Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7cmu_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N TYR 1.A O no hydrogen 3.136 N/A CYS 6.A N ALA 2.A O no hydrogen 2.915 N/A CYS 6.A SG ALA 2.A O no hydrogen 3.435 N/A ALA 7.A N LEU 3.A O no hydrogen 2.895 N/A LEU 8.A N SER 4.A O no hydrogen 2.898 N/A ILE 9.A N TYR 5.A O no hydrogen 2.887 N/A LEU 10.A N CYS 6.A O no hydrogen 2.916 N/A ALA 11.A N ALA 7.A O no hydrogen 2.909 N/A ILE 12.A N LEU 8.A O no hydrogen 2.887 N/A VAL 13.A N ILE 9.A O no hydrogen 2.920 N/A PHE 14.A N LEU 10.A O no hydrogen 2.926 N/A GLY 15.A N ALA 11.A O no hydrogen 2.912 N/A ASN 16.A N ILE 12.A O no hydrogen 2.934 N/A ASN 16.A ND2 ASP 44.A OD2 no hydrogen 3.101 N/A GLY 17.A N VAL 13.A O no hydrogen 2.896 N/A LEU 18.A N PHE 14.A O no hydrogen 2.919 N/A VAL 19.A N GLY 15.A O no hydrogen 2.923 N/A CYS 20.A N ASN 16.A O no hydrogen 2.896 N/A MET 21.A N GLY 17.A O no hydrogen 2.908 N/A ALA 22.A N LEU 18.A O no hydrogen 2.901 N/A VAL 23.A N VAL 19.A O no hydrogen 2.927 N/A LEU 24.A N CYS 20.A O no hydrogen 2.902 N/A LYS 25.A N MET 21.A O no hydrogen 2.901 N/A GLU 26.A N ALA 22.A O no hydrogen 3.099 N/A ALA 28.A N GLU 26.A OE2 no hydrogen 2.885 N/A LEU 29.A N GLU 26.A O no hydrogen 3.327 N/A LEU 29.A N GLU 26.A OE1 no hydrogen 2.599 N/A GLN 30.A N ARG 27.A O no hydrogen 2.988 N/A THR 32.A N GLY 110.A O no hydrogen 3.410 N/A THR 32.A OG1 GLY 110.A O no hydrogen 2.753 N/A THR 33.A OG1 TYR 107.A OH no hydrogen 3.085 N/A ASN 34.A ND2 LEU 29.A O no hydrogen 2.737 N/A TYR 35.A N THR 32.A O no hydrogen 3.120 N/A VAL 38.A N ASN 34.A O no hydrogen 2.900 N/A SER 39.A N TYR 35.A O no hydrogen 2.878 N/A SER 39.A OG ASN 89.A OD1 no hydrogen 2.897 N/A LEU 40.A N LEU 36.A O no hydrogen 2.923 N/A ALA 41.A N VAL 37.A O no hydrogen 2.887 N/A VAL 42.A N VAL 38.A O no hydrogen 2.882 N/A ALA 43.A N SER 39.A O no hydrogen 2.910 N/A ASP 44.A N LEU 40.A O no hydrogen 2.908 N/A LEU 45.A N ALA 41.A O no hydrogen 2.878 N/A LEU 46.A N VAL 42.A O no hydrogen 2.917 N/A VAL 47.A N ALA 43.A O no hydrogen 2.904 N/A ALA 48.A N ASP 44.A O no hydrogen 2.877 N/A THR 49.A N LEU 45.A O no hydrogen 2.919 N/A THR 49.A OG1 LEU 45.A O no hydrogen 3.244 N/A THR 49.A OG1 LEU 46.A O no hydrogen 2.925 N/A LEU 50.A N LEU 46.A O no hydrogen 2.930 N/A VAL 51.A N VAL 47.A O no hydrogen 3.219 N/A VAL 55.A N VAL 51.A O no hydrogen 3.091 N/A VAL 56.A N MET 52.A O no hydrogen 2.829 N/A TYR 57.A N PRO 53.A O no hydrogen 2.936 N/A LEU 