Finding intermodel H-bonds
Finding intramodel H-bonds
Constraints relaxed by 0.4 angstroms and 20 degrees
Models used:
	#0 3pyk_A.cif

H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist):
GLY 4.A N       ASN 9.A O       no hydrogen  3.017  N/A
GLY 6.A N       ASN 9.A OD1     no hydrogen  3.190  N/A
ASN 9.A N       GLY 6.A O       no hydrogen  3.293  N/A
HIS 13.A N      GLY 10.A O      no hydrogen  2.806  N/A
TRP 14.A NE1    GLY 4.A O       no hydrogen  3.070  N/A
TRP 14.A NE1    ASN 9.A O       no hydrogen  3.156  N/A
LYS 16.A N      HIS 13.A O      no hydrogen  3.198  N/A
LYS 16.A NZ     HIS 13.A ND1    no hydrogen  2.792  N/A
PHE 18.A N      TRP 14.A O      no hydrogen  2.918  N/A
ALA 21.A N      PHE 18.A O      no hydrogen  2.868  N/A
LYS 22.A N      PRO 19.A O      no hydrogen  3.175  N/A
GLY 23.A N      ILE 20.A O.A    no hydrogen  2.877  N/A
GLY 23.A N      ILE 20.A O.B    no hydrogen  2.754  N/A
ARG 25.A N      GLU 202.A OE2   no hydrogen  3.024  N/A
ARG 25.A NE     GLY 193.A O     no hydrogen  2.972  N/A
ARG 25.A NH1    PRO 135.A O     no hydrogen  3.364  N/A
ARG 25.A NH2    PRO 135.A O     no hydrogen  3.198  N/A
ARG 25.A NH2    GLY 193.A O     no hydrogen  3.029  N/A
ARG 25.A NH2    VAL 204.A O     no hydrogen  3.093  N/A
GLN 26.A NE2    LEU 200.A O     no hydrogen  3.071  N/A
GLN 26.A NE2    GLU 202.A OE2   no hydrogen  3.017  N/A
SER 27.A N      SER 194.A OG    no hydrogen  2.921  N/A
SER 27.A OG     TYR 191.A OH    no hydrogen  2.765  N/A
SER 27.A OG     SER 194.A O     no hydrogen  3.495  N/A
ILE 31.A N      THR 106.A O     no hydrogen  2.788  N/A
THR 33.A N      ASP 108.A OD1   no hydrogen  2.835  N/A
THR 33.A OG1    ASP 108.A OD1   no hydrogen  3.254  N/A
THR 33.A OG1    ASP 108.A OD2   no hydrogen  2.660  N/A
HIS 34.A N      ASP 32.A OD1.B  no hydrogen  2.867  N/A
THR 35.A N      ASP 32.A O.A    no hydrogen  3.058  N/A
THR 35.A N      ASP 32.A O.B    no hydrogen  3.037  N/A
THR 35.A OG1    ASP 32.A OD2.A  no hydrogen  2.945  N/A
THR 35.A OG1    ASP 32.A OD2.B  no hydrogen  3.198  N/A
ALA 36.A N      ASP 32.A O.A    no hydrogen  3.053  N/A
ALA 36.A N      ASP 32.A O.B    no hydrogen  3.041  N/A
LYS 37.A N      ILE 253.A O     no hydrogen  3.319  N/A
ASP 39.A N      ALA 255.A O     no hydrogen  2.924  N/A
SER 41.A N      ASP 39.A OD1    no hydrogen  3.001  N/A
SER 41.A OG     ASP 39.A OD1    no hydrogen  2.537  N/A
SER 41.A OG     ASP 39.A OD2    no hydrogen  3.461  N/A
LEU 42.A N      ASP 39.A O      no hydrogen  3.109  N/A
SER 46.A N      LYS 78.A O.A    no hydrogen  2.849  N/A
SER 46.A N      LYS 78.A O.B    no hydrogen  2.824  N/A
SER 48.A N      VAL 76.A O      no hydrogen  2.873  N/A
TYR 49.A OH     HIS 120.A NE2   no hydrogen  2.722  N/A
GLN 51.A NE2    ASP 50.A OD2    no hydrogen  3.093  N/A
ALA 52.A N      TYR 49.A O      no hydrogen  3.117  N/A
THR 53.A OG1    GLN 51.A O      no hydrogen  3.300  N/A
SER 54.A OG     PHE 173.A O     no hydrogen  2.645  N/A
