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

H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist):
ALA 1.A N      SER 4.A OG     no hydrogen  3.292  N/A
SER 4.A N      ALA 1.A O      no hydrogen  2.875  N/A
SER 4.A OG     ALA 1.A O      no hydrogen  2.635  N/A
ALA 5.A N      ALA 1.A O      no hydrogen  3.089  N/A
GLN 6.A N      LEU 2.A O      no hydrogen  2.793  N/A
GLU 7.A N      GLU 3.A O      no hydrogen  2.922  N/A
SER 8.A N      SER 4.A O      no hydrogen  2.902  N/A
SER 8.A OG     SER 4.A O      no hydrogen  3.102  N/A
HIS 9.A N      ALA 5.A O      no hydrogen  2.932  N/A
HIS 9.A ND1    GLN 14.A O     no hydrogen  3.118  N/A
ALA 10.A N     GLN 6.A O      no hydrogen  2.762  N/A
LEU 11.A N     GLU 7.A O      no hydrogen  2.962  N/A
HIS 12.A N     SER 8.A O      no hydrogen  2.836  N/A
HIS 13.A N     HIS 9.A O      no hydrogen  2.541  N/A
ALA 17.A N     ASN 15.A OD1   no hydrogen  2.818  N/A
LEU 19.A N     ASN 15.A O     no hydrogen  2.873  N/A
ARG 20.A N     ALA 16.A O     no hydrogen  3.000  N/A
ARG 20.A NE    ILE 25.A O     no hydrogen  3.154  N/A
PHE 21.A N     ALA 17.A O     no hydrogen  3.199  N/A
GLN 22.A N     ALA 18.A O     no hydrogen  2.819  N/A
PHE 23.A N     LEU 19.A O     no hydrogen  2.818  N/A
ILE 25.A N     ARG 20.A O     no hydrogen  3.179  N/A
THR 26.A N     GLN 29.A OE1   no hydrogen  2.885  N/A
ARG 27.A NE    GLU 28.A OE2   no hydrogen  3.104  N/A
GLN 29.A N     THR 26.A OG1   no hydrogen  3.089  N/A
ALA 30.A N     THR 26.A O     no hydrogen  2.969  N/A
ARG 31.A N     ARG 27.A O     no hydrogen  2.735  N/A
ARG 31.A NH1   GLU 28.A OE2   no hydrogen  2.916  N/A
GLU 32.A N     GLU 28.A O     no hydrogen  3.002  N/A
ILE 33.A N     GLN 29.A O     no hydrogen  3.094  N/A
VAL 34.A N     ALA 30.A O     no hydrogen  3.052  N/A
LYS 35.A N     ARG 31.A O     no hydrogen  2.747  N/A
LYS 35.A NZ    GLU 32.A OE2   no hydrogen  2.848  N/A
LEU 36.A N     GLU 32.A O     no hydrogen  2.975  N/A
CYS 37.A N     VAL 34.A O     no hydrogen  3.061  N/A
CYS 40.A N     CYS 37.A O     no hydrogen  3.009  N/A
CYS 40.A SG    HIS 9.A NE2    no hydrogen  3.809  N/A
CYS 40.A SG    HIS 13.A ND1   no hydrogen  3.478  N/A
GLN 45.A NE2   GLY 47.A O     no hydrogen  2.681  N/A
ASN 49.A ND2   GLN 149.A O    no hydrogen  2.843  N/A
ASN 49.A ND2   GLY 150.A O    no hydrogen  3.505  N/A
ARG 51.A NH1   HIS 84.A NE2   no hydrogen  2.980  N/A
GLY 52.A N     THR 81.A OG1   no hydrogen  2.948  N/A
ARG 56.A N     ASP 80.A OD1   no hydrogen  2.817  N/A
ARG 56.A NE    MET 110.A O    no hydrogen  3.226  N/A
ARG 56.A NH2   MET 110.A O    no hydrogen  3.168  N/A
TRP 59.A N     LYS 115.A O    no hydrogen  3.025  N/A
TRP 59.A NE1   ASP 80.A OD1   no hydrogen  2.945  N/A