58.A N TRP 54.A O no hydrogen 2.912 N/A GLU 59.A N VAL 55.A O no hydrogen 2.879 N/A VAL 60.A N VAL 56.A O no hydrogen 2.888 N/A THR 61.A N TYR 57.A O no hydrogen 2.905 N/A THR 61.A OG1 TYR 57.A O no hydrogen 2.983 N/A THR 61.A OG1 LEU 58.A O no hydrogen 2.980 N/A THR 61.A OG1 VAL 64.A O no hydrogen 3.067 N/A GLY 62.A N GLU 59.A O no hydrogen 3.147 N/A GLY 63.A N LEU 58.A O no hydrogen 2.780 N/A TRP 65.A N THR 148.A O no hydrogen 2.972 N/A TRP 65.A NE1 SER 68.A O no hydrogen 3.248 N/A CYS 71.A N SER 68.A O no hydrogen 3.094 N/A CYS 72.A N SER 68.A O no hydrogen 3.432 N/A ASP 73.A N ARG 69.A O no hydrogen 2.913 N/A VAL 74.A N ILE 70.A O no hydrogen 2.894 N/A PHE 75.A N CYS 71.A O no hydrogen 2.889 N/A VAL 76.A N CYS 72.A O no hydrogen 2.930 N/A THR 77.A N ASP 73.A O no hydrogen 2.908 N/A THR 77.A OG1 ASP 73.A O no hydrogen 2.801 N/A THR 77.A OG1 ASP 73.A OD1 no hydrogen 3.485 N/A LEU 78.A N VAL 74.A O no hydrogen 2.885 N/A ASP 79.A N PHE 75.A O no hydrogen 2.931 N/A VAL 80.A N VAL 76.A O no hydrogen 2.944 N/A MET 81.A N THR 77.A O no hydrogen 2.915 N/A MET 82.A N LEU 78.A O no hydrogen 2.910 N/A CYS 83.A N ASP 79.A O no hydrogen 2.966 N/A THR 84.A N VAL 80.A O no hydrogen 2.918 N/A THR 84.A OG1 VAL 80.A O no hydrogen 3.466 N/A THR 84.A OG1 SER 165.A OG no hydrogen 2.953 N/A ALA 85.A N MET 81.A O no hydrogen 2.883 N/A SER 86.A N MET 82.A O no hydrogen 2.910 N/A SER 86.A OG MET 82.A O no hydrogen 2.989 N/A ILE 87.A N CYS 83.A O no hydrogen 2.987 N/A LEU 88.A N THR 84.A O no hydrogen 2.907 N/A ASN 89.A N ALA 85.A O no hydrogen 2.841 N/A ASN 89.A ND2 ALA 85.A O no hydrogen 2.664 N/A LEU 90.A N SER 86.A O no hydrogen 2.964 N/A CYS 91.A N ILE 87.A O no hydrogen 2.970 N/A CYS 91.A SG PRO 169.A O no hydrogen 3.960 N/A CYS 91.A SG THR 173.A OG1 no hydrogen 3.714 N/A ALA 92.A N LEU 88.A O no hydrogen 2.840 N/A ILE 93.A N ASN 89.A O no hydrogen 2.899 N/A SER 94.A N LEU 90.A O no hydrogen 2.974 N/A ILE 95.A N CYS 91.A O no hydrogen 2.903 N/A ASP 96.A N ALA 92.A O no hydrogen 2.866 N/A ARG 97.A N ILE 93.A O no hydrogen 2.960 N/A ARG 97.A NH1 TYR 177.A OH no hydrogen 3.317 N/A TYR 98.A N SER 94.A O no hydrogen 2.929 N/A THR 99.A N ILE 95.A O no hydrogen 2.869 N/A THR 99.A OG1 ILE 95.A O no hydrogen 2.978 N/A ALA 100.A N ASP 96.A O no hydrogen 2.921 N/A VAL 101.A N ARG 97.A O no hydrogen 2.927 N/A VAL 102.A N TYR 98.A O no hydrogen 2.887 N/A MET 103.A N THR 99.A O no hydrogen 2.695 N/A TYR 107.A OH ASP 96.A OD2 no hydrogen 