NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
652037 |
6svh   |
34434 | cing | 1-original | 2 | DYANA/DIANA | distance | NOE | simple |
# Restraints file 2: bundleShort.lol 16 SER H 22 VAL HA 2.48 # bi-dir reff= 3.64; 16 H 22 HA; norm i-->j: 22 HA ,norm j-->i: 16 H 22 VAL HA 23 TYR H 1.53 # bi-dir reff= 2.25; 23 H 22 HA; norm i-->j: 22 HA ,norm j-->i: 23 H 15 MET HG2 22 VAL HA 0.93 # uni-dir reff= 3.92; 15 HG2 22 HA; norm i-->j: 22 HA; applied: errUni 15 MET QB 22 VAL HA 1.80 # uni-dir reff= 3.90; 15 QB 22 HA; norm i-->j: 22 HA; applied: errUni*errMethyleneQ 22 VAL HA 22 VAL QG2 1.72 # bi-dir reff= 3.32; 22 QG2 22 HA; norm i-->j: 22 HA ,norm j-->i: 22 QG2; applied: *errMeth 22 VAL HA 22 VAL QG1 1.77 # bi-dir reff= 3.42; 22 QG1 22 HA; norm i-->j: 22 HA ,norm j-->i: 22 QG1; applied: *errMeth 22 VAL H 22 VAL HB 1.66 # bi-dir reff= 2.43; 22 H 22 HB; norm i-->j: 22 HB ,norm j-->i: 22 H 21 ARG HA 22 VAL HB 2.60 # uni-dir reff= 4.76; 21 HA 22 HB; norm i-->j: 22 HB; applied: errUni 11 TRP HA 11 TRP HB2 2.00 # bi-dir reff= 2.93; 11 HA 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 11 HA 11 TRP HB2 12 GLU H 2.75 # bi-dir reff= 4.03; 12 H 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 12 H 11 TRP HA 11 TRP HB3 1.78 # bi-dir reff= 2.62; 11 HA 11 HB3; norm i-->j: 11 HB3 ,norm j-->i: 11 HA 7 LEU HB2 11 TRP HB3 2.10 # uni-dir reff= 3.85; 7 HB2 11 HB3; norm i-->j: 11 HB3; applied: errUni 21 ARG HB3 22 VAL H 1.64 # uni-dir reff= 3.00; 22 H 21 HB3; norm i-->j: 21 HB3; applied: errUni 21 ARG H 21 ARG HB3 2.47 # bi-dir reff= 3.62; 21 H 21 HB3; norm i-->j: 21 HB3 ,norm j-->i: 21 H 21 ARG HB3 34 PHE QE 2.52 # uni-dir reff= 5.47; 34 QE 21 HB3; norm i-->j: 21 HB3; applied: errUni*errMethyleneQ UPL SET TO 8A 21 ARG HB3 21 ARG HD2 2.20 # uni-dir reff= 4.04; 21 HD2 21 HB3; norm i-->j: 21 HB3; applied: errUni 21 ARG HB3 21 ARG HD3 2.54 # bi-dir reff= 3.73; 21 HD3 21 HB3; norm i-->j: 21 HB3 ,norm j-->i: 21 HD3 21 ARG HB2 22 VAL H 2.58 # bi-dir reff= 3.79; 22 H 21 HB2; norm i-->j: 21 HB2 ,norm j-->i: 22 H 21 ARG H 21 ARG HB2 1.70 # bi-dir reff= 2.50; 21 H 21 HB2; norm i-->j: 21 HB2 ,norm j-->i: 21 H 21 ARG HA 21 ARG HB2 1.52 # uni-dir reff= 2.79; 21 HA 21 HB2; norm i-->j: 21 HB2; applied: errUni 21 ARG HB2 21 ARG HD2 1.90 # uni-dir reff= 3.49; 21 HD2 21 HB2; norm i-->j: 21 HB2; applied: errUni 21 ARG HB2 21 ARG HD3 1.53 # uni-dir reff= 2.80; 21 HD3 21 HB2; norm i-->j: 21 HB2; applied: errUni 21 ARG HB2 34 PHE QE 2.64 # uni-dir reff= 5.72; 34 QE 21 HB2; norm i-->j: 21 HB2; applied: errUni*errMethyleneQ UPL SET TO 8A 7 LEU HB2 11 TRP HB2 2.49 # bi-dir reff= 3.65; 7 HB2 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 7 HB2 11 TRP HB2 11 TRP HD1 1.95 # bi-dir reff= 2.86; 11 HD1 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 11 HD1 7 LEU HB3 11 TRP HB2 1.78 # bi-dir reff= 2.62; 7 HB3 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 7 HB3 7 LEU QD2 11 TRP HB2 2.32 # bi-dir reff= 4.46; 7 QD2 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 7 QD2; applied: *errMeth 7 LEU QD1 11 TRP HB2 2.51 # bi-dir reff= 4.83; 7 QD1 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 7 QD1; applied: *errMeth 11 TRP HB3 12 GLU H 1.98 # bi-dir reff= 2.91; 12 H 11 HB3; norm i-->j: 11 HB3 ,norm j-->i: 12 H 7 LEU HB3 11 TRP HB3 1.49 # uni-dir reff= 2.72; 7 HB3 11 HB3; norm i-->j: 11 HB3; applied: errUni 7 LEU QD2 11 TRP HB3 2.08 # bi-dir reff= 4.01; 7 QD2 11 HB3; norm i-->j: 11 HB3 ,norm j-->i: 7 QD2; applied: *errMeth 11 TRP HB3 37 PRO HG2 2.22 # uni-dir reff= 4.07; 37 HG2 11 HB3; norm i-->j: 11 HB3; applied: errUni 11 TRP HB3 11 TRP HD1 2.06 # uni-dir reff= 3.77; 11 HD1 11 HB3; norm i-->j: 11 HB3; applied: errUni 7 LEU QD1 11 TRP HB3 1.52 # uni-dir reff= 3.66; 7 QD1 11 HB3; norm i-->j: 11 HB3; applied: errUni*errMeth 37 PRO HA 38 SER H 1.60 # bi-dir reff= 2.35; 38 H 37 HA; norm i-->j: 37 HA ,norm j-->i: 38 H 33 GLN HE21 37 PRO HA 2.11 # uni-dir reff= 3.87; 33 HE21 37 HA; norm i-->j: 37 HA; applied: errUni 33 GLN HE22 37 PRO HA 2.04 # bi-dir reff= 3.00; 33 HE22 37 HA; norm i-->j: 37 HA ,norm j-->i: 33 HE22 9 PRO HB3 10 GLY H 1.96 # bi-dir reff= 4.08; 10 H 9 HB3; norm i-->j: 9 HB3 ,norm j-->i: 10 H; applied: errStereo( 0.0649) 33 GLN H 33 GLN HB2 1.74 # uni-dir reff= 3.19; 33 H 33 HB2; norm i-->j: 33 HB2; applied: errUni 33 GLN HB2 34 PHE H 2.19 # bi-dir reff= 3.22; 34 H 33 HB2; norm i-->j: 33 HB2 ,norm j-->i: 34 H 33 GLN HB2 35 GLU H 1.53 # uni-dir reff= 2.80; 35 H 33 HB2; norm i-->j: 33 HB2; applied: errUni 33 GLN HB2 33 GLN HE21 1.73 # uni-dir reff= 3.18; 33 HE21 33 HB2; norm i-->j: 33 HB2; applied: errUni 33 GLN HB2 33 GLN HE22 2.78 # bi-dir reff= 4.08; 33 HE22 33 HB2; norm i-->j: 33 HB2 ,norm j-->i: 33 HE22 33 GLN HA 33 GLN HB2 1.66 # uni-dir reff= 3.05; 33 HA 33 HB2; norm i-->j: 33 HB2; applied: errUni 29 THR HA 30 ASN H 1.94 # uni-dir reff= 3.57; 30 H 29 HA; norm i-->j: 29 HA; applied: errUni 29 THR H 29 THR HA 1.97 # bi-dir reff= 2.89; 29 H 29 HA; norm i-->j: 29 HA ,norm j-->i: 29 H 11 TRP HE3 25 PHE H 2.06 # bi-dir reff= 3.02; 25 H 11 HE3; norm i-->j: 11 HE3 ,norm j-->i: 25 H 17 ARG QB 18 ASN H 2.00 # bi-dir reff= 3.47; 18 H 17 QB; norm i-->j: 17 QB ,norm j-->i: 18 H; applied: *errMethyleneQ 17 ARG QB 17 ARG HD2 1.41 # uni-dir reff= 3.39; 17 HD2 17 QB; norm i-->j: 17 QB; applied: errUni*errMethyleneQ 17 ARG QB 17 ARG HD3 1.41 # uni-dir reff= 3.06; 17 HD3 17 QB; norm i-->j: 17 QB; applied: errUni*errMethyleneQ 17 ARG HA 17 ARG QB 1.61 # bi-dir reff= 2.79; 17 HA 17 QB; norm i-->j: 17 QB ,norm j-->i: 17 HA; applied: *errMethyleneQ 8 PRO HB3 11 TRP HD1 2.79 # bi-dir reff= 4.10; 11 HD1 8 HB3; norm i-->j: 8 HB3 ,norm j-->i: 11 HD1 8 PRO HB2 11 TRP HE1 2.50 # bi-dir reff= 3.67; 11 HE1 8 HB2; norm i-->j: 8 HB2 ,norm j-->i: 11 HE1 8 PRO HB2 11 TRP HD1 1.75 # bi-dir reff= 2.57; 11 HD1 8 HB2; norm i-->j: 8 HB2 ,norm j-->i: 11 HD1 8 PRO HB2 9 PRO HD2 1.56 # uni-dir reff= 2.86; 9 HD2 8 HB2; norm i-->j: 8 HB2; applied: errUni 35 GLU H 35 GLU HB2 1.78 # bi-dir reff= 2.79; 35 H 35 HB2; norm i-->j: 35 HB2 ,norm j-->i: 35 H; applied: errStereo( 0.0648) 35 GLU HB2 36 ARG H 2.23 # bi-dir reff= 3.74; 36 H 35 HB2; norm i-->j: 35 HB2 ,norm j-->i: 36 H; applied: errStereo( 0.0563) 33 GLN HE21 35 GLU HB2 2.07 # uni-dir reff= 3.80; 33 HE21 35 HB2; norm i-->j: 35 HB2; applied: errUni 33 GLN HE22 35 GLU HB2 2.48 # bi-dir reff= 3.84; 33 HE22 35 HB2; norm i-->j: 35 HB2 ,norm j-->i: 33 HE22; applied: errStereo( 0.0513) 35 GLU HA 35 GLU HB2 1.86 # bi-dir reff= 2.89; 35 HA 35 HB2; norm i-->j: 35 HB2 ,norm j-->i: 35 HA; applied: errStereo( 0.0513) 35 GLU HB3 36 ARG H 2.23 # bi-dir reff= 3.47; 36 H 35 HB3; norm i-->j: 35 HB3 ,norm j-->i: 36 H; applied: errStereo( 0.0560) 35 GLU H 35 GLU HB3 1.78 # bi-dir reff= 3.02; 35 H 35 HB3; norm i-->j: 35 HB3 ,norm j-->i: 35 H; applied: errStereo( 0.0654) 33 GLN HE21 35 GLU HB3 2.07 # uni-dir reff= 3.87; 33 HE21 35 HB3; norm i-->j: 35 HB3; applied: errUni 33 GLN HE22 35 GLU HB3 2.48 # bi-dir reff= 3.95; 33 HE22 35 HB3; norm i-->j: 35 HB3 ,norm j-->i: 33 HE22; applied: errStereo( 0.0416) 35 GLU HA 35 GLU HB3 1.86 # bi-dir reff= 2.83; 35 HA 35 HB3; norm i-->j: 35 HB3 ,norm j-->i: 35 HA; applied: errStereo( 0.0354) 16 SER H 23 TYR QE 2.17 # bi-dir reff= 3.75; 16 H 23 QE; norm i-->j: 23 QE ,norm j-->i: 16 H; applied: *errMethyleneQ 23 TYR QE 25 PHE QD 1.40 # uni-dir reff= 3.59; 25 QD 23 QE; norm i-->j: 23 QE; applied: errUni*errMethyleneQ*errMethyleneQ UPL SET TO 8A 16 SER HA 23 TYR QE 1.58 # uni-dir reff= 3.42; 16 HA 23 QE; norm i-->j: 23 QE; applied: errUni*errMethyleneQ 16 SER QB 23 TYR QE 1.91 # bi-dir reff= 3.91; 16 QB 23 QE; norm i-->j: 23 QE ,norm j-->i: 16 QB; applied: *errMethyleneQ*errMethyleneQ 23 TYR QE 25 PHE HB2 1.59 # bi-dir reff= 2.76; 25 HB2 23 QE; norm i-->j: 23 QE ,norm j-->i: 25 HB2; applied: *errMethyleneQ 23 TYR QE 25 PHE HB3 2.15 # bi-dir reff= 3.72; 25 HB3 23 QE; norm i-->j: 23 QE ,norm j-->i: 25 HB3; applied: *errMethyleneQ 14 ARG HD2 23 TYR QE 1.81 # uni-dir reff= 3.92; 14 HD2 23 QE; norm i-->j: 23 QE; applied: errUni*errMethyleneQ 14 ARG HB3 23 TYR QE 2.26 # bi-dir reff= 3.92; 14 HB3 23 QE; norm i-->j: 23 QE ,norm j-->i: 14 HB3; applied: *errMethyleneQ 14 ARG HB2 23 TYR QE 1.49 # uni-dir reff= 3.23; 14 HB2 23 QE; norm i-->j: 23 QE; applied: errUni*errMethyleneQ 11 TRP HE1 26 ASN HD22 2.62 # bi-dir reff= 3.85; 26 HD22 11 HE1; norm i-->j: 11 HE1 ,norm j-->i: 26 HD22 11 TRP HE1 26 ASN HD21 2.10 # bi-dir reff= 3.08; 26 HD21 11 HE1; norm i-->j: 11 HE1 ,norm j-->i: 26 HD21 8 PRO HG3 11 TRP HE1 2.70 # bi-dir reff= 3.96; 8 HG3 11 HE1; norm i-->j: 11 HE1 ,norm j-->i: 8 HG3 11 TRP HE1 37 PRO HB2 2.05 # uni-dir reff= 3.76; 37 HB2 11 HE1; norm i-->j: 11 HE1; applied: errUni 11 TRP HE1 37 PRO HB3 2.07 # uni-dir reff= 3.80; 37 HB3 11 HE1; norm i-->j: 11 HE1; applied: errUni 27 HIS H 27 HIS HB3 1.92 # bi-dir reff= 3.11; 27 H 27 HB3; norm i-->j: 27 HB3 ,norm j-->i: 27 H; applied: errStereo( 0.0686) 27 HIS H 27 HIS HB2 1.92 # bi-dir reff= 3.03; 27 H 27 HB2; norm i-->j: 27 HB2 ,norm j-->i: 27 H; applied: errStereo( 0.0687) 19 SER H 19 SER HA 2.00 # bi-dir reff= 2.94; 19 H 19 HA; norm i-->j: 19 HA ,norm j-->i: 19 H 19 SER HA 19 SER HB2 1.68 # bi-dir reff= 2.47; 19 HB2 19 HA; norm i-->j: 19 HA ,norm j-->i: 19 HB2 19 SER HA 19 SER HB3 1.82 # bi-dir reff= 2.67; 19 HB3 19 HA; norm i-->j: 19 HA ,norm j-->i: 19 HB3 17 ARG HA 18 ASN H 2.29 # bi-dir reff= 3.36; 18 H 17 HA; norm i-->j: 17 HA ,norm j-->i: 18 H 17 ARG HA 17 ARG HD3 3.30 # bi-dir reff= 5.14; 17 HD3 17 HA; norm i-->j: 17 HA ,norm j-->i: 17 HD3; applied: errStereo( 0.0572) 11 TRP HZ3 26 ASN H 1.91 # uni-dir reff= 3.50; 11 HZ3 26 H; norm i-->j: 26 H; applied: errUni 26 ASN H 31 ALA H 1.70 # uni-dir reff= 3.13; 31 H 26 H; norm i-->j: 26 H; applied: errUni 25 PHE HA 26 ASN H 1.52 # bi-dir reff= 2.23; 25 HA 26 H; norm i-->j: 26 H ,norm j-->i: 25 HA 26 ASN H 26 ASN HA 2.04 # bi-dir reff= 2.99; 26 HA 26 H; norm i-->j: 26 H ,norm j-->i: 26 HA 26 ASN H 26 ASN HD21 3.41 # bi-dir reff= 5.01; 26 HD21 26 H; norm i-->j: 26 H ,norm j-->i: 26 HD21 26 ASN H 26 ASN HB3 1.85 # bi-dir reff= 2.72; 26 HB3 26 H; norm i-->j: 26 H ,norm j-->i: 26 HB3 26 ASN H 31 ALA QB 1.66 # uni-dir reff= 3.99; 31 QB 26 H; norm i-->j: 26 H; applied: errUni*errMeth 26 ASN H 26 ASN HB2 1.89 # bi-dir reff= 2.78; 26 HB2 26 H; norm i-->j: 26 H ,norm j-->i: 26 HB2 38 SER H 38 SER HA 2.11 # bi-dir reff= 3.10; 38 H 38 HA; norm i-->j: 38 HA ,norm j-->i: 38 H 38 SER HA 39 GLY H 1.96 # bi-dir reff= 2.88; 39 H 38 HA; norm i-->j: 38 HA ,norm j-->i: 39 H 38 SER HA 38 SER HB2 1.66 # uni-dir reff= 3.07; 38 HB2 38 HA; norm i-->j: 38 HA; applied: errUni 38 SER HA 38 SER HB3 1.66 # uni-dir reff= 3.05; 38 HB3 38 HA; norm i-->j: 38 HA; applied: errUni 10 GLY HA3 28 ILE HG13 2.22 # bi-dir reff= 3.26; 10 HA3 28 HG13; norm i-->j: 28 HG13 ,norm j-->i: 10 HA3 28 ILE H 28 ILE HG13 1.85 # bi-dir reff= 2.72; 28 H 28 HG13; norm i-->j: 28 HG13 ,norm j-->i: 28 H 28 ILE HA 28 ILE HG13 2.25 # bi-dir reff= 3.30; 28 HA 28 HG13; norm i-->j: 28 HG13 ,norm j-->i: 28 HA 28 ILE HB 28 ILE HG13 1.88 # bi-dir reff= 2.76; 28 HB 28 HG13; norm i-->j: 28 HG13 ,norm j-->i: 28 HB 28 ILE H 28 ILE HG12 2.38 # bi-dir reff= 3.50; 28 H 28 HG12; norm i-->j: 28 HG12 ,norm j-->i: 28 H 28 ILE HA 28 ILE HG12 1.89 # bi-dir reff= 2.77; 28 HA 28 HG12; norm i-->j: 28 HG12 ,norm j-->i: 28 HA 13 LYS HB2 24 TYR QE 1.92 # bi-dir reff= 3.34; 13 HB2 24 QE; norm i-->j: 24 QE ,norm j-->i: 13 HB2; applied: *errMethyleneQ 24 TYR QE 36 ARG QB 1.73 # uni-dir reff= 4.44; 36 QB 24 QE; norm i-->j: 24 QE; applied: errUni*errMethyleneQ*errMethyleneQ 27 HIS HD2 28 ILE HG13 2.17 # uni-dir reff= 3.98; 27 HD2 28 HG13; norm i-->j: 28 HG13; applied: errUni 10 GLY HA2 28 ILE HG13 2.22 # bi-dir reff= 3.26; 10 HA2 28 HG13; norm i-->j: 28 HG13 ,norm j-->i: 10 HA2 10 GLY HA3 28 ILE HG12 2.66 # uni-dir reff= 4.88; 10 HA3 28 HG12; norm i-->j: 28 HG12; applied: errUni 28 ILE HB 28 ILE HG12 1.61 # uni-dir reff= 2.96; 28 HB 28 HG12; norm i-->j: 28 HG12; applied: errUni 24 TYR QE 36 ARG HA 1.99 # bi-dir reff= 3.44; 36 HA 24 QE; norm i-->j: 24 QE ,norm j-->i: 36 HA; applied: *errMethyleneQ 11 TRP HA 12 GLU H 1.49 # bi-dir reff= 2.19; 12 H 11 HA; norm i-->j: 11 HA ,norm j-->i: 12 H 11 TRP HA 27 HIS H 2.56 # bi-dir reff= 3.76; 27 H 11 HA; norm i-->j: 11 HA ,norm j-->i: 27 H 11 TRP HA 26 ASN HA 1.61 # bi-dir reff= 2.36; 26 HA 11 HA; norm i-->j: 11 HA ,norm j-->i: 26 HA 8 PRO HG2 37 PRO HB2 1.85 # uni-dir reff= 3.38; 37 HB2 8 HG2; norm i-->j: 8 HG2; applied: errUni 8 PRO HG2 37 PRO HG2 2.28 # uni-dir reff= 4.19; 37 HG2 8 HG2; norm i-->j: 8 HG2; applied: errUni 8 PRO HG3 11 TRP HD1 2.73 # bi-dir reff= 4.00; 11 HD1 8 HG3; norm i-->j: 8 HG3 ,norm j-->i: 11 HD1 8 PRO HG3 37 PRO HB2 1.68 # uni-dir reff= 3.09; 37 HB2 8 HG3; norm i-->j: 8 HG3; applied: errUni 14 ARG HG2 15 MET H 2.37 # uni-dir reff= 4.35; 15 H 14 HG2; norm i-->j: 14 HG2; applied: errUni 14 ARG HA 14 ARG HG2 1.69 # uni-dir reff= 3.10; 14 HA 14 HG2; norm i-->j: 14 HG2; applied: errUni 12 GLU HG3 14 ARG HG2 2.31 # bi-dir reff= 3.99; 12 HG3 14 HG2; norm i-->j: 14 HG2 ,norm j-->i: 12 HG3; applied: errStereo( 0.1062) 14 ARG H 14 ARG HG2 1.91 # uni-dir reff= 3.57; 14 H 14 HG2; norm i-->j: 14 HG2; applied: errUni 14 ARG HG3 15 MET H 2.37 # bi-dir reff= 4.63; 15 H 14 HG3; norm i-->j: 14 HG3 ,norm j-->i: 15 H; applied: errStereo( 0.0271) 14 ARG HA 14 ARG HG3 1.69 # bi-dir reff= 3.36; 14 HA 14 HG3; norm i-->j: 14 HG3 ,norm j-->i: 14 HA; applied: errStereo( 0.0530) 14 ARG H 14 ARG HG3 1.91 # uni-dir reff= 3.51; 14 H 14 HG3; norm i-->j: 14 HG3; applied: errUni 24 TYR QE 36 ARG HG3 0.75 # uni-dir reff= 4.22; 24 QE 36 HG3; norm i-->j: 36 HG3; applied: errUni*errMethyleneQ UPL SET TO 8A 36 ARG HA 36 ARG HG3 1.89 # bi-dir reff= 2.92; 36 HA 36 HG3; norm i-->j: 36 HG3 ,norm j-->i: 36 HA; applied: errStereo( 0.0525) 36 ARG HG3 37 PRO HD2 1.59 # uni-dir reff= 2.91; 37 HD2 36 HG3; norm i-->j: 36 HG3; applied: errUni 14 ARG H 23 TYR H 2.21 # bi-dir reff= 3.25; 23 H 14 H; norm i-->j: 14 H ,norm j-->i: 23 H 14 ARG H 24 TYR HA 2.21 # bi-dir reff= 3.24; 24 HA 14 H; norm i-->j: 14 H ,norm j-->i: 24 HA 13 LYS HA 14 ARG H 1.49 # bi-dir reff= 2.19; 13 HA 14 H; norm i-->j: 14 H ,norm j-->i: 13 HA 13 LYS HB3 14 ARG H 2.21 # uni-dir reff= 4.06; 13 HB3 14 H; norm i-->j: 14 H; applied: errUni 13 LYS HB2 14 ARG H 2.45 # uni-dir reff= 4.50; 13 HB2 14 H; norm i-->j: 14 H; applied: errUni 13 LYS QG 14 ARG H 1.95 # bi-dir reff= 3.38; 13 QG 14 H; norm i-->j: 14 H ,norm j-->i: 13 QG; applied: *errMethyleneQ 14 ARG H 22 VAL QG1 2.51 # bi-dir reff= 4.84; 22 QG1 14 H; norm i-->j: 14 H ,norm j-->i: 22 QG1; applied: *errMeth 14 ARG H 14 ARG HB2 1.86 # bi-dir reff= 2.73; 14 HB2 14 H; norm i-->j: 14 H ,norm j-->i: 14 HB2 24 TYR HA 25 PHE H 1.51 # bi-dir reff= 2.22; 25 H 24 HA; norm i-->j: 24 HA ,norm j-->i: 25 H 24 TYR H 24 TYR HA 2.08 # bi-dir reff= 3.05; 24 H 24 HA; norm i-->j: 24 HA ,norm j-->i: 24 H 24 TYR HA 24 TYR QD 1.51 # uni-dir reff= 3.28; 24 QD 24 HA; norm i-->j: 24 HA; applied: errUni*errMethyleneQ UPL SET TO 8A 13 LYS HA 24 TYR HA 1.83 # bi-dir reff= 2.69; 13 HA 24 HA; norm i-->j: 24 HA ,norm j-->i: 13 HA 24 TYR HA 24 TYR HB2 2.02 # bi-dir reff= 2.96; 24 HB2 24 HA; norm i-->j: 24 HA ,norm j-->i: 24 HB2 13 LYS QG 24 TYR HA 2.01 # uni-dir reff= 4.36; 13 QG 24 HA; norm i-->j: 24 HA; applied: errUni*errMethyleneQ 35 GLU HA 36 ARG H 1.55 # bi-dir reff= 2.27; 36 H 35 HA; norm i-->j: 35 HA ,norm j-->i: 36 H 35 GLU H 35 GLU HA 2.01 # bi-dir reff= 2.95; 35 H 35 HA; norm i-->j: 35 HA ,norm j-->i: 35 H 35 GLU HA 35 GLU HG2 1.71 # uni-dir reff= 3.83; 35 HG2 35 HA; norm i-->j: 35 HA; applied: errUni 35 GLU HA 35 GLU HG3 1.71 # uni-dir reff= 3.14; 35 HG3 35 HA; norm i-->j: 35 HA; applied: errUni 21 ARG QG 22 VAL H 1.78 # uni-dir reff= 3.86; 22 H 21 QG; norm i-->j: 21 QG; applied: errUni*errMethyleneQ 21 ARG H 21 ARG QG 1.69 # uni-dir reff= 3.67; 21 H 21 QG; norm i-->j: 21 QG; applied: errUni*errMethyleneQ 19 SER HB2 21 ARG QG 1.87 # uni-dir reff= 4.07; 19 HB2 21 QG; norm i-->j: 21 QG; applied: errUni*errMethyleneQ 36 ARG H 36 ARG HG2 2.77 # bi-dir reff= 4.21; 36 H 36 HG2; norm i-->j: 36 HG2 ,norm j-->i: 36 H; applied: errStereo( 0.0354) 36 ARG HA 36 ARG HG2 1.89 # bi-dir reff= 3.17; 36 HA 36 HG2; norm i-->j: 36 HG2 ,norm j-->i: 36 HA; applied: errStereo( 0.0529) 36 ARG HG2 37 PRO HD2 1.59 # bi-dir reff= 3.03; 37 HD2 36 HG2; norm i-->j: 36 HG2 ,norm j-->i: 37 HD2; applied: errStereo( 0.0354) 12 GLU QB 14 ARG HG3 1.18 # bi-dir reff= 4.27; 12 QB 14 HG3; norm i-->j: 14 HG3 ,norm j-->i: 12 QB; applied: errStereo( 0.0354)*errMethyleneQ 36 ARG HG3 37 PRO HD3 2.56 # uni-dir reff= 4.74; 37 HD3 36 HG3; norm i-->j: 36 HG3; applied: errUni 32 SER HA 33 GLN H 1.56 # bi-dir reff= 2.29; 33 H 32 HA; norm i-->j: 32 HA ,norm j-->i: 33 H 32 SER H 32 SER HA 2.02 # bi-dir reff= 2.96; 32 H 32 HA; norm i-->j: 32 HA ,norm j-->i: 32 H 11 TRP HZ3 32 SER HA 2.21 # bi-dir reff= 3.24; 11 HZ3 32 HA; norm i-->j: 32 HA ,norm j-->i: 11 HZ3 32 SER HA 32 SER HB2 1.79 # bi-dir reff= 2.87; 32 HB2 32 HA; norm i-->j: 32 HA ,norm j-->i: 32 HB2; applied: errStereo( 0.0294) 32 SER HA 32 SER HB3 1.79 # bi-dir reff= 2.71; 32 HB3 32 HA; norm i-->j: 32 HA ,norm j-->i: 32 HB3; applied: errStereo( 0.0294) 32 SER HA 33 GLN HB3 2.06 # uni-dir reff= 3.78; 33 HB3 32 HA; norm i-->j: 32 HA; applied: errUni 26 ASN HB3 32 SER HA 2.27 # uni-dir reff= 4.16; 26 HB3 32 HA; norm i-->j: 32 HA; applied: errUni 11 TRP HE3 24 TYR HA 2.26 # uni-dir reff= 4.14; 11 HE3 24 HA; norm i-->j: 24 HA; applied: errUni 25 PHE H 25 PHE HA 2.07 # bi-dir reff= 3.04; 25 H 25 HA; norm i-->j: 25 HA ,norm j-->i: 25 H 25 PHE HA 25 PHE QD 1.81 # bi-dir reff= 3.13; 25 QD 25 HA; norm i-->j: 25 HA ,norm j-->i: 25 QD; applied: *errMethyleneQ 25 PHE HA 25 PHE HB2 1.73 # bi-dir reff= 2.54; 25 HB2 25 HA; norm i-->j: 25 HA ,norm j-->i: 