GLN 60.A N     VAL 79.A O     no hydrogen  2.936  N/A
MET 61.A N     LYS 117.A O    no hydrogen  2.842  N/A
ASP 62.A N     VAL 77.A O     no hydrogen  3.098  N/A
VAL 63.A N     ASP 62.A OD1   no hydrogen  2.656  N/A
THR 64.A N     VAL 75.A O     no hydrogen  3.024  N/A
HIS 65.A N     THR 64.A OG1   no hydrogen  2.634  N/A
VAL 66.A N     LYS 73.A O     no hydrogen  2.987  N/A
SER 67.A N     HIS 65.A O     no hydrogen  2.837  N/A
PHE 69.A N     VAL 66.A O     no hydrogen  3.142  N/A
GLY 70.A N     SER 67.A O     no hydrogen  3.035  N/A
LEU 72.A N     PHE 69.A O     no hydrogen  3.168  N/A
LYS 73.A N     GLY 70.A O     no hydrogen  3.017  N/A
TYR 74.A N     LYS 71.A O     no hydrogen  3.525  N/A
VAL 75.A N     LYS 73.A O     no hydrogen  2.696  N/A
HIS 76.A N     THR 89.A O     no hydrogen  2.896  N/A
HIS 76.A NE2   GLY 93.A O     no hydrogen  2.969  N/A
VAL 77.A N     ASP 62.A O     no hydrogen  2.804  N/A
THR 78.A N     PHE 87.A O     no hydrogen  2.839  N/A
THR 78.A OG1   HIS 102.A NE2  no hydrogen  2.757  N/A
VAL 79.A N     GLN 60.A O     no hydrogen  2.897  N/A
ASP 80.A N     PHE 85.A O     no hydrogen  2.877  N/A
THR 81.A N     LEU 58.A O     no hydrogen  3.030  N/A
THR 81.A OG1   LEU 58.A O     no hydrogen  2.531  N/A
SER 83.A N     ASP 80.A OD2   no hydrogen  2.969  N/A
SER 83.A OG    ASP 80.A OD2   no hydrogen  2.806  N/A
HIS 84.A N     ASP 80.A O     no hydrogen  2.684  N/A
PHE 85.A N     ASP 80.A O     no hydrogen  3.343  N/A
THR 86.A N     ASN 189.A OD1  no hydrogen  3.032  N/A
THR 86.A OG1   ASN 189.A OD1  no hydrogen  3.442  N/A
PHE 87.A N     THR 78.A O     no hydrogen  2.892  N/A
THR 89.A N     HIS 76.A O     no hydrogen  2.766  N/A
THR 89.A OG1   HIS 102.A ND1  no hydrogen  2.818  N/A
THR 89.A OG1   GLN 105.A OE1  no hydrogen  2.646  N/A
ARG 91.A N     TYR 74.A O     no hydrogen  2.940  N/A
ARG 91.A NE    ASP 98.A OD1   no hydrogen  2.913  N/A
ARG 91.A NH2   ASP 98.A OD1   no hydrogen  2.897  N/A
ALA 95.A N     ASP 98.A OD2   no hydrogen  2.933  N/A
ASP 98.A N     ALA 95.A O     no hydrogen  2.769  N/A
VAL 99.A N     ALA 95.A O     no hydrogen  3.033  N/A
LEU 100.A N    THR 96.A O     no hydrogen  2.841  N/A
GLN 101.A N    LYS 97.A O     no hydrogen  2.849  N/A
GLN 101.A NE2  GLN 101.A O    no hydrogen  3.474  N/A
HIS 102.A N    ASP 98.A O     no hydrogen  3.151  N/A
HIS 102.A ND1  THR 89.A OG1   no hydrogen  2.818  N/A
HIS 102.A NE2  THR 78.A OG1   no hydrogen  2.757  N/A
LEU 103.A N    VAL 99.A O     no hydrogen  2.852  N/A
ALA 104.A N    LEU 100.A O    no hydrogen  2.794  N/A
GLN 105.A N    GLN 101.A O    no hydrogen  3.023  N/A
SER 106.A N    HIS 102.A O    no hydrogen  2.755  N/A
SER 106.A OG   LEU 103.A O    no hydrogen  2.598  N/A