2.802 N/A GLY 110.A N TYR 107.A O no hydrogen 2.841 N/A THR 111.A OG1 HIS 109.A O no hydrogen 2.826 N/A CYS 116.A N GLY 112.A O no hydrogen 3.083 N/A CYS 116.A SG GLY 112.A O no hydrogen 3.324 N/A ARG 117.A N GLN 113.A O no hydrogen 2.898 N/A ARG 118.A N SER 114.A O no hydrogen 3.235 N/A VAL 119.A N SER 115.A O no hydrogen 2.932 N/A ALA 120.A N CYS 116.A O no hydrogen 2.905 N/A LEU 121.A N ARG 117.A O no hydrogen 2.890 N/A MET 122.A N ARG 118.A O no hydrogen 2.896 N/A ILE 123.A N VAL 119.A O no hydrogen 2.948 N/A THR 124.A N ALA 120.A O no hydrogen 2.894 N/A THR 124.A OG1 ALA 120.A O no hydrogen 2.752 N/A ALA 125.A N LEU 121.A O no hydrogen 2.865 N/A VAL 126.A N MET 122.A O no hydrogen 2.900 N/A TRP 127.A N ILE 123.A O no hydrogen 2.968 N/A VAL 128.A N THR 124.A O no hydrogen 2.868 N/A LEU 129.A N ALA 125.A O no hydrogen 2.862 N/A ALA 130.A N VAL 126.A O no hydrogen 2.954 N/A PHE 131.A N TRP 127.A O no hydrogen 2.926 N/A ALA 132.A N VAL 128.A O no hydrogen 2.865 N/A VAL 133.A N LEU 129.A O no hydrogen 2.893 N/A SER 134.A N ALA 130.A O no hydrogen 2.947 N/A SER 134.A OG THR 77.A O no hydrogen 2.695 N/A CYS 135.A N PHE 131.A O no hydrogen 2.881 N/A CYS 135.A SG ALA 132.A O no hydrogen 2.873 N/A LEU 137.A N SER 134.A O no hydrogen 3.317 N/A LEU 138.A N CYS 135.A O no hydrogen 2.902 N/A PHE 139.A N PRO 136.A O no hydrogen 3.163 N/A GLY 140.A N LEU 137.A O no hydrogen 3.106 N/A PHE 141.A N PRO 136.A O no hydrogen 3.380 N/A THR 143.A N PHE 141.A O no hydrogen 2.730 N/A THR 148.A N ASP 146.A OD1 no hydrogen 3.377 N/A THR 148.A OG1 TRP 65.A O no hydrogen 3.508 N/A VAL 149.A N ASP 146.A O no hydrogen 3.182 N/A CYS 150.A SG CYS 72.A O no hydrogen 3.737 N/A SER 151.A OG SER 153.A OG no hydrogen 3.394 N/A SER 153.A OG SER 151.A OG no hydrogen 3.394 N/A ASN 154.A ND2 PHE 141.A O no hydrogen 3.025 N/A ASP 156.A N ASN 154.A OD1 no hydrogen 3.117 N/A VAL 158.A N ASN 154.A O no hydrogen 3.022 N/A SER 161.A N PHE 157.A O no hydrogen 2.909 N/A SER 161.A OG PHE 157.A O no hydrogen 2.848 N/A SER 161.A OG VAL 158.A O no hydrogen 2.776 N/A SER 162.A N VAL 158.A O no hydrogen 2.891 N/A SER 162.A OG VAL 158.A O no hydrogen 2.871 N/A VAL 163.A N ILE 159.A O no hydrogen 2.905 N/A VAL 164.A N TYR 160.A O no hydrogen 2.944 N/A SER 165.A N SER 161.A O no hydrogen 2.879 N/A SER 165.A OG THR 84.A OG1 no hydrogen 2.953 N/A PHE 166.A N SER 162.A O no hydrogen 2.922 N/A LEU 168.A N VAL 163.A O no hydrogen 3.278 N/A PHE 170.A N PHE 166.A O no