Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pqh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 7.A N ARG 4.A O no hydrogen 3.306 N/A GLU 16.A N GLU 16.A OE1 no hydrogen 2.857 N/A TYR 17.A N GLY 14.A O no hydrogen 3.097 N/A MET 23.A N ASP 21.A OD1 no hydrogen 3.003 N/A GLN 24.A N ASP 21.A O no hydrogen 2.953 N/A LEU 25.A N PRO 22.A O no hydrogen 3.326 N/A TYR 27.A OH GLU 32.A OE1 no hydrogen 2.669 N/A ARG 30.A N ASP 28.A OD1 no hydrogen 2.848 N/A TRP 31.A N ASP 28.A O no hydrogen 3.063 N/A GLU 32.A N SER 29.A O no hydrogen 2.874 N/A PHE 33.A N ALA 108.A O no hydrogen 2.888 N/A ARG 35.A NH2 PRO 114.A O no hydrogen 2.922 N/A GLY 37.A N PRO 34.A O no hydrogen 3.122 N/A LEU 38.A N ARG 35.A O no hydrogen 3.274 N/A VAL 39.A N THR 56.A O no hydrogen 2.929 N/A GLY 41.A N GLU 54.A O no hydrogen 2.735 N/A ARG 42.A NE GLU 54.A OE2 no hydrogen 3.172 N/A LEU 44.A N VAL 52.A O no hydrogen 2.606 N/A GLY 45.A N VAL 52.A O no hydrogen 3.146 N/A GLY 47.A N GLY 50.A O no hydrogen 2.794 N/A LYS 51.A N MET 73.A O no hydrogen 2.831 N/A VAL 52.A N GLY 45.A O no hydrogen 2.812 N/A VAL 53.A N VAL 71.A O no hydrogen 2.944 N/A GLU 54.A N ARG 42.A O no hydrogen 2.960 N/A GLY 55.A N VAL 69.A O no hydrogen 2.672 N/A THR 56.A N VAL 39.A O no hydrogen 2.932 N/A ALA 57.A N MET 67.A O no hydrogen 2.936 N/A TYR 58.A N GLY 37.A O no hydrogen 2.935 N/A GLY 59.A N PRO 65.A O no hydrogen 2.747 N/A GLN 64.A N SER 61.A OG no hydrogen 2.828 N/A MET 67.A N ALA 57.A O no hydrogen 3.167 N/A LYS 68.A NZ GLU 54.A OE1 no hydrogen 3.434 N/A VAL 69.A N GLY 55.A O no hydrogen 2.690 N/A ALA 70.A N ILE 119.A O no hydrogen 2.821 N/A VAL 71.A N VAL 53.A O no hydrogen 2.722 N/A LYS 72.A N ILE 117.A O no hydrogen 2.690 N/A LYS 72.A NZ GLU 89.A OE2 no hydrogen 3.245 N/A LYS 72.A NZ ASP 186.A OD1 no hydrogen 2.995 N/A MET 73.A N LYS 51.A O no hydrogen 2.888 N/A LYS 75.A N PHE 49.A O no hydrogen 3.269 N/A LYS 75.A NZ GLY 47.A O no hydrogen 2.995 N/A ALA 78.A N LYS 75.A O no hydrogen 3.161 N/A LYS 83.A N ARG 79.A O no hydrogen 3.147 N/A GLN 84.A N SER 80.A O no hydrogen 3.115 N/A ALA 85.A N SER 81.A O no hydrogen 3.394 N/A LEU 86.A N GLU 82.A O no hydrogen 3.088 N/A MET 87.A N LYS 83.A O no hydrogen 3.280 N/A SER 88.A N GLN 84.A O no hydrogen 3.075 N/A GLU 89.A N ALA 85.A O no hydrogen 2.764 N/A LEU 90.A N LEU 86.A O no hydrogen 2.916 N/A LYS 91.A N MET 87.A O no hydrogen 2.923 N/A LYS 91.A