Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dcv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N LEU 3.A O no hydrogen 3.174 N/A TYR 7.A N LEU 3.A O no hydrogen 3.324 N/A GLN 8.A N ILE 25.A O no hydrogen 2.647 N/A GLN 8.A NE2 VAL 9.A O no hydrogen 3.550 N/A LEU 13.A N VAL 21.A O no hydrogen 2.670 N/A GLY 14.A N VAL 21.A O no hydrogen 3.450 N/A GLY 16.A N GLY 19.A O no hydrogen 3.069 N/A SER 20.A N HIS 37.A O no hydrogen 3.050 N/A VAL 21.A N GLY 14.A O no hydrogen 2.940 N/A TYR 22.A N ILE 35.A O no hydrogen 2.836 N/A SER 23.A N PRO 11.A O no hydrogen 2.864 N/A GLY 24.A N VAL 33.A O no hydrogen 3.162 N/A ILE 25.A N GLN 8.A O no hydrogen 3.056 N/A ARG 26.A N LEU 31.A O no hydrogen 2.801 N/A ARG 26.A NE ASP 29.A OD1 no hydrogen 3.154 N/A ARG 26.A NE ASP 29.A OD2 no hydrogen 3.368 N/A ARG 26.A NH1 ASP 29.A OD1 no hydrogen 2.867 N/A VAL 27.A N GLN 6.A O no hydrogen 2.904 N/A LEU 31.A N ASP 29.A OD2 no hydrogen 2.892 N/A VAL 33.A N GLY 24.A O no hydrogen 3.097 N/A ALA 34.A N LEU 89.A O no hydrogen 2.753 N/A ILE 35.A N TYR 22.A O no hydrogen 2.878 N/A LYS 36.A N LEU 87.A O no hydrogen 2.807 N/A LYS 36.A NZ GLU 58.A OE1 no hydrogen 2.559 N/A LYS 36.A NZ GLU 58.A OE2 no hydrogen 3.013 N/A LYS 36.A NZ ASP 155.A OD1 no hydrogen 3.556 N/A HIS 37.A N SER 20.A O no hydrogen 2.865 N/A VAL 38.A N PHE 85.A O no hydrogen 2.967 N/A LYS 40.A N ASP 83.A O no hydrogen 3.211 N/A LYS 40.A NZ GLU 80.A OE2 no hydrogen 2.660 N/A LYS 40.A NZ ARG 81.A O no hydrogen 3.052 N/A LYS 40.A NZ PRO 82.A O no hydrogen 3.325 N/A ASP 41.A N ASP 41.A OD1 no hydrogen 2.482 N/A ARG 42.A N GLU 39.A O no hydrogen 3.001 N/A ILE 43.A N LYS 40.A O no hydrogen 3.344 N/A GLY 47.A N VAL 55.A O no hydrogen 2.646 N/A LEU 49.A N THR 53.A O no hydrogen 2.974 N/A GLY 52.A N LEU 49.A O no hydrogen 2.995 N/A VAL 55.A N GLY 47.A O no hydrogen 2.840 N/A MET 57.A N ASP 45.A O no hydrogen 2.835 N/A VAL 59.A N PRO 56.A O no hydrogen 2.823 N/A VAL 60.A N PRO 56.A O no hydrogen 3.469 N/A LEU 61.A N MET 57.A O no hydrogen 2.800 N/A LEU 62.A N GLU 58.A O no hydrogen 2.871 N/A LYS 63.A N VAL 59.A O no hydrogen 3.099 N/A LYS 64.A N VAL 60.A O no hydrogen 3.196 N/A VAL 65.A N LEU 62.A O no hydrogen 3.223 N/A SER 66.A OG LYS 63.A O no hydrogen 3.292 N/A SER 70.A OG GLU 150.A OE1 no hydrogen 3.525 N/A ILE 73.A N LEU 153.A O no hydrogen 3.018 N/A ARG 74.A N GLU 90.A OE1 no hydrogen 2.972 N/A LEU 76.A N ILE 88.A O no hydrogen 2.608 N/A ASP 77.A N ILE 88.A O no hydrogen 3.304 N/A PHE 79.A N VAL 86.A O no hydrogen 2.911 N/A ARG 81.A N SER 84.A O no hydrogen 2.772 N/A ARG 81.A NH1 GLU 4.A OE2 no hydrogen 2.867 N/A SER 84.A N ARG 81.A O no hydrogen 3.292 N/A PHE 85.A N VAL 38.A O no hydrogen 2.727 N/A VAL 86.A N PHE 79.A O no hydrogen 2.902 N/A LEU 87.A N