25 HB2 25 PHE HA 25 PHE HB3 2.06 # bi-dir reff= 3.02; 25 HB3 25 HA; norm i-->j: 25 HA ,norm j-->i: 25 HB3 13 LYS HA 24 TYR QD 1.77 # uni-dir reff= 3.83; 24 QD 13 HA; norm i-->j: 13 HA; applied: errUni*errMethyleneQ UPL SET TO 8A 13 LYS HA 24 TYR QE 1.88 # uni-dir reff= 4.08; 24 QE 13 HA; norm i-->j: 13 HA; applied: errUni*errMethyleneQ UPL SET TO 8A 13 LYS HA 13 LYS HB3 1.66 # uni-dir reff= 3.03; 13 HB3 13 HA; norm i-->j: 13 HA; applied: errUni 13 LYS HA 13 LYS HB2 1.81 # bi-dir reff= 2.65; 13 HB2 13 HA; norm i-->j: 13 HA ,norm j-->i: 13 HB2 7 LEU QD2 13 LYS HA 1.39 # uni-dir reff= 3.35; 7 QD2 13 HA; norm i-->j: 13 HA; applied: errUni*errMeth 7 LEU QD2 12 GLU H 2.67 # bi-dir reff= 5.15; 12 H 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 12 H; applied: *errMeth 7 LEU QD2 13 LYS H 2.21 # bi-dir reff= 4.27; 13 H 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 13 H; applied: *errMeth 7 LEU H 7 LEU QD2 2.62 # bi-dir reff= 5.05; 7 H 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 7 H; applied: *errMeth 7 LEU QD2 24 TYR QD 1.75 # uni-dir reff= 4.99; 24 QD 7 QD2; norm i-->j: 7 QD2; applied: errUni*errMeth*errMethyleneQ UPL SET TO 8A 7 LEU QD2 24 TYR QE 1.61 # uni-dir reff= 4.60; 24 QE 7 QD2; norm i-->j: 7 QD2; applied: errUni*errMeth*errMethyleneQ UPL SET TO 8A 7 LEU QD2 12 GLU HA 2.14 # bi-dir reff= 4.12; 12 HA 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 12 HA; applied: *errMeth 7 LEU HA 7 LEU QD2 2.23 # bi-dir reff= 4.29; 7 HA 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 7 HA; applied: *errMeth 7 LEU QD2 13 LYS HB2 1.78 # uni-dir reff= 4.28; 13 HB2 7 QD2; norm i-->j: 7 QD2; applied: errUni*errMeth 7 LEU HB3 7 LEU QD2 1.76 # bi-dir reff= 3.39; 7 HB3 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 7 HB3; applied: *errMeth 24 TYR QE 36 ARG H 2.48 # bi-dir reff= 4.30; 24 QE 36 H; norm i-->j: 36 H ,norm j-->i: 24 QE; applied: *errMethyleneQ 36 ARG H 36 ARG HA 2.00 # bi-dir reff= 2.94; 36 HA 36 H; norm i-->j: 36 H ,norm j-->i: 36 HA 35 GLU HG2 36 ARG H 2.51 # uni-dir reff= 5.05; 35 HG2 36 H; norm i-->j: 36 H; applied: errUni 35 GLU HG3 36 ARG H 2.51 # uni-dir reff= 4.60; 35 HG3 36 H; norm i-->j: 36 H; applied: errUni 36 ARG H 36 ARG HG3 2.77 # bi-dir reff= 4.59; 36 HG3 36 H; norm i-->j: 36 H ,norm j-->i: 36 HG3; applied: errStereo( 0.1047) 23 TYR HA 24 TYR H 1.72 # bi-dir reff= 2.53; 24 H 23 HA; norm i-->j: 23 HA ,norm j-->i: 24 H 23 TYR HA 23 TYR HB3 1.62 # bi-dir reff= 2.46; 23 HB3 23 HA; norm i-->j: 23 HA ,norm j-->i: 23 HB3; applied: errStereo( 0.0051) 23 TYR HA 23 TYR HB2 1.62 # bi-dir reff= 2.39; 23 HB2 23 HA; norm i-->j: 23 HA ,norm j-->i: 23 HB2; applied: errStereo( 0.0050) 22 VAL QG1 23 TYR HA 1.17 # uni-dir reff= 2.80; 22 QG1 23 HA; norm i-->j: 23 HA; applied: errUni*errMeth 18 ASN H 18 ASN HA 2.00 # bi-dir reff= 2.94; 18 H 18 HA; norm i-->j: 18 HA ,norm j-->i: 18 H 18 ASN HA 19 SER H 1.90 # uni-dir reff= 3.49; 19 H 18 HA; norm i-->j: 18 HA; applied: errUni 8 PRO HD2 37 PRO HG2 2.05 # bi-dir reff= 3.01; 8 HD2 37 HG2; norm i-->j: 37 HG2 ,norm j-->i: 8 HD2 12 GLU HA 13 LYS H 1.58 # bi-dir reff= 2.32; 12 HA 13 H; norm i-->j: 13 H ,norm j-->i: 12 HA 13 LYS H 13 LYS HA 2.07 # bi-dir reff= 3.04; 13 HA 13 H; norm i-->j: 13 H ,norm j-->i: 13 HA 12 GLU HG2 13 LYS H 2.38 # bi-dir reff= 3.90; 12 HG2 13 H; norm i-->j: 13 H ,norm j-->i: 12 HG2; applied: errStereo( 0.0658) 12 GLU QB 13 LYS H 2.19 # bi-dir reff= 3.81; 12 QB 13 H; norm i-->j: 13 H ,norm j-->i: 12 QB; applied: *errMethyleneQ 13 LYS H 13 LYS HB3 1.51 # uni-dir reff= 2.77; 13 HB3 13 H; norm i-->j: 13 H; applied: errUni 13 LYS H 13 LYS HB2 1.84 # bi-dir reff= 2.70; 13 HB2 13 H; norm i-->j: 13 H ,norm j-->i: 13 HB2 11 TRP HZ2 26 ASN HD21 2.39 # bi-dir reff= 3.51; 26 HD21 11 HZ2; norm i-->j: 11 HZ2 ,norm j-->i: 26 HD21 11 TRP HZ2 37 PRO HB3 2.02 # uni-dir reff= 3.71; 37 HB3 11 HZ2; norm i-->j: 11 HZ2; applied: errUni 17 ARG HA 18 ASN HA 2.55 # uni-dir reff= 4.69; 17 HA 18 HA; norm i-->j: 18 HA; applied: errUni 18 ASN HA 18 ASN QB 1.64 # bi-dir reff= 2.84; 18 QB 18 HA; norm i-->j: 18 HA ,norm j-->i: 18 QB; applied: *errMethyleneQ 8 PRO HD3 37 PRO HG2 2.66 # bi-dir reff= 3.91; 8 HD3 37 HG2; norm i-->j: 37 HG2 ,norm j-->i: 8 HD3 30 ASN HA 31 ALA H 1.58 # uni-dir reff= 2.91; 31 H 30 HA; norm i-->j: 30 HA; applied: errUni 13 LYS QG 24 TYR QE 1.57 # uni-dir reff= 4.04; 24 QE 13 QG; norm i-->j: 13 QG; applied: errUni*errMethyleneQ*errMethyleneQ UPL SET TO 8A 13 LYS HA 13 LYS QG 1.42 # uni-dir reff= 3.09; 13 HA 13 QG; norm i-->j: 13 QG; applied: errUni*errMethyleneQ 13 LYS HB2 13 LYS QG 1.58 # bi-dir reff= 2.74; 13 HB2 13 QG; norm i-->j: 13 QG ,norm j-->i: 13 HB2; applied: *errMethyleneQ 13 LYS QG 22 VAL QG1 1.23 # uni-dir reff= 3.50; 22 QG1 13 QG; norm i-->j: 13 QG; applied: errUni*errMeth*errMethyleneQ 13 LYS QG 13 LYS QE 1.49 # uni-dir reff= 3.82; 13 QE 13 QG; norm i-->j: 13 QG; applied: errUni*errMethyleneQ*errMethyleneQ 7 LEU H 7 LEU HB2 1.83 # bi-dir reff= 2.69; 7 HB2 7 H; norm i-->j: 7 H ,norm j-->i: 7 HB2 7 LEU H 7 LEU HB3 2.57 # bi-dir reff= 3.77; 7 HB3 7 H; norm i-->j: 7 H ,norm j-->i: 7 HB3 22 VAL H 22 VAL QG2 1.72 # bi-dir reff= 3.30; 22 QG2 22 H; norm i-->j: 22 H ,norm j-->i: 22 QG2; applied: *errMeth 22 VAL H 22 VAL QG1 2.43 # bi-dir reff= 4.67; 22 QG1 22 H; norm i-->j: 22 H ,norm j-->i: 22 QG1; applied: *errMeth 12 GLU HA 12 GLU HG2 2.14 # bi-dir reff= 3.64; 12 HG2 12 HA; norm i-->j: 12 HA ,norm j-->i: 12 HG2; applied: errStereo( 0.0703) 12 GLU H 12 GLU HA 2.13 # bi-dir reff= 3.12; 12 H 12 HA; norm i-->j: 12 HA ,norm j-->i: 12 H 12 GLU HA 12 GLU QB 1.62 # bi-dir reff= 2.81; 12 QB 12 HA; norm i-->j: 12 HA ,norm j-->i: 12 QB; applied: *errMethyleneQ 24 TYR QD 36 ARG HA 1.81 # uni-dir reff= 3.93; 24 QD 36 HA; norm i-->j: 36 HA; applied: errUni*errMethyleneQ UPL SET TO 8A 36 ARG HA 37 PRO HD3 1.62 # bi-dir reff= 2.38; 37 HD3 36 HA; norm i-->j: 36 HA ,norm j-->i: 37 HD3 36 ARG HA 37 PRO HD2 1.60 # bi-dir reff= 2.35; 37 HD2 36 HA; norm i-->j: 36 HA ,norm j-->i: 37 HD2 6 LYS HA 6 LYS QG 1.72 # uni-dir reff= 3.72; 6 HA 6 QG; norm i-->j: 6 QG; applied: errUni*errMethyleneQ 12 GLU H 25 PHE H 1.91 # bi-dir reff= 2.81; 12 H 25 H; norm i-->j: 25 H ,norm j-->i: 12 H 13 LYS HA 25 PHE H 2.13 # uni-dir reff= 3.92; 13 HA 25 H; norm i-->j: 25 H; applied: errUni 25 PHE H 25 PHE HB2 2.14 # bi-dir reff= 3.14; 25 HB2 25 H; norm i-->j: 25 H ,norm j-->i: 25 HB2 24 TYR HB3 25 PHE H 1.76 # uni-dir reff= 3.23; 24 HB3 25 H; norm i-->j: 25 H; applied: errUni 25 PHE H 25 PHE HB3 1.79 # bi-dir reff= 2.63; 25 HB3 25 H; norm i-->j: 25 H ,norm j-->i: 25 HB3 12 GLU QB 25 PHE H 2.49 # bi-dir reff= 4.31; 12 QB 25 H; norm i-->j: 25 H ,norm j-->i: 12 QB; applied: *errMethyleneQ 14 ARG H 14 ARG HA 2.08 # bi-dir reff= 3.05; 14 H 14 HA; norm i-->j: 14 HA ,norm j-->i: 14 H 14 ARG HA 15 MET H 1.70 # bi-dir reff= 2.50; 15 H 14 HA; norm i-->j: 14 HA ,norm j-->i: 15 H 14 ARG HA 14 ARG HD2 1.85 # bi-dir reff= 3.25; 14 HD2 14 HA; norm i-->j: 14 HA ,norm j-->i: 14 HD2; applied: errStereo( 0.0864) 14 ARG HA 14 ARG HB3 1.71 # bi-dir reff= 2.51; 14 HB3 14 HA; norm i-->j: 14 HA ,norm j-->i: 14 HB3 14 ARG HA 14 ARG HB2 2.20 # bi-dir reff= 3.23; 14 HB2 14 HA; norm i-->j: 14 HA ,norm j-->i: 14 HB2 7 LEU QD1 24 TYR QD 1.78 # uni-dir reff= 5.08; 24 QD 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth*errMethyleneQ UPL SET TO 8A 7 LEU QD1 24 TYR QE 1.55 # uni-dir reff= 4.41; 24 QE 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth*errMethyleneQ UPL SET TO 8A 7 LEU HA 7 LEU QD1 1.85 # bi-dir reff= 3.55; 7 HA 7 QD1; norm i-->j: 7 QD1 ,norm j-->i: 7 HA; applied: *errMeth 7 LEU QD1 8 PRO HD3 2.39 # bi-dir reff= 4.60; 8 HD3 7 QD1; norm i-->j: 7 QD1 ,norm j-->i: 8 HD3; applied: *errMeth 7 LEU QD1 8 PRO HD2 2.17 # bi-dir reff= 4.19; 8 HD2 7 QD1; norm i-->j: 7 QD1 ,norm j-->i: 8 HD2; applied: *errMeth 7 LEU QD1 37 PRO HD3 2.35 # uni-dir reff= 5.67; 37 HD3 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth 7 LEU QD1 37 PRO HD2 1.70 # uni-dir reff= 4.09; 37 HD2 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth 7 LEU HB3 7 LEU QD1 1.78 # bi-dir reff= 3.43; 7 HB3 7 QD1; norm i-->j: 7 QD1 ,norm j-->i: 7 HB3; applied: *errMeth 7 LEU QD1 37 PRO HG3 2.08 # uni-dir reff= 5.00; 37 HG3 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth 7 LEU H 7 LEU HA 2.16 # bi-dir reff= 3.17; 7 H 7 HA; norm i-->j: 7 HA ,norm j-->i: 7 H 7 LEU HA 8 PRO HD2 1.83 # bi-dir reff= 2.68; 8 HD2 7 HA; norm i-->j: 7 HA ,norm j-->i: 8 HD2 7 LEU HA 7 LEU HB2 2.08 # bi-dir reff= 3.05; 7 HB2 7 HA; norm i-->j: 7 HA ,norm j-->i: 7 HB2 7 LEU HA 7 LEU HB3 1.87 # bi-dir reff= 2.75; 7 HB3 7 HA; norm i-->j: 7 HA ,norm j-->i: 7 HB3 23 TYR H 23 TYR QD 2.01 # bi-dir reff= 3.48; 23 QD 23 H; norm i-->j: 23 H ,norm j-->i: 23 QD; applied: *errMethyleneQ 23 TYR H 23 TYR HA 2.13 # uni-dir reff= 3.90; 23 HA 23 H; norm i-->j: 23 H; applied: errUni 23 TYR H 23 TYR HB3 2.28 # bi-dir reff= 3.61; 23 HB3 23 H; norm i-->j: 23 H ,norm j-->i: 23 HB3; applied: errStereo( 0.0703) 22 VAL HB 23 TYR H 2.03 # uni-dir reff= 3.73; 22 HB 23 H; norm i-->j: 23 H; applied: errUni 22 VAL QG2 23 TYR H 2.64 # bi-dir reff= 5.08; 22 QG2 23 H; norm i-->j: 23 H ,norm j-->i: 22 QG2; applied: *errMeth 22 VAL QG1 23 TYR H 1.77 # bi-dir reff= 3.41; 22 QG1 23 H; norm i-->j: 23 H ,norm j-->i: 22 QG1; applied: *errMeth 14 ARG HB2 23 TYR H 2.69 # bi-dir reff= 3.95; 14 HB2 23 H; norm i-->j: 23 H ,norm j-->i: 14 HB2 27 HIS H 28 ILE H 1.85 # bi-dir reff= 2.71; 27 H 28 H; norm i-->j: 28 H ,norm j-->i: 27 H 28 ILE H 30 ASN H 2.47 # bi-dir reff= 3.62; 30 H 28 H; norm i-->j: 28 H ,norm j-->i: 30 H 28 ILE H 29 THR H 1.61 # bi-dir reff= 2.37; 29 H 28 H; norm i-->j: 28 H ,norm j-->i: 29 H 27 HIS HA 28 ILE H 1.95 # uni-dir reff= 3.57; 27 HA 28 H; norm i-->j: 28 H; applied: errUni 28 ILE H 28 ILE HA 2.06 # bi-dir reff= 3.03; 28 HA 28 H; norm i-->j: 28 H ,norm j-->i: 28 HA 28 ILE H 28 ILE HB 1.73 # bi-dir reff= 2.54; 28 HB 28 H; norm i-->j: 28 H ,norm j-->i: 28 HB 15 MET HG2 22 VAL QG2 2.34 # uni-dir reff= 5.63; 15 HG2 22 QG2; norm i-->j: 22 QG2; applied: errUni*errMeth 15 MET HG3 22 VAL QG2 2.34 # uni-dir reff= 5.62; 15 HG3 22 QG2; norm i-->j: 22 QG2; applied: errUni*errMeth 16 SER H 21 ARG H 2.38 # bi-dir reff= 3.50; 21 H 16 H; norm i-->j: 16 H ,norm j-->i: 21 H 15 MET HG2 16 SER H 1.80 # uni-dir reff= 3.48; 15 HG2 16 H; norm i-->j: 16 H; applied: errUni 16 SER H 23 TYR QD 1.70 # uni-dir reff= 3.68; 23 QD 16 H; norm i-->j: 16 H; applied: errUni*errMethyleneQ UPL SET TO 8A 16 SER H 16 SER QB 1.49 # bi-dir reff= 2.57; 16 QB 16 H; norm i-->j: 16 H ,norm j-->i: 16 QB; applied: *errMethyleneQ 15 MET HG3 16 SER H 1.80 # uni-dir reff= 3.30; 15 HG3 16 H; norm i-->j: 16 H; applied: errUni 15 MET QB 16 SER H 1.66 # uni-dir reff= 3.60; 15 QB 16 H; norm i-->j: 16 H; applied: errUni*errMethyleneQ 31 ALA HA 32 SER H 1.56 # bi-dir reff= 2.29; 32 H 31 HA; norm i-->j: 31 HA ,norm j-->i: 32 H 31 ALA H 31 ALA HA 2.00 # bi-dir reff= 2.94; 31 H 31 HA; norm i-->j: 31 HA ,norm j-->i: 31 H 11 TRP HE3 12 GLU H 1.71 # uni-dir reff= 3.13; 11 HE3 12 H; norm i-->j: 12 H; applied: errUni 12 GLU H 26 ASN HA 2.42 # bi-dir reff= 3.55; 26 HA 12 H; norm i-->j: 12 H ,norm j-->i: 26 HA 12 GLU H 12 GLU HG2 2.28 # bi-dir reff= 3.43; 12 HG2 12 H; norm i-->j: 12 H ,norm j-->i: 12 HG2; applied: errStereo( 0.0258) 12 GLU H 12 GLU HG3 2.28 # bi-dir reff= 3.82; 12 HG3 12 H; norm i-->j: 12 H ,norm j-->i: 12 HG3; applied: errStereo( 0.1047) 12 GLU H 12 GLU QB 1.85 # bi-dir reff= 3.22; 12 QB 12 H; norm i-->j: 12 H ,norm j-->i: 12 QB; applied: *errMethyleneQ 22 VAL QG1 24 TYR QE 1.72 # uni-dir reff= 4.91; 24 QE 22 QG1; norm i-->j: 22 QG1; applied: errUni*errMeth*errMethyleneQ UPL SET TO 8A 13 LYS HD3 22 VAL QG1 1.72 # uni-dir reff= 4.16; 13 HD3 22 QG1; norm i-->j: 22 QG1; applied: errUni*errMeth 24 TYR H 33 GLN H 2.06 # bi-dir reff= 3.03; 24 H 33 H; norm i-->j: 33 H ,norm j-->i: 24 H 32 SER HB2 33 GLN H 2.48 # bi-dir reff= 3.97; 32 HB2 33 H; norm i-->j: 33 H ,norm j-->i: 32 HB2; applied: errStereo( 0.0529) 33 GLN H 33 GLN QG 1.64 # uni-dir reff= 3.56; 33 QG 33 H; norm i-->j: 33 H; applied: errUni*errMethyleneQ 33 GLN H 33 GLN HB3 1.51 # uni-dir reff= 2.77; 33 HB3 33 H; norm i-->j: 33 H; applied: errUni 32 SER HB3 33 GLN H 2.48 # bi-dir reff= 3.84; 32 HB3 33 H; norm i-->j: 33 H ,norm j-->i: 32 HB3; applied: errStereo( 0.0526) 34 PHE H 35 GLU H 1.78 # bi-dir reff= 2.61; 35 H 34 H; norm i-->j: 34 H ,norm j-->i: 35 H 34 PHE H 34 PHE QD 1.92 # bi-dir reff= 3.33; 34 QD 34 H; norm i-->j: 34 H ,norm j-->i: 34 QD; applied: *errMethyleneQ 33 GLN HA 34 PHE H 1.66 # uni-dir reff= 3.05; 33 HA 34 H; norm i-->j: 34 H; applied: errUni 34 PHE H 34 PHE HA 2.04 # uni-dir reff= 3.74; 34 HA 34 H; norm i-->j: 34 H; applied: errUni 34 PHE H 34 PHE HB3 1.78 # bi-dir reff= 3.25; 34 HB3 34 H; norm i-->j: 34 H ,norm j-->i: 34 HB3; applied: errStereo( 0.0582) 34 PHE H 34 PHE HB2 1.78 # bi-dir reff= 2.76; 34 HB2 34 H; norm i-->j: 34 H ,norm j-->i: 34 HB2; applied: errStereo( 0.0554) 33 GLN HB3 34 PHE H 1.83 # uni-dir reff= 3.35; 33 HB3 34 H; norm i-->j: 34 H; applied: errUni 30 ASN H 31 ALA H 1.91 # bi-dir reff= 2.80; 30 H 31 H; norm i-->j: 31 H ,norm j-->i: 30 H 29 THR H 31 ALA H 2.71 # bi-dir reff= 3.98; 29 H 31 H; norm i-->j: 31 H ,norm j-->i: 29 H 29 THR HB 31 ALA H 2.60 # bi-dir reff= 3.81; 29 HB 31 H; norm i-->j: 31 H ,norm j-->i: 29 HB 30 ASN HB2 31 ALA H 2.36 # uni-dir reff= 4.34; 30 HB2 31 H; norm i-->j: 31 H; applied: errUni 30 ASN HB3 31 ALA H 3.14 # bi-dir reff= 4.61; 30 HB3 31 H; norm i-->j: 31 H ,norm j-->i: 30 HB3 26 ASN HB3 31 ALA H 1.78 # bi-dir reff= 2.61; 26 HB3 31 H; norm i-->j: 31 H ,norm j-->i: 26 HB3 31 ALA H 31 ALA QB 1.62 # bi-dir reff= 3.12; 31 QB 31 H; norm i-->j: 31 H ,norm j-->i: 31 QB; applied: *errMeth 29 THR QG2 31 ALA H 2.92 # bi-dir reff= 5.62; 29 QG2 31 H; norm i-->j: 31 H ,norm j-->i: 29 QG2; applied: *errMeth 26 ASN HB2 31 ALA H 2.67 # bi-dir reff= 3.92; 26 HB2 31 H; norm i-->j: 31 H ,norm j-->i: 26 HB2 11 TRP HZ2 31 ALA QB 2.11 # uni-dir reff= 5.09; 11 HZ2 31 QB; norm i-->j: 31 QB; applied: errUni*errMeth 29 THR HB 31 ALA QB 2.23 # bi-dir reff= 4.31; 29 HB 31 QB; norm i-->j: 31 QB ,norm j-->i: 29 HB; applied: *errMeth 28 ILE H 29 THR QG2 2.42 # uni-dir reff= 5.83; 28 H 29 QG2; norm i-->j: 29 QG2; applied: errUni*errMeth 29 THR QG2 30 ASN H 2.75 # bi-dir reff= 5.31; 30 H 29 QG2; norm i-->j: 29 QG2 ,norm j-->i: 30 H; applied: *errMeth 29 THR H 29 THR QG2 1.66 # bi-dir reff= 3.20; 29 H 29 QG2; norm i-->j: 29 QG2 ,norm j-->i: 29 H; applied: *errMeth 26 ASN HD22 29 THR QG2 2.14 # bi-dir reff= 4.13; 26 HD22 29 QG2; norm i-->j: 29 QG2 ,norm j-->i: 26 HD22; applied: *errMeth 28 ILE HB 29 THR QG2 1.61 # uni-dir reff= 3.88; 28 HB 29 QG2; norm i-->j: 29 QG2; applied: errUni*errMeth 27 HIS H 29 THR H 2.39 # uni-dir reff= 4.39; 29 H 27 H; norm i-->j: 27 H; applied: errUni 27 HIS H 27 HIS HD2 1.81 # uni-dir reff= 3.31; 27 HD2 27 H; norm i-->j: 27 H; applied: errUni 26 ASN HA 27 HIS H 1.53 # bi-dir reff= 2.24; 26 HA 27 H; norm i-->j: 27 H ,norm j-->i: 26 HA 27 HIS H 28 ILE HG13 2.18 # uni-dir reff= 4.00; 28 HG13 27 H; norm i-->j: 27 H; applied: errUni 26 ASN HB2 27 HIS H 2.54 # uni-dir reff= 4.66; 26 HB2 27 H; norm i-->j: 27 H; applied: errUni 26 ASN HB3 31 ALA QB 1.96 # bi-dir reff= 3.79; 26 HB3 31 QB; norm i-->j: 31 QB ,norm j-->i: 26 HB3; applied: *errMeth 26 ASN HA 28 ILE H 1.90 # uni-dir reff= 3.49; 28 H 26 HA; norm i-->j: 26 HA; applied: errUni 26 ASN HA 29 THR H 2.01 # uni-dir reff= 3.69; 29 H 26 HA; norm i-->j: 26 HA; applied: errUni 26 ASN HA 26 ASN HB3 2.06 # bi-dir reff= 3.02; 26 HB3 26 HA; norm i-->j: 26 HA ,norm j-->i: 26 HB3 26 ASN HA 26 ASN HB2 1.79 # bi-dir reff= 2.63; 26 HB2 26 HA; norm i-->j: 26 HA ,norm j-->i: 26 HB2 8 PRO HD3 37 PRO HG3 3.67 # bi-dir reff= 5.39; 37 HG3 8 HD3; norm i-->j: 8 HD3 ,norm j-->i: 37 HG3 8 PRO HA 9 PRO HD2 1.83 # uni-dir reff= 3.35; 8 HA 9 HD2; norm i-->j: 9 HD2; applied: errUni 7 LEU HB3 8 PRO HD3 2.71 # bi-dir reff= 3.98; 7 HB3 8 HD3; norm i-->j: 8 HD3 ,norm j-->i: 7 HB3 8 PRO HD2 11 TRP HD1 2.23 # uni-dir reff= 4.09; 11 HD1 8 HD2; norm i-->j: 8 HD2; applied: errUni 8 PRO HD2 11 TRP HB2 1.81 # uni-dir reff= 3.31; 11 HB2 8 HD2; norm i-->j: 8 HD2; applied: errUni 7 LEU HB3 8 PRO HD2 1.78 # bi-dir reff= 2.61; 7 HB3 8 HD2; norm i-->j: 8 HD2 ,norm j-->i: 7 HB3 7 LEU QD2 8 PRO HD2 1.92 # uni-dir reff= 4.63; 7 QD2 8 HD2; norm i-->j: 8 HD2; applied: errUni*errMeth 8 PRO HD2 37 PRO HB2 1.84 # uni-dir reff= 3.37; 37 HB2 8 HD2; norm i-->j: 8 HD2; applied: errUni 8 PRO HD2 37 PRO HG3 2.19 # uni-dir reff= 4.02; 37 HG3 8 HD2; norm i-->j: 8 HD2; applied: errUni 21 ARG H 22 VAL H 3.11 # bi-dir reff= 4.56; 22 H 21 H; norm i-->j: 21 H ,norm j-->i: 22 H 21 ARG H 21 ARG HA 1.57 # uni-dir reff= 2.88; 21 HA 21 H; norm i-->j: 21 H; applied: errUni 16 SER QB 21 ARG H 1.65 # bi-dir reff= 2.86; 16 QB 21 H; norm i-->j: 21 H ,norm j-->i: 16 QB; applied: *errMethyleneQ 19 SER HB2 21 ARG H 2.08 # uni-dir reff= 3.81; 19 HB2 21 H; norm i-->j: 21 H; applied: errUni 35 GLU H 36 ARG H 2.67 # uni-dir reff= 4.90; 36 H 35 H; norm i-->j: 35 H; applied: errUni 33 GLN HE21 35 GLU H 2.49 # uni-dir reff= 4.57; 33 HE21 35 H; norm i-->j: 35 H; applied: errUni 34 PHE HB3 35 GLU H 2.07 # bi-dir reff= 3.60; 34 HB3 35 H; norm i-->j: 35 H ,norm j-->i: 34 HB3; applied: errStereo( 0.0610) 34 PHE HB2 35 GLU H 2.07 # bi-dir reff= 3.23; 34 HB2 35 H; norm i-->j: 35 H ,norm j-->i: 34 HB2; applied: errStereo( 0.0602) 29 THR H 30 ASN H 1.63 # bi-dir reff= 2.39; 29 H 30 H; norm i-->j: 30 H ,norm j-->i: 29 H 27 HIS HA 30 ASN H 2.02 # uni-dir reff= 3.71; 27 HA 30 H; norm i-->j: 30 H; applied: errUni 30 ASN H 30 ASN HB2 1.99 # uni-dir reff= 3.65; 30 HB2 30 H; norm i-->j: 30 H; applied: errUni 30 ASN H 30 ASN HB3 2.71 # bi-dir reff= 3.98; 30 HB3 30 H; norm i-->j: 30 H ,norm j-->i: 30 HB3 