Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1f0q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 203.A OD2 no hydrogen 2.920 N/A SER 2.A OG HIS 304.A NE2 no hydrogen 2.660 N/A SER 2.A OG GLN 305.A OE1 no hydrogen 3.157 N/A ALA 4.A N TYR 177.A OH no hydrogen 3.144 N/A ARG 5.A NH1 GLN 305.A O no hydrogen 3.013 N/A TYR 7.A OH ASP 140.A OD1 no hydrogen 2.835 N/A ASN 11.A ND2 GLY 146.A O no hydrogen 2.848 N/A ASN 11.A ND2 TYR 177.A O no hydrogen 2.918 N/A LEU 13.A N VAL 10.A O no hydrogen 3.433 N/A ARG 14.A NH1 GLN 145.A OE1 no hydrogen 2.518 N/A ARG 14.A NH2 GLN 145.A OE1 no hydrogen 2.660 N/A LYS 16.A NZ ASP 20.A OD2 no hydrogen 2.665 N/A TYR 18.A N PRO 15.A O no hydrogen 2.657 N/A TYR 18.A OH GLN 145.A O no hydrogen 3.167 N/A ASP 20.A N LYS 16.A O no hydrogen 3.064 N/A TYR 21.A N TRP 19.A O no hydrogen 2.903 N/A GLY 29.A N ILE 95.A O no hydrogen 3.356 N/A ASP 33.A N GLU 30.A O no hydrogen 2.805 N/A TYR 34.A N GLN 31.A O no hydrogen 2.986 N/A TYR 34.A OH ASP 94.A OD2 no hydrogen 2.539 N/A VAL 37.A N GLU 50.A O no hydrogen 3.013 N/A LYS 39.A NZ GLY 41.A O no hydrogen 3.471 N/A VAL 40.A N VAL 48.A O no hydrogen 2.881 N/A GLY 41.A N VAL 48.A O no hydrogen 3.289 N/A GLY 43.A N SER 46.A O no hydrogen 2.732 N/A SER 46.A OG GLY 43.A O no hydrogen 2.851 N/A GLU 47.A N ILE 64.A O no hydrogen 3.257 N/A VAL 48.A N GLY 41.A O no hydrogen 3.275 N/A PHE 49.A N ILE 62.A O no hydrogen 2.855 N/A GLU 50.A N ARG 38.A O no hydrogen 2.811 N/A ASN 56.A ND2 ASN 53.A OD1 no hydrogen 2.326 N/A LYS 59.A NZ GLU 50.A OE2 no hydrogen 2.861 N/A CYS 60.A N GLY 51.A O no hydrogen 3.233 N/A CYS 60.A SG ILE 52.A O no hydrogen 3.132 N/A ILE 62.A N PHE 49.A O no hydrogen 2.791 N/A LYS 63.A N LEU 106.A O no hydrogen 3.035 N/A LYS 63.A NZ GLY 43.A O no hydrogen 3.532 N/A LYS 63.A NZ SER 46.A OG no hydrogen 3.010 N/A LYS 63.A NZ ASP 170.A OD1 no hydrogen 3.136 N/A LYS 63.A NZ ASP 170.A OD2 no hydrogen 3.227 N/A ILE 64.A N GLU 47.A O no hydrogen 2.911 N/A LYS 66.A N TYR 45.A O no hydrogen 2.800 N/A LYS 72.A NZ GLY 172.A O no hydrogen 2.868 N/A LYS 74.A N LYS 70.A O no hydrogen 3.329 N/A LYS 74.A NZ GLU 22.A O no hydrogen 3.377 N/A ARG 75.A N LYS 71.A O no hydrogen 3.269 N/A ARG 75.A NH2 GLY 172.A O no hydrogen 2.979 N/A GLU 76.A N LYS 72.A O no hydrogen 3.010 N/A ILE 77.A N ILE 73.A O no hydrogen 3.112 N/A LYS 78.A N LYS 74.A O no hydrogen 2.684 N/A LYS 78.A NZ GLU 17.A O no hydrogen 3.303 N/A ILE 79.A N ARG 75.A O no hydrogen 3.006 N/A LEU 80.A N GLU 76.A O no hydrogen 2.956 N/A GLN 81.A N ILE 77.A O no hydrogen 2.780 N/A ASN 82.A N