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

H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist):
GLU 4.A N      THR 2.A OG1    no hydrogen  3.187  N/A
GLN 6.A N      THR 2.A O      no hydrogen  3.233  N/A
SER 7.A N      ARG 3.A O      no hydrogen  3.122  N/A
SER 7.A OG     ARG 3.A O      no hydrogen  2.849  N/A
LEU 8.A N      GLU 4.A O      no hydrogen  3.098  N/A
ALA 9.A N      LEU 5.A O      no hydrogen  2.839  N/A
ALA 10.A N     GLN 6.A O      no hydrogen  2.882  N/A
ALA 11.A N     LEU 8.A O      no hydrogen  3.357  N/A
GLN 17.A N     SER 15.A OG    no hydrogen  3.326  N/A
LEU 19.A N     SER 15.A O     no hydrogen  3.078  N/A
LEU 19.A N     ALA 16.A O     no hydrogen  3.131  N/A
LYS 20.A N     ALA 16.A O     no hydrogen  2.684  N/A
ASP 23.A N     LYS 20.A O     no hydrogen  3.305  N/A
PHE 26.A N     ASP 23.A O     no hydrogen  2.889  N/A
GLU 30.A N     GLU 30.A OE1   no hydrogen  2.822  N/A
LEU 31.A N     ASP 28.A O     no hydrogen  3.001  N/A
SER 32.A N     GLU 35.A OE1   no hydrogen  2.543  N/A
SER 32.A OG    GLU 35.A OE1   no hydrogen  2.943  N/A
GLU 35.A N     SER 32.A OG    no hydrogen  3.150  N/A
THR 36.A N     SER 32.A O     no hydrogen  3.106  N/A
THR 36.A N     ASP 33.A O     no hydrogen  2.906  N/A
THR 36.A OG1   ASP 33.A O     no hydrogen  2.601  N/A
ALA 37.A N     ASP 33.A O     no hydrogen  2.999  N/A
LEU 38.A N     LEU 34.A O     no hydrogen  2.974  N/A
CYS 39.A N     GLU 35.A O     no hydrogen  3.022  N/A
CYS 39.A SG    GLU 35.A O     no hydrogen  3.125  N/A
THR 40.A N     THR 36.A O     no hydrogen  2.780  N/A
THR 40.A OG1   THR 36.A O     no hydrogen  2.850  N/A
ILE 41.A N     ALA 37.A O     no hydrogen  3.014  N/A
ARG 42.A N     LEU 38.A O     no hydrogen  2.809  N/A
ARG 42.A NE    PRO 14.A O     no hydrogen  2.864  N/A
ARG 42.A NH1   ASP 46.A OD1   no hydrogen  2.779  N/A
ARG 42.A NH2   VAL 13.A O     no hydrogen  2.842  N/A
ARG 42.A NH2   PRO 14.A O     no hydrogen  3.174  N/A
MET 43.A N     CYS 39.A O     no hydrogen  3.059  N/A
MET 43.A N     THR 40.A O     no hydrogen  2.930  N/A
PHE 44.A N     THR 40.A O     no hydrogen  3.204  N/A
THR 45.A N     ILE 41.A O     no hydrogen  2.995  N/A
THR 45.A OG1   ILE 41.A O     no hydrogen  2.787  N/A
ASP 46.A N     ARG 42.A O     no hydrogen  2.936  N/A
LEU 47.A N     MET 43.A O     no hydrogen  3.188  N/A
ASN 48.A N     THR 45.A O     no hydrogen  3.174  N/A
LEU 49.A N     PHE 44.A O     no hydrogen  2.978  N/A
ASN 52.A N     ASN 48.A O     no hydrogen  3.051  N/A
GLN 54.A N     GLN 51.A O     no hydrogen  3.210  N/A
MET 55.A N     VAL 50.A O     no hydrogen  3.279  N/A
VAL 59.A N     LYS 56.A O     no hydrogen  2.767  N/A
LEU 60.A N     LYS 56.A O     no hydrogen  2.957  N/A
CYS 61.A N     HIS 57.A O     no hydrogen  3.002  N/A
CYS 61.A SG    HIS 57.A O     no hydrogen  3.239  N/A
ARG 62.A N     GLU 58.A O     no hydrogen  2.982  N/A
TRP 63.A N     VAL 59.A O     no hydrogen  2.809  N/A
ILE 64.A N     LEU 60.A O     no hydrogen  2.937  N/A
LEU 65.A N     CYS 61.A O     no hydrogen  2.878  N/A
SER 66.A N     ARG 62.A O     no hydrogen  2.934  N/A
SER 66.A OG    ARG 62.A O     no hydrogen  3.092  N/A
VAL 67.A N     TRP 63.A O     no hydrogen  2.922  N/A
LYS 68.A N     ILE 64.A O     no hydrogen  2.944  N/A
LYS 68.A NZ    GLU 4.A OE2    no hydrogen  3.145  N/A
LYS 69.A N     LEU 65.A O     no hydrogen  2.894  N/A
ASN 70.A N     SER 66.A O     no hydrogen  3.092  N/A
ASN 70.A N     VAL 67.A O     no hydrogen  2.995  N/A
ASN 70.A ND2   SER 66.A O     no hydrogen  3.054  N/A
TYR 71.A N     LYS 68.A O     no hydrogen  3.207  N/A
TYR 71.A OH    LEU 116.A O    no hydrogen  2.610  N/A
ARG 72.A NE    ASP 121.A OD1  no hydrogen  3.073  N/A
VAL 75.A N     ARG 72.A O     no hydrogen  3.349  N/A
TYR 77.A N     GLU 242.A OE2  no hydrogen  2.987  N/A
HIS 78.A N     GLU 242.A OE2  no hydrogen  2.848  N/A
HIS 78.A ND1   GLU 242.A OE1  no hydrogen  2.824  N/A
ASN 79.A ND2   VAL 75.A O     no hydrogen  2.615  N/A
ASN 79.A ND2   ALA 76.A O     no hydrogen  2.921  N/A
TRP 80.A NE1   THR 36.A OG1   no hydrogen  2.876  N/A
ARG 81.A N     ASN 79.A OD1   no hydrogen  3.036  N/A
ARG 81.A NH1   ASP 28.A OD2   no hydrogen  3.099  N/A
ARG 81.A NH1   LEU 31.A O     no hydrogen  3.105  N/A
ARG 81.A NH2   LEU 31.A O     no hydrogen  2.817  N/A
ARG 81.A NH2   ASP 33.A OD1   no hydrogen  3.135  N/A
HIS 82.A N     ASN 79.A O     no hydrogen  2.836  N/A
ALA 83.A N     ASN 79.A O     no hydrogen  3.129  N/A
PHE 84.A N     TRP 80.A O     no hydrogen  2.693  N/A
ASN 85.A N     ARG 81.A O     no hydrogen  2.911  N/A
ASN 85.A ND2   ASP 28.A OD1   no hydrogen  2.768  N/A
ASN 85.A ND2   ARG 81.A O     no hydrogen  2.936  N/A
THR 86.A N     HIS 82.A O     no hydrogen  2.892  N/A
THR 86.A OG1   HIS 82.A O     no hydrogen  2.677  N/A
ALA 87.A N     ALA 83.A O     no hydrogen  3.095  N/A
GLN 88.A N     PHE 84.A O     no hydrogen  2.969  N/A
GLN 88.A NE2   ILE 21.A O     no hydrogen  3.068  N/A
GLN 88.A NE2   ASP 23.A O     no hydrogen  3.321  N/A
CYS 89.A N     ASN 85.A O     no hydrogen  2.810  N/A
MET 90.A N     THR 86.A O     no hydrogen  2.936  N/A
PHE 91.A N     ALA 87.A O     no hydrogen  2.767  N/A
ALA 92.A N     GLN 88.A O     no hydrogen  2.867  N/A