26 ASN HB3 30 ASN H 2.32 # bi-dir reff= 3.41; 26 HB3 30 H; norm i-->j: 30 H ,norm j-->i: 26 HB3 30 ASN H 31 ALA QB 3.04 # bi-dir reff= 5.86; 31 QB 30 H; norm i-->j: 30 H ,norm j-->i: 31 QB; applied: *errMeth 33 GLN HE21 37 PRO HD3 2.08 # uni-dir reff= 3.82; 33 HE21 37 HD3; norm i-->j: 37 HD3; applied: errUni 24 TYR QD 37 PRO HD3 1.72 # uni-dir reff= 3.73; 24 QD 37 HD3; norm i-->j: 37 HD3; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR QE 37 PRO HD3 2.14 # uni-dir reff= 4.63; 24 QE 37 HD3; norm i-->j: 37 HD3; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR HB2 37 PRO HD3 1.74 # uni-dir reff= 3.20; 24 HB2 37 HD3; norm i-->j: 37 HD3; applied: errUni 36 ARG HG2 37 PRO HD3 2.56 # uni-dir reff= 4.70; 36 HG2 37 HD3; norm i-->j: 37 HD3; applied: errUni 24 TYR QD 37 PRO HD2 2.11 # uni-dir reff= 4.56; 24 QD 37 HD2; norm i-->j: 37 HD2; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR QE 37 PRO HD2 2.04 # uni-dir reff= 4.41; 24 QE 37 HD2; norm i-->j: 37 HD2; applied: errUni*errMethyleneQ UPL SET TO 8A 11 TRP HB3 37 PRO HD2 2.36 # uni-dir reff= 4.34; 11 HB3 37 HD2; norm i-->j: 37 HD2; applied: errUni 24 TYR HB2 37 PRO HD2 3.04 # bi-dir reff= 4.46; 24 HB2 37 HD2; norm i-->j: 37 HD2 ,norm j-->i: 24 HB2 15 MET H 15 MET HG3 2.47 # uni-dir reff= 4.54; 15 HG3 15 H; norm i-->j: 15 H; applied: errUni 14 ARG HB3 15 MET H 1.68 # bi-dir reff= 2.46; 14 HB3 15 H; norm i-->j: 15 H ,norm j-->i: 14 HB3 14 ARG HB2 15 MET H 2.43 # bi-dir reff= 3.56; 14 HB2 15 H; norm i-->j: 15 H ,norm j-->i: 14 HB2 23 TYR QD 24 TYR H 1.65 # uni-dir reff= 3.58; 23 QD 24 H; norm i-->j: 24 H; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR H 24 TYR QD 1.47 # uni-dir reff= 3.19; 24 QD 24 H; norm i-->j: 24 H; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR H 24 TYR QE 1.79 # uni-dir reff= 3.88; 24 QE 24 H; norm i-->j: 24 H; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR H 24 TYR HB3 2.06 # uni-dir reff= 3.77; 24 HB3 24 H; norm i-->j: 24 H; applied: errUni 24 TYR H 24 TYR HB2 1.76 # bi-dir reff= 2.59; 24 HB2 24 H; norm i-->j: 24 H ,norm j-->i: 24 HB2 23 TYR HB2 24 TYR H 1.46 # bi-dir reff= 2.52; 23 HB2 24 H; norm i-->j: 24 H ,norm j-->i: 23 HB2; applied: errStereo( 0.0808) 11 TRP H 11 TRP HA 1.95 # bi-dir reff= 2.86; 11 HA 11 H; norm i-->j: 11 H ,norm j-->i: 11 HA 10 GLY HA3 11 TRP H 2.15 # bi-dir reff= 3.15; 10 HA3 11 H; norm i-->j: 11 H ,norm j-->i: 10 HA3 11 TRP H 11 TRP HB2 1.66 # bi-dir reff= 2.43; 11 HB2 11 H; norm i-->j: 11 H ,norm j-->i: 11 HB2 18 ASN QB 18 ASN HD21 1.76 # bi-dir reff= 3.25; 18 QB 18 HD21; norm i-->j: 18 HD21 ,norm j-->i: 18 QB; applied: errStereo( 0.0577)*errMethyleneQ 38 SER H 39 GLY H 2.38 # bi-dir reff= 3.49; 38 H 39 H; norm i-->j: 39 H ,norm j-->i: 38 H 8 PRO HG3 39 GLY H 2.95 # uni-dir reff= 5.41; 8 HG3 39 H; norm i-->j: 39 H; applied: errUni 37 PRO HB2 39 GLY H 2.54 # uni-dir reff= 4.66; 37 HB2 39 H; norm i-->j: 39 H; applied: errUni 18 ASN H 19 SER H 1.80 # bi-dir reff= 2.64; 19 H 18 H; norm i-->j: 18 H ,norm j-->i: 19 H 18 ASN H 18 ASN QB 1.71 # bi-dir reff= 2.96; 18 QB 18 H; norm i-->j: 18 H ,norm j-->i: 18 QB; applied: *errMethyleneQ 33 GLN HE22 38 SER H 2.55 # uni-dir reff= 4.68; 33 HE22 38 H; norm i-->j: 38 H; applied: errUni 38 SER H 38 SER HB3 1.87 # uni-dir reff= 3.44; 38 HB3 38 H; norm i-->j: 38 H; applied: errUni 37 PRO HB2 38 SER H 1.94 # uni-dir reff= 3.57; 37 HB2 38 H; norm i-->j: 38 H; applied: errUni 37 PRO HB3 38 SER H 2.21 # uni-dir reff= 4.05; 37 HB3 38 H; norm i-->j: 38 H; applied: errUni 28 ILE H 28 ILE QG2 2.30 # uni-dir reff= 5.54; 28 H 28 QG2; norm i-->j: 28 QG2; applied: errUni*errMeth 28 ILE QG2 29 THR H 2.35 # bi-dir reff= 4.53; 29 H 28 QG2; norm i-->j: 28 QG2 ,norm j-->i: 29 H; applied: *errMeth 28 ILE HA 28 ILE QG2 1.68 # bi-dir reff= 3.24; 28 HA 28 QG2; norm i-->j: 28 QG2 ,norm j-->i: 28 HA; applied: *errMeth 28 ILE QG2 28 ILE HG13 1.98 # uni-dir reff= 4.78; 28 HG13 28 QG2; norm i-->j: 28 QG2; applied: errUni*errMeth 33 GLN HB3 33 GLN HE22 2.62 # uni-dir reff= 4.82; 33 HB3 33 HE22; norm i-->j: 33 HE22; applied: errUni 33 GLN HE22 37 PRO HB3 1.85 # uni-dir reff= 3.39; 37 HB3 33 HE22; norm i-->j: 33 HE22; applied: errUni 30 ASN HB3 30 ASN HD22 2.48 # uni-dir reff= 4.55; 30 HB3 30 HD22; norm i-->j: 30 HD22; applied: errUni 32 SER H 32 SER HB3 1.97 # uni-dir reff= 3.68; 32 HB3 32 H; norm i-->j: 32 H; applied: errUni 31 ALA QB 32 SER H 1.44 # uni-dir reff= 3.46; 31 QB 32 H; norm i-->j: 32 H; applied: errUni*errMeth 30 ASN HB2 30 ASN HD22 2.90 # uni-dir reff= 5.32; 30 HB2 30 HD22; norm i-->j: 30 HD22; applied: errUni 32 SER H 33 GLN H 2.50 # uni-dir reff= 4.59; 33 H 32 H; norm i-->j: 32 H; applied: errUni 32 SER H 32 SER HB2 1.97 # bi-dir reff= 3.08; 32 HB2 32 H; norm i-->j: 32 H ,norm j-->i: 32 HB2; applied: errStereo( 0.0624) 10 GLY H 10 GLY HA3 1.98 # bi-dir reff= 2.90; 10 H 10 HA3; norm i-->j: 10 HA3 ,norm j-->i: 10 H 9 PRO HA 10 GLY HA3 2.13 # uni-dir reff= 3.89; 9 HA 10 HA3; norm i-->j: 10 HA3; applied: errUni 10 GLY HA3 28 ILE QD1 1.94 # bi-dir reff= 3.74; 28 QD1 10 HA3; norm i-->j: 10 HA3 ,norm j-->i: 28 QD1; applied: *errMeth 10 GLY HA2 11 TRP H 1.82 # uni-dir reff= 3.33; 11 H 10 HA2; norm i-->j: 10 HA2; applied: errUni 10 GLY HA2 26 ASN HD22 3.18 # bi-dir reff= 4.67; 26 HD22 10 HA2; norm i-->j: 10 HA2 ,norm j-->i: 26 HD22 10 GLY HA2 28 ILE QD1 2.22 # bi-dir reff= 4.27; 28 QD1 10 HA2; norm i-->j: 10 HA2 ,norm j-->i: 28 QD1; applied: *errMeth 10 GLY H 10 GLY HA2 1.66 # bi-dir reff= 2.43; 10 H 10 HA2; norm i-->j: 10 HA2 ,norm j-->i: 10 H 10 GLY HA3 28 ILE H 2.14 # uni-dir reff= 3.93; 28 H 10 HA3; norm i-->j: 10 HA3; applied: errUni 10 GLY HA3 26 ASN HD22 1.70 # uni-dir reff= 3.11; 26 HD22 10 HA3; norm i-->j: 10 HA3; applied: errUni 9 PRO HA 10 GLY HA2 3.05 # bi-dir reff= 4.47; 9 HA 10 HA2; norm i-->j: 10 HA2 ,norm j-->i: 9 HA 19 SER H 20 GLY H 1.76 # bi-dir reff= 2.58; 19 H 20 H; norm i-->j: 20 H ,norm j-->i: 19 H 20 GLY H 21 ARG HB2 2.51 # uni-dir reff= 4.60; 21 HB2 20 H; norm i-->j: 20 H; applied: errUni 10 GLY H 11 TRP H 1.52 # uni-dir reff= 2.79; 11 H 10 H; norm i-->j: 10 H; applied: errUni 9 PRO HA 10 GLY H 1.48 # bi-dir reff= 2.17; 9 HA 10 H; norm i-->j: 10 H ,norm j-->i: 9 HA 9 PRO HB2 10 GLY H 1.96 # uni-dir reff= 3.60; 9 HB2 10 H; norm i-->j: 10 H; applied: errUni 10 GLY H 28 ILE QD1 2.78 # bi-dir reff= 5.36; 28 QD1 10 H; norm i-->j: 10 H ,norm j-->i: 28 QD1; applied: *errMeth 18 ASN H 20 GLY H 2.19 # uni-dir reff= 4.01; 18 H 20 H; norm i-->j: 20 H; applied: errUni 14 ARG HD3 25 PHE HB2 2.71 # bi-dir reff= 4.50; 14 HD3 25 HB2; norm i-->j: 25 HB2 ,norm j-->i: 14 HD3; applied: errStereo( 0.0271) 14 ARG HG3 25 PHE HB2 2.53 # bi-dir reff= 4.78; 14 HG3 25 HB2; norm i-->j: 25 HB2 ,norm j-->i: 14 HG3; applied: errStereo( 0.0349) 14 ARG HD3 25 PHE HB3 2.71 # bi-dir reff= 4.28; 14 HD3 25 HB3; norm i-->j: 25 HB3 ,norm j-->i: 14 HD3; applied: errStereo( 0.0282) 12 GLU HG3 25 PHE HB3 2.32 # bi-dir reff= 3.97; 12 HG3 25 HB3; norm i-->j: 25 HB3 ,norm j-->i: 12 HG3; applied: errStereo( 0.1047) 12 GLU QB 25 PHE HB3 2.26 # bi-dir reff= 3.91; 12 QB 25 HB3; norm i-->j: 25 HB3 ,norm j-->i: 12 QB; applied: *errMethyleneQ 14 ARG HG3 25 PHE HB3 1.95 # bi-dir reff= 3.56; 14 HG3 25 HB3; norm i-->j: 25 HB3 ,norm j-->i: 14 HG3; applied: errStereo( 0.0601) 19 SER H 19 SER HB2 2.54 # bi-dir reff= 3.73; 19 HB2 19 H; norm i-->j: 19 H ,norm j-->i: 19 HB2 19 SER H 19 SER HB3 2.01 # bi-dir reff= 2.95; 19 HB3 19 H; norm i-->j: 19 H ,norm j-->i: 19 HB3 18 ASN QB 19 SER H 1.34 # uni-dir reff= 2.90; 18 QB 19 H; norm i-->j: 19 H; applied: errUni*errMethyleneQ 16 SER QB 19 SER H 1.91 # bi-dir reff= 3.32; 16 QB 19 H; norm i-->j: 19 H ,norm j-->i: 16 QB; applied: *errMethyleneQ 21 ARG HD3 34 PHE QE 2.87 # uni-dir reff= 6.21; 34 QE 21 HD3; norm i-->j: 21 HD3; applied: errUni*errMethyleneQ UPL SET TO 8A 26 ASN HD22 28 ILE HB 1.89 # uni-dir reff= 3.47; 28 HB 26 HD22; norm i-->j: 26 HD22; applied: errUni 26 ASN HD22 28 ILE QD1 2.66 # bi-dir reff= 5.13; 28 QD1 26 HD22; norm i-->j: 26 HD22 ,norm j-->i: 28 QD1; applied: *errMeth 26 ASN HB2 26 ASN HD22 2.64 # bi-dir reff= 3.87; 26 HB2 26 HD22; norm i-->j: 26 HD22 ,norm j-->i: 26 HB2 26 ASN HB3 26 ASN HD21 2.32 # bi-dir reff= 3.40; 26 HB3 26 HD21; norm i-->j: 26 HD21 ,norm j-->i: 26 HB3 26 ASN HD21 31 ALA QB 1.89 # uni-dir reff= 4.57; 31 QB 26 HD21; norm i-->j: 26 HD21; applied: errUni*errMeth 26 ASN HD21 29 THR QG2 1.77 # uni-dir reff= 4.27; 29 QG2 26 HD21; norm i-->j: 26 HD21; applied: errUni*errMeth 26 ASN HB2 26 ASN HD21 1.64 # bi-dir reff= 2.41; 26 HB2 26 HD21; norm i-->j: 26 HD21 ,norm j-->i: 26 HB2 23 TYR HB3 34 PHE QD 1.61 # bi-dir reff= 3.25; 23 HB3 34 QD; norm i-->j: 34 QD ,norm j-->i: 23 HB3; applied: errStereo( 0.0383)*errMethyleneQ 14 ARG HD2 25 PHE HB3 2.71 # bi-dir reff= 4.10; 25 HB3 14 HD2; norm i-->j: 14 HD2 ,norm j-->i: 25 HB3; applied: errStereo( 0.0288) 14 ARG HB2 14 ARG HD2 2.52 # bi-dir reff= 3.80; 14 HB2 14 HD2; norm i-->j: 14 HD2 ,norm j-->i: 14 HB2; applied: errStereo( 0.0276) 14 ARG HA 14 ARG HD3 1.85 # uni-dir reff= 3.40; 14 HA 14 HD3; norm i-->j: 14 HD3; applied: errUni 14 ARG HB2 14 ARG HD3 2.52 # bi-dir reff= 3.91; 14 HB2 14 HD3; norm i-->j: 14 HD3 ,norm j-->i: 14 HB2; applied: errStereo( 0.0271) 25 PHE QD 26 ASN H 1.44 # uni-dir reff= 3.12; 26 H 25 QD; norm i-->j: 25 QD; applied: errUni*errMethyleneQ 25 PHE QD 32 SER HB3 1.81 # bi-dir reff= 3.15; 32 HB3 25 QD; norm i-->j: 25 QD ,norm j-->i: 32 HB3; applied: errStereo( 0.0074)*errMethyleneQ 7 LEU HB2 7 LEU QD2 1.42 # uni-dir reff= 3.42; 7 QD2 7 HB2; norm i-->j: 7 HB2; applied: errUni*errMeth 7 LEU HB2 7 LEU QD1 1.62 # uni-dir reff= 3.91; 7 QD1 7 HB2; norm i-->j: 7 HB2; applied: errUni*errMeth 28 ILE H 28 ILE QD1 2.23 # uni-dir reff= 5.36; 28 H 28 QD1; norm i-->j: 28 QD1; applied: errUni*errMeth 28 ILE QD1 29 THR H 2.65 # uni-dir reff= 6.38; 29 H 28 QD1; norm i-->j: 28 QD1; applied: errUni*errMeth 27 HIS HD2 28 ILE QD1 2.36 # uni-dir reff= 5.70; 27 HD2 28 QD1; norm i-->j: 28 QD1; applied: errUni*errMeth 28 ILE HA 28 ILE QD1 1.95 # uni-dir reff= 4.69; 28 HA 28 QD1; norm i-->j: 28 QD1; applied: errUni*errMeth 28 ILE HB 28 ILE QD1 1.53 # uni-dir reff= 3.67; 28 HB 28 QD1; norm i-->j: 28 QD1; applied: errUni*errMeth 28 ILE HB 29 THR H 1.74 # bi-dir reff= 2.55; 28 HB 29 H; norm i-->j: 29 H ,norm j-->i: 28 HB 24 TYR HB2 25 PHE H 2.11 # uni-dir reff= 3.86; 25 H 24 HB2; norm i-->j: 24 HB2; applied: errUni 24 TYR HB2 33 GLN HB3 2.22 # uni-dir reff= 4.08; 33 HB3 24 HB2; norm i-->j: 24 HB2; applied: errUni 24 TYR HB2 37 PRO HG3 2.06 # uni-dir reff= 3.79; 37 HG3 24 HB2; norm i-->j: 24 HB2; applied: errUni 23 TYR HB3 34 PHE QE 1.02 # uni-dir reff= 4.80; 34 QE 23 HB3; norm i-->j: 23 HB3; applied: errUni*errMethyleneQ UPL SET TO 8A 23 TYR HB3 24 TYR H 1.46 # uni-dir reff= 2.68; 24 H 23 HB3; norm i-->j: 23 HB3; applied: errUni 23 TYR HB2 34 PHE QD 1.61 # uni-dir reff= 3.50; 34 QD 23 HB2; norm i-->j: 23 HB2; applied: errUni*errMethyleneQ UPL SET TO 8A 29 THR H 29 THR HB 2.08 # uni-dir reff= 3.81; 29 H 29 HB; norm i-->j: 29 HB; applied: errUni 34 PHE HA 34 PHE HB3 1.78 # uni-dir reff= 3.26; 34 HA 34 HB3; norm i-->j: 34 HB3; applied: errUni 34 PHE HA 34 PHE HB2 1.78 # uni-dir reff= 3.51; 34 HA 34 HB2; norm i-->j: 34 HB2; applied: errUni 26 ASN HB3 29 THR H 1.64 # uni-dir reff= 3.02; 29 H 26 HB3; norm i-->j: 26 HB3; applied: errUni 26 ASN HB2 31 ALA QB 1.42 # uni-dir reff= 3.42; 31 QB 26 HB2; norm i-->j: 26 HB2; applied: errUni*errMeth 30 ASN HB3 30 ASN HD21 1.73 # uni-dir reff= 3.18; 30 HD21 30 HB3; norm i-->j: 30 HB3; applied: errUni 25 PHE QD 32 SER HB2 1.81 # bi-dir reff= 3.86; 25 QD 32 HB2; norm i-->j: 32 HB2 ,norm j-->i: 25 QD; applied: errStereo( 0.0077)*errMethyleneQ 32 SER HB3 34 PHE QE 1.24 # uni-dir reff= 5.28; 34 QE 32 HB3; norm i-->j: 32 HB3; applied: errUni*errMethyleneQ UPL SET TO 8A 12 GLU HG2 25 PHE HB3 2.32 # uni-dir reff= 4.26; 25 HB3 12 HG2; norm i-->j: 12 HG2; applied: errUni 12 GLU HG2 14 ARG HG2 2.31 # uni-dir reff= 4.36; 14 HG2 12 HG2; norm i-->j: 12 HG2; applied: errUni 12 GLU HG2 14 ARG HG3 2.31 # uni-dir reff= 4.24; 14 HG3 12 HG2; norm i-->j: 12 HG2; applied: errUni 12 GLU HG3 13 LYS H 2.38 # bi-dir reff= 3.90; 13 H 12 HG3; norm i-->j: 12 HG3 ,norm j-->i: 13 H; applied: errStereo( 0.1047) 12 GLU HG3 14 ARG HG3 2.31 # bi-dir reff= 3.88; 14 HG3 12 HG3; norm i-->j: 12 HG3 ,norm j-->i: 14 HG3; applied: errStereo( 0.1047) 11 TRP HH2 33 GLN HB3 1.93 # uni-dir reff= 3.54; 33 HB3 11 HH2; norm i-->j: 11 HH2; applied: errUni 11 TRP HH2 31 ALA QB 1.29 # uni-dir reff= 3.12; 31 QB 11 HH2; norm i-->j: 11 HH2; applied: errUni*errMeth 14 ARG H 14 ARG HB3 1.96 # uni-dir reff= 3.58; 14 H 14 HB3; norm i-->j: 14 HB3; applied: errUni 14 ARG HB3 14 ARG HD2 1.70 # uni-dir reff= 3.13; 14 HD2 14 HB3; norm i-->j: 14 HB3; applied: errUni 14 ARG HB3 14 ARG HD3 1.70 # uni-dir reff= 3.23; 14 HD3 14 HB3; norm i-->j: 14 HB3; applied: errUni 12 GLU QB 27 HIS HD2 1.96 # uni-dir reff= 4.26; 27 HD2 12 QB; norm i-->j: 12 QB; applied: errUni*errMethyleneQ 11 TRP HZ3 25 PHE HA 1.75 # uni-dir reff= 3.22; 25 HA 11 HZ3; norm i-->j: 11 HZ3; applied: errUni 11 TRP HZ3 24 TYR HB2 1.68 # uni-dir reff= 3.08; 24 HB2 11 HZ3; norm i-->j: 11 HZ3; applied: errUni 16 SER QB 23 TYR QD 1.89 # bi-dir reff= 3.88; 23 QD 16 QB; norm i-->j: 16 QB ,norm j-->i: 23 QD; applied: *errMethyleneQ*errMethyleneQ 16 SER QB 21 ARG HB3 2.56 # bi-dir reff= 4.44; 21 HB3 16 QB; norm i-->j: 16 QB ,norm j-->i: 21 HB3; applied: *errMethyleneQ 16 SER QB 21 ARG HB2 2.06 # bi-dir reff= 3.58; 21 HB2 16 QB; norm i-->j: 16 QB ,norm j-->i: 21 HB2; applied: *errMethyleneQ 28 ILE HA 29 THR H 2.05 # uni-dir reff= 3.76; 29 H 28 HA; norm i-->j: 28 HA; applied: errUni 11 TRP HZ3 24 TYR HB3 1.83 # uni-dir reff= 3.36; 24 HB3 11 HZ3; norm i-->j: 11 HZ3; applied: errUni 11 TRP HZ3 33 GLN HB3 2.01 # uni-dir reff= 3.68; 33 HB3 11 HZ3; norm i-->j: 11 HZ3; applied: errUni 11 TRP HZ3 31 ALA QB 1.61 # uni-dir reff= 3.88; 31 QB 11 HZ3; norm i-->j: 11 HZ3; applied: errUni*errMeth 10 GLY HA2 28 ILE H 2.97 # bi-dir reff= 4.36; 28 H 10 HA2; norm i-->j: 10 HA2 ,norm j-->i: 28 H 10 GLY HA2 27 HIS H 2.08 # uni-dir reff= 3.81; 27 H 10 HA2; norm i-->j: 10 HA2; applied: errUni 11 TRP HD1 26 ASN HD21 2.16 # uni-dir reff= 3.96; 26 HD21 11 HD1; norm i-->j: 11 HD1; applied: errUni 7 LEU QD2 37 PRO HG2 2.69 # bi-dir reff= 5.18; 37 HG2 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 37 HG2; applied: *errMeth 7 LEU QD2 37 PRO HG3 3.32 # bi-dir reff= 6.40; 37 HG3 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 37 HG3; applied: *errMeth 9 PRO HG3 10 GLY H 2.70 # bi-dir reff= 5.17; 10 H 9 HG3; norm i-->j: 9 HG3 ,norm j-->i: 10 H; applied: errStereo( 0.0368) 14 ARG HD2 25 PHE HB2 2.71 # uni-dir reff= 4.97; 25 HB2 14 HD2; norm i-->j: 14 HD2; applied: errUni 14 ARG HD2 15 MET H 2.78 # bi-dir reff= 5.18; 15 H 14 HD2; norm i-->j: 14 HD2 ,norm j-->i: 15 H; applied: errStereo( 0.0462) 14 ARG HD3 15 MET H 2.78 # uni-dir reff= 5.10; 15 H 14 HD3; norm i-->j: 14 HD3; applied: errUni 15 MET H 16 SER H 2.94 # bi-dir reff= 4.32; 16 H 15 H; norm i-->j: 15 H ,norm j-->i: 16 H 15 MET H 23 TYR QE 2.61 # bi-dir reff= 4.53; 23 QE 15 H; norm i-->j: 15 H ,norm j-->i: 23 QE; applied: *errMethyleneQ 24 TYR HB2 33 GLN H 1.94 # uni-dir reff= 3.56; 33 H 24 HB2; norm i-->j: 24 HB2; applied: errUni 25 PHE HA 32 SER HB3 2.18 # uni-dir reff= 4.00; 32 HB3 25 HA; norm i-->j: 25 HA; applied: errUni 25 PHE HA 32 SER HB2 2.18 # uni-dir reff= 4.31; 32 HB2 25 HA; norm i-->j: 25 HA; applied: errUni 25 PHE HB2 26 ASN H 2.90 # bi-dir reff= 4.25; 26 H 25 HB2; norm i-->j: 25 HB2 ,norm j-->i: 26 H 25 PHE HB3 26 ASN H 2.90 # bi-dir reff= 4.25; 26 H 25 HB3; norm i-->j: 25 HB3 ,norm j-->i: 26 H 27 HIS HB3 28 ILE H 2.81 # bi-dir reff= 4.25; 28 H 27 HB3; norm i-->j: 27 HB3 ,norm j-->i: 28 H; applied: errStereo( 0.0262) 27 HIS HB2 28 ILE H 2.81 # bi-dir reff= 4.24; 28 H 27 HB2; norm i-->j: 27 HB2 ,norm j-->i: 28 H; applied: errStereo( 0.0264) 28 ILE HG13 29 THR H 2.48 # uni-dir reff= 4.55; 29 H 28 HG13; norm i-->j: 28 HG13; applied: errUni 28 ILE QG2 28 ILE HG12 1.51 # uni-dir reff= 3.64; 28 HG12 28 QG2; norm i-->j: 28 QG2; applied: errUni*errMeth 29 THR HA 29 THR HB 1.76 # bi-dir reff= 2.58; 29 HB 29 HA; norm i-->j: 29 HA ,norm j-->i: 29 HB 29 THR HA 30 ASN HB3 2.68 # uni-dir reff= 4.92; 30 HB3 29 HA; norm i-->j: 29 HA; applied: errUni 25 PHE H 26 ASN H 2.48 # uni-dir reff= 4.54; 25 H 26 H; norm i-->j: 26 H; applied: errUni 9 PRO HG2 10 GLY H 2.70 # uni-dir reff= 4.96; 9 HG2 10 H; norm i-->j: 10 H; applied: errUni 14 ARG HD3 23 TYR QE 1.81 # uni-dir reff= 4.34; 14 HD3 23 QE; norm i-->j: 23 QE; applied: errUni*errMethyleneQ 24 TYR QD 25 PHE H 2.41 # uni-dir reff= 5.22; 24 QD 25 H; norm i-->j: 25 H; applied: errUni*errMethyleneQ UPL SET TO 8A 14 ARG HG2 25 PHE HB2 2.53 # uni-dir reff= 4.64; 14 HG2 25 HB2; norm i-->j: 25 HB2; applied: errUni 14 ARG HG2 25 PHE HB3 1.95 # uni-dir reff= 3.58; 14 HG2 25 HB3; norm i-->j: 25 HB3; applied: errUni 10 GLY HA3 27 HIS H 2.31 # uni-dir reff= 4.24; 10 HA3 27 H; norm i-->j: 27 H; applied: errUni 28 ILE QG2 30 ASN H 2.73 # uni-dir reff= 6.58; 28 QG2 30 H; norm i-->j: 30 H; applied: errUni*errMeth 29 THR HB 30 ASN H 2.37 # uni-dir reff= 4.34; 29 HB 30 H; norm i-->j: 30 H; applied: errUni 6 LYS HA 6 LYS HD2 2.03 # uni-dir reff= 5.93; 6 HA 6 HD2; norm i-->j: 6 HD2; applied: errUni 13 LYS HA 14 ARG HB2 2.56 # uni-dir reff= 4.70; 13 HA 14 HB2; norm i-->j: 14 HB2; applied: errUni 28 ILE HA 30 ASN H 2.72 # uni-dir reff= 4.99; 28 HA 30 H; norm i-->j: 30 H; applied: errUni 24 TYR HB3 33 GLN H 2.70 # uni-dir reff= 4.96; 24 HB3 33 H; norm i-->j: 33 H; applied: errUni 21 ARG HH22 34 PHE HB3 2.19 # uni-dir reff= 4.03; 21 HH22 34 HB3; norm i-->j: 34 HB3; applied: errUni 21 ARG HH22 34 PHE HB2 2.19 # uni-dir reff= 4.22; 21 HH22 34 HB2; norm i-->j: 34 HB2; applied: errUni 