Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wh1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG THR 3.A OG1 no hydrogen 2.880 N/A THR 3.A N SER 1.A OG no hydrogen 3.150 N/A THR 3.A OG1 SER 1.A OG no hydrogen 2.880 N/A SER 4.A N SER 1.A O no hydrogen 3.055 N/A SER 4.A OG SER 1.A O no hydrogen 2.877 N/A PHE 5.A N TRP 2.A O no hydrogen 3.110 N/A VAL 6.A N TRP 2.A O no hydrogen 2.985 N/A VAL 10.A N THR 7.A OG1 no hydrogen 3.106 N/A PHE 11.A N THR 7.A O no hydrogen 3.052 N/A GLU 12.A N PRO 8.A O no hydrogen 2.877 N/A GLY 13.A N ALA 9.A O no hydrogen 2.994 N/A TRP 14.A N VAL 10.A O no hydrogen 3.026 N/A TRP 14.A NE1 THR 192.A OG1 no hydrogen 3.056 N/A PHE 15.A N PHE 11.A O no hydrogen 2.922 N/A ARG 18.A N PHE 15.A O no hydrogen 3.273 N/A ARG 18.A NE GLU 12.A OE1 no hydrogen 2.850 N/A ARG 18.A NH1 TYR 22.A O no hydrogen 2.763 N/A ARG 18.A NH2 GLU 12.A OE1 no hydrogen 3.015 N/A ASN 19.A N LEU 64.A O no hydrogen 2.789 N/A PHE 21.A N ASN 19.A OD1 no hydrogen 2.948 N/A TYR 22.A N ASN 19.A O no hydrogen 3.005 N/A TYR 22.A OH PHE 66.A O no hydrogen 2.784 N/A TYR 24.A OH VAL 6.A O no hydrogen 2.674 N/A GLY 26.A N THR 23.A OG1 no hydrogen 2.887 N/A LEU 27.A N THR 23.A O no hydrogen 3.136 N/A VAL 28.A N TYR 24.A O no hydrogen 2.913 N/A SER 29.A N ASP 25.A O no hydrogen 2.903 N/A SER 29.A OG ASP 25.A O no hydrogen 3.104 N/A ALA 30.A N GLY 26.A O no hydrogen 3.022 N/A SER 31.A N LEU 27.A O no hydrogen 2.877 N/A SER 31.A OG VAL 28.A O no hydrogen 2.717 N/A ASN 32.A N VAL 28.A O no hydrogen 3.216 N/A ASN 32.A N SER 29.A O no hydrogen 3.174 N/A GLY 33.A N ALA 30.A O no hydrogen 3.091 N/A TYR 34.A N SER 31.A O no hydrogen 2.889 N/A GLU 36.A N GLU 36.A OE1 no hydrogen 2.833 N/A PHE 37.A N TYR 34.A O no hydrogen 2.895 N/A GLY 38.A N GLU 49.A OE1 no hydrogen 2.846 N/A THR 39.A N GLU 36.A O no hydrogen 3.215 N/A THR 39.A OG1 PRO 35.A O no hydrogen 2.615 N/A THR 40.A OG1 GLU 36.A O no hydrogen 2.728 N/A SER 42.A N ASP 45.A OD2 no hydrogen 2.912 N/A ASP 45.A N SER 42.A OG no hydrogen 3.067 N/A GLN 46.A N SER 42.A O no hydrogen 2.987 N/A GLN 46.A NE2 GLY 41.A O no hydrogen 2.894 N/A LYS 47.A N LEU 43.A O no hydrogen 2.920 N/A LYS 47.A NZ LEU 193.A O no hydrogen 2.877 N/A ARG 48.A N ASP 44.A O no hydrogen 2.892 N/A ARG 48.A NH1 ASP 196.A O no hydrogen 2.858 N/A ARG 48.A NH2 ASP 45.A OD1 no hydrogen 2.907 N/A GLU 49.A N ASP 45.A O no hydrogen 2.895 N/A LEU 50.A N GLN 46.A O no hydrogen 3.121 N/A ALA 51.A N LYS 47.A O no hydrogen 2.957 