Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wdu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N ILE 213.A O no hydrogen 2.981 N/A VAL 5.A N PHE 211.A O no hydrogen 2.818 N/A LEU 6.A N ILE 31.A O no hydrogen 2.724 N/A GLN 7.A N MET 209.A O no hydrogen 2.905 N/A GLN 7.A NE2 VAL 181.A O no hydrogen 3.525 N/A ALA 8.A N LEU 33.A O no hydrogen 3.038 N/A ASN 9.A ND2 ASP 131.A OD2 no hydrogen 3.102 N/A LEU 10.A N GLN 35.A O no hydrogen 2.993 N/A GLN 11.A N ASN 9.A OD1 no hydrogen 2.866 N/A ARG 12.A N GLU 36.A O no hydrogen 2.643 N/A LYS 13.A N LEU 10.A O no hydrogen 3.155 N/A LYS 13.A NZ SER 203.A O no hydrogen 3.128 N/A THR 17.A N LYS 13.A O no hydrogen 3.137 N/A THR 17.A OG1 LYS 14.A O no hydrogen 3.532 N/A ALA 18.A N LEU 15.A O no hydrogen 2.974 N/A GLU 19.A N LEU 15.A O no hydrogen 2.900 N/A LEU 20.A N ALA 16.A O no hydrogen 2.813 N/A ALA 21.A N THR 17.A O no hydrogen 3.120 N/A ILE 22.A N ALA 18.A O no hydrogen 2.953 N/A GLU 23.A N GLU 19.A O no hydrogen 2.866 N/A ALA 24.A N LEU 20.A O no hydrogen 2.974 N/A ALA 25.A N ALA 21.A O no hydrogen 3.027 N/A THR 26.A N ILE 22.A O no hydrogen 2.941 N/A THR 26.A OG1 ILE 22.A O no hydrogen 2.789 N/A ARG 27.A N GLU 23.A O no hydrogen 2.779 N/A ARG 27.A NH1 GLU 23.A OE2 no hydrogen 3.411 N/A LYS 28.A N ALA 25.A O no hydrogen 3.110 N/A ALA 29.A N ALA 24.A O no hydrogen 2.862 N/A ALA 30.A N ARG 4.A O no hydrogen 2.903 N/A ILE 31.A N ARG 4.A O no hydrogen 3.202 N/A ALA 32.A N ALA 63.A O no hydrogen 2.928 N/A LEU 33.A N LEU 6.A O no hydrogen 2.556 N/A ILE 34.A N ALA 61.A O no hydrogen 2.879 N/A GLN 35.A N ALA 8.A O no hydrogen 3.088 N/A GLN 35.A NE2 LEU 33.A O no hydrogen 3.138 N/A GLN 35.A NE2 SER 98.A OG no hydrogen 3.068 N/A GLU 36.A N LYS 59.A O no hydrogen 2.685 N/A ARG 46.A N VAL 64.A O no hydrogen 3.146 N/A ARG 46.A NH2 ASP 66.A O no hydrogen 3.304 N/A ARG 46.A NH2 LEU 69.A O no hydrogen 3.030 N/A PHE 48.A N ILE 62.A O no hydrogen 2.934 N/A SER 50.A N ALA 60.A O no hydrogen 2.949 N/A SER 50.A OG ALA 60.A O no hydrogen 2.999 N/A THR 51.A N THR 79.A O no hydrogen 2.667 N/A GLN 53.A N THR 57.A O no hydrogen 2.958 N/A GLN 53.A NE2 THR 51.A O no hydrogen 2.875 N/A GLN 53.A NE2 ASN 80.A OD1 no hydrogen 2.687 N/A GLY 56.A N GLN 53.A O no hydrogen 2.670 N/A THR 57.A N ASP 55.A OD1 no hydrogen 2.927 N/A THR 57.A OG1 ASP 55.A OD1 no hydrogen 2.822 N/A LYS 59.A NZ GLU 102.A OE2 no hydrogen 2.542 N/A ALA 60.A N SER 50.A OG no hydrogen 3.160 N/A ALA 61.A N ILE 34.A O no hydrogen 3.027 N/A ILE 62.A N PHE 48.A O no hydrogen 2.758 N/A ALA 63.A N ALA 32.A O no hydrogen 2.938 N/A VAL 64.A N ARG 46.A O no hydrogen 2.815 N/A PHE 65.A N ALA 30.A O no hydrogen 2.899 N/A ASP 66.A N ALA 30.A O no hydrogen 3.451 N/A ASP 68.A N ASP 66.A OD2 no hydrogen 2.991 N/A LEU 69.A N ASP 66.A OD2 no hydrogen 3.116 N/A ILE 72.A N GLY 86.A O no hydrogen 2.951 N/A LEU 77.A N TYR 74.A O no hydrogen 2.891 N/A THR 78.A N TYR 74.A O no hydrogen 3.172 N/A THR 78.A OG1 PRO 75.A O no hydrogen 3.083 N/A THR 79.A N ILE 82.A O no hydrogen 2.763 N/A THR 79.A OG1 GLN 113.A OE1 no hydrogen 2.703 N/A ASN 81.A N THR 79.A OG1 no hydrogen 3.013 N/A ASN 81.A ND2 TYR 100.A O no hydrogen 2.879 N/A ASN 81.A ND2 GLU 102.A OE2 no hydrogen 2.985 N/A ILE 82.A N THR 79.A OG1 no hydrogen 3.108 N/A VAL 83.A N SER 98.A O no hydrogen 3.033 N/A VAL 85.A N LEU 96.A O no hydrogen 2.832 N/A GLY 86.A N ILE 72.A O no hydrogen 2.865 N/A ILE 87.A N ILE 94.A O no hydrogen 2.785 N/A ARG 88.A N ASP 70.A O no hydrogen 2.935 N/A ARG 88.A NH1 GLU 93.A OE1 no hydrogen 3.091 N/A THR 89.A N TRP 92.A O no hydrogen 2.824 N/A TRP 92.A N THR 89.A O no hydrogen 3.226 N/A TRP 92.A N THR 89.A OG1 no hydrogen 3.404 N/A TRP 92.A NE1 ARG 214.A O no hydrogen 3.126 N/A ILE 94.A N ILE 87.A O no hydrogen 2.774 N/A THR 95.A N ARG 125.A O no hydrogen 2.882 N/A LEU 96.A N VAL 85.A O no hydrogen 2.635 N/A VAL 97.A N ILE 127.A O no hydrogen 2.931 N/A SER 98.A N VAL 83.A O no hydrogen 3.061 N/A SER 98.A OG ILE 34.A O no hydrogen 2.540 N/A SER 98.A OG ALA 61.A O no hydrogen 3.282 N/A TYR 99.A N GLY 129.A O no hydrogen 3.007 N/A TYR 99.A OH VAL 181.A O no hydrogen 2.900 N/A TYR 100.A N ASN 81.A O no hydrogen 3.020 N/A PHE 101.A N ASP 131.A O no hydrogen 3.013 N/A GLU 108.A N GLU 108.A OE2 no hydrogen 2.765 N/A LEU 111.A N ILE 107.A O no hydrogen 2.968 N/A GLU 112.A N GLU 108.A O no hydrogen 3.133 N/A GLN 113.A N SER 109.A O no hydrogen 3.148 N/A GLN 113.A NE2 SER 109.A O no hydrogen 3.694 N/A ILE 114.A N TYR 110.A O no hydrogen 3.080 N/A LYS 115.A N LEU 111.A O no hydrogen 2.985 N/A LYS 115.A NZ GLU 157.A OE1 no hydrogen 3.104 N/A ARG 116.A N GLU 112.A O no hydrogen 2.778 N/A ARG 116.A NH1 GLN 76.A O no hydrogen 2.728 N/A ARG 116.A NH2 GLN 76.A O no hydrogen 3.423 