Finding intermodel H-bonds
Finding intramodel H-bonds
Constraints relaxed by 0.4 angstroms and 20 degrees
Models used:
	#0 2pug_A.cif

H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist):
THR 1.A OG1    ASP 4.A OD2    no hydrogen  2.869  N/A
VAL 5.A N      THR 1.A O      no hydrogen  3.075  N/A
VAL 5.A N      ILE 2.A O      no hydrogen  2.875  N/A
ALA 6.A N      ILE 2.A O      no hydrogen  2.922  N/A
LYS 7.A N      LYS 3.A O      no hydrogen  3.211  N/A
ARG 8.A N      ASP 4.A O      no hydrogen  3.372  N/A
ALA 9.A N      VAL 5.A O      no hydrogen  2.953  N/A
ASN 10.A N     LYS 7.A O      no hydrogen  2.988  N/A
ASN 10.A ND2   LYS 7.A O      no hydrogen  3.468  N/A
VAL 11.A N     ALA 6.A O      no hydrogen  2.890  N/A
THR 15.A N     SER 12.A OG    no hydrogen  2.978  N/A
VAL 16.A N     SER 12.A O     no hydrogen  2.911  N/A
SER 17.A N     THR 13.A O     no hydrogen  2.682  N/A
HIS 18.A N     THR 14.A O     no hydrogen  2.849  N/A
VAL 19.A N     THR 15.A O     no hydrogen  3.000  N/A
ILE 20.A N     VAL 16.A O     no hydrogen  3.057  N/A
ASN 21.A N     SER 17.A O     no hydrogen  2.877  N/A
ASN 21.A ND2   SER 17.A O     no hydrogen  2.677  N/A
LYS 22.A N     VAL 19.A O     no hydrogen  3.402  N/A
THR 23.A N     HIS 18.A O     no hydrogen  3.050  N/A
ARG 31.A N     ALA 27.A O     no hydrogen  2.673  N/A
ARG 31.A NH2   VAL 26.A O     no hydrogen  3.048  N/A
ASN 32.A N     GLU 28.A O     no hydrogen  2.644  N/A
ALA 33.A N     GLU 29.A O     no hydrogen  3.103  N/A
VAL 34.A N     THR 30.A O     no hydrogen  2.990  N/A
TRP 35.A N     ARG 31.A O     no hydrogen  3.025  N/A
ALA 36.A N     ASN 32.A O     no hydrogen  2.686  N/A
ALA 37.A N     ALA 33.A O     no hydrogen  2.824  N/A
ILE 38.A N     VAL 34.A O     no hydrogen  2.659  N/A
LYS 39.A N     TRP 35.A O     no hydrogen  2.771  N/A
LYS 39.A N     ALA 36.A O     no hydrogen  3.028  N/A
GLU 40.A N     ALA 36.A O     no hydrogen  3.104  N/A
LEU 41.A N     ALA 37.A O     no hydrogen  2.903  N/A
HIS 42.A N     LYS 39.A O     no hydrogen  2.671  N/A
TYR 43.A N     ILE 38.A O     no hydrogen  2.767  N/A
ARG 50.A N     SER 46.A O     no hydrogen  3.185  N/A
SER 51.A N     ALA 47.A O     no hydrogen  2.620  N/A
SER 51.A OG    ALA 47.A O     no hydrogen  2.713  N/A
SER 51.A OG    HIS 56.A O     no hydrogen  3.532  N/A
LEU 52.A N     VAL 48.A O     no hydrogen  2.845  N/A
LYS 53.A N     ALA 49.A O     no hydrogen  3.182  N/A
LYS 53.A N     ARG 50.A O     no hydrogen  2.848  N/A
VAL 54.A N     ARG 50.A O     no hydrogen  2.908  N/A
ASN 55.A N     SER 51.A O     no hydrogen  2.801  N/A
THR 57.A N     ASP 115.A OD1  no hydrogen  2.684  N/A
THR 57.A OG1   SER 59.A OG    no hydrogen  3.014  N/A
