Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xr3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH GLY 43.A O no hydrogen 2.501 N/A THR 4.A N VAL 13.A O no hydrogen 2.908 N/A THR 4.A OG1 GLN 5.A O no hydrogen 3.508 N/A GLN 5.A NE2 ILE 9.A O no hydrogen 3.059 N/A LEU 6.A N LEU 11.A O no hydrogen 2.921 N/A ARG 8.A N GLY 208.A O no hydrogen 2.768 N/A ARG 8.A NH1 LEU 182.A O no hydrogen 2.968 N/A ARG 8.A NH2 LEU 182.A O no hydrogen 2.822 N/A ARG 8.A NH2 GLY 208.A O no hydrogen 3.111 N/A ILE 9.A N LEU 6.A O no hydrogen 3.120 N/A VAL 13.A N THR 4.A O no hydrogen 2.809 N/A SER 14.A N ASN 45.A OD1 no hydrogen 2.880 N/A SER 14.A OG LEU 16.A O no hydrogen 2.582 N/A SER 14.A OG ASN 45.A OD1 no hydrogen 3.327 N/A ARG 15.A N GLU 2.A O no hydrogen 2.938 N/A ARG 15.A NE GLU 2.A OE1 no hydrogen 2.952 N/A ARG 15.A NH1 GLU 2.A OE1 no hydrogen 3.265 N/A ARG 15.A NH1 LEU 266.A O no hydrogen 2.984 N/A ARG 15.A NH2 THR 272.A O no hydrogen 2.996 N/A VAL 17.A N PRO 274.A O no hydrogen 3.183 N/A LEU 18.A N PHE 46.A O no hydrogen 2.886 N/A GLY 19.A N VAL 276.A O no hydrogen 2.855 N/A THR 20.A OG1 ASP 48.A O no hydrogen 2.781 N/A PHE 23.A N THR 20.A O no hydrogen 2.780 N/A GLY 24.A N THR 27.A O no hydrogen 2.773 N/A THR 26.A N ASN 22.A O no hydrogen 3.044 N/A THR 27.A N ASN 22.A O no hydrogen 2.894 N/A THR 27.A OG1 ARG 279.A O no hydrogen 3.172 N/A GLU 31.A N ASP 28.A OD2 no hydrogen 3.096 N/A SER 32.A N ASP 28.A O no hydrogen 2.858 N/A SER 32.A OG THR 27.A O no hydrogen 3.527 N/A SER 32.A OG ASP 28.A O no hydrogen 2.978 N/A HIS 33.A N GLU 29.A O no hydrogen 2.907 N/A HIS 33.A NE2 ILE 65.A O no hydrogen 2.946 N/A ALA 34.A N ALA 30.A O no hydrogen 3.235 N/A ALA 34.A N GLU 31.A O no hydrogen 3.134 N/A ILE 35.A N GLU 31.A O no hydrogen 3.044 N/A MET 36.A N SER 32.A O no hydrogen 2.981 N/A ASP 37.A N HIS 33.A O no hydrogen 3.028 N/A ALA 38.A N ALA 34.A O no hydrogen 2.878 N/A ALA 39.A N ILE 35.A O no hydrogen 2.853 N/A LEU 40.A N MET 36.A O no hydrogen 3.050 N/A ASP 41.A N ASP 37.A O no hydrogen 3.150 N/A ALA 42.A N ALA 38.A O no hydrogen 2.956 N/A GLY 43.A N LEU 40.A O no hydrogen 2.859 N/A ILE 44.A N ALA 39.A O no hydrogen 2.948 N/A ASN 45.A ND2 LYS 12.A O no hydrogen 3.126 N/A PHE 47.A N VAL 81.A O no hydrogen 3.009 N/A ASP 48.A N LEU 18.A O no hydrogen 2.818 N/A THR 49.A N ALA 83.A O no hydrogen 2.920 N/A THR 49.A OG1 THR 20.A OG1 no hydrogen 2.976 N/A ALA 50.A N THR 49.A