Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6zdi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N SER 28.A O no hydrogen 3.007 N/A LYS 6.A N TYR 3.A O no hydrogen 3.368 N/A VAL 7.A N ASP 80.A OD2 no hydrogen 2.796 N/A VAL 8.A N ARG 31.A O no hydrogen 2.852 N/A VAL 9.A N CYS 81.A O no hydrogen 2.929 N/A VAL 10.A N VAL 33.A O no hydrogen 3.081 N/A THR 11.A N VAL 83.A O no hydrogen 3.016 N/A GLY 13.A N CYS 35.A O no hydrogen 2.994 N/A GLY 14.A N ASP 36.A OD2 no hydrogen 2.983 N/A ARG 15.A NH1 GLU 190.A OE1 no hydrogen 3.446 N/A ARG 15.A NH1 GLU 190.A OE2 no hydrogen 3.029 N/A ARG 15.A NH2 GLU 190.A OE2 no hydrogen 3.204 N/A ALA 19.A N ARG 15.A O no hydrogen 3.275 N/A GLY 20.A N GLY 16.A O no hydrogen 3.064 N/A ILE 21.A N ILE 17.A O no hydrogen 2.795 N/A VAL 22.A N GLY 18.A O no hydrogen 2.733 N/A ARG 23.A N ALA 19.A O no hydrogen 2.994 N/A ARG 23.A NH1 GLU 48.A OE1 no hydrogen 2.890 N/A ARG 23.A NH1 GLU 48.A OE2 no hydrogen 3.279 N/A ARG 23.A NH2 GLU 48.A OE2 no hydrogen 2.731 N/A ALA 24.A N GLY 20.A O no hydrogen 2.913 N/A PHE 25.A N ILE 21.A O no hydrogen 3.050 N/A VAL 26.A N VAL 22.A O no hydrogen 3.024 N/A ASN 27.A N ARG 23.A O no hydrogen 2.960 N/A SER 28.A N ALA 24.A O no hydrogen 3.140 N/A SER 28.A N PHE 25.A O no hydrogen 3.082 N/A SER 28.A OG ALA 24.A O no hydrogen 3.161 N/A GLY 29.A N VAL 26.A O no hydrogen 2.964 N/A ALA 30.A N PHE 25.A O no hydrogen 3.124 N/A ARG 31.A N LYS 6.A O no hydrogen 2.960 N/A VAL 32.A N GLY 51.A O.A no hydrogen 2.931 N/A VAL 32.A N GLY 51.A O.B no hydrogen 2.776 N/A VAL 33.A N VAL 8.A O no hydrogen 2.650 N/A ILE 34.A N VAL 53.A O no hydrogen 2.639 N/A CYS 35.A N VAL 10.A O no hydrogen 2.846 N/A CYS 35.A SG CYS 57.A O no hydrogen 3.632 N/A ASP 38.A N ASP 36.A OD1 no hydrogen 3.011 N/A ARG 43.A N GLU 39.A O no hydrogen 3.002 N/A ALA 44.A N SER 40.A O no hydrogen 3.462 N/A LEU 45.A N GLY 41.A O no hydrogen 2.972 N/A GLU 46.A N GLY 42.A O no hydrogen 2.990 N/A GLN 47.A N ARG 43.A O no hydrogen 3.113 N/A GLU 48.A N ALA 44.A O no hydrogen 2.932 N/A LEU 49.A N LEU 45.A O no hydrogen 2.914 N/A ALA 52.A N LEU 49.A O no hydrogen 3.214 N/A VAL 53.A N VAL 32.A O no hydrogen 2.979 N/A PHE 54.A N GLU 46.A OE1 no hydrogen 3.089 N/A ILE 55.A N ILE 34.A O no hydrogen 2.833 N/A CYS 57.A N ASP 36.A O no hydrogen 3.085 N/A ASP 58.A N ASP 64.A OD2 no hydrogen 3.106 N/A THR 60.A N ASP 58.A OD1 no hydrogen 2.995 N/A THR 60.A OG1 ASP 58.A OD1 no hydrogen 2.620 N/A GLN 61.A N ASP 58.A O no hydrogen 2.878 N/A GLN 61.A NE2 THR 60.A OG1 no hydrogen 3.336 N/A VAL 65.A N GLN 61.A O no hydrogen 3.132 N/A LYS 66.A N GLU 62.A O no hydrogen 2.789 N/A THR 67.A N ASP 63.A O no hydrogen 2.879 N/A THR 67.A OG1 ASP 63.A O no hydrogen 3.509 N/A LEU 68.A N ASP 64.A O no hydrogen 2.730 N/A VAL 69.A N VAL 65.A O no hydrogen 3.016 N/A SER 70.A N LYS 66.A O no hydrogen 3.092 N/A SER 70.A OG LYS 66.A O no hydrogen 3.267 N/A