LEU 55.A N      GLU 67.A O      no hydrogen  2.671  N/A
ARG 56.A NH2    SER 170.A OG    no hydrogen  2.893  N/A
ILE 57.A N      ALA 171.A O     no hydrogen  2.911  N/A
LEU 58.A N      ASN 65.A O      no hydrogen  2.897  N/A
ASN 59.A N      LYS 169.A O     no hydrogen  2.931  N/A
ASN 59.A ND2    ILE 164.A O     no hydrogen  3.089  N/A
ASN 59.A ND2    ASN 227.A O     no hydrogen  3.141  N/A
ASN 60.A N      ALA 63.A O      no hydrogen  3.097  N/A
GLY 61.A N      ASN 59.A OD1    no hydrogen  2.836  N/A
HIS 62.A N      ASN 60.A OD1    no hydrogen  2.910  N/A
ALA 63.A N      ASN 60.A OD1    no hydrogen  2.912  N/A
ASN 65.A N      LEU 58.A O      no hydrogen  2.841  N/A
VAL 66.A N      PHE 91.A O      no hydrogen  2.846  N/A
GLU 67.A N      ARG 56.A O      no hydrogen  2.875  N/A
PHE 68.A N      ILE 89.A O      no hydrogen  2.858  N/A
ASP 69.A N      THR 53.A O      no hydrogen  2.877  N/A
SER 71.A N      ASP 69.A OD1    no hydrogen  3.014  N/A
SER 71.A OG     ASP 69.A OD1    no hydrogen  2.731  N/A
LYS 74.A N      GLN 72.A O      no hydrogen  2.884  N/A
VAL 76.A N      SER 48.A O      no hydrogen  2.925  N/A
LEU 77.A N      TYR 86.A O      no hydrogen  2.828  N/A
LYS 78.A N.A    SER 46.A O      no hydrogen  2.915  N/A
LYS 78.A N.B    SER 46.A O      no hydrogen  2.928  N/A
GLY 80.A N      PRO 44.A O      no hydrogen  3.106  N/A
LEU 82.A N      GLY 79.A O      no hydrogen  2.894  N/A
TYR 86.A N      LEU 77.A O      no hydrogen  3.052  N/A
TYR 86.A OH     ASP 136.A O     no hydrogen  3.056  N/A
ARG 87.A N      TRP 121.A O     no hydrogen  2.813  N/A
ARG 87.A NE     ASP 73.A OD1    no hydrogen  2.530  N/A
ARG 87.A NH1    ASP 70.A O      no hydrogen  3.107  N/A
ARG 87.A NH2    ASP 73.A OD1    no hydrogen  3.165  N/A
LEU 88.A N      ALA 75.A O      no hydrogen  2.922  N/A
ILE 89.A N      VAL 119.A O     no hydrogen  2.910  N/A
PHE 91.A N      VAL 66.A O      no hydrogen  2.937  N/A
HIS 92.A N      HIS 117.A O     no hydrogen  3.093  N/A
HIS 92.A ND1    GLN 90.A OE1    no hydrogen  2.810  N/A
HIS 94.A N      GLU 115.A O     no hydrogen  2.870  N/A
HIS 94.A ND1    ASN 241.A O     no hydrogen  2.788  N/A
HIS 94.A NE2    HIS 92.A NE2    no hydrogen  3.176  N/A
TRP 95.A N      ASN 241.A OD1   no hydrogen  2.820  N/A
TRP 95.A NE1    MET 238.A O     no hydrogen  2.869  N/A
SER 97.A N      ASP 240.A OD1   no hydrogen  3.053  N/A
SER 97.A OG     ASP 240.A OD1   no hydrogen  3.537  N/A
SER 97.A OG     ASP 240.A OD2   no hydrogen  2.644  N/A
GLN 101.A N     LEU 98.A O      no hydrogen  3.363  N/A
GLN 101.A NE2   ASP 240.A OD1   no hydrogen  2.809  N/A
GLN 101.A NE2   ASP 240.A OD2   no hydrogen  3.372  N/A
SER 103.A N     TYR 112.A O     no hydrogen  2.972  N/A
SER 103.A OG    HIS 105.A O     no hydrogen  2.787  N/A
GLU 104.A N     GLU 115.A OE1   no hydrogen  2.850  N/A
HIS 105.A N     GLU 115.A OE1   no hydrogen  2.836  N/A
HIS 105.A ND1   GLU 115.A OE2   no hydrogen  2.771  N/A