ALA 93.A N     CYS 89.A O     no hydrogen  2.958  N/A
LEU 94.A N     MET 90.A O     no hydrogen  2.858  N/A
LEU 94.A N     PHE 91.A O     no hydrogen  2.898  N/A
LYS 95.A N     PHE 91.A O     no hydrogen  2.838  N/A
LYS 95.A NZ    ASP 46.A O     no hydrogen  2.713  N/A
LYS 95.A NZ    GLN 100.A OE1  no hydrogen  3.359  N/A
GLY 97.A N     ALA 92.A O     no hydrogen  2.719  N/A
LYS 98.A N     LYS 95.A O     no hydrogen  2.957  N/A
ILE 99.A N     LEU 94.A O     no hydrogen  3.078  N/A
GLN 100.A N    LEU 94.A O     no hydrogen  3.010  N/A
LYS 102.A N    ILE 99.A O     no hydrogen  2.869  N/A
LEU 103.A N    GLN 100.A O    no hydrogen  3.264  N/A
THR 104.A N    GLU 107.A OE1  no hydrogen  2.653  N/A
GLU 107.A N    THR 104.A OG1  no hydrogen  3.153  N/A
ILE 108.A N    THR 104.A O    no hydrogen  3.046  N/A
LEU 109.A N    ASP 105.A O    no hydrogen  2.881  N/A
ALA 110.A N    LEU 106.A O    no hydrogen  3.010  N/A
LEU 111.A N    GLU 107.A O    no hydrogen  2.749  N/A
LEU 112.A N    ILE 108.A O    no hydrogen  2.893  N/A
ILE 113.A N    LEU 109.A O    no hydrogen  3.125  N/A
ALA 114.A N    ALA 110.A O    no hydrogen  2.788  N/A
ALA 115.A N    LEU 111.A O    no hydrogen  2.756  N/A
LEU 116.A N    LEU 112.A O    no hydrogen  3.041  N/A
SER 117.A N    ILE 113.A O    no hydrogen  2.886  N/A
SER 117.A N    ALA 114.A O    no hydrogen  3.049  N/A
SER 117.A OG   ILE 113.A O    no hydrogen  2.738  N/A
HIS 118.A ND1  ALA 115.A O    no hydrogen  2.738  N/A
ASP 119.A N    TYR 71.A OH    no hydrogen  3.365  N/A
LEU 120.A N    SER 117.A O    no hydrogen  2.875  N/A
HIS 122.A N    ASP 119.A O    no hydrogen  3.132  N/A
VAL 125.A N    GLU 242.A OE1  no hydrogen  2.958  N/A
ASN 126.A ND2  PHE 243.A O    no hydrogen  2.717  N/A
ASN 126.A ND2  GLN 246.A O    no hydrogen  3.041  N/A
SER 136.A OG   ASP 181.A OD2  no hydrogen  2.849  N/A
HIS 140.A N    SER 136.A O    no hydrogen  3.005  N/A
HIS 141.A N    ILE 137.A O    no hydrogen  3.257  N/A
HIS 142.A N    MET 138.A O    no hydrogen  2.899  N/A
HIS 142.A ND1  LEU 120.A O    no hydrogen  2.680  N/A
PHE 143.A N    GLU 139.A O    no hydrogen  2.991  N/A
ASP 144.A N    HIS 140.A O    no hydrogen  3.012  N/A
GLN 145.A N    HIS 141.A O    no hydrogen  3.000  N/A
GLN 145.A NE2  ASN 70.A OD1   no hydrogen  3.203  N/A
CYS 146.A N    HIS 142.A O    no hydrogen  2.863  N/A
LEU 147.A N    PHE 143.A O    no hydrogen  2.877  N/A
MET 148.A N    ASP 144.A O    no hydrogen  2.770  N/A
ILE 149.A N    GLN 145.A O    no hydrogen  3.071  N/A
LEU 150.A N    CYS 146.A O    no hydrogen  2.853  N/A
ASN 151.A N    LEU 147.A O    no hydrogen  2.871  N/A
