Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i0q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.A N GLN 3.A O no hydrogen 3.032 N/A ILE 8.A N ALA 4.A O no hydrogen 2.640 N/A GLU 9.A N GLN 5.A O no hydrogen 3.095 N/A GLU 9.A N GLN 6.A O no hydrogen 3.062 N/A LEU 10.A N GLN 6.A O no hydrogen 3.301 N/A LEU 11.A N LEU 7.A O no hydrogen 3.122 N/A LYS 12.A N ILE 8.A O no hydrogen 3.277 N/A LYS 12.A NZ ASP 18.A OD1 no hydrogen 3.065 N/A VAL 13.A N GLU 9.A O no hydrogen 2.773 N/A HIS 14.A N LEU 10.A O no hydrogen 2.654 N/A TYR 15.A N LEU 11.A O no hydrogen 2.731 N/A GLY 16.A N LEU 11.A O no hydrogen 2.808 N/A HIS 20.A N ASP 33.A O no hydrogen 3.226 N/A HIS 20.A NE2 SER 34.A O no hydrogen 2.831 N/A THR 21.A N ASP 33.A O no hydrogen 3.519 N/A ILE 25.A N ALA 29.A O no hydrogen 3.228 N/A PHE 28.A N LEU 43.A O no hydrogen 2.707 N/A TYR 30.A N ILE 41.A O no hydrogen 3.408 N/A TYR 30.A OH ILE 2.A O no hydrogen 3.166 N/A GLN 31.A NE2 ASP 33.A OD1 no hydrogen 2.669 N/A GLN 31.A NE2 ASP 33.A OD2 no hydrogen 3.251 N/A SER 34.A N LYS 37.A O no hydrogen 2.782 N/A SER 34.A OG LYS 37.A O no hydrogen 3.255 N/A SER 36.A N SER 34.A OG no hydrogen 2.685 N/A SER 36.A OG SER 34.A OG no hydrogen 3.412 N/A LYS 37.A N SER 34.A OG no hydrogen 2.714 N/A SER 38.A OG ASP 33.A OD1 no hydrogen 3.219 N/A SER 38.A OG ASP 33.A OD2 no hydrogen 3.425 N/A TYR 39.A N ALA 32.A O no hydrogen 3.117 N/A PHE 40.A N TYR 90.A O no hydrogen 2.593 N/A ILE 41.A N TYR 30.A O no hydrogen 3.101 N/A LYS 42.A N ILE 88.A O no hydrogen 2.696 N/A LEU 43.A N PHE 28.A O no hydrogen 2.860 N/A LYS 44.A N LYS 86.A O no hydrogen 3.384 N/A ASN 52.A ND2 ASP 222.A OD1 no hydrogen 3.346 N/A ILE 56.A N ASN 52.A O no hydrogen 3.344 N/A ARG 57.A N LEU 53.A O no hydrogen 3.120 N/A LEU 58.A N SER 54.A O no hydrogen 2.902 N/A LEU 59.A N ILE 55.A O no hydrogen 2.678 N/A HIS 60.A N ILE 56.A O no hydrogen 2.655 N/A ASP 61.A N ARG 57.A O no hydrogen 2.810 N/A SER 62.A N LEU 58.A O no hydrogen 3.037 N/A SER 62.A OG THR 121.A OG1 no hydrogen 2.951 N/A GLY 63.A N HIS 60.A O no hydrogen 2.928 N/A ILE 64.A N LEU 59.A O no hydrogen 3.266 N/A ILE 71.A N ALA 89.A O no hydrogen 3.000 N/A THR 73.A N LYS 77.A O no hydrogen 2.827 N/A THR 73.A OG1 LYS 77.A O no hydrogen 2.969 N/A THR 73.A OG1 PHE 79.A O no hydrogen 3.441 N/A LEU 74.A N HIS 14.A O no hydrogen 3.009 N/A ALA 76.A N THR 73.A O no hydrogen 2.372 N/A LYS 77.A N THR 73.A OG1 no hydrogen 2.992 N/A GLN 80.A N ILE 87.A O no hydrogen 3.058 N/A ILE 88.A N LYS 42.A O no hydrogen 3.212 N/A TYR 90.A N PHE 40.A O no hydrogen 2.705 N/A PHE 92.A N SER 38.A O no hydrogen 2.870 N/A GLY 98.A N ALA 205.A O no hydrogen 2.790 N/A PHE 99.A N ASN 97.A OD1 no hydrogen 2.822 N/A THR 100.A N ASN 97.A O no hydrogen 2.841 N/A GLN 101.A N ASN 97.A O no hydrogen 2.603 N/A THR 