Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u5z_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ILE 3.A O no hydrogen 3.379 N/A ILE 3.A N SER 1.A OG no hydrogen 2.691 N/A THR 4.A N GLU 23.A OE2 no hydrogen 2.606 N/A THR 4.A OG1 GLU 23.A OE1 no hydrogen 2.621 N/A THR 4.A OG1 GLU 23.A OE2 no hydrogen 2.815 N/A ASN 6.A N LYS 15.A O no hydrogen 2.819 N/A ASN 6.A ND2 GLN 14.A O no hydrogen 2.942 N/A GLU 13.A N ILE 11.A O no hydrogen 2.621 N/A LYS 15.A NZ GLU 184.A OE1 no hydrogen 3.125 N/A LYS 15.A NZ GLU 184.A OE2 no hydrogen 3.133 N/A TYR 16.A OH GLU 184.A OE1 no hydrogen 2.735 N/A ARG 17.A NE THR 59.A OG1 no hydrogen 3.243 N/A ARG 17.A NH2 THR 59.A OG1 no hydrogen 3.375 N/A ILE 21.A N ASP 67.A OD2 no hydrogen 3.064 N/A ASP 22.A N THR 20.A OG1 no hydrogen 2.855 N/A GLU 23.A N THR 20.A OG1 no hydrogen 3.218 N/A CYS 24.A SG THR 20.A O no hydrogen 3.579 N/A CYS 24.A SG ILE 21.A O no hydrogen 4.021 N/A ALA 28.A N ASP 165.A OD1 no hydrogen 3.354 N/A LYS 31.A N PRO 27.A O no hydrogen 3.012 N/A LYS 31.A NZ ILE 21.A O no hydrogen 3.238 N/A LYS 31.A NZ ASP 22.A O no hydrogen 2.739 N/A GLU 32.A N ALA 28.A O no hydrogen 3.134 N/A THR 33.A N PHE 29.A O no hydrogen 2.767 N/A PHE 34.A N ASP 30.A O no hydrogen 2.994 N/A PHE 34.A N LYS 31.A O no hydrogen 3.046 N/A LYS 35.A N LYS 31.A O no hydrogen 3.054 N/A LYS 35.A NZ ASP 22.A OD1 no hydrogen 3.552 N/A LYS 35.A NZ ASP 22.A OD2 no hydrogen 3.152 N/A SER 36.A N GLU 32.A O no hydrogen 2.883 N/A ILE 37.A N PHE 34.A O no hydrogen 3.244 N/A THR 38.A N PHE 34.A O no hydrogen 3.197 N/A THR 38.A OG1 PHE 34.A O no hydrogen 3.169 N/A THR 38.A OG1 LYS 35.A O no hydrogen 2.737 N/A SER 39.A N LYS 35.A O no hydrogen 2.906 N/A SER 39.A OG LYS 35.A O no hydrogen 2.923 N/A LYS 40.A N SER 36.A O no hydrogen 3.395 N/A GLY 41.A N ILE 37.A O no hydrogen 3.310 N/A LYS 42.A NZ GLN 102.A OE1 no hydrogen 3.486 N/A HIS 45.A NE2 SER 130.A OG no hydrogen 3.088 N/A ILE 46.A N ILE 135.A O no hydrogen 2.956 N/A ILE 47.A N ARG 154.A O no hydrogen 2.941 N/A LEU 48.A N ILE 137.A O no hydrogen 2.592 N/A HIS 49.A N ILE 156.A O no hydrogen 3.420 N/A SER 50.A N ALA 139.A O no hydrogen 3.367 N/A SER 52.A OG PRO 53.A O no hydrogen 3.148 N/A LYS 57.A NZ THR 55.A OG1 no hydrogen 3.163 N/A THR 59.A N GLY 56.A O no hydrogen 2.893 N/A VAL 60.A N GLY 56.A O no hydrogen 2.690 N/A ALA 61.A N LYS 57.A O no hydrogen 3.132 N/A LYS 62.A N THR 58.A O no hydrogen 3.502 N/A ALA 63.A N THR 59.A O no hydrogen 2.973 N/A LEU 64.A N VAL 60.A O no hydrogen 3.212 N/A CYS 65.A N ALA 61.A O no hydrogen 3.362 N/A CYS 65.A SG ALA 61.A O no