N/A VAL 117.A N GLN 113.A O no hydrogen 3.002 N/A GLU 118.A N ILE 114.A O no hydrogen 2.969 N/A ARG 119.A N LYS 115.A O no hydrogen 2.905 N/A LYS 120.A N ARG 116.A O no hydrogen 3.042 N/A ARG 125.A N ASP 187.A OD1 no hydrogen 3.181 N/A ARG 125.A N ASP 187.A OD2 no hydrogen 2.849 N/A LEU 126.A N THR 185.A OG1 no hydrogen 3.057 N/A ILE 127.A N THR 95.A O no hydrogen 3.153 N/A PHE 128.A N PHE 183.A O no hydrogen 2.730 N/A GLY 129.A N VAL 97.A O no hydrogen 2.931 N/A GLY 130.A N VAL 181.A O no hydrogen 3.123 N/A ASP 131.A N TYR 99.A O no hydrogen 3.222 N/A ALA 132.A N VAL 179.A O no hydrogen 2.969 N/A ASN 133.A N ASP 131.A OD1 no hydrogen 2.946 N/A LYS 135.A N ASP 145.A OD1 no hydrogen 3.028 N/A LYS 135.A N ASP 145.A OD2 no hydrogen 3.037 N/A LYS 135.A NZ TYR 175.A OH no hydrogen 3.442 N/A SER 136.A N SER 141.A OG no hydrogen 3.041 N/A SER 136.A OG ASP 144.A OD1 no hydrogen 3.552 N/A THR 137.A N ASP 144.A OD1 no hydrogen 2.587 N/A THR 137.A OG1 ASP 144.A OD1 no hydrogen 2.892 N/A TRP 138.A N SER 136.A OG no hydrogen 3.120 N/A TRP 139.A N SER 136.A O no hydrogen 2.967 N/A TRP 139.A NE1 ALA 134.A O no hydrogen 3.090 N/A GLY 140.A N THR 137.A O no hydrogen 3.136 N/A SER 141.A N SER 136.A O no hydrogen 3.049 N/A SER 141.A OG SER 136.A O no hydrogen 3.165 N/A SER 141.A OG ARG 178.A O no hydrogen 2.627 N/A ASP 145.A N LYS 135.A O no hydrogen 3.014 N/A ARG 147.A NE ASN 133.A O no hydrogen 2.641 N/A ARG 147.A NH1 LYS 105.A O no hydrogen 2.933 N/A ARG 147.A NH2 ALA 132.A O no hydrogen 3.208 N/A ARG 147.A NH2 ASN 133.A O no hydrogen 3.381 N/A GLY 148.A N ASP 145.A OD1 no hydrogen 2.697 N/A ASP 149.A N ASP 145.A O no hydrogen 3.028 N/A GLN 150.A N ALA 146.A O no hydrogen 3.073 N/A GLN 150.A NE2 GLU 108.A OE1 no hydrogen 3.458 N/A LEU 151.A N ARG 147.A O no hydrogen 2.978 N/A MET 152.A N GLY 148.A O no hydrogen 2.773 N/A GLY 153.A N ASP 149.A O no hydrogen 2.837 N/A THR 154.A N GLN 150.A O no hydrogen 2.975 N/A THR 154.A OG1 GLN 150.A O no hydrogen 3.118 N/A LEU 155.A N LEU 151.A O no hydrogen 2.805 N/A GLY 156.A N MET 152.A O no hydrogen 2.847 N/A GLU 157.A N GLY 153.A O no hydrogen 3.128 N/A LEU 158.A N THR 154.A O no hydrogen 3.135 N/A LEU 158.A N LEU 155.A O no hydrogen 3.106 N/A GLY 159.A N GLY 156.A O no hydrogen 3.458 N/A LEU 160.A N LEU 155.A O no hydrogen 3.040 N/A HIS 161.A N CYS 184.A O no hydrogen 2.740 N/A