N/A ALA 52.A N ARG 48.A O no hydrogen 2.822 N/A PHE 53.A N GLU 49.A O no hydrogen 2.900 N/A LEU 54.A N LEU 50.A O no hydrogen 2.945 N/A GLY 55.A N ALA 51.A O no hydrogen 2.782 N/A ASN 56.A N ALA 52.A O no hydrogen 3.032 N/A ASN 56.A ND2 ALA 52.A O no hydrogen 2.988 N/A ASN 56.A ND2 THR 157.A OG1 no hydrogen 3.039 N/A ILE 57.A N PHE 53.A O no hydrogen 3.020 N/A ASN 58.A N LEU 54.A O no hydrogen 2.799 N/A GLN 59.A N GLY 55.A O no hydrogen 3.245 N/A ALA 60.A N ASN 56.A O no hydrogen 3.010 N/A SER 61.A N ILE 57.A O no hydrogen 2.925 N/A SER 61.A OG ILE 57.A O no hydrogen 2.746 N/A GLY 63.A N ASN 58.A O no hydrogen 2.963 N/A LEU 64.A N SER 61.A OG no hydrogen 2.857 N/A GLN 65.A N GLY 62.A O no hydrogen 3.145 N/A GLN 65.A NE2 GLY 62.A O no hydrogen 2.842 N/A PHE 66.A N SER 61.A O no hydrogen 3.085 N/A GLU 69.A N GLY 93.A O no hydrogen 2.806 N/A GLN 70.A NE2 GLN 68.A O no hydrogen 2.848 N/A TYR 75.A N SER 73.A OG no hydrogen 2.963 N/A TYR 75.A OH GLU 69.A OE2 no hydrogen 2.748 N/A CYS 76.A N ASP 74.A OD1 no hydrogen 3.091 N/A ASP 77.A N ASN 102.A OD1 no hydrogen 2.862 N/A SER 79.A N ASP 77.A OD1 no hydrogen 2.957 N/A SER 79.A OG ASP 77.A OD1 no hydrogen 2.568 N/A SER 80.A N ASP 77.A O no hydrogen 3.078 N/A ALA 86.A N TYR 91.A OH no hydrogen 2.988 N/A LYS 89.A N ALA 86.A O no hydrogen 2.998 N/A TYR 91.A N ASP 74.A O no hydrogen 2.728 N/A TYR 91.A OH LEU 117.A O no hydrogen 2.675 N/A TYR 92.A OH GLN 68.A OE1 no hydrogen 2.698 N/A GLY 93.A N GLU 69.A OE1 no hydrogen 2.925 N/A ARG 94.A N LEU 99.A O no hydrogen 3.114 N/A ARG 94.A NH1 GLN 90.A O no hydrogen 2.794 N/A ARG 94.A NH1 TYR 105.A OH no hydrogen 3.022 N/A ARG 94.A NH2 GLN 90.A O no hydrogen 2.995 N/A ARG 94.A NH2 ASP 121.A OD1 no hydrogen 2.972 N/A GLY 95.A N ILE 67.A O no hydrogen 2.845 N/A GLN 98.A N GLY 95.A O no hydrogen 3.028 N/A GLN 98.A NE2 ILE 67.A O no hydrogen 3.318 N/A GLN 98.A NE2 GLY 95.A O no hydrogen 3.140 N/A LEU 99.A N ARG 94.A O no hydrogen 3.049 N/A SER 100.A OG GLN 98.A O no hydrogen 2.812 N/A TRP 101.A N TYR 91.A O no hydrogen 2.864 N/A ASN 102.A N TYR 75.A O no hydrogen 3.293 N/A ASN 102.A ND2 ASP 77.A O no hydrogen 3.442 N/A ASN 102.A ND2 SER 80.A O no hydrogen 3.255 N/A ASN 102.A ND2 TYR 83.A O no hydrogen 2.898 N/A ASN 104.A N TRP 101.A O no hydrogen 3.041 N/A ASN 104.A ND2 SER 100.A O no hydrogen 2.888 N/A TYR 105.A N TRP 101.A O no hydrogen 3.060 N/A TYR 105.A OH TYR 92.A O no hydrogen 2.750 N/A TYR 105.A OH LEU 99.A O no hydrogen 2.955 N/A GLY 106.A