Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3reu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N ASN 2.A OD1 no hydrogen 3.299 N/A ILE 6.A N ASN 2.A O no hydrogen 2.991 N/A ILE 7.A N ALA 3.A O no hydrogen 3.174 N/A SER 8.A N GLU 5.A O no hydrogen 3.104 N/A SER 8.A OG VAL 4.A O no hydrogen 2.599 N/A ARG 9.A N ILE 6.A O no hydrogen 3.528 N/A ARG 9.A NE ILE 6.A O no hydrogen 2.961 N/A ARG 9.A NH1 ALA 279.A O no hydrogen 3.025 N/A ARG 9.A NH1 GLN 282.A O no hydrogen 3.231 N/A ARG 9.A NH2 GLN 282.A O no hydrogen 2.827 N/A ILE 15.A N ILE 11.A O no hydrogen 2.971 N/A ASP 16.A N TYR 12.A O no hydrogen 2.990 N/A ILE 17.A N LYS 13.A O no hydrogen 3.015 N/A GLN 18.A N ALA 14.A O no hydrogen 2.896 N/A THR 19.A N ILE 15.A O no hydrogen 2.973 N/A THR 19.A OG1 ILE 15.A O no hydrogen 2.841 N/A LYS 20.A N ASP 16.A O no hydrogen 3.222 N/A ILE 21.A N ILE 17.A O no hydrogen 2.900 N/A LEU 22.A N GLN 18.A O no hydrogen 2.827 N/A ASP 23.A N THR 19.A O no hydrogen 3.042 N/A TYR 24.A N LYS 20.A O no hydrogen 3.007 N/A TYR 24.A OH LEU 136.A O no hydrogen 2.792 N/A MET 25.A N ILE 21.A O no hydrogen 2.923 N/A THR 26.A N LEU 22.A O no hydrogen 3.015 N/A THR 26.A OG1 LEU 22.A O no hydrogen 2.827 N/A THR 26.A OG1 ASP 23.A O no hydrogen 3.469 N/A LYS 27.A N ASP 23.A O no hydrogen 3.187 N/A LYS 27.A NZ ASP 31.A OD2 no hydrogen 2.987 N/A PHE 28.A N TYR 24.A O no hydrogen 2.970 N/A PHE 29.A N MET 25.A O no hydrogen 3.290 N/A THR 30.A N THR 26.A O no hydrogen 2.903 N/A THR 30.A OG1 THR 26.A O no hydrogen 3.282 N/A THR 30.A OG1 LYS 27.A O no hydrogen 3.507 N/A ASP 31.A N LYS 27.A O no hydrogen 2.843 N/A ARG 32.A N PHE 29.A O no hydrogen 3.052 N/A ARG 32.A NH1 PHE 28.A O no hydrogen 2.958 N/A ARG 32.A NH2 GLU 135.A OE2 no hydrogen 2.947 N/A GLY 33.A N THR 30.A O no hydrogen 3.167 N/A PHE 34.A N PHE 29.A O no hydrogen 3.142 N/A LYS 35.A N LYS 90.A O no hydrogen 2.905 N/A LEU 37.A N PHE 92.A O no hydrogen 2.823 N/A SER 43.A N ARG 71.A O no hydrogen 3.063 N/A SER 43.A OG ILE 45.A O no hydrogen 3.310 N/A SER 43.A OG HIS 79.A NE2 no hydrogen 3.277 N/A ILE 45.A N SER 43.A OG no hydrogen 3.369 N/A THR 46.A OG1 SER 75.A O no hydrogen 3.381 N/A LEU 49.A N ASP 47.A OD1 no hydrogen 3.048 N/A ALA 54.A N ASP 52.A OD1 no hydrogen 2.900 N/A GLY 55.A N ASP 52.A O no hydrogen 3.025 N/A VAL 63.A N MET 70.A O no hydrogen 3.053 N/A VAL 65.A N VAL 68.A O no hydrogen 2.821 N/A VAL 68.A N VAL 65.A O no hydrogen 2.966 N/A MET 70.A N VAL 63.A O no hydrogen 2.850 N/A ARG 71.A N SER 43.A O no hydrogen 2.693 N/A ARG 71.A NH1 PRO 44.A O no hydrogen 2.791 N/A LEU 72.A N ALA 61.A O no hydrogen 2.938 N/A THR 73.A N MET 41.A O no hydrogen 3.049 N/A THR 73.A OG1 ILE 40.A O no hydrogen 2.761 N/A HIS 74.A N THR 46.A OG1 no