Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wr8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N GLU 142.A OE1 no hydrogen 2.767 N/A GLY 1.A N GLU 142.A OE2 no hydrogen 3.405 N/A SER 2.A N GLU 142.A OE2 no hydrogen 2.851 N/A HIS 3.A N GLU 142.A OE2 no hydrogen 2.917 N/A ILE 5.A N LYS 33.A O no hydrogen 2.977 N/A THR 6.A N VAL 65.A O no hydrogen 2.824 N/A THR 6.A OG1 HIS 66.A ND1 no hydrogen 2.693 N/A LEU 7.A N VAL 35.A O no hydrogen 3.006 N/A THR 8.A N VAL 67.A O no hydrogen 3.056 N/A THR 9.A N THR 38.A O no hydrogen 2.893 N/A THR 9.A OG1 HIS 39.A ND1 no hydrogen 2.707 N/A ASP 10.A N VAL 69.A O no hydrogen 3.406 N/A PHE 11.A N THR 9.A OG1 no hydrogen 3.051 N/A GLY 12.A N HIS 39.A O no hydrogen 2.749 N/A GLU 20.A N PRO 16.A O no hydrogen 2.815 N/A MET 21.A N TYR 17.A O no hydrogen 3.084 N/A LYS 22.A N VAL 18.A O no hydrogen 2.952 N/A LYS 22.A NZ ASP 36.A OD1 no hydrogen 2.569 N/A LYS 22.A NZ ASP 36.A OD2 no hydrogen 3.330 N/A VAL 23.A N GLY 19.A O no hydrogen 2.870 N/A ALA 24.A N GLU 20.A O no hydrogen 2.972 N/A MET 25.A N MET 21.A O no hydrogen 3.053 N/A LEU 26.A N LYS 22.A O no hydrogen 2.949 N/A ARG 27.A N VAL 23.A O no hydrogen 2.840 N/A ASN 29.A N MET 25.A O no hydrogen 2.713 N/A ASN 29.A ND2 ALA 139.A O no hydrogen 3.018 N/A ASN 29.A ND2 GLU 142.A OE1 no hydrogen 3.126 N/A ALA 32.A N ASN 29.A O no hydrogen 3.035 N/A LYS 33.A NZ GLY 1.A O no hydrogen 3.238 N/A VAL 35.A N ILE 5.A O no hydrogen 2.842 N/A VAL 37.A N LEU 7.A O no hydrogen 2.783 N/A THR 38.A N LEU 7.A O no hydrogen 3.411 N/A HIS 39.A ND1 THR 9.A OG1 no hydrogen 2.707 N/A HIS 39.A NE2 ASP 36.A OD2 no hydrogen 2.795 N/A SER 40.A N THR 38.A OG1 no hydrogen 3.012 N/A VAL 41.A N THR 9.A O no hydrogen 3.422 N/A THR 42.A N GLU 48.A OE2 no hydrogen 2.893 N/A THR 42.A OG1 GLU 48.A OE2 no hydrogen 2.713 N/A ARG 43.A NE HIS 44.A NE2 no hydrogen 3.113 N/A ARG 43.A NH2 HIS 44.A NE2 no hydrogen 3.130 N/A HIS 44.A N ASP 10.A OD2 no hydrogen 2.786 N/A SER 45.A N THR 42.A O no hydrogen 2.963 N/A GLU 48.A N SER 45.A OG no hydrogen 3.078 N/A GLY 49.A N SER 45.A O no hydrogen 3.048 N/A SER 50.A N ILE 46.A O no hydrogen 2.834 N/A SER 50.A OG LEU 95.A O no hydrogen 2.704 N/A PHE 51.A N LEU 47.A O no hydrogen 3.118 N/A VAL 52.A N GLU 48.A O no hydrogen 2.989 N/A MET 53.A N GLY 49.A O no hydrogen 3.015 N/A GLU 54.A N SER 50.A O no hydrogen 2.828 N/A GLN 55.A N PHE 51.A O no hydrogen 3.108 N/A VAL 56.A N VAL 52.A O no hydrogen 3.235 N/A VAL 57.A N MET 53.A O no hydrogen 2.833 N/A LYS 58.A N GLU 54.A O no hydrogen 3.070 N/A LYS 58.A NZ GLN 55.A OE1 no hydrogen 3.001 N/A LYS 58.A NZ ASP 230.A OD2 no hydrogen 2.581 N/A TYR 59.A N VAL 56.A O no hydrogen 3.201 N/A SER 60.A N VAL 57.A O no hydrogen 3.274 N/A SER 60.A