ASN 151.A N    MET 148.A O    no hydrogen  2.976  N/A
SER 152.A N    ILE 149.A O    no hydrogen  3.058  N/A
SER 152.A OG   MET 148.A O    no hydrogen  3.021  N/A
ASN 155.A N    SER 152.A O    no hydrogen  3.035  N/A
GLN 156.A NE2  ASN 151.A O    no hydrogen  3.381  N/A
GLN 156.A NE2  SER 152.A O    no hydrogen  3.479  N/A
ILE 157.A N    ASN 155.A O    no hydrogen  2.886  N/A
SER 159.A N    GLN 156.A O    no hydrogen  2.942  N/A
SER 159.A OG   GLN 156.A O    no hydrogen  3.496  N/A
LEU 161.A N    LEU 158.A O    no hydrogen  2.850  N/A
SER 162.A N    GLU 165.A OE1  no hydrogen  3.170  N/A
GLU 165.A N    SER 162.A OG   no hydrogen  3.182  N/A
TYR 166.A N    SER 162.A O    no hydrogen  2.829  N/A
LYS 167.A N    ILE 163.A O    no hydrogen  2.767  N/A
THR 168.A N    GLU 164.A O    no hydrogen  3.069  N/A
THR 168.A OG1  GLU 164.A O    no hydrogen  2.974  N/A
THR 169.A N    GLU 165.A O    no hydrogen  2.819  N/A
THR 169.A OG1  GLU 165.A O    no hydrogen  2.975  N/A
LEU 170.A N    TYR 166.A O    no hydrogen  2.988  N/A
LYS 171.A N    LYS 167.A O    no hydrogen  3.067  N/A
ILE 172.A N    THR 168.A O    no hydrogen  3.055  N/A
ILE 173.A N    THR 169.A O    no hydrogen  2.794  N/A
LYS 174.A N    LEU 170.A O    no hydrogen  2.910  N/A
GLN 175.A N    LYS 171.A O    no hydrogen  2.989  N/A
ALA 176.A N    ILE 172.A O    no hydrogen  2.826  N/A
ILE 177.A N    ILE 173.A O    no hydrogen  2.920  N/A
LEU 178.A N    LYS 174.A O    no hydrogen  3.050  N/A
ALA 179.A N    GLN 175.A O    no hydrogen  2.858  N/A
ALA 179.A N    ALA 176.A O    no hydrogen  2.952  N/A
THR 180.A N    ILE 177.A O    no hydrogen  3.271  N/A
THR 180.A OG1  ILE 177.A O    no hydrogen  2.723  N/A
ASP 181.A N    LEU 178.A O    no hydrogen  3.200  N/A
ALA 183.A N    ASP 181.A OD1  no hydrogen  3.106  N/A
TYR 185.A N    ASP 181.A O    no hydrogen  3.097  N/A
TYR 185.A OH   ILE 262.A O    no hydrogen  3.079  N/A
ILE 186.A N    LEU 182.A O    no hydrogen  2.924  N/A
LYS 187.A N    ALA 183.A O    no hydrogen  3.140  N/A
ARG 188.A N    LEU 184.A O    no hydrogen  3.081  N/A
ARG 189.A NH1  ALA 261.A O    no hydrogen  2.830  N/A
ARG 189.A NH2  ALA 261.A O    no hydrogen  3.489  N/A
PHE 193.A N    ARG 189.A O    no hydrogen  2.786  N/A
GLU 194.A N    GLY 190.A O    no hydrogen  2.860  N/A
LEU 195.A N    GLU 191.A O    no hydrogen  3.130  N/A
ILE 196.A N    PHE 192.A O    no hydrogen  3.330  N/A
ARG 197.A N    PHE 193.A O    no hydrogen  3.032  N/A
LYS 198.A N    GLU 194.A O    no hydrogen  2.956  N/A
ASN 199.A N    ILE 196.A O    no hydrogen  3.002  N/A
ASN 202.A N    GLN 208.A OE1  no hydrogen  2.677  N/A