11 TRP HE3 37 PRO HG3 2.21 # uni-dir reff= 4.06; 11 HE3 37 HG3; norm i-->j: 37 HG3; applied: errUni 11 TRP HE3 37 PRO HG2 3.17 # uni-dir reff= 5.83; 11 HE3 37 HG2; norm i-->j: 37 HG2; applied: errUni 37 PRO HG2 38 SER H 2.73 # uni-dir reff= 4.99; 37 HG2 38 H; norm i-->j: 38 H; applied: errUni 37 PRO HB3 39 GLY H 3.11 # uni-dir reff= 5.72; 37 HB3 39 H; norm i-->j: 39 H; applied: errUni 22 VAL H 22 VAL HA 2.07 # bi-dir reff= 3.04; 22 H 22 HA; norm i-->j: 22 HA ,norm j-->i: 22 H 37 PRO HA 39 GLY H 2.64 # uni-dir reff= 4.83; 39 H 37 HA; norm i-->j: 37 HA; applied: errUni 37 PRO HA 38 SER HA 3.28 # bi-dir reff= 4.82; 38 HA 37 HA; norm i-->j: 37 HA ,norm j-->i: 38 HA 36 ARG HA 37 PRO HA 3.15 # bi-dir reff= 4.62; 36 HA 37 HA; norm i-->j: 37 HA ,norm j-->i: 36 HA 28 ILE HB 29 THR HA 2.50 # uni-dir reff= 4.59; 28 HB 29 HA; norm i-->j: 29 HA; applied: errUni 28 ILE QG2 29 THR HA 1.76 # uni-dir reff= 4.25; 28 QG2 29 HA; norm i-->j: 29 HA; applied: errUni*errMeth 14 ARG HG3 23 TYR QE 0.73 # uni-dir reff= 4.20; 14 HG3 23 QE; norm i-->j: 23 QE; applied: errUni*errMethyleneQ 11 TRP HE1 37 PRO HG3 2.46 # uni-dir reff= 4.52; 37 HG3 11 HE1; norm i-->j: 11 HE1; applied: errUni 11 TRP HE1 26 ASN HB2 3.24 # bi-dir reff= 4.75; 26 HB2 11 HE1; norm i-->j: 11 HE1 ,norm j-->i: 26 HB2 8 PRO HB3 11 TRP HE1 2.85 # uni-dir reff= 5.24; 8 HB3 11 HE1; norm i-->j: 11 HE1; applied: errUni 18 ASN QB 19 SER HA 1.94 # uni-dir reff= 4.21; 18 QB 19 HA; norm i-->j: 19 HA; applied: errUni*errMethyleneQ 17 ARG HA 17 ARG HD2 3.30 # bi-dir reff= 5.32; 17 HD2 17 HA; norm i-->j: 17 HA ,norm j-->i: 17 HD2; applied: errStereo( 0.0572) 17 ARG HA 20 GLY H 2.58 # uni-dir reff= 4.72; 20 H 17 HA; norm i-->j: 17 HA; applied: errUni 10 GLY HA2 28 ILE HG12 2.52 # uni-dir reff= 4.62; 10 HA2 28 HG12; norm i-->j: 28 HG12; applied: errUni 14 ARG HG3 25 PHE H 1.52 # bi-dir reff= 4.18; 25 H 14 HG3; norm i-->j: 14 HG3 ,norm j-->i: 25 H; applied: errStereo( 0.0433) 13 LYS HA 14 ARG HG3 1.35 # uni-dir reff= 4.69; 13 HA 14 HG3; norm i-->j: 14 HG3; applied: errUni 14 ARG H 15 MET H 3.22 # bi-dir reff= 4.72; 15 H 14 H; norm i-->j: 14 H ,norm j-->i: 15 H 14 ARG H 24 TYR QD 2.58 # uni-dir reff= 5.60; 24 QD 14 H; norm i-->j: 14 H; applied: errUni*errMethyleneQ UPL SET TO 8A 13 LYS QE 14 ARG H 2.87 # uni-dir reff= 6.21; 13 QE 14 H; norm i-->j: 14 H; applied: errUni*errMethyleneQ 14 ARG H 14 ARG HD2 1.67 # uni-dir reff= 5.27; 14 HD2 14 H; norm i-->j: 14 H; applied: errUni 25 PHE HB2 32 SER HA 2.21 # uni-dir reff= 4.06; 25 HB2 32 HA; norm i-->j: 32 HA; applied: errUni 31 ALA QB 32 SER HA 2.63 # bi-dir reff= 5.07; 31 QB 32 HA; norm i-->j: 32 HA ,norm j-->i: 31 QB; applied: *errMeth 25 PHE HA 26 ASN HB3 2.60 # uni-dir reff= 4.76; 26 HB3 25 HA; norm i-->j: 25 HA; applied: errUni 12 GLU H 25 PHE HA 2.26 # uni-dir reff= 4.15; 12 H 25 HA; norm i-->j: 25 HA; applied: errUni 11 TRP HE3 25 PHE HA 1.96 # uni-dir reff= 3.60; 11 HE3 25 HA; norm i-->j: 25 HA; applied: errUni 25 PHE HA 31 ALA QB 2.06 # uni-dir reff= 4.98; 31 QB 25 HA; norm i-->j: 25 HA; applied: errUni*errMeth 24 TYR QD 36 ARG H 2.58 # uni-dir reff= 5.58; 24 QD 36 H; norm i-->j: 36 H; applied: errUni*errMethyleneQ UPL SET TO 8A 7 LEU QD1 13 LYS H 2.17 # uni-dir reff= 5.24; 7 QD1 13 H; norm i-->j: 13 H; applied: errUni*errMeth 13 LYS H 13 LYS QG 2.19 # uni-dir reff= 4.76; 13 H 13 QG; norm i-->j: 13 QG; applied: errUni*errMethyleneQ 26 ASN H 30 ASN HA 2.34 # uni-dir reff= 4.29; 26 H 30 HA; norm i-->j: 30 HA; applied: errUni 30 ASN HA 31 ALA QB 2.23 # uni-dir reff= 5.36; 31 QB 30 HA; norm i-->j: 30 HA; applied: errUni*errMeth 7 LEU H 8 PRO HD3 3.12 # uni-dir reff= 5.72; 8 HD3 7 H; norm i-->j: 7 H; applied: errUni 21 ARG HD2 22 VAL H 3.26 # uni-dir reff= 5.98; 21 HD2 22 H; norm i-->j: 22 H; applied: errUni 12 GLU HA 12 GLU HG3 2.14 # bi-dir reff= 3.38; 12 HG3 12 HA; norm i-->j: 12 HA ,norm j-->i: 12 HG3; applied: errStereo( 0.0703) 33 GLN HE21 36 ARG HA 2.73 # uni-dir reff= 5.02; 33 HE21 36 HA; norm i-->j: 36 HA; applied: errUni 35 GLU HA 36 ARG HA 2.43 # uni-dir reff= 4.45; 35 HA 36 HA; norm i-->j: 36 HA; applied: errUni 14 ARG HD3 25 PHE H 1.84 # uni-dir reff= 5.59; 14 HD3 25 H; norm i-->j: 25 H; applied: errUni 14 ARG H 25 PHE H 2.29 # uni-dir reff= 4.20; 14 H 25 H; norm i-->j: 25 H; applied: errUni 7 LEU QD1 24 TYR HA 2.71 # uni-dir reff= 6.53; 24 HA 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth 6 LYS HA 7 LEU QD1 2.79 # uni-dir reff= 6.73; 6 HA 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth 7 LEU HA 37 PRO HG2 2.62 # uni-dir reff= 4.82; 37 HG2 7 HA; norm i-->j: 7 HA; applied: errUni 16 SER H 23 TYR H 2.68 # uni-dir reff= 4.91; 16 H 23 H; norm i-->j: 23 H; applied: errUni 23 TYR H 23 TYR HB2 2.28 # uni-dir reff= 4.43; 23 HB2 23 H; norm i-->j: 23 H; applied: errUni 27 HIS HD2 28 ILE H 2.66 # uni-dir reff= 4.87; 27 HD2 28 H; norm i-->j: 28 H; applied: errUni 26 ASN HD22 28 ILE H 3.06 # bi-dir reff= 4.49; 26 HD22 28 H; norm i-->j: 28 H ,norm j-->i: 26 HD22 21 ARG HA 22 VAL QG2 2.30 # uni-dir reff= 5.55; 21 HA 22 QG2; norm i-->j: 22 QG2; applied: errUni*errMeth 16 SER H 21 ARG HA 2.34 # uni-dir reff= 4.28; 21 HA 16 H; norm i-->j: 16 H; applied: errUni 15 MET QE 16 SER H 2.06 # uni-dir reff= 4.95; 15 QE 16 H; norm i-->j: 16 H; applied: errUni*errMeth 31 ALA HA 32 SER HA 2.70 # uni-dir reff= 4.95; 32 HA 31 HA; norm i-->j: 31 HA; applied: errUni 12 GLU H 27 HIS HD2 2.42 # uni-dir reff= 4.43; 27 HD2 12 H; norm i-->j: 12 H; applied: errUni 12 GLU H 24 TYR HA 2.43 # uni-dir reff= 4.46; 24 HA 12 H; norm i-->j: 12 H; applied: errUni 12 GLU H 27 HIS H 3.18 # bi-dir reff= 4.67; 27 H 12 H; norm i-->j: 12 H ,norm j-->i: 27 H 12 GLU H 25 PHE HB3 2.69 # bi-dir reff= 3.95; 25 HB3 12 H; norm i-->j: 12 H ,norm j-->i: 25 HB3 12 GLU H 13 LYS H 2.34 # uni-dir reff= 4.30; 13 H 12 H; norm i-->j: 12 H; applied: errUni 12 GLU H 13 LYS HA 2.47 # uni-dir reff= 4.54; 13 HA 12 H; norm i-->j: 12 H; applied: errUni 12 GLU H 26 ASN HB2 2.63 # uni-dir reff= 4.83; 26 HB2 12 H; norm i-->j: 12 H; applied: errUni 33 GLN H 33 GLN HA 2.15 # uni-dir reff= 3.95; 33 HA 33 H; norm i-->j: 33 H; applied: errUni 27 HIS H 28 ILE HB 2.67 # uni-dir reff= 4.90; 28 HB 27 H; norm i-->j: 27 H; applied: errUni 26 ASN H 27 HIS H 2.84 # uni-dir reff= 5.22; 26 H 27 H; norm i-->j: 27 H; applied: errUni 27 HIS H 27 HIS HA 1.62 # uni-dir reff= 2.97; 27 HA 27 H; norm i-->j: 27 H; applied: errUni 27 HIS H 28 ILE HA 2.75 # uni-dir reff= 5.03; 28 HA 27 H; norm i-->j: 27 H; applied: errUni 9 PRO HD2 11 TRP HD1 2.83 # uni-dir reff= 5.20; 11 HD1 9 HD2; norm i-->j: 9 HD2; applied: errUni 7 LEU H 8 PRO HD2 3.33 # uni-dir reff= 6.12; 7 H 8 HD2; norm i-->j: 8 HD2; applied: errUni 8 PRO HD3 37 PRO HB2 2.14 # uni-dir reff= 3.93; 37 HB2 8 HD3; norm i-->j: 8 HD3; applied: errUni 8 PRO HD3 11 TRP HB2 2.78 # uni-dir reff= 5.10; 11 HB2 8 HD3; norm i-->j: 8 HD3; applied: errUni 19 SER H 21 ARG H 2.18 # uni-dir reff= 4.00; 19 H 21 H; norm i-->j: 21 H; applied: errUni 19 SER HA 21 ARG H 2.88 # uni-dir reff= 5.28; 19 HA 21 H; norm i-->j: 21 H; applied: errUni 21 ARG H 21 ARG HD2 2.72 # uni-dir reff= 4.99; 21 HD2 21 H; norm i-->j: 21 H; applied: errUni 36 ARG QB 37 PRO HD3 2.58 # uni-dir reff= 5.58; 36 QB 37 HD3; norm i-->j: 37 HD3; applied: errUni*errMethyleneQ 36 ARG H 37 PRO HD3 2.73 # uni-dir reff= 5.01; 36 H 37 HD3; norm i-->j: 37 HD3; applied: errUni 34 PHE HA 35 GLU H 2.52 # uni-dir reff= 4.63; 34 HA 35 H; norm i-->j: 35 H; applied: errUni 34 PHE QD 35 GLU H 2.92 # uni-dir reff= 6.32; 34 QD 35 H; norm i-->j: 35 H; applied: errUni*errMethyleneQ UPL SET TO 8A 26 ASN HB2 30 ASN H 3.24 # uni-dir reff= 5.95; 26 HB2 30 H; norm i-->j: 30 H; applied: errUni 33 GLN HE21 37 PRO HD2 2.89 # uni-dir reff= 5.30; 33 HE21 37 HD2; norm i-->j: 37 HD2; applied: errUni 7 LEU QD2 37 PRO HD2 1.91 # uni-dir reff= 4.61; 7 QD2 37 HD2; norm i-->j: 37 HD2; applied: errUni*errMeth 15 MET H 23 TYR H 2.68 # uni-dir reff= 4.92; 23 H 15 H; norm i-->j: 15 H; applied: errUni 15 MET H 16 SER HA 2.28 # uni-dir reff= 4.18; 16 HA 15 H; norm i-->j: 15 H; applied: errUni 15 MET H 15 MET QE 2.77 # uni-dir reff= 6.67; 15 QE 15 H; norm i-->j: 15 H; applied: errUni*errMeth 24 TYR H 32 SER HA 2.63 # uni-dir reff= 4.83; 32 HA 24 H; norm i-->j: 24 H; applied: errUni 22 VAL QG1 24 TYR H 2.13 # uni-dir reff= 5.13; 22 QG1 24 H; norm i-->j: 24 H; applied: errUni*errMeth 17 ARG QB 18 ASN HD21 1.49 # uni-dir reff= 5.79; 17 QB 18 HD21; norm i-->j: 18 HD21; applied: errUni*errMethyleneQ 23 TYR H 24 TYR H 2.43 # uni-dir reff= 4.45; 23 H 24 H; norm i-->j: 24 H; applied: errUni 24 TYR H 34 PHE QD 2.50 # uni-dir reff= 5.42; 34 QD 24 H; norm i-->j: 24 H; applied: errUni*errMethyleneQ UPL SET TO 8A 18 ASN H 18 ASN HD21 2.52 # uni-dir reff= 4.97; 18 H 18 HD21; norm i-->j: 18 HD21; applied: errUni 18 ASN HA 18 ASN HD21 1.67 # uni-dir reff= 5.23; 18 HA 18 HD21; norm i-->j: 18 HD21; applied: errUni 17 ARG QG 18 ASN HD22 1.68 # uni-dir reff= 6.21; 17 QG 18 HD22; norm i-->j: 18 HD22; applied: errUni*errMethyleneQ 8 PRO HG2 39 GLY H 3.25 # uni-dir reff= 5.97; 8 HG2 39 H; norm i-->j: 39 H; applied: errUni 18 ASN H 18 ASN HD22 2.52 # uni-dir reff= 4.63; 18 HD22 18 H; norm i-->j: 18 H; applied: errUni 37 PRO HD2 38 SER H 3.00 # uni-dir reff= 5.50; 37 HD2 38 H; norm i-->j: 38 H; applied: errUni 8 PRO HG3 38 SER H 3.13 # uni-dir reff= 5.74; 8 HG3 38 H; norm i-->j: 38 H; applied: errUni 36 ARG HG2 38 SER H 1.66 # uni-dir reff= 5.25; 36 HG2 38 H; norm i-->j: 38 H; applied: errUni 30 ASN H 30 ASN HD22 3.34 # uni-dir reff= 6.13; 30 H 30 HD22; norm i-->j: 30 HD22; applied: errUni 31 ALA H 32 SER H 2.54 # uni-dir reff= 4.66; 31 H 32 H; norm i-->j: 32 H; applied: errUni 9 PRO HB3 10 GLY HA3 1.17 # uni-dir reff= 4.36; 9 HB3 10 HA3; norm i-->j: 10 HA3; applied: errUni 18 ASN QB 20 GLY H 2.26 # uni-dir reff= 4.89; 18 QB 20 H; norm i-->j: 20 H; applied: errUni*errMethyleneQ 10 GLY H 28 ILE HG13 3.24 # uni-dir reff= 5.95; 28 HG13 10 H; norm i-->j: 10 H; applied: errUni 16 SER H 20 GLY H 2.49 # uni-dir reff= 4.57; 16 H 20 H; norm i-->j: 20 H; applied: errUni 23 TYR QD 32 SER HB2 0.62 # uni-dir reff= 3.94; 32 HB2 23 QD; norm i-->j: 23 QD; applied: errUni*errMethyleneQ 19 SER H 21 ARG HB2 2.66 # uni-dir reff= 4.89; 21 HB2 19 H; norm i-->j: 19 H; applied: errUni 23 TYR QD 33 GLN H 1.61 # uni-dir reff= 3.48; 33 H 23 QD; norm i-->j: 23 QD; applied: errUni*errMethyleneQ 19 SER HB2 21 ARG HD3 2.19 # uni-dir reff= 4.01; 19 HB2 21 HD3; norm i-->j: 21 HD3; applied: errUni 11 TRP HZ2 26 ASN HD22 2.70 # uni-dir reff= 4.95; 11 HZ2 26 HD22; norm i-->j: 26 HD22; applied: errUni 26 ASN HD22 29 THR H 2.15 # uni-dir reff= 3.95; 29 H 26 HD22; norm i-->j: 26 HD22; applied: errUni 26 ASN HD22 31 ALA H 2.87 # uni-dir reff= 5.26; 31 H 26 HD22; norm i-->j: 26 HD22; applied: errUni 26 ASN HD21 31 ALA H 2.60 # uni-dir reff= 4.78; 31 H 26 HD21; norm i-->j: 26 HD21; applied: errUni 26 ASN HA 26 ASN HD21 2.36 # uni-dir reff= 4.33; 26 HA 26 HD21; norm i-->j: 26 HD21; applied: errUni 34 PHE HA 34 PHE QD 1.50 # uni-dir reff= 3.25; 34 HA 34 QD; norm i-->j: 34 QD; applied: errUni*errMethyleneQ 26 ASN HD21 29 THR H 2.23 # uni-dir reff= 4.09; 29 H 26 HD21; norm i-->j: 26 HD21; applied: errUni 7 LEU HB2 11 TRP H 2.72 # uni-dir reff= 4.99; 11 H 7 HB2; norm i-->j: 7 HB2; applied: errUni 9 PRO HB2 28 ILE QD1 1.30 # uni-dir reff= 6.03; 9 HB2 28 QD1; norm i-->j: 28 QD1; applied: errUni*errMeth 11 TRP HE3 24 TYR HB2 1.93 # uni-dir reff= 3.54; 11 HE3 24 HB2; norm i-->j: 24 HB2; applied: errUni 24 TYR HB2 37 PRO HG2 2.57 # uni-dir reff= 4.71; 37 HG2 24 HB2; norm i-->j: 24 HB2; applied: errUni 23 TYR HB2 33 GLN H 0.91 # uni-dir reff= 3.88; 33 H 23 HB2; norm i-->j: 23 HB2; applied: errUni 34 PHE HB3 35 GLU HA 1.04 # uni-dir reff= 4.11; 35 HA 34 HB3; norm i-->j: 34 HB3; applied: errUni 26 ASN HB3 29 THR QG2 1.87 # uni-dir reff= 4.50; 29 QG2 26 HB3; norm i-->j: 26 HB3; applied: errUni*errMeth 11 TRP HZ2 26 ASN HB2 2.09 # uni-dir reff= 3.84; 11 HZ2 26 HB2; norm i-->j: 26 HB2; applied: errUni 26 ASN HB2 29 THR QG2 2.11 # uni-dir reff= 5.08; 29 QG2 26 HB2; norm i-->j: 26 HB2; applied: errUni*errMeth 25 PHE HB2 32 SER HB2 1.67 # uni-dir reff= 5.27; 25 HB2 32 HB2; norm i-->j: 32 HB2; applied: errUni 11 TRP HH2 26 ASN HB3 2.53 # uni-dir reff= 4.65; 26 HB3 11 HH2; norm i-->j: 11 HH2; applied: errUni 19 SER HB2 21 ARG HD2 2.40 # uni-dir reff= 4.41; 21 HD2 19 HB2; norm i-->j: 19 HB2; applied: errUni 11 TRP HH2 26 ASN H 2.05 # uni-dir reff= 3.76; 26 H 11 HH2; norm i-->j: 11 HH2; applied: errUni 11 TRP HH2 33 GLN HE21 2.04 # uni-dir reff= 3.74; 33 HE21 11 HH2; norm i-->j: 11 HH2; applied: errUni 11 TRP HH2 37 PRO HG3 2.34 # uni-dir reff= 4.29; 37 HG3 11 HH2; norm i-->j: 11 HH2; applied: errUni 14 ARG HB3 23 TYR H 2.62 # uni-dir reff= 4.81; 23 H 14 HB3; norm i-->j: 14 HB3; applied: errUni 14 ARG HB2 23 TYR QD 2.08 # uni-dir reff= 4.51; 23 QD 14 HB2; norm i-->j: 14 HB2; applied: errUni*errMethyleneQ UPL SET TO 8A 14 ARG HB2 25 PHE HB2 2.56 # uni-dir reff= 4.70; 25 HB2 14 HB2; norm i-->j: 14 HB2; applied: errUni 16 SER QB 19 SER HB2 1.46 # uni-dir reff= 3.16; 19 HB2 16 QB; norm i-->j: 16 QB; applied: errUni*errMethyleneQ 16 SER QB 18 ASN QB 1.66 # uni-dir reff= 4.26; 18 QB 16 QB; norm i-->j: 16 QB; applied: errUni*errMethyleneQ*errMethyleneQ 16 SER QB 18 ASN H 1.90 # uni-dir reff= 4.12; 18 H 16 QB; norm i-->j: 16 QB; applied: errUni*errMethyleneQ 27 HIS HD2 28 ILE HA 2.70 # uni-dir reff= 4.96; 27 HD2 28 HA; norm i-->j: 28 HA; applied: errUni 27 HIS HA 28 ILE HA 2.61 # uni-dir reff= 4.78; 27 HA 28 HA; norm i-->j: 28 HA; applied: errUni 11 TRP HZ3 33 GLN H 1.92 # uni-dir reff= 3.53; 33 H 11 HZ3; norm i-->j: 11 HZ3; applied: errUni 7 LEU HB2 8 PRO HD2 2.43 # uni-dir reff= 4.45; 8 HD2 7 HB2; norm i-->j: 7 HB2; applied: errUni 11 TRP H 11 TRP HB3 1.69 # uni-dir reff= 3.10; 11 H 11 HB3; norm i-->j: 11 HB3; applied: errUni 18 ASN QB 18 ASN HD22 1.76 # bi-dir reff= 4.15; 18 QB 18 HD22; norm i-->j: 18 HD22 ,norm j-->i: 18 QB; applied: errStereo( 0.0582)*errMethyleneQ 19 SER HA 20 GLY H 1.99 # uni-dir reff= 3.64; 19 HA 20 H; norm i-->j: 20 H; applied: errUni 19 SER HB2 20 GLY H 1.77 # uni-dir reff= 3.25; 20 H 19 HB2; norm i-->j: 19 HB2; applied: errUni 35 GLU H 35 GLU HG3 1.69 # uni-dir reff= 3.10; 35 HG3 35 H; norm i-->j: 35 H; applied: errUni 35 GLU H 35 GLU HG2 1.69 # uni-dir reff= 3.51; 35 HG2 35 H; norm i-->j: 35 H; applied: errUni 33 GLN HB3 35 GLU H 2.36 # uni-dir reff= 4.32; 35 H 33 HB3; norm i-->j: 35 H; applied: errUni 15 MET H 15 MET HG2 2.47 # uni-dir reff= 4.74; 15 H 15 HG2; norm i-->j: 15 H; applied: errUni 11 TRP HZ2 37 PRO HB2 2.32 # uni-dir reff= 4.26; 11 HZ2 37 HB2; norm i-->j: 11 HZ2; applied: errUni 33 GLN HE22 37 PRO HB2 2.36 # uni-dir reff= 4.34; 33 HE22 37 HB2; norm i-->j: 33 HE22; applied: errUni 8 PRO HD2 37 PRO HB3 2.59 # uni-dir reff= 4.75; 8 HD2 37 HB3; norm i-->j: 8 HD2; applied: errUni 8 PRO HG3 37 PRO HB3 2.38 # uni-dir reff= 4.37; 8 HG3 37 HB3; norm i-->j: 8 HG3; applied: errUni 36 ARG H 36 ARG HB2 1.77 # uni-dir reff= 3.25; 36 H 36 HB2; norm i-->j: 36 H; applied: errUni 24 TYR QE 36 ARG HB2 1.87 # uni-dir reff= 4.12; 24 QE 36 HB2; norm i-->j: 24 QE; applied: errUni*errMethyleneQ UPL SET TO 8A 36 ARG HA 36 ARG HB2 1.73 # uni-dir reff= 3.17; 36 HA 36 HB2; norm i-->j: 36 HA; applied: errUni 36 ARG H 36 ARG HB3 1.77 # uni-dir reff= 3.29; 36 H 36 HB3; norm i-->j: 36 H; applied: errUni 24 TYR QE 36 ARG HB3 1.87 # uni-dir reff= 4.05; 24 QE 36 HB3; norm i-->j: 24 QE; applied: errUni*errMethyleneQ UPL SET TO 8A 36 ARG HA 36 ARG HB3 1.73 # uni-dir reff= 3.25; 36 HA 36 HB3; norm i-->j: 36 HA; applied: errUni 36 ARG HB3 37 PRO HD2 1.54 # uni-dir reff= 5.03; 37 HD2 36 HB3; norm i-->j: 37 HD2; applied: errUni 27 HIS HA 27 HIS HD2 1.91 # uni-dir reff= 3.51; 27 HD2 27 HA; norm i-->j: 27 HD2; applied: errUni 39 GLY H 39 GLY HA2 1.83 # uni-dir reff= 3.36; 39 H 39 HA2; norm i-->j: 39 H; applied: errUni 8 PRO HG2 39 GLY HA2 2.08 # uni-dir reff= 3.81; 8 HG2 39 HA2; norm i-->j: 8 HG2; applied: errUni 39 GLY H 39 GLY HA3 1.83 # uni-dir reff= 3.39; 39 H 39 HA3; norm i-->j: 39 H; applied: errUni 8 PRO HG2 39 GLY HA3 2.08 # uni-dir reff= 3.89; 8 HG2 39 HA3; norm i-->j: 8 HG2; applied: errUni 8 PRO HG3 39 GLY HA3 1.05 # uni-dir reff= 4.12; 8 HG3 39 HA3; norm i-->j: 8 HG3; applied: errUni 13 LYS QE 22 VAL QG1 2.05 # uni-dir reff= 5.84; 22 QG1 13 QE; norm i-->j: 22 QG1; applied: errUni*errMeth*errMethyleneQ 24 TYR HB3 37 PRO HG3 2.15 # uni-dir reff= 3.95; 37 HG3 24 HB3; norm i-->j: 37 HG3; applied: errUni 11 TRP HE3 24 TYR HB3 1.40 # uni-dir reff= 2.56; 11 HE3 24 HB3; norm i-->j: 11 HE3; applied: errUni 25 PHE HZ 30 ASN HB2 1.74 # uni-dir reff= 3.19; 25 HZ 30 HB2; norm i-->j: 25 HZ; applied: errUni 38 SER H 38 SER HB2 1.87 # uni-dir reff= 3.43; 38 H 38 HB2; norm i-->j: 38 H; applied: errUni 38 SER HB2 39 GLY H 2.44 # uni-dir reff= 4.47; 39 H 38 HB2; norm i-->j: 39 H; applied: errUni 38 SER HB3 39 GLY H 2.44 # uni-dir reff= 4.52; 39 H 38 HB3; norm i-->j: 39 H; applied: errUni 14 ARG HA 15 MET QB 2.10 # uni-dir reff= 4.56; 14 HA 15 QB; norm i-->j: 14 HA; applied: errUni*errMethyleneQ 6 LYS HB2 7 LEU H 2.28 # uni-dir reff= 4.17; 7 H 6 HB2; norm i-->j: 7 H; applied: errUni 6 LYS HB3 7 LEU H 2.28 # uni-dir reff= 4.27; 7 H 6 HB3; norm i-->j: 7 H; applied: errUni 13 LYS HD2 22 VAL QG1 2.94 # uni-dir reff= 7.08; 22 QG1 13 HD2; norm i-->j: 22 QG1; applied: errUni*errMeth 30 ASN HA 30 ASN HD21 2.05 # uni-dir reff= 3.76; 30 HA 30 HD21; norm i-->j: 30 HA; applied: errUni 23 TYR HB2 34 PHE HA 0.23 # uni-dir reff= 2.63; 23 HB2 34 HA; norm i-->j: 23 HB2; applied: errUni 8 PRO HG2 37 PRO HB3 2.51 # uni-dir reff= 4.60; 8 HG2 37 HB3; norm i-->j: 8 HG2; applied: errUni 35 GLU HA 36 ARG HB3 2.01 # uni-dir reff= 5.88; 35 HA 36 HB3; norm i-->j: 35 HA; applied: errUni 27 HIS HA 30 ASN HA 2.25 # uni-dir reff= 4.12; 30 HA 27 