PHE 107.A N    LEU 103.A O    no hydrogen  2.759  N/A
PHE 107.A N    ALA 104.A O    no hydrogen  3.177  N/A
ALA 108.A N    ALA 104.A O    no hydrogen  3.181  N/A
TYR 109.A N    GLN 105.A O    no hydrogen  2.735  N/A
MET 110.A N    SER 106.A O    no hydrogen  2.727  N/A
GLY 111.A N    SER 106.A O    no hydrogen  3.144  N/A
GLN 114.A N    VAL 57.A O     no hydrogen  2.881  N/A
LYS 115.A N    VAL 57.A O     no hydrogen  2.869  N/A
ILE 116.A N    SER 139.A O    no hydrogen  2.800  N/A
LYS 117.A N    TRP 59.A O     no hydrogen  2.818  N/A
LYS 117.A NZ   GLY 150.A O    no hydrogen  3.297  N/A
THR 118.A N    VAL 141.A O    no hydrogen  2.850  N/A
THR 118.A OG1  ASP 119.A O    no hydrogen  2.753  N/A
THR 118.A OG1  HIS 140.A NE2  no hydrogen  2.691  N/A
ASN 120.A ND2  GLY 143.A O    no hydrogen  3.000  N/A
ALA 121.A N    ASP 119.A OD1  no hydrogen  2.797  N/A
TYR 124.A N    ALA 121.A O    no hydrogen  2.893  N/A
VAL 125.A N    ALA 121.A O    no hydrogen  3.097  N/A
SER 126.A N    PRO 122.A O    no hydrogen  3.007  N/A
SER 126.A OG   SER 128.A OG   no hydrogen  2.884  N/A
ARG 127.A NH1  GLU 131.A OE1  no hydrogen  2.800  N/A
ARG 127.A NH2  GLU 131.A OE1  no hydrogen  3.412  N/A
SER 128.A N    SER 126.A OG   no hydrogen  3.163  N/A
SER 128.A OG   SER 126.A OG   no hydrogen  2.884  N/A
ILE 129.A N    SER 126.A O    no hydrogen  2.855  N/A
GLN 130.A N    SER 126.A O    no hydrogen  3.143  N/A
GLN 130.A NE2  TYR 124.A O    no hydrogen  3.058  N/A
GLN 130.A NE2  HIS 140.A ND1  no hydrogen  2.954  N/A
GLU 131.A N    ARG 127.A O    no hydrogen  2.706  N/A
PHE 132.A N    SER 128.A O    no hydrogen  3.153  N/A
LEU 133.A N    ILE 129.A O    no hydrogen  2.900  N/A
ALA 134.A N    GLN 130.A O    no hydrogen  2.905  N/A
ARG 135.A N    GLU 131.A O    no hydrogen  2.924  N/A
ARG 135.A NE   GLU 131.A OE2  no hydrogen  3.068  N/A
ARG 135.A NH2  GLU 131.A OE2  no hydrogen  2.834  N/A
TRP 136.A N    PHE 132.A O    no hydrogen  2.930  N/A
LYS 137.A NZ   ALA 134.A O    no hydrogen  2.748  N/A
LYS 137.A NZ   ARG 135.A O    no hydrogen  3.456  N/A
ILE 138.A N    LEU 133.A O    no hydrogen  3.001  N/A
SER 139.A N    GLN 114.A O    no hydrogen  3.152  N/A
HIS 140.A NE2  THR 118.A OG1  no hydrogen  2.691  N/A
VAL 141.A N    ILE 116.A O    no hydrogen  3.062  N/A
THR 142.A OG1  ASN 120.A OD1  no hydrogen  2.686  N/A
ASN 147.A N    ILE 144.A O    no hydrogen  3.146  N/A
GLN 149.A N    ASN 147.A OD1  no hydrogen  2.837  N/A
GLY 150.A N    ASN 147.A O    no hydrogen  3.080  N/A
GLN 151.A N    PRO 148.A O    no hydrogen  2.986  N/A
ALA 152.A N    GLN 149.A O    no hydrogen  3.026  N/A
VAL 154.A N    GLN 60.A OE1   no hydrogen  2.935  N/A
