Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4whq_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A ND2 GLN 3.A OE1 no hydrogen 3.477 N/A ARG 7.A N ARG 231.A O no hydrogen 2.780 N/A ARG 7.A NE GLU 236.A OE2 no hydrogen 2.940 N/A ARG 7.A NH1 ASP 4.A OD1 no hydrogen 2.748 N/A ARG 7.A NH1 ASP 4.A OD2 no hydrogen 3.357 N/A ARG 7.A NH1 SER 6.A O no hydrogen 2.799 N/A ARG 7.A NH2 ASP 4.A OD2 no hydrogen 3.012 N/A ARG 7.A NH2 GLU 236.A OE1 no hydrogen 2.972 N/A PHE 8.A N GLN 41.A OE1 no hydrogen 2.881 N/A VAL 9.A N GLY 229.A O no hydrogen 2.855 N/A ARG 11.A NH2 LYS 173.A O no hydrogen 3.170 N/A ASN 14.A N ASP 12.A OD1 no hydrogen 2.956 N/A TRP 15.A N ASP 12.A O no hydrogen 3.022 N/A HIS 16.A N ASP 12.A O no hydrogen 3.225 N/A LYS 18.A NZ ASN 14.A OD1 no hydrogen 2.434 N/A THR 21.A N SER 27.A OG no hydrogen 3.094 N/A THR 21.A OG1 THR 21.A O no hydrogen 2.741 N/A THR 21.A OG1 SER 27.A OG no hydrogen 3.276 N/A TYR 24.A N THR 21.A O no hydrogen 2.890 N/A LYS 25.A N ASN 151.A OD1 no hydrogen 2.959 N/A LYS 25.A NZ ASN 151.A O no hydrogen 2.883 N/A SER 27.A N TYR 24.A O no hydrogen 2.995 N/A SER 27.A OG THR 21.A O no hydrogen 2.927 N/A SER 27.A OG THR 21.A OG1 no hydrogen 3.276 N/A SER 27.A OG TYR 24.A O no hydrogen 2.926 N/A ILE 28.A N LYS 25.A O no hydrogen 3.067 N/A ARG 30.A N SER 27.A O no hydrogen 3.363 N/A SER 31.A OG SER 27.A O no hydrogen 2.787 N/A SER 31.A OG ILE 28.A O no hydrogen 3.211 N/A ARG 33.A NH1 SER 31.A OG no hydrogen 2.759 N/A ARG 33.A NH1 PRO 32.A O no hydrogen 3.483 N/A ARG 33.A NH2 ILE 28.A O no hydrogen 2.968 N/A GLN 41.A NE2 PHE 8.A O no hydrogen 2.891 N/A SER 42.A N GLU 45.A OE1 no hydrogen 2.874 N/A SER 42.A OG GLU 45.A OE1 no hydrogen 2.771 N/A SER 44.A N SER 42.A OG no hydrogen 2.978 N/A GLU 45.A N SER 42.A O no hydrogen 2.893 N/A THR 46.A N SER 42.A O no hydrogen 3.073 N/A THR 46.A OG1 ASP 4.A OD1 no hydrogen 2.646 N/A THR 46.A OG1 SER 42.A O no hydrogen 3.253 N/A THR 47.A OG1 ILE 43.A O no hydrogen 2.752 N/A SER 52.A N ASN 50.A OD1 no hydrogen 2.912 N/A SER 52.A OG ASN 50.A OD1 no hydrogen 2.616 N/A LEU 54.A N PHE 51.A O no hydrogen 2.995 N/A GLY 57.A N ASP 60.A OD2 no hydrogen 2.905 N/A ASP 60.A N GLY 57.A O no hydrogen 3.133 N/A ASP 62.A N HIS 59.A O no hydrogen 2.865 N/A LEU 63.A N ARG 140.A O no hydrogen 2.742 N/A LEU 64.A N ASP 62.A OD1 no hydrogen 3.101 N/A LEU 65.A N ASP 62.A O no hydrogen 3.083 N/A ASN 66.A N ASP 62.A O no hydrogen 2.898 N/A ASN 66.A ND2 HIS 59.A O no hydrogen 3.398 N/A ASN 66.A ND2 ASP 60.A O no hydrogen 3.679 N/A