Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2yiy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N ALA 69.A O no hydrogen 3.045 N/A GLU 9.A N ASP 6.A O no hydrogen 2.951 N/A ILE 10.A N TYR 7.A O no hydrogen 3.249 N/A GLU 11.A N LYS 28.A O no hydrogen 3.013 N/A GLU 13.A N LYS 26.A O no hydrogen 2.737 N/A GLU 14.A N GLU 14.A OE1 no hydrogen 2.925 N/A VAL 16.A N VAL 24.A O no hydrogen 2.750 N/A GLY 17.A N VAL 24.A O no hydrogen 3.148 N/A ARG 18.A NE GLU 40.A OE1 no hydrogen 3.203 N/A ARG 18.A NE GLU 40.A OE2 no hydrogen 2.984 N/A ARG 18.A NH2 GLU 40.A OE2 no hydrogen 2.728 N/A GLY 22.A N GLU 44.A OE2 no hydrogen 2.963 N/A VAL 23.A N GLN 38.A O no hydrogen 2.861 N/A VAL 24.A N GLY 17.A O no hydrogen 2.909 N/A CYS 25.A N ILE 36.A O no hydrogen 3.024 N/A LYS 26.A N GLU 14.A O no hydrogen 2.901 N/A LYS 26.A NZ GLU 13.A OE1 no hydrogen 3.505 N/A LYS 26.A NZ GLU 14.A OE2 no hydrogen 2.967 N/A ALA 27.A N VAL 34.A O no hydrogen 2.903 N/A LYS 28.A N GLU 11.A O no hydrogen 3.002 N/A TRP 29.A N LYS 32.A O no hydrogen 3.242 N/A ARG 30.A NE GLU 9.A OE2 no hydrogen 2.830 N/A VAL 34.A N ALA 27.A O no hydrogen 2.798 N/A ALA 35.A N MET 78.A O no hydrogen 2.929 N/A ILE 36.A N CYS 25.A O no hydrogen 2.928 N/A LYS 37.A N LEU 76.A O no hydrogen 2.780 N/A LYS 37.A NZ GLU 51.A OE1 no hydrogen 2.682 N/A GLN 38.A N VAL 23.A O no hydrogen 2.849 N/A GLN 38.A NE2 TYR 7.A OH no hydrogen 2.799 N/A GLU 40.A N GLU 44.A OE2 no hydrogen 2.970 N/A GLU 44.A N SER 41.A O no hydrogen 3.179 N/A ARG 45.A NE GLU 42.A OE1 no hydrogen 3.039 N/A ARG 45.A NH2 GLU 42.A OE2 no hydrogen 2.994 N/A LYS 46.A NZ LYS 46.A O no hydrogen 3.562 N/A PHE 48.A N GLU 44.A O no hydrogen 3.006 N/A PHE 48.A N ARG 45.A O no hydrogen 2.872 N/A ILE 49.A N ARG 45.A O no hydrogen 3.075 N/A VAL 50.A N LYS 46.A O no hydrogen 3.169 N/A GLU 51.A N ALA 47.A O no hydrogen 3.178 N/A LEU 52.A N PHE 48.A O no hydrogen 2.821 N/A ARG 53.A N ILE 49.A O no hydrogen 2.895 N/A GLN 54.A N VAL 50.A O no hydrogen 3.046 N/A LEU 55.A N GLU 51.A O no hydrogen 2.789 N/A SER 56.A N LEU 52.A O no hydrogen 3.298 N/A SER 56.A OG LEU 52.A O no hydrogen 2.782 N/A SER 56.A OG ARG 53.A O no hydrogen 3.360 N/A ARG 57.A N GLN 54.A O no hydrogen 3.219 N/A ASN 59.A N TYR 117.A OH no hydrogen 2.776 N/A ASN 62.A N HIS 60.A ND1 no hydrogen 3.154 N/A ASN 62.A ND2 LEU 145.A O no hydrogen 2.874 N/A ILE 63.A N HIS 60.A O no hydrogen 3.121 N/A VAL 64.A N ILE 147.A O no hydrogen 3.169 N/A LYS 65.A N GLU 79.A OE2 no hydrogen 2.870 N/A LYS 65.A NZ LEU 66.A O no hydrogen 2.883 N/A TYR 67.A N VAL 77.A O no hydrogen 2.642 N/A GLY 68.A N VAL 77.A O no hydrogen 3.461 N/A ALA 69.A N HIS 3.A O no hydrogen 2.970 N/A CYS 70.A N CYS 75.A O no hydrogen 2.705 N/A CYS 70.A SG ILE 5.A O no hydrogen 3.701 N/A CYS 75.A N CYS 70.A O no hydrogen 3.296 N/A CYS 75.A SG LEU 76.A O no hydrogen 3.879 N/A LEU 76.A N LYS 37.A O no hydrogen 2.769 N/A VAL 77.A N GLY 68.A O no hydrogen 2.813 