N ASN 102.A O no hydrogen 2.805 N/A GLU 107.A N TYR 103.A O no hydrogen 3.177 N/A ALA 108.A N ASN 104.A O no hydrogen 2.927 N/A GLY 109.A N TYR 105.A O no hydrogen 2.853 N/A ALA 110.A N GLY 106.A O no hydrogen 2.962 N/A ASP 111.A N GLU 107.A O no hydrogen 2.975 N/A LEU 112.A N ALA 108.A O no hydrogen 2.797 N/A LEU 114.A N GLY 109.A O no hydrogen 2.936 N/A ASN 119.A N ASP 115.A O no hydrogen 2.832 N/A LEU 122.A N ASN 119.A O no hydrogen 3.089 N/A VAL 123.A N PRO 120.A O no hydrogen 3.078 N/A ALA 124.A N ASP 121.A O no hydrogen 2.946 N/A GLN 125.A N LEU 122.A O no hydrogen 3.194 N/A ASP 126.A N LEU 122.A O no hydrogen 2.980 N/A VAL 129.A N ASP 126.A OD1 no hydrogen 3.071 N/A ALA 130.A N ASP 126.A O no hydrogen 2.923 N/A TRP 131.A N SER 127.A O no hydrogen 3.028 N/A ARG 132.A N THR 128.A O no hydrogen 3.012 N/A ARG 132.A NH2 LEU 112.A O no hydrogen 3.244 N/A THR 133.A N VAL 129.A O no hydrogen 2.866 N/A THR 133.A OG1 ALA 130.A O no hydrogen 2.788 N/A ALA 134.A N ALA 130.A O no hydrogen 3.288 N/A LEU 135.A N TRP 131.A O no hydrogen 3.051 N/A TRP 136.A N ARG 132.A O no hydrogen 2.760 N/A TRP 136.A NE1 ASP 111.A OD2 no hydrogen 2.837 N/A PHE 137.A N THR 133.A O no hydrogen 2.988 N/A TRP 138.A N ALA 134.A O no hydrogen 3.078 N/A TRP 138.A NE1 GLU 49.A OE2 no hydrogen 2.825 N/A MET 139.A N LEU 135.A O no hydrogen 2.897 N/A LYS 140.A N TRP 136.A O no hydrogen 2.726 N/A LYS 140.A NZ GLU 107.A OE2 no hydrogen 2.799 N/A LYS 140.A NZ ASP 111.A OD2 no hydrogen 2.729 N/A ARG 141.A N PHE 137.A O no hydrogen 2.917 N/A ARG 141.A NE ASN 104.A OD1 no hydrogen 3.181 N/A ARG 141.A NH1 GLU 107.A OE1 no hydrogen 3.157 N/A ARG 141.A NH1 GLU 107.A OE2 no hydrogen 3.216 N/A ARG 141.A NH2 ASN 104.A OD1 no hydrogen 2.830 N/A ARG 141.A NH2 GLU 107.A OE1 no hydrogen 2.883 N/A ASP 142.A N MET 139.A O no hydrogen 3.183 N/A CYS 143.A SG THR 157.A O no hydrogen 4.025 N/A HIS 144.A N TRP 138.A O no hydrogen 3.055 N/A HIS 144.A ND1 GLU 49.A OE2 no hydrogen 2.655 N/A GLY 145.A N ASP 142.A OD1 no hydrogen 2.906 N/A ALA 146.A N ASP 142.A O no hydrogen 3.242 N/A ILE 147.A N CYS 143.A O no hydrogen 3.050 N/A THR 148.A N HIS 144.A O no hydrogen 3.091 N/A THR 148.A OG1 HIS 144.A O no hydrogen 2.763 N/A SER 153.A N ALA 146.A O no hydrogen 2.935 N/A SER 153.A OG SER 155.A OG no hydrogen 3.128 N/A SER 153.A OG ASP 200.A OD2 no hydrogen 2.755 N/A SER 155.A N ASP 200.A O no hydrogen 3.036 N/A SER 155.A OG SER 153.A OG no hydrogen 3.128 N/A SER 155.A OG ASP 200.A OD1 