THR 57.A OG1   ARG 113.A O    no hydrogen  2.723  N/A
THR 57.A OG1   ASP 115.A OD1  no hydrogen  2.927  N/A
LYS 58.A N     ASP 115.A OD2  no hydrogen  2.585  N/A
SER 59.A OG    THR 57.A OG1   no hydrogen  3.014  N/A
ILE 60.A N     THR 89.A O     no hydrogen  2.671  N/A
GLY 61.A N     GLY 116.A O    no hydrogen  3.172  N/A
LEU 62.A N     ILE 91.A O     no hydrogen  2.740  N/A
LEU 63.A N     LEU 118.A O    no hydrogen  2.865  N/A
ALA 64.A N     GLY 93.A O     no hydrogen  2.677  N/A
THR 65.A OG1   MET 120.A O    no hydrogen  2.836  N/A
THR 65.A OG1   SER 122.A OG   no hydrogen  2.823  N/A
SER 67.A OG    ASN 94.A OD1   no hydrogen  3.027  N/A
TYR 71.A OH    GLN 290.A OE1  no hydrogen  2.798  N/A
ALA 73.A N     ALA 69.A O     no hydrogen  2.759  N/A
GLU 74.A N     ALA 70.A O     no hydrogen  3.040  N/A
ILE 75.A N     TYR 71.A O     no hydrogen  3.291  N/A
ILE 76.A N     PHE 72.A O     no hydrogen  2.841  N/A
GLU 77.A N     ALA 73.A O     no hydrogen  2.893  N/A
ALA 78.A N     GLU 74.A O     no hydrogen  3.043  N/A
VAL 79.A N     ILE 75.A O     no hydrogen  2.985  N/A
GLU 80.A N     ILE 76.A O     no hydrogen  2.863  N/A
LYS 81.A N     GLU 77.A O     no hydrogen  3.015  N/A
ASN 82.A N     ALA 78.A O     no hydrogen  3.212  N/A
ASN 82.A ND2   ALA 78.A O     no hydrogen  3.100  N/A
CYS 83.A N     VAL 79.A O     no hydrogen  2.976  N/A
CYS 83.A SG    VAL 79.A O     no hydrogen  3.689  N/A
PHE 84.A N     GLU 80.A O     no hydrogen  3.041  N/A
GLN 85.A N     LYS 81.A O     no hydrogen  3.148  N/A
LYS 86.A N     ASN 82.A O     no hydrogen  3.144  N/A
LYS 86.A N     CYS 83.A O     no hydrogen  3.094  N/A
GLY 87.A N     PHE 84.A O     no hydrogen  3.184  N/A
TYR 88.A N     CYS 83.A O     no hydrogen  2.758  N/A
THR 89.A N     LYS 58.A O     no hydrogen  3.099  N/A
ILE 91.A N     ILE 60.A O     no hydrogen  2.845  N/A
GLY 93.A N     LEU 62.A O     no hydrogen  2.816  N/A
ALA 95.A N     ALA 64.A O     no hydrogen  2.938  N/A
TRP 96.A N     THR 65.A O     no hydrogen  2.993  N/A
ASN 97.A ND2   CYS 121.A O    no hydrogen  3.081  N/A
ASN 98.A N     ALA 95.A O     no hydrogen  2.693  N/A
GLN 102.A N    ASN 98.A O     no hydrogen  2.672  N/A
ARG 103.A N    LEU 99.A O     no hydrogen  2.655  N/A
ARG 103.A NE   GLU 100.A OE1  no hydrogen  3.072  N/A
ALA 104.A N    GLU 100.A O    no hydrogen  2.820  N/A
TYR 105.A N    LYS 101.A O    no hydrogen  3.125  N/A
LEU 106.A N    GLN 102.A O    no hydrogen  2.731  N/A
SER 107.A N    ARG 103.A O    no hydrogen  3.037  N/A
SER 107.A OG   ALA 104.A O    no hydrogen  3.174  N/A
SER 107.A OG   GLN 111.A OE1  no hydrogen  3.480  N/A
MET 108.A N    ALA 104.A O    no hydrogen  2.761  N/A
MET 109.A N    TYR 105.A O    no hydrogen  2.699  N/A