GLU 155.A N    GLN 151.A O    no hydrogen  2.875  N/A
ARG 156.A N    ALA 152.A O    no hydrogen  2.989  N/A
ARG 156.A NH1  ARG 156.A O    no hydrogen  3.288  N/A
ARG 156.A NH1  ASN 160.A OD1  no hydrogen  2.785  N/A
THR 157.A N    ILE 153.A O    no hydrogen  2.949  N/A
THR 157.A OG1  ILE 153.A O    no hydrogen  2.738  N/A
HIS 158.A N    VAL 154.A O    no hydrogen  2.707  N/A
GLN 159.A N    GLU 155.A O    no hydrogen  3.141  N/A
ASN 160.A N    ARG 156.A O    no hydrogen  3.219  N/A
ILE 161.A N    THR 157.A O    no hydrogen  2.792  N/A
LYS 162.A N    HIS 158.A O    no hydrogen  2.868  N/A
ALA 163.A N    GLN 159.A O    no hydrogen  3.006  N/A
GLN 164.A N    ASN 160.A O    no hydrogen  2.896  N/A
LEU 165.A N    ILE 161.A O    no hydrogen  2.817  N/A
ASN 166.A N    LYS 162.A O    no hydrogen  2.925  N/A
LYS 167.A N    ALA 163.A O    no hydrogen  2.989  N/A
LEU 168.A N    GLN 164.A O    no hydrogen  2.963  N/A
GLN 169.A N    LEU 165.A O    no hydrogen  2.802  N/A
LYS 170.A N    ASN 166.A O    no hydrogen  3.021  N/A
ALA 171.A N    LYS 167.A O    no hydrogen  2.988  N/A
GLY 172.A N    GLN 169.A O    no hydrogen  3.143  N/A
TYR 174.A OH   LEU 168.A O    no hydrogen  2.795  N/A
TYR 174.A OH   HIS 183.A ND1  no hydrogen  3.268  N/A
TYR 175.A N    HIS 179.A ND1  no hydrogen  2.938  N/A
HIS 178.A NE2  ALA 90.A O     no hydrogen  3.080  N/A
HIS 179.A N    THR 176.A OG1  no hydrogen  2.695  N/A
LEU 180.A N    THR 176.A O    no hydrogen  3.200  N/A
LEU 181.A N    PRO 177.A O    no hydrogen  2.944  N/A
ALA 182.A N    HIS 178.A O    no hydrogen  2.768  N/A
HIS 183.A N    HIS 179.A O    no hydrogen  3.025  N/A
HIS 183.A ND1  TYR 174.A OH   no hydrogen  3.268  N/A
ALA 184.A N    LEU 180.A O    no hydrogen  2.955  N/A
LEU 185.A N    LEU 181.A O    no hydrogen  2.839  N/A
PHE 186.A N    ALA 182.A O    no hydrogen  2.878  N/A
VAL 187.A N    HIS 183.A O    no hydrogen  3.025  N/A
LEU 188.A N    ALA 184.A O    no hydrogen  2.808  N/A
ASN 189.A N    LEU 185.A O    no hydrogen  3.086  N/A
ASN 189.A ND2  THR 86.A O     no hydrogen  2.691  N/A
ASN 189.A ND2  TYR 109.A OH   no hydrogen  2.936  N/A
HIS 190.A N    PHE 186.A O    no hydrogen  2.826  N/A
VAL 191.A N    VAL 187.A O    no hydrogen  2.979  N/A
ASN 192.A N    VAL 187.A O    no hydrogen  2.813  N/A
ASP 194.A N    HIS 198.A O    no hydrogen  2.890  N/A
GLN 196.A N    ASP 194.A OD1  no hydrogen  2.731  N/A
GLN 196.A NE2  ASN 195.A OD1  no hydrogen  2.936  N/A
GLY 197.A N    ASP 194.A O    no hydrogen  3.145  N/A
HIS 198.A N    ASP 194.A OD1  no hydrogen  2.880  N/A
HIS 198.A ND1  GLU 202.A OE2  no hydrogen  2.792  N/A
THR 199.A N    GLU 202.A OE1  no hydrogen  2.962  N/A
THR 199.A OG1  ASN 189.A O    no hydrogen  3.527  N/A