hydrogen 2.948 N/A HIS 74.A ND1 ASP 47.A O no hydrogen 2.969 N/A SER 75.A OG ASP 47.A OD2 no hydrogen 2.700 N/A ILE 77.A N SER 75.A OG no hydrogen 3.151 N/A LYS 80.A N MET 76.A O no hydrogen 2.761 N/A LYS 80.A NZ ASP 118.A OD1 no hydrogen 2.547 N/A LYS 80.A NZ PHE 119.A O no hydrogen 2.877 N/A LYS 80.A NZ GLU 120.A OE1 no hydrogen 3.173 N/A LYS 80.A NZ ALA 261.A O no hydrogen 3.380 N/A GLN 81.A N ILE 77.A O no hydrogen 3.142 N/A GLN 81.A NE2 GLU 223.A O no hydrogen 3.102 N/A LEU 82.A N LEU 78.A O no hydrogen 3.086 N/A ALA 83.A N HIS 79.A O no hydrogen 2.886 N/A ILE 84.A N LYS 80.A O no hydrogen 3.110 N/A ALA 85.A N GLN 81.A O no hydrogen 2.925 N/A MET 86.A N LEU 82.A O no hydrogen 2.984 N/A MET 86.A N ALA 83.A O no hydrogen 3.067 N/A GLY 87.A N ILE 84.A O no hydrogen 2.852 N/A LEU 88.A N ALA 83.A O no hydrogen 3.435 N/A LYS 90.A N LEU 88.A O no hydrogen 2.748 N/A LYS 90.A NZ ARG 32.A O no hydrogen 3.041 N/A ILE 91.A N GLU 120.A O no hydrogen 2.973 N/A PHE 92.A N LYS 35.A O no hydrogen 2.913 N/A VAL 93.A N ASP 118.A O no hydrogen 2.982 N/A SER 95.A N GLN 116.A O no hydrogen 2.900 N/A SER 95.A OG PRO 96.A O no hydrogen 3.472 N/A ASN 97.A N PHE 114.A O no hydrogen 2.749 N/A ILE 98.A N THR 73.A O no hydrogen 2.923 N/A ARG 99.A N TYR 112.A O no hydrogen 2.954 N/A ARG 99.A NE HIS 74.A O no hydrogen 3.070 N/A ARG 99.A NH2 HIS 74.A O no hydrogen 3.172 N/A ARG 99.A NH2 ASN 97.A OD1 no hydrogen 3.423 N/A GLU 101.A N ARG 99.A O no hydrogen 2.773 N/A SER 102.A OG GLU 56.A OE2 no hydrogen 2.844 N/A ARG 103.A NH2 ASP 106.A OD2 no hydrogen 2.936 N/A ARG 103.A NH2 PRO 288.A O no hydrogen 2.951 N/A ARG 104.A N SER 102.A OG no hydrogen 3.083 N/A ARG 104.A NE GLU 56.A OE1 no hydrogen 2.789 N/A ARG 104.A NH2 GLU 56.A OE2 no hydrogen 3.473 N/A LYS 105.A N SER 102.A O no hydrogen 2.958 N/A ASP 106.A N ARG 103.A O no hydrogen 3.116 N/A ASP 107.A N LYS 105.A O no hydrogen 2.864 N/A ARG 109.A N ASP 107.A OD1 no hydrogen 2.833 N/A ARG 109.A NH1 GLU 174.A OE2 no hydrogen 3.251 N/A HIS 110.A ND1 ASP 107.A OD1 no hydrogen 2.736 N/A SER 111.A OG.A GLN 282.A OE1 no hydrogen 2.962 N/A SER 111.A OG.B GLU 113.A O no hydrogen 2.725 N/A SER 111.A OG.B GLN 282.A OE1 no hydrogen 3.231 N/A SER 111.A OG.B ARG 286.A O no hydrogen 3.120 N/A TYR 112.A N ARG 286.A O no hydrogen 2.771 N/A PHE 114.A N ASN 97.A O no hydrogen 3.185 N/A THR 115.A N GLU 266.A OE1 no hydrogen 3.099 N/A THR 115.A N GLU 266.A OE2 no hydrogen 3.097 N/A GLN 116.A N SER 95.A O no hydrogen 2.957 N/A GLN 116.A NE2 ASN 97.A OD1 no hydrogen 2.633 N/A LEU 117.A N ILE 263.A O no hydrogen 2.908 N/A ASP 118.A N VAL 93.A O no hydrogen 2.942 N/A PHE 119.A N ALA 261.A O no hydrogen 2.780 N/A GLU 120.A N ILE 91.A O no hydrogen 2.925 N/A ILE 121.A N ALA 