Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nwu_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N SER 24.A O no hydrogen 2.973 N/A VAL 4.A N LYS 22.A O no hydrogen 2.942 N/A GLN 5.A N GLN 120.A OE1 no hydrogen 3.064 N/A GLN 5.A NE2 TYR 94.A O no hydrogen 2.776 N/A GLN 5.A NE2 THR 122.A OG1 no hydrogen 3.008 N/A SER 6.A N SER 20.A O no hydrogen 3.271 N/A GLU 9.A N LEU 123.A O no hydrogen 3.189 N/A LYS 11.A N THR 125.A O no hydrogen 2.799 N/A LYS 11.A NZ SER 16.A O no hydrogen 3.058 N/A GLY 14.A N LEU 86C.A O no hydrogen 2.712 N/A SER 15.A N LYS 12.A O no hydrogen 3.039 N/A SER 15.A OG LYS 12.A O no hydrogen 2.642 N/A VAL 17.A N LEU 83.A O no hydrogen 2.954 N/A VAL 19.A N MET 81.A O.A no hydrogen 2.897 N/A VAL 19.A N MET 81.A O.B no hydrogen 2.745 N/A SER 20.A N SER 6.A OG no hydrogen 3.130 N/A CYS 21.A N ALA 79.A O no hydrogen 2.855 N/A LYS 22.A N VAL 4.A O no hydrogen 2.953 N/A ALA 23.A N SER 77.A O no hydrogen 2.796 N/A SER 24.A N GLN 2.A O no hydrogen 2.926 N/A ILE 34.A N ILE 51.A O no hydrogen 2.946 N/A SER 35.A N ALA 97.A O no hydrogen 2.699 N/A TRP 36.A N GLY 49.A O no hydrogen 2.928 N/A VAL 37.A N TYR 95.A O no hydrogen 2.884 N/A ARG 38.A N GLU 46.A O no hydrogen 2.941 N/A ARG 38.A NE GLU 46.A OE2 no hydrogen 2.921 N/A ARG 38.A NH1 ASP 90.A OD1 no hydrogen 2.910 N/A ARG 38.A NH1 TYR 94.A OH no hydrogen 2.942 N/A ARG 38.A NH2 GLU 46.A OE2 no hydrogen 2.947 N/A GLN 39.A N VAL 93.A O no hydrogen 2.831 N/A GLN 39.A NE2 GLN 43.A O.A no hydrogen 2.944 N/A GLN 43.A N.A ALA 40.A O.A no hydrogen 2.766 N/A GLN 43.A N.B ALA 40.A O.B no hydrogen 3.085 N/A GLU 46.A N ARG 38.A O no hydrogen 2.879 N/A MET 48.A N.A TRP 36.A O no hydrogen 2.823 N/A MET 48.A N.B TRP 36.A O no hydrogen 2.757 N/A GLY 50.A N ASN 59.A O no hydrogen 2.947 N/A ILE 51.A N ILE 34.A O no hydrogen 2.853 N/A ILE 52.A N THR 57.A O no hydrogen 3.247 N/A PHE 55.A N ILE 52.A O no hydrogen 2.927 N/A GLY 56.A N ILE 52.A O no hydrogen 2.953 N/A ASN 59.A N GLY 50.A O no hydrogen 3.049 N/A ASN 59.A ND2 TYR 112H.A OH no hydrogen 2.973 N/A ALA 61.A N MET 48.A O.A no hydrogen 2.758 N/A ALA 61.A N MET 48.A O.B no hydrogen 3.108 N/A LYS 63.A NZ GLU 46.A OE1 no hydrogen 2.620 N/A PHE 64.A N ALA 61.A O no hydrogen 3.006 N/A GLN 65.A N.A ALA 61.A O no hydrogen 3.167 N/A GLN 65.A N.A GLN 62.A O no hydrogen 3.260 N/A GLN 65.A N.B ALA 61.A O no hydrogen 3.154 N/A GLN 65.A N.B GLN 62.A O no hydrogen 3.264 N/A GLN 65.A NE2.B TYR 60.A O no hydrogen 2.831 N/A ARG 67.A N PHE 64.A O no hydrogen 2.899 N/A ARG 67.A NH1 ASP 90.A OD2 no hydrogen 2.774 N/A ARG 67.A NH1 SER 84A.A O no hydrogen 3.010 N/A ARG 67.A NH2 ASP 90.A OD1 no hydrogen 2.941 N/A ARG 67.A NH2 ASP 