Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1gaq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG ASP 289.A OD2 no hydrogen 2.882 N/A LYS 3.A N ASP 289.A OD2 no hydrogen 2.822 N/A LYS 4.A N SER 2.A OG no hydrogen 2.837 N/A LYS 4.A NZ GLU 136.A O no hydrogen 2.983 N/A LYS 4.A NZ GLU 136.A OE2 no hydrogen 3.412 N/A GLN 5.A N MET 139.A O no hydrogen 2.511 N/A ASN 12.A N PRO 132.A O no hydrogen 2.991 N/A LEU 13.A N GLY 131.A O no hydrogen 2.949 N/A TYR 14.A N GLY 131.A O no hydrogen 3.190 N/A GLU 18.A N LYS 15.A O no hydrogen 2.737 N/A TYR 20.A N ILE 129.A O no hydrogen 2.896 N/A TYR 20.A OH GLU 47.A OE2 no hydrogen 2.456 N/A GLY 22.A N VAL 127.A O no hydrogen 2.958 N/A CYS 24.A N ASP 125.A O no hydrogen 3.118 N/A CYS 24.A SG LEU 26.A O no hydrogen 3.516 N/A LEU 25.A N VAL 43.A O no hydrogen 2.801 N/A LEU 26.A N VAL 43.A O no hydrogen 3.299 N/A ASN 27.A ND2 LEU 118.A O no hydrogen 3.350 N/A ASN 27.A ND2 LEU 121.A O no hydrogen 2.783 N/A THR 28.A N HIS 41.A O no hydrogen 2.968 N/A LYS 29.A NZ ASP 33.A OD1 no hydrogen 3.497 N/A LYS 29.A NZ ASP 33.A OD2 no hydrogen 3.542 N/A LYS 29.A NZ GLU 38.A OE1 no hydrogen 3.556 N/A ILE 30.A N THR 39.A O no hydrogen 3.196 N/A GLY 32.A N SER 190.A O no hydrogen 2.962 N/A ALA 35.A N GLY 32.A O no hydrogen 2.744 N/A TRP 40.A N VAL 97.A O no hydrogen 2.734 N/A TRP 40.A NE1 GLU 38.A OE2 no hydrogen 3.188 N/A HIS 41.A N THR 28.A O no hydrogen 2.885 N/A HIS 41.A ND1 TYR 194.A OH no hydrogen 2.684 N/A HIS 41.A NE2 ASP 86.A OD1 no hydrogen 2.819 N/A MET 42.A N LEU 95.A O no hydrogen 2.864 N/A VAL 43.A N LEU 26.A O no hydrogen 2.743 N/A PHE 44.A N VAL 93.A O no hydrogen 2.957 N/A SER 45.A N ARG 23.A O no hydrogen 2.937 N/A THR 46.A N LYS 91.A O no hydrogen 2.763 N/A THR 46.A OG1 LYS 91.A O no hydrogen 2.737 N/A GLU 47.A N LYS 91.A O no hydrogen 3.261 N/A LYS 49.A N THR 46.A O no hydrogen 2.984 N/A TYR 52.A N ILE 50.A O no hydrogen 2.728 N/A TYR 52.A OH SER 82.A O no hydrogen 2.604 N/A TYR 52.A OH THR 92.A O no hydrogen 3.348 N/A ARG 53.A NE GLY 8.A O no hydrogen 2.848 N/A GLU 54.A N GLU 54.A OE2 no hydrogen 2.615 N/A GLN 56.A N ARG 53.A O no hydrogen 3.088 N/A SER 57.A N VAL 133.A O no hydrogen 2.859 N/A SER 57.A OG VAL 133.A O no hydrogen 3.268 N/A ILE 58.A N TYR 77.A O no hydrogen 3.223 N/A GLY 59.A N THR 130.A O no hydrogen 2.889 N/A VAL 60.A N ARG 75.A O no hydrogen 2.955 N/A ILE 61.A N GLN 128.A O no hydrogen 3.044 N/A ASP 66.A N LYS 70.A O no hydrogen 3.107 N/A ASN 68.A N ASP 66.A O no hydrogen 2.474 N/A GLY 69.A N ASP 66.A O no hydrogen 3.003 N/A ARG 75.A N VAL 60.A O no hydrogen 3.162 N/A ARG 75.A NH1 LYS 73.A O no hydrogen 2.591 N/A TYR 77.A N ILE 58.A O no hydrogen 3.045 N/A SER 78.A OG GLU 294.A OE1 no hydrogen 3.435 N/A ILE 79.A N GLN 56.A O no hydrogen 