HA; norm i-->j: 30 HA; applied: errUni 7 LEU HA 7 LEU HG 2.06 # uni-dir reff= 3.78; 7 HA 7 HG; norm i-->j: 7 HA; applied: errUni 7 LEU HB3 7 LEU HG 1.90 # uni-dir reff= 3.48; 7 HB3 7 HG; norm i-->j: 7 HB3; applied: errUni 7 LEU H 7 LEU HG 1.85 # uni-dir reff= 3.39; 7 H 7 HG; norm i-->j: 7 H; applied: errUni 17 ARG QG 18 ASN H 2.49 # uni-dir reff= 5.41; 18 H 17 QG; norm i-->j: 18 H; applied: errUni*errMethyleneQ 33 GLN HE21 36 ARG H 3.05 # uni-dir reff= 5.58; 36 H 33 HE21; norm i-->j: 36 H; applied: errUni 20 GLY HA2 22 VAL H 1.92 # uni-dir reff= 5.73; 22 H 20 HA2; norm i-->j: 22 H; applied: errUni 8 PRO HB3 39 GLY HA2 2.18 # uni-dir reff= 4.00; 8 HB3 39 HA2; norm i-->j: 8 HB3; applied: errUni 8 PRO HB2 39 GLY HA2 1.27 # uni-dir reff= 4.53; 8 HB2 39 HA2; norm i-->j: 8 HB2; applied: errUni 8 PRO HB3 39 GLY HA3 2.18 # uni-dir reff= 4.10; 8 HB3 39 HA3; norm i-->j: 8 HB3; applied: errUni 33 GLN HE21 37 PRO HG3 2.46 # uni-dir reff= 4.51; 37 HG3 33 HE21; norm i-->j: 37 HG3; applied: errUni 24 TYR HB3 37 PRO HD2 2.58 # uni-dir reff= 4.72; 37 HD2 24 HB3; norm i-->j: 37 HD2; applied: errUni 13 LYS HA 24 TYR HB3 2.75 # uni-dir reff= 5.03; 13 HA 24 HB3; norm i-->j: 13 HA; applied: errUni 24 TYR HB3 37 PRO HG2 3.03 # uni-dir reff= 5.56; 37 HG2 24 HB3; norm i-->j: 37 HG2; applied: errUni 33 GLN HE22 35 GLU HG2 2.72 # uni-dir reff= 5.06; 33 HE22 35 HG2; norm i-->j: 33 HE22; applied: errUni 33 GLN HE22 35 GLU HG3 2.72 # uni-dir reff= 4.99; 33 HE22 35 HG3; norm i-->j: 33 HE22; applied: errUni 15 MET QB 23 TYR H 2.69 # uni-dir reff= 5.83; 23 H 15 QB; norm i-->j: 23 H; applied: errUni*errMethyleneQ 13 LYS HB3 24 TYR QE 2.05 # uni-dir reff= 4.44; 24 QE 13 HB3; norm i-->j: 24 QE; applied: errUni*errMethyleneQ UPL SET TO 8A 6 LYS HA 6 LYS QD 2.01 6 LYS HA 6 LYS HD3 2.03 8 PRO HB2 39 GLY QA 1.27 8 PRO HB2 39 GLY HA3 1.27 8 PRO HG3 39 GLY QA 1.05 8 PRO HG3 39 GLY HA2 1.05 9 PRO QB 10 GLY H 1.91 9 PRO QB 10 GLY HA3 1.17 9 PRO HB2 10 GLY HA3 1.17 9 PRO QB 28 ILE QD1 1.29 9 PRO HB3 28 ILE QD1 1.30 9 PRO QG 10 GLY H 2.60 12 GLU HA 12 GLU QG 1.97 12 GLU QB 14 ARG QG 1.17 12 GLU QB 14 ARG HG2 1.18 12 GLU QG 13 LYS H 2.16 12 GLU QG 14 ARG QG 1.88 12 GLU QG 25 PHE HB3 2.11 13 LYS HA 14 ARG QG 1.35 13 LYS HA 14 ARG HG2 1.35 14 ARG H 14 ARG QD 1.66 14 ARG H 14 ARG HD3 1.67 14 ARG HA 14 ARG QG 1.63 14 ARG HA 14 ARG QD 1.72 14 ARG QG 15 MET H 2.30 14 ARG QG 23 TYR QE 0.73 14 ARG HG2 23 TYR QE 0.73 14 ARG QG 25 PHE H 1.52 14 ARG HG2 25 PHE H 1.52 14 ARG QG 25 PHE HB2 2.43 14 ARG QG 25 PHE HB3 1.84 14 ARG QD 15 MET H 2.65 14 ARG QD 23 TYR QE 1.68 14 ARG QD 25 PHE H 1.83 14 ARG HD2 25 PHE H 1.84 14 ARG QD 25 PHE HB2 2.52 14 ARG QD 25 PHE HB3 2.47 15 MET H 15 MET QG 2.25 15 MET QG 16 SER H 1.64 15 MET QG 22 VAL HA 0.93 15 MET HG3 22 VAL HA 0.93 17 ARG HA 17 ARG QD 2.99 17 ARG QB 18 ASN QD2 1.49 17 ARG QB 18 ASN HD22 1.49 17 ARG QG 18 ASN QD2 1.67 17 ARG QG 18 ASN HD21 1.68 18 ASN H 18 ASN QD2 2.32 18 ASN HA 18 ASN QD2 1.66 18 ASN HA 18 ASN HD22 1.67 20 GLY QA 22 VAL H 1.91 20 GLY HA3 22 VAL H 1.92 21 ARG HH22 34 PHE QB 2.00 23 TYR H 23 TYR QB 2.09 23 TYR QB 24 TYR H 1.34 23 TYR QB 33 GLN H 0.91 23 TYR HB3 33 GLN H 0.91 23 TYR QB 34 PHE HA 0.23 23 TYR HB3 34 PHE HA 0.23 23 TYR QB 34 PHE QD 1.51 23 TYR QB 34 PHE QE 1.01 23 TYR HB2 34 PHE QE 1.02 23 TYR QD 32 SER QB 0.62 23 TYR QD 32 SER HB3 0.62 24 TYR QE 36 ARG QG 0.75 24 TYR QE 36 ARG HG2 0.75 25 PHE HA 32 SER QB 2.01 25 PHE HB2 32 SER QB 1.66 25 PHE HB2 32 SER HB3 1.67 25 PHE QD 32 SER QB 1.73 32 SER HA 32 SER QB 1.64 32 SER QB 33 GLN H 2.24 32 SER QB 34 PHE QE 1.23 32 SER HB2 34 PHE QE 1.24 33 GLN HE22 35 GLU QB 2.25 34 PHE H 34 PHE QB 1.68 34 PHE HA 34 PHE QB 1.64 34 PHE QB 35 GLU H 1.93 34 PHE QB 35 GLU HA 1.04 34 PHE HB2 35 GLU HA 1.04 35 GLU H 35 GLU QB 1.64 35 GLU H 35 GLU QG 1.58 35 GLU HA 35 GLU QG 1.64 35 GLU HA 36 ARG QB 2.51 35 GLU HA 36 ARG HB2 2.01 35 GLU QB 36 ARG H 2.06 35 GLU QG 36 ARG H 2.33 36 ARG HA 36 ARG QG 1.74 36 ARG QB 37 PRO HD2 2.18 36 ARG HB2 37 PRO HD2 1.54 36 ARG QG 37 PRO HD2 1.53 36 ARG QG 38 SER H 1.65 36 ARG HG3 38 SER H 1.66 # Restraints file 3: bundleShort.cco 26 ASN H 26 ASN HA 9.93 0.14 & 14 ARG H 14 ARG HA 9.47 0.13 & 36 ARG H 36 ARG HA 2.79 0.33 & 13 LYS H 13 LYS HA 8.08 0.23 & 7 LEU H 7 LEU HA 5.91 0.64 & 22 VAL H 22 VAL HA 5.79 0.11 & 25 PHE H 25 PHE HA 10.32 0.12 & 23 TYR H 23 TYR HA 6.89 0.10 & 28 ILE H 28 ILE HA 8.80 0.10 & 16 SER H 16 SER HA 4.41 0.10 & 12 GLU H 12 GLU HA 9.74 0.13 & 33 GLN H 33 GLN HA 7.80 0.15 & 34 PHE H 34 PHE HA 6.27 0.11 & 31 ALA H 31 ALA HA 6.99 0.11 & 27 HIS H 27 HIS HA 6.21 0.21 & 21 ARG H 21 ARG HA 6.18 0.11 & 35 GLU H 35 GLU HA 5.43 0.11 & 30 ASN H 30 ASN HA 6.97 0.12 & 15 MET H 15 MET HA 9.72 0.10 & 11 TRP H 11 TRP HA 7.75 0.11 & 24 TYR H 24 TYR HA 10.17 0.15 & 38 SER H 38 SER HA 7.89 0.10 & 18 ASN H 18 ASN HA 8.23 0.10 & 32 SER H 32 SER HA 9.55 0.11 & 19 SER H 19 SER HA 8.88 0.11 & 29 THR H 29 THR HA 8.64 0.10 & 11 TRP N 11 TRP CG 1.01 0.50 & 23 TYR N 23 TYR CG 1.08 0.50 & 24 TYR N 24 TYR CG 0.83 0.50 & 25 PHE N 25 PHE CG 2.45 0.50 & 27 HIS N 27 HIS CG 1.46 0.50 & 34 PHE N 34 PHE CG 1.35 0.50 & 11 TRP C 11 TRP CG 4.41 0.80 & 23 TYR C 23 TYR CG 1.08 0.80 & 24 TYR C 24 TYR CG 3.28 0.80 & 25 PHE C 25 PHE CG 0.82 0.80 & 27 HIS C 27 HIS CG 1.87 0.80 & 34 PHE C 34 PHE CG 2.39 0.80 & 11 TRP HA 11 TRP HB3 2.41 1.25 & 14 ARG HA 14 ARG HB2 8.15 1.05 & 14 ARG HA 14 ARG HB3 1.88 1.25 & 19 SER HA 19 SER HB3 2.13 1.11 & 19 SER HA 19 SER HB2 1.96 1.12 & 21 ARG HA 21 ARG HB2 6.80 1.05 & 21 ARG HA 21 ARG HB3 4.09 1.09 & 22 VAL HA 22 VAL HB 8.26 1.04 & 24 TYR HA 24 TYR HB3 3.26 1.15 & 24 TYR HA 24 TYR HB2 8.83 1.05 & 25 PHE HA 25 PHE HB3 7.97 1.08 & 25 PHE HA 25 PHE HB2 3.30 1.20 & 26 ASN HA 26 ASN HB2 2.33 1.32 & 26 ASN HA 26 ASN HB3 10.37 1.06 & 27 HIS HA 27 HIS HB3 4.33 1.11 & 27 HIS HA 27 HIS HB2 3.50 1.13 & 7 LEU HA 7 LEU HB2 8.78 1.08 & 7 LEU HA 7 LEU HB3 2.69 1.28 & 28 ILE HA 28 ILE HB 8.41 1.03 # Restraints file 4: bundleShort.upl 16 SER H 22 VAL HA 2.48 # bi-dir reff= 3.64; 16 H 22 HA; norm i-->j: 22 HA ,norm j-->i: 16 H 22 VAL HA 23 TYR H 1.53 # bi-dir reff= 2.25; 23 H 22 HA; norm i-->j: 22 HA ,norm j-->i: 23 H 15 MET QB 22 VAL HA 2.98 # uni-dir reff= 3.90; 15 QB 22 HA; norm i-->j: 22 HA; applied: errUni*errMethyleneQ 22 VAL HA 22 VAL QG2 2.04 # bi-dir reff= 3.32; 22 QG2 22 HA; norm i-->j: 22 HA ,norm j-->i: 22 QG2; applied: *errMeth 22 VAL HA 22 VAL QG1 2.11 # bi-dir reff= 3.42; 22 QG1 22 HA; norm i-->j: 22 HA ,norm j-->i: 22 QG1; applied: *errMeth 22 VAL H 22 VAL HB 1.66 # bi-dir reff= 2.43; 22 H 22 HB; norm i-->j: 22 HB ,norm j-->i: 22 H 21 ARG HA 22 VAL HB 3.90 # uni-dir reff= 4.76; 21 HA 22 HB; norm i-->j: 22 HB; applied: errUni 11 TRP HA 11 TRP HB2 2.00 # bi-dir reff= 2.93; 11 HA 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 11 HA 11 TRP HB2 12 GLU H 2.75 # bi-dir reff= 4.03; 12 H 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 12 H 11 TRP HA 11 TRP HB3 1.78 # bi-dir reff= 2.62; 11 HA 11 HB3; norm i-->j: 11 HB3 ,norm j-->i: 11 HA 7 LEU HB2 11 TRP HB3 3.15 # uni-dir reff= 3.85; 7 HB2 11 HB3; norm i-->j: 11 HB3; applied: errUni 21 ARG HB3 22 VAL H 2.45 # uni-dir reff= 3.00; 22 H 21 HB3; norm i-->j: 21 HB3; applied: errUni 21 ARG H 21 ARG HB3 2.47 # bi-dir reff= 3.62; 21 H 21 HB3; norm i-->j: 21 HB3 ,norm j-->i: 21 H 21 ARG HB3 34 PHE QE 5.45 # uni-dir reff= 5.47; 34 QE 21 HB3; norm i-->j: 21 HB3; applied: errUni*errMethyleneQ UPL SET TO 8A 21 ARG HB3 21 ARG HD3 2.54 # bi-dir reff= 3.73; 21 HD3 21 HB3; norm i-->j: 21 HB3 ,norm j-->i: 21 HD3 21 ARG HB2 22 VAL H 2.58 # bi-dir reff= 3.79; 22 H 21 HB2; norm i-->j: 21 HB2 ,norm j-->i: 22 H 21 ARG H 21 ARG HB2 1.70 # bi-dir reff= 2.50; 21 H 21 HB2; norm i-->j: 21 HB2 ,norm j-->i: 21 H 21 ARG HB2 21 ARG HD2 2.85 # uni-dir reff= 3.49; 21 HD2 21 HB2; norm i-->j: 21 HB2; applied: errUni 21 ARG HB2 21 ARG HD3 2.29 # uni-dir reff= 2.80; 21 HD3 21 HB2; norm i-->j: 21 HB2; applied: errUni 21 ARG HB2 34 PHE QE 5.45 # uni-dir reff= 5.72; 34 QE 21 HB2; norm i-->j: 21 HB2; applied: errUni*errMethyleneQ UPL SET TO 8A 7 LEU HB2 11 TRP HB2 2.49 # bi-dir reff= 3.65; 7 HB2 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 7 HB2 11 TRP HB2 11 TRP HD1 1.95 # bi-dir reff= 2.86; 11 HD1 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 11 HD1 7 LEU HB3 11 TRP HB2 1.78 # bi-dir reff= 2.62; 7 HB3 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 7 HB3 7 LEU QD2 11 TRP HB2 2.75 # bi-dir reff= 4.46; 7 QD2 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 7 QD2; applied: *errMeth 7 LEU QD1 11 TRP HB2 2.97 # bi-dir reff= 4.83; 7 QD1 11 HB2; norm i-->j: 11 HB2 ,norm j-->i: 7 QD1; applied: *errMeth 11 TRP HB3 12 GLU H 1.98 # bi-dir reff= 2.91; 12 H 11 HB3; norm i-->j: 11 HB3 ,norm j-->i: 12 H 7 LEU HB3 11 TRP HB3 2.22 # uni-dir reff= 2.72; 7 HB3 11 HB3; norm i-->j: 11 HB3; applied: errUni 7 LEU QD2 11 TRP HB3 2.47 # bi-dir reff= 4.01; 7 QD2 11 HB3; norm i-->j: 11 HB3 ,norm j-->i: 7 QD2; applied: *errMeth 11 TRP HB3 37 PRO HG2 3.33 # uni-dir reff= 4.07; 37 HG2 11 HB3; norm i-->j: 11 HB3; applied: errUni 7 LEU QD1 11 TRP HB3 2.70 # uni-dir reff= 3.66; 7 QD1 11 HB3; norm i-->j: 11 HB3; applied: errUni*errMeth 37 PRO HA 38 SER H 1.60 # bi-dir reff= 2.35; 38 H 37 HA; norm i-->j: 37 HA ,norm j-->i: 38 H 33 GLN HE21 37 PRO HA 3.17 # uni-dir reff= 3.87; 33 HE21 37 HA; norm i-->j: 37 HA; applied: errUni 33 GLN HE22 37 PRO HA 2.04 # bi-dir reff= 3.00; 33 HE22 37 HA; norm i-->j: 37 HA ,norm j-->i: 33 HE22 9 PRO HB3 10 GLY H 2.96 # bi-dir reff= 4.08; 10 H 9 HB3; norm i-->j: 9 HB3 ,norm j-->i: 10 H; applied: errStereo( 0.0649) 33 GLN H 33 GLN HB2 2.61 # uni-dir reff= 3.19; 33 H 33 HB2; norm i-->j: 33 HB2; applied: errUni 33 GLN HB2 34 PHE H 2.19 # bi-dir reff= 3.22; 34 H 33 HB2; norm i-->j: 33 HB2 ,norm j-->i: 34 H 33 GLN HB2 35 GLU H 2.29 # uni-dir reff= 2.80; 35 H 33 HB2; norm i-->j: 33 HB2; applied: errUni 33 GLN HB2 33 GLN HE21 2.60 # uni-dir reff= 3.18; 33 HE21 33 HB2; norm i-->j: 33 HB2; applied: errUni 33 GLN HB2 33 GLN HE22 2.78 # bi-dir reff= 4.08; 33 HE22 33 HB2; norm i-->j: 33 HB2 ,norm j-->i: 33 HE22 29 THR H 29 THR HA 1.97 # bi-dir reff= 2.89; 29 H 29 HA; norm i-->j: 29 HA ,norm j-->i: 29 H 29 THR HA 29 THR QG2 2.25 # uni-dir reff= 3.04; 29 QG2 29 HA; norm i-->j: 29 HA; applied: errUni*errMeth 11 TRP HE3 25 PHE H 2.06 # bi-dir reff= 3.02; 25 H 11 HE3; norm i-->j: 11 HE3 ,norm j-->i: 25 H 17 ARG QB 18 ASN H 2.21 # bi-dir reff= 3.47; 18 H 17 QB; norm i-->j: 17 QB ,norm j-->i: 18 H; applied: *errMethyleneQ 17 ARG QB 17 ARG HD2 2.60 # uni-dir reff= 3.39; 17 HD2 17 QB; norm i-->j: 17 QB; applied: errUni*errMethyleneQ 17 ARG QB 17 ARG HD3 2.60 # uni-dir reff= 3.06; 17 HD3 17 QB; norm i-->j: 17 QB; applied: errUni*errMethyleneQ 17 ARG HA 17 ARG QB 1.78 # bi-dir reff= 2.79; 17 HA 17 QB; norm i-->j: 17 QB ,norm j-->i: 17 HA; applied: *errMethyleneQ 8 PRO HB3 11 TRP HD1 2.79 # bi-dir reff= 4.10; 11 HD1 8 HB3; norm i-->j: 8 HB3 ,norm j-->i: 11 HD1 8 PRO HB3 9 PRO HD3 2.58 # bi-dir reff= 3.79; 9 HD3 8 HB3; norm i-->j: 8 HB3 ,norm j-->i: 9 HD3 8 PRO HB2 11 TRP HE1 2.50 # bi-dir reff= 3.67; 11 HE1 8 HB2; norm i-->j: 8 HB2 ,norm j-->i: 11 HE1 8 PRO HB2 11 TRP HD1 1.75 # bi-dir reff= 2.57; 11 HD1 8 HB2; norm i-->j: 8 HB2 ,norm j-->i: 11 HD1 8 PRO HB2 9 PRO HD2 2.34 # uni-dir reff= 2.86; 9 HD2 8 HB2; norm i-->j: 8 HB2; applied: errUni 35 GLU H 35 GLU HB2 2.19 # bi-dir reff= 2.79; 35 H 35 HB2; norm i-->j: 35 HB2 ,norm j-->i: 35 H; applied: errStereo( 0.0648) 35 GLU HB2 36 ARG H 2.70 # bi-dir reff= 3.74; 36 H 35 HB2; norm i-->j: 35 HB2 ,norm j-->i: 36 H; applied: errStereo( 0.0563) 33 GLN HE21 35 GLU HB2 3.17 # uni-dir reff= 3.80; 33 HE21 35 HB2; norm i-->j: 35 HB2; applied: errUni 33 GLN HE22 35 GLU HB2 2.80 # bi-dir reff= 3.84; 33 HE22 35 HB2; norm i-->j: 35 HB2 ,norm j-->i: 33 HE22; applied: errStereo( 0.0513) 35 GLU HB3 36 ARG H 2.70 # bi-dir reff= 3.47; 36 H 35 HB3; norm i-->j: 35 HB3 ,norm j-->i: 36 H; applied: errStereo( 0.0560) 35 GLU H 35 GLU HB3 2.19 # bi-dir reff= 3.02; 35 H 35 HB3; norm i-->j: 35 HB3 ,norm j-->i: 35 H; applied: errStereo( 0.0654) 33 GLN HE21 35 GLU HB3 3.17 # uni-dir reff= 3.87; 33 HE21 35 HB3; norm i-->j: 35 HB3; applied: errUni 33 GLN HE22 35 GLU HB3 2.80 # bi-dir reff= 3.95; 33 HE22 35 HB3; norm i-->j: 35 HB3 ,norm j-->i: 33 HE22; applied: errStereo( 0.0416) 16 SER H 23 TYR QE 2.39 # bi-dir reff= 3.75; 16 H 23 QE; norm i-->j: 23 QE ,norm j-->i: 16 H; applied: *errMethyleneQ 23 TYR QE 25 PHE QD 5.45 # uni-dir reff= 3.59; 25 QD 23 QE; norm i-->j: 23 QE; applied: errUni*errMethyleneQ*errMethyleneQ UPL SET TO 8A 16 SER HA 23 TYR QE 2.62 # uni-dir reff= 3.42; 16 HA 23 QE; norm i-->j: 23 QE; applied: errUni*errMethyleneQ 16 SER QB 23 TYR QE 2.33 # bi-dir reff= 3.91; 16 QB 23 QE; norm i-->j: 23 QE ,norm j-->i: 16 QB; applied: *errMethyleneQ*errMethyleneQ 23 TYR QE 25 PHE HB2 1.76 # bi-dir reff= 2.76; 25 HB2 23 QE; norm i-->j: 23 QE ,norm j-->i: 25 HB2; applied: *errMethyleneQ 23 TYR QE 25 PHE HB3 2.37 # bi-dir reff= 3.72; 25 HB3 23 QE; norm i-->j: 23 QE ,norm j-->i: 25 HB3; applied: *errMethyleneQ 14 ARG HD2 23 TYR QE 3.32 # uni-dir reff= 3.92; 14 HD2 23 QE; norm i-->j: 23 QE; applied: errUni*errMethyleneQ 14 ARG HB3 23 TYR QE 2.50 # bi-dir reff= 3.92; 14 HB3 23 QE; norm i-->j: 23 QE ,norm j-->i: 14 HB3; applied: *errMethyleneQ 14 ARG HB2 23 TYR QE 2.47 # uni-dir reff= 3.23; 14 HB2 23 QE; norm i-->j: 23 QE; applied: errUni*errMethyleneQ 11 TRP HE1 26 ASN HD22 2.62 # bi-dir reff= 3.85; 26 HD22 11 HE1; norm i-->j: 11 HE1 ,norm j-->i: 26 HD22 11 TRP HE1 26 ASN HD21 2.10 # bi-dir reff= 3.08; 26 HD21 11 HE1; norm i-->j: 11 HE1 ,norm j-->i: 26 HD21 8 PRO HG3 11 TRP HE1 2.70 # bi-dir reff= 3.96; 8 HG3 11 HE1; norm i-->j: 11 HE1 ,norm j-->i: 8 HG3 11 TRP HE1 37 PRO HB2 3.07 # uni-dir reff= 3.76; 37 HB2 11 HE1; norm i-->j: 11 HE1; applied: errUni 11 TRP HE1 37 PRO HB3 3.11 # uni-dir reff= 3.80; 37 HB3 11 HE1; norm i-->j: 11 HE1; applied: errUni 27 HIS H 27 HIS HB3 2.26 # bi-dir reff= 3.11; 27 H 27 HB3; norm i-->j: 27 HB3 ,norm j-->i: 27 H; applied: errStereo( 0.0686) 27 HIS H 27 HIS HB2 2.26 # bi-dir reff= 3.03; 27 H 27 HB2; norm i-->j: 27 HB2 ,norm j-->i: 27 H; applied: errStereo( 0.0687) 19 SER HA 19 SER HB2 1.68 # bi-dir reff= 2.47; 19 HB2 19 HA; norm i-->j: 19 HA ,norm j-->i: 19 HB2 19 SER HA 19 SER HB3 1.82 # bi-dir reff= 2.67; 19 HB3 19 HA; norm i-->j: 19 HA ,norm j-->i: 19 HB3 17 ARG HA 18 ASN H 2.29 # bi-dir reff= 3.36; 18 H 17 HA; norm i-->j: 17 HA ,norm j-->i: 18 H 17 ARG HA 17 ARG HD3 3.83 # bi-dir reff= 5.14; 17 HD3 17 HA; norm i-->j: 17 HA ,norm j-->i: 17 HD3; applied: errStereo( 0.0572) 17 ARG HA 17 ARG QG 2.26 # uni-dir reff= 2.95; 17 QG 17 HA; norm i-->j: 17 HA; applied: errUni*errMethyleneQ 11 TRP HZ3 26 ASN H 2.86 # uni-dir reff= 3.50; 11 HZ3 26 H; norm i-->j: 26 H; applied: errUni 26 ASN H 31 ALA H 2.55 # uni-dir reff= 3.13; 31 H 26 H; norm i-->j: 26 H; applied: errUni 25 PHE HA 26 ASN H 1.52 # bi-dir reff= 2.23; 25 HA 26 H; norm i-->j: 26 H ,norm j-->i: 25 HA 26 ASN H 26 ASN HD21 3.41 # bi-dir reff= 5.01; 26 HD21 26 H; norm i-->j: 26 H ,norm j-->i: 26 HD21 26 ASN H 26 ASN HB3 1.85 # bi-dir reff= 2.72; 26 HB3 26 H; norm i-->j: 26 H ,norm j-->i: 26 HB3 26 ASN H 31 ALA QB 2.94 # uni-dir reff= 3.99; 31 QB 26 H; norm i-->j: 26 H; applied: errUni*errMeth 26 ASN H 26 ASN HB2 1.89 # bi-dir reff= 2.78; 26 HB2 26 H; norm i-->j: 26 H ,norm j-->i: 26 HB2 38 SER HA 39 GLY H 1.96 # bi-dir reff= 2.88; 39 H 38 HA; norm i-->j: 38 HA ,norm j-->i: 39 H 10 GLY HA3 28 ILE HG13 2.22 # bi-dir reff= 3.26; 10 HA3 28 HG13; norm i-->j: 28 HG13 ,norm j-->i: 10 HA3 28 ILE H 28 ILE HG13 1.85 # bi-dir reff= 2.72; 28 H 28 HG13; norm i-->j: 28 HG13 ,norm j-->i: 28 H 28 ILE HA 28 ILE HG13 2.25 # bi-dir reff= 3.30; 28 HA 28 HG13; norm i-->j: 28 HG13 ,norm j-->i: 28 HA 28 ILE HB 28 ILE HG13 1.88 # bi-dir reff= 2.76; 28 HB 28 HG13; norm i-->j: 28 HG13 ,norm j-->i: 28 HB 28 ILE H 28 ILE HG12 2.38 # bi-dir reff= 3.50; 28 H 28 HG12; norm i-->j: 28 HG12 ,norm j-->i: 28 H 28 ILE HA 28 ILE HG12 1.89 # bi-dir reff= 2.77; 28 HA 28 HG12; norm i-->j: 28 HG12 ,norm j-->i: 28 HA 13 LYS HB2 24 TYR QE 2.13 # bi-dir reff= 3.34; 13 HB2 24 QE; norm i-->j: 24 QE ,norm j-->i: 13 HB2; applied: *errMethyleneQ 24 TYR QE 36 ARG QB 3.17 # uni-dir reff= 4.44; 36 QB 24 QE; norm i-->j: 24 QE; applied: errUni*errMethyleneQ*errMethyleneQ 27 HIS HD2 28 ILE HG13 3.26 # uni-dir reff= 3.98; 27 HD2 28 HG13; norm i-->j: 28 HG13; applied: errUni 10 GLY HA2 28 ILE HG13 2.22 # bi-dir reff= 3.26; 10 HA2 28 HG13; norm i-->j: 28 HG13 ,norm j-->i: 10 HA2 10 GLY HA3 28 ILE HG12 3.99 # uni-dir reff= 4.88; 10 HA3 28 HG12; norm i-->j: 28 HG12; applied: errUni 24 TYR QE 36 ARG HA 2.19 # bi-dir reff= 3.44; 36 HA 24 QE; norm i-->j: 24 QE ,norm j-->i: 36 HA; applied: *errMethyleneQ 11 TRP HA 12 GLU H 1.49 # bi-dir reff= 2.19; 12 H 11 HA; norm i-->j: 11 HA ,norm j-->i: 12 H 11 TRP HA 27 HIS H 2.56 # bi-dir reff= 3.76; 27 H 11 HA; norm i-->j: 11 HA ,norm j-->i: 27 H 11 TRP HA 26 ASN HA 1.61 # bi-dir reff= 2.36; 26 HA 11 HA; norm i-->j: 11 HA ,norm j-->i: 26 HA 7 LEU HA 8 PRO HG2 3.69 # uni-dir reff= 4.52; 7 HA 8 HG2; norm i-->j: 8 HG2; applied: errUni 8 PRO HG2 37 PRO HB2 2.77 # uni-dir reff= 3.38; 37 HB2 8 HG2; norm i-->j: 8 HG2; applied: errUni 8 PRO HG2 37 PRO HG2 3.43 # uni-dir reff= 4.19; 37 HG2 8 HG2; norm i-->j: 8 HG2; applied: errUni 8 PRO HG3 11 TRP HD1 2.73 # bi-dir reff= 4.00; 11 HD1 8 HG3; norm i-->j: 8 HG3 ,norm j-->i: 11 HD1 8 PRO HG3 37 PRO HB2 2.52 # uni-dir reff= 3.09; 37 HB2 8 HG3; norm i-->j: 8 HG3; applied: errUni 14 ARG HG2 15 MET H 3.56 # uni-dir reff= 4.35; 15 H 14 HG2; norm i-->j: 14 HG2; applied: errUni 14 ARG HA 14 ARG HG2 2.53 # uni-dir reff= 3.10; 14 HA 14 HG2; norm i-->j: 14 HG2; applied: errUni 12 GLU HG3 14 ARG HG2 3.57 # bi-dir reff= 3.99; 12 HG3 14 HG2; norm i-->j: 14 HG2 ,norm j-->i: 12 