no hydrogen 2.657 N/A SER 155.A OG ASP 200.A OD2 no hydrogen 3.291 N/A GLY 156.A N SER 153.A OG no hydrogen 2.952 N/A THR 157.A N PHE 154.A O no hydrogen 2.962 N/A THR 157.A OG1 PHE 154.A O no hydrogen 2.769 N/A ILE 158.A N PHE 154.A O no hydrogen 3.366 N/A ARG 159.A N SER 155.A O no hydrogen 3.024 N/A ARG 159.A NH1 SER 155.A OG no hydrogen 2.932 N/A ILE 160.A N GLY 156.A O no hydrogen 3.047 N/A ILE 161.A N THR 157.A O no hydrogen 2.989 N/A ASN 162.A N ILE 158.A O no hydrogen 2.905 N/A ASN 162.A ND2 GLU 166.A OE2 no hydrogen 2.814 N/A GLY 163.A N ARG 159.A O no hydrogen 2.950 N/A LEU 165.A N ASN 162.A O no hydrogen 3.265 N/A GLU 166.A N ASN 162.A O no hydrogen 3.031 N/A CYS 167.A N GLY 163.A O no hydrogen 2.914 N/A ASN 168.A N CYS 203.A OXT no hydrogen 2.789 N/A GLN 169.A NE2 CYS 167.A O no hydrogen 3.107 N/A GLY 172.A N ASN 176.A OD1 no hydrogen 2.999 N/A SER 173.A N PRO 170.A O no hydrogen 2.965 N/A SER 173.A OG PRO 170.A O no hydrogen 2.719 N/A MET 177.A N SER 173.A O no hydrogen 2.840 N/A GLN 178.A N ILE 174.A O no hydrogen 2.972 N/A MET 179.A N GLY 175.A O no hydrogen 2.993 N/A GLU 180.A N ASN 176.A O no hydrogen 2.889 N/A ASN 181.A N MET 177.A O no hydrogen 2.945 N/A ARG 182.A N GLN 178.A O no hydrogen 3.082 N/A ARG 182.A NE GLU 166.A OE1 no hydrogen 2.671 N/A ARG 182.A NE GLU 166.A OE2 no hydrogen 3.473 N/A ARG 182.A NH1 ASN 56.A OD1 no hydrogen 2.903 N/A ARG 182.A NH2 GLU 166.A OE2 no hydrogen 2.893 N/A VAL 183.A N MET 179.A O no hydrogen 3.137 N/A THR 184.A N GLU 180.A O no hydrogen 2.857 N/A THR 184.A OG1 GLU 180.A O no hydrogen 3.097 N/A TYR 185.A N ASN 181.A O no hydrogen 2.895 N/A TYR 186.A N ARG 182.A O no hydrogen 2.924 N/A TYR 186.A OH PRO 197.A O no hydrogen 2.728 N/A THR 187.A N VAL 183.A O no hydrogen 2.901 N/A THR 187.A OG1 VAL 183.A O no hydrogen 3.120 N/A THR 187.A OG1 THR 184.A O no hydrogen 2.958 N/A GLN 188.A N THR 184.A O no hydrogen 2.880 N/A PHE 189.A N TYR 185.A O no hydrogen 2.864 N/A CYS 190.A N TYR 186.A O no hydrogen 2.848 N/A CYS 190.A SG TYR 186.A O no hydrogen 3.397 N/A GLN 191.A N THR 187.A O no hydrogen 2.979 N/A THR 192.A N GLN 188.A O no hydrogen 3.063 N/A THR 192.A OG1 GLN 188.A O no hydrogen 3.289 N/A LEU 193.A N PHE 189.A O no hydrogen 3.079 N/A GLY 194.A N GLN 191.A O no hydrogen 3.123 N/A VAL 195.A N CYS 190.A O no hydrogen 3.014 N/A GLY 198.A N ASP 196.A OD1 no hydrogen 2.849 N/A ARG 202.A NE GLU 180.A OE2 no hydrogen 3.016 N/A ARG 202.A NH2 GLU 180.A OE1 no hydrogen 3.138 N/A