ASN 66.A ND2 VAL 126.A O no hydrogen 2.964 N/A ASN 69.A ND2 PHE 67.A O no hydrogen 3.321 N/A ASN 69.A ND2 PRO 121.A O no hydrogen 2.975 N/A ILE 74.A N ASP 120.A OD2 no hydrogen 2.842 N/A ARG 77.A NE ASP 217.A O no hydrogen 3.156 N/A ARG 77.A NE ASP 217.A OD1 no hydrogen 3.203 N/A ARG 77.A NH2 ASP 217.A OD1 no hydrogen 2.790 N/A ILE 78.A N THR 141.A O no hydrogen 2.935 N/A ILE 79.A N LEU 219.A O no hydrogen 2.869 N/A VAL 80.A N PHE 139.A O no hydrogen 2.858 N/A ALA 81.A N TYR 221.A O no hydrogen 3.112 N/A GLY 82.A N TYR 137.A O no hydrogen 3.216 N/A ARG 83.A N ASP 224.A OD1 no hydrogen 2.839 N/A ARG 83.A NE ASP 134.A O no hydrogen 2.806 N/A ARG 83.A NH2 ASP 134.A O no hydrogen 3.022 N/A VAL 84.A N GLY 135.A O no hydrogen 2.751 N/A VAL 85.A N ILE 225.A O no hydrogen 2.989 N/A ASP 86.A N LYS 90.A O no hydrogen 2.824 N/A TYR 88.A N ASP 86.A OD1 no hydrogen 2.960 N/A GLY 89.A N ASP 86.A O no hydrogen 2.840 N/A LYS 90.A N ASP 86.A OD1 no hydrogen 3.077 N/A VAL 92.A N VAL 84.A O no hydrogen 2.890 N/A ASN 94.A N THR 131.A O no hydrogen 3.041 N/A THR 95.A N THR 131.A OG1 no hydrogen 2.892 N/A THR 95.A OG1 SER 166.A OG no hydrogen 3.296 N/A LEU 96.A N SER 166.A OG no hydrogen 3.089 N/A VAL 97.A N CYS 129.A O no hydrogen 2.956 N/A GLU 98.A N GLY 164.A O no hydrogen 2.853 N/A MET 99.A N GLY 127.A O no hydrogen 2.929 N/A TRP 100.A N HIS 162.A O no hydrogen 3.005 N/A GLN 101.A N GLY 125.A O no hydrogen 2.929 N/A GLN 101.A NE2 ALA 102.A O no hydrogen 2.944 N/A GLN 101.A NE2 ILE 142.A O no hydrogen 2.900 N/A ASN 103.A N ARG 107.A O no hydrogen 2.943 N/A ASN 103.A ND2 PRO 118.A O no hydrogen 3.039 N/A GLY 105.A N ASN 103.A OD1 no hydrogen 2.904 N/A GLY 106.A N ASN 103.A O no hydrogen 2.985 N/A ARG 107.A N ASN 103.A OD1 no hydrogen 3.132 N/A ARG 107.A NH1 ALA 117.A O no hydrogen 2.737 N/A TYR 108.A N ASP 113.A OD2 no hydrogen 2.782 N/A TYR 108.A OH TYR 147.A OH.A no hydrogen 2.753 N/A TYR 108.A OH HIS 162.A NE2 no hydrogen 3.151 N/A ARG 109.A NE PHE 123.A O no hydrogen 2.951 N/A ARG 109.A NH2 ASP 120.A O no hydrogen 2.829 N/A ARG 109.A NH2 PHE 123.A O no hydrogen 3.477 N/A ASN 112.A N HIS 110.A ND1 no hydrogen 3.016 N/A ASP 113.A N HIS 110.A O no hydrogen 3.049 N/A ARG 114.A NH2 ASN 112.A O no hydrogen 3.551 N/A TYR 115.A N ASP 113.A OD1 no hydrogen 2.973 N/A ASN 122.A N ASP 120.A OD1 no hydrogen 3.024 N/A PHE 123.A N ASP 120.A O no hydrogen 3.086 N/A GLY 127.A N MET 99.A O no hydrogen 2.992 N/A ARG 128.A N ASP 60.A O no hydrogen 2.981 N/A ARG 128.A NE ASP 60.A OD2 no hydrogen 2.938 