OG1 no hydrogen 2.741 N/A TYR 53.A N ALA 50.A O no hydrogen 3.249 N/A TRP 55.A N VAL 52.A O no hydrogen 3.148 N/A ASN 58.A N TRP 55.A O no hydrogen 2.763 N/A LYS 59.A NZ GLY 56.A O no hydrogen 2.857 N/A LYS 59.A NZ GLY 91.A O no hydrogen 2.847 N/A LYS 59.A NZ ASP 93.A OD1 no hydrogen 2.778 N/A GLY 60.A N TYR 53.A O no hydrogen 3.147 N/A ARG 61.A N ASN 58.A O no hydrogen 3.263 N/A ARG 61.A NH1 GLU 64.A OE1 no hydrogen 2.971 N/A ARG 61.A NH2 GLU 29.A OE1 no hydrogen 3.266 N/A THR 62.A OG1 PHE 23.A O no hydrogen 2.648 N/A GLU 64.A N GLY 60.A O no hydrogen 3.056 N/A ILE 65.A N ARG 61.A O no hydrogen 2.884 N/A LEU 66.A N THR 62.A O no hydrogen 3.135 N/A GLY 67.A N GLU 63.A O no hydrogen 2.912 N/A SER 68.A N GLU 64.A O no hydrogen 2.883 N/A SER 68.A OG GLU 29.A OE2 no hydrogen 2.469 N/A SER 68.A OG HIS 33.A NE2 no hydrogen 2.992 N/A SER 68.A OG GLU 64.A O no hydrogen 3.488 N/A SER 68.A OG ILE 65.A O no hydrogen 3.162 N/A TRP 69.A N ILE 65.A O no hydrogen 3.143 N/A TRP 69.A NE1 ASP 37.A OD1 no hydrogen 2.852 N/A PHE 70.A N LEU 66.A O no hydrogen 2.971 N/A ALA 71.A N GLY 67.A O no hydrogen 3.229 N/A GLN 72.A N TRP 69.A O no hydrogen 3.279 N/A GLY 73.A N PHE 70.A O no hydrogen 3.150 N/A ARG 76.A NE ASP 37.A OD1 no hydrogen 2.946 N/A ARG 76.A NH1 ASP 37.A OD1 no hydrogen 3.421 N/A ARG 76.A NH1 ASP 37.A OD2 no hydrogen 2.811 N/A ARG 76.A NH2 GLY 73.A O no hydrogen 2.983 N/A ARG 77.A NE THR 121.A OG1 no hydrogen 3.036 N/A ARG 77.A NH1 HIS 123.A O no hydrogen 2.743 N/A ARG 77.A NH1 ASP 125.A OD2 no hydrogen 3.043 N/A ARG 77.A NH2 ARG 77.A O no hydrogen 2.851 N/A ARG 77.A NH2 VAL 80.A O no hydrogen 3.265 N/A ARG 77.A NH2 ASP 125.A OD2 no hydrogen 2.952 N/A LYS 79.A N ASP 75.A O no hydrogen 3.130 N/A LYS 79.A N ARG 76.A O no hydrogen 3.407 N/A VAL 80.A N ARG 77.A O no hydrogen 3.367 N/A VAL 81.A N ASN 45.A O no hydrogen 2.597 N/A LEU 82.A N ASP 125.A OD2 no hydrogen 2.861 N/A ALA 83.A N PHE 47.A O no hydrogen 3.004 N/A THR 84.A N LEU 126.A O no hydrogen 3.084 N/A THR 84.A OG1 GLU 63.A OE1 no hydrogen 2.657 N/A LYS 85.A N THR 84.A OG1 no hydrogen 2.781 N/A LYS 85.A NZ ASP 48.A OD1 no hydrogen 3.115 N/A LYS 85.A NZ ASP 48.A OD2 no hydrogen 2.708 N/A LYS 85.A NZ THR 49.A O no hydrogen 2.930 N/A LYS 85.A NZ TYR 53.A OH no hydrogen 3.226 N/A VAL 86.A N GLN 128.A O no hydrogen 3.068 N/A ASN 89.A ND2 LEU 92.A O no hydrogen 3.044 N/A GLY 91.A N ASN 89.A OD1 no hydrogen 3.070 