HG3; applied: errStereo( 0.1062) 14 ARG H 14 ARG HG2 2.92 # uni-dir reff= 3.57; 14 H 14 HG2; norm i-->j: 14 HG2; applied: errUni 14 ARG HG3 15 MET H 3.56 # bi-dir reff= 4.63; 15 H 14 HG3; norm i-->j: 14 HG3 ,norm j-->i: 15 H; applied: errStereo( 0.0271) 14 ARG HA 14 ARG HG3 2.53 # bi-dir reff= 3.36; 14 HA 14 HG3; norm i-->j: 14 HG3 ,norm j-->i: 14 HA; applied: errStereo( 0.0530) 14 ARG H 14 ARG HG3 2.92 # uni-dir reff= 3.51; 14 H 14 HG3; norm i-->j: 14 HG3; applied: errUni 36 ARG HA 36 ARG HG3 2.28 # bi-dir reff= 2.92; 36 HA 36 HG3; norm i-->j: 36 HG3 ,norm j-->i: 36 HA; applied: errStereo( 0.0525) 36 ARG HG3 37 PRO HD2 2.38 # uni-dir reff= 2.91; 37 HD2 36 HG3; norm i-->j: 36 HG3; applied: errUni 14 ARG H 23 TYR H 2.21 # bi-dir reff= 3.25; 23 H 14 H; norm i-->j: 14 H ,norm j-->i: 23 H 14 ARG H 24 TYR HA 2.21 # bi-dir reff= 3.24; 24 HA 14 H; norm i-->j: 14 H ,norm j-->i: 24 HA 13 LYS HA 14 ARG H 1.49 # bi-dir reff= 2.19; 13 HA 14 H; norm i-->j: 14 H ,norm j-->i: 13 HA 13 LYS HB3 14 ARG H 3.32 # uni-dir reff= 4.06; 13 HB3 14 H; norm i-->j: 14 H; applied: errUni 13 LYS HB2 14 ARG H 3.68 # uni-dir reff= 4.50; 13 HB2 14 H; norm i-->j: 14 H; applied: errUni 13 LYS QG 14 ARG H 2.15 # bi-dir reff= 3.38; 13 QG 14 H; norm i-->j: 14 H ,norm j-->i: 13 QG; applied: *errMethyleneQ 14 ARG H 22 VAL QG1 2.98 # bi-dir reff= 4.84; 22 QG1 14 H; norm i-->j: 14 H ,norm j-->i: 22 QG1; applied: *errMeth 14 ARG H 14 ARG HB2 1.86 # bi-dir reff= 2.73; 14 HB2 14 H; norm i-->j: 14 H ,norm j-->i: 14 HB2 24 TYR HA 25 PHE H 1.51 # bi-dir reff= 2.22; 25 H 24 HA; norm i-->j: 24 HA ,norm j-->i: 25 H 24 TYR HA 24 TYR QD 5.45 # uni-dir reff= 3.28; 24 QD 24 HA; norm i-->j: 24 HA; applied: errUni*errMethyleneQ UPL SET TO 8A 13 LYS HA 24 TYR HA 1.83 # bi-dir reff= 2.69; 13 HA 24 HA; norm i-->j: 24 HA ,norm j-->i: 13 HA 24 TYR HA 24 TYR HB3 2.01 # uni-dir reff= 2.46; 24 HB3 24 HA; norm i-->j: 24 HA; applied: errUni 24 TYR HA 24 TYR HB2 2.02 # bi-dir reff= 2.96; 24 HB2 24 HA; norm i-->j: 24 HA ,norm j-->i: 24 HB2 13 LYS QG 24 TYR HA 3.33 # uni-dir reff= 4.36; 13 QG 24 HA; norm i-->j: 24 HA; applied: errUni*errMethyleneQ 35 GLU HA 36 ARG H 1.55 # bi-dir reff= 2.27; 36 H 35 HA; norm i-->j: 35 HA ,norm j-->i: 36 H 21 ARG QG 22 VAL H 2.95 # uni-dir reff= 3.86; 22 H 21 QG; norm i-->j: 21 QG; applied: errUni*errMethyleneQ 21 ARG H 21 ARG QG 2.81 # uni-dir reff= 3.67; 21 H 21 QG; norm i-->j: 21 QG; applied: errUni*errMethyleneQ 19 SER HB2 21 ARG QG 3.11 # uni-dir reff= 4.07; 19 HB2 21 QG; norm i-->j: 21 QG; applied: errUni*errMethyleneQ 21 ARG HB3 21 ARG QG 1.96 # uni-dir reff= 2.57; 21 HB3 21 QG; norm i-->j: 21 QG; applied: errUni*errMethyleneQ 36 ARG HA 36 ARG HG2 2.28 # bi-dir reff= 3.17; 36 HA 36 HG2; norm i-->j: 36 HG2 ,norm j-->i: 36 HA; applied: errStereo( 0.0529) 36 ARG HG2 37 PRO HD2 2.38 # bi-dir reff= 3.03; 37 HD2 36 HG2; norm i-->j: 36 HG2 ,norm j-->i: 37 HD2; applied: errStereo( 0.0354) 36 ARG HG3 37 PRO HD3 3.88 # uni-dir reff= 4.74; 37 HD3 36 HG3; norm i-->j: 36 HG3; applied: errUni 32 SER HA 33 GLN H 1.56 # bi-dir reff= 2.29; 33 H 32 HA; norm i-->j: 32 HA ,norm j-->i: 33 H 11 TRP HZ3 32 SER HA 2.21 # bi-dir reff= 3.24; 11 HZ3 32 HA; norm i-->j: 32 HA ,norm j-->i: 11 HZ3 32 SER HA 32 SER HB2 2.01 # bi-dir reff= 2.87; 32 HB2 32 HA; norm i-->j: 32 HA ,norm j-->i: 32 HB2; applied: errStereo( 0.0294) 32 SER HA 32 SER HB3 2.01 # bi-dir reff= 2.71; 32 HB3 32 HA; norm i-->j: 32 HA ,norm j-->i: 32 HB3; applied: errStereo( 0.0294) 32 SER HA 33 GLN HB3 3.09 # uni-dir reff= 3.78; 33 HB3 32 HA; norm i-->j: 32 HA; applied: errUni 26 ASN HB3 32 SER HA 3.41 # uni-dir reff= 4.16; 26 HB3 32 HA; norm i-->j: 32 HA; applied: errUni 11 TRP HE3 24 TYR HA 3.38 # uni-dir reff= 4.14; 11 HE3 24 HA; norm i-->j: 24 HA; applied: errUni 21 ARG HA 21 ARG QG 2.22 # uni-dir reff= 2.90; 21 HA 21 QG; norm i-->j: 21 QG; applied: errUni*errMethyleneQ 25 PHE HA 25 PHE QD 2.00 # bi-dir reff= 3.13; 25 QD 25 HA; norm i-->j: 25 HA ,norm j-->i: 25 QD; applied: *errMethyleneQ 25 PHE HA 25 PHE HB2 1.73 # bi-dir reff= 2.54; 25 HB2 25 HA; norm i-->j: 25 HA ,norm j-->i: 25 HB2 25 PHE HA 25 PHE HB3 2.06 # bi-dir reff= 3.02; 25 HB3 25 HA; norm i-->j: 25 HA ,norm j-->i: 25 HB3 13 LYS HA 24 TYR QD 5.45 # uni-dir reff= 3.83; 24 QD 13 HA; norm i-->j: 13 HA; applied: errUni*errMethyleneQ UPL SET TO 8A 13 LYS HA 24 TYR QE 5.45 # uni-dir reff= 4.08; 24 QE 13 HA; norm i-->j: 13 HA; applied: errUni*errMethyleneQ UPL SET TO 8A 13 LYS HA 13 LYS HB2 1.81 # bi-dir reff= 2.65; 13 HB2 13 HA; norm i-->j: 13 HA ,norm j-->i: 13 HB2 7 LEU QD2 13 LYS HA 2.47 # uni-dir reff= 3.35; 7 QD2 13 HA; norm i-->j: 13 HA; applied: errUni*errMeth 7 LEU QD2 12 GLU H 3.17 # bi-dir reff= 5.15; 12 H 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 12 H; applied: *errMeth 7 LEU QD2 13 LYS H 2.63 # bi-dir reff= 4.27; 13 H 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 13 H; applied: *errMeth 7 LEU H 7 LEU QD2 3.11 # bi-dir reff= 5.05; 7 H 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 7 H; applied: *errMeth 7 LEU QD2 24 TYR QD 5.45 # uni-dir reff= 4.99; 24 QD 7 QD2; norm i-->j: 7 QD2; applied: errUni*errMeth*errMethyleneQ UPL SET TO 8A 7 LEU QD2 24 TYR QE 5.45 # uni-dir reff= 4.60; 24 QE 7 QD2; norm i-->j: 7 QD2; applied: errUni*errMeth*errMethyleneQ UPL SET TO 8A 7 LEU QD2 12 GLU HA 2.53 # bi-dir reff= 4.12; 12 HA 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 12 HA; applied: *errMeth 7 LEU HA 7 LEU QD2 2.64 # bi-dir reff= 4.29; 7 HA 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 7 HA; applied: *errMeth 7 LEU QD2 13 LYS HB2 3.16 # uni-dir reff= 4.28; 13 HB2 7 QD2; norm i-->j: 7 QD2; applied: errUni*errMeth 7 LEU HB3 7 LEU QD2 2.09 # bi-dir reff= 3.39; 7 HB3 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 7 HB3; applied: *errMeth 24 TYR QE 36 ARG H 2.74 # bi-dir reff= 4.30; 24 QE 36 H; norm i-->j: 36 H ,norm j-->i: 24 QE; applied: *errMethyleneQ 36 ARG H 36 ARG HA 2.00 # bi-dir reff= 2.94; 36 HA 36 H; norm i-->j: 36 H ,norm j-->i: 36 HA 36 ARG H 36 ARG QB 2.21 # uni-dir reff= 2.89; 36 QB 36 H; norm i-->j: 36 H; applied: errUni*errMethyleneQ 23 TYR HA 24 TYR H 1.72 # bi-dir reff= 2.53; 24 H 23 HA; norm i-->j: 23 HA ,norm j-->i: 24 H 23 TYR HA 23 TYR HB3 1.68 # bi-dir reff= 2.46; 23 HB3 23 HA; norm i-->j: 23 HA ,norm j-->i: 23 HB3; applied: errStereo( 0.0051) 23 TYR HA 23 TYR HB2 1.68 # bi-dir reff= 2.39; 23 HB2 23 HA; norm i-->j: 23 HA ,norm j-->i: 23 HB2; applied: errStereo( 0.0050) 22 VAL QG1 23 TYR HA 2.07 # uni-dir reff= 2.80; 22 QG1 23 HA; norm i-->j: 23 HA; applied: errUni*errMeth 18 ASN H 18 ASN HA 2.00 # bi-dir reff= 2.94; 18 H 18 HA; norm i-->j: 18 HA ,norm j-->i: 18 H 8 PRO HD2 37 PRO HG2 2.05 # bi-dir reff= 3.01; 8 HD2 37 HG2; norm i-->j: 37 HG2 ,norm j-->i: 8 HD2 12 GLU HA 13 LYS H 1.58 # bi-dir reff= 2.32; 12 HA 13 H; norm i-->j: 13 H ,norm j-->i: 12 HA 12 GLU HG2 13 LYS H 2.94 # bi-dir reff= 3.90; 12 HG2 13 H; norm i-->j: 13 H ,norm j-->i: 12 HG2; applied: errStereo( 0.0658) 12 GLU QB 13 LYS H 2.43 # bi-dir reff= 3.81; 12 QB 13 H; norm i-->j: 13 H ,norm j-->i: 12 QB; applied: *errMethyleneQ 13 LYS H 13 LYS HB3 2.26 # uni-dir reff= 2.77; 13 HB3 13 H; norm i-->j: 13 H; applied: errUni 13 LYS H 13 LYS HB2 1.84 # bi-dir reff= 2.70; 13 HB2 13 H; norm i-->j: 13 H ,norm j-->i: 13 HB2 11 TRP HZ2 26 ASN HD21 2.39 # bi-dir reff= 3.51; 26 HD21 11 HZ2; norm i-->j: 11 HZ2 ,norm j-->i: 26 HD21 11 TRP HZ2 37 PRO HB3 3.03 # uni-dir reff= 3.71; 37 HB3 11 HZ2; norm i-->j: 11 HZ2; applied: errUni 17 ARG HA 18 ASN HA 3.83 # uni-dir reff= 4.69; 17 HA 18 HA; norm i-->j: 18 HA; applied: errUni 18 ASN HA 18 ASN QB 1.81 # bi-dir reff= 2.84; 18 QB 18 HA; norm i-->j: 18 HA ,norm j-->i: 18 QB; applied: *errMethyleneQ 8 PRO HD3 37 PRO HG2 2.66 # bi-dir reff= 3.91; 8 HD3 37 HG2; norm i-->j: 37 HG2 ,norm j-->i: 8 HD3 30 ASN H 30 ASN HA 1.51 # bi-dir reff= 2.22; 30 H 30 HA; norm i-->j: 30 HA ,norm j-->i: 30 H 30 ASN HA 31 ALA H 2.38 # uni-dir reff= 2.91; 31 H 30 HA; norm i-->j: 30 HA; applied: errUni 13 LYS QG 24 TYR QE 5.45 # uni-dir reff= 4.04; 24 QE 13 QG; norm i-->j: 13 QG; applied: errUni*errMethyleneQ*errMethyleneQ UPL SET TO 8A 13 LYS HA 13 LYS QG 2.36 # uni-dir reff= 3.09; 13 HA 13 QG; norm i-->j: 13 QG; applied: errUni*errMethyleneQ 13 LYS HB2 13 LYS QG 1.74 # bi-dir reff= 2.74; 13 HB2 13 QG; norm i-->j: 13 QG ,norm j-->i: 13 HB2; applied: *errMethyleneQ 13 LYS QG 22 VAL QG1 2.42 # uni-dir reff= 3.50; 22 QG1 13 QG; norm i-->j: 13 QG; applied: errUni*errMeth*errMethyleneQ 13 LYS QG 13 LYS QE 2.74 # uni-dir reff= 3.82; 13 QE 13 QG; norm i-->j: 13 QG; applied: errUni*errMethyleneQ*errMethyleneQ 6 LYS HA 7 LEU H 2.14 # uni-dir reff= 2.62; 6 HA 7 H; norm i-->j: 7 H; applied: errUni 7 LEU H 7 LEU HB2 1.83 # bi-dir reff= 2.69; 7 HB2 7 H; norm i-->j: 7 H ,norm j-->i: 7 HB2 7 LEU H 7 LEU HB3 2.57 # bi-dir reff= 3.77; 7 HB3 7 H; norm i-->j: 7 H ,norm j-->i: 7 HB3 7 LEU H 7 LEU QD1 3.46 # bi-dir reff= 5.62; 7 QD1 7 H; norm i-->j: 7 H ,norm j-->i: 7 QD1; applied: *errMeth 21 ARG HA 22 VAL H 1.89 # uni-dir reff= 2.31; 21 HA 22 H; norm i-->j: 22 H; applied: errUni 22 VAL H 22 VAL QG2 2.03 # bi-dir reff= 3.30; 22 QG2 22 H; norm i-->j: 22 H ,norm j-->i: 22 QG2; applied: *errMeth 22 VAL H 22 VAL QG1 2.88 # bi-dir reff= 4.67; 22 QG1 22 H; norm i-->j: 22 H ,norm j-->i: 22 QG1; applied: *errMeth 12 GLU HA 12 GLU HG2 2.65 # bi-dir reff= 3.64; 12 HG2 12 HA; norm i-->j: 12 HA ,norm j-->i: 12 HG2; applied: errStereo( 0.0703) 12 GLU HA 12 GLU QB 1.79 # bi-dir reff= 2.81; 12 QB 12 HA; norm i-->j: 12 HA ,norm j-->i: 12 QB; applied: *errMethyleneQ 24 TYR QD 36 ARG HA 5.45 # uni-dir reff= 3.93; 24 QD 36 HA; norm i-->j: 36 HA; applied: errUni*errMethyleneQ UPL SET TO 8A 36 ARG HA 37 PRO HD3 1.62 # bi-dir reff= 2.38; 37 HD3 36 HA; norm i-->j: 36 HA ,norm j-->i: 37 HD3 36 ARG HA 37 PRO HD2 1.60 # bi-dir reff= 2.35; 37 HD2 36 HA; norm i-->j: 36 HA ,norm j-->i: 37 HD2 6 LYS HA 6 LYS QG 2.85 # uni-dir reff= 3.72; 6 HA 6 QG; norm i-->j: 6 QG; applied: errUni*errMethyleneQ 12 GLU H 25 PHE H 1.91 # bi-dir reff= 2.81; 12 H 25 H; norm i-->j: 25 H ,norm j-->i: 12 H 13 LYS HA 25 PHE H 3.20 # uni-dir reff= 3.92; 13 HA 25 H; norm i-->j: 25 H; applied: errUni 25 PHE H 25 PHE HB2 2.14 # bi-dir reff= 3.14; 25 HB2 25 H; norm i-->j: 25 H ,norm j-->i: 25 HB2 24 TYR HB3 25 PHE H 2.64 # uni-dir reff= 3.23; 24 HB3 25 H; norm i-->j: 25 H; applied: errUni 25 PHE H 25 PHE HB3 1.79 # bi-dir reff= 2.63; 25 HB3 25 H; norm i-->j: 25 H ,norm j-->i: 25 HB3 12 GLU QB 25 PHE H 2.75 # bi-dir reff= 4.31; 12 QB 25 H; norm i-->j: 25 H ,norm j-->i: 12 QB; applied: *errMethyleneQ 14 ARG HA 15 MET H 1.70 # bi-dir reff= 2.50; 15 H 14 HA; norm i-->j: 14 HA ,norm j-->i: 15 H 14 ARG HA 14 ARG HD2 2.78 # bi-dir reff= 3.25; 14 HD2 14 HA; norm i-->j: 14 HA ,norm j-->i: 14 HD2; applied: errStereo( 0.0864) 14 ARG HA 14 ARG HB3 1.71 # bi-dir reff= 2.51; 14 HB3 14 HA; norm i-->j: 14 HA ,norm j-->i: 14 HB3 7 LEU QD1 24 TYR QD 5.45 # uni-dir reff= 5.08; 24 QD 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth*errMethyleneQ UPL SET TO 8A 7 LEU QD1 24 TYR QE 5.45 # uni-dir reff= 4.41; 24 QE 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth*errMethyleneQ UPL SET TO 8A 7 LEU HA 7 LEU QD1 2.19 # bi-dir reff= 3.55; 7 HA 7 QD1; norm i-->j: 7 QD1 ,norm j-->i: 7 HA; applied: *errMeth 7 LEU QD1 8 PRO HD3 2.83 # bi-dir reff= 4.60; 8 HD3 7 QD1; norm i-->j: 7 QD1 ,norm j-->i: 8 HD3; applied: *errMeth 7 LEU QD1 8 PRO HD2 2.58 # bi-dir reff= 4.19; 8 HD2 7 QD1; norm i-->j: 7 QD1 ,norm j-->i: 8 HD2; applied: *errMeth 7 LEU QD1 37 PRO HD3 4.18 # uni-dir reff= 5.67; 37 HD3 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth 7 LEU QD1 37 PRO HD2 3.02 # uni-dir reff= 4.09; 37 HD2 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth 7 LEU HB3 7 LEU QD1 2.11 # bi-dir reff= 3.43; 7 HB3 7 QD1; norm i-->j: 7 QD1 ,norm j-->i: 7 HB3; applied: *errMeth 7 LEU QD1 37 PRO HG3 3.69 # uni-dir reff= 5.00; 37 HG3 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth 7 LEU HA 8 PRO HD3 1.53 # bi-dir reff= 2.25; 8 HD3 7 HA; norm i-->j: 7 HA ,norm j-->i: 8 HD3 7 LEU HA 8 PRO HD2 1.83 # bi-dir reff= 2.68; 8 HD2 7 HA; norm i-->j: 7 HA ,norm j-->i: 8 HD2 7 LEU HA 7 LEU HB3 1.87 # bi-dir reff= 2.75; 7 HB3 7 HA; norm i-->j: 7 HA ,norm j-->i: 7 HB3 23 TYR H 23 TYR QD 2.22 # bi-dir reff= 3.48; 23 QD 23 H; norm i-->j: 23 H ,norm j-->i: 23 QD; applied: *errMethyleneQ 22 VAL HB 23 TYR H 3.05 # uni-dir reff= 3.73; 22 HB 23 H; norm i-->j: 23 H; applied: errUni 22 VAL QG2 23 TYR H 3.13 # bi-dir reff= 5.08; 22 QG2 23 H; norm i-->j: 23 H ,norm j-->i: 22 QG2; applied: *errMeth 22 VAL QG1 23 TYR H 2.10 # bi-dir reff= 3.41; 22 QG1 23 H; norm i-->j: 23 H ,norm j-->i: 22 QG1; applied: *errMeth 14 ARG HB2 23 TYR H 2.69 # bi-dir reff= 3.95; 14 HB2 23 H; norm i-->j: 23 H ,norm j-->i: 14 HB2 27 HIS H 28 ILE H 1.85 # bi-dir reff= 2.71; 27 H 28 H; norm i-->j: 28 H ,norm j-->i: 27 H 28 ILE H 30 ASN H 2.47 # bi-dir reff= 3.62; 30 H 28 H; norm i-->j: 28 H ,norm j-->i: 30 H 28 ILE H 29 THR H 1.61 # bi-dir reff= 2.37; 29 H 28 H; norm i-->j: 28 H ,norm j-->i: 29 H 28 ILE H 28 ILE HB 1.73 # bi-dir reff= 2.54; 28 HB 28 H; norm i-->j: 28 H ,norm j-->i: 28 HB 15 MET HG2 22 VAL QG2 4.16 # uni-dir reff= 5.63; 15 HG2 22 QG2; norm i-->j: 22 QG2; applied: errUni*errMeth 15 MET HG3 22 VAL QG2 4.16 # uni-dir reff= 5.62; 15 HG3 22 QG2; norm i-->j: 22 QG2; applied: errUni*errMeth 16 SER H 21 ARG H 2.38 # bi-dir reff= 3.50; 21 H 16 H; norm i-->j: 16 H ,norm j-->i: 21 H 15 MET HG2 16 SER H 2.84 # uni-dir reff= 3.48; 15 HG2 16 H; norm i-->j: 16 H; applied: errUni 16 SER H 23 TYR QD 5.45 # uni-dir reff= 3.68; 23 QD 16 H; norm i-->j: 16 H; applied: errUni*errMethyleneQ UPL SET TO 8A 16 SER H 16 SER QB 1.64 # bi-dir reff= 2.57; 16 QB 16 H; norm i-->j: 16 H ,norm j-->i: 16 QB; applied: *errMethyleneQ 15 MET HG3 16 SER H 2.84 # uni-dir reff= 3.30; 15 HG3 16 H; norm i-->j: 16 H; applied: errUni 15 MET QB 16 SER H 2.75 # uni-dir reff= 3.60; 15 QB 16 H; norm i-->j: 16 H; applied: errUni*errMethyleneQ 31 ALA HA 32 SER H 1.56 # bi-dir reff= 2.29; 32 H 31 HA; norm i-->j: 31 HA ,norm j-->i: 32 H 31 ALA H 31 ALA HA 2.00 # bi-dir reff= 2.94; 31 H 31 HA; norm i-->j: 31 HA ,norm j-->i: 31 H 11 TRP HE3 12 GLU H 2.56 # uni-dir reff= 3.13; 11 HE3 12 H; norm i-->j: 12 H; applied: errUni 12 GLU H 26 ASN HA 2.42 # bi-dir reff= 3.55; 26 HA 12 H; norm i-->j: 12 H ,norm j-->i: 26 HA 12 GLU H 12 GLU HG2 2.88 # bi-dir reff= 3.43; 12 HG2 12 H; norm i-->j: 12 H ,norm j-->i: 12 HG2; applied: errStereo( 0.0258) 12 GLU H 12 GLU HG3 2.88 # bi-dir reff= 3.82; 12 HG3 12 H; norm i-->j: 12 H ,norm j-->i: 12 HG3; applied: errStereo( 0.1047) 12 GLU H 12 GLU QB 2.05 # bi-dir reff= 3.22; 12 QB 12 H; norm i-->j: 12 H ,norm j-->i: 12 QB; applied: *errMethyleneQ 22 VAL QG1 24 TYR QE 5.45 # uni-dir reff= 4.91; 24 QE 22 QG1; norm i-->j: 22 QG1; applied: errUni*errMeth*errMethyleneQ UPL SET TO 8A 13 LYS HD3 22 VAL QG1 3.07 # uni-dir reff= 4.16; 13 HD3 22 QG1; norm i-->j: 22 QG1; applied: errUni*errMeth 24 TYR H 33 GLN H 2.06 # bi-dir reff= 3.03; 24 H 33 H; norm i-->j: 33 H ,norm j-->i: 24 H 32 SER HB2 33 GLN H 2.85 # bi-dir reff= 3.97; 32 HB2 33 H; norm i-->j: 33 H ,norm j-->i: 32 HB2; applied: errStereo( 0.0529) 33 GLN H 33 GLN QG 2.73 # uni-dir reff= 3.56; 33 QG 33 H; norm i-->j: 33 H; applied: errUni*errMethyleneQ 33 GLN H 33 GLN HB3 2.27 # uni-dir reff= 2.77; 33 HB3 33 H; norm i-->j: 33 H; applied: errUni 32 SER HB3 33 GLN H 2.85 # bi-dir reff= 3.84; 32 HB3 33 H; norm i-->j: 33 H ,norm j-->i: 32 HB3; applied: errStereo( 0.0526) 34 PHE H 35 GLU H 1.78 # bi-dir reff= 2.61; 35 H 34 H; norm i-->j: 34 H ,norm j-->i: 35 H 34 PHE H 34 PHE QD 2.12 # bi-dir reff= 3.33; 34 QD 34 H; norm i-->j: 34 H ,norm j-->i: 34 QD; applied: *errMethyleneQ 34 PHE H 34 PHE HB3 2.34 # bi-dir reff= 3.25; 34 HB3 34 H; norm i-->j: 34 H ,norm j-->i: 34 HB3; applied: errStereo( 0.0582) 34 PHE H 34 PHE HB2 2.34 # bi-dir reff= 2.76; 34 HB2 34 H; norm i-->j: 34 H ,norm j-->i: 34 HB2; applied: errStereo( 0.0554) 33 GLN HB3 34 PHE H 2.74 # uni-dir reff= 3.35; 33 HB3 34 H; norm i-->j: 34 H; applied: errUni 30 ASN H 31 ALA H 1.91 # bi-dir reff= 2.80; 30 H 31 H; norm i-->j: 31 H ,norm j-->i: 30 H 29 THR H 31 ALA H 2.71 # bi-dir reff= 3.98; 29 H 31 H; norm i-->j: 31 H ,norm j-->i: 29 H 29 THR HB 31 ALA H 2.60 # bi-dir reff= 3.81; 29 HB 31 H; norm i-->j: 31 H ,norm j-->i: 29 HB 30 ASN HB2 31 ALA H 3.55 # uni-dir reff= 4.34; 30 HB2 31 H; norm i-->j: 31 H; applied: errUni 30 ASN HB3 31 ALA H 3.14 # bi-dir reff= 4.61; 30 HB3 31 H; norm i-->j: 31 H ,norm j-->i: 30 HB3 26 ASN HB3 31 ALA H 1.78 # bi-dir reff= 2.61; 26 HB3 31 H; norm i-->j: 31 H ,norm j-->i: 26 HB3 31 ALA H 31 ALA QB 1.92 # bi-dir reff= 3.12; 31 QB 31 H; norm i-->j: 31 H ,norm j-->i: 31 QB; applied: *errMeth 29 THR QG2 31 ALA H 3.45 # bi-dir reff= 5.62; 29 QG2 31 H; norm i-->j: 31 H ,norm j-->i: 29 QG2; applied: *errMeth 26 ASN HB2 31 ALA H 2.67 # bi-dir reff= 3.92; 26 HB2 31 H; norm i-->j: 31 H ,norm j-->i: 26 HB2 11 TRP HZ2 31 ALA QB 3.76 # uni-dir reff= 5.09; 11 HZ2 31 QB; norm i-->j: 31 QB; applied: errUni*errMeth 29 THR HB 31 ALA QB 2.65 # bi-dir reff= 4.31; 29 HB 31 QB; norm i-->j: 31 QB ,norm j-->i: 29 HB; applied: *errMeth 28 ILE H 29 THR QG2 4.31 # uni-dir reff= 5.83; 28 H 29 QG2; norm i-->j: 29 QG2; applied: errUni*errMeth 29 THR QG2 30 ASN H 3.26 # bi-dir reff= 5.31; 30 H 29 QG2; norm i-->j: 29 QG2 ,norm j-->i: 30 H; applied: *errMeth 29 THR H 29 THR QG2 1.97 # bi-dir reff= 3.20; 29 H 29 QG2; norm i-->j: 29 QG2 ,norm j-->i: 29 H; applied: *errMeth 26 ASN HD22 29 THR QG2 2.54 # bi-dir reff= 4.13; 26 HD22 29 QG2; norm i-->j: 29 QG2 ,norm j-->i: 26 HD22; applied: *errMeth 28 ILE HB 29 THR QG2 2.86 # uni-dir reff= 3.88; 28 HB 29 QG2; norm i-->j: 29 QG2; applied: errUni*errMeth 27 HIS H 29 THR H 3.59 # uni-dir reff= 4.39; 29 H 