LEU 163.A N THR 182.A O no hydrogen 2.767 N/A ASN 164.A ND2 ASP 180.A O no hydrogen 2.923 N/A THR 170.A N SER 177.A O no hydrogen 2.995 N/A THR 170.A OG1 SER 177.A O no hydrogen 3.534 N/A THR 170.A OG1 ASP 180.A OD1 no hydrogen 2.640 N/A PHE 171.A N SER 177.A O no hydrogen 2.981 N/A ASP 172.A N ASP 205.A O no hydrogen 2.674 N/A THR 173.A N TYR 175.A O no hydrogen 2.732 N/A TYR 175.A N THR 173.A O no hydrogen 2.606 N/A GLN 176.A NE2 ASP 172.A OD1 no hydrogen 2.749 N/A SER 177.A N PHE 171.A O no hydrogen 2.779 N/A ARG 178.A NE TRP 139.A O no hydrogen 2.760 N/A ARG 178.A NH1 VAL 168.A O no hydrogen 2.651 N/A ARG 178.A NH2 TRP 139.A O no hydrogen 3.333 N/A ARG 178.A NH2 GLU 165.A O no hydrogen 2.931 N/A VAL 179.A N THR 170.A OG1 no hydrogen 3.315 N/A VAL 181.A N GLY 130.A O no hydrogen 2.971 N/A THR 182.A N ASN 164.A OD1 no hydrogen 2.936 N/A THR 182.A OG1 GLN 7.A OE1 no hydrogen 2.548 N/A PHE 183.A N PHE 128.A O no hydrogen 2.969 N/A CYS 184.A N HIS 161.A O no hydrogen 2.966 N/A CYS 184.A SG HIS 161.A O no hydrogen 4.037 N/A CYS 184.A SG THR 185.A O no hydrogen 3.465 N/A THR 185.A N LEU 126.A O no hydrogen 3.066 N/A THR 185.A OG1 LEU 126.A O no hydrogen 3.509 N/A THR 185.A OG1 ASP 187.A OD2 no hydrogen 2.873 N/A MET 188.A N THR 185.A O no hydrogen 3.069 N/A LEU 189.A N GLU 186.A O no hydrogen 3.014 N/A LEU 191.A N MET 188.A O no hydrogen 2.879 N/A ASP 193.A N ASN 212.A O no hydrogen 3.193 N/A TRP 195.A NE1 THR 182.A OG1 no hydrogen 3.238 N/A ARG 196.A N VAL 210.A O no hydrogen 2.926 N/A ASP 198.A N GLY 208.A O no hydrogen 2.799 N/A LEU 201.A N ASP 198.A O no hydrogen 3.221 N/A SER 203.A OG GLU 19.A OE1 no hydrogen 2.667 N/A SER 203.A OG GLU 19.A OE2 no hydrogen 3.200 N/A SER 203.A OG SER 203.A O no hydrogen 2.475 N/A SER 204.A OG ASN 9.A O no hydrogen 2.992 N/A ASN 207.A N THR 170.A O no hydrogen 2.657 N/A ASN 207.A ND2 PRO 169.A O no hydrogen 2.506 N/A MET 209.A N GLN 7.A O no hydrogen 2.761 N/A VAL 210.A N ARG 196.A O no hydrogen 2.905 N/A PHE 211.A N VAL 5.A O no hydrogen 3.167 N/A ASN 212.A N ASP 193.A O no hydrogen 2.830 N/A ASN 212.A ND2 ASP 193.A O no hydrogen 3.054 N/A ASN 212.A ND2 ASP 193.A OD1 no hydrogen 3.326 N/A ILE 213.A N TYR 3.A O no hydrogen 2.952 N/A ARG 214.A N LEU 191.A O no hydrogen 2.719 N/A ARG 214.A NE ASP 193.A OD1 no hydrogen 3.545 N/A ARG 214.A NE ASP 193.A OD2 no hydrogen 2.782 N/A