259.A O no hydrogen 2.879 N/A GLU 122.A N GLU 89.A O no hydrogen 2.848 N/A GLY 123.A N PRO 257.A O no hydrogen 2.862 N/A ALA 124.A N ILE 121.A O no hydrogen 3.395 N/A LYS 125.A N ASP 128.A OD2 no hydrogen 2.942 N/A MET 126.A N GLU 221.A OE2 no hydrogen 2.793 N/A VAL 129.A N LYS 125.A O no hydrogen 3.220 N/A MET 130.A N MET 126.A O no hydrogen 2.955 N/A ARG 131.A N LYS 127.A O no hydrogen 2.914 N/A ARG 131.A NH1 GLU 134.A OE1 no hydrogen 3.137 N/A LEU 132.A N ASP 128.A O no hydrogen 3.017 N/A ILE 133.A N VAL 129.A O no hydrogen 2.934 N/A GLU 134.A N MET 130.A O no hydrogen 2.963 N/A GLU 135.A N ARG 131.A O no hydrogen 3.070 N/A LEU 136.A N LEU 132.A O no hydrogen 2.950 N/A ILE 137.A N ILE 133.A O no hydrogen 2.861 N/A TYR 138.A N GLU 134.A O no hydrogen 2.812 N/A GLY 139.A N GLU 135.A O no hydrogen 3.141 N/A LEU 140.A N LEU 136.A O no hydrogen 2.955 N/A PHE 141.A N ILE 137.A O no hydrogen 2.950 N/A ARG 142.A N TYR 138.A O no hydrogen 3.172 N/A ARG 142.A NE GLU 145.A OE1 no hydrogen 3.136 N/A ARG 142.A NH1 GLU 145.A OE2 no hydrogen 3.043 N/A ARG 142.A NH1 PRO 153.A O no hydrogen 2.935 N/A ARG 142.A NH2 PRO 153.A O no hydrogen 3.554 N/A LYS 143.A N GLY 139.A O no hydrogen 3.161 N/A ALA 144.A N LEU 140.A O no hydrogen 2.814 N/A GLU 145.A N PHE 141.A O no hydrogen 3.161 N/A TRP 147.A N LYS 143.A O no hydrogen 3.011 N/A THR 148.A N ALA 144.A O no hydrogen 2.946 N/A THR 148.A OG1 ALA 144.A O no hydrogen 2.775 N/A GLY 149.A N GLU 145.A O no hydrogen 2.779 N/A ARG 150.A N THR 148.A OG1 no hydrogen 3.001 N/A ARG 150.A NH1 ILE 272.A O no hydrogen 3.322 N/A ARG 150.A NH2 ILE 272.A O no hydrogen 2.839 N/A PHE 152.A N GLU 145.A OE2 no hydrogen 2.964 N/A ALA 155.A N GLU 182.A OE1 no hydrogen 3.335 N/A ARG 156.A NH1 ARG 156.A O no hydrogen 2.975 N/A HIS 157.A ND1 GLU 134.A OE1 no hydrogen 2.784 N/A PHE 158.A N GLU 134.A OE2 no hydrogen 2.981 N/A TYR 161.A N TRP 185.A O no hydrogen 2.959 N/A TYR 163.A N VAL 187.A O no hydrogen 2.902 N/A ILE 166.A N ASP 162.A O no hydrogen 2.972 N/A LEU 167.A N TYR 163.A O no hydrogen 3.091 N/A GLU 168.A N LYS 164.A O no hydrogen 3.071 N/A GLU 169.A N ASP 165.A O no hydrogen 3.007 N/A PHE 170.A N ILE 166.A O no hydrogen 2.817 N/A GLY 171.A N ILE 166.A O no hydrogen 3.242 N/A LYS 175.A N SER 172.A OG no hydrogen 3.294 N/A ALA 176.A N SER 172.A O no hydrogen 3.184 N/A SER 177.A N ASP 173.A O no hydrogen 3.003 N/A SER 177.A OG LEU 209.A O no hydrogen 2.729 N/A MET 178.A N GLU 174.A O no hydrogen 3.234 N/A GLU 179.A N LYS 175.A O no hydrogen 3.124 N/A GLU 179.A N ALA 176.A O no hydrogen 2.938 N/A MET 180.A N ALA 176.A O no hydrogen 3.134 N/A MET 180.A N SER 177.A O no hydrogen 3.336 N/A PHE 184.A N ILE 208.A O no hydrogen 2.959 N/A TRP 185.A N LYS 159.A O no