3.440 N/A ALA 80.A N SER 94.A O no hydrogen 2.893 N/A SER 81.A OG TYR 52.A OH no hydrogen 3.054 N/A SER 82.A OG GLU 169.A OE1 no hydrogen 3.066 N/A SER 82.A OG GLU 169.A OE2 no hydrogen 3.200 N/A ALA 83.A N GLU 54.A OE1 no hydrogen 3.251 N/A GLY 85.A N SER 82.A O no hydrogen 2.759 N/A GLY 88.A N GLY 85.A O no hydrogen 3.381 N/A SER 90.A N ILE 84.A O no hydrogen 2.824 N/A LYS 91.A N ASP 89.A OD1 no hydrogen 2.687 N/A VAL 93.A N PHE 44.A O no hydrogen 3.198 N/A SER 94.A N SER 81.A OG no hydrogen 2.714 N/A SER 94.A OG ASP 86.A OD1 no hydrogen 2.945 N/A LEU 95.A N MET 42.A O no hydrogen 2.795 N/A CYS 96.A SG TYR 194.A OH no hydrogen 3.517 N/A VAL 97.A N TRP 40.A O no hydrogen 2.830 N/A ARG 99.A N GLU 38.A O no hydrogen 3.065 N/A ARG 99.A NE ASN 116.A OD1 no hydrogen 3.441 N/A ARG 99.A NH1 GLU 38.A OE2 no hydrogen 2.907 N/A ARG 99.A NH2 ASP 120.A OD2 no hydrogen 2.476 N/A LEU 100.A N SER 115.A OG no hydrogen 3.060 N/A TYR 102.A N VAL 110.A O no hydrogen 3.260 N/A ASN 104.A N GLU 108.A O no hydrogen 2.889 N/A ASN 104.A ND2 GLU 108.A OE1 no hydrogen 3.348 N/A GLY 107.A N ASN 104.A O no hydrogen 3.144 N/A GLU 108.A N ASN 104.A OD1 no hydrogen 2.812 N/A VAL 110.A N TYR 102.A O no hydrogen 2.700 N/A GLY 112.A N LEU 100.A O no hydrogen 2.951 N/A CYS 114.A SG TYR 77.A OH no hydrogen 3.525 N/A ASN 116.A ND2 LEU 100.A O no hydrogen 2.863 N/A ASN 116.A ND2 GLY 112.A O no hydrogen 2.785 N/A PHE 117.A N VAL 113.A O no hydrogen 3.042 N/A LEU 118.A N CYS 114.A O no hydrogen 2.774 N/A CYS 119.A N SER 115.A O no hydrogen 3.254 N/A CYS 119.A SG VAL 97.A O no hydrogen 3.661 N/A CYS 119.A SG SER 115.A O no hydrogen 3.141 N/A LEU 121.A N LEU 118.A O no hydrogen 3.108 N/A GLN 122.A N ASP 125.A OD2 no hydrogen 2.653 N/A GLY 124.A N CYS 24.A O no hydrogen 2.725 N/A ASP 125.A N GLN 122.A O no hydrogen 2.796 N/A VAL 127.A N GLY 22.A O no hydrogen 3.232 N/A ILE 129.A N TYR 20.A O no hydrogen 2.820 N/A THR 130.A N GLY 59.A O no hydrogen 2.918 N/A GLY 131.A N TYR 14.A O no hydrogen 2.829 N/A VAL 133.A N SER 57.A O no hydrogen 2.558 N/A LYS 141.A N LYS 3.A O no hydrogen 3.093 N/A ASN 144.A N ASP 142.A OD1 no hydrogen 3.378 N/A THR 146.A N ASN 248.A O no hydrogen 2.635 N/A ILE 148.A N TYR 250.A O no hydrogen 3.171 N/A MET 149.A N TRP 181.A O no hydrogen 2.559 N/A LEU 150.A N TYR 252.A O no hydrogen 2.746 N/A ALA 151.A N PHE 183.A O no hydrogen 2.726 N/A THR 152.A N CYS 254.A O no hydrogen 3.440 N/A GLY 153.A N GLY 185.A O no hydrogen 3.315 N/A THR 154.A OG1 TYR 296.A OH no hydrogen 2.985 N/A GLY 155.A N THR 152.A O no hydrogen 2.819 N/A ILE 156.A N GLY 153.A O no hydrogen 3.057 N/A ALA 157.A N THR 154.A O no hydrogen 3.198 N/A ARG 160.A N ILE 156.A O no hydrogen 2.879 N/A ARG 160.A N ALA 157.A O no hydrogen 3.097 N/A ARG 160.A NH1 ALA 