N/A MET 78.A N ALA 35.A O no hydrogen 2.703 N/A GLU 79.A N LYS 65.A O no hydrogen 3.105 N/A GLY 84.A N ALA 81.A O no hydrogen 3.062 N/A LEU 86.A N LEU 136.A O no hydrogen 2.804 N/A ASN 88.A N SER 85.A O no hydrogen 3.233 N/A ASN 88.A N SER 85.A OG no hydrogen 3.410 N/A VAL 89.A N SER 85.A O no hydrogen 3.208 N/A LEU 90.A N LEU 86.A O no hydrogen 2.844 N/A HIS 91.A N TYR 87.A O no hydrogen 2.828 N/A HIS 91.A NE2 GLU 182.A OE2 no hydrogen 2.718 N/A GLY 92.A N ASN 88.A O no hydrogen 2.854 N/A TYR 98.A N TYR 261.A O no hydrogen 2.643 N/A TYR 99.A N TYR 278.A OH no hydrogen 3.392 N/A TYR 99.A OH VAL 183.A O no hydrogen 2.542 N/A HIS 103.A N THR 100.A OG1 no hydrogen 3.339 N/A ALA 104.A N THR 100.A O no hydrogen 3.105 N/A MET 105.A N ALA 101.A O no hydrogen 2.878 N/A SER 106.A N ALA 102.A O no hydrogen 2.866 N/A SER 106.A OG GLN 110.A OE1 no hydrogen 2.834 N/A TRP 107.A N HIS 103.A O no hydrogen 2.884 N/A TRP 107.A NE1 GLY 142.A O no hydrogen 2.758 N/A CYS 108.A N ALA 104.A O no hydrogen 3.334 N/A CYS 108.A SG ALA 104.A O no hydrogen 3.390 N/A LEU 109.A N MET 105.A O no hydrogen 3.051 N/A GLN 110.A N SER 106.A O no hydrogen 2.949 N/A GLN 110.A NE2 THR 143.A O no hydrogen 3.555 N/A CYS 111.A N TRP 107.A O no hydrogen 2.942 N/A SER 112.A N CYS 108.A O no hydrogen 3.044 N/A SER 112.A OG CYS 108.A O no hydrogen 3.395 N/A SER 112.A OG LEU 109.A O no hydrogen 2.641 N/A GLN 113.A N LEU 109.A O no hydrogen 2.828 N/A GLY 114.A N GLN 110.A O no hydrogen 3.102 N/A VAL 115.A N CYS 111.A O no hydrogen 2.931 N/A ALA 116.A N SER 112.A O no hydrogen 2.794 N/A TYR 117.A N GLN 113.A O no hydrogen 3.153 N/A LEU 118.A N GLY 114.A O no hydrogen 3.141 N/A HIS 119.A N VAL 115.A O no hydrogen 2.844 N/A HIS 119.A ND1 LEU 126.A O no hydrogen 3.268 N/A HIS 119.A NE2 GLU 169.A O no hydrogen 2.952 N/A SER 120.A N TYR 117.A O no hydrogen 3.420 N/A SER 120.A OG TYR 117.A O no hydrogen 3.162 N/A MET 121.A N LEU 118.A O no hydrogen 3.474 N/A GLN 122.A NE2 SER 120.A O no hydrogen 3.639 N/A LEU 126.A N LEU 118.A O no hydrogen 2.796 N/A HIS 128.A N ASP 172.A OD2 no hydrogen 2.874 N/A HIS 128.A NE2 CYS 148.A O no hydrogen 2.647 N/A ARG 129.A N ASP 172.A OD1 no hydrogen 2.945 N/A ARG 129.A NE TYR 167.A OH no hydrogen 2.694 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 3.081 N/A LYS 132.A NZ SER 153.A OG no hydrogen 2.786 N/A ASN 135.A N LYS 132.A O no hydrogen 3.014 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.764 N/A LEU 136.A N PRO 133.A O no hydrogen 3.130 N/A LEU 137.A N LYS 146.A O no hydrogen 2.806 N/A LEU 138.A N GLY 84.A O no hydrogen 3.163 N/A VAL 139.A N VAL 144.A O no hydrogen 2.732 N/A THR 143.A N ALA 140.A O no hydrogen 3.292 N/A THR 143.A OG1 ALA 140.A O no hydrogen 2.669 N/A VAL 144.A N VAL 139.A O no hydrogen 2.979 N/A LYS 146.A N LEU 137.A O no hydrogen 2.787 N/A LYS 146.A NZ PRO 61.A O no hydrogen 3.324 N/A LYS 146.A NZ GLU 79.A OE2 no hydrogen 3.102 N/A ILE 147.A N ASN 