hydrogen 2.914 N/A TRP 185.A NE1 GLU 134.A OE2 no hydrogen 3.010 N/A ILE 186.A N ASP 206.A O no hydrogen 2.922 N/A VAL 187.A N TYR 161.A O no hydrogen 2.951 N/A ASN 188.A N ASN 204.A O no hydrogen 3.264 N/A ASN 188.A ND2 ASP 162.A OD2 no hydrogen 3.034 N/A ILE 189.A N ASN 204.A OD1 no hydrogen 2.885 N/A ARG 191.A NE ASP 195.A OD2 no hydrogen 2.759 N/A ARG 191.A NH1 ASP 206.A OD1 no hydrogen 2.897 N/A ARG 191.A NH2 ASP 206.A OD1 no hydrogen 3.431 N/A ARG 191.A NH2 GLY 219.A O no hydrogen 2.974 N/A GLU 192.A N GLU 192.A OE2 no hydrogen 2.832 N/A TYR 194.A OH ASP 47.A OD1 no hydrogen 2.952 N/A TYR 194.A OH ASP 47.A OD2 no hydrogen 3.073 N/A ASP 195.A N GLU 192.A O no hydrogen 3.235 N/A ARG 196.A N GLU 221.A O no hydrogen 2.864 N/A GLU 197.A N GLU 223.A OE2 no hydrogen 2.980 N/A GLU 198.A N VAL 201.A O no hydrogen 2.875 N/A GLY 200.A N GLU 197.A OE2 no hydrogen 2.599 N/A VAL 201.A N GLU 198.A O no hydrogen 3.008 N/A TRP 202.A N ASN 188.A OD1 no hydrogen 2.891 N/A LYS 203.A N ARG 196.A O no hydrogen 2.892 N/A ASN 204.A ND2 ILE 189.A O no hydrogen 2.816 N/A ASN 204.A ND2 ASP 195.A OD2 no hydrogen 2.978 N/A TYR 205.A N GLY 219.A O no hydrogen 3.143 N/A TYR 205.A OH GLY 260.A O no hydrogen 2.885 N/A ASP 206.A N ILE 186.A O no hydrogen 2.767 N/A LEU 207.A N SER 217.A O no hydrogen 2.752 N/A ILE 208.A N PHE 184.A O no hydrogen 2.817 N/A LEU 209.A N GLY 214.A O no hydrogen 2.934 N/A TYR 211.A N MET 180.A O no hydrogen 3.055 N/A GLY 212.A N SER 177.A O no hydrogen 3.110 N/A TYR 213.A N PRO 210.A O no hydrogen 3.211 N/A GLY 214.A N SER 177.A OG no hydrogen 2.992 N/A VAL 216.A N LEU 207.A O no hydrogen 2.862 N/A SER 217.A N LEU 207.A O no hydrogen 3.461 N/A SER 217.A OG GLY 262.A O no hydrogen 2.880 N/A SER 218.A N GLY 262.A O no hydrogen 3.117 N/A SER 218.A OG ASP 206.A OD1 no hydrogen 2.699 N/A GLY 219.A N TYR 205.A O no hydrogen 2.977 N/A GLY 220.A N GLY 260.A O no hydrogen 3.101 N/A GLU 221.A N LYS 203.A O no hydrogen 2.974 N/A ARG 222.A N SER 258.A O no hydrogen 2.911 N/A ARG 222.A NE GLU 120.A OE1 no hydrogen 3.419 N/A ARG 222.A NE GLU 120.A OE2 no hydrogen 2.833 N/A ARG 222.A NH1 ASP 195.A OD1 no hydrogen 3.227 N/A ARG 222.A NH2 GLU 120.A OE1 no hydrogen 2.857 N/A GLU 223.A N TYR 194.A O no hydrogen 2.989 N/A LYS 228.A NZ GLU 197.A O no hydrogen 2.887 N/A LYS 228.A NZ GLU 197.A OE1 no hydrogen 3.011 N/A LYS 228.A NZ GLU 223.A OE2 no hydrogen 2.789 N/A ILE 229.A N GLU 225.A O no hydrogen 2.985 N/A VAL 230.A N TYR 226.A O no hydrogen 2.862 N/A ALA 231.A N GLU 227.A O no hydrogen 3.105 N/A LYS 232.A N LYS 228.A O no hydrogen 3.155 N/A LYS 232.A NZ PHE 193.A O no hydrogen 2.900 N/A LYS 232.A NZ GLU 223.A OE2 no hydrogen 2.901 N/A ILE 233.A N ILE 229.A O no hydrogen 3.035 N/A ARG 