104.A N GLN 107.A OE1 no hydrogen 2.629 N/A GLN 107.A N THR 104.A OG1 no hydrogen 2.897 N/A TRP 108.A N THR 104.A O no hydrogen 2.911 N/A TRP 108.A NE1 GLU 249.A OE2 no hydrogen 2.654 N/A LYS 109.A N GLY 105.A O no hydrogen 3.139 N/A LYS 109.A NZ GLU 255.A OE2 no hydrogen 3.504 N/A GLN 110.A N LYS 106.A O no hydrogen 3.123 N/A GLN 110.A NE2 GLU 66.A OE2 no hydrogen 2.546 N/A LEU 111.A N GLN 107.A O no hydrogen 2.971 N/A LEU 111.A N TRP 108.A O no hydrogen 2.991 N/A GLY 112.A N TRP 108.A O no hydrogen 3.008 N/A LYS 113.A N LYS 109.A O no hydrogen 2.966 N/A VAL 114.A N GLN 110.A O no hydrogen 3.111 N/A LEU 115.A N LEU 111.A O no hydrogen 3.104 N/A ARG 116.A N GLY 112.A O no hydrogen 3.189 N/A ARG 116.A NE GLU 120.A OE2 no hydrogen 3.393 N/A GLN 117.A N LYS 113.A O no hydrogen 3.210 N/A ILE 118.A N VAL 114.A O no hydrogen 3.040 N/A HIS 119.A N LEU 115.A O no hydrogen 2.842 N/A HIS 119.A ND1 TYR 257.A OH no hydrogen 2.710 N/A HIS 119.A NE2 ASP 232.A OD2 no hydrogen 3.192 N/A GLU 120.A N ARG 116.A O no hydrogen 2.679 N/A GLU 120.A N GLN 117.A O no hydrogen 2.823 N/A THR 121.A N ILE 118.A O no hydrogen 3.052 N/A THR 121.A OG1 SER 62.A OG no hydrogen 2.951 N/A THR 121.A OG1 GLN 117.A O no hydrogen 3.236 N/A GLN 128.A N PRO 124.A O no hydrogen 2.745 N/A GLN 128.A NE2 VAL 123.A O no hydrogen 2.362 N/A GLN 129.A N SER 126.A O no hydrogen 3.135 N/A GLN 129.A NE2 ILE 125.A O no hydrogen 3.538 N/A GLN 130.A N ILE 127.A O no hydrogen 3.115 N/A LEU 131.A N ILE 127.A O no hydrogen 3.394 N/A LYS 133.A NZ GLN 128.A O no hydrogen 2.854 N/A LYS 133.A NZ LEU 131.A O no hydrogen 2.684 N/A GLU 134.A N LEU 226.A O no hydrogen 3.267 N/A LYS 139.A N SER 137.A OG no hydrogen 3.015 N/A ARG 141.A NH1 SER 137.A O no hydrogen 3.055 N/A ARG 141.A NH2 TYR 136.A O no hydrogen 3.562 N/A GLU 142.A N PRO 138.A O no hydrogen 3.302 N/A ILE 143.A N LYS 139.A O no hydrogen 3.212 N/A ILE 143.A N TRP 140.A O no hydrogen 2.940 N/A VAL 144.A N TRP 140.A O no hydrogen 3.069 N/A ARG 145.A N ARG 141.A O no hydrogen 2.823 N/A ARG 145.A NH1 GLU 183.A OE1 no hydrogen 3.041 N/A ARG 145.A NH2 GLU 183.A OE1 no hydrogen 3.006 N/A SER 146.A N GLU 142.A O no hydrogen 3.143 N/A SER 146.A OG ILE 143.A O no hydrogen 3.215 N/A PHE 147.A N VAL 144.A O no hydrogen 3.006 N/A TYR 148.A N ARG 145.A O no hydrogen 3.005 N/A SER 156.A OG ASP 154.A OD1 no hydrogen 3.512 N/A ALA 162.A N ASP 158.A O no hydrogen 2.820 N/A PHE 164.A N LEU 160.A O no hydrogen 3.373 N/A LYS 165.A N THR 161.A O no hydrogen 3.051 N/A LYS 165.A NZ GLU 152.A O no hydrogen 3.328 N/A LYS 165.A NZ ASP 157.A OD1 no hydrogen 2.567 N/A SER 166.A N ALA 162.A O no hydrogen 2.705 N/A PHE 167.A N ALA 163.A O no hydrogen 2.702 N/A PHE 168.A N PHE 164.A O no hydrogen 2.742 N/A ASN 169.A N LYS 165.A O no hydrogen 3.311 N/A ASN 169.A N SER 