ALA 110.A N    LEU 106.A O    no hydrogen  2.940  N/A
GLN 111.A N    SER 107.A O    no hydrogen  2.947  N/A
LYS 112.A N    MET 108.A O    no hydrogen  2.755  N/A
ARG 113.A N    ALA 110.A O    no hydrogen  2.676  N/A
ARG 113.A NH1  ALA 110.A O    no hydrogen  3.460  N/A
VAL 114.A N    MET 109.A O    no hydrogen  3.386  N/A
ASP 115.A N    SER 59.A O     no hydrogen  2.946  N/A
LEU 117.A N    PRO 139.A O    no hydrogen  2.747  N/A
LEU 118.A N    GLY 61.A O     no hydrogen  2.770  N/A
VAL 119.A N    VAL 141.A O    no hydrogen  2.798  N/A
MET 120.A N    LEU 63.A O     no hydrogen  3.026  N/A
CYS 121.A N    TYR 124.A OH   no hydrogen  2.759  N/A
CYS 121.A SG   LEU 63.A O     no hydrogen  3.921  N/A
SER 122.A N    ASP 144.A OD2  no hydrogen  2.895  N/A
SER 122.A OG   THR 65.A OG1   no hydrogen  2.823  N/A
TYR 124.A OH   ASP 144.A OD1  no hydrogen  2.750  N/A
TYR 124.A OH   ASP 144.A OD2  no hydrogen  3.317  N/A
LEU 129.A N    PRO 125.A O    no hydrogen  2.765  N/A
ALA 130.A N    GLU 126.A O    no hydrogen  2.736  N/A
MET 131.A N    PRO 127.A O    no hydrogen  3.149  N/A
LEU 132.A N    LEU 128.A O    no hydrogen  3.175  N/A
GLU 133.A N    LEU 129.A O    no hydrogen  3.346  N/A
GLU 134.A N    ALA 130.A O    no hydrogen  3.158  N/A
TYR 135.A N    LEU 132.A O    no hydrogen  2.925  N/A
ARG 136.A N    GLU 133.A O    no hydrogen  2.708  N/A
ARG 136.A NH2  ASP 151.A OD2  no hydrogen  3.514  N/A
ILE 138.A N    TYR 135.A O    no hydrogen  2.796  N/A
VAL 141.A N    LEU 117.A O    no hydrogen  2.844  N/A
VAL 142.A N    ASP 154.A O    no hydrogen  3.082  N/A
MET 143.A N    VAL 119.A O    no hydrogen  2.989  N/A
LYS 149.A NZ   GLU 147.A OE2  no hydrogen  3.172  N/A
ASP 154.A N    MET 140.A O    no hydrogen  3.345  N/A
ALA 155.A N    GLN 315.A O    no hydrogen  2.881  N/A
VAL 156.A N    VAL 142.A O    no hydrogen  3.468  N/A
ILE 157.A N    ILE 317.A O    no hydrogen  2.675  N/A
ASN 159.A ND2  GLU 318.A OE1  no hydrogen  3.434  N/A
ASN 159.A ND2  VAL 319.A O    no hydrogen  2.650  N/A
ALA 160.A N    ASP 158.A OD1  no hydrogen  3.048  N/A
GLY 163.A N    ASN 159.A O    no hydrogen  3.147  N/A
GLY 164.A N    ALA 160.A O    no hydrogen  2.878  N/A
TYR 165.A N    PHE 161.A O    no hydrogen  3.062  N/A
TYR 165.A OH   GLU 204.A OE1  no hydrogen  2.615  N/A
TYR 165.A OH   GLU 204.A OE2  no hydrogen  2.822  N/A
MET 166.A N    GLU 162.A O    no hydrogen  3.058  N/A
ALA 167.A N    GLY 163.A O    no hydrogen  3.056  N/A
GLY 168.A N    GLY 164.A O    no hydrogen  3.172  N/A
ARG 169.A N    TYR 165.A O    no hydrogen  3.085  N/A
ARG 169.A NE   GLU 173.A OE2  no hydrogen  3.195  N/A
ARG 169.A NH2  GLU 173.A OE2  no hydrogen  2.942  N/A
TYR 170.A N    MET 166.A O    no hydrogen  2.973  N/A