LYS 78.A O no hydrogen 2.907 N/A ASN 82.A ND2 TYR 18.A O no hydrogen 3.546 N/A LEU 83.A N ILE 79.A O no hydrogen 2.939 N/A GLY 86.A N LEU 83.A O no hydrogen 3.055 N/A ASN 88.A ND2 GLU 134.A O no hydrogen 2.889 N/A ASN 88.A ND2 GLU 134.A OE1 no hydrogen 2.860 N/A ILE 89.A N GLY 86.A O no hydrogen 3.362 N/A VAL 90.A N LEU 168.A O no hydrogen 3.178 N/A LEU 93.A N ILE 107.A O no hydrogen 2.681 N/A ASP 94.A N ILE 107.A O no hydrogen 3.185 N/A ILE 95.A N ASP 94.A OD1 no hydrogen 3.310 N/A HIS 100.A ND1 ASP 98.A OD1 no hydrogen 2.770 N/A THR 103.A N SER 101.A O no hydrogen 2.545 N/A THR 103.A OG1 LEU 65.A O no hydrogen 3.328 N/A THR 103.A OG1 PRO 104.A O no hydrogen 2.528 N/A SER 105.A N VAL 96.A O no hydrogen 3.440 N/A LEU 106.A N LYS 63.A O no hydrogen 3.213 N/A ILE 107.A N ASP 94.A O no hydrogen 3.064 N/A PHE 108.A N ILE 61.A O no hydrogen 2.968 N/A ASN 113.A ND2 ASN 113.A O no hydrogen 2.238 N/A LYS 117.A N ASP 115.A OD2 no hydrogen 2.320 N/A VAL 118.A N ASP 115.A O no hydrogen 3.274 N/A VAL 118.A N ASP 115.A OD2 no hydrogen 3.233 N/A LEU 119.A N ASP 115.A O no hydrogen 2.437 N/A THR 122.A N LEU 119.A O no hydrogen 2.684 N/A THR 122.A OG1 LEU 119.A O no hydrogen 2.777 N/A LEU 123.A N LEU 119.A O no hydrogen 3.243 N/A LEU 123.A N TYR 120.A O no hydrogen 2.932 N/A THR 124.A N ASP 127.A OD2 no hydrogen 2.681 N/A THR 124.A OG1 ASP 127.A OD2 no hydrogen 2.313 N/A ASP 127.A N THR 124.A OG1 no hydrogen 3.312 N/A ILE 128.A N THR 124.A O no hydrogen 3.207 N/A ARG 129.A NE ASP 125.A OD1 no hydrogen 2.771 N/A ARG 129.A NH1 TYR 318.A O no hydrogen 2.601 N/A ARG 129.A NH2 ASP 125.A OD2 no hydrogen 3.271 N/A TYR 130.A N TYR 126.A O no hydrogen 3.119 N/A TYR 130.A OH ARG 164.A O no hydrogen 2.696 N/A TYR 131.A N ASP 127.A O no hydrogen 3.029 N/A ILE 132.A N ILE 128.A O no hydrogen 2.743 N/A TYR 133.A N ARG 129.A O no hydrogen 2.993 N/A GLU 134.A N TYR 130.A O no hydrogen 2.980 N/A LEU 135.A N TYR 131.A O no hydrogen 2.767 N/A LEU 136.A N ILE 132.A O no hydrogen 2.834 N/A LYS 137.A N TYR 133.A O no hydrogen 2.950 N/A LYS 137.A NZ GLU 134.A OE2 no hydrogen 3.408 N/A LYS 137.A NZ GLU 326.A OE2 no hydrogen 3.088 N/A ALA 138.A N GLU 134.A O no hydrogen 3.306 N/A LEU 139.A N LEU 135.A O no hydrogen 2.913 N/A ASP 140.A N LEU 136.A O no hydrogen 2.769 N/A TYR 141.A N LYS 137.A O no hydrogen 3.280 N/A CYS 142.A N ALA 138.A O no hydrogen 3.267 N/A CYS 142.A SG ALA 138.A O no hydrogen 3.783 N/A CYS 142.A SG LEU 139.A O no hydrogen 3.251 N/A CYS 142.A SG ILE 147.A O no hydrogen 3.607 N/A HIS 143.A N LEU 139.A O no hydrogen 2.898 N/A