62.A O no hydrogen 2.700 N/A CYS 148.A N ASN 135.A O no hydrogen 2.880 N/A CYS 148.A SG LYS 146.A O no hydrogen 3.974 N/A PHE 150.A N ASN 135.A OD1 no hydrogen 2.961 N/A GLY 151.A N ASP 149.A OD1 no hydrogen 3.076 N/A SER 153.A OG ASP 130.A OD1 no hydrogen 2.680 N/A TRP 156.A N SER 153.A O no hydrogen 3.082 N/A TRP 156.A NE1 GLU 182.A OE1 no hydrogen 2.745 N/A MET 157.A N ALA 154.A O no hydrogen 3.359 N/A GLU 160.A N GLU 160.A OE1 no hydrogen 2.889 N/A VAL 161.A N ALA 158.A O no hydrogen 3.193 N/A GLU 163.A N PRO 159.A O no hydrogen 2.882 N/A GLY 164.A N VAL 161.A O no hydrogen 3.196 N/A SER 165.A OG GLU 163.A OE2 no hydrogen 3.111 N/A LYS 170.A N SER 168.A OG no hydrogen 3.413 N/A LYS 170.A NZ PRO 232.A O no hydrogen 3.385 N/A LYS 170.A NZ ARG 235.A O no hydrogen 2.933 N/A CYS 171.A N SER 168.A O no hydrogen 3.078 N/A CYS 171.A SG SER 168.A O no hydrogen 3.255 N/A CYS 171.A SG ASP 172.A OD1 no hydrogen 3.813 N/A PHE 174.A N LYS 170.A O no hydrogen 3.407 N/A SER 175.A N CYS 171.A O no hydrogen 3.165 N/A SER 175.A OG TRP 156.A O no hydrogen 2.634 N/A SER 175.A OG CYS 171.A O no hydrogen 3.179 N/A TRP 176.A N ASP 172.A O no hydrogen 2.888 N/A TRP 176.A NE1 CYS 108.A O no hydrogen 2.607 N/A GLY 177.A N VAL 173.A O no hydrogen 3.012 N/A ILE 178.A N PHE 174.A O no hydrogen 3.241 N/A ILE 179.A N SER 175.A O no hydrogen 3.120 N/A LEU 180.A N TRP 176.A O no hydrogen 2.921 N/A TRP 181.A N GLY 177.A O no hydrogen 3.255 N/A TRP 181.A NE1 PRO 211.A O no hydrogen 2.766 N/A GLU 182.A N ILE 178.A O no hydrogen 2.966 N/A VAL 183.A N ILE 179.A O no hydrogen 2.874 N/A ILE 184.A N LEU 180.A O no hydrogen 3.245 N/A THR 185.A N TRP 181.A O no hydrogen 3.060 N/A THR 185.A OG1 TRP 181.A O no hydrogen 2.770 N/A ARG 186.A N GLU 182.A O no hydrogen 2.897 N/A ARG 186.A NE LEU 90.A O no hydrogen 2.935 N/A ARG 186.A NH1 PRO 97.A O no hydrogen 2.778 N/A ARG 186.A NH2 VAL 89.A O no hydrogen 2.702 N/A ARG 186.A NH2 PRO 97.A O no hydrogen 2.834 N/A ARG 187.A N THR 185.A OG1 no hydrogen 3.397 N/A ARG 187.A NH2 PRO 268.A O no hydrogen 2.684 N/A LYS 188.A NZ TYR 87.A OH no hydrogen 3.057 N/A ASP 191.A N LYS 188.A O no hydrogen 3.404 N/A ILE 193.A N PHE 190.A O no hydrogen 3.309 N/A ARG 199.A N PRO 196.A O no hydrogen 3.167 N/A MET 201.A N ALA 197.A O no hydrogen 3.117 N/A TRP 202.A N PHE 198.A O no hydrogen 2.888 N/A ALA 203.A N ARG 199.A O no hydrogen 3.145 N/A VAL 204.A N ILE 200.A O no hydrogen 2.961 N/A HIS 205.A N MET 201.A O no hydrogen 2.893 N/A ASN 206.A N TRP 202.A O no hydrogen 3.041 N/A ASN 206.A N ALA 203.A O no hydrogen 3.019 N/A GLY 207.A N VAL 204.A O no hydrogen 3.057 N/A THR 208.A N ALA 203.A O no hydrogen 2.983 N/A THR 208.A OG1 ALA 203.A O no hydrogen 3.289 N/A ARG 209.A NE TRP 228.A O no hydrogen 2.728 N/A ARG 209.A NH1 VAL 204.A O no hydrogen 3.197 N/A ARG 209.A NH1 THR 208.A O no hydrogen 2.919 N/A ARG 209.A NH2 TRP 228.A O no hydrogen 2.947 N/A LEU 212.A N GLY 273.A O no hydrogen 