166.A O no hydrogen 2.528 N/A GLN 170.A N SER 166.A O no hydrogen 2.792 N/A ASN 171.A N PHE 168.A O no hydrogen 3.332 N/A ASN 171.A ND2 PHE 167.A O no hydrogen 3.099 N/A SER 172.A N ASN 169.A O no hydrogen 3.041 N/A ILE 175.A N ASN 171.A O no hydrogen 3.303 N/A HIS 176.A N SER 172.A O no hydrogen 2.962 N/A ARG 177.A N ALA 173.A O no hydrogen 3.183 N/A LEU 178.A N ALA 174.A O no hydrogen 2.952 N/A VAL 179.A N ILE 175.A O no hydrogen 2.832 N/A ASP 180.A N HIS 176.A O no hydrogen 2.491 N/A THR 181.A N ARG 177.A O no hydrogen 2.542 N/A THR 181.A OG1 ARG 177.A O no hydrogen 2.649 N/A SER 182.A N LEU 178.A O no hydrogen 2.923 N/A SER 182.A OG GLU 273.A OE1 no hydrogen 3.134 N/A GLU 183.A N VAL 179.A O no hydrogen 2.871 N/A LYS 184.A N ASP 180.A O no hydrogen 2.988 N/A LEU 185.A N THR 181.A O no hydrogen 2.898 N/A SER 186.A OG GLU 183.A O no hydrogen 2.718 N/A LYS 187.A NZ GLU 183.A OE2 no hydrogen 3.386 N/A LYS 188.A N LEU 185.A O no hydrogen 3.207 N/A ILE 189.A N SER 186.A O no hydrogen 3.019 N/A ASP 194.A N ASP 192.A OD1 no hydrogen 2.865 N/A LYS 195.A N ASP 192.A O no hydrogen 2.662 N/A TYR 196.A OH GLU 134.A O no hydrogen 2.772 N/A VAL 197.A N ALA 227.A O no hydrogen 2.806 N/A CYS 199.A N MET 225.A O no hydrogen 2.712 N/A CYS 199.A SG VAL 197.A O no hydrogen 3.288 N/A CYS 199.A SG ALA 227.A O no hydrogen 3.274 N/A CYS 199.A SG PRO 228.A O no hydrogen 4.045 N/A HIS 200.A N ASP 232.A OD2 no hydrogen 2.923 N/A HIS 200.A NE2 ILE 219.A O no hydrogen 2.662 N/A SER 201.A OG GLU 223.A O no hydrogen 3.292 N/A ASP 202.A N HIS 200.A ND1 no hydrogen 3.035 N/A HIS 204.A N ASP 202.A O no hydrogen 3.139 N/A ASN 207.A N HIS 204.A O no hydrogen 2.718 N/A ASN 207.A ND2 ASP 202.A O no hydrogen 2.873 N/A VAL 208.A N ALA 205.A O no hydrogen 3.450 N/A LEU 209.A N TYR 217.A O no hydrogen 2.939 N/A VAL 210.A N PRO 96.A O no hydrogen 2.776 N/A SER 215.A N ASN 212.A O no hydrogen 3.106 N/A TYR 217.A N LEU 209.A O no hydrogen 2.997 N/A ILE 218.A N GLU 66.A O no hydrogen 2.812 N/A ILE 219.A N ASN 207.A O no hydrogen 2.773 N/A MET 225.A N CYS 199.A O no hydrogen 2.947 N/A LEU 226.A N ARG 132.A O no hydrogen 3.126 N/A ALA 227.A N VAL 197.A O no hydrogen 2.984 N/A LYS 229.A NZ GLU 230.A OE2 no hydrogen 2.510 N/A LYS 229.A NZ ASN 261.A O no hydrogen 2.866 N/A GLU 230.A N GLU 230.A OE1 no hydrogen 2.588 N/A ARG 231.A N PRO 228.A O no hydrogen 2.634 N/A ASP 232.A N LYS 229.A O no hydrogen 2.779 N/A LEU 233.A N LYS 229.A O no hydrogen 3.171 N/A MET 234.A N GLU 230.A O no hydrogen 3.080 N/A PHE 235.A N ASP 232.A O no hydrogen 2.796 N/A ILE 236.A N LEU 233.A O no hydrogen 3.096 N/A GLY 238.A N PHE 235.A O no hydrogen 2.872 N/A GLY 239.A N TRP 244.A O no hydrogen 3.131 N/A ASN 242.A N GLY 239.A O no hydrogen 2.783 N/A ASN 242.A ND2 PRO 304.A O no hydrogen 3.375 N/A GLU 249.A