OG VAL 56.A O no hydrogen 2.583 N/A GLY 63.A N ASP 85.A O no hydrogen 2.717 N/A THR 64.A N PRO 61.A O no hydrogen 3.280 N/A THR 64.A OG1 PRO 61.A O no hydrogen 2.608 N/A VAL 65.A N MET 4.A O no hydrogen 2.989 N/A HIS 66.A N TYR 87.A O no hydrogen 2.913 N/A HIS 66.A ND1 THR 6.A OG1 no hydrogen 2.693 N/A HIS 66.A NE2 GLN 86.A OE1 no hydrogen 2.752 N/A VAL 67.A N THR 6.A O no hydrogen 2.875 N/A GLY 68.A N VAL 89.A O no hydrogen 2.954 N/A VAL 69.A N THR 8.A O no hydrogen 2.837 N/A VAL 74.A N ASP 71.A O no hydrogen 3.242 N/A ARG 77.A NE ASP 71.A OD1 no hydrogen 2.840 N/A ARG 77.A NH1 ARG 77.A O no hydrogen 2.923 N/A ARG 77.A NH2 ASP 71.A OD1 no hydrogen 3.562 N/A ARG 77.A NH2 ASP 71.A OD2 no hydrogen 2.678 N/A ARG 77.A NH2 HIS 129.A ND1 no hydrogen 2.951 N/A ARG 78.A NE ASP 92.A OD2 no hydrogen 3.051 N/A ARG 78.A NH2 ASP 92.A OD2 no hydrogen 2.883 N/A ARG 78.A NH2 SER 158.A OG no hydrogen 3.190 N/A ILE 80.A N VAL 90.A O no hydrogen 2.914 N/A VAL 81.A N TYR 109.A O no hydrogen 2.858 N/A ILE 82.A N LEU 88.A O no hydrogen 2.721 N/A GLU 83.A N SER 107.A O no hydrogen 2.662 N/A ASP 85.A N LYS 104.A O no hydrogen 3.110 N/A GLN 86.A NE2 VAL 57.A O no hydrogen 3.118 N/A TYR 87.A N THR 64.A O no hydrogen 2.874 N/A TYR 87.A OH GLU 83.A OE2 no hydrogen 2.880 N/A LEU 88.A N ILE 82.A O no hydrogen 3.013 N/A VAL 89.A N HIS 66.A O no hydrogen 2.798 N/A VAL 90.A N ILE 80.A O no hydrogen 3.097 N/A ASP 92.A N ARG 78.A O no hydrogen 2.743 N/A ASN 93.A ND2 ILE 70.A O no hydrogen 2.880 N/A LEU 95.A N ASN 93.A OD1 no hydrogen 3.009 N/A THR 97.A N GLY 94.A O no hydrogen 2.948 N/A THR 97.A OG1 GLY 94.A O no hydrogen 2.885 N/A LEU 98.A N SER 50.A OG no hydrogen 2.970 N/A LEU 100.A N ALA 96.A O no hydrogen 2.962 N/A LYS 101.A N LEU 98.A O no hydrogen 3.138 N/A LYS 101.A NZ GLU 54.A OE2 no hydrogen 2.924 N/A LYS 101.A NZ GLU 191.A OE1 no hydrogen 2.780 N/A LYS 101.A NZ GLU 191.A OE2 no hydrogen 3.145 N/A LYS 101.A NZ TYR 231.A OH no hydrogen 3.019 N/A HIS 102.A N PRO 99.A O no hydrogen 2.969 N/A HIS 102.A NE2 GLU 54.A OE2 no hydrogen 2.808 N/A ILE 103.A N LEU 100.A O no hydrogen 3.473 N/A LYS 104.A N ASP 85.A OD2 no hydrogen 3.112 N/A LYS 106.A N GLU 83.A O no hydrogen 2.684 N/A SER 107.A N GLU 83.A O no hydrogen 3.056 N/A SER 107.A OG GLU 83.A OE1 no hydrogen 2.717 N/A SER 107.A OG TYR 109.A OH no hydrogen 3.319 N/A TYR 109.A N VAL 81.A O no hydrogen 2.829 N/A TYR 109.A OH GLU 83.A OE1 no hydrogen 3.212 N/A TYR 109.A OH GLU 148.A OE2 no hydrogen 2.794 N/A GLU 110.A N ARG 152.A O no hydrogen 2.893 N/A ILE 111.A N ALA 79.A O no hydrogen 2.825 N/A ILE 112.A N PHE 150.A O no hydrogen 2.857 N/A LYS 115.A N ILE 112.A O no hydrogen 2.904 N/A LYS 115.A NZ GLU 148.A O no hydrogen 3.557 N/A ILE 116.A N