TYR 170.A OH   GLU 325.A OE2  no hydrogen  2.872  N/A
LEU 171.A N    ALA 167.A O    no hydrogen  3.129  N/A
ILE 172.A N    GLY 168.A O    no hydrogen  2.845  N/A
GLU 173.A N    ARG 169.A O    no hydrogen  2.776  N/A
ARG 174.A N    LEU 171.A O    no hydrogen  3.126  N/A
ARG 174.A NE   TYR 170.A OH   no hydrogen  3.245  N/A
ARG 174.A NH1  ASP 331.A OD1  no hydrogen  2.993  N/A
ARG 174.A NH2  TYR 170.A OH   no hydrogen  3.353  N/A
GLY 175.A N    ILE 172.A O    no hydrogen  3.075  N/A
HIS 176.A N    LEU 171.A O    no hydrogen  3.188  N/A
HIS 176.A ND1  THR 239.A OG1  no hydrogen  2.658  N/A
HIS 176.A NE2  ALA 330.A O    no hydrogen  2.678  N/A
ARG 177.A NH2  ALA 205.A O    no hydrogen  2.694  N/A
GLY 180.A N    ALA 240.A O    no hydrogen  2.856  N/A
VAL 181.A N    TRP 213.A O    no hydrogen  2.916  N/A
ILE 182.A N    PHE 242.A O    no hydrogen  3.055  N/A
GLN 188.A N    PRO 185.A O    no hydrogen  3.150  N/A
ASN 189.A ND2  ASP 158.A OD1  no hydrogen  3.006  N/A
ALA 192.A N    GLN 188.A O    no hydrogen  2.973  N/A
GLY 193.A N    ASN 189.A O    no hydrogen  2.729  N/A
ARG 194.A N    GLY 191.A O    no hydrogen  3.178  N/A
ARG 194.A NH1  GLY 244.A O    no hydrogen  2.803  N/A
ARG 194.A NH1  ASP 273.A OD1  no hydrogen  2.847  N/A
ARG 194.A NH2  ASP 273.A OD1  no hydrogen  2.664  N/A
LEU 195.A N    GLY 191.A O    no hydrogen  3.243  N/A
ALA 196.A N    ALA 192.A O    no hydrogen  2.953  N/A
GLY 197.A N    GLY 193.A O    no hydrogen  3.353  N/A
PHE 198.A N    ARG 194.A O    no hydrogen  3.102  N/A
MET 199.A N    LEU 195.A O    no hydrogen  2.762  N/A
LYS 200.A N    ALA 196.A O    no hydrogen  2.925  N/A
ALA 201.A N    GLY 197.A O    no hydrogen  3.511  N/A
MET 202.A N    PHE 198.A O    no hydrogen  3.206  N/A
GLU 203.A N    MET 199.A O    no hydrogen  3.005  N/A
GLU 204.A N    LYS 200.A O    no hydrogen  2.722  N/A
ALA 205.A N    MET 202.A O    no hydrogen  2.738  N/A
MET 206.A N    GLU 203.A O    no hydrogen  3.028  N/A
ILE 207.A N    MET 202.A O    no hydrogen  2.968  N/A
SER 212.A OG   GLN 234.A OE1  no hydrogen  3.467  N/A
TRP 213.A N    PRO 210.A O    no hydrogen  2.668  N/A
TRP 213.A NE1  HIS 236.A O    no hydrogen  3.226  N/A
ILE 214.A N    GLU 211.A O    no hydrogen  3.181  N/A
VAL 215.A N    VAL 181.A O    no hydrogen  2.897  N/A
GLN 216.A NE2  GLY 217.A O    no hydrogen  2.672  N/A
GLY 217.A N    PRO 183.A O    no hydrogen  2.663  N/A
ASP 218.A N    SER 223.A OG   no hydrogen  3.017  N/A
GLU 220.A N    ASP 218.A OD1  no hydrogen  2.762  N/A
SER 223.A N    GLU 220.A O    no hydrogen  2.689  N/A
SER 223.A OG   ASP 218.A OD1  no hydrogen  2.831  N/A
SER 223.A OG   GLU 220.A O    no hydrogen  2.682  N/A