NZ LEU 25.A O no hydrogen 3.493 N/A ILE 92.A N SER 88.A O no hydrogen 2.933 N/A MET 93.A N GLU 89.A O no hydrogen 3.136 N/A THR 94.A N LEU 90.A O no hydrogen 3.003 N/A THR 94.A OG1 LEU 90.A O no hydrogen 3.021 N/A THR 94.A OG1 LYS 91.A O no hydrogen 3.039 N/A LEU 96.A N ILE 92.A O no hydrogen 3.087 N/A LEU 96.A N MET 93.A O no hydrogen 3.322 N/A HIS 99.A N ASN 104.A OD1 no hydrogen 2.916 N/A ASN 101.A N HIS 99.A ND1 no hydrogen 2.957 N/A ASN 101.A ND2 GLN 151.A OE1 no hydrogen 3.049 N/A ASN 101.A ND2 VAL 182.A O no hydrogen 2.773 N/A ILE 102.A N HIS 99.A O no hydrogen 3.231 N/A VAL 103.A N ILE 184.A O no hydrogen 2.805 N/A ASN 104.A N GLU 120.A OE1 no hydrogen 2.785 N/A ASN 104.A ND2 HIS 99.A O no hydrogen 3.057 N/A ASN 104.A ND2 GLU 120.A OE1 no hydrogen 2.754 N/A LEU 106.A N ILE 118.A O no hydrogen 2.715 N/A GLY 107.A N ILE 118.A O no hydrogen 3.243 N/A ALA 108.A N TRP 31.A O no hydrogen 2.979 N/A CYS 109.A N TYR 116.A O no hydrogen 3.081 N/A CYS 109.A SG PHE 33.A O no hydrogen 3.282 N/A THR 110.A N GLU 32.A OE2 no hydrogen 2.699 N/A THR 110.A OG1 GLU 32.A OE1 no hydrogen 2.528 N/A THR 110.A OG1 GLU 32.A OE2 no hydrogen 3.104 N/A TYR 116.A N CYS 109.A O no hydrogen 2.987 N/A ILE 117.A N LYS 72.A O no hydrogen 2.942 N/A ILE 118.A N GLY 107.A O no hydrogen 2.792 N/A ILE 119.A N ALA 70.A O no hydrogen 2.785 N/A GLU 120.A N ASN 104.A O no hydrogen 3.091 N/A TYR 124.A N LEU 176.A O no hydrogen 3.196 N/A GLY 125.A N CYS 122.A O no hydrogen 3.236 N/A LEU 127.A N VAL 174.A O no hydrogen 2.693 N/A ASN 129.A N ASP 126.A OD2 no hydrogen 2.536 N/A TYR 130.A N ASP 126.A O no hydrogen 3.143 N/A LEU 131.A N LEU 127.A O no hydrogen 2.942 N/A HIS 132.A N VAL 128.A O no hydrogen 3.042 N/A HIS 132.A NE2 GLY 242.A O no hydrogen 2.698 N/A LYS 133.A N ASN 129.A O no hydrogen 2.878 N/A ASN 134.A N TYR 130.A O no hydrogen 3.218 N/A ARG 135.A N HIS 132.A O no hydrogen 3.320 N/A PHE 138.A N ASN 134.A O no hydrogen 3.092 N/A THR 141.A N ASP 144.A OD2 no hydrogen 3.273 N/A LEU 146.A N LEU 142.A O no hydrogen 3.108 N/A SER 147.A N LEU 143.A O no hydrogen 2.811 N/A SER 147.A OG TYR 308.A OH no hydrogen 2.577 N/A PHE 148.A N ASP 144.A O no hydrogen 2.850 N/A THR 149.A N LEU 145.A O no hydrogen 3.023 N/A THR 149.A OG1 LEU 145.A O no hydrogen 2.582 N/A TYR 150.A N LEU 146.A O no hydrogen 2.839 N/A GLN 151.A N SER 147.A O no hydrogen 3.072 N/A GLN 151.A NE2 SER 147.A O no