ILE 112.A O no hydrogen 3.156 N/A ARG 117.A N PRO 113.A O no hydrogen 2.898 N/A PHE 119.A N ILE 116.A O no hydrogen 2.714 N/A THR 120.A N ILE 116.A O no hydrogen 3.124 N/A THR 120.A OG1 ARG 117.A O no hydrogen 3.549 N/A GLY 121.A N ARG 117.A O no hydrogen 2.905 N/A TRP 122.A NE1 ASP 132.A OD2 no hydrogen 2.646 N/A SER 125.A N ASP 132.A OD1 no hydrogen 2.874 N/A SER 125.A OG ASP 132.A OD1 no hydrogen 2.682 N/A PHE 128.A N SER 125.A OG no hydrogen 2.931 N/A HIS 129.A NE2 SER 125.A O no hydrogen 2.945 N/A ARG 131.A NE ASP 132.A OD2 no hydrogen 2.791 N/A ARG 131.A NH1 GLU 20.A OE1 no hydrogen 2.911 N/A ARG 131.A NH2 ASP 132.A OD1 no hydrogen 3.114 N/A ARG 131.A NH2 ASP 132.A OD2 no hydrogen 3.522 N/A ASP 132.A N PHE 128.A O no hydrogen 3.220 N/A ILE 133.A N HIS 129.A O no hydrogen 2.799 N/A PHE 134.A N HIS 129.A O no hydrogen 2.816 N/A GLY 135.A N GLY 130.A O no hydrogen 2.906 N/A ALA 137.A N ILE 133.A O no hydrogen 2.923 N/A GLY 138.A N PHE 134.A O no hydrogen 2.967 N/A ALA 139.A N GLY 135.A O no hydrogen 2.909 N/A LEU 140.A N PRO 136.A O no hydrogen 2.810 N/A ILE 141.A N ALA 137.A O no hydrogen 2.895 N/A GLU 142.A N GLY 138.A O no hydrogen 3.046 N/A LYS 143.A N ALA 139.A O no hydrogen 2.965 N/A LYS 143.A NZ ILE 28.A O no hydrogen 3.111 N/A GLY 144.A N ILE 141.A O no hydrogen 3.132 N/A ILE 145.A N LEU 140.A O no hydrogen 2.915 N/A HIS 146.A N GLU 149.A OE1 no hydrogen 3.409 N/A GLU 148.A N GLU 148.A OE1 no hydrogen 2.641 N/A GLU 149.A N HIS 146.A O no hydrogen 2.872 N/A PHE 150.A N PRO 147.A O no hydrogen 3.110 N/A ARG 152.A N GLU 110.A O no hydrogen 2.956 N/A ARG 152.A NE GLU 110.A OE1 no hydrogen 3.373 N/A ARG 152.A NH2 GLU 110.A OE1 no hydrogen 3.129 N/A ILE 154.A N VAL 108.A O no hydrogen 2.912 N/A SER 158.A N PRO 155.A O no hydrogen 3.179 N/A SER 158.A OG PRO 155.A O no hydrogen 2.845 N/A VAL 160.A N ASP 92.A OD1 no hydrogen 2.740 N/A LEU 162.A N THR 97.A OG1 no hydrogen 2.904 N/A ARG 167.A N ILE 174.A O no hydrogen 3.199 N/A LYS 168.A NZ GLY 170.A O no hydrogen 3.435 N/A GLU 169.A N VAL 172.A O no hydrogen 2.677 N/A VAL 172.A N GLU 169.A O no hydrogen 2.982 N/A TRP 173.A N VAL 255.A O no hydrogen 2.927 N/A ILE 174.A N ARG 167.A O no hydrogen 2.684 N/A LEU 175.A N LEU 253.A O no hydrogen 2.915 N/A LYS 176.A N ASN 189.A OD1 no hydrogen 2.739 N/A LYS 176.A NZ ASN 163.A O no hydrogen 3.053 N/A VAL 177.A N ASP 251.A O no hydrogen 2.868 N/A ILE 178.A N ILE 187.A O no hydrogen 2.912 N/A ILE 180.A N GLU 48.A OE1 no hydrogen 3.339 N/A ASP 181.A N ASN 185.A O no hydrogen 3.115 N/A PHE 183.A N ASP 181.A OD1 no hydrogen 2.892 N/A GLY 184.A N ASP 181.A O no hydrogen 2.950 N/A ASN 185.A N ASP 181.A OD1 no hydrogen 2.891 N/A ASN 185.A ND2 ASP 181.A OD2 no hydrogen 2.843 N/A VAL 