hydrogen 2.482 N/A GLY 171.A N TYR 167.A O no hydrogen 2.866 N/A VAL 172.A N LEU 168.A O no hydrogen 2.926 N/A THR 173.A N PRO 169.A O no hydrogen 2.868 N/A THR 173.A OG1 PRO 169.A O no hydrogen 2.897 N/A VAL 174.A N PHE 170.A O no hydrogen 2.914 N/A LEU 175.A N GLY 171.A O no hydrogen 2.922 N/A VAL 176.A N VAL 172.A O no hydrogen 2.879 N/A TYR 177.A N THR 173.A O no hydrogen 2.899 N/A ALA 178.A N VAL 174.A O no hydrogen 2.925 N/A ARG 179.A N LEU 175.A O no hydrogen 2.895 N/A ILE 180.A N VAL 176.A O no hydrogen 2.899 N/A TYR 181.A N TYR 177.A O no hydrogen 2.902 N/A VAL 182.A N ALA 178.A O no hydrogen 2.920 N/A VAL 183.A N ARG 179.A O no hydrogen 2.860 N/A LEU 184.A N ILE 180.A O no hydrogen 2.935 N/A LYS 185.A N TYR 181.A O no hydrogen 2.960 N/A LYS 185.A NZ GLU 196.A OE1 no hydrogen 3.225 N/A LYS 185.A NZ GLU 196.A OE2 no hydrogen 3.478 N/A GLN 186.A N VAL 182.A O no hydrogen 2.862 N/A GLN 186.A NE2 GLN 186.A O no hydrogen 3.418 N/A ARG 187.A N VAL 183.A O no hydrogen 2.898 N/A ARG 188.A N LEU 184.A O no hydrogen 2.920 N/A ARG 189.A N LYS 185.A O no hydrogen 2.919 N/A LYS 190.A N GLN 186.A O no hydrogen 2.875 N/A ARG 191.A N ARG 187.A O no hydrogen 2.916 N/A ILE 192.A N ARG 188.A O no hydrogen 3.078 N/A LYS 198.A N LEU 194.A O no hydrogen 2.872 N/A ALA 199.A N ARG 195.A O no hydrogen 2.928 N/A THR 200.A N GLU 196.A O no hydrogen 2.914 N/A THR 200.A OG1 GLU 196.A O no hydrogen 3.286 N/A THR 200.A OG1 GLU 196.A OE2 no hydrogen 3.125 N/A GLN 201.A N LYS 197.A O no hydrogen 2.862 N/A MET 202.A N LYS 198.A O no hydrogen 2.875 N/A VAL 203.A N ALA 199.A O no hydrogen 2.966 N/A ALA 204.A N THR 200.A O no hydrogen 2.891 N/A ILE 205.A N GLN 201.A O no hydrogen 2.858 N/A VAL 206.A N MET 202.A O no hydrogen 2.943 N/A LEU 207.A N VAL 203.A O no hydrogen 2.952 N/A GLY 208.A N ALA 204.A O no hydrogen 2.878 N/A ALA 209.A N ILE 205.A O no hydrogen 2.879 N/A PHE 210.A N VAL 206.A O no hydrogen 2.954 N/A ILE 211.A N LEU 207.A O no hydrogen 2.922 N/A VAL 212.A N GLY 208.A O no hydrogen 2.905 N/A CYS 213.A N ALA 209.A O no hydrogen 2.897 N/A CYS 213.A SG ALA 209.A O no hydrogen 3.100 N/A TRP 214.A N PHE 210.A O no hydrogen 2.961 N/A LEU 215.A N ILE 211.A O no hydrogen 2.906 N/A PHE 218.A N TRP 214.A O no hydrogen 3.127 N/A LEU 219.A N LEU 215.A O no hydrogen 2.924 N/A THR 220.A N PRO 216.A O no hydrogen 2.907 N/A THR 220.A OG1 PRO 216.A O no hydrogen 3.041 N/A HIS 221.A N PHE 217.A O no hydrogen 2.867 N/A VAL 222.A N PHE 218.A