27 H; norm i-->j: 27 H; applied: errUni 27 HIS H 27 HIS HD2 2.70 # uni-dir reff= 3.31; 27 HD2 27 H; norm i-->j: 27 H; applied: errUni 26 ASN HA 27 HIS H 1.53 # bi-dir reff= 2.24; 26 HA 27 H; norm i-->j: 27 H ,norm j-->i: 26 HA 27 HIS H 28 ILE HG13 3.27 # uni-dir reff= 4.00; 28 HG13 27 H; norm i-->j: 27 H; applied: errUni 26 ASN HB2 27 HIS H 3.82 # uni-dir reff= 4.66; 26 HB2 27 H; norm i-->j: 27 H; applied: errUni 26 ASN HB3 31 ALA QB 2.33 # bi-dir reff= 3.79; 26 HB3 31 QB; norm i-->j: 31 QB ,norm j-->i: 26 HB3; applied: *errMeth 26 ASN HA 28 ILE H 2.85 # uni-dir reff= 3.49; 28 H 26 HA; norm i-->j: 26 HA; applied: errUni 26 ASN HA 29 THR H 3.01 # uni-dir reff= 3.69; 29 H 26 HA; norm i-->j: 26 HA; applied: errUni 26 ASN HA 26 ASN HB3 2.06 # bi-dir reff= 3.02; 26 HB3 26 HA; norm i-->j: 26 HA ,norm j-->i: 26 HB3 26 ASN HA 26 ASN HB2 1.79 # bi-dir reff= 2.63; 26 HB2 26 HA; norm i-->j: 26 HA ,norm j-->i: 26 HB2 8 PRO HA 9 PRO HD3 2.23 # uni-dir reff= 2.72; 8 HA 9 HD3; norm i-->j: 9 HD3; applied: errUni 8 PRO HD3 37 PRO HG3 3.67 # bi-dir reff= 5.39; 37 HG3 8 HD3; norm i-->j: 8 HD3 ,norm j-->i: 37 HG3 7 LEU HB3 8 PRO HD3 2.71 # bi-dir reff= 3.98; 7 HB3 8 HD3; norm i-->j: 8 HD3 ,norm j-->i: 7 HB3 8 PRO HD2 11 TRP HD1 3.34 # uni-dir reff= 4.09; 11 HD1 8 HD2; norm i-->j: 8 HD2; applied: errUni 8 PRO HD2 11 TRP HB2 2.70 # uni-dir reff= 3.31; 11 HB2 8 HD2; norm i-->j: 8 HD2; applied: errUni 7 LEU HB3 8 PRO HD2 1.78 # bi-dir reff= 2.61; 7 HB3 8 HD2; norm i-->j: 8 HD2 ,norm j-->i: 7 HB3 7 LEU QD2 8 PRO HD2 3.41 # uni-dir reff= 4.63; 7 QD2 8 HD2; norm i-->j: 8 HD2; applied: errUni*errMeth 8 PRO HD2 37 PRO HB2 2.76 # uni-dir reff= 3.37; 37 HB2 8 HD2; norm i-->j: 8 HD2; applied: errUni 8 PRO HD2 37 PRO HG3 3.28 # uni-dir reff= 4.02; 37 HG3 8 HD2; norm i-->j: 8 HD2; applied: errUni 21 ARG H 22 VAL H 3.11 # bi-dir reff= 4.56; 22 H 21 H; norm i-->j: 21 H ,norm j-->i: 22 H 16 SER QB 21 ARG H 1.82 # bi-dir reff= 2.86; 16 QB 21 H; norm i-->j: 21 H ,norm j-->i: 16 QB; applied: *errMethyleneQ 19 SER HB2 21 ARG H 3.12 # uni-dir reff= 3.81; 19 HB2 21 H; norm i-->j: 21 H; applied: errUni 35 GLU H 36 ARG H 4.01 # uni-dir reff= 4.90; 36 H 35 H; norm i-->j: 35 H; applied: errUni 33 GLN HE21 35 GLU H 3.73 # uni-dir reff= 4.57; 33 HE21 35 H; norm i-->j: 35 H; applied: errUni 34 PHE HB3 35 GLU H 2.60 # bi-dir reff= 3.60; 34 HB3 35 H; norm i-->j: 35 H ,norm j-->i: 34 HB3; applied: errStereo( 0.0610) 34 PHE HB2 35 GLU H 2.60 # bi-dir reff= 3.23; 34 HB2 35 H; norm i-->j: 35 H ,norm j-->i: 34 HB2; applied: errStereo( 0.0602) 29 THR H 30 ASN H 1.63 # bi-dir reff= 2.39; 29 H 30 H; norm i-->j: 30 H ,norm j-->i: 29 H 27 HIS HA 30 ASN H 3.03 # uni-dir reff= 3.71; 27 HA 30 H; norm i-->j: 30 H; applied: errUni 30 ASN H 30 ASN HB3 2.71 # bi-dir reff= 3.98; 30 HB3 30 H; norm i-->j: 30 H ,norm j-->i: 30 HB3 26 ASN HB3 30 ASN H 2.32 # bi-dir reff= 3.41; 26 HB3 30 H; norm i-->j: 30 H ,norm j-->i: 26 HB3 30 ASN H 31 ALA QB 3.60 # bi-dir reff= 5.86; 31 QB 30 H; norm i-->j: 30 H ,norm j-->i: 31 QB; applied: *errMeth 33 GLN HE21 37 PRO HD3 3.12 # uni-dir reff= 3.82; 33 HE21 37 HD3; norm i-->j: 37 HD3; applied: errUni 24 TYR QD 37 PRO HD3 5.45 # uni-dir reff= 3.73; 24 QD 37 HD3; norm i-->j: 37 HD3; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR QE 37 PRO HD3 5.45 # uni-dir reff= 4.63; 24 QE 37 HD3; norm i-->j: 37 HD3; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR HB2 37 PRO HD3 2.62 # uni-dir reff= 3.20; 24 HB2 37 HD3; norm i-->j: 37 HD3; applied: errUni 36 ARG HG2 37 PRO HD3 3.88 # uni-dir reff= 4.70; 36 HG2 37 HD3; norm i-->j: 37 HD3; applied: errUni 24 TYR QD 37 PRO HD2 5.45 # uni-dir reff= 4.56; 24 QD 37 HD2; norm i-->j: 37 HD2; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR QE 37 PRO HD2 5.45 # uni-dir reff= 4.41; 24 QE 37 HD2; norm i-->j: 37 HD2; applied: errUni*errMethyleneQ UPL SET TO 8A 11 TRP HB3 37 PRO HD2 3.54 # uni-dir reff= 4.34; 11 HB3 37 HD2; norm i-->j: 37 HD2; applied: errUni 24 TYR HB2 37 PRO HD2 3.04 # bi-dir reff= 4.46; 24 HB2 37 HD2; norm i-->j: 37 HD2 ,norm j-->i: 24 HB2 36 ARG QB 37 PRO HD2 3.61 # uni-dir reff= 4.73; 36 QB 37 HD2; norm i-->j: 37 HD2; applied: errUni*errMethyleneQ 15 MET H 15 MET HG3 3.87 # uni-dir reff= 4.54; 15 HG3 15 H; norm i-->j: 15 H; applied: errUni 15 MET H 15 MET QB 2.24 # uni-dir reff= 2.93; 15 QB 15 H; norm i-->j: 15 H; applied: errUni*errMethyleneQ 14 ARG HB3 15 MET H 1.68 # bi-dir reff= 2.46; 14 HB3 15 H; norm i-->j: 15 H ,norm j-->i: 14 HB3 14 ARG HB2 15 MET H 2.43 # bi-dir reff= 3.56; 14 HB2 15 H; norm i-->j: 15 H ,norm j-->i: 14 HB2 23 TYR QD 24 TYR H 5.45 # uni-dir reff= 3.58; 23 QD 24 H; norm i-->j: 24 H; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR H 24 TYR QD 5.45 # uni-dir reff= 3.19; 24 QD 24 H; norm i-->j: 24 H; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR H 24 TYR QE 5.45 # uni-dir reff= 3.88; 24 QE 24 H; norm i-->j: 24 H; applied: errUni*errMethyleneQ UPL SET TO 8A 24 TYR H 24 TYR HB2 1.76 # bi-dir reff= 2.59; 24 HB2 24 H; norm i-->j: 24 H ,norm j-->i: 24 HB2 23 TYR HB2 24 TYR H 2.19 # bi-dir reff= 2.52; 23 HB2 24 H; norm i-->j: 24 H ,norm j-->i: 23 HB2; applied: errStereo( 0.0808) 11 TRP H 11 TRP HA 1.95 # bi-dir reff= 2.86; 11 HA 11 H; norm i-->j: 11 H ,norm j-->i: 11 HA 10 GLY HA3 11 TRP H 2.15 # bi-dir reff= 3.15; 10 HA3 11 H; norm i-->j: 11 H ,norm j-->i: 10 HA3 11 TRP H 11 TRP HB2 1.66 # bi-dir reff= 2.43; 11 HB2 11 H; norm i-->j: 11 H ,norm j-->i: 11 HB2 38 SER H 39 GLY H 2.38 # bi-dir reff= 3.49; 38 H 39 H; norm i-->j: 39 H ,norm j-->i: 38 H 8 PRO HG3 39 GLY H 4.43 # uni-dir reff= 5.41; 8 HG3 39 H; norm i-->j: 39 H; applied: errUni 37 PRO HB2 39 GLY H 3.82 # uni-dir reff= 4.66; 37 HB2 39 H; norm i-->j: 39 H; applied: errUni 18 ASN H 19 SER H 1.80 # bi-dir reff= 2.64; 19 H 18 H; norm i-->j: 18 H ,norm j-->i: 19 H 18 ASN H 18 ASN QB 1.89 # bi-dir reff= 2.96; 18 QB 18 H; norm i-->j: 18 H ,norm j-->i: 18 QB; applied: *errMethyleneQ 33 GLN HE22 38 SER H 3.82 # uni-dir reff= 4.68; 33 HE22 38 H; norm i-->j: 38 H; applied: errUni 38 SER H 38 SER HB3 2.81 # uni-dir reff= 3.44; 38 HB3 38 H; norm i-->j: 38 H; applied: errUni 37 PRO HB2 38 SER H 2.92 # uni-dir reff= 3.57; 37 HB2 38 H; norm i-->j: 38 H; applied: errUni 28 ILE H 28 ILE QG2 4.09 # uni-dir reff= 5.54; 28 H 28 QG2; norm i-->j: 28 QG2; applied: errUni*errMeth 28 ILE QG2 29 THR H 2.79 # bi-dir reff= 4.53; 29 H 28 QG2; norm i-->j: 28 QG2 ,norm j-->i: 29 H; applied: *errMeth 28 ILE HA 28 ILE QG2 1.99 # bi-dir reff= 3.24; 28 HA 28 QG2; norm i-->j: 28 QG2 ,norm j-->i: 28 HA; applied: *errMeth 33 GLN HE22 37 PRO HB3 2.77 # uni-dir reff= 3.39; 37 HB3 33 HE22; norm i-->j: 33 HE22; applied: errUni 31 ALA QB 32 SER H 2.55 # uni-dir reff= 3.46; 31 QB 32 H; norm i-->j: 32 H; applied: errUni*errMeth 32 SER H 33 GLN H 3.75 # uni-dir reff= 4.59; 33 H 32 H; norm i-->j: 32 H; applied: errUni 10 GLY H 10 GLY HA3 1.98 # bi-dir reff= 2.90; 10 H 10 HA3; norm i-->j: 10 HA3 ,norm j-->i: 10 H 9 PRO HA 10 GLY HA3 3.18 # uni-dir reff= 3.89; 9 HA 10 HA3; norm i-->j: 10 HA3; applied: errUni 10 GLY HA3 28 ILE QD1 2.30 # bi-dir reff= 3.74; 28 QD1 10 HA3; norm i-->j: 10 HA3 ,norm j-->i: 28 QD1; applied: *errMeth 10 GLY HA2 26 ASN HD22 3.18 # bi-dir reff= 4.67; 26 HD22 10 HA2; norm i-->j: 10 HA2 ,norm j-->i: 26 HD22 10 GLY HA2 28 ILE QD1 2.63 # bi-dir reff= 4.27; 28 QD1 10 HA2; norm i-->j: 10 HA2 ,norm j-->i: 28 QD1; applied: *errMeth 10 GLY H 10 GLY HA2 1.66 # bi-dir reff= 2.43; 10 H 10 HA2; norm i-->j: 10 HA2 ,norm j-->i: 10 H 10 GLY HA3 28 ILE H 3.22 # uni-dir reff= 3.93; 28 H 10 HA3; norm i-->j: 10 HA3; applied: errUni 10 GLY HA3 26 ASN HD22 2.55 # uni-dir reff= 3.11; 26 HD22 10 HA3; norm i-->j: 10 HA3; applied: errUni 9 PRO HA 10 GLY HA2 3.05 # bi-dir reff= 4.47; 9 HA 10 HA2; norm i-->j: 10 HA2 ,norm j-->i: 9 HA 19 SER H 20 GLY H 1.76 # bi-dir reff= 2.58; 19 H 20 H; norm i-->j: 20 H ,norm j-->i: 19 H 20 GLY H 21 ARG HB2 3.75 # uni-dir reff= 4.60; 21 HB2 20 H; norm i-->j: 20 H; applied: errUni 10 GLY H 11 TRP H 2.28 # uni-dir reff= 2.79; 11 H 10 H; norm i-->j: 10 H; applied: errUni 9 PRO HA 10 GLY H 1.48 # bi-dir reff= 2.17; 9 HA 10 H; norm i-->j: 10 H ,norm j-->i: 9 HA 9 PRO HB2 10 GLY H 2.96 # uni-dir reff= 3.60; 9 HB2 10 H; norm i-->j: 10 H; applied: errUni 10 GLY H 28 ILE QD1 3.30 # bi-dir reff= 5.36; 28 QD1 10 H; norm i-->j: 10 H ,norm j-->i: 28 QD1; applied: *errMeth 18 ASN H 20 GLY H 3.28 # uni-dir reff= 4.01; 18 H 20 H; norm i-->j: 20 H; applied: errUni 14 ARG HD3 25 PHE HB3 3.00 # bi-dir reff= 4.28; 14 HD3 25 HB3; norm i-->j: 25 HB3 ,norm j-->i: 14 HD3; applied: errStereo( 0.0282) 12 GLU QB 25 PHE HB3 2.49 # bi-dir reff= 3.91; 12 QB 25 HB3; norm i-->j: 25 HB3 ,norm j-->i: 12 QB; applied: *errMethyleneQ 14 ARG HG3 25 PHE HB3 2.92 # bi-dir reff= 3.56; 14 HG3 25 HB3; norm i-->j: 25 HB3 ,norm j-->i: 14 HG3; applied: errStereo( 0.0601) 19 SER H 19 SER HB2 2.54 # bi-dir reff= 3.73; 19 HB2 19 H; norm i-->j: 19 H ,norm j-->i: 19 HB2 19 SER H 19 SER HB3 2.01 # bi-dir reff= 2.95; 19 HB3 19 H; norm i-->j: 19 H ,norm j-->i: 19 HB3 18 ASN QB 19 SER H 2.21 # uni-dir reff= 2.90; 18 QB 19 H; norm i-->j: 19 H; applied: errUni*errMethyleneQ 16 SER QB 19 SER H 2.11 # bi-dir reff= 3.32; 16 QB 19 H; norm i-->j: 19 H ,norm j-->i: 16 QB; applied: *errMethyleneQ 21 ARG HD3 34 PHE QE 5.45 # uni-dir reff= 6.21; 34 QE 21 HD3; norm i-->j: 21 HD3; applied: errUni*errMethyleneQ UPL SET TO 8A 26 ASN HD22 28 ILE HB 2.84 # uni-dir reff= 3.47; 28 HB 26 HD22; norm i-->j: 26 HD22; applied: errUni 26 ASN HD22 28 ILE QD1 3.16 # bi-dir reff= 5.13; 28 QD1 26 HD22; norm i-->j: 26 HD22 ,norm j-->i: 28 QD1; applied: *errMeth 26 ASN HB2 26 ASN HD22 2.64 # bi-dir reff= 3.87; 26 HB2 26 HD22; norm i-->j: 26 HD22 ,norm j-->i: 26 HB2 26 ASN HB3 26 ASN HD21 2.32 # bi-dir reff= 3.40; 26 HB3 26 HD21; norm i-->j: 26 HD21 ,norm j-->i: 26 HB3 26 ASN HD21 31 ALA QB 3.37 # uni-dir reff= 4.57; 31 QB 26 HD21; norm i-->j: 26 HD21; applied: errUni*errMeth 26 ASN HD21 29 THR QG2 3.15 # uni-dir reff= 4.27; 29 QG2 26 HD21; norm i-->j: 26 HD21; applied: errUni*errMeth 26 ASN HB2 26 ASN HD21 1.64 # bi-dir reff= 2.41; 26 HB2 26 HD21; norm i-->j: 26 HD21 ,norm j-->i: 26 HB2 14 ARG HD2 14 ARG HH22 3.28 # uni-dir reff= 4.00; 14 HH22 14 HD2; norm i-->j: 14 HD2; applied: errUni 14 ARG HD2 25 PHE HB3 3.00 # bi-dir reff= 4.10; 25 HB3 14 HD2; norm i-->j: 14 HD2 ,norm j-->i: 25 HB3; applied: errStereo( 0.0288) 14 ARG HB2 14 ARG HD2 2.73 # bi-dir reff= 3.80; 14 HB2 14 HD2; norm i-->j: 14 HD2 ,norm j-->i: 14 HB2; applied: errStereo( 0.0276) 14 ARG HD3 14 ARG HH22 3.28 # uni-dir reff= 3.91; 14 HH22 14 HD3; norm i-->j: 14 HD3; applied: errUni 14 ARG HA 14 ARG HD3 2.78 # uni-dir reff= 3.40; 14 HA 14 HD3; norm i-->j: 14 HD3; applied: errUni 14 ARG HB2 14 ARG HD3 2.73 # bi-dir reff= 3.91; 14 HB2 14 HD3; norm i-->j: 14 HD3 ,norm j-->i: 14 HB2; applied: errStereo( 0.0271) 25 PHE QD 26 ASN H 2.38 # uni-dir reff= 3.12; 26 H 25 QD; norm i-->j: 25 QD; applied: errUni*errMethyleneQ 25 PHE QD 32 SER HB3 2.48 # bi-dir reff= 3.15; 32 HB3 25 QD; norm i-->j: 25 QD ,norm j-->i: 32 HB3; applied: errStereo( 0.0074)*errMethyleneQ 7 LEU HB2 7 LEU QD2 2.53 # uni-dir reff= 3.42; 7 QD2 7 HB2; norm i-->j: 7 HB2; applied: errUni*errMeth 28 ILE H 28 ILE QD1 3.96 # uni-dir reff= 5.36; 28 H 28 QD1; norm i-->j: 28 QD1; applied: errUni*errMeth 28 ILE QD1 29 THR H 4.71 # uni-dir reff= 6.38; 29 H 28 QD1; norm i-->j: 28 QD1; applied: errUni*errMeth 27 HIS HD2 28 ILE QD1 4.21 # uni-dir reff= 5.70; 27 HD2 28 QD1; norm i-->j: 28 QD1; applied: errUni*errMeth 28 ILE HA 28 ILE QD1 3.47 # uni-dir reff= 4.69; 28 HA 28 QD1; norm i-->j: 28 QD1; applied: errUni*errMeth 28 ILE HB 28 ILE QD1 2.71 # uni-dir reff= 3.67; 28 HB 28 QD1; norm i-->j: 28 QD1; applied: errUni*errMeth 28 ILE HB 29 THR H 1.74 # bi-dir reff= 2.55; 28 HB 29 H; norm i-->j: 29 H ,norm j-->i: 28 HB 24 TYR HB2 25 PHE H 3.15 # uni-dir reff= 3.86; 25 H 24 HB2; norm i-->j: 24 HB2; applied: errUni 24 TYR HB2 33 GLN HB3 3.33 # uni-dir reff= 4.08; 33 HB3 24 HB2; norm i-->j: 24 HB2; applied: errUni 24 TYR HB2 37 PRO HG3 3.10 # uni-dir reff= 3.79; 37 HG3 24 HB2; norm i-->j: 24 HB2; applied: errUni 23 TYR HB3 24 TYR H 2.19 # uni-dir reff= 2.68; 24 H 23 HB3; norm i-->j: 23 HB3; applied: errUni 26 ASN HB3 29 THR H 2.47 # uni-dir reff= 3.02; 29 H 26 HB3; norm i-->j: 26 HB3; applied: errUni 26 ASN HB2 31 ALA QB 2.53 # uni-dir reff= 3.42; 31 QB 26 HB2; norm i-->j: 26 HB2; applied: errUni*errMeth 25 PHE QD 32 SER HB2 2.48 # bi-dir reff= 3.86; 25 QD 32 HB2; norm i-->j: 32 HB2 ,norm j-->i: 25 QD; applied: errStereo( 0.0077)*errMethyleneQ 12 GLU HG2 14 ARG HG2 3.57 # uni-dir reff= 4.36; 14 HG2 12 HG2; norm i-->j: 12 HG2; applied: errUni 12 GLU HG2 14 ARG HG3 3.57 # uni-dir reff= 4.24; 14 HG3 12 HG2; norm i-->j: 12 HG2; applied: errUni 12 GLU HG3 13 LYS H 2.94 # bi-dir reff= 3.90; 13 H 12 HG3; norm i-->j: 12 HG3 ,norm j-->i: 13 H; applied: errStereo( 0.1047) 12 GLU HG3 14 ARG HG3 3.57 # bi-dir reff= 3.88; 14 HG3 12 HG3; norm i-->j: 12 HG3 ,norm j-->i: 14 HG3; applied: errStereo( 0.1047) 11 TRP HH2 33 GLN HB3 2.90 # uni-dir reff= 3.54; 33 HB3 11 HH2; norm i-->j: 11 HH2; applied: errUni 11 TRP HH2 31 ALA QB 2.31 # uni-dir reff= 3.12; 31 QB 11 HH2; norm i-->j: 11 HH2; applied: errUni*errMeth 14 ARG HB3 14 ARG HD2 2.64 # uni-dir reff= 3.13; 14 HD2 14 HB3; norm i-->j: 14 HB3; applied: errUni 14 ARG HB3 14 ARG HD3 2.64 # uni-dir reff= 3.23; 14 HD3 14 HB3; norm i-->j: 14 HB3; applied: errUni 12 GLU QB 27 HIS HD2 3.26 # uni-dir reff= 4.26; 27 HD2 12 QB; norm i-->j: 12 QB; applied: errUni*errMethyleneQ 11 TRP HZ3 25 PHE HA 2.63 # uni-dir reff= 3.22; 25 HA 11 HZ3; norm i-->j: 11 HZ3; applied: errUni 11 TRP HZ3 24 TYR HB2 2.51 # uni-dir reff= 3.08; 24 HB2 11 HZ3; norm i-->j: 11 HZ3; applied: errUni 16 SER QB 23 TYR QD 2.32 # bi-dir reff= 3.88; 23 QD 16 QB; norm i-->j: 16 QB ,norm j-->i: 23 QD; applied: *errMethyleneQ*errMethyleneQ 16 SER QB 21 ARG HB3 2.83 # bi-dir reff= 4.44; 21 HB3 16 QB; norm i-->j: 16 QB ,norm j-->i: 21 HB3; applied: *errMethyleneQ 16 SER QB 21 ARG HB2 2.28 # bi-dir reff= 3.58; 21 HB2 16 QB; norm i-->j: 16 QB ,norm j-->i: 21 HB2; applied: *errMethyleneQ 11 TRP HZ3 24 TYR HB3 2.75 # uni-dir reff= 3.36; 24 HB3 11 HZ3; norm i-->j: 11 HZ3; applied: errUni 11 TRP HZ3 33 GLN HB3 3.01 # uni-dir reff= 3.68; 33 HB3 11 HZ3; norm i-->j: 11 HZ3; applied: errUni 11 TRP HZ3 31 ALA QB 2.87 # uni-dir reff= 3.88; 31 QB 11 HZ3; norm i-->j: 11 HZ3; applied: errUni*errMeth 10 GLY HA2 28 ILE H 2.97 # bi-dir reff= 4.36; 28 H 10 HA2; norm i-->j: 10 HA2 ,norm j-->i: 28 H 10 GLY HA2 27 HIS H 3.11 # uni-dir reff= 3.81; 27 H 10 HA2; norm i-->j: 10 HA2; applied: errUni 11 TRP HD1 26 ASN HD21 3.24 # uni-dir reff= 3.96; 26 HD21 11 HD1; norm i-->j: 11 HD1; applied: errUni 7 LEU QD2 37 PRO HG2 3.19 # bi-dir reff= 5.18; 37 HG2 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 37 HG2; applied: *errMeth 7 LEU QD2 37 PRO HG3 3.94 # bi-dir reff= 6.40; 37 HG3 7 QD2; norm i-->j: 7 QD2 ,norm j-->i: 37 HG3; applied: *errMeth 7 LEU HA 8 PRO HG3 3.93 # uni-dir reff= 4.81; 7 HA 8 HG3; norm i-->j: 8 HG3; applied: errUni 15 MET H 16 SER H 2.94 # bi-dir reff= 4.32; 16 H 15 H; norm i-->j: 15 H ,norm j-->i: 16 H 15 MET H 23 TYR QE 2.89 # bi-dir reff= 4.53; 23 QE 15 H; norm i-->j: 15 H ,norm j-->i: 23 QE; applied: *errMethyleneQ 24 TYR HB2 33 GLN H 2.92 # uni-dir reff= 3.56; 33 H 24 HB2; norm i-->j: 24 HB2; applied: errUni 25 PHE HA 32 SER HB3 3.52 # uni-dir reff= 4.00; 32 HB3 25 HA; norm i-->j: 25 HA; applied: errUni 25 PHE HA 32 SER HB2 3.52 # uni-dir reff= 4.31; 32 HB2 25 HA; norm i-->j: 25 HA; applied: errUni 25 PHE HB2 26 ASN H 2.90 # bi-dir reff= 4.25; 26 H 25 HB2; norm i-->j: 25 HB2 ,norm j-->i: 26 H 25 PHE HB3 26 ASN H 2.90 # bi-dir reff= 4.25; 26 H 25 HB3; norm i-->j: 25 HB3 ,norm j-->i: 26 H 27 HIS HB3 28 ILE H 2.97 # bi-dir reff= 4.25; 28 H 27 HB3; norm i-->j: 27 HB3 ,norm j-->i: 28 H; applied: errStereo( 0.0262) 27 HIS HB2 28 ILE H 2.97 # bi-dir reff= 4.24; 28 H 27 HB2; norm i-->j: 27 HB2 ,norm j-->i: 28 H; applied: errStereo( 0.0264) 28 ILE HG13 29 THR H 3.72 # uni-dir reff= 4.55; 29 H 28 HG13; norm i-->j: 28 HG13; applied: errUni 28 ILE QG2 28 ILE HG12 2.69 # uni-dir reff= 3.64; 28 HG12 28 QG2; norm i-->j: 28 QG2; applied: errUni*errMeth 29 THR HA 29 THR HB 1.76 # bi-dir reff= 2.58; 29 HB 29 HA; norm i-->j: 29 HA ,norm j-->i: 29 HB 29 THR HA 30 ASN HB3 4.02 # uni-dir reff= 4.92; 30 HB3 29 HA; norm i-->j: 29 HA; applied: errUni 25 PHE H 26 ASN H 3.71 # uni-dir reff= 4.54; 25 H 26 H; norm i-->j: 26 H; applied: errUni 14 ARG HD3 23 TYR QE 3.32 # uni-dir reff= 4.34; 14 HD3 23 QE; norm i-->j: 23 QE; applied: errUni*errMethyleneQ 24 TYR QD 25 PHE H 5.45 # uni-dir reff= 5.22; 24 QD 25 H; norm i-->j: 25 H; applied: errUni*errMethyleneQ UPL SET TO 8A 14 ARG HG2 25 PHE HB3 2.92 # uni-dir reff= 3.58; 14 HG2 25 HB3; norm i-->j: 25 HB3; applied: errUni 10 GLY HA3 27 HIS H 3.46 # uni-dir reff= 4.24; 10 HA3 27 H; norm i-->j: 27 H; applied: errUni 28 ILE QG2 30 ASN H 4.86 # uni-dir reff= 6.58; 28 QG2 30 H; norm i-->j: 30 H; applied: errUni*errMeth 29 THR HB 30 ASN H 3.55 # uni-dir reff= 4.34; 29 HB 30 H; norm i-->j: 30 H; applied: errUni 13 LYS HA 14 ARG HB2 3.84 # uni-dir reff= 4.70; 13 HA 14 HB2; norm i-->j: 14 HB2; applied: errUni 28 ILE HA 30 ASN H 4.08 # uni-dir reff= 4.99; 28 HA 30 H; norm i-->j: 30 H; applied: errUni 24 TYR HB3 33 GLN H 4.06 # uni-dir reff= 4.96; 24 HB3 33 H; norm i-->j: 33 H; applied: errUni 21 ARG HH22 34 PHE HB3 3.45 # uni-dir reff= 4.03; 21 HH22 34 HB3; norm i-->j: 34 HB3; applied: errUni 21 ARG HH22 34 PHE HB2 3.45 # uni-dir reff= 4.22; 21 HH22 34 HB2; norm i-->j: 34 HB2; applied: errUni 11 TRP HE3 37 PRO HG3 3.32 # uni-dir reff= 4.06; 11 HE3 37 HG3; norm i-->j: 37 HG3; applied: errUni 11 TRP HE3 37 PRO HG2 4.77 # uni-dir reff= 5.83; 11 HE3 37 HG2; norm i-->j: 37 