234.A N VAL 230.A O no hydrogen 2.989 N/A ARG 234.A NE GLU 240.A OE2 no hydrogen 2.884 N/A ARG 234.A NH2 GLU 240.A OE1 no hydrogen 3.052 N/A ARG 234.A NH2 GLU 240.A OE2 no hydrogen 3.412 N/A ALA 235.A N ALA 231.A O no hydrogen 2.843 N/A ALA 236.A N LYS 232.A O no hydrogen 3.116 N/A ALA 236.A N ILE 233.A O no hydrogen 3.302 N/A GLY 237.A N ARG 234.A O no hydrogen 3.004 N/A LEU 238.A N ILE 233.A O no hydrogen 3.139 N/A SER 242.A N LYS 239.A O no hydrogen 2.963 N/A PHE 243.A N GLU 240.A O no hydrogen 2.956 N/A TYR 246.A OH GLN 81.A OE1 no hydrogen 2.714 N/A LEU 247.A N PHE 243.A O no hydrogen 2.918 N/A GLU 248.A N ARG 244.A O no hydrogen 2.922 N/A ILE 249.A N PRO 245.A O no hydrogen 3.206 N/A ALA 250.A N TYR 246.A O no hydrogen 2.914 N/A ARG 251.A N LEU 247.A O no hydrogen 2.780 N/A ALA 252.A N GLU 248.A O no hydrogen 3.107 N/A GLY 253.A N ALA 250.A O no hydrogen 2.885 N/A LYS 254.A N ILE 249.A O no hydrogen 3.169 N/A SER 258.A OG GLU 120.A OE2 no hydrogen 2.765 N/A ALA 259.A N ILE 121.A O no hydrogen 3.107 N/A GLY 260.A N GLY 220.A O no hydrogen 3.181 N/A ALA 261.A N PHE 119.A O no hydrogen 3.047 N/A GLY 262.A N SER 218.A O no hydrogen 2.899 N/A ILE 263.A N LEU 117.A O no hydrogen 2.931 N/A GLY 264.A N VAL 216.A O no hydrogen 3.010 N/A VAL 265.A N THR 115.A O no hydrogen 3.183 N/A GLU 266.A N GLU 266.A OE1 no hydrogen 2.812 N/A ARG 267.A NE ARG 109.A O no hydrogen 2.879 N/A ARG 267.A NH1 GLU 215.A O no hydrogen 2.918 N/A ARG 267.A NH2 ARG 109.A O no hydrogen 3.315 N/A LEU 268.A N GLY 264.A O no hydrogen 3.157 N/A VAL 269.A N VAL 265.A O no hydrogen 2.975 N/A ARG 270.A N GLU 266.A O no hydrogen 2.926 N/A ARG 270.A NE ALA 275.A O no hydrogen 3.220 N/A ARG 270.A NH1 TYR 213.A O no hydrogen 3.512 N/A ARG 270.A NH2 LYS 276.A O no hydrogen 2.996 N/A PHE 271.A N ARG 267.A O no hydrogen 3.173 N/A ILE 272.A N LEU 268.A O no hydrogen 3.052 N/A VAL 273.A N VAL 269.A O no hydrogen 2.980 N/A GLY 274.A N PHE 271.A O no hydrogen 3.281 N/A ALA 275.A N ARG 270.A O no hydrogen 3.008 N/A HIS 277.A N GLU 280.A OE2 no hydrogen 3.104 N/A HIS 277.A NE2 ASP 106.A OD1 no hydrogen 2.956 N/A ILE 278.A N GLY 108.A O no hydrogen 2.969 N/A ALA 279.A N HIS 277.A ND1 no hydrogen 2.933 N/A GLU 280.A N HIS 277.A O no hydrogen 2.945 N/A VAL 281.A N ILE 278.A O no hydrogen 3.086 N/A GLN 282.A N ALA 279.A O no hydrogen 3.289 N/A GLN 282.A NE2 SER 111.A OG.B no hydrogen 3.275 N/A GLN 282.A NE2 GLU 113.A O no hydrogen 3.540 N/A ARG 286.A NE GLU 113.A OE1 no hydrogen 2.965 N/A ARG 286.A NH1 PRO 285.A O no hydrogen 3.126 N/A ARG 286.A NH1 ILE 294.A O no hydrogen 2.731 N/A ARG 286.A NH2 ILE 294.A OXT no hydrogen 3.098 N/A ILE 290.A N VAL 287.A O no hydrogen 2.956 N/A ALA 292.A N TYR 112.A OH no hydrogen 3.130 N/A