LYS 36.A O no hydrogen 2.686 N/A ILE 88.A N ASP 77.A O no hydrogen 2.884 N/A LEU 89.A N ALA 34.A O no hydrogen 2.860 N/A GLU 90.A N ARG 74.A O no hydrogen 2.970 N/A ARG 91.A NE VAL 33.A O no hydrogen 2.684 N/A ARG 91.A NH1 GLY 24.A O no hydrogen 2.673 N/A GLN 96.A N ILE 144.A O no hydrogen 2.957 N/A GLN 96.A NE2 GLU 104.A OE1 no hydrogen 3.074 N/A LEU 98.A N ILE 142.A O no hydrogen 2.828 N/A PHE 99.A N ASP 97.A OD2 no hydrogen 3.139 N/A PHE 101.A N ASP 97.A O no hydrogen 2.915 N/A ILE 102.A N LEU 98.A O no hydrogen 2.867 N/A THR 103.A N PHE 99.A O no hydrogen 2.807 N/A THR 103.A OG1 PHE 99.A O no hydrogen 2.596 N/A GLU 104.A N ASP 100.A O no hydrogen 3.061 N/A ARG 105.A N ILE 102.A O no hydrogen 3.432 N/A ARG 105.A NH1 HIS 271.A O no hydrogen 3.044 N/A ARG 105.A NH2 HIS 271.A O no hydrogen 3.159 N/A GLY 106.A N ILE 102.A O no hydrogen 2.767 N/A LEU 108.A N MET 204.A O no hydrogen 2.900 N/A ALA 113.A N GLN 109.A O no hydrogen 2.877 N/A ARG 114.A N GLU 110.A O no hydrogen 2.644 N/A ARG 114.A NE TRP 257.A O no hydrogen 2.697 N/A ARG 114.A NH2 TRP 257.A O no hydrogen 3.564 N/A SER 115.A N GLU 111.A O no hydrogen 3.143 N/A SER 115.A OG THR 267.A OG1 no hydrogen 2.588 N/A PHE 116.A N LEU 112.A O no hydrogen 2.991 N/A PHE 117.A N ALA 113.A O no hydrogen 2.859 N/A TRP 118.A N ARG 114.A O no hydrogen 2.971 N/A GLN 119.A N SER 115.A O no hydrogen 3.228 N/A GLN 119.A NE2 GLY 149.A O no hydrogen 2.907 N/A VAL 120.A N PHE 116.A O no hydrogen 2.976 N/A LEU 121.A N PHE 117.A O no hydrogen 2.784 N/A GLU 122.A N TRP 118.A O no hydrogen 2.874 N/A ALA 123.A N GLN 119.A O no hydrogen 3.175 N/A VAL 124.A N VAL 120.A O no hydrogen 3.036 N/A ARG 125.A N LEU 121.A O no hydrogen 3.082 N/A ARG 125.A NH2 GLU 122.A OE2 no hydrogen 3.487 N/A HIS 126.A N GLU 122.A O no hydrogen 3.055 N/A CYS 127.A N ALA 123.A O no hydrogen 3.086 N/A CYS 127.A SG ALA 123.A O no hydrogen 3.313 N/A HIS 128.A N VAL 124.A O no hydrogen 2.810 N/A ASN 129.A N ARG 125.A O no hydrogen 2.982 N/A CYS 130.A N HIS 126.A O no hydrogen 3.112 N/A CYS 130.A N CYS 127.A O no hydrogen 3.050 N/A CYS 130.A SG HIS 126.A NE2 no hydrogen 3.751 N/A CYS 130.A SG HIS 126.A O no hydrogen 3.473 N/A GLY 131.A N HIS 128.A O no hydrogen 3.086 N/A VAL 132.A N CYS 127.A O no hydrogen 2.807 N/A LEU 133.A N ALA 160.A O no hydrogen 2.876 N/A HIS 134.A NE2 ILE 154.A O no hydrogen 2.946 N/A ARG 135.A NE TYR 187.A OH no hydrogen 3.076 N/A ARG 135.A NH1 SER 158.A O no hydrogen 2.962 N/A ARG 135.A NH1 GLY 159.A O no hydrogen 2.975 N/A ARG 135.A NH2 ASP 169.A O no hydrogen 2.706 N/A ARG 135.A NH2 ASP 169.A OD2 no hydrogen 2.693 N/A ARG 135.A NH2 TYR 187.A OH no hydrogen 3.158 N/A ASP 136.A N HIS 134.A ND1 no hydrogen 2.862 N/A LYS 138.A NZ GLU 140.A OE1 no hydrogen 3.520 N/A GLU 140.A