ALA 201.A N    ASN 189.A O    no hydrogen  2.993  N/A
GLU 202.A N    THR 199.A OG1  no hydrogen  3.050  N/A
ARG 203.A N    THR 199.A O    no hydrogen  2.825  N/A
ARG 203.A NE   SER 83.A O     no hydrogen  2.851  N/A
ARG 203.A NH1  ASP 194.A OD2  no hydrogen  2.847  N/A
ARG 203.A NH2  SER 83.A O     no hydrogen  2.800  N/A
HIS 204.A N    ALA 200.A O    no hydrogen  2.832  N/A
HIS 204.A NE2  MET 110.A O    no hydrogen  2.874  N/A
TRP 205.A N    ALA 201.A O    no hydrogen  3.010  N/A
VAL 216.A N    ASP 230.A O    no hydrogen  2.827  N/A
MET 217.A N    ARG 259.A O    no hydrogen  2.809  N/A
TRP 218.A N    LYS 227.A O    no hydrogen  2.903  N/A
LYS 219.A N    PHE 257.A O    no hydrogen  3.224  N/A
ASP 220.A N    SER 225.A O    no hydrogen  2.874  N/A
LEU 222.A N    ASP 220.A OD1  no hydrogen  2.865  N/A
THR 223.A N    ASP 220.A O    no hydrogen  3.011  N/A
THR 223.A OG1  ASP 220.A O    no hydrogen  2.991  N/A
THR 223.A OG1  SER 225.A OG   no hydrogen  2.760  N/A
GLY 224.A N    ASP 220.A O    no hydrogen  2.699  N/A
SER 225.A N    ASP 220.A O    no hydrogen  3.342  N/A
SER 225.A OG   THR 223.A OG1  no hydrogen  2.760  N/A
LYS 227.A N    TRP 218.A O    no hydrogen  2.755  N/A
LYS 227.A NZ   ASP 220.A OD2  no hydrogen  2.936  N/A
ASP 230.A N    VAL 216.A O    no hydrogen  2.971  N/A
VAL 231.A N    ASP 230.A OD1  no hydrogen  2.704  N/A
LEU 232.A N    PRO 214.A O    no hydrogen  3.158  N/A
ILE 233.A N    CYS 241.A O    no hydrogen  2.681  N/A
THR 234.A N    CYS 241.A O    no hydrogen  3.093  N/A
THR 234.A OG1  ALA 235.A O    no hydrogen  3.488  N/A
ALA 235.A N    THR 234.A OG1  no hydrogen  2.569  N/A
GLY 236.A N    TYR 239.A O    no hydrogen  2.898  N/A
GLY 238.A N    ASP 255.A OD2  no hydrogen  3.164  N/A
TYR 239.A N    GLY 236.A O    no hydrogen  3.090  N/A
ALA 240.A N    VAL 253.A O    no hydrogen  2.838  N/A
CYS 241.A N    THR 234.A O    no hydrogen  2.930  N/A
CYS 241.A SG   ILE 251.A O    no hydrogen  3.585  N/A
VAL 242.A N    ILE 251.A O    no hydrogen  3.039  N/A
ALA 247.A N    PRO 244.A O    no hydrogen  3.039  N/A
ILE 251.A N    VAL 242.A O    no hydrogen  2.774  N/A
VAL 253.A N    ALA 240.A O    no hydrogen  3.077  N/A
ASP 255.A N    GLY 238.A O    no hydrogen  3.074  N/A
ARG 256.A NE   GLN 45.A O     no hydrogen  2.774  N/A
ARG 256.A NH2  GLN 45.A O     no hydrogen  2.821  N/A
PHE 257.A N    PRO 254.A O    no hydrogen  3.225  N/A
ILE 258.A N    ASP 255.A O    no hydrogen  3.291  N/A
ARG 259.A N    MET 217.A O    no hydrogen  3.018  N/A
ARG 259.A NH1  ARG 256.A O    no hydrogen  2.802  N/A
ARG 259.A NH1  ILE 258.A O    no hydrogen  2.882  N/A
ARG 259.A NH2  ARG 256.A O    no hydrogen  3.432  N/A
PHE 261.A N    MET 215.A O    no hydrogen  3.019  N/A