hydrogen 3.488 N/A GLN 151.A NE2 SER 147.A OG no hydrogen 3.275 N/A GLN 151.A NE2 LYS 180.A O no hydrogen 3.194 N/A VAL 152.A N PHE 148.A O no hydrogen 3.132 N/A ALA 153.A N THR 149.A O no hydrogen 3.280 N/A ARG 154.A N TYR 150.A O no hydrogen 2.881 N/A ARG 154.A NE GLU 157.A OE2 no hydrogen 3.324 N/A ARG 154.A NH1 TYR 150.A OH no hydrogen 2.546 N/A GLY 155.A N GLN 151.A O no hydrogen 2.777 N/A MET 156.A N VAL 152.A O no hydrogen 2.802 N/A GLU 157.A N ALA 153.A O no hydrogen 2.894 N/A PHE 158.A N ARG 154.A O no hydrogen 2.998 N/A LEU 159.A N GLY 155.A O no hydrogen 3.076 N/A ALA 160.A N MET 156.A O no hydrogen 2.851 N/A SER 161.A N GLU 157.A O no hydrogen 3.040 N/A SER 161.A OG GLU 157.A O no hydrogen 3.466 N/A SER 161.A OG PHE 158.A O no hydrogen 2.656 N/A LYS 162.A N PHE 158.A O no hydrogen 3.296 N/A LYS 162.A N LEU 159.A O no hydrogen 2.971 N/A ASN 163.A N ALA 160.A O no hydrogen 3.059 N/A CYS 164.A N LEU 159.A O no hydrogen 3.061 N/A VAL 165.A N ARG 191.A O no hydrogen 2.978 N/A HIS 166.A N ASP 227.A OD2 no hydrogen 2.849 N/A HIS 166.A NE2 CYS 185.A O no hydrogen 2.947 N/A ARG 167.A N ASP 227.A OD1 no hydrogen 3.043 N/A ASP 168.A N HIS 166.A ND1 no hydrogen 3.077 N/A ALA 171.A N GLU 237.A OE1 no hydrogen 2.925 N/A ARG 172.A NH2 ASP 168.A OD1 no hydrogen 3.019 N/A ASN 173.A N ALA 170.A O no hydrogen 2.750 N/A ASN 173.A ND2 ASP 168.A O no hydrogen 3.054 N/A VAL 174.A N ALA 171.A O no hydrogen 3.142 N/A LEU 175.A N LYS 183.A O no hydrogen 2.749 N/A LEU 176.A N GLY 125.A O no hydrogen 3.178 N/A ALA 177.A N ILE 181.A O no hydrogen 2.597 N/A VAL 182.A N GLN 151.A OE1 no hydrogen 2.760 N/A LYS 183.A N LEU 175.A O no hydrogen 2.695 N/A ILE 184.A N ASN 101.A O no hydrogen 2.830 N/A CYS 185.A N ASN 173.A O no hydrogen 3.045 N/A CYS 185.A SG ASN 173.A O no hydrogen 3.537 N/A ALA 190.A N PHE 187.A O no hydrogen 3.264 N/A ARG 191.A N VAL 165.A O no hydrogen 3.095 N/A ILE 193.A N ASN 163.A O no hydrogen 2.961 N/A HIS 195.A N ASP 192.A O no hydrogen 2.983 N/A ASN 198.A N MET 194.A O no hydrogen 3.266 N/A TYR 199.A N HIS 195.A O no hydrogen 3.137 N/A VAL 209.A N LEU 207.A O no hydrogen 2.925 N/A LYS 210.A NZ PRO 245.A O no hydrogen 3.107 N/A LYS 210.A NZ TYR 246.A O no hydrogen 2.948 N/A LYS 210.A NZ MET 249.A O no hydrogen 2.876 N/A TRP 211.A N PRO 208.A O no hydrogen 2.696 N/A TRP 211.A NE1 GLU 237.A OE1 no hydrogen 2.859 N/A MET 212.A N VAL 209.A O no