186.A N ILE 234.A O no hydrogen 2.872 N/A ILE 187.A N TYR 179.A O no hydrogen 2.839 N/A LEU 188.A N LEU 232.A O no hydrogen 2.872 N/A ASN 189.A N LYS 176.A O no hydrogen 3.019 N/A ASN 189.A ND2 VAL 164.A O no hydrogen 2.877 N/A LEU 190.A N LEU 188.A O no hydrogen 2.737 N/A TYR 193.A OH TYR 210.A OH no hydrogen 2.836 N/A TYR 193.A OH TYR 231.A O no hydrogen 2.821 N/A LYS 195.A NZ GLU 212.A OE2 no hydrogen 3.039 N/A ARG 197.A N LEU 258.A O no hydrogen 2.955 N/A THR 198.A N LEU 258.A O no hydrogen 3.076 N/A VAL 199.A N LEU 208.A O no hydrogen 2.884 N/A GLU 200.A N ARG 256.A O no hydrogen 2.785 N/A LEU 201.A N LEU 206.A O no hydrogen 2.967 N/A LEU 202.A N ARG 254.A O no hydrogen 3.024 N/A PHE 204.A N LEU 201.A O no hydrogen 3.065 N/A LEU 208.A N VAL 199.A O no hydrogen 2.827 N/A TYR 210.A N ARG 197.A O no hydrogen 3.095 N/A TYR 210.A OH TYR 193.A OH no hydrogen 2.836 N/A LEU 211.A N ALA 224.A O no hydrogen 2.809 N/A TYR 214.A OH GLU 233.A OE2 no hydrogen 2.616 N/A LEU 216.A N THR 213.A O no hydrogen 3.212 N/A VAL 217.A N TYR 214.A O no hydrogen 3.326 N/A GLY 220.A N ASN 237.A O no hydrogen 2.857 N/A GLU 221.A N GLU 218.A O no hydrogen 3.123 N/A LEU 223.A N ALA 235.A O no hydrogen 2.795 N/A ALA 224.A N PRO 209.A O no hydrogen 3.076 N/A LEU 225.A N GLU 233.A O no hydrogen 2.865 N/A HIS 229.A NE2.A GLU 233.A OE1 no hydrogen 3.090 N/A TYR 231.A N HIS 229.A ND1.A no hydrogen 3.184 N/A TYR 231.A OH GLU 54.A OE1 no hydrogen 2.740 N/A TYR 231.A OH GLU 54.A OE2 no hydrogen 3.363 N/A LEU 232.A N LEU 188.A O no hydrogen 3.462 N/A GLU 233.A N LEU 225.A O no hydrogen 2.945 N/A ILE 234.A N VAL 186.A O no hydrogen 2.813 N/A ALA 235.A N LEU 223.A O no hydrogen 2.903 N/A ASN 237.A N GLU 221.A O no hydrogen 2.884 N/A ASN 237.A ND2 VAL 217.A O no hydrogen 2.935 N/A GLY 239.A N VAL 236.A O no hydrogen 2.999 N/A ALA 242.A N GLY 184.A O no hydrogen 2.855 N/A GLU 243.A N SER 240.A OG no hydrogen 3.072 N/A ARG 244.A N SER 240.A O no hydrogen 3.063 N/A ARG 244.A NH1 GLY 220.A O no hydrogen 2.931 N/A ARG 244.A NH2 GLY 220.A O no hydrogen 2.873 N/A LEU 245.A N ALA 241.A O no hydrogen 2.883 N/A VAL 247.A N ALA 242.A O no hydrogen 3.130 N/A LYS 248.A N ASP 251.A OD2 no hydrogen 2.860 N/A GLY 250.A N VAL 177.A O no hydrogen 2.803 N/A ASP 251.A N LYS 248.A O no hydrogen 3.045 N/A LEU 253.A N LEU 175.A O no hydrogen 2.716 N/A ARG 254.A N ASP 203.A OD2 no hydrogen 2.954 N/A ARG 254.A NE ASP 203.A OD1 no hydrogen 3.017 N/A ARG 254.A NH2 ASP 203.A OD1 no hydrogen 3.082 N/A VAL 255.A N TRP 173.A O no hydrogen 2.882 N/A ARG 256.A N GLU 200.A O no hydrogen 2.953 N/A ARG 256.A NE GLU 200.A OE1 no hydrogen 2.952 N/A ARG 256.A NH2 GLU 200.A OE1 no hydrogen 2.841 N/A LEU 258.A N THR 198.A O no hydrogen 2.951 N/A