80.A O no hydrogen 2.944 N/A ARG 160.A NH1 ASP 86.A OD1 no hydrogen 3.149 N/A ARG 160.A NH1 ASP 86.A OD2 no hydrogen 2.859 N/A ARG 160.A NH2 GLU 197.A OE2 no hydrogen 3.351 N/A SER 161.A N ALA 157.A O no hydrogen 3.199 N/A SER 161.A OG SER 81.A O no hydrogen 2.972 N/A PHE 162.A N PRO 158.A O no hydrogen 2.949 N/A LEU 163.A N PHE 159.A O no hydrogen 2.868 N/A TRP 164.A N ARG 160.A O no hydrogen 3.199 N/A TRP 164.A NE1 GLU 197.A OE1 no hydrogen 2.874 N/A LYS 165.A N PHE 162.A O no hydrogen 3.031 N/A MET 166.A N PHE 162.A O no hydrogen 3.173 N/A PHE 167.A N LEU 163.A O no hydrogen 3.044 N/A LYS 175.A NZ HIS 171.A O no hydrogen 3.198 N/A ASN 177.A N PRO 143.A O no hydrogen 2.704 N/A GLY 180.A N ASN 208.A O no hydrogen 2.701 N/A TRP 181.A N ILE 147.A O no hydrogen 2.934 N/A TRP 181.A NE1 ASP 212.A OD1 no hydrogen 2.676 N/A LEU 182.A N ARG 210.A O no hydrogen 2.959 N/A PHE 183.A N MET 149.A O no hydrogen 2.812 N/A LEU 184.A N ASP 212.A O no hydrogen 3.077 N/A GLY 185.A N ALA 151.A O no hydrogen 2.798 N/A THR 188.A OG1 SER 190.A OG no hydrogen 2.491 N/A THR 188.A OG1 SER 191.A OG no hydrogen 3.177 N/A SER 190.A OG ASP 34.A OD1 no hydrogen 3.172 N/A SER 190.A OG THR 188.A OG1 no hydrogen 2.491 N/A SER 191.A N THR 188.A O no hydrogen 3.034 N/A SER 191.A OG THR 188.A OG1 no hydrogen 3.177 N/A LEU 192.A N SER 189.A O no hydrogen 3.057 N/A TYR 194.A OH HIS 41.A ND1 no hydrogen 2.684 N/A LYS 195.A NZ GLU 196.A OE2 no hydrogen 3.068 N/A PHE 198.A N TYR 194.A O no hydrogen 3.031 N/A GLY 199.A N GLU 196.A O no hydrogen 2.691 N/A LYS 200.A N GLU 196.A O no hydrogen 2.975 N/A MET 201.A N GLU 197.A O no hydrogen 2.979 N/A LYS 202.A N PHE 198.A O no hydrogen 3.365 N/A LYS 202.A NZ PRO 206.A O no hydrogen 3.129 N/A LYS 202.A NZ PHE 209.A O no hydrogen 3.299 N/A GLU 203.A N LYS 200.A O no hydrogen 3.086 N/A ARG 204.A N LYS 200.A O no hydrogen 2.845 N/A ASN 208.A N ALA 205.A O no hydrogen 3.026 N/A PHE 209.A N ALA 205.A O no hydrogen 3.238 N/A ARG 210.A N GLY 180.A O no hydrogen 3.132 N/A ARG 210.A NH1 GLU 239.A OE1 no hydrogen 2.539 N/A ASP 212.A N LEU 182.A O no hydrogen 2.849 N/A ALA 214.A N LEU 184.A O no hydrogen 2.795 N/A SER 216.A N VAL 186.A O no hydrogen 2.915 N/A SER 216.A OG VAL 186.A O no hydrogen 3.278 N/A ARG 217.A N PRO 187.A O no hydrogen 3.248 N/A ASN 221.A N GLU 225.A O no hydrogen 3.267 N/A GLY 224.A N ALA 222.A O no hydrogen 2.554 N/A ARG 226.A NE SER 216.A O no hydrogen 3.186 N/A MET 227.A N GLN 219.A O no hydrogen 2.696 N/A THR 231.A N TYR 228.A O no hydrogen 2.710 N/A THR 231.A OG1 ARG 226.A O no hydrogen 3.162 N/A ARG 232.A N TYR 228.A O no hydrogen 2.855 N/A ARG 232.A NE TYR 213.A O no hydrogen 2.727 N/A ARG 232.A NH2 TYR 213.A O no hydrogen 3.409 N/A ARG 232.A NH2 GLN 219.A OE1 no hydrogen 2.653 N/A