HIS 143.A NE2 ASP 209.A OD2 no hydrogen 2.718 N/A SER 144.A N ASP 140.A O no hydrogen 2.996 N/A SER 144.A OG TYR 141.A O no hydrogen 2.380 N/A GLN 145.A N TYR 141.A O no hydrogen 2.974 N/A GLN 145.A N CYS 142.A O no hydrogen 3.052 N/A GLN 145.A NE2 SER 144.A OG no hydrogen 3.337 N/A GLY 146.A N HIS 143.A O no hydrogen 2.852 N/A ILE 147.A N CYS 142.A O no hydrogen 2.845 N/A MET 148.A N GLU 175.A O no hydrogen 2.688 N/A HIS 149.A N ASP 209.A OD2 no hydrogen 2.927 N/A HIS 149.A NE2 ILE 169.A O no hydrogen 2.812 N/A ARG 150.A N ASP 209.A OD1 no hydrogen 2.760 N/A ARG 150.A NE LEU 173.A O no hydrogen 2.831 N/A ARG 150.A NH1 TYR 204.A OH no hydrogen 2.669 N/A ARG 150.A NH2 LEU 173.A O no hydrogen 2.667 N/A LYS 153.A NZ SER 189.A OG no hydrogen 2.775 N/A ASN 156.A N LYS 153.A O no hydrogen 2.757 N/A ASN 156.A ND2 ASP 151.A O no hydrogen 2.583 N/A ASN 156.A ND2 ASP 151.A OD2 no hydrogen 2.790 N/A VAL 157.A N PRO 154.A O no hydrogen 3.188 N/A ASP 160.A N LYS 165.A O no hydrogen 2.768 N/A GLU 162.A N ASP 160.A OD1 no hydrogen 3.259 N/A LEU 163.A N ASP 160.A OD1 no hydrogen 3.259 N/A ARG 164.A NH1 ASP 127.A OD1 no hydrogen 2.590 N/A ARG 164.A NH2 ASP 127.A OD1 no hydrogen 3.197 N/A LYS 165.A N ASP 160.A O no hydrogen 3.322 N/A ARG 167.A N MET 158.A O no hydrogen 2.910 N/A ARG 167.A NH1 LEU 166.A O no hydrogen 2.619 N/A LEU 168.A N ASN 88.A O no hydrogen 2.942 N/A ILE 169.A N ASN 156.A O no hydrogen 2.970 N/A TRP 171.A NE1 LEU 168.A O no hydrogen 3.232 N/A ALA 174.A N TRP 171.A O no hydrogen 3.297 N/A GLU 175.A N MET 148.A O no hydrogen 2.837 N/A PHE 176.A N GLU 175.A OE1 no hydrogen 3.137 N/A TYR 177.A N GLY 146.A O no hydrogen 2.748 N/A HIS 178.A N TYR 183.A OH no hydrogen 2.777 N/A LYS 181.A N HIS 178.A O no hydrogen 3.068 N/A TYR 183.A N GLN 202.A O no hydrogen 3.061 N/A TYR 183.A OH PHE 176.A O no hydrogen 2.778 N/A SER 189.A OG ASP 151.A OD1 no hydrogen 3.503 N/A ARG 190.A NE GLY 230.A O no hydrogen 3.106 N/A PHE 192.A N SER 189.A O no hydrogen 3.047 N/A LYS 193.A N ARG 190.A O no hydrogen 3.096 N/A LYS 193.A NZ VAL 187.A O no hydrogen 2.803 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.695 N/A LEU 197.A N GLY 194.A O no hydrogen 2.991 N/A VAL 199.A N PRO 195.A O no hydrogen 2.881 N/A VAL 199.A N GLU 196.A O no hydrogen 3.342 N/A LEU 201.A N GLU 196.A O no hydrogen 2.876 N/A ASP 203.A N ASP 203.A OD1 no hydrogen 2.576 N/A TYR 204.A OH ASN 184.A O no hydrogen 2.677 N/A TYR 206.A OH TYR 7.A O no hydrogen 2.672 N/A SER 207.A N ASP 205.A OD1 no hydrogen 2.863 N/A SER 207.A OG ASP 205.A OD1 no hydrogen 2.814 