hydrogen 3.600 N/A HIS 66.A N LYS 62.A O no hydrogen 3.192 N/A ASP 67.A N ALA 63.A O no hydrogen 2.834 N/A VAL 68.A N LEU 64.A O no hydrogen 3.164 N/A VAL 68.A N CYS 65.A O no hydrogen 3.271 N/A ASN 69.A N HIS 66.A O no hydrogen 3.167 N/A ALA 70.A N CYS 65.A O no hydrogen 2.912 N/A ASP 71.A N GLN 102.A O no hydrogen 2.911 N/A MET 73.A N VAL 104.A O no hydrogen 3.167 N/A VAL 75.A N VAL 106.A O no hydrogen 2.816 N/A GLY 77.A N ASP 108.A O no hydrogen 2.547 N/A SER 78.A N ASN 76.A OD1 no hydrogen 3.330 N/A ASP 79.A N ASN 76.A O no hydrogen 2.765 N/A CYS 80.A N GLY 77.A O no hydrogen 2.927 N/A PHE 84.A N LYS 81.A O no hydrogen 2.814 N/A VAL 85.A N LYS 81.A O no hydrogen 3.144 N/A ARG 86.A N ILE 82.A O no hydrogen 3.174 N/A ARG 86.A NH1 ASP 83.A OD1 no hydrogen 3.408 N/A GLY 87.A N PHE 84.A O no hydrogen 2.930 N/A LEU 89.A N PHE 84.A O no hydrogen 3.111 N/A THR 90.A N GLY 87.A O no hydrogen 2.760 N/A ASN 91.A N GLY 87.A O no hydrogen 2.856 N/A PHE 92.A N PRO 88.A O no hydrogen 3.275 N/A ALA 93.A N LEU 89.A O no hydrogen 3.194 N/A SER 94.A N THR 90.A O no hydrogen 2.937 N/A SER 94.A OG THR 90.A O no hydrogen 3.308 N/A ALA 95.A N ASN 91.A O no hydrogen 3.230 N/A ALA 95.A N PHE 92.A O no hydrogen 3.220 N/A ARG 101.A NE ASP 99.A OD2 no hydrogen 3.157 N/A ARG 101.A NH2 ASP 99.A OD2 no hydrogen 2.842 N/A GLN 102.A NE2 LYS 103.A O no hydrogen 3.511 N/A LYS 103.A NZ ALA 95.A O no hydrogen 3.138 N/A VAL 104.A N ASP 71.A O no hydrogen 2.829 N/A ILE 105.A N SER 134.A O no hydrogen 2.772 N/A VAL 106.A N MET 73.A O no hydrogen 2.884 N/A ILE 107.A N ILE 136.A O no hydrogen 2.888 N/A ASP 108.A N VAL 75.A O no hydrogen 2.981 N/A PHE 110.A N THR 138.A O no hydrogen 2.886 N/A ALA 116.A N SER 113.A O no hydrogen 3.342 N/A SER 118.A OG CYS 80.A O no hydrogen 3.250 N/A GLN 119.A N LEU 115.A O no hydrogen 2.731 N/A GLN 119.A NE2 PHE 110.A O no hydrogen 3.247 N/A GLN 119.A NE2 GLY 144.A O no hydrogen 2.806 N/A ARG 120.A N ALA 116.A O no hydrogen 3.053 N/A HIS 121.A N GLU 117.A O no hydrogen 2.935 N/A LEU 122.A N SER 118.A O no hydrogen 2.950 N/A ARG 123.A N GLN 119.A O no hydrogen 2.929 N/A ARG 123.A NE PRO 148.A O no hydrogen 2.873 N/A ARG 123.A NH1 ARG 123.A O no hydrogen 2.804 N/A ARG 123.A NH1 GLU 127.A OE2 no hydrogen 3.208 N/A PHE 125.A N HIS 121.A O no hydrogen 2.996 N/A MET 126.A N LEU 122.A O no hydrogen 2.685 N/A GLU 127.A N SER 124.A O no hydrogen 2.891 N/A ALA 128.A N SER 124.A O no hydrogen 3.416 N/A TYR 129.A N PHE 125.A O no hydrogen 2.886 N/A SER 130.A OG HIS 45.A NE2 no hydrogen 3.088 N/A ASN 132.A N TYR 129.A O no hydrogen 2.872 