N/A HIS 100.A N TRP 97.A O no hydrogen 3.014 N/A LYS 102.A N TYR 87.A O no hydrogen 2.747 N/A LEU 103.A N ASP 133.A OD2 no hydrogen 3.037 N/A ALA 105.A N GLU 140.A OE2 no hydrogen 2.843 N/A ASN 107.A N SER 104.A OG no hydrogen 3.061 N/A ASN 107.A ND2 LYS 102.A O no hydrogen 2.796 N/A ILE 108.A N SER 104.A O no hydrogen 3.013 N/A ARG 109.A N ALA 105.A O no hydrogen 3.028 N/A ARG 110.A N LEU 106.A O no hydrogen 3.222 N/A ARG 110.A NH2 ASN 107.A OD1 no hydrogen 3.182 N/A SER 111.A N ASN 107.A O no hydrogen 2.898 N/A SER 111.A OG ASN 107.A O no hydrogen 2.668 N/A VAL 112.A N ILE 108.A O no hydrogen 3.114 N/A ASP 113.A N ARG 109.A O no hydrogen 3.411 N/A ALA 114.A N ARG 110.A O no hydrogen 3.239 N/A SER 115.A N SER 111.A O no hydrogen 2.932 N/A SER 115.A OG GLU 63.A OE1 no hydrogen 2.921 N/A SER 115.A OG GLU 63.A OE2 no hydrogen 3.368 N/A SER 115.A OG SER 111.A O no hydrogen 3.222 N/A LEU 116.A N VAL 112.A O no hydrogen 2.843 N/A LYS 117.A N ASP 113.A O no hydrogen 3.214 N/A LYS 117.A NZ ASP 113.A OD2 no hydrogen 3.249 N/A ARG 118.A N ALA 114.A O no hydrogen 3.020 N/A ARG 118.A NE GLU 63.A OE2 no hydrogen 2.820 N/A ARG 118.A NH1 GLU 63.A OE2 no hydrogen 2.874 N/A LEU 119.A N SER 115.A O no hydrogen 2.930 N/A GLY 120.A N LYS 117.A O no hydrogen 3.104 N/A THR 121.A OG1 HIS 123.A O no hydrogen 3.258 N/A HIS 123.A ND1 ASP 122.A OD1 no hydrogen 2.607 N/A ILE 124.A N LYS 153.A O no hydrogen 2.862 N/A ASP 125.A N LEU 82.A O no hydrogen 3.010 N/A LEU 126.A N LEU 82.A O no hydrogen 2.960 N/A TYR 127.A N TYR 156.A O no hydrogen 2.882 N/A GLN 128.A N THR 84.A O no hydrogen 3.031 N/A GLN 128.A NE2 ASP 48.A OD1 no hydrogen 2.856 N/A GLN 128.A NE2 THR 84.A O no hydrogen 3.301 N/A PHE 129.A N GLY 158.A O no hydrogen 3.001 N/A HIS 130.A N VAL 86.A O no hydrogen 2.973 N/A HIS 131.A ND1 VAL 132.A O no hydrogen 2.736 N/A VAL 132.A N ASN 161.A O no hydrogen 3.176 N/A ASP 135.A N ASP 133.A OD1 no hydrogen 2.889 N/A THR 136.A N ASP 133.A O no hydrogen 3.398 N/A THR 136.A OG1 ASP 133.A OD2 no hydrogen 2.609 N/A GLU 140.A N PRO 137.A O no hydrogen 3.130 N/A ILE 141.A N PRO 137.A O no hydrogen 3.126 N/A TRP 142.A N TRP 138.A O no hydrogen 2.930 N/A TRP 142.A NE1 ALA 170.A O no hydrogen 2.953 N/A GLN 143.A N ASP 139.A O no hydrogen 3.172 N/A ALA 144.A N GLU 140.A O no hydrogen 3.157 N/A MET 145.A N ILE 141.A O no hydrogen 3.013 N/A ASP 146.A N TRP 142.A O no hydrogen 2.824 N/A VAL 147.A