HIS 105.A NE2   TYR 191.A OH    no hydrogen  2.624  N/A
THR 106.A N     VAL 29.A O      no hydrogen  3.476  N/A
THR 106.A OG1   ASP 30.A OD1    no hydrogen  2.675  N/A
VAL 107.A N     LYS 110.A O     no hydrogen  3.088  N/A
ASP 108.A N     ILE 31.A O      no hydrogen  2.857  N/A
LYS 109.A N     ASP 30.A OD1    no hydrogen  2.789  N/A
LYS 110.A N     VAL 107.A O     no hydrogen  2.878  N/A
TYR 112.A N     SER 103.A OG    no hydrogen  2.906  N/A
ALA 114.A N     LEU 145.A O     no hydrogen  3.375  N/A
GLU 115.A N     HIS 94.A O      no hydrogen  2.874  N/A
LEU 116.A N     ILE 143.A O     no hydrogen  2.789  N/A
HIS 117.A N     HIS 92.A O      no hydrogen  2.877  N/A
HIS 117.A NE2   GLU 115.A OE2   no hydrogen  2.688  N/A
LEU 118.A N     LEU 141.A O     no hydrogen  2.889  N/A
VAL 119.A N     GLN 90.A O      no hydrogen  2.823  N/A
HIS 120.A N     ALA 139.A O     no hydrogen  2.916  N/A
HIS 120.A ND1   ALA 139.A O     no hydrogen  3.032  N/A
HIS 120.A NE2   TYR 49.A OH     no hydrogen  2.722  N/A
TRP 121.A N     ARG 87.A O      no hydrogen  2.925  N/A
TRP 121.A NE1   ASP 70.A OD2    no hydrogen  2.666  N/A
ASN 122.A N     GLY 137.A O     no hydrogen  2.817  N/A
ASN 122.A ND2   ASP 136.A O     no hydrogen  3.065  N/A
THR 123.A N     THR 85.A O      no hydrogen  2.926  N/A
THR 123.A OG1   THR 85.A O      no hydrogen  3.272  N/A
LYS 124.A N     ASN 122.A OD1   no hydrogen  3.089  N/A
TYR 125.A N     ASN 122.A O     no hydrogen  3.051  N/A
TYR 125.A OH    ASP 136.A OD1   no hydrogen  2.579  N/A
GLY 126.A N     THR 123.A O     no hydrogen  3.164  N/A
ASP 127.A N     TYR 125.A O     no hydrogen  2.974  N/A
LYS 130.A N.A   ASP 127.A OD1   no hydrogen  2.875  N/A
LYS 130.A N.B   ASP 127.A OD1   no hydrogen  2.875  N/A
ALA 131.A N     ASP 127.A O     no hydrogen  2.957  N/A
VAL 132.A N     PHE 128.A O.A   no hydrogen  3.081  N/A
VAL 132.A N     PHE 128.A O.B   no hydrogen  3.183  N/A
GLN 133.A N     LYS 130.A O.A   no hydrogen  3.257  N/A
GLN 133.A N     LYS 130.A O.B   no hydrogen  2.913  N/A
GLN 134.A N     ALA 131.A O     no hydrogen  3.020  N/A
GLY 137.A N     GLN 134.A O     no hydrogen  3.125  N/A
LEU 138.A N     CYS 203.A O.A   no hydrogen  2.955  N/A
LEU 138.A N     CYS 203.A O.B   no hydrogen  2.845  N/A
ALA 139.A N     HIS 120.A O     no hydrogen  2.907  N/A
VAL 140.A N     THR 205.A O     no hydrogen  3.162  N/A
LEU 141.A N     LEU 118.A O     no hydrogen  2.916  N/A
GLY 142.A N     ILE 207.A O     no hydrogen  2.770  N/A
ILE 143.A N     LEU 116.A O     no hydrogen  2.893  N/A
LEU 145.A N     ALA 114.A O     no hydrogen  2.916  N/A
LYS 146.A N     ILE 213.A O     no hydrogen  2.931  N/A
GLY 148.A N     VAL 215.A O     no hydrogen  2.759  N/A
LYS 151.A N     GLN 219.A OE1   no hydrogen  3.075  N/A
LYS 151.A NZ    LEU 182.A O     no hydrogen  2.918  N/A
LEU 154.A N     LYS 151.A O     no hydrogen  3.001  N/A
GLN 155.A N     PRO 152.A O     no hydrogen  3.106  N/A