N/A LEU 208.A N ASP 205.A O no hydrogen 2.851 N/A ASP 209.A N TYR 206.A O no hydrogen 2.814 N/A TRP 211.A N LEU 208.A O no hydrogen 3.107 N/A SER 212.A N LEU 208.A O no hydrogen 3.302 N/A SER 212.A OG PHE 192.A O no hydrogen 2.886 N/A LEU 213.A N ASP 209.A O no hydrogen 2.916 N/A GLY 214.A N MET 210.A O no hydrogen 3.014 N/A CYS 215.A N TRP 211.A O no hydrogen 3.021 N/A CYS 215.A SG TYR 191.A O no hydrogen 3.564 N/A CYS 215.A SG TRP 211.A O no hydrogen 3.582 N/A MET 216.A N SER 212.A O no hydrogen 3.142 N/A PHE 217.A N LEU 213.A O no hydrogen 2.903 N/A ALA 218.A N GLY 214.A O no hydrogen 2.990 N/A GLY 219.A N CYS 215.A O no hydrogen 3.081 N/A MET 220.A N MET 216.A O no hydrogen 2.905 N/A MET 220.A N PHE 217.A O no hydrogen 2.717 N/A ILE 221.A N PHE 217.A O no hydrogen 2.902 N/A PHE 222.A N ALA 218.A O no hydrogen 2.927 N/A LYS 224.A N GLY 219.A O no hydrogen 3.100 N/A GLY 230.A N PHE 228.A O no hydrogen 2.816 N/A HIS 231.A N ASP 235.A OD2 no hydrogen 2.968 N/A ASP 235.A N ASP 232.A OD1 no hydrogen 3.080 N/A GLN 236.A N ASP 232.A O no hydrogen 2.781 N/A GLN 236.A NE2 PHE 228.A O no hydrogen 2.971 N/A LEU 237.A N HIS 234.A O no hydrogen 3.202 N/A VAL 238.A N HIS 234.A O no hydrogen 3.384 N/A LYS 239.A N ASP 235.A O no hydrogen 2.813 N/A LYS 239.A NZ ASP 235.A OD1 no hydrogen 2.949 N/A LYS 239.A NZ ASP 235.A OD2 no hydrogen 2.955 N/A ILE 240.A N GLN 236.A O no hydrogen 3.140 N/A ALA 241.A N LEU 237.A O no hydrogen 2.782 N/A LYS 242.A N VAL 238.A O no hydrogen 2.752 N/A VAL 243.A N ILE 240.A O no hydrogen 2.788 N/A LEU 244.A N ILE 240.A O no hydrogen 2.898 N/A GLY 245.A N ALA 241.A O no hydrogen 2.894 N/A THR 246.A N HIS 271.A O no hydrogen 2.976 N/A THR 246.A OG1 HIS 271.A O no hydrogen 3.015 N/A ASN 250.A N THR 246.A O no hydrogen 2.864 N/A VAL 251.A N ASP 247.A O no hydrogen 3.133 N/A TYR 252.A N GLY 248.A O no hydrogen 3.085 N/A LEU 253.A N LEU 249.A O no hydrogen 2.857 N/A ASN 254.A N ASN 250.A O no hydrogen 3.059 N/A LYS 255.A N VAL 251.A O no hydrogen 2.920 N/A LYS 255.A NZ ASP 303.A OD2 no hydrogen 2.601 N/A TYR 256.A N TYR 252.A O no hydrogen 3.175 N/A TYR 256.A OH ASP 303.A OD1 no hydrogen 2.578 N/A ARG 257.A N ASN 254.A O no hydrogen 2.571 N/A ILE 258.A N LEU 253.A O no hydrogen 2.841 N/A LEU 264.A N ASP 261.A O no hydrogen 3.120 N/A LEU 264.A N PRO 262.A O no hydrogen 1.916 N/A GLU 265.A N ASP 261.A O no hydrogen 3.261 N/A VAL 268.A N GLU 265.A O no hydrogen 3.190 N/A GLY 269.A N GLU 265.A O no hydrogen 2.908 N/A HIS 271.A N THR 246.A OG1 no hydrogen 3.031 N/A LYS 274.A N VAL 243.A O no hydrogen 