N/A ARG 128.A NH1 ASP 60.A OD2 no hydrogen 3.071 N/A CYS 129.A N VAL 97.A O no hydrogen 2.913 N/A CYS 129.A SG LEU 130.A O no hydrogen 3.996 N/A THR 131.A N THR 95.A O no hydrogen 2.866 N/A THR 131.A OG1 VAL 92.A O no hydrogen 2.740 N/A ASP 132.A N TYR 136.A O no hydrogen 2.873 N/A ASP 134.A N ASP 132.A OD1 no hydrogen 2.876 N/A GLY 135.A N ASP 132.A O no hydrogen 3.038 N/A TYR 136.A N ASP 132.A OD1 no hydrogen 2.956 N/A TYR 137.A N GLY 82.A O no hydrogen 2.900 N/A TYR 137.A OH PHE 223.A O no hydrogen 2.602 N/A PHE 139.A N VAL 80.A O no hydrogen 2.797 N/A ARG 140.A N HIS 61.A O no hydrogen 3.011 N/A ARG 140.A NE ASP 62.A OD1 no hydrogen 3.058 N/A ARG 140.A NH1 ASP 62.A OD1 no hydrogen 3.499 N/A ARG 140.A NH1 ASP 62.A OD2 no hydrogen 2.824 N/A THR 141.A N ILE 78.A O no hydrogen 2.845 N/A THR 141.A OG1 GLN 101.A OE1 no hydrogen 2.654 N/A THR 141.A OG1 ILE 142.A O no hydrogen 3.420 N/A ILE 142.A N THR 141.A OG1 no hydrogen 2.647 N/A LYS 143.A N GLU 76.A O no hydrogen 2.900 N/A GLY 145.A N ASN 103.A O no hydrogen 2.988 N/A TYR 147.A N.A ARG 157.A O no hydrogen 3.305 N/A TYR 147.A N.B ARG 157.A O no hydrogen 3.183 N/A TYR 147.A OH.A TYR 108.A OH no hydrogen 2.753 N/A TYR 147.A OH.B ASP 113.A OD1 no hydrogen 2.638 N/A TRP 149.A N ASP 155.A O no hydrogen 3.102 N/A ASN 151.A N TRP 149.A O no hydrogen 2.930 N/A ASN 151.A ND2 ASP 23.A O no hydrogen 2.840 N/A ASN 151.A ND2 ASP 155.A OD2 no hydrogen 2.904 N/A GLY 152.A N ASP 155.A OD2 no hydrogen 2.785 N/A TRP 156.A NE1 ASN 154.A OD1 no hydrogen 2.904 N/A ARG 157.A N TYR 147.A O.A no hydrogen 2.770 N/A ARG 157.A N TYR 147.A O.B no hydrogen 2.823 N/A ARG 157.A NH1 GLN 177.A OE1 no hydrogen 2.873 N/A ARG 157.A NH2 GLN 177.A OE1 no hydrogen 3.186 N/A ARG 157.A NH2 TYR 179.A OH no hydrogen 2.879 N/A ALA 159.A N ASP 183.A OD2 no hydrogen 3.238 N/A HIS 160.A ND1 PRO 158.A O no hydrogen 2.745 N/A HIS 160.A NE2 HIS 162.A NE2 no hydrogen 3.059 N/A ILE 161.A N LEU 178.A O no hydrogen 2.980 N/A HIS 162.A N TRP 100.A O no hydrogen 2.843 N/A HIS 162.A NE2 TYR 108.A OH no hydrogen 3.151 N/A PHE 163.A N THR 176.A O no hydrogen 2.911 N/A GLY 164.A N GLU 98.A O no hydrogen 2.786 N/A ILE 165.A N LEU 174.A O no hydrogen 2.885 N/A SER 166.A N LEU 96.A O no hydrogen 3.009 N/A SER 166.A OG THR 95.A OG1 no hydrogen 3.296 N/A SER 169.A N THR 172.A OG1 no hydrogen 3.139 N/A ILE 170.A N THR 47.A O no hydrogen 2.959 N/A ALA 171.A N GLU 45.A O no hydrogen 3.295 N/A THR 172.A N SER 169.A O no hydrogen 2.999 N/A THR 172.A OG1 SER 166.A O no hydrogen 3.034 N/A