GLU 204.A N    ASN 202.A OD1  no hydrogen  3.216  N/A
ASP 205.A N    ASN 202.A O    no hydrogen  3.286  N/A
HIS 207.A N    ASP 205.A OD1  no hydrogen  3.296  N/A
LYS 209.A N    ASP 205.A O    no hydrogen  2.837  N/A
LYS 209.A NZ   GLU 107.A OE1  no hydrogen  3.270  N/A
LYS 209.A NZ   GLU 107.A OE2  no hydrogen  2.834  N/A
GLU 210.A N    PRO 206.A O    no hydrogen  3.108  N/A
LEU 211.A N    HIS 207.A O    no hydrogen  3.295  N/A
PHE 212.A N    GLN 208.A O    no hydrogen  2.877  N/A
LEU 213.A N    LYS 209.A O    no hydrogen  2.990  N/A
ALA 214.A N    GLU 210.A O    no hydrogen  3.198  N/A
MET 215.A N    LEU 211.A O    no hydrogen  2.913  N/A
LEU 216.A N    PHE 212.A O    no hydrogen  2.634  N/A
MET 217.A N    LEU 213.A O    no hydrogen  2.947  N/A
THR 218.A N    ALA 214.A O    no hydrogen  3.218  N/A
THR 218.A OG1  ALA 214.A O    no hydrogen  3.437  N/A
ALA 219.A N    MET 215.A O    no hydrogen  2.920  N/A
CYS 220.A N    LEU 216.A O    no hydrogen  3.191  N/A
CYS 220.A SG   LEU 216.A O    no hydrogen  3.433  N/A
ASP 221.A N    MET 217.A O    no hydrogen  3.079  N/A
LEU 222.A N    THR 218.A O    no hydrogen  2.938  N/A
SER 223.A N    CYS 220.A O    no hydrogen  3.100  N/A
SER 223.A OG   CYS 220.A O    no hydrogen  2.608  N/A
ILE 225.A N    LEU 222.A O    no hydrogen  3.037  N/A
THR 226.A N    SER 223.A O    no hydrogen  2.759  N/A
THR 226.A OG1  SER 223.A O    no hydrogen  2.520  N/A
LYS 227.A N    ALA 224.A O    no hydrogen  3.192  N/A
LYS 227.A NZ   PHE 24.A O     no hydrogen  2.972  N/A
LYS 227.A NZ   PHE 26.A O     no hydrogen  2.603  N/A
ILE 231.A N    PRO 228.A O    no hydrogen  2.749  N/A
GLN 232.A N    PRO 228.A O    no hydrogen  2.866  N/A
GLN 233.A N    TRP 229.A O    no hydrogen  2.772  N/A
ILE 235.A N    ILE 231.A O    no hydrogen  2.946  N/A
ALA 236.A N    GLN 232.A O    no hydrogen  2.865  N/A
GLU 237.A N    GLN 233.A O    no hydrogen  3.050  N/A
LEU 238.A N    ARG 234.A O    no hydrogen  3.018  N/A
VAL 239.A N    ILE 235.A O    no hydrogen  2.821  N/A
ALA 240.A N    ALA 236.A O    no hydrogen  2.938  N/A
THR 241.A N    GLU 237.A O    no hydrogen  3.108  N/A
THR 241.A OG1  GLU 237.A O    no hydrogen  3.127  N/A
GLU 242.A N    LEU 238.A O    no hydrogen  3.173  N/A
PHE 243.A N    VAL 239.A O    no hydrogen  2.924  N/A
PHE 244.A N    ALA 240.A O    no hydrogen  3.021  N/A
ASP 245.A N    THR 241.A O    no hydrogen  3.022  N/A
MET 254.A N    LYS 250.A O    no hydrogen  3.166  N/A
GLN 255.A N    ILE 251.A O    no hydrogen  2.967  N/A
VAL 256.A N    PRO 252.A O    no hydrogen  3.202  N/A
GLY 257.A N    SER 253.A O    no hydrogen  2.967  N/A