N GLN 143.A O no hydrogen 3.057 N/A LEU 148.A N ALA 144.A O no hydrogen 3.408 N/A VAL 149.A N MET 145.A O no hydrogen 2.907 N/A ARG 150.A N ASP 146.A O no hydrogen 2.856 N/A GLN 151.A N VAL 147.A O no hydrogen 3.053 N/A GLY 152.A N VAL 149.A O no hydrogen 3.158 N/A LYS 153.A N LEU 148.A O no hydrogen 2.973 N/A LYS 153.A NZ GLN 151.A OE1 no hydrogen 3.037 N/A LEU 155.A N ILE 124.A O no hydrogen 3.291 N/A TYR 156.A N ASP 125.A O no hydrogen 2.918 N/A GLY 158.A N TYR 127.A O no hydrogen 2.988 N/A SER 159.A N SER 184.A O no hydrogen 2.771 N/A SER 159.A OG SER 184.A O no hydrogen 3.093 N/A SER 159.A OG GLU 185.A OE1 no hydrogen 2.688 N/A SER 160.A OG GLN 186.A O no hydrogen 3.192 N/A ASN 161.A N GLN 186.A O no hydrogen 3.081 N/A ASN 161.A ND2 HIS 130.A O no hydrogen 3.047 N/A PHE 162.A N GLU 185.A OE2 no hydrogen 3.064 N/A ALA 163.A N ASN 166.A OD1 no hydrogen 2.958 N/A ASN 166.A N ALA 163.A O no hydrogen 2.930 N/A ILE 167.A N ALA 163.A O no hydrogen 3.362 N/A ALA 168.A N GLY 164.A O no hydrogen 3.094 N/A GLN 169.A N TRP 165.A O no hydrogen 2.905 N/A ALA 170.A N ASN 166.A O no hydrogen 2.991 N/A ASN 171.A N ILE 167.A O no hydrogen 3.012 N/A ASN 171.A ND2 LEU 182.A O no hydrogen 3.042 N/A GLU 172.A N ALA 168.A O no hydrogen 2.985 N/A THR 173.A N GLN 169.A O no hydrogen 2.938 N/A THR 173.A OG1 GLN 169.A O no hydrogen 2.750 N/A ALA 174.A N ALA 170.A O no hydrogen 3.061 N/A ALA 175.A N ASN 171.A O no hydrogen 2.975 N/A ARG 176.A N GLU 172.A O no hydrogen 3.168 N/A HIS 177.A N ALA 174.A O no hydrogen 3.246 N/A GLY 178.A N ALA 175.A O no hydrogen 2.845 N/A ARG 179.A N ALA 174.A O no hydrogen 2.963 N/A ARG 179.A NH1 ASP 146.A OD2 no hydrogen 3.565 N/A LEU 182.A N ASN 171.A OD1 no hydrogen 2.805 N/A VAL 183.A N VAL 157.A O no hydrogen 2.910 N/A GLU 185.A N GLY 210.A O no hydrogen 2.840 N/A GLN 186.A N SER 159.A O no hydrogen 2.820 N/A GLN 186.A NE2 ASP 48.A OD2 no hydrogen 3.500 N/A CYS 187.A N ILE 212.A O no hydrogen 2.827 N/A TYR 189.A N TRP 214.A O no hydrogen 3.505 N/A TYR 189.A OH GLU 197.A OE1 no hydrogen 2.363 N/A ASN 190.A N GLU 193.A O no hydrogen 3.115 N/A ASN 190.A ND2 SER 215.A O no hydrogen 2.817 N/A ASN 190.A ND2 HIS 218.A ND1 no hydrogen 3.256 N/A GLU 193.A N ASN 190.A O no hydrogen 3.023 N/A GLU 193.A N ASN 190.A OD1 no hydrogen 2.857 N/A ARG 194.A NE GLU 197.A OE1 no hydrogen 3.151 N/A ARG 194.A NE GLU 197.A OE2 no hydrogen 3.192 N/A ARG 194.A NH1 ASP 