N ASP 139.A OD2 no hydrogen 2.889 N/A ASN 141.A N LYS 138.A O no hydrogen 2.948 N/A ASN 141.A ND2 ASP 136.A O no hydrogen 2.754 N/A ASN 141.A ND2 ASP 136.A OD2 no hydrogen 3.108 N/A ILE 142.A N ASP 139.A O no hydrogen 3.259 N/A LEU 143.A N LYS 152.A O no hydrogen 2.921 N/A ILE 144.A N GLN 96.A O no hydrogen 2.620 N/A ASP 145.A N GLU 150.A O no hydrogen 2.756 N/A ASN 147.A N ASP 145.A OD2 no hydrogen 3.233 N/A GLY 149.A N ASP 145.A O no hydrogen 2.782 N/A LEU 151.A N GLN 119.A OE1 no hydrogen 3.040 N/A LYS 152.A N LEU 143.A O no hydrogen 2.907 N/A LYS 152.A NZ SER 70.A O no hydrogen 2.752 N/A LEU 153.A N GLY 71.A O no hydrogen 2.705 N/A ILE 154.A N ASN 141.A O no hydrogen 2.825 N/A PHE 156.A N GLU 58.A OE2 no hydrogen 3.052 N/A GLY 157.A N ASP 155.A OD1 no hydrogen 3.272 N/A GLY 159.A N PHE 156.A O no hydrogen 3.027 N/A ALA 160.A N LEU 133.A O no hydrogen 2.924 N/A LEU 162.A N GLY 131.A O no hydrogen 2.733 N/A LYS 163.A NZ VAL 166.A O no hydrogen 2.571 N/A TYR 167.A N TYR 187.A O no hydrogen 2.703 N/A TYR 167.A OH LEU 161.A O no hydrogen 2.781 N/A THR 173.A N ASP 136.A OD1 no hydrogen 2.927 N/A ARG 174.A NE ASP 214.A OD1 no hydrogen 2.992 N/A ARG 174.A NH2 ASP 214.A OD1 no hydrogen 3.449 N/A ARG 174.A NH2 ASP 214.A OD2 no hydrogen 3.005 N/A TYR 176.A N THR 173.A O no hydrogen 3.182 N/A SER 177.A N ARG 174.A O no hydrogen 2.574 N/A SER 177.A OG ARG 174.A O no hydrogen 2.657 N/A GLU 180.A N GLU 180.A OE2 no hydrogen 2.586 N/A TRP 181.A N PRO 178.A O no hydrogen 3.051 N/A ILE 182.A N PRO 178.A O no hydrogen 3.475 N/A ARG 183.A N PRO 179.A O no hydrogen 2.994 N/A ARG 183.A NE TYR 184.A OH no hydrogen 3.405 N/A ARG 183.A NH2 TYR 184.A OH no hydrogen 3.281 N/A TYR 184.A N GLU 180.A O no hydrogen 2.924 N/A HIS 185.A N TRP 181.A O no hydrogen 2.701 N/A TYR 187.A N TYR 167.A O no hydrogen 3.085 N/A TYR 187.A OH ASP 169.A O no hydrogen 2.517 N/A SER 191.A OG HIS 188.A O no hydrogen 3.428 N/A ALA 192.A N HIS 188.A O no hydrogen 3.088 N/A ALA 193.A N GLY 189.A O no hydrogen 2.906 N/A VAL 194.A N ARG 190.A O no hydrogen 2.983 N/A TRP 195.A N SER 191.A O no hydrogen 3.117 N/A SER 196.A N ALA 192.A O no hydrogen 3.169 N/A SER 196.A OG ALA 193.A O no hydrogen 2.836 N/A LEU 197.A N ALA 193.A O no hydrogen 2.950 N/A GLY 198.A N VAL 194.A O no hydrogen 2.893 N/A ILE 199.A N TRP 195.A O no hydrogen 3.001 N/A LEU 200.A N SER 196.A O no hydrogen 2.901 N/A LEU 201.A N LEU 197.A O no hydrogen 2.900 N/A TYR 202.A N GLY 198.A O no hydrogen 3.156 N/A TYR 202.A OH PHE 223.A O no hydrogen 2.689 N/A ASP 203.A N ILE 199.A O no hydrogen 2.955 N/A MET 204.A N LEU 200.A O no hydrogen 2.871 N/A VAL 205.A N LEU 201.A O no hydrogen 3.059 N/A CYS 206.A N TYR 202.A O no hydrogen 2.829 N/A GLY 207.A N ASP 203.A O no hydrogen 2.885 