GLN 155.A NE2   ASP 159.A OD1   no hydrogen  2.998  N/A
VAL 158.A N     LEU 154.A O     no hydrogen  3.160  N/A
ASP 159.A N     GLN 155.A O     no hydrogen  2.877  N/A
VAL 160.A N     VAL 157.A O     no hydrogen  3.112  N/A
LEU 161.A N     VAL 158.A O     no hydrogen  3.260  N/A
SER 163.A N     VAL 160.A O     no hydrogen  2.981  N/A
SER 163.A OG    VAL 160.A O     no hydrogen  2.720  N/A
ILE 164.A N     LEU 161.A O     no hydrogen  3.039  N/A
LYS 167.A N     ASN 229.A O     no hydrogen  2.916  N/A
GLY 168.A N     ASN 59.A O      no hydrogen  2.739  N/A
LYS 169.A N     THR 166.A O     no hydrogen  3.155  N/A
ALA 171.A N     ILE 57.A O      no hydrogen  2.900  N/A
PHE 173.A N     LEU 55.A O      no hydrogen  3.141  N/A
THR 174.A N     ASP 172.A OD2   no hydrogen  2.927  N/A
THR 174.A OG1   ASP 172.A OD2   no hydrogen  2.710  N/A
THR 174.A OG1   ASN 175.A OD1   no hydrogen  3.337  N/A
PHE 176.A N     SER 54.A OG     no hydrogen  2.817  N/A
ARG 179.A N     ASP 177.A OD1   no hydrogen  3.028  N/A
ARG 179.A NE    ASP 177.A OD1   no hydrogen  2.894  N/A
ARG 179.A NE    ASP 177.A OD2   no hydrogen  3.393  N/A
ARG 179.A NH1   ASP 50.A OD1    no hydrogen  2.868  N/A
ARG 179.A NH2   ASP 177.A OD2   no hydrogen  3.534  N/A
GLY 180.A N     ASP 177.A O     no hydrogen  3.214  N/A
LEU 181.A N     PRO 178.A O     no hydrogen  3.019  N/A
LEU 182.A N     ARG 179.A O     no hydrogen  3.379  N/A
SER 185.A N     GLU 211.A OE1   no hydrogen  2.896  N/A
ASP 187.A N     SER 185.A OG    no hydrogen  3.025  N/A
TYR 188.A N     SER 256.A OG    no hydrogen  2.928  N/A
TYR 188.A OH    LYS 43.A O      no hydrogen  3.140  N/A
TRP 189.A N     VAL 208.A O     no hydrogen  2.850  N/A
THR 190.A N     LYS 254.A O     no hydrogen  2.871  N/A
THR 190.A OG1   TRP 206.A O     no hydrogen  2.751  N/A
TYR 191.A N     TRP 206.A O     no hydrogen  3.253  N/A
TYR 191.A OH    SER 27.A OG     no hydrogen  2.765  N/A
TYR 191.A OH    HIS 105.A NE2   no hydrogen  2.624  N/A
GLY 193.A N     VAL 204.A O     no hydrogen  2.743  N/A
SER 194.A N     SER 27.A OG     no hydrogen  2.925  N/A
SER 194.A OG    LEU 195.A O     no hydrogen  2.736  N/A
LEU 195.A N     LEU 201.A O     no hydrogen  2.943  N/A
THR 196.A OG1   GLU 104.A OE1   no hydrogen  2.615  N/A
THR 196.A OG1   GLU 104.A OE2   no hydrogen  3.448  N/A
THR 197.A OG1   PRO 198.A O     no hydrogen  3.309  N/A
LEU 200.A N     THR 197.A O     no hydrogen  2.788  N/A
CYS 203.A N.A   LEU 201.A O     no hydrogen  3.091  N/A
CYS 203.A N.B   LEU 201.A O     no hydrogen  3.107  N/A
CYS 203.A SG.A  VAL 132.A O     no hydrogen  3.303  N/A
CYS 203.A SG.B  LEU 201.A O     no hydrogen  3.726  N/A
VAL 204.A N     GLY 193.A O     no hydrogen  3.186  N/A
THR 205.A N     LEU 138.A O     no hydrogen  2.875  N/A
TRP 206.A N     TYR 191.A O     no hydrogen  2.946  N/A
TRP 206.A NE1   SER 194.A O     no hydrogen  2.956  N/A
ILE 207.A N     VAL 140.A O     no hydrogen  2.985  N/A