304.A OD1 no hydrogen 2.823 N/A ARG 194.A NH1 PHE 307.A O no hydrogen 2.582 N/A ARG 194.A NH2 GLU 197.A OE1 no hydrogen 3.183 N/A ARG 194.A NH2 GLU 197.A OE2 no hydrogen 3.477 N/A ARG 194.A NH2 ASP 304.A OD1 no hydrogen 3.504 N/A ARG 195.A N GLU 193.A OE2 no hydrogen 3.012 N/A ARG 195.A NE GLU 193.A OE1 no hydrogen 3.389 N/A ARG 195.A NE GLU 193.A OE2 no hydrogen 3.088 N/A ARG 195.A NH1 GLU 193.A OE1 no hydrogen 2.670 N/A GLU 197.A N ARG 194.A O no hydrogen 3.046 N/A MET 198.A N ARG 195.A O no hydrogen 3.158 N/A VAL 201.A N ALA 196.A O no hydrogen 2.922 N/A ALA 203.A N GLU 199.A O no hydrogen 3.050 N/A ALA 204.A N VAL 200.A O no hydrogen 3.008 N/A ARG 205.A N VAL 201.A O no hydrogen 2.954 N/A GLU 206.A N PRO 202.A O no hydrogen 2.941 N/A TYR 207.A N ALA 203.A O no hydrogen 2.863 N/A TYR 207.A OH GLU 172.A OE1 no hydrogen 2.626 N/A GLY 208.A N ARG 205.A O no hydrogen 3.291 N/A LEU 209.A N ALA 204.A O no hydrogen 2.865 N/A GLY 210.A N VAL 183.A O no hydrogen 2.960 N/A ILE 212.A N GLU 185.A O no hydrogen 2.810 N/A ALA 213.A N GLY 273.A O no hydrogen 3.240 N/A TRP 214.A N CYS 187.A O no hydrogen 2.912 N/A TRP 214.A NE1 ASN 161.A OD1 no hydrogen 3.146 N/A HIS 218.A N SER 215.A O no hydrogen 3.030 N/A GLY 220.A N LEU 217.A O no hydrogen 3.127 N/A LEU 222.A N LEU 217.A O no hydrogen 2.979 N/A GLY 223.A N GLY 220.A O no hydrogen 2.463 N/A ILE 226.A N GLU 247.A OE1 no hydrogen 2.945 N/A ARG 227.A N GLU 247.A OE2 no hydrogen 2.975 N/A LYS 228.A N GLY 224.A O no hydrogen 3.360 N/A LYS 228.A NZ GLY 223.A O no hydrogen 3.521 N/A GLU 229.A N ILE 226.A O no hydrogen 2.768 N/A LEU 234.A N ALA 231.A O no hydrogen 3.038 N/A GLN 238.A N ASP 236.A OD1 no hydrogen 2.755 N/A GLN 238.A NE2 GLN 238.A O no hydrogen 3.170 N/A GLN 239.A N ASP 236.A OD1 no hydrogen 3.477 N/A ARG 240.A N ASP 236.A O no hydrogen 2.984 N/A ARG 240.A NE LEU 234.A O no hydrogen 2.918 N/A GLU 241.A N PRO 237.A O no hydrogen 3.080 N/A GLN 242.A N GLN 238.A O no hydrogen 3.369 N/A ILE 243.A N GLN 239.A O no hydrogen 3.137 N/A GLN 244.A N ARG 240.A O no hydrogen 2.995 N/A ARG 245.A N GLU 241.A O no hydrogen 2.867 N/A TYR 246.A N GLN 242.A O no hydrogen 3.112 N/A TYR 246.A OH PRO 257.A O no hydrogen 2.906 N/A GLU 247.A N ILE 243.A O no hydrogen 2.782 N/A ASP 248.A N GLN 244.A O no hydrogen 2.911 N/A LEU 249.A N ARG 245.A O no hydrogen 3.028 N/A LEU 250.A N TYR 246.A O no hydrogen 3.196 N/A LEU 250.A N GLU 247.A