PHE 258.A N    MET 254.A O    no hydrogen  2.765  N/A
ILE 259.A N    GLN 255.A O    no hydrogen  2.897  N/A
ASP 260.A N    VAL 256.A O    no hydrogen  2.882  N/A
ALA 261.A N    GLY 257.A O    no hydrogen  2.868  N/A
ILE 262.A N    PHE 258.A O    no hydrogen  3.010  N/A
CYS 263.A SG   PHE 258.A O    no hydrogen  3.724  N/A
LEU 264.A N    ILE 259.A O    no hydrogen  2.995  N/A
TYR 267.A N    CYS 263.A O    no hydrogen  3.030  N/A
TYR 267.A OH   ALA 219.A O    no hydrogen  2.632  N/A
GLU 268.A N    LEU 264.A O    no hydrogen  2.884  N/A
ALA 269.A N    GLN 265.A O    no hydrogen  2.809  N/A
LEU 270.A N    LEU 266.A O    no hydrogen  2.819  N/A
THR 271.A N    TYR 267.A O    no hydrogen  3.070  N/A
THR 271.A N    GLU 268.A O    no hydrogen  2.851  N/A
THR 271.A OG1  TYR 267.A O    no hydrogen  2.975  N/A
HIS 272.A N    GLU 268.A O    no hydrogen  3.076  N/A
HIS 272.A N    ALA 269.A O    no hydrogen  2.853  N/A
VAL 273.A N    ALA 269.A O    no hydrogen  3.141  N/A
SER 274.A N    LEU 270.A O    no hydrogen  2.937  N/A
SER 274.A OG   GLY 97.A O     no hydrogen  2.566  N/A
CYS 277.A N    SER 274.A O    no hydrogen  3.100  N/A
CYS 277.A SG   GLY 97.A O     no hydrogen  3.897  N/A
LEU 280.A N    CYS 277.A O    no hydrogen  2.990  N/A
ASP 282.A N    PHE 278.A O    no hydrogen  2.778  N/A
GLY 283.A N    PRO 279.A O    no hydrogen  3.187  N/A
CYS 284.A N    LEU 280.A O    no hydrogen  3.015  N/A
ARG 285.A N    LEU 281.A O    no hydrogen  2.950  N/A
ARG 285.A NH2  GLU 268.A OE1  no hydrogen  3.526  N/A
LYS 286.A N    ASP 282.A O    no hydrogen  2.961  N/A
LYS 286.A NZ   ASP 282.A OD2  no hydrogen  3.282  N/A
ASN 287.A N    GLY 283.A O    no hydrogen  3.019  N/A
ASN 287.A ND2  ILE 225.A O    no hydrogen  2.745  N/A
ASN 287.A ND2  LYS 227.A O    no hydrogen  2.750  N/A
ARG 288.A N    CYS 284.A O    no hydrogen  3.103  N/A
ARG 288.A N    ARG 285.A O    no hydrogen  2.886  N/A
ARG 288.A NE   ASP 260.A OD1  no hydrogen  2.961  N/A
ARG 288.A NH1  ASP 260.A OD2  no hydrogen  3.182  N/A
GLN 289.A N    ARG 285.A O    no hydrogen  3.046  N/A
LYS 290.A N    LYS 286.A O    no hydrogen  3.035  N/A
TRP 291.A N    ASN 287.A O    no hydrogen  3.040  N/A
GLN 292.A N    ARG 288.A O    no hydrogen  2.914  N/A
GLN 292.A NE2  GLU 296.A OE2  no hydrogen  2.753  N/A
ALA 293.A N    GLN 289.A O    no hydrogen  3.083  N/A
LEU 294.A N    LYS 290.A O    no hydrogen  3.313  N/A
ALA 295.A N    TRP 291.A O    no hydrogen  2.864  N/A
GLU 296.A N    GLN 292.A O    no hydrogen  2.975  N/A
GLU 296.A N    ALA 293.A O    no hydrogen  3.254  N/A
GLN 297.A N    ALA 293.A O    no hydrogen  3.132  N/A