HG2; applied: errUni 37 PRO HB3 39 GLY H 4.67 # uni-dir reff= 5.72; 37 HB3 39 H; norm i-->j: 39 H; applied: errUni 37 PRO HA 39 GLY H 3.95 # uni-dir reff= 4.83; 39 H 37 HA; norm i-->j: 37 HA; applied: errUni 37 PRO HA 38 SER HA 3.28 # bi-dir reff= 4.82; 38 HA 37 HA; norm i-->j: 37 HA ,norm j-->i: 38 HA 36 ARG HA 37 PRO HA 3.15 # bi-dir reff= 4.62; 36 HA 37 HA; norm i-->j: 37 HA ,norm j-->i: 36 HA 28 ILE HB 29 THR HA 3.75 # uni-dir reff= 4.59; 28 HB 29 HA; norm i-->j: 29 HA; applied: errUni 28 ILE QG2 29 THR HA 3.14 # uni-dir reff= 4.25; 28 QG2 29 HA; norm i-->j: 29 HA; applied: errUni*errMeth 11 TRP HE1 37 PRO HG3 3.69 # uni-dir reff= 4.52; 37 HG3 11 HE1; norm i-->j: 11 HE1; applied: errUni 11 TRP HE1 26 ASN HB2 3.24 # bi-dir reff= 4.75; 26 HB2 11 HE1; norm i-->j: 11 HE1 ,norm j-->i: 26 HB2 8 PRO HB3 11 TRP HE1 4.29 # uni-dir reff= 5.24; 8 HB3 11 HE1; norm i-->j: 11 HE1; applied: errUni 18 ASN QB 19 SER HA 3.22 # uni-dir reff= 4.21; 18 QB 19 HA; norm i-->j: 19 HA; applied: errUni*errMethyleneQ 17 ARG HA 17 ARG HD2 3.83 # bi-dir reff= 5.32; 17 HD2 17 HA; norm i-->j: 17 HA ,norm j-->i: 17 HD2; applied: errStereo( 0.0572) 17 ARG HA 20 GLY H 3.86 # uni-dir reff= 4.72; 20 H 17 HA; norm i-->j: 17 HA; applied: errUni 10 GLY HA2 28 ILE HG12 3.78 # uni-dir reff= 4.62; 10 HA2 28 HG12; norm i-->j: 28 HG12; applied: errUni 14 ARG H 15 MET H 3.22 # bi-dir reff= 4.72; 15 H 14 H; norm i-->j: 14 H ,norm j-->i: 15 H 14 ARG H 24 TYR QD 5.45 # uni-dir reff= 5.60; 24 QD 14 H; norm i-->j: 14 H; applied: errUni*errMethyleneQ UPL SET TO 8A 13 LYS QE 14 ARG H 4.75 # uni-dir reff= 6.21; 13 QE 14 H; norm i-->j: 14 H; applied: errUni*errMethyleneQ 25 PHE HB2 32 SER HA 3.32 # uni-dir reff= 4.06; 25 HB2 32 HA; norm i-->j: 32 HA; applied: errUni 31 ALA QB 32 SER HA 3.12 # bi-dir reff= 5.07; 31 QB 32 HA; norm i-->j: 32 HA ,norm j-->i: 31 QB; applied: *errMeth 25 PHE HA 26 ASN HB3 3.89 # uni-dir reff= 4.76; 26 HB3 25 HA; norm i-->j: 25 HA; applied: errUni 12 GLU H 25 PHE HA 3.39 # uni-dir reff= 4.15; 12 H 25 HA; norm i-->j: 25 HA; applied: errUni 11 TRP HE3 25 PHE HA 2.94 # uni-dir reff= 3.60; 11 HE3 25 HA; norm i-->j: 25 HA; applied: errUni 25 PHE HA 31 ALA QB 3.68 # uni-dir reff= 4.98; 31 QB 25 HA; norm i-->j: 25 HA; applied: errUni*errMeth 24 TYR QD 36 ARG H 5.45 # uni-dir reff= 5.58; 24 QD 36 H; norm i-->j: 36 H; applied: errUni*errMethyleneQ UPL SET TO 8A 7 LEU QD1 13 LYS H 3.87 # uni-dir reff= 5.24; 7 QD1 13 H; norm i-->j: 13 H; applied: errUni*errMeth 13 LYS H 13 LYS QG 3.64 # uni-dir reff= 4.76; 13 H 13 QG; norm i-->j: 13 QG; applied: errUni*errMethyleneQ 26 ASN H 30 ASN HA 3.50 # uni-dir reff= 4.29; 26 H 30 HA; norm i-->j: 30 HA; applied: errUni 30 ASN HA 31 ALA QB 3.97 # uni-dir reff= 5.36; 31 QB 30 HA; norm i-->j: 30 HA; applied: errUni*errMeth 7 LEU H 8 PRO HD3 4.68 # uni-dir reff= 5.72; 8 HD3 7 H; norm i-->j: 7 H; applied: errUni 21 ARG HD2 22 VAL H 4.88 # uni-dir reff= 5.98; 21 HD2 22 H; norm i-->j: 22 H; applied: errUni 12 GLU HA 12 GLU HG3 2.65 # bi-dir reff= 3.38; 12 HG3 12 HA; norm i-->j: 12 HA ,norm j-->i: 12 HG3; applied: errStereo( 0.0703) 33 GLN HE21 36 ARG HA 4.10 # uni-dir reff= 5.02; 33 HE21 36 HA; norm i-->j: 36 HA; applied: errUni 35 GLU HA 36 ARG HA 3.64 # uni-dir reff= 4.45; 35 HA 36 HA; norm i-->j: 36 HA; applied: errUni 14 ARG H 25 PHE H 3.43 # uni-dir reff= 4.20; 14 H 25 H; norm i-->j: 25 H; applied: errUni 7 LEU QD1 24 TYR HA 4.82 # uni-dir reff= 6.53; 24 HA 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth 6 LYS HA 7 LEU QD1 4.97 # uni-dir reff= 6.73; 6 HA 7 QD1; norm i-->j: 7 QD1; applied: errUni*errMeth 7 LEU HA 37 PRO HG2 3.94 # uni-dir reff= 4.82; 37 HG2 7 HA; norm i-->j: 7 HA; applied: errUni 16 SER H 23 TYR H 4.01 # uni-dir reff= 4.91; 16 H 23 H; norm i-->j: 23 H; applied: errUni 27 HIS HD2 28 ILE H 3.99 # uni-dir reff= 4.87; 27 HD2 28 H; norm i-->j: 28 H; applied: errUni 26 ASN HD22 28 ILE H 3.06 # bi-dir reff= 4.49; 26 HD22 28 H; norm i-->j: 28 H ,norm j-->i: 26 HD22 21 ARG HA 22 VAL QG2 4.10 # uni-dir reff= 5.55; 21 HA 22 QG2; norm i-->j: 22 QG2; applied: errUni*errMeth 16 SER H 21 ARG HA 3.50 # uni-dir reff= 4.28; 21 HA 16 H; norm i-->j: 16 H; applied: errUni 15 MET QE 16 SER H 3.66 # uni-dir reff= 4.95; 15 QE 16 H; norm i-->j: 16 H; applied: errUni*errMeth 31 ALA HA 32 SER HA 4.05 # uni-dir reff= 4.95; 32 HA 31 HA; norm i-->j: 31 HA; applied: errUni 12 GLU H 27 HIS HD2 3.62 # uni-dir reff= 4.43; 27 HD2 12 H; norm i-->j: 12 H; applied: errUni 12 GLU H 24 TYR HA 3.64 # uni-dir reff= 4.46; 24 HA 12 H; norm i-->j: 12 H; applied: errUni 12 GLU H 27 HIS H 3.18 # bi-dir reff= 4.67; 27 H 12 H; norm i-->j: 12 H ,norm j-->i: 27 H 12 GLU H 25 PHE HB3 2.69 # bi-dir reff= 3.95; 25 HB3 12 H; norm i-->j: 12 H ,norm j-->i: 25 HB3 12 GLU H 13 LYS H 3.52 # uni-dir reff= 4.30; 13 H 12 H; norm i-->j: 12 H; applied: errUni 12 GLU H 13 LYS HA 3.71 # uni-dir reff= 4.54; 13 HA 12 H; norm i-->j: 12 H; applied: errUni 12 GLU H 26 ASN HB2 3.95 # uni-dir reff= 4.83; 26 HB2 12 H; norm i-->j: 12 H; applied: errUni 27 HIS H 28 ILE HB 4.01 # uni-dir reff= 4.90; 28 HB 27 H; norm i-->j: 27 H; applied: errUni 26 ASN H 27 HIS H 4.26 # uni-dir reff= 5.22; 26 H 27 H; norm i-->j: 27 H; applied: errUni 27 HIS H 28 ILE HA 4.12 # uni-dir reff= 5.03; 28 HA 27 H; norm i-->j: 27 H; applied: errUni 9 PRO HD2 11 TRP HD1 4.25 # uni-dir reff= 5.20; 11 HD1 9 HD2; norm i-->j: 9 HD2; applied: errUni 7 LEU H 8 PRO HD2 5.00 # uni-dir reff= 6.12; 7 H 8 HD2; norm i-->j: 8 HD2; applied: errUni 8 PRO HD3 37 PRO HB2 3.22 # uni-dir reff= 3.93; 37 HB2 8 HD3; norm i-->j: 8 HD3; applied: errUni 8 PRO HD3 11 TRP HB2 4.17 # uni-dir reff= 5.10; 11 HB2 8 HD3; norm i-->j: 8 HD3; applied: errUni 19 SER H 21 ARG H 3.27 # uni-dir reff= 4.00; 19 H 21 H; norm i-->j: 21 H; applied: errUni 19 SER HA 21 ARG H 4.32 # uni-dir reff= 5.28; 19 HA 21 H; norm i-->j: 21 H; applied: errUni 21 ARG H 21 ARG HD2 4.07 # uni-dir reff= 4.99; 21 HD2 21 H; norm i-->j: 21 H; applied: errUni 36 ARG QB 37 PRO HD3 4.26 # uni-dir reff= 5.58; 36 QB 37 HD3; norm i-->j: 37 HD3; applied: errUni*errMethyleneQ 36 ARG H 37 PRO HD3 4.09 # uni-dir reff= 5.01; 36 H 37 HD3; norm i-->j: 37 HD3; applied: errUni 34 PHE QD 35 GLU H 5.45 # uni-dir reff= 6.32; 34 QD 35 H; norm i-->j: 35 H; applied: errUni*errMethyleneQ UPL SET TO 8A 26 ASN HB2 30 ASN H 4.86 # uni-dir reff= 5.95; 26 HB2 30 H; norm i-->j: 30 H; applied: errUni 33 GLN HE21 37 PRO HD2 4.33 # uni-dir reff= 5.30; 33 HE21 37 HD2; norm i-->j: 37 HD2; applied: errUni 7 LEU QD2 37 PRO HD2 3.40 # uni-dir reff= 4.61; 7 QD2 37 HD2; norm i-->j: 37 HD2; applied: errUni*errMeth 15 MET H 23 TYR H 4.02 # uni-dir reff= 4.92; 23 H 15 H; norm i-->j: 15 H; applied: errUni 15 MET H 16 SER HA 3.42 # uni-dir reff= 4.18; 16 HA 15 H; norm i-->j: 15 H; applied: errUni 15 MET H 15 MET QE 4.93 # uni-dir reff= 6.67; 15 QE 15 H; norm i-->j: 15 H; applied: errUni*errMeth 24 TYR H 32 SER HA 3.94 # uni-dir reff= 4.83; 32 HA 24 H; norm i-->j: 24 H; applied: errUni 22 VAL QG1 24 TYR H 3.79 # uni-dir reff= 5.13; 22 QG1 24 H; norm i-->j: 24 H; applied: errUni*errMeth 23 TYR H 24 TYR H 3.64 # uni-dir reff= 4.45; 23 H 24 H; norm i-->j: 24 H; applied: errUni 24 TYR H 34 PHE QD 5.45 # uni-dir reff= 5.42; 34 QD 24 H; norm i-->j: 24 H; applied: errUni*errMethyleneQ UPL SET TO 8A 18 ASN H 18 ASN HD21 4.06 # uni-dir reff= 4.97; 18 H 18 HD21; norm i-->j: 18 HD21; applied: errUni 8 PRO HG2 39 GLY H 4.88 # uni-dir reff= 5.97; 8 HG2 39 H; norm i-->j: 39 H; applied: errUni 18 ASN H 18 ASN HD22 4.06 # uni-dir reff= 4.63; 18 HD22 18 H; norm i-->j: 18 H; applied: errUni 8 PRO HG3 38 SER H 4.69 # uni-dir reff= 5.74; 8 HG3 38 H; norm i-->j: 38 H; applied: errUni 30 ASN H 30 ASN HD22 5.01 # uni-dir reff= 6.13; 30 H 30 HD22; norm i-->j: 30 HD22; applied: errUni 31 ALA H 32 SER H 3.81 # uni-dir reff= 4.66; 31 H 32 H; norm i-->j: 32 H; applied: errUni 18 ASN QB 20 GLY H 3.74 # uni-dir reff= 4.89; 18 QB 20 H; norm i-->j: 20 H; applied: errUni*errMethyleneQ 10 GLY H 28 ILE HG13 4.86 # uni-dir reff= 5.95; 28 HG13 10 H; norm i-->j: 10 H; applied: errUni 16 SER H 20 GLY H 3.74 # uni-dir reff= 4.57; 16 H 20 H; norm i-->j: 20 H; applied: errUni 19 SER H 21 ARG HB2 4.00 # uni-dir reff= 4.89; 21 HB2 19 H; norm i-->j: 19 H; applied: errUni 23 TYR QD 33 GLN H 2.66 # uni-dir reff= 3.48; 33 H 23 QD; norm i-->j: 23 QD; applied: errUni*errMethyleneQ 19 SER HB2 21 ARG HD3 3.28 # uni-dir reff= 4.01; 19 HB2 21 HD3; norm i-->j: 21 HD3; applied: errUni 11 TRP HZ2 26 ASN HD22 4.05 # uni-dir reff= 4.95; 11 HZ2 26 HD22; norm i-->j: 26 HD22; applied: errUni 26 ASN HD22 29 THR H 3.23 # uni-dir reff= 3.95; 29 H 26 HD22; norm i-->j: 26 HD22; applied: errUni 26 ASN HD22 31 ALA H 4.30 # uni-dir reff= 5.26; 31 H 26 HD22; norm i-->j: 26 HD22; applied: errUni 26 ASN HD21 31 ALA H 3.91 # uni-dir reff= 4.78; 31 H 26 HD21; norm i-->j: 26 HD21; applied: errUni 26 ASN HA 26 ASN HD21 3.54 # uni-dir reff= 4.33; 26 HA 26 HD21; norm i-->j: 26 HD21; applied: errUni 34 PHE HA 34 PHE QD 2.49 # uni-dir reff= 3.25; 34 HA 34 QD; norm i-->j: 34 QD; applied: errUni*errMethyleneQ 26 ASN HD21 29 THR H 3.35 # uni-dir reff= 4.09; 29 H 26 HD21; norm i-->j: 26 HD21; applied: errUni 7 LEU HB2 11 TRP H 4.08 # uni-dir reff= 4.99; 11 H 7 HB2; norm i-->j: 7 HB2; applied: errUni 11 TRP HE3 24 TYR HB2 2.90 # uni-dir reff= 3.54; 11 HE3 24 HB2; norm i-->j: 24 HB2; applied: errUni 24 TYR HB2 37 PRO HG2 3.85 # uni-dir reff= 4.71; 37 HG2 24 HB2; norm i-->j: 24 HB2; applied: errUni 26 ASN HB3 29 THR QG2 3.32 # uni-dir reff= 4.50; 29 QG2 26 HB3; norm i-->j: 26 HB3; applied: errUni*errMeth 11 TRP HZ2 26 ASN HB2 3.13 # uni-dir reff= 3.84; 11 HZ2 26 HB2; norm i-->j: 26 HB2; applied: errUni 26 ASN HB2 29 THR QG2 3.75 # uni-dir reff= 5.08; 29 QG2 26 HB2; norm i-->j: 26 HB2; applied: errUni*errMeth 11 TRP HH2 26 ASN HB3 3.81 # uni-dir reff= 4.65; 26 HB3 11 HH2; norm i-->j: 11 HH2; applied: errUni 19 SER HB2 21 ARG HD2 3.60 # uni-dir reff= 4.41; 21 HD2 19 HB2; norm i-->j: 19 HB2; applied: errUni 11 TRP HH2 26 ASN H 3.07 # uni-dir reff= 3.76; 26 H 11 HH2; norm i-->j: 11 HH2; applied: errUni 11 TRP HH2 33 GLN HE21 3.06 # uni-dir reff= 3.74; 33 HE21 11 HH2; norm i-->j: 11 HH2; applied: errUni 11 TRP HH2 37 PRO HG3 3.50 # uni-dir reff= 4.29; 37 HG3 11 HH2; norm i-->j: 11 HH2; applied: errUni 14 ARG HB3 23 TYR H 3.93 # uni-dir reff= 4.81; 23 H 14 HB3; norm i-->j: 14 HB3; applied: errUni 14 ARG HB2 23 TYR QD 5.45 # uni-dir reff= 4.51; 23 QD 14 HB2; norm i-->j: 14 HB2; applied: errUni*errMethyleneQ UPL SET TO 8A 14 ARG HB2 25 PHE HB2 3.84 # uni-dir reff= 4.70; 25 HB2 14 HB2; norm i-->j: 14 HB2; applied: errUni 16 SER QB 19 SER HB2 2.42 # uni-dir reff= 3.16; 19 HB2 16 QB; norm i-->j: 16 QB; applied: errUni*errMethyleneQ 16 SER QB 18 ASN QB 3.05 # uni-dir reff= 4.26; 18 QB 16 QB; norm i-->j: 16 QB; applied: errUni*errMethyleneQ*errMethyleneQ 16 SER QB 18 ASN H 3.15 # uni-dir reff= 4.12; 18 H 16 QB; norm i-->j: 16 QB; applied: errUni*errMethyleneQ 27 HIS HD2 28 ILE HA 4.05 # uni-dir reff= 4.96; 27 HD2 28 HA; norm i-->j: 28 HA; applied: errUni 27 HIS HA 28 ILE HA 3.91 # uni-dir reff= 4.78; 27 HA 28 HA; norm i-->j: 28 HA; applied: errUni 11 TRP HZ3 33 GLN H 2.88 # uni-dir reff= 3.53; 33 H 11 HZ3; norm i-->j: 11 HZ3; applied: errUni 7 LEU HB2 8 PRO HD2 3.64 # uni-dir reff= 4.45; 8 HD2 7 HB2; norm i-->j: 7 HB2; applied: errUni 11 TRP H 11 TRP HB3 2.54 # uni-dir reff= 3.10; 11 H 11 HB3; norm i-->j: 11 HB3; applied: errUni 19 SER HB2 20 GLY H 2.66 # uni-dir reff= 3.25; 20 H 19 HB2; norm i-->j: 19 HB2; applied: errUni 35 GLU H 35 GLU HG3 2.87 # uni-dir reff= 3.10; 35 HG3 35 H; norm i-->j: 35 H; applied: errUni 19 SER H 19 SER HA 2.00 # bi-dir reff= 2.94; 19 H 19 HA; norm i-->j: 19 HA ,norm j-->i: 19 H 35 GLU H 35 GLU HG2 2.87 # uni-dir reff= 3.51; 35 HG2 35 H; norm i-->j: 35 H; applied: errUni 33 GLN HB3 35 GLU H 3.54 # uni-dir reff= 4.32; 35 H 33 HB3; norm i-->j: 35 H; applied: errUni 15 MET H 15 MET HG2 3.87 # uni-dir reff= 4.74; 15 H 15 HG2; norm i-->j: 15 H; applied: errUni 11 TRP HZ2 37 PRO HB2 3.48 # uni-dir reff= 4.26; 11 HZ2 37 HB2; norm i-->j: 11 HZ2; applied: errUni 33 GLN HE22 37 PRO HB2 3.55 # uni-dir reff= 4.34; 33 HE22 37 HB2; norm i-->j: 33 HE22; applied: errUni 8 PRO HD2 37 PRO HB3 3.88 # uni-dir reff= 4.75; 8 HD2 37 HB3; norm i-->j: 8 HD2; applied: errUni 8 PRO HG3 37 PRO HB3 3.57 # uni-dir reff= 4.37; 8 HG3 37 HB3; norm i-->j: 8 HG3; applied: errUni 36 ARG H 36 ARG HB2 2.69 # uni-dir reff= 3.25; 36 H 36 HB2; norm i-->j: 36 H; applied: errUni 24 TYR QE 36 ARG HB2 5.45 # uni-dir reff= 4.12; 24 QE 36 HB2; norm i-->j: 24 QE; applied: errUni*errMethyleneQ UPL SET TO 8A 36 ARG H 36 ARG HB3 2.69 # uni-dir reff= 3.29; 36 H 36 HB3; norm i-->j: 36 H; applied: errUni 24 TYR QE 36 ARG HB3 5.45 # uni-dir reff= 4.05; 24 QE 36 HB3; norm i-->j: 24 QE; applied: errUni*errMethyleneQ UPL SET TO 8A 27 HIS HA 27 HIS HD2 2.87 # uni-dir reff= 3.51; 27 HD2 27 HA; norm i-->j: 27 HD2; applied: errUni 8 PRO HG2 39 GLY HA2 3.18 # uni-dir reff= 3.81; 8 HG2 39 HA2; norm i-->j: 8 HG2; applied: errUni 8 PRO HG2 39 GLY HA3 3.18 # uni-dir reff= 3.89; 8 HG2 39 HA3; norm i-->j: 8 HG2; applied: errUni 13 LYS QE 22 VAL QG1 4.03 # uni-dir reff= 5.84; 22 QG1 13 QE; norm i-->j: 22 QG1; applied: errUni*errMeth*errMethyleneQ 24 TYR HB3 37 PRO HG3 3.23 # uni-dir reff= 3.95; 37 HG3 24 HB3; norm i-->j: 37 HG3; applied: errUni 11 TRP HE3 24 TYR HB3 2.09 # uni-dir reff= 2.56; 11 HE3 24 HB3; norm i-->j: 11 HE3; applied: errUni 25 PHE HZ 30 ASN HB2 2.60 # uni-dir reff= 3.19; 25 HZ 30 HB2; norm i-->j: 25 HZ; applied: errUni 38 SER H 38 SER HB2 2.81 # uni-dir reff= 3.43; 38 H 38 HB2; norm i-->j: 38 H; applied: errUni 38 SER HB2 39 GLY H 3.69 # uni-dir reff= 4.47; 39 H 38 HB2; norm i-->j: 39 H; applied: errUni 38 SER HB3 39 GLY H 3.69 # uni-dir reff= 4.52; 39 H 38 HB3; norm i-->j: 39 H; applied: errUni 14 ARG HA 15 MET QB 3.48 # uni-dir reff= 4.56; 14 HA 15 QB; norm i-->j: 14 HA; applied: errUni*errMethyleneQ 6 LYS HB2 7 LEU H 3.49 # uni-dir reff= 4.17; 7 H 6 HB2; norm i-->j: 7 H; applied: errUni 6 LYS HB3 7 LEU H 3.49 # uni-dir reff= 4.27; 7 H 6 HB3; norm i-->j: 7 H; applied: errUni 13 LYS HD2 22 VAL QG1 5.23 # uni-dir reff= 7.08; 22 QG1 13 HD2; norm i-->j: 22 QG1; applied: errUni*errMeth 30 ASN HA 30 ASN HD21 3.07 # uni-dir reff= 3.76; 30 HA 30 HD21; norm i-->j: 30 HA; applied: errUni 8 PRO HG2 37 PRO HB3 3.76 # uni-dir reff= 4.60; 8 HG2 37 HB3; norm i-->j: 8 HG2; applied: errUni 27 HIS HA 30 ASN HA 3.37 # uni-dir reff= 4.12; 30 HA 27 HA; norm i-->j: 30 HA; applied: errUni 7 LEU H 7 LEU HG 2.77 # uni-dir reff= 3.39; 7 H 7 HG; norm i-->j: 7 H; applied: errUni 17 ARG QG 18 ASN H 4.14 # uni-dir reff= 5.41; 18 H 17 QG; norm i-->j: 18 H; applied: errUni*errMethyleneQ 33 GLN HE21 36 ARG H 4.56 # uni-dir reff= 5.58; 36 H 33 HE21; norm i-->j: 36 H; applied: errUni 8 PRO HB3 39 GLY HA2 3.35 # uni-dir reff= 4.00; 8 HB3 39 HA2; norm i-->j: 8 HB3; applied: errUni 8 PRO HB3 39 GLY HA3 3.35 # uni-dir reff= 4.10; 8 HB3 39 HA3; norm i-->j: 8 HB3; applied: errUni 33 GLN HE21 37 PRO HG3 3.69 # uni-dir reff= 4.51; 37 HG3 33 HE21; norm i-->j: 37 HG3; applied: errUni 24 TYR HB3 37 PRO HD2 3.86 # uni-dir reff= 4.72; 37 HD2 24 HB3; norm i-->j: 37 HD2; applied: errUni 13 LYS HA 24 TYR HB3 4.12 # uni-dir reff= 5.03; 13 HA 24 HB3; norm i-->j: 13 HA; applied: errUni 24 TYR HB3 37 PRO HG2 4.54 # uni-dir reff= 5.56; 37 HG2 24 HB3; norm i-->j: 37 HG2; applied: errUni 33 GLN HE22 35 GLU HG2 4.14 # uni-dir reff= 5.06; 33 HE22 35 HG2; norm i-->j: 33 HE22; applied: errUni 33 GLN HE22 35 GLU HG3 4.14 # uni-dir reff= 4.99; 33 HE22 35 HG3; norm i-->j: 33 HE22; applied: errUni 15 MET QB 23 TYR H 4.46 # uni-dir reff= 5.83; 23 H 15 QB; norm i-->j: 23 H; applied: errUni*errMethyleneQ 13 LYS HB3 24 TYR QE 5.45 # uni-dir reff= 4.44; 24 QE 13 HB3; norm i-->j: 24 QE; applied: errUni*errMethyleneQ UPL SET TO 8A 6 LYS H 6 LYS QB 2.04 6 LYS HA 6 LYS QD 4.66 8 PRO HB2 39 GLY QA 3.60 8 PRO HB3 9 PRO QG 3.96 8 PRO HB3 39 GLY QA 2.95 8 PRO HG3 39 GLY QA 3.29 9 PRO QB 10 GLY HA3 3.48 9 PRO QB 28 ILE QD1 4.30 9 PRO QG 10 GLY H 3.37 12 GLU H 12 GLU QG 2.28 12 GLU HA 12 GLU QG 2.27 12 GLU QB 14 ARG QG 2.77 12 GLU QG 13 LYS H 2.57 12 GLU QG 14 ARG QG 2.51 12 GLU QG 25 PHE HB3 2.83 13 LYS HA 14 ARG QG 3.72 14 ARG H 14 ARG QD 4.17 14 ARG HA 14 ARG QG 2.20 14 ARG HA 14 ARG QD 2.27 14 ARG HB2 14 ARG QG 1.65 14 ARG HB3 14 ARG QG 1.79 14 ARG HB3 14 ARG QD 2.31 14 ARG QG 14 ARG HH21 3.08 14 ARG QG 14 ARG HH22 3.81 14 ARG QG 15 MET H 3.00 14 ARG QG 23 TYR QE 3.14 14 ARG QG 25 PHE H 2.91 14 ARG QG 25 PHE HB2 3.15 14 ARG QG 25 PHE HB3 2.41 14 ARG QD 14 ARG HH22 2.88 14 ARG QD 15 MET H 3.46 14 ARG QD 23 TYR QE 2.79 14 ARG QD 25 PHE H 4.41 14 ARG QD 25 PHE HB2 3.05 14 ARG QD 25 PHE HB3 2.61 15 MET H 15 MET QG 3.37 15 MET QG 16 SER H 2.46 15 MET QG 22 VAL HA 3.13 17 ARG HA 17 ARG QD 3.35 17 ARG QB 17 ARG QD 2.18 17 ARG QB 18 ASN QD2 4.27 17 ARG QG 18 ASN QD2 4.57 18 ASN H 18 ASN QD2 3.48 18 ASN QB 18 ASN QD2 2.12 20 GLY QA 22 VAL H 4.51 21 ARG HH22 34 PHE QB 3.00 23 TYR H 23 TYR QB 2.43 23 TYR QB 24 TYR H 1.76 23 TYR QB 33 GLN H 3.10 23 TYR QB 34 PHE HA 2.13 23 TYR QB 34 PHE QD 2.13 23 TYR QB 34 PHE QE 5.21 23 TYR QD 32 SER QB 2.96 24 TYR QE 36 ARG QG 5.22 25 PHE HA 32 SER QB 3.01 25 PHE HB2 32 SER QB 4.16 25 PHE QD 32 SER QB 1.94 32 SER H 32 SER QB 2.16 32 SER HA 32 SER QB 1.74 32 SER QB 33 GLN H 2.49 32 SER QB 34 PHE QE 5.22 34 PHE H 34 PHE QB 1.88 34 PHE QB 35 GLU H 2.18 34 PHE QB 35 GLU HA 3.28 35 GLU H 35 GLU QB 1.87 35 GLU H 35 GLU QG 2.38 35 GLU HA 35 GLU QG 2.40 35 GLU HA 36 ARG QB 4.16 35 GLU QB 36 ARG H 2.30 35 GLU QG 36 ARG H 3.49 36 ARG H 36 ARG QG 2.81 36 ARG HA 36 ARG QG 1.93 36 ARG QB 37 PRO HD2 3.61 36 ARG QG 37 PRO HD2 1.99 36 ARG QG 38 SER H 4.15
Contact the webmaster for help, if required. Thursday, May 16, 2024 11:36:53 PM GMT (wattos1)