VAL 208.A N     TRP 189.A O     no hydrogen  2.807  N/A
LEU 209.A N     GLY 142.A O     no hydrogen  2.866  N/A
LYS 210.A N     ASP 187.A O     no hydrogen  2.944  N/A
ILE 213.A N     PHE 144.A O     no hydrogen  2.840  N/A
VAL 215.A N     LYS 146.A O     no hydrogen  2.878  N/A
SER 216.A N     GLN 219.A OE1   no hydrogen  3.046  N/A
SER 216.A OG    GLU 218.A OE1   no hydrogen  3.338  N/A
GLN 219.A N     SER 216.A OG    no hydrogen  3.146  N/A
GLN 219.A NE2   LYS 151.A O     no hydrogen  3.025  N/A
GLN 219.A NE2   GLN 155.A OE1   no hydrogen  2.916  N/A
VAL 220.A N     SER 216.A O     no hydrogen  3.128  N/A
LEU 221.A N     SER 217.A O     no hydrogen  2.936  N/A
LYS 222.A N     GLU 218.A O     no hydrogen  3.343  N/A
LYS 222.A N     GLN 219.A O     no hydrogen  3.213  N/A
PHE 223.A N     GLN 219.A O     no hydrogen  3.368  N/A
ARG 224.A N     VAL 220.A O     no hydrogen  3.181  N/A
ARG 224.A NE    GLY 96.A O      no hydrogen  2.863  N/A
ARG 224.A NH2   ASP 99.A OD1    no hydrogen  2.809  N/A
LYS 225.A N     LYS 222.A O     no hydrogen  3.250  N/A
LEU 226.A N     PHE 223.A O     no hydrogen  3.241  N/A
ASN 227.A N     LYS 165.A O     no hydrogen  2.786  N/A
ASN 227.A ND2   GLU 235.A OE2   no hydrogen  2.960  N/A
PHE 228.A N     GLU 236.A O.A   no hydrogen  2.953  N/A
PHE 228.A N     GLU 236.A O.B   no hydrogen  2.976  N/A
ASN 229.A ND2   ASN 227.A OD1   no hydrogen  3.463  N/A
ASN 229.A ND2   GLY 230.A O     no hydrogen  2.983  N/A
GLY 230.A N     GLU 233.A OE1   no hydrogen  2.786  N/A
GLU 233.A N     GLY 230.A O     no hydrogen  3.300  N/A
GLU 236.A N.A   ASN 229.A OD1   no hydrogen  2.793  N/A
GLU 236.A N.B   ASN 229.A OD1   no hydrogen  2.792  N/A
MET 238.A N     LEU 226.A O     no hydrogen  2.863  N/A
ASN 241.A N     TRP 95.A O      no hydrogen  3.289  N/A
ASN 241.A ND2   HIS 62.A O      no hydrogen  2.961  N/A
TRP 242.A NE1   ASP 240.A OD1   no hydrogen  3.071  N/A
ARG 243.A N     GLU 104.A OE2   no hydrogen  2.787  N/A
ARG 243.A NH1   GLN 26.A OE1    no hydrogen  2.786  N/A
ARG 243.A NH1   SER 27.A O      no hydrogen  2.832  N/A
ARG 243.A NH2   ALA 21.A O      no hydrogen  3.136  N/A
ARG 243.A NH2   GLN 26.A OE1    no hydrogen  3.388  N/A
GLN 246.A N     PRO 28.A O      no hydrogen  2.797  N/A
GLN 246.A NE2   PRO 244.A O     no hydrogen  2.833  N/A
LYS 249.A NZ    GLY 23.A O      no hydrogen  2.944  N/A
LYS 249.A NZ    GLU 24.A OE2    no hydrogen  3.308  N/A
ARG 251.A NE    LEU 248.A O     no hydrogen  2.832  N/A
ARG 251.A NH1   GLN 26.A O      no hydrogen  3.035  N/A
ARG 251.A NH1   PRO 192.A O     no hydrogen  2.882  N/A
ARG 251.A NH2   GLN 26.A O      no hydrogen  2.828  N/A
ARG 251.A NH2   PRO 247.A O     no hydrogen  2.850  N/A
LYS 254.A N     THR 190.A O     no hydrogen  2.916  N/A
ALA 255.A N     LYS 37.A O      no hydrogen  2.845  N/A
SER 256.A N     TYR 188.A O     no hydrogen  2.854  N/A
SER 256.A OG    TYR 188.A O     no hydrogen  3.360  N/A