N LYS 246.A O no hydrogen 2.893 N/A ILE 250.A N PRO 247.A O no hydrogen 3.057 N/A PHE 253.A N GLU 249.A O no hydrogen 3.222 N/A TYR 254.A N ILE 250.A O no hydrogen 3.331 N/A GLU 255.A N GLN 251.A O no hydrogen 3.150 N/A GLY 256.A N PHE 253.A O no hydrogen 3.055 N/A TYR 257.A N PHE 253.A O no hydrogen 3.137 N/A TYR 257.A OH HIS 119.A ND1 no hydrogen 2.710 N/A GLY 258.A N TYR 254.A O no hydrogen 3.055 N/A THR 265.A N ASP 263.A OD1 no hydrogen 2.882 N/A ILE 266.A N ASP 263.A O no hydrogen 2.793 N/A ILE 266.A N ASP 263.A OD1 no hydrogen 3.307 N/A LEU 267.A N ASP 263.A O no hydrogen 3.118 N/A SER 268.A N LYS 264.A O no hydrogen 2.825 N/A TYR 269.A N THR 265.A O no hydrogen 2.902 N/A TYR 270.A N ILE 266.A O no hydrogen 2.953 N/A ARG 271.A N SER 268.A O no hydrogen 2.772 N/A ARG 271.A NE MET 234.A O no hydrogen 3.175 N/A ARG 271.A NH2 MET 234.A O no hydrogen 3.157 N/A HIS 272.A N SER 268.A O no hydrogen 3.145 N/A HIS 272.A N TYR 269.A O no hydrogen 3.210 N/A HIS 272.A ND1 SER 268.A O no hydrogen 2.898 N/A GLU 273.A N TYR 269.A O no hydrogen 2.934 N/A ARG 274.A N TYR 270.A O no hydrogen 3.220 N/A ARG 274.A NH1 ASP 278.A OD2 no hydrogen 2.647 N/A ARG 274.A NH2 ASP 202.A OD2 no hydrogen 3.461 N/A VAL 276.A N HIS 272.A O no hydrogen 3.008 N/A GLU 277.A N GLU 273.A O no hydrogen 2.968 N/A ASP 278.A N ARG 274.A O no hydrogen 3.004 N/A ILE 279.A N ILE 275.A O no hydrogen 2.743 N/A ALA 280.A N VAL 276.A O no hydrogen 2.735 N/A VAL 281.A N GLU 277.A O no hydrogen 2.530 N/A TYR 282.A N ASP 278.A O no hydrogen 2.571 N/A GLN 284.A N ALA 280.A O no hydrogen 3.059 N/A ASP 285.A N VAL 281.A O no hydrogen 3.244 N/A LEU 286.A N TYR 282.A O no hydrogen 3.314 N/A LEU 286.A N GLY 283.A O no hydrogen 2.904 N/A GLU 293.A N SER 290.A O no hydrogen 2.907 N/A SER 294.A N SER 290.A O no hydrogen 2.554 N/A SER 294.A OG ASP 285.A OD2 no hydrogen 3.363 N/A SER 294.A OG SER 290.A O no hydrogen 2.958 N/A TYR 297.A N GLU 293.A O no hydrogen 2.834 N/A LYS 299.A N PHE 295.A O no hydrogen 3.048 N/A GLU 300.A N LYS 296.A O no hydrogen 3.246 N/A GLU 300.A N TYR 297.A O no hydrogen 3.095 N/A MET 301.A N TYR 297.A O no hydrogen 3.321 N/A MET 301.A N PHE 298.A O no hydrogen 3.263 N/A PHE 302.A N LYS 299.A O no hydrogen 3.212 N/A ASP 303.A N GLU 300.A O no hydrogen 3.069 N/A ASN 305.A N GLU 309.A OE2 no hydrogen 2.417 N/A ASN 306.A N ASP 303.A O no hydrogen 3.191 N/A VAL 307.A N ASN 306.A OD1 no hydrogen 2.765 N/A VAL 308.A N MET 301.A O no hydrogen 3.182 N/A ILE 310.A N ASN 306.A O no hydrogen 3.319 N/A ALA 311.A N VAL 308.A O no hydrogen 3.224 N/A PHE 312.A N VAL 308.A O no hydrogen 3.199 N/A PHE 312.A N GLU 309.A O no hydrogen 2.642 N/A ALA 313.A N GLU 309.A O no hydrogen 2.740 N/A GLU 315.A N ALA 313.A O no hydrogen 2.595 N/A GLN 316.A NE2 LYS 264.A O no hydrogen 3.120 N/A