O no hydrogen 3.103 N/A ASP 251.A N GLU 247.A O no hydrogen 3.001 N/A LYS 252.A N ASP 248.A O no hydrogen 3.275 N/A HIS 253.A N LEU 249.A O no hydrogen 3.319 N/A HIS 253.A ND1 LEU 249.A O no hydrogen 3.145 N/A GLY 254.A N ASP 251.A O no hydrogen 2.918 N/A LEU 255.A N LEU 250.A O no hydrogen 2.990 N/A VAL 260.A N GLU 256.A O no hydrogen 3.054 N/A ALA 261.A N PRO 257.A O no hydrogen 3.148 N/A ALA 263.A N GLU 259.A O no hydrogen 3.053 N/A TRP 264.A N VAL 260.A O no hydrogen 2.745 N/A LEU 266.A N LEU 262.A O no hydrogen 3.164 N/A THR 267.A N TRP 264.A O no hydrogen 2.970 N/A THR 267.A OG1 TRP 264.A O no hydrogen 2.652 N/A ARG 268.A N LEU 265.A O no hydrogen 3.122 N/A ARG 268.A NE TYR 189.A OH no hydrogen 3.197 N/A ARG 268.A NH2 GLU 197.A OE1 no hydrogen 3.328 N/A VAL 271.A N ARG 268.A O no hydrogen 3.268 N/A THR 272.A N VAL 211.A O no hydrogen 2.631 N/A THR 272.A OG1 VAL 211.A O no hydrogen 3.240 N/A ILE 275.A N ALA 213.A O no hydrogen 3.039 N/A VAL 276.A N VAL 17.A O no hydrogen 2.905 N/A GLN 283.A N THR 280.A OG1 no hydrogen 3.324 N/A LEU 284.A N THR 280.A O no hydrogen 3.357 N/A LEU 284.A N ALA 281.A O no hydrogen 3.191 N/A ALA 285.A N ALA 281.A O no hydrogen 3.074 N/A SER 286.A N ASP 282.A O no hydrogen 3.253 N/A SER 286.A OG GLU 259.A OE1 no hydrogen 3.169 N/A ALA 287.A N GLN 283.A O no hydrogen 3.232 N/A VAL 288.A N LEU 284.A O no hydrogen 3.148 N/A ARG 289.A N ALA 285.A O no hydrogen 3.166 N/A ARG 289.A NE GLU 259.A OE1 no hydrogen 3.507 N/A ARG 289.A NH1 GLU 259.A OE1 no hydrogen 3.536 N/A ALA 290.A N SER 286.A O no hydrogen 3.174 N/A ALA 291.A N ALA 287.A O no hydrogen 3.075 N/A GLU 292.A N ARG 289.A O no hydrogen 3.033 N/A LEU 293.A N ARG 289.A O no hydrogen 3.033 N/A VAL 299.A N THR 296.A OG1 no hydrogen 3.229 N/A LEU 300.A N THR 296.A O no hydrogen 2.857 N/A THR 301.A N ASP 297.A O no hydrogen 2.880 N/A THR 301.A OG1 ASP 297.A O no hydrogen 2.886 N/A ALA 302.A N GLU 298.A O no hydrogen 3.177 N/A LEU 303.A N VAL 299.A O no hydrogen 2.964 N/A ASP 304.A N LEU 300.A O no hydrogen 3.253 N/A GLU 305.A N THR 301.A O no hydrogen 3.211 N/A ILE 306.A N ALA 302.A O no hydrogen 3.129 N/A PHE 307.A N LEU 303.A O no hydrogen 2.709 N/A SER 313.A N MET 198.A O no hydrogen 2.981 N/A GLU 315.A N GLU 315.A OE1 no hydrogen 2.680 N/A ALA 316.A N PRO 312.A O no hydrogen 2.916 N/A PHE 317.A N PRO 314.A O no hydrogen 3.051 N/A ALA 318.A N PRO 314.A O no hydrogen 2.787 N/A