2.937 N/A TRP 276.A NE1 ASP 297.A OD1 no hydrogen 2.735 N/A LYS 278.A N PRO 275.A O no hydrogen 2.826 N/A PHE 279.A N TRP 276.A O no hydrogen 3.049 N/A MET 280.A N LEU 277.A O no hydrogen 3.194 N/A ASN 281.A N ASN 284.A OD1 no hydrogen 2.527 N/A ASN 284.A N ASN 281.A O no hydrogen 2.717 N/A ASN 284.A ND2 PHE 222.A O no hydrogen 2.874 N/A ASN 284.A ND2 PHE 279.A O no hydrogen 2.984 N/A GLN 285.A N ALA 282.A O no hydrogen 3.434 N/A VAL 288.A N ASN 284.A O no hydrogen 3.231 N/A ILE 293.A N SER 289.A O no hydrogen 2.963 N/A ASP 294.A N PRO 290.A O no hydrogen 3.026 N/A PHE 295.A N GLU 291.A O no hydrogen 3.036 N/A LEU 296.A N ALA 292.A O no hydrogen 2.741 N/A ASP 297.A N ILE 293.A O no hydrogen 2.618 N/A LYS 298.A N ASP 294.A O no hydrogen 3.177 N/A LYS 298.A N PHE 295.A O no hydrogen 3.209 N/A LYS 298.A NZ ASP 294.A OD2 no hydrogen 3.170 N/A LEU 299.A N LEU 296.A O no hydrogen 2.876 N/A LEU 300.A N LEU 296.A O no hydrogen 3.031 N/A ARG 301.A N LEU 299.A O no hydrogen 3.203 N/A ARG 301.A NH2 ASP 297.A OD2 no hydrogen 2.938 N/A TYR 302.A OH GLY 245.A O no hydrogen 2.841 N/A HIS 304.A NE2 SER 2.A OG no hydrogen 2.660 N/A GLN 305.A N ASP 303.A OD1 no hydrogen 3.154 N/A GLU 306.A N ASP 303.A O no hydrogen 2.743 N/A ARG 307.A N HIS 304.A O no hydrogen 3.286 N/A ARG 307.A NE ARG 301.A O no hydrogen 2.785 N/A ARG 307.A NH1 GLU 196.A OE1 no hydrogen 3.300 N/A ARG 307.A NH1 GLU 196.A OE2 no hydrogen 2.702 N/A ARG 307.A NH1 SER 207.A O no hydrogen 2.934 N/A ARG 307.A NH2 GLU 196.A OE1 no hydrogen 2.483 N/A ARG 307.A NH2 ARG 301.A O no hydrogen 3.431 N/A ARG 307.A NH2 TYR 302.A O no hydrogen 2.885 N/A LEU 308.A N LYS 298.A O no hydrogen 3.145 N/A THR 309.A N GLU 312.A OE1 no hydrogen 2.965 N/A THR 309.A OG1 GLU 312.A OE1 no hydrogen 3.266 N/A GLU 312.A N THR 309.A OG1 no hydrogen 3.127 N/A ALA 313.A N THR 309.A O no hydrogen 2.861 N/A MET 314.A N ALA 310.A O no hydrogen 3.256 N/A THR 315.A N GLU 312.A O no hydrogen 2.919 N/A THR 315.A OG1 GLU 312.A O no hydrogen 2.783 N/A HIS 316.A N ALA 313.A O no hydrogen 3.078 N/A HIS 316.A NE2 ASP 294.A OD2 no hydrogen 2.649 N/A TYR 318.A N HIS 316.A ND1 no hydrogen 2.828 N/A PHE 319.A N HIS 316.A O no hydrogen 2.931 N/A GLN 320.A N PRO 317.A O no hydrogen 3.136 N/A ARG 323.A N PHE 319.A O no hydrogen 3.038 N/A ARG 323.A NH1 MET 314.A O no hydrogen 3.116 N/A ARG 323.A NH1 HIS 316.A O no hydrogen 3.074 N/A ALA 324.A N GLN 320.A O no hydrogen 3.116 N/A ALA 325.A N ARG 323.A O no hydrogen 2.548 N/A GLU 326.A N ARG 323.A O no hydrogen 2.926 N/A ARG 329.A N ALA 325.A O no hydrogen 3.147 N/A