N/A ASN 132.A ND2 ALA 93.A O no hydrogen 2.878 N/A SER 134.A N LYS 103.A O no hydrogen 2.875 N/A SER 134.A OG ILE 43.A O no hydrogen 2.847 N/A ILE 135.A N HIS 45.A ND1 no hydrogen 2.851 N/A ILE 136.A N ILE 105.A O no hydrogen 2.872 N/A ILE 137.A N ILE 46.A O no hydrogen 2.685 N/A THR 138.A N ILE 107.A O no hydrogen 2.959 N/A THR 138.A OG1 ASP 108.A OD1 no hydrogen 3.077 N/A ALA 139.A N LEU 48.A O no hydrogen 2.943 N/A ASN 140.A N ASP 111.A OD2 no hydrogen 2.773 N/A ASN 140.A ND2 SER 50.A OG no hydrogen 2.961 N/A ASN 140.A ND2 PRO 51.A O no hydrogen 3.309 N/A ASN 141.A N ASP 111.A OD2 no hydrogen 3.105 N/A ASP 143.A N ASN 141.A OD1 no hydrogen 2.867 N/A GLY 144.A N ASN 141.A O no hydrogen 3.194 N/A ILE 145.A N ILE 142.A O no hydrogen 2.514 N/A ILE 146.A N GLN 119.A OE1 no hydrogen 2.486 N/A LEU 149.A N ILE 146.A O no hydrogen 3.002 N/A GLN 150.A NE2 ILE 145.A O no hydrogen 2.909 N/A SER 151.A N LYS 147.A O no hydrogen 3.192 N/A ARG 152.A NH2 SER 130.A OG no hydrogen 3.157 N/A CYS 153.A SG LEU 149.A O no hydrogen 3.377 N/A ARG 154.A N HIS 45.A O no hydrogen 2.625 N/A ILE 156.A N ILE 47.A O no hydrogen 3.100 N/A THR 157.A OG1 PHE 158.A O no hydrogen 3.163 N/A PHE 158.A N HIS 49.A O no hydrogen 3.147 N/A THR 162.A OG1 GLU 164.A OE1 no hydrogen 3.454 N/A GLU 164.A N THR 162.A OG1 no hydrogen 2.981 N/A ASP 165.A N THR 162.A OG1 no hydrogen 2.850 N/A LYS 166.A N THR 162.A O no hydrogen 3.047 N/A GLU 168.A N GLU 164.A O no hydrogen 2.972 N/A MET 169.A N ASP 165.A O no hydrogen 3.020 N/A MET 170.A N LYS 166.A O no hydrogen 3.163 N/A LYS 171.A N ILE 167.A O no hydrogen 3.487 N/A GLN 172.A N GLU 168.A O no hydrogen 2.833 N/A MET 173.A N MET 169.A O no hydrogen 3.116 N/A ILE 174.A N MET 170.A O no hydrogen 2.806 N/A ARG 175.A N LYS 171.A O no hydrogen 3.014 N/A ARG 176.A N GLN 172.A O no hydrogen 3.011 N/A ARG 176.A NH2 TYR 16.A O no hydrogen 2.631 N/A ARG 176.A NH2 GLU 23.A OE2 no hydrogen 3.356 N/A LEU 177.A N MET 173.A O no hydrogen 2.663 N/A THR 178.A N ILE 174.A O no hydrogen 3.087 N/A THR 178.A OG1 ILE 174.A O no hydrogen 2.927 N/A GLU 179.A N ARG 175.A O no hydrogen 3.120 N/A ILE 180.A N ARG 176.A O no hydrogen 3.131 N/A CYS 181.A N LEU 177.A O no hydrogen 3.027 N/A CYS 181.A SG LEU 177.A O no hydrogen 3.488 N/A LYS 182.A N THR 178.A O no hydrogen 3.025 N/A HIS 183.A N GLU 179.A O no hydrogen 3.262 N/A HIS 183.A ND1 GLU 179.A O no hydrogen 3.144 N/A GLU 184.A N ILE 180.A O no hydrogen 2.924 N/A GLY 185.A N CYS 181.A O no hydrogen 3.123 N/A ILE 186.A N CYS 181.A O no hydrogen 2.972 N/A ALA 187.A N GLY 219.A O no hydrogen 3.375 