GLY 224.A N    GLU 220.A O    no hydrogen  3.356  N/A
TYR 225.A N    PRO 221.A O    no hydrogen  2.891  N/A
TYR 225.A OH   GLU 258.A OE1  no hydrogen  2.633  N/A
ARG 226.A N    GLU 222.A O    no hydrogen  2.958  N/A
ALA 227.A N    SER 223.A O    no hydrogen  2.968  N/A
MET 228.A N    GLY 224.A O    no hydrogen  3.003  N/A
GLN 229.A N    TYR 225.A O    no hydrogen  3.200  N/A
GLN 230.A N    ARG 226.A O    no hydrogen  2.861  N/A
ILE 231.A N    ALA 227.A O    no hydrogen  2.883  N/A
LEU 232.A N    MET 228.A O    no hydrogen  2.891  N/A
GLN 234.A NE2  SER 212.A O    no hydrogen  3.693  N/A
HIS 236.A NE2  GLU 178.A OE2  no hydrogen  2.699  N/A
ARG 237.A NE   LEU 232.A O    no hydrogen  3.193  N/A
ARG 237.A NH2  LEU 232.A O    no hydrogen  2.694  N/A
THR 239.A N    GLU 178.A O    no hydrogen  2.705  N/A
THR 239.A OG1  HIS 176.A ND1  no hydrogen  2.658  N/A
VAL 241.A N    SER 268.A O    no hydrogen  2.869  N/A
PHE 242.A N    GLY 180.A O    no hydrogen  2.916  N/A
CYS 243.A N    ILE 270.A O    no hydrogen  2.736  N/A
CYS 243.A SG   GLY 245.A O    no hydrogen  3.754  N/A
GLY 244.A N    ILE 182.A O    no hydrogen  2.749  N/A
ASP 246.A N    TYR 272.A O    no hydrogen  2.985  N/A
ALA 249.A N    GLY 245.A O    no hydrogen  2.856  N/A
MET 250.A N    ASP 246.A O    no hydrogen  2.744  N/A
GLY 251.A N    ILE 247.A O    no hydrogen  3.171  N/A
ALA 252.A N    MET 248.A O    no hydrogen  2.797  N/A
LEU 253.A N    ALA 249.A O    no hydrogen  2.751  N/A
CYS 254.A N    MET 250.A O    no hydrogen  3.180  N/A
CYS 254.A SG   GLU 258.A OE2  no hydrogen  3.506  N/A
ALA 255.A N    GLY 251.A O    no hydrogen  3.448  N/A
ALA 256.A N    ALA 252.A O    no hydrogen  3.237  N/A
ASP 257.A N    LEU 253.A O    no hydrogen  3.093  N/A
GLU 258.A N    CYS 254.A O    no hydrogen  2.826  N/A
MET 259.A N    ALA 255.A O    no hydrogen  2.810  N/A
MET 259.A N    ALA 256.A O    no hydrogen  2.832  N/A
GLY 260.A N    ASP 257.A O    no hydrogen  3.101  N/A
LEU 261.A N    ALA 256.A O    no hydrogen  2.748  N/A
ARG 262.A N    ASP 266.A OD2  no hydrogen  2.647  N/A
GLN 265.A N    GLN 265.A OE1  no hydrogen  2.772  N/A
ASP 266.A N    ARG 262.A O    no hydrogen  2.465  N/A
VAL 267.A N    ARG 262.A O    no hydrogen  2.841  N/A
SER 268.A N    THR 239.A O    no hydrogen  3.486  N/A
SER 268.A OG   ALA 330.A O    no hydrogen  3.441  N/A
LEU 269.A N    SER 328.A O    no hydrogen  2.739  N/A
ILE 270.A N    VAL 241.A O    no hydrogen  2.991  N/A
GLY 271.A N    THR 286.A O    no hydrogen  3.074  N/A
ASP 273.A N    ILE 288.A O    no hydrogen  2.701  N/A
VAL 275.A N    ASP 246.A OD2  no hydrogen  2.976  N/A
ARG 276.A N    GLU 74.A OE2   no hydrogen  2.692  N/A
ALA 278.A N    VAL 275.A O    no hydrogen  2.991  N/A