hydrogen 2.956 N/A GLU 215.A N GLU 215.A OE1 no hydrogen 2.561 N/A SER 216.A N ALA 213.A O no hydrogen 2.788 N/A SER 216.A OG LEU 221.A O no hydrogen 2.752 N/A ILE 217.A N ALA 213.A O no hydrogen 3.106 N/A PHE 218.A N PRO 214.A O no hydrogen 2.919 N/A ASP 219.A N GLU 215.A O no hydrogen 2.969 N/A ASN 220.A N SER 216.A O no hydrogen 3.096 N/A LEU 221.A N GLU 215.A O no hydrogen 3.206 N/A THR 223.A N SER 226.A OG no hydrogen 2.648 N/A SER 226.A N THR 223.A OG1 no hydrogen 3.148 N/A SER 226.A OG THR 223.A O no hydrogen 2.718 N/A ASP 227.A N THR 223.A O no hydrogen 3.086 N/A VAL 228.A N THR 224.A O no hydrogen 2.971 N/A TRP 229.A N LEU 225.A O no hydrogen 3.375 N/A SER 230.A N SER 226.A O no hydrogen 3.208 N/A SER 230.A OG TRP 211.A O no hydrogen 2.656 N/A SER 230.A OG SER 226.A O no hydrogen 3.389 N/A TYR 231.A N ASP 227.A O no hydrogen 2.816 N/A TYR 231.A OH THR 149.A O no hydrogen 2.595 N/A GLY 232.A N VAL 228.A O no hydrogen 2.909 N/A ILE 233.A N TRP 229.A O no hydrogen 3.054 N/A LEU 234.A N SER 230.A O no hydrogen 2.746 N/A LEU 235.A N TYR 231.A O no hydrogen 2.876 N/A TRP 236.A N GLY 232.A O no hydrogen 3.073 N/A TRP 236.A NE1 ALA 266.A O no hydrogen 3.098 N/A GLU 237.A N ILE 233.A O no hydrogen 3.037 N/A ILE 238.A N LEU 234.A O no hydrogen 2.978 N/A PHE 239.A N LEU 235.A O no hydrogen 3.029 N/A SER 240.A N TRP 236.A O no hydrogen 2.953 N/A SER 240.A OG TRP 236.A O no hydrogen 2.927 N/A SER 240.A OG GLU 237.A O no hydrogen 3.266 N/A LEU 241.A N ILE 238.A O no hydrogen 2.991 N/A GLY 242.A N GLU 237.A O no hydrogen 2.909 N/A GLY 243.A N SER 240.A OG no hydrogen 3.066 N/A MET 249.A N TYR 246.A O no hydrogen 3.125 N/A PHE 255.A N ASP 252.A OD1 no hydrogen 3.145 N/A TYR 256.A N ASP 252.A O no hydrogen 2.988 N/A ASN 257.A N SER 253.A O no hydrogen 2.860 N/A LYS 258.A N THR 254.A O no hydrogen 2.803 N/A ILE 259.A N PHE 255.A O no hydrogen 2.981 N/A LYS 260.A N TYR 256.A O no hydrogen 3.035 N/A SER 261.A N ASN 257.A O no hydrogen 3.099 N/A SER 261.A OG ASN 257.A O no hydrogen 2.735 N/A GLY 262.A N LYS 258.A O no hydrogen 3.208 N/A GLY 262.A N ILE 259.A O no hydrogen 3.154 N/A TYR 263.A N LYS 258.A O no hydrogen 2.821 N/A ARG 264.A NE TRP 283.A O no hydrogen 2.826 N/A ARG 264.A NH1 ILE 259.A O no hydrogen 3.247 N/A ARG 264.A NH1 TYR 263.A O no hydrogen 2.843 N/A ARG 264.A NH2 TRP 283.A O no hydrogen 2.766 N/A LYS 267.A NZ ALA 271.A O no hydrogen 3.344 