N/A ALA 189.A N LEU 221.A O no hydrogen 3.037 N/A ASP 190.A N LEU 221.A O no hydrogen 3.260 N/A LYS 192.A N ASP 190.A OD1 no hydrogen 2.976 N/A VAL 194.A N MET 191.A O no hydrogen 2.662 N/A ALA 195.A N MET 191.A O no hydrogen 3.234 N/A ALA 196.A N LYS 192.A O no hydrogen 3.028 N/A LEU 197.A N VAL 193.A O no hydrogen 3.186 N/A VAL 198.A N VAL 194.A O no hydrogen 3.487 N/A LYS 199.A N ALA 195.A O no hydrogen 3.004 N/A LYS 200.A N ALA 196.A O no hydrogen 2.908 N/A LYS 200.A NZ GLU 211.A OE1 no hydrogen 3.019 N/A LYS 200.A NZ VAL 229.A O no hydrogen 3.513 N/A ASN 201.A N LEU 197.A O no hydrogen 3.259 N/A PHE 202.A N LYS 199.A O no hydrogen 3.258 N/A ASP 204.A N ASN 201.A O no hydrogen 2.905 N/A PHE 205.A N GLY 54.A O no hydrogen 2.946 N/A ARG 206.A N ASP 204.A OD1 no hydrogen 2.754 N/A LYS 207.A N ASP 204.A OD1 no hydrogen 3.230 N/A THR 208.A N ASP 204.A O no hydrogen 3.302 N/A THR 208.A OG1 LEU 197.A O no hydrogen 3.532 N/A ILE 209.A N PHE 205.A O no hydrogen 3.183 N/A ILE 209.A N ARG 206.A O no hydrogen 3.226 N/A GLY 210.A N ARG 206.A O no hydrogen 3.055 N/A GLU 211.A N LYS 207.A O no hydrogen 2.736 N/A LEU 212.A N ILE 209.A O no hydrogen 2.645 N/A ASP 213.A N ILE 209.A O no hydrogen 3.087 N/A ASP 213.A N GLY 210.A O no hydrogen 2.599 N/A SER 214.A N GLY 210.A O no hydrogen 3.024 N/A SER 214.A OG GLY 210.A O no hydrogen 3.521 N/A TYR 215.A N GLU 211.A O no hydrogen 3.361 N/A SER 216.A N ASP 213.A O no hydrogen 3.228 N/A SER 216.A OG ASP 213.A O no hydrogen 3.251 N/A SER 217.A OG SER 214.A O no hydrogen 2.731 N/A LYS 218.A NZ ASP 222.A OD2 no hydrogen 2.710 N/A LEU 221.A N ALA 187.A O no hydrogen 2.904 N/A GLY 224.A N ASP 222.A OD1 no hydrogen 2.949 N/A ILE 225.A N ASP 222.A OD1 no hydrogen 2.960 N/A LEU 226.A N ASP 222.A O no hydrogen 3.032 N/A LEU 228.A N ILE 225.A O no hydrogen 3.241 N/A VAL 229.A N ILE 225.A O no hydrogen 3.203 N/A THR 230.A N LEU 226.A O no hydrogen 3.079 N/A THR 230.A OG1 LEU 226.A O no hydrogen 3.362 N/A THR 230.A OG1 SER 227.A O no hydrogen 3.496 N/A ASN 231.A N LEU 228.A O no hydrogen 3.310 N/A VAL 239.A N ASP 238.A OD1 no hydrogen 2.849 N/A LEU 240.A N ILE 236.A O no hydrogen 3.048 N/A GLU 241.A N ASP 237.A O no hydrogen 2.890 N/A SER 242.A N ASP 238.A O no hydrogen 3.236 N/A SER 242.A OG ASP 238.A O no hydrogen 3.047 N/A LEU 243.A N VAL 239.A O no hydrogen 2.830 N/A LYS 244.A N LEU 240.A O no hydrogen 3.223 N/A ASN 245.A N GLU 241.A O no hydrogen 3.197 N/A LYS 246.A N LEU 243.A O no hydrogen 3.234 N/A ARG 252.A N VAL 248.A O no hydrogen 2.566 N/A ALA 253.A N GLN 250.A O no hydrogen 3.026 N/A LEU 