SER 70.A OG THR 67.A O no hydrogen 3.065 N/A GLU 71.A N THR 67.A O no hydrogen 2.803 N/A THR 72.A N LEU 68.A O no hydrogen 3.032 N/A THR 72.A OG1 LEU 68.A O no hydrogen 2.871 N/A ILE 73.A N VAL 69.A O no hydrogen 3.035 N/A ARG 74.A N SER 70.A O no hydrogen 2.951 N/A ARG 74.A NE GLU 71.A OE1 no hydrogen 2.877 N/A ARG 74.A NH1 GLU 71.A OE2 no hydrogen 2.926 N/A ARG 75.A N GLU 71.A O no hydrogen 2.882 N/A PHE 76.A N THR 72.A O no hydrogen 2.832 N/A GLY 77.A N ILE 73.A O no hydrogen 2.664 N/A ARG 78.A NE ASP 80.A OD1 no hydrogen 3.200 N/A ARG 78.A NE ASP 80.A OD2 no hydrogen 2.837 N/A ARG 78.A NH1 ASP 80.A OD1 no hydrogen 2.700 N/A ASP 80.A N VAL 7.A O no hydrogen 2.894 N/A CYS 81.A N VAL 7.A O no hydrogen 3.207 N/A CYS 81.A SG ASN 131.A O no hydrogen 3.786 N/A CYS 81.A SG ASN 131.A OD1 no hydrogen 3.513 N/A VAL 82.A N ASN 131.A O no hydrogen 3.211 N/A VAL 83.A N VAL 9.A O no hydrogen 2.770 N/A ASN 84.A N ILE 133.A O no hydrogen 2.945 N/A ASN 84.A ND2 THR 118.A OG1 no hydrogen 2.941 N/A ASN 84.A ND2 ASN 134.A OD1 no hydrogen 2.847 N/A ASN 85.A N THR 11.A OG1 no hydrogen 3.088 N/A ASN 85.A ND2 THR 11.A O no hydrogen 3.266 N/A ALA 86.A N THR 11.A OG1 no hydrogen 2.808 N/A HIS 88.A N ASN 110.A OD1 no hydrogen 2.870 N/A HIS 89.A ND1 PRO 90.A O no hydrogen 2.552 N/A HIS 89.A NE2 GLN 144.A OE1 no hydrogen 2.861 N/A GLN 93.A N GLN 146.A O no hydrogen 3.208 N/A ARG 94.A N GLU 97.A OE2 no hydrogen 3.114 N/A GLU 96.A N GLU 96.A OE2 no hydrogen 2.414 N/A GLU 97.A N ARG 94.A O no hydrogen 2.896 N/A THR 98.A N PRO 95.A O no hydrogen 3.170 N/A THR 98.A OG1 PRO 95.A O no hydrogen 2.663 N/A GLY 102.A N SER 99.A OG no hydrogen 2.928 N/A PHE 103.A N SER 99.A O no hydrogen 3.001 N/A ARG 104.A N ALA 100.A O no hydrogen 3.110 N/A GLN 105.A N GLN 101.A O no hydrogen 3.068 N/A LEU 106.A N GLY 102.A O no hydrogen 2.918 N/A LEU 107.A N PHE 103.A O no hydrogen 2.867 N/A GLU 108.A N ARG 104.A O no hydrogen 2.834 N/A LEU 109.A N GLN 105.A O no hydrogen 3.243 N/A ASN 110.A N LEU 106.A O no hydrogen 2.823 N/A ASN 110.A ND2 HIS 88.A O no hydrogen 3.133 N/A ASN 110.A ND2 THR 153.A OG1 no hydrogen 2.902 N/A LEU 111.A N LEU 107.A O no hydrogen 3.073 N/A LEU 112.A N LEU 107.A O no hydrogen 2.885 N/A GLY 113.A N GLU 108.A O no hydrogen 2.802 N/A THR 114.A OG1 ASN 110.A O no hydrogen 3.554 N/A TYR 115.A N LEU 111.A O no hydrogen 2.952 N/A THR 116.A N LEU 112.A O no hydrogen 2.883 N/A THR 116.A OG1 LEU 112.A O no hydrogen 3.032 N/A LEU 117.A N GLY 113.A O no hydrogen 3.331 N/A THR 118.A N THR 114.A O no hydrogen 3.169 N/A THR 118.A OG1 THR 114.A O no hydrogen 2.817 N/A LYS 119.A N TYR 115.A O no hydrogen 2.975 N/A LEU 120.A N THR 116.A O no hydrogen 2.989 N/A ALA 121.A N LEU 117.A O no hydrogen 2.855 N/A ALA 121.A N THR 118.A O no hydrogen 3.164 N/A LEU 122.A N THR 118.A O no hydrogen 2.861 N/A TYR 124.A N ALA 121.A O no hydrogen 2.938 N/A LEU 125.A N ALA 121.A O no hydrogen 