ALA 234.A N GLN 230.A O no hydrogen 3.132 N/A ALA 234.A N THR 231.A O no hydrogen 3.236 N/A GLU 235.A N ARG 232.A O no hydrogen 3.215 N/A TYR 236.A N MET 233.A O no hydrogen 3.066 N/A TYR 236.A OH ASP 212.A OD2 no hydrogen 2.756 N/A LYS 237.A N ALA 234.A O no hydrogen 2.993 N/A LEU 240.A N TYR 236.A O no hydrogen 2.890 N/A TRP 241.A N LYS 237.A O no hydrogen 3.115 N/A GLU 242.A N GLU 238.A O no hydrogen 3.242 N/A LEU 243.A N LEU 240.A O no hydrogen 2.942 N/A LEU 244.A N LEU 240.A O no hydrogen 3.210 N/A LYS 245.A N LEU 243.A O no hydrogen 2.560 N/A LYS 245.A NZ GLU 242.A OE2 no hydrogen 2.649 N/A LYS 246.A N LEU 243.A O no hydrogen 3.097 N/A THR 249.A N LYS 246.A O no hydrogen 3.040 N/A THR 249.A OG1 LEU 243.A O no hydrogen 2.833 N/A TYR 250.A N THR 146.A O no hydrogen 3.085 N/A VAL 251.A N GLN 290.A O no hydrogen 2.585 N/A TYR 252.A N ILE 148.A O no hydrogen 2.735 N/A TYR 252.A OH LEU 138.A O no hydrogen 2.823 N/A MET 253.A N ASN 292.A O no hydrogen 3.095 N/A CYS 254.A N LEU 150.A O no hydrogen 3.102 N/A CYS 254.A SG GLY 155.A O no hydrogen 3.697 N/A CYS 254.A SG GLU 294.A O no hydrogen 3.415 N/A GLY 255.A N GLU 294.A O no hydrogen 3.378 N/A LYS 257.A N TYR 296.A O no hydrogen 2.585 N/A MET 259.A N LEU 256.A O no hydrogen 3.244 N/A LYS 261.A N GLY 258.A O no hydrogen 3.289 N/A LYS 261.A NZ ASP 265.A OD2 no hydrogen 2.667 N/A ASP 264.A N GLU 260.A O no hydrogen 3.289 N/A ASP 265.A N LYS 261.A O no hydrogen 2.859 N/A ILE 266.A N GLY 262.A O no hydrogen 2.865 N/A MET 267.A N ASP 264.A O no hydrogen 3.029 N/A VAL 268.A N ASP 264.A O no hydrogen 2.600 N/A SER 269.A N ASP 265.A O no hydrogen 3.454 N/A ALA 271.A N MET 267.A O no hydrogen 2.962 N/A GLU 272.A N VAL 268.A O no hydrogen 2.570 N/A ASP 274.A N ALA 271.A O no hydrogen 2.660 N/A TRP 278.A NE1 ASP 264.A OD2 no hydrogen 2.843 N/A TYR 281.A N TRP 278.A O no hydrogen 2.673 N/A TYR 281.A OH LEU 244.A O no hydrogen 2.552 N/A LYS 282.A N TRP 278.A O no hydrogen 2.922 N/A LYS 282.A N PHE 279.A O no hydrogen 3.037 N/A LYS 282.A NZ ASP 264.A OD1 no hydrogen 3.354 N/A LYS 282.A NZ ASP 264.A OD2 no hydrogen 2.599 N/A LYS 283.A N PHE 279.A O no hydrogen 3.391 N/A GLN 284.A N TYR 281.A O no hydrogen 2.921 N/A GLN 284.A NE2 ASP 280.A O no hydrogen 2.460 N/A LEU 285.A N TYR 281.A O no hydrogen 3.100 N/A LYS 286.A N LYS 282.A O no hydrogen 2.887 N/A GLY 288.A N LEU 285.A O no hydrogen 2.810 N/A GLN 290.A N LEU 285.A O no hydrogen 3.177 N/A GLN 290.A NE2 LYS 246.A O no hydrogen 2.916 N/A GLN 290.A NE2 THR 249.A O no hydrogen 2.946 N/A ASN 292.A N VAL 251.A O no hydrogen 3.272 N/A ASN 292.A ND2 GLU 136.A O no hydrogen 3.077 N/A ASN 292.A ND2 GLU 136.A OE2 no hydrogen 2.952 N/A TYR 296.A N GLY 255.A O no hydrogen 2.883 N/A TYR 296.A OH THR 154.A OG1 no hydrogen 2.985 N/A