and name CA )
( resid 15 and name C ) 0.9500 0.2000
!! 16 PHE CA 16 PHE C 2.550 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 16 and name CA )
( resid 16 and name C ) 12.7500 0.2000
!! 17 ASN CA 17 ASN C -1.870 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 17 and name CA )
( resid 17 and name C ) -9.3500 0.2000
!! 18 TYR CA 18 TYR C 0.000 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 18 and name CA )
( resid 18 and name C ) 0.0000 0.2000
!! 19 LYS CA 19 LYS C 1.370 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 19 and name CA )
( resid 19 and name C ) 6.8500 0.2000
!! 20 SER CA 20 SER C 0.630 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 20 and name CA )
( resid 20 and name C ) 3.1500 0.2000
!! 21 ASN CA 21 ASN C -1.050 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 21 and name CA )
( resid 21 and name C ) -5.2500 0.2000
!! 22 VAL CA 22 VAL C -0.180 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 22 and name CA )
( resid 22 and name C ) -0.9000 0.2000
!! 23 CYS CA 23 CYS C 3.440 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 23 and name CA )
( resid 23 and name C ) 17.2000 0.2000
!! 24 ASN CA 24 ASN C -1.660 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 24 and name CA )
( resid 24 and name C ) -8.3000 0.2000
!! 25 GLY CA 25 GLY C 0.050 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 25 and name CA )
( resid 25 and name C ) 0.2500 0.2000
!! 26 CYS CA 26 CYS C 0.370 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 26 and name CA )
( resid 26 and name C ) 1.8500 0.2000
!! 27 GLY CA 27 GLY C -2.290 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 27 and name CA )
( resid 27 and name C ) -11.4500 0.2000
!! 28 ASP CA 28 ASP C 2.490 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 28 and name CA )
( resid 28 and name C ) 12.4500 0.2000
!! 29 GLN CA 29 GLN C -0.960 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 29 and name CA )
( resid 29 and name C ) -4.8000 0.2000
!! 30 VAL CA 30 VAL C -0.230 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 30 and name CA )
( resid 30 and name C ) -1.1500 0.2000
!! 31 ALA CA 31 ALA C 3.480 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 31 and name CA )
( resid 31 and name C ) 17.4000 0.2000
!! 32 ALA CA 32 ALA C 0.400 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 32 and name CA )
( resid 32 and name C ) 2.0000 0.2000
!! 33 CYS CA 33 CYS C -0.790 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 33 and name CA )
( resid 33 and name C ) -3.9500 0.2000
!! 34 GLU CA 34 GLU C 0.520 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 34 and name CA )
( resid 34 and name C ) 2.6000 0.2000
!! 35 ALA CA 35 ALA C 1.990 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 35 and name CA )
( resid 35 and name C ) 9.9500 0.2000
!! 36 GLU CA 36 GLU C -0.980 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 36 and name CA )
( resid 36 and name C ) -4.9000 0.2000
!! 37 CYS CA 37 CYS C -3.420 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 37 and name CA )
( resid 37 and name C ) -17.1000 0.2000
!! 38 PHE CA 38 PHE C 2.060 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 38 and name CA )
( resid 38 and name C ) 10.3000 0.2000
!! 39 ARG CA 39 ARG C -0.250 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 39 and name CA )
( resid 39 and name C ) -1.2500 0.2000
!! 40 ASN CA 40 ASN C -2.270 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 40 and name CA )
( resid 40 and name C ) -11.3500 0.2000
!! 41 ASP CA 41 ASP C 2.900 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 41 and name CA )
( resid 41 and name C ) 14.5000 0.2000
!! 42 VAL CA 42 VAL C -0.030 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 42 and name CA )
( resid 42 and name C ) -0.1500 0.2000
!! 43 TYR CA 43 TYR C -1.960 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 43 and name CA )
( resid 43 and name C ) -9.8000 0.2000
!! 44 THR CA 44 THR C 0.010 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 44 and name CA )
( resid 44 and name C ) 0.0500 0.2000
!! 45 ALA CA 45 ALA C 2.050 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 45 and name CA )
( resid 45 and name C ) 10.2500 0.2000
!! 46 CYS CA 46 CYS C -0.740 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 46 and name CA )
( resid 46 and name C ) -3.7000 0.2000
!! 47 HIS CA 47 HIS C -2.430 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 47 and name CA )
( resid 47 and name C ) -12.1500 0.2000
!! 48 GLU CA 48 GLU C 1.270 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 48 and name CA )
( resid 48 and name C ) 6.3500 0.2000
!! 49 ALA CA 49 ALA C 0.500 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 49 and name CA )
( resid 49 and name C ) 2.5000 0.2000
!! 50 GLN CA 50 GLN C -0.550 0.200 5.00
assign ( resid 600 and name OO )
( resid 600 and name Z )
( resid 600 and name X )
( resid 600 and name Y )
( resid 50 and name CA )
( resid 50 and name C ) -2.7500 0.2000
Contact the webmaster for help, if required. Sunday, April 28, 2024 9:16:09 PM GMT (wattos1)