254.A N GLN 250.A O no hydrogen 2.965 N/A ALA 255.A N LEU 251.A O no hydrogen 3.180 N/A LYS 257.A N LEU 254.A O no hydrogen 2.950 N/A LYS 257.A NZ ASP 238.A OD2 no hydrogen 2.714 N/A TYR 258.A N ALA 255.A O no hydrogen 3.234 N/A TYR 258.A OH ALA 235.A O no hydrogen 3.164 N/A TYR 258.A OH ASP 238.A OD1 no hydrogen 2.920 N/A TYR 258.A OH ASP 238.A OD2 no hydrogen 3.270 N/A TYR 262.A OH ASN 292.A OD1 no hydrogen 2.359 N/A PHE 265.A N ASP 261.A O no hydrogen 3.345 N/A VAL 266.A N TYR 262.A O no hydrogen 2.956 N/A LYS 268.A N TRP 264.A O no hydrogen 3.025 N/A LYS 268.A NZ GLU 272.A OE2 no hydrogen 3.081 N/A LEU 269.A N PHE 265.A O no hydrogen 2.972 N/A ALA 270.A N VAL 266.A O no hydrogen 3.096 N/A GLU 271.A N GLY 267.A O no hydrogen 2.925 N/A GLU 272.A N LYS 268.A O no hydrogen 3.241 N/A ILE 273.A N LEU 269.A O no hydrogen 2.916 N/A SER 275.A OG GLU 272.A O no hydrogen 3.284 N/A THR 278.A OG1 GLN 280.A OE1 no hydrogen 3.107 N/A SER 281.A N THR 278.A O no hydrogen 2.925 N/A ILE 282.A N PRO 279.A O no hydrogen 3.123 N/A ARG 284.A NE GLU 316.A OE1 no hydrogen 2.677 N/A ARG 284.A NH1 GLU 287.A OE1 no hydrogen 2.878 N/A ARG 284.A NH2 GLU 316.A OE2 no hydrogen 3.440 N/A MET 285.A N SER 281.A O no hydrogen 3.045 N/A ILE 288.A N ARG 284.A O no hydrogen 2.772 N/A VAL 289.A N MET 285.A O no hydrogen 2.908 N/A GLY 290.A N TYR 286.A O no hydrogen 2.594 N/A GLU 291.A N GLU 287.A O no hydrogen 3.154 N/A ASN 292.A N ILE 288.A O no hydrogen 3.272 N/A ASN 292.A ND2 HIS 305.A O no hydrogen 2.984 N/A ASN 293.A N VAL 289.A O no hydrogen 2.843 N/A GLN 294.A N GLY 290.A O no hydrogen 3.198 N/A TYR 295.A N GLU 291.A O no hydrogen 3.192 N/A HIS 296.A N ASN 293.A O no hydrogen 3.279 N/A ILE 298.A N TYR 295.A O no hydrogen 3.037 N/A ALA 299.A N TYR 295.A O no hydrogen 3.083 N/A GLU 303.A N ASN 301.A OD1 no hydrogen 3.197 N/A HIS 305.A N ASN 301.A O no hydrogen 3.118 N/A HIS 305.A NE2 ASN 292.A O no hydrogen 2.858 N/A LEU 306.A N THR 302.A O no hydrogen 2.988 N/A LEU 306.A N GLU 303.A O no hydrogen 3.277 N/A ALA 307.A N GLU 303.A O no hydrogen 3.119 N/A TYR 308.A N LEU 304.A O no hydrogen 2.898 N/A LEU 309.A N LEU 306.A O no hydrogen 3.067 N/A PHE 310.A N LEU 306.A O no hydrogen 3.176 N/A ILE 311.A N ALA 307.A O no hydrogen 3.031 N/A GLN 312.A N TYR 308.A O no hydrogen 3.350 N/A LEU 313.A N LEU 309.A O no hydrogen 2.971 N/A ALA 314.A N PHE 310.A O no hydrogen 2.989 N/A CYS 315.A N ILE 311.A O no hydrogen 3.223 N/A CYS 315.A SG ILE 311.A O no hydrogen 3.325 N/A GLU 316.A N GLN 312.A O no hydrogen 3.493 N/A MET 317.A N LEU 313.A O no hydrogen 2.827 N/A