90.A OD2 no hydrogen 3.414 N/A THR 69.A N GLU 82.A O no hydrogen 2.966 N/A ILE 70.A N TYR 60.A OH no hydrogen 2.901 N/A THR 71.A N TYR 80.A O no hydrogen 3.073 N/A ASP 73.A N THR 78.A O no hydrogen 2.811 N/A SER 75.A N ASP 73.A OD1 no hydrogen 3.090 N/A SER 75.A OG ASP 73.A OD1 no hydrogen 2.801 N/A THR 76.A N ASP 73.A O no hydrogen 3.093 N/A THR 76.A OG1 ASP 73.A O no hydrogen 3.468 N/A THR 76.A OG1 THR 78.A OG1 no hydrogen 3.248 N/A SER 77.A N GLU 74.A O no hydrogen 3.507 N/A THR 78.A N ASP 73.A O no hydrogen 3.268 N/A THR 78.A OG1 THR 76.A O no hydrogen 2.839 N/A THR 78.A OG1 THR 76.A OG1 no hydrogen 3.248 N/A ALA 79.A N CYS 21.A O no hydrogen 2.826 N/A TYR 80.A N THR 71.A O no hydrogen 2.924 N/A MET 81.A N.A VAL 19.A O no hydrogen 2.917 N/A MET 81.A N.B VAL 19.A O no hydrogen 2.891 N/A GLU 82.A N THR 69.A O no hydrogen 2.933 N/A LEU 83.A N VAL 17.A O no hydrogen 2.880 N/A ARG 87.A N ASP 90.A OD2 no hydrogen 2.941 N/A ARG 87.A NE.B GLU 89.A OE1 no hydrogen 2.687 N/A ARG 87.A NH2.B GLU 89.A OE1 no hydrogen 3.399 N/A ASP 90.A N ARG 87.A O no hydrogen 2.854 N/A THR 91.A N SER 88.A O no hydrogen 3.061 N/A THR 91.A OG1 SER 88.A O no hydrogen 3.095 N/A ALA 92.A N VAL 124.A O no hydrogen 3.157 N/A VAL 93.A N GLN 39.A O no hydrogen 2.897 N/A TYR 94.A N THR 122.A O no hydrogen 2.868 N/A TYR 94.A OH ASP 90.A O no hydrogen 2.632 N/A TYR 95.A N VAL 37.A O no hydrogen 2.758 N/A CYS 96.A N GLN 5.A OE1 no hydrogen 3.070 N/A CYS 96.A SG GLN 5.A OE1 no hydrogen 3.586 N/A ALA 97.A N SER 35.A O no hydrogen 2.793 N/A ARG 98.A N TYR 117.A O no hydrogen 2.842 N/A ARG 98.A NE ASP 116.A OD1 no hydrogen 3.251 N/A ARG 98.A NH1 THR 28D.A OG1 no hydrogen 3.030 N/A ARG 98.A NH2 ASP 116.A OD2 no hydrogen 3.013 N/A GLY 99.A N ALA 33I.A O no hydrogen 2.997 N/A TYR 102.A N ARG 111G.A O no hydrogen 3.151 N/A ASP 104.A N SER 109E.A O no hydrogen 2.682 N/A ASP 116.A N ARG 98.A O no hydrogen 2.726 N/A TYR 117.A N ARG 98.A O no hydrogen 3.375 N/A GLY 119.A N CYS 96.A O no hydrogen 2.849 N/A GLN 120.A N GLN 120.A OE1 no hydrogen 2.649 N/A GLN 120.A NE2 GLN 5.A O no hydrogen 3.309 N/A GLY 121.A N GLN 5.A OE1 no hydrogen 3.131 N/A THR 122.A N TYR 94.A O no hydrogen 2.859 N/A THR 122.A OG1 SER 6.A O no hydrogen 2.729 N/A VAL 124.A N ALA 92.A O no hydrogen 2.988 N/A THR 125.A N GLU 9.A O no hydrogen 2.863 N/A VAL 126.A N THR 91.A OG1 no hydrogen 2.900 N/A SER 127.A N LYS 11.A O no hydrogen 2.869 N/A GLY 129.A N SER 127.A OG no hydrogen 2.922 N/A SER 132.A N PHE 161.A O no hydrogen 2.792 N/A THR 135.A N LYS 158.A O no hydrogen 2.899 N/A PHE 137.A N LEU 156.A O no hydrogen 2.884 N/A LEU 139.A N GLY 154.A O no hydrogen 2.870 N/A SER 142.A N SER 145.A OG no