N/A ILE 209.A N ASP 208.A OD1 no hydrogen 2.958 N/A GLU 212.A N GLU 216.A OE1 no hydrogen 2.501 N/A HIS 213.A N GLU 216.A OE1 no hydrogen 3.119 N/A ILE 217.A N HIS 213.A O no hydrogen 3.200 N/A ILE 218.A N ASP 214.A O no hydrogen 2.995 N/A ARG 219.A N GLU 215.A O no hydrogen 3.115 N/A GLY 220.A N GLU 216.A O no hydrogen 3.020 N/A ARG 225.A NE TYR 202.A OH no hydrogen 3.265 N/A GLN 226.A NE2 CYS 206.A O no hydrogen 3.526 N/A SER 229.A N GLU 110.A OE2 no hydrogen 2.686 N/A SER 229.A OG GLU 110.A OE1 no hydrogen 2.715 N/A SER 229.A OG GLU 110.A OE2 no hydrogen 3.167 N/A CYS 231.A N SER 229.A OG no hydrogen 3.244 N/A GLN 232.A N SER 229.A O no hydrogen 2.997 N/A GLN 232.A NE2 VAL 228.A O no hydrogen 3.584 N/A LEU 234.A N GLU 230.A O no hydrogen 2.999 N/A ILE 235.A N CYS 231.A O no hydrogen 3.000 N/A ARG 236.A N GLN 232.A O no hydrogen 2.988 N/A TRP 237.A N HIS 233.A O no hydrogen 3.074 N/A TRP 237.A N LEU 234.A O no hydrogen 3.157 N/A TRP 237.A NE1 ASP 245.A O no hydrogen 3.029 N/A CYS 238.A N LEU 234.A O no hydrogen 2.996 N/A CYS 238.A SG LEU 234.A O no hydrogen 3.456 N/A LEU 239.A N ILE 235.A O no hydrogen 3.134 N/A ALA 240.A N TRP 237.A O no hydrogen 2.980 N/A ASP 245.A N ARG 242.A O no hydrogen 2.910 N/A ARG 246.A N PRO 243.A O no hydrogen 2.773 N/A ARG 246.A NE ALA 240.A O no hydrogen 2.873 N/A ARG 246.A NH1 GLU 180.A OE1 no hydrogen 2.914 N/A ARG 246.A NH1 SER 191.A O no hydrogen 2.806 N/A ARG 246.A NH2 GLU 180.A OE2 no hydrogen 2.606 N/A ARG 246.A NH2 ALA 240.A O no hydrogen 3.375 N/A ARG 246.A NH2 LEU 241.A O no hydrogen 3.353 N/A THR 248.A N GLU 251.A OE1 no hydrogen 3.072 N/A THR 248.A OG1 GLU 251.A OE1 no hydrogen 3.372 N/A GLU 251.A N THR 248.A OG1 no hydrogen 3.045 N/A ILE 252.A N THR 248.A O no hydrogen 2.864 N/A GLN 253.A N PHE 249.A O no hydrogen 2.924 N/A GLN 253.A NE2 GLU 122.A OE2 no hydrogen 3.147 N/A ASN 254.A N GLU 250.A O no hydrogen 2.906 N/A HIS 255.A N ILE 252.A O no hydrogen 3.236 N/A TRP 257.A N HIS 255.A ND1 no hydrogen 2.971 N/A TRP 257.A NE1 GLU 110.A OE1 no hydrogen 2.692 N/A MET 258.A N HIS 255.A O no hydrogen 2.777 N/A GLN 259.A N PRO 256.A O no hydrogen 3.347 N/A LEU 263.A N GLU 266.A OE2 no hydrogen 3.159 N/A GLN 265.A NE2 ASN 147.A O no hydrogen 3.372 N/A GLN 265.A NE2 GLN 265.A O no hydrogen 2.850 N/A THR 267.A N LEU 263.A O no hydrogen 3.056 N/A THR 267.A OG1 SER 115.A OG no hydrogen 2.588 N/A THR 267.A OG1 LEU 263.A O no hydrogen 2.933 N/A ALA 268.A N PRO 264.A O no hydrogen 2.922 N/A GLU 269.A N GLN 265.A O no hydrogen 3.012 N/A ILE 270.A N GLU 266.A O no hydrogen 2.899 N/A HIS 271.A N THR 267.A O no hydrogen 2.910 N/A HIS 271.A NE2 GLU 111.A OE1 no hydrogen 2.844 N/A LEU 272.A N ALA 268.A O no hydrogen 2.949 N/A HIS 273.A N ALA 268.A O no hydrogen 2.647 N/A