O no hydrogen 2.924 N/A LEU 223.A N LEU 219.A O no hydrogen 2.931 N/A ASN 224.A N THR 220.A O no hydrogen 2.897 N/A THR 225.A N HIS 221.A O no hydrogen 3.426 N/A THR 225.A OG1 HIS 221.A O no hydrogen 2.780 N/A HIS 226.A N VAL 222.A O no hydrogen 2.923 N/A HIS 226.A ND1 VAL 222.A O no hydrogen 3.285 N/A HIS 226.A NE2 PRO 155.A O no hydrogen 3.075 N/A CYS 227.A N LEU 223.A O no hydrogen 2.668 N/A GLN 228.A N GLN 228.A OE1 no hydrogen 2.619 N/A CYS 230.A SG THR 229.A O no hydrogen 3.516 N/A SER 233.A OG GLU 235.A OE1 no hydrogen 3.124 N/A GLU 235.A N GLU 235.A OE1 no hydrogen 2.706 N/A LEU 236.A N SER 233.A OG no hydrogen 3.413 N/A TYR 237.A N SER 233.A O no hydrogen 3.240 N/A SER 238.A N PRO 234.A O no hydrogen 2.903 N/A SER 238.A OG PRO 234.A O no hydrogen 3.324 N/A SER 238.A OG GLU 235.A O no hydrogen 2.578 N/A ALA 239.A N GLU 235.A O no hydrogen 2.900 N/A THR 240.A N LEU 236.A O no hydrogen 2.913 N/A THR 240.A OG1 LEU 236.A O no hydrogen 3.261 N/A THR 240.A OG1 TYR 237.A O no hydrogen 2.656 N/A THR 241.A N TYR 237.A O no hydrogen 2.893 N/A THR 241.A OG1 TYR 237.A O no hydrogen 2.934 N/A TRP 242.A N SER 238.A O no hydrogen 2.908 N/A LEU 243.A N ALA 239.A O no hydrogen 2.903 N/A GLY 244.A N THR 240.A O no hydrogen 2.889 N/A TYR 245.A N THR 241.A O no hydrogen 2.901 N/A TYR 245.A OH ASP 79.A OD1 no hydrogen 3.107 N/A VAL 246.A N TRP 242.A O no hydrogen 2.923 N/A SER 248.A N TYR 245.A O no hydrogen 3.154 N/A SER 248.A OG ASP 44.A OD1 no hydrogen 3.107 N/A LEU 250.A N VAL 246.A O no hydrogen 2.931 N/A ASN 251.A N ASN 247.A O no hydrogen 2.891 N/A ILE 254.A N LEU 250.A O no hydrogen 3.296 N/A TYR 255.A N ASN 251.A O no hydrogen 2.935 N/A THR 256.A N PRO 252.A O no hydrogen 2.886 N/A THR 256.A OG1 PRO 252.A O no hydrogen 2.458 N/A THR 257.A N VAL 253.A O no hydrogen 2.891 N/A THR 257.A OG1 VAL 253.A O no hydrogen 2.921 N/A ASN 259.A N THR 256.A O no hydrogen 3.079 N/A GLU 261.A N GLU 261.A OE1 no hydrogen 2.720 N/A ARG 263.A N ASN 259.A O no hydrogen 2.775 N/A LYS 264.A N ILE 260.A O no hydrogen 2.907 N/A ALA 265.A N GLU 261.A O no hydrogen 2.920 N/A PHE 266.A N PHE 262.A O no hydrogen 2.890 N/A LEU 267.A N ARG 263.A O no hydrogen 2.905 N/A LYS 268.A N LYS 264.A O no hydrogen 2.901 N/A ILE 269.A N ALA 265.A O no hydrogen 2.912 N/A LEU 270.A N PHE 266.A O no hydrogen 2.894 N/A SER 271.A N LEU 267.A O no hydrogen 2.904 N/A CYS 272.A N ILE 269.A O no hydrogen 3.292 N/A CYS 272.A SG LYS 268.A O no hydrogen 3.734 N/A