hydrogen 3.053 N/A LYS 144.A N SER 142.A OG no hydrogen 2.887 N/A SER 145.A N SER 142.A O no hydrogen 3.017 N/A SER 145.A OG SER 142.A O no hydrogen 3.495 N/A SER 145.A OG ALA 152.A O no hydrogen 2.770 N/A THR 146.A OG1.B SER 142.A O no hydrogen 2.845 N/A SER 147.A N THR 150.A O no hydrogen 2.835 N/A THR 150.A N SER 147.A O no hydrogen 2.929 N/A ALA 151.A N VAL 199.A O no hydrogen 2.837 N/A ALA 152.A N SER 145.A O no hydrogen 2.768 N/A LEU 153.A N VAL 197.A O no hydrogen 3.053 N/A GLY 154.A N LEU 139.A O no hydrogen 2.874 N/A CYS 155.A N.A SER 195.A O no hydrogen 2.803 N/A CYS 155.A N.B SER 195.A O no hydrogen 2.878 N/A CYS 155.A SG.B GLY 154.A O no hydrogen 3.532 N/A LEU 156.A N PHE 137.A O no hydrogen 2.802 N/A VAL 157.A N LEU 193.A O no hydrogen 2.761 N/A LYS 158.A N THR 135.A O no hydrogen 2.876 N/A LYS 158.A NZ ASP 159.A OD1 no hydrogen 3.205 N/A LYS 158.A NZ ASP 159.A OD2 no hydrogen 3.427 N/A LYS 158.A NZ GLN 186.A OE1.A no hydrogen 3.341 N/A ASP 159.A N SER 192.A OG.B no hydrogen 3.199 N/A TYR 160.A N TYR 191.A O no hydrogen 3.135 N/A TYR 160.A OH GLU 163.A OE1 no hydrogen 2.678 N/A PHE 161.A N SER 132.A O no hydrogen 2.921 N/A THR 166.A N ASN 214.A O no hydrogen 3.033 N/A SER 168.A N ASN 212.A O no hydrogen 2.843 N/A SER 168.A OG ASN 212.A OD1 no hydrogen 2.832 N/A TRP 169.A NE1 SER 195.A OG no hydrogen 2.991 N/A ASN 170.A N ILE 210.A O no hydrogen 2.781 N/A ASN 170.A ND2 THR 208.A O no hydrogen 3.103 N/A SER 171.A N ASN 212.A OD1 no hydrogen 2.659 N/A GLY 172.A N TRP 169.A O no hydrogen 2.982 N/A ALA 173.A N ASN 170.A O no hydrogen 3.062 N/A LEU 174.A N TRP 169.A O no hydrogen 3.261 N/A VAL 178.A N THR 175.A O no hydrogen 3.383 N/A HIS 179.A N VAL 196.A O no hydrogen 2.783 N/A THR 180.A OG1 SER 195.A OG no hydrogen 2.843 N/A PHE 181.A N SER 194.A O no hydrogen 2.961 N/A VAL 184.A N SER 192.A O no hydrogen 3.009 N/A GLN 186.A N LEU 190.A O no hydrogen 2.750 N/A GLN 186.A NE2.A ASP 159.A OD1 no hydrogen 2.952 N/A GLN 186.A NE2.A LEU 190.A O no hydrogen 3.053 N/A GLN 186.A NE2.B VAL 184.A O no hydrogen 2.848 N/A GLY 189.A N GLN 186.A O no hydrogen 2.912 N/A LEU 190.A N SER 188.A OG no hydrogen 3.205 N/A TYR 191.A N TYR 160.A O no hydrogen 2.819 N/A SER 192.A N VAL 184.A O no hydrogen 3.152 N/A SER 192.A OG.A VAL 157.A O no hydrogen 3.442 N/A SER 192.A OG.B TYR 191.A O no hydrogen 3.014 N/A LEU 193.A N VAL 157.A O no hydrogen 2.952 N/A SER 195.A N CYS 155.A O.A no hydrogen 2.820 N/A SER 195.A N CYS 155.A O.B no hydrogen 2.936 N/A SER 195.A OG THR 180.A OG1 no hydrogen 2.843 N/A VAL 196.A N HIS 179.A O no hydrogen 2.812 N/A VAL 197.A N LEU 153.A O no hydrogen 2.790 N/A THR 198.A N GLY 177.A O no hydrogen 3.346 