THR 172.A OG1 SER 169.A O no hydrogen 2.805 N/A LEU 174.A N ILE 165.A O no hydrogen 2.996 N/A THR 176.A N PHE 163.A O no hydrogen 2.952 N/A GLN 177.A N THR 176.A OG1 no hydrogen 2.764 N/A LEU 178.A N ILE 161.A O no hydrogen 2.750 N/A TYR 179.A N LEU 204.A O no hydrogen 2.836 N/A TYR 179.A OH GLN 177.A OE1 no hydrogen 3.192 N/A GLU 181.A N ALA 206.A O no hydrogen 2.967 N/A ASP 183.A N PHE 180.A O no hydrogen 3.089 N/A LEU 185.A N ASP 183.A OD1 no hydrogen 2.936 N/A ILE 186.A N ASP 183.A O no hydrogen 3.173 N/A MET 188.A N LEU 185.A O no hydrogen 3.061 N/A CYS 189.A N ILE 186.A O no hydrogen 3.357 N/A LYS 193.A N CYS 189.A O no hydrogen 2.929 N/A LYS 193.A NZ PRO 187.A O no hydrogen 3.037 N/A SER 194.A N ILE 191.A O no hydrogen 3.162 N/A SER 194.A OG ILE 191.A O no hydrogen 2.677 N/A ILE 195.A N VAL 192.A O no hydrogen 3.120 N/A ASN 197.A ND2 GLU 199.A OE1 no hydrogen 3.245 N/A ALA 200.A N ASN 197.A O no hydrogen 2.827 N/A VAL 201.A N ASN 197.A O no hydrogen 3.336 N/A GLN 202.A N PRO 198.A O no hydrogen 3.139 N/A GLN 203.A N ALA 200.A O no hydrogen 3.017 N/A LEU 204.A N VAL 201.A O no hydrogen 2.903 N/A ILE 205.A N GLN 202.A O no hydrogen 3.221 N/A ALA 206.A N TYR 179.A O no hydrogen 2.792 N/A LYS 207.A N ARG 222.A O no hydrogen 3.065 N/A LEU 208.A N GLU 181.A OE2 no hydrogen 2.832 N/A ASP 209.A N ALA 220.A O no hydrogen 2.787 N/A ASN 211.A ND2 ASP 209.A OD1 no hydrogen 3.010 N/A ASN 212.A N ASP 209.A O no hydrogen 3.055 N/A ALA 213.A N MET 210.A O no hydrogen 3.207 N/A ASN 214.A N CYS 218.A O no hydrogen 2.933 N/A CYS 218.A N ASN 214.A O no hydrogen 3.005 N/A CYS 218.A SG LEU 219.A O no hydrogen 3.812 N/A LEU 219.A N ARG 77.A O no hydrogen 3.009 N/A TYR 221.A N ILE 79.A O no hydrogen 2.767 N/A ARG 222.A N LYS 207.A O no hydrogen 2.820 N/A ARG 222.A NE ASP 209.A OD2 no hydrogen 2.775 N/A ARG 222.A NH1 ASP 209.A OD2 no hydrogen 3.089 N/A PHE 223.A N ALA 81.A O no hydrogen 2.869 N/A ILE 225.A N ARG 83.A O no hydrogen 2.899 N/A LEU 227.A N VAL 85.A O no hydrogen 2.828 N/A ARG 228.A NE VAL 9.A O no hydrogen 2.803 N/A ARG 228.A NH1 ALA 171.A O no hydrogen 2.982 N/A ARG 228.A NH2 PHE 8.A O no hydrogen 3.398 N/A ARG 228.A NH2 VAL 9.A O no hydrogen 3.088 N/A GLY 229.A N GLN 87.A OE1 no hydrogen 2.965 N/A GLN 230.A N ASP 86.A OD2 no hydrogen 3.066 N/A GLN 230.A NE2 SER 6.A OG no hydrogen 2.812 N/A ARG 231.A N ARG 7.A O no hydrogen 2.904 N/A ARG 231.A NH1 LYS 232.A O no hydrogen 2.932 N/A HIS 234.A ND1 HIS 234.A O no hydrogen 2.804 N/A CYS 238.A SG GLU 236.A O no hydrogen 3.956 N/A