ARG 279.A NH1  ARG 279.A O    no hydrogen  2.681  N/A
TYR 280.A N    ASN 277.A O    no hydrogen  2.956  N/A
PHE 281.A N    ALA 278.A O    no hydrogen  3.122  N/A
LEU 285.A N    ALA 278.A O    no hydrogen  3.197  N/A
THR 286.A N    SER 328.A OG   no hydrogen  2.903  N/A
THR 287.A N    ILE 324.A O    no hydrogen  2.995  N/A
THR 287.A OG1  ASP 246.A OD1  no hydrogen  2.739  N/A
ILE 288.A N    GLY 271.A O    no hydrogen  3.399  N/A
HIS 289.A N    ARG 322.A O    no hydrogen  2.681  N/A
GLN 290.A N    ASP 273.A O    no hydrogen  3.193  N/A
LYS 292.A NZ   GLU 74.A OE1   no hydrogen  3.045  N/A
LYS 292.A NZ   ASN 274.A O    no hydrogen  2.866  N/A
LEU 295.A N    PRO 291.A O    no hydrogen  3.155  N/A
GLY 296.A N    LYS 292.A O    no hydrogen  2.881  N/A
GLU 297.A N    ASP 293.A O    no hydrogen  2.870  N/A
THR 298.A N    SER 294.A O    no hydrogen  2.836  N/A
ALA 299.A N    LEU 295.A O    no hydrogen  3.149  N/A
PHE 300.A N    GLY 296.A O    no hydrogen  2.953  N/A
ASN 301.A N    GLU 297.A O    no hydrogen  3.024  N/A
MET 302.A N    THR 298.A O    no hydrogen  3.316  N/A
LEU 303.A N    ALA 299.A O    no hydrogen  3.002  N/A
LEU 304.A N    PHE 300.A O    no hydrogen  2.944  N/A
ASP 305.A N    ASN 301.A O    no hydrogen  2.935  N/A
ARG 306.A N    MET 302.A O    no hydrogen  2.896  N/A
ARG 306.A NE   ASP 154.A OD1  no hydrogen  3.422  N/A
ILE 307.A N    LEU 303.A O    no hydrogen  2.817  N/A
VAL 308.A N    LEU 304.A O    no hydrogen  2.615  N/A
LYS 310.A N    ILE 307.A O    no hydrogen  3.185  N/A
ARG 311.A NE   ASP 305.A OD2  no hydrogen  2.753  N/A
ARG 311.A NH1  ASP 154.A OD1  no hydrogen  3.144  N/A
ARG 311.A NH1  ASP 154.A OD2  no hydrogen  3.128  N/A
ARG 311.A NH1  GLU 313.A O    no hydrogen  2.641  N/A
ARG 311.A NH2  ASP 154.A OD2  no hydrogen  2.668  N/A
ARG 311.A NH2  ASP 305.A OD2  no hydrogen  3.155  N/A
ILE 317.A N    ALA 155.A O    no hydrogen  2.787  N/A
VAL 319.A N    ILE 157.A O    no hydrogen  2.719  N/A
HIS 320.A ND1  GLU 162.A OE1  no hydrogen  2.727  N/A
ARG 322.A N    HIS 289.A O    no hydrogen  3.048  N/A
ILE 324.A N    THR 287.A O    no hydrogen  2.729  N/A
ARG 326.A N    THR 286.A OG1  no hydrogen  2.623  N/A
ARG 326.A NE   LEU 285.A O    no hydrogen  2.713  N/A
ARG 326.A NH2  ASN 274.A OD1  no hydrogen  2.941  N/A
ARG 326.A NH2  LEU 285.A O    no hydrogen  3.390  N/A
ARG 327.A N    ALA 284.A O    no hydrogen  2.695  N/A
SER 328.A OG   LEU 269.A O    no hydrogen  2.660  N/A
ALA 330.A N    SER 268.A OG   no hydrogen  2.687  N/A
GLY 332.A N    ARG 174.A O    no hydrogen  2.595  N/A
PHE 334.A N    GLY 175.A O    no hydrogen  2.835  N/A
ARG 335.A N    GLY 332.A O    no hydrogen  3.117  N/A
TYR 337.A N    PHE 334.A O    no hydrogen  3.031  N/A