2.977 N/A LYS 214.A N VAL 275.A O no hydrogen 2.708 N/A LEU 216.A N ILE 213.A O no hydrogen 3.447 N/A GLU 221.A N PRO 217.A O no hydrogen 2.925 N/A SER 222.A N LYS 218.A O no hydrogen 2.920 N/A LEU 223.A N PRO 219.A O no hydrogen 3.370 N/A MET 224.A N ILE 220.A O no hydrogen 2.985 N/A THR 225.A N GLU 221.A O no hydrogen 3.060 N/A THR 225.A OG1 GLU 221.A O no hydrogen 3.249 N/A THR 225.A OG1 SER 222.A O no hydrogen 3.413 N/A ARG 226.A N SER 222.A O no hydrogen 3.322 N/A ARG 226.A NH1 GLU 240.A OE2 no hydrogen 3.064 N/A ARG 226.A NH2 GLU 240.A OE2 no hydrogen 2.894 N/A CYS 227.A N LEU 223.A O no hydrogen 3.220 N/A CYS 227.A SG LEU 223.A O no hydrogen 3.187 N/A SER 229.A N ARG 226.A O no hydrogen 3.333 N/A SER 229.A OG THR 225.A O no hydrogen 3.339 N/A SER 229.A OG ARG 226.A O no hydrogen 2.695 N/A SER 233.A N ASP 231.A OD1 no hydrogen 3.219 N/A SER 233.A OG ASP 231.A OD1 no hydrogen 2.736 N/A GLN 234.A N ASP 231.A O no hydrogen 3.074 N/A ARG 235.A N PRO 232.A O no hydrogen 3.254 N/A ARG 235.A NE SER 229.A O no hydrogen 2.848 N/A ARG 235.A NH1 GLU 160.A OE2 no hydrogen 2.792 N/A ARG 235.A NH1 LYS 170.A O no hydrogen 2.783 N/A ARG 235.A NH2 GLU 160.A OE1 no hydrogen 2.818 N/A ARG 235.A NH2 SER 229.A O no hydrogen 3.059 N/A GLU 240.A N SER 237.A O no hydrogen 3.129 N/A ILE 241.A N SER 237.A O no hydrogen 3.158 N/A VAL 242.A N MET 238.A O no hydrogen 2.831 N/A LYS 243.A N GLU 239.A O no hydrogen 3.090 N/A ILE 244.A N GLU 240.A O no hydrogen 2.852 N/A MET 245.A N ILE 241.A O no hydrogen 2.783 N/A THR 246.A N VAL 242.A O no hydrogen 2.876 N/A THR 246.A OG1 VAL 242.A O no hydrogen 2.639 N/A HIS 247.A N LYS 243.A O no hydrogen 3.139 N/A LEU 248.A N ILE 244.A O no hydrogen 3.028 N/A MET 249.A N MET 245.A O no hydrogen 3.019 N/A TYR 251.A N LEU 248.A O no hydrogen 2.992 N/A TYR 251.A OH ASP 291.A OD2 no hydrogen 2.722 N/A PHE 252.A N MET 249.A O no hydrogen 2.995 N/A GLU 257.A N GLY 254.A O no hydrogen 3.292 N/A LEU 259.A N GLY 141.A O no hydrogen 2.852 N/A CYS 263.A N LEU 96.A O no hydrogen 2.817 N/A CYS 263.A SG GLN 264.A O no hydrogen 3.872 N/A CYS 263.A SG HIS 265.A NE2 no hydrogen 3.466 N/A CYS 263.A SG TYR 278.A OH no hydrogen 3.413 N/A ARG 274.A N GLU 271.A O no hydrogen 3.426 N/A ARG 274.A NH2 ILE 213.A O no hydrogen 3.396 N/A VAL 275.A N LEU 212.A O no hydrogen 2.824 N/A TYR 278.A N ILE 184.A O no hydrogen 2.602 N/A VAL 279.A N ILE 184.A O no hydrogen 3.216 N/A ALA 282.A N ASP 280.A OD1 no hydrogen 3.136 N/A TYR 285.A N PHE 281.A O no hydrogen 3.114 N/A TYR 285.A OH ASN 215.A O no hydrogen 2.630 N/A ARG 286.A N ALA 282.A O no hydrogen 3.155 N/A ARG 286.A NH1 GLU 283.A OE1 no hydrogen 2.588 N/A LEU 287.A N GLU 283.A O no hydrogen 2.937 N/A TRP 288.A N PHE 284.A O no hydrogen 2.811 N/A SER 289.A N TYR 285.A O no hydrogen 2.972 N/A VAL 290.A N ARG 286.A O no hydrogen 3.331 N/A HIS 292.A N TRP 288.A O no hydrogen 2.641 N/A HIS 292.A ND1 TRP 288.A O no hydrogen 2.960 N/A