N/A ALA 271.A N PRO 268.A O no hydrogen 3.158 N/A VAL 275.A N THR 272.A OG1 no hydrogen 3.154 N/A TYR 276.A N THR 272.A O no hydrogen 3.071 N/A TYR 276.A OH MET 265.A O no hydrogen 2.973 N/A GLU 277.A N SER 273.A O no hydrogen 3.261 N/A ILE 278.A N VAL 275.A O no hydrogen 3.211 N/A MET 279.A N VAL 275.A O no hydrogen 3.367 N/A VAL 280.A N TYR 276.A O no hydrogen 2.922 N/A LYS 281.A N GLU 277.A O no hydrogen 2.963 N/A CYS 282.A N ILE 278.A O no hydrogen 3.051 N/A CYS 282.A SG ILE 278.A O no hydrogen 3.121 N/A TRP 283.A N MET 279.A O no hydrogen 3.205 N/A TRP 283.A N VAL 280.A O no hydrogen 3.155 N/A ASN 284.A N LYS 281.A O no hydrogen 3.372 N/A GLU 286.A N ASN 284.A OD1 no hydrogen 3.019 N/A LYS 289.A N GLU 286.A O no hydrogen 3.030 N/A ARG 290.A N PRO 287.A O no hydrogen 3.048 N/A ARG 290.A NE ASN 284.A O no hydrogen 2.833 N/A ARG 290.A NH1 GLU 215.A OE2 no hydrogen 2.989 N/A ARG 290.A NH1 LEU 225.A O no hydrogen 2.937 N/A ARG 290.A NH2 GLU 215.A OE1 no hydrogen 3.148 N/A ARG 290.A NH2 ASN 284.A O no hydrogen 3.110 N/A HIS 295.A N SER 292.A OG no hydrogen 2.996 N/A HIS 295.A ND1 HIS 295.A O no hydrogen 2.643 N/A LEU 296.A N SER 292.A O no hydrogen 2.748 N/A SER 297.A N PHE 293.A O no hydrogen 3.037 N/A SER 297.A OG TYR 294.A O no hydrogen 2.637 N/A GLU 298.A N TYR 294.A O no hydrogen 3.119 N/A ILE 299.A N HIS 295.A O no hydrogen 2.965 N/A VAL 300.A N LEU 296.A O no hydrogen 2.900 N/A GLU 301.A N SER 297.A O no hydrogen 2.630 N/A ASN 302.A N GLU 298.A O no hydrogen 3.309 N/A ASN 302.A N ILE 299.A O no hydrogen 3.086 N/A LEU 304.A N GLU 301.A O no hydrogen 3.297 N/A TYR 308.A N PRO 305.A O no hydrogen 3.103 N/A TYR 308.A OH SER 147.A OG no hydrogen 2.577 N/A LYS 309.A NZ GLU 301.A OE1 no hydrogen 3.299 N/A SER 311.A N GLN 307.A O no hydrogen 2.862 N/A SER 311.A OG GLN 307.A O no hydrogen 3.539 N/A SER 311.A OG TYR 308.A O no hydrogen 2.994 N/A TYR 312.A N TYR 308.A O no hydrogen 2.627 N/A TYR 312.A OH ASN 101.A OD1 no hydrogen 2.902 N/A GLU 313.A N LYS 309.A O no hydrogen 2.936 N/A LYS 314.A N LYS 310.A O no hydrogen 3.010 N/A ILE 315.A N SER 311.A O no hydrogen 2.998 N/A HIS 316.A N TYR 312.A O no hydrogen 2.996 N/A LEU 317.A N GLU 313.A O no hydrogen 2.862 N/A ASP 318.A N LYS 314.A O no hydrogen 3.086 N/A PHE 319.A N ILE 315.A O no hydrogen 3.011 N/A LEU 320.A N LEU 317.A O no hydrogen 2.947 N/A LYS 321.A N ASP 318.A O no hydrogen 3.019 N/A