3.025 N/A ARG 126.A N LEU 122.A O no hydrogen 2.819 N/A ARG 126.A NE GLU 168.A OE2 no hydrogen 2.905 N/A ARG 126.A NH2 GLU 168.A OE1 no hydrogen 2.823 N/A ARG 126.A NH2 GLU 168.A OE2 no hydrogen 3.237 N/A LYS 127.A N PRO 123.A O no hydrogen 3.466 N/A SER 128.A N TYR 124.A O no hydrogen 3.222 N/A SER 128.A N LEU 125.A O no hydrogen 3.258 N/A SER 128.A OG LEU 79.A O no hydrogen 2.731 N/A SER 128.A OG TYR 124.A O no hydrogen 3.425 N/A SER 128.A OG LEU 125.A O no hydrogen 3.342 N/A GLN 129.A N ARG 126.A O no hydrogen 3.346 N/A GLY 130.A N LEU 125.A O no hydrogen 2.758 N/A ASN 131.A N ASP 80.A O no hydrogen 2.875 N/A VAL 132.A N ARG 174.A O no hydrogen 2.899 N/A ILE 133.A N VAL 82.A O no hydrogen 2.878 N/A ASN 134.A N ASN 176.A O no hydrogen 2.929 N/A ASN 134.A ND2 THR 161.A OG1 no hydrogen 2.944 N/A ILE 135.A N ASN 84.A O no hydrogen 3.055 N/A SER 136.A N ILE 178.A O no hydrogen 2.734 N/A SER 136.A OG LYS 154.A O no hydrogen 3.127 N/A SER 136.A OG THR 158.A OG1 no hydrogen 2.888 N/A LEU 138.A N PRO 180.A O no hydrogen 2.996 N/A VAL 139.A N SER 137.A OG no hydrogen 3.128 N/A GLY 140.A N SER 137.A O no hydrogen 3.232 N/A ALA 141.A N LEU 138.A O no hydrogen 3.021 N/A ILE 142.A N LEU 138.A O no hydrogen 3.193 N/A GLY 143.A N VAL 139.A O no hydrogen 2.809 N/A VAL 151.A N ALA 147.A O no hydrogen 2.758 N/A ALA 152.A N VAL 148.A O no hydrogen 2.976 N/A THR 153.A N PRO 149.A O no hydrogen 2.935 N/A THR 153.A OG1 TYR 150.A O no hydrogen 2.712 N/A LYS 154.A N TYR 150.A O no hydrogen 3.144 N/A LYS 154.A NZ ILE 135.A O no hydrogen 2.932 N/A LYS 154.A NZ SER 136.A O no hydrogen 3.249 N/A GLY 155.A N VAL 151.A O no hydrogen 2.792 N/A ALA 156.A N ALA 152.A O no hydrogen 3.077 N/A VAL 157.A N THR 153.A O no hydrogen 3.172 N/A THR 158.A N LYS 154.A O no hydrogen 3.134 N/A THR 158.A OG1 SER 136.A OG no hydrogen 2.888 N/A THR 158.A OG1 LYS 154.A O no hydrogen 3.426 N/A ALA 159.A N GLY 155.A O no hydrogen 3.254 N/A MET 160.A N ALA 156.A O no hydrogen 2.795 N/A THR 161.A N VAL 157.A O no hydrogen 2.934 N/A THR 161.A OG1 VAL 157.A O no hydrogen 2.502 N/A LYS 162.A N THR 158.A O no hydrogen 3.350 N/A ALA 163.A N ALA 159.A O no hydrogen 3.008 N/A LEU 164.A N MET 160.A O no hydrogen 2.825 N/A ALA 165.A N THR 161.A O no hydrogen 3.036 N/A LEU 166.A N LYS 162.A O no hydrogen 3.166 N/A ASP 167.A N ALA 163.A O no hydrogen 3.185 N/A GLU 168.A N LEU 164.A O no hydrogen 2.915 N/A SER 169.A N ALA 165.A O no hydrogen 2.997 N/A SER 169.A OG LEU 166.A O no hydrogen 3.062 N/A TYR 171.A N GLU 168.A O no hydrogen 2.897 N/A GLY 172.A N SER 169.A O no hydrogen 3.110 N/A VAL 173.A N GLU 168.A O no hydrogen 3.322 N/A ARG 174.A NH1 LEU 227.A O no hydrogen 2.827 N/A ARG 174.A NH1 CYS 234.A O no hydrogen 3.476 N/A ARG 174.A NH2 LEU 227.A O no hydrogen 3.041 N/A VAL 175.A N THR 235.A OG1 no hydrogen 3.067 N/A ASN 176.A N VAL 132.A O no hydrogen 2.922 N/A ASN 176.A ND2 CYS 