N/A VAL 199.A N ALA 151.A O no hydrogen 2.814 N/A SER 201.A N.A GLY 149.A O no hydrogen 2.812 N/A SER 201.A N.B GLY 149.A O no hydrogen 2.798 N/A SER 203.A N PRO 200.A O no hydrogen 2.988 N/A SER 203.A OG PRO 200.A O no hydrogen 2.670 N/A SER 203.A OG TYR 209.A OH no hydrogen 2.662 N/A LEU 204.A N SER 201.A O.A no hydrogen 3.269 N/A LEU 204.A N SER 201.A O.B no hydrogen 3.093 N/A THR 206.A N SER 203.A O no hydrogen 3.221 N/A GLN 207.A N SER 203.A O no hydrogen 2.905 N/A GLN 207.A NE2 THR 208.A O no hydrogen 2.947 N/A TYR 209.A OH SER 203.A OG no hydrogen 2.662 N/A ILE 210.A N ASN 170.A OD1 no hydrogen 2.875 N/A CYS 211.A N.A LYS 224.A O no hydrogen 2.852 N/A CYS 211.A N.B LYS 224.A O no hydrogen 2.958 N/A CYS 211.A SG.B LYS 224.A O no hydrogen 3.860 N/A ASN 212.A N SER 168.A O no hydrogen 2.905 N/A ASN 212.A ND2 ASP 223.A OD1 no hydrogen 2.815 N/A VAL 213.A N VAL 222.A O no hydrogen 2.815 N/A ASN 214.A N THR 166.A O no hydrogen 3.002 N/A HIS 215.A N THR 220.A O no hydrogen 2.862 N/A HIS 215.A ND1 SER 218.A OG no hydrogen 2.743 N/A HIS 215.A NE2 PRO 162.A O no hydrogen 2.782 N/A LYS 216.A NZ.A ASN 219.A OD1 no hydrogen 3.548 N/A SER 218.A N HIS 215.A O no hydrogen 3.319 N/A SER 218.A OG HIS 215.A ND1 no hydrogen 2.743 N/A SER 218.A OG HIS 215.A O no hydrogen 3.492 N/A SER 218.A OG THR 220.A OG1 no hydrogen 2.813 N/A ASN 219.A N LYS 216.A O no hydrogen 2.917 N/A THR 220.A N HIS 215.A O no hydrogen 3.182 N/A THR 220.A OG1 SER 218.A O no hydrogen 3.008 N/A THR 220.A OG1 SER 218.A OG no hydrogen 2.813 N/A VAL 222.A N VAL 213.A O no hydrogen 2.893 N/A LYS 224.A N CYS 211.A O.A no hydrogen 2.916 N/A LYS 224.A N CYS 211.A O.B no hydrogen 2.918 N/A LYS 225.A NZ.A GLU 227.A OE2 no hydrogen 2.809 N/A VAL 226.A N TYR 209.A O no hydrogen 2.915 N/A LYS 229.A N PRO 141.A O no hydrogen 2.985 N/A SER 84A.A N ARG 67.A O no hydrogen 2.899 N/A SER 84A.A OG ARG 67.A O no hydrogen 3.296 N/A LEU 86C.A N SER 15.A O no hydrogen 2.984 N/A TRP 107C.A N ASP 104.A OD2 no hydrogen 2.715 N/A GLY 108D.A N ASP 104.A O no hydrogen 2.761 N/A SER 109E.A N ASP 104.A O no hydrogen 3.193 N/A SER 109E.A OG TYR 110F.A O no hydrogen 2.828 N/A SER 30F.A N GLY 26B.A O no hydrogen 3.101 N/A SER 30F.A OG GLY 26B.A O no hydrogen 2.786 N/A ASN 31G.A N ASP 27C.A O no hydrogen 2.748 N/A ASN 31G.A ND2 ASP 27C.A O no hydrogen 3.373 N/A ASN 31G.A ND2 ASP 27C.A OD1 no hydrogen 2.190 N/A ARG 111G.A N TYR 102.A O no hydrogen 2.764 N/A ARG 111G.A NH1 ASP 104.A OD1 no hydrogen 3.058 N/A TYR 32H.A N THR 28D.A O no hydrogen 3.062 N/A TYR 112H.A OH GLY 50.A O no hydrogen 3.137 N/A ALA 33I.A N GLY 99.A O no hydrogen 2.866 N/A ASN 113I.A N PRO 100.A O no hydrogen 3.521 N/A