234.A O no hydrogen 3.067 N/A CYS 177.A N ILE 237.A O no hydrogen 2.994 N/A CYS 177.A SG ILE 237.A O no hydrogen 3.492 N/A ILE 178.A N ASN 134.A O no hydrogen 2.758 N/A SER 179.A N LEU 239.A O no hydrogen 2.815 N/A SER 179.A OG SER 137.A O no hydrogen 3.162 N/A SER 179.A OG GLU 238.A OE2 no hydrogen 2.545 N/A GLY 181.A N VAL 241.A O no hydrogen 2.823 N/A ASN 182.A ND2 GLN 209.A OE1 no hydrogen 2.618 N/A TRP 184.A N GLY 215.A O no hydrogen 3.031 N/A TRP 188.A N THR 185.A OG1 no hydrogen 3.217 N/A TRP 188.A NE1 ASN 182.A OD1 no hydrogen 2.874 N/A GLU 189.A N THR 185.A O no hydrogen 2.911 N/A GLU 190.A N PRO 186.A O no hydrogen 2.700 N/A LEU 191.A N LEU 187.A O no hydrogen 2.942 N/A ALA 192.A N TRP 188.A O no hydrogen 2.973 N/A ALA 193.A N GLU 189.A O no hydrogen 3.107 N/A LEU 194.A N LEU 191.A O no hydrogen 3.206 N/A MET 195.A N ALA 192.A O no hydrogen 2.795 N/A ALA 200.A N ASP 197.A OD2 no hydrogen 3.425 N/A SER 201.A N ASP 197.A O no hydrogen 2.996 N/A ILE 202.A N PRO 198.A O no hydrogen 2.986 N/A ARG 203.A N ARG 199.A O no hydrogen 2.955 N/A GLU 204.A N ALA 200.A O no hydrogen 2.872 N/A GLY 205.A N SER 201.A O no hydrogen 2.916 N/A MET 206.A N ILE 202.A O no hydrogen 3.004 N/A LEU 207.A N ARG 203.A O no hydrogen 3.245 N/A ALA 208.A N GLU 204.A O no hydrogen 3.161 N/A GLN 209.A N MET 206.A O no hydrogen 3.406 N/A GLN 209.A NE2 GLY 205.A O no hydrogen 2.808 N/A GLN 209.A NE2 ARG 213.A O no hydrogen 2.967 N/A LEU 211.A N GLY 243.A O no hydrogen 3.494 N/A GLY 212.A N GLN 209.A O no hydrogen 2.919 N/A ARG 213.A NH1 MET 214.A O no hydrogen 2.981 N/A ARG 213.A NH1 GLU 219.A OE1 no hydrogen 3.112 N/A ARG 213.A NH1 GLU 219.A OE2 no hydrogen 3.443 N/A ARG 213.A NH2 GLU 219.A OE2 no hydrogen 2.901 N/A GLY 215.A N ASN 182.A O no hydrogen 2.768 N/A GLN 216.A N GLU 219.A OE1 no hydrogen 2.783 N/A GLU 219.A N GLN 216.A O no hydrogen 2.849 N/A VAL 220.A N GLN 216.A O no hydrogen 3.362 N/A GLY 221.A N PRO 217.A O no hydrogen 2.797 N/A ALA 222.A N ALA 218.A O no hydrogen 2.950 N/A ALA 223.A N GLU 219.A O no hydrogen 3.196 N/A ALA 224.A N VAL 220.A O no hydrogen 2.932 N/A VAL 225.A N GLY 221.A O no hydrogen 2.925 N/A PHE 226.A N ALA 222.A O no hydrogen 3.037 N/A LEU 227.A N ALA 223.A O no hydrogen 3.049 N/A ALA 228.A N ALA 224.A O no hydrogen 3.058 N/A SER 229.A N VAL 225.A O no hydrogen 2.920 N/A SER 229.A OG VAL 225.A O no hydrogen 2.749 N/A GLU 230.A N PHE 226.A O no hydrogen 3.017 N/A CYS 234.A N ALA 231.A O no hydrogen 2.865 N/A GLY 236.A N VAL 175.A O no hydrogen 2.610 N/A ILE 237.A N ASN 176.A OD1 no hydrogen 2.938 N/A LEU 239.A N CYS 177.A O no hydrogen 2.890 N/A VAL 241.A N SER 179.A O no hydrogen 2.965 N/A THR 242.A OG1 GLU 246.A OE1 no hydrogen 2.690 N/A GLY 244.A N THR 242.A OG1 no hydrogen 3.293 N/A ALA 245.A N THR 242.A O no hydrogen 3.398 N/A GLU 246.A N GLU 246.A OE1 no hydrogen 2.564 N/A LEU 247.A N GLY 244.A O no hydrogen 3.068 N/A