Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3udb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 5.A NE2 TYR 40.A OH no hydrogen 2.034 N/A ARG 9.A N ASP 6.A O no hydrogen 3.028 N/A ARG 9.A NH1 GLU 71.A OE2 no hydrogen 3.275 N/A TYR 10.A N ASP 6.A O no hydrogen 2.986 N/A TYR 10.A OH GLU 71.A OE1 no hydrogen 2.682 N/A GLU 11.A N ARG 28.A O no hydrogen 2.691 N/A VAL 13.A N LEU 26.A O no hydrogen 2.912 N/A LYS 14.A N LEU 26.A O no hydrogen 3.310 N/A ALA 24.A N ILE 16.A O no hydrogen 3.367 N/A ARG 25.A N VAL 38.A O no hydrogen 3.039 N/A ARG 25.A NH2 PRO 2.A O no hydrogen 2.564 N/A LEU 26.A N LYS 14.A O no hydrogen 2.820 N/A MET 27.A N VAL 36.A O no hydrogen 2.878 N/A ARG 28.A N GLU 11.A O no hydrogen 2.888 N/A ARG 28.A NE GLU 11.A OE2 no hydrogen 2.657 N/A ARG 28.A NH2 GLU 11.A OE2 no hydrogen 2.529 N/A ASP 29.A N GLU 34.A O no hydrogen 3.147 N/A LYS 30.A N ARG 9.A O no hydrogen 2.895 N/A LYS 30.A NZ SER 7.A O no hydrogen 3.152 N/A VAL 36.A N MET 27.A O no hydrogen 2.821 N/A ALA 37.A N MET 83.A O no hydrogen 2.784 N/A VAL 38.A N ARG 25.A O no hydrogen 2.898 N/A LYS 39.A N ILE 81.A O no hydrogen 2.864 N/A TYR 40.A OH HIS 5.A NE2 no hydrogen 2.034 N/A ILE 41.A N LEU 79.A O no hydrogen 2.917 N/A ARG 43.A N THR 77.A O no hydrogen 3.281 N/A ARG 43.A NE THR 75.A O no hydrogen 2.682 N/A LYS 46.A NZ GLU 42.A OE1 no hydrogen 2.794 N/A ILE 47.A N GLY 44.A O no hydrogen 3.286 N/A VAL 51.A N ASP 48.A OD2 no hydrogen 3.033 N/A LYS 52.A N ASP 48.A O no hydrogen 3.262 N/A LYS 52.A NZ GLU 49.A OE2 no hydrogen 1.969 N/A ARG 53.A N GLU 49.A O no hydrogen 2.503 N/A GLU 54.A N ASN 50.A O no hydrogen 3.013 N/A ILE 55.A N VAL 51.A O no hydrogen 2.990 N/A ILE 56.A N LYS 52.A O no hydrogen 3.042 N/A ASN 57.A N ARG 53.A O no hydrogen 2.874 N/A HIS 58.A N GLU 54.A O no hydrogen 2.916 N/A HIS 58.A ND1 TYR 152.A OH no hydrogen 3.106 N/A HIS 58.A NE2 VAL 67.A O no hydrogen 2.494 N/A ARG 59.A N ILE 55.A O no hydrogen 2.937 N/A ARG 59.A NH2 GLN 261.A O no hydrogen 1.963 N/A SER 60.A N ASN 57.A O no hydrogen 3.283 N/A SER 60.A OG ASN 57.A O no hydrogen 2.772 N/A LEU 61.A N HIS 58.A O no hydrogen 3.395 N/A ARG 62.A N TYR 119.A OH no hydrogen 3.130 N/A HIS 63.A NE2 SER 115.A OG no hydrogen 2.932 N/A ASN 65.A N HIS 63.A ND1 no hydrogen 2.832 N/A ASN 65.A ND2 GLN 112.A OE1 no hydrogen 3.045 N/A ASN 65.A ND2 LEU 145.A O no hydrogen 3.050 N/A ILE 66.A N HIS 63.A O no hydrogen 3.178 N/A VAL 67.A N ILE 147.A O no hydrogen 2.972 N/A LYS 70.A N VAL 82.A O no hydrogen 3.068 N/A GLU 71.A N VAL 82.A O no hydrogen 3.307 N/A ILE 73.A N ALA 80.A O no hydrogen 2.943 N/A THR 75.A N HIS 78.A O no hydrogen 2.966 N/A THR 75.A OG1 HIS 78.A O no hydrogen 2.754 N/A HIS 78.A N THR 75.A OG1 no hydrogen 2.909 N/A LEU 79.A N ILE 41.A O no hydrogen 2.780 N/A ALA 80.A N ILE 73.A O no hydrogen 2.781 N/A ILE 81.A N LYS 39.A O no hydrogen 2.807 N/A VAL 82.A N GLU 71.A O no hydrogen 2.942 N/A MET 83.A N ALA 37.A O no hydrogen 2.952 N/A GLU 84.A N ARG 68.A O no hydrogen 3.264 N/A LEU 91.A N THR 135.A O no hydrogen 3.014 N/A ARG 94.A N GLU 90.A O no hydrogen 3.274 N/A ARG 94.A N LEU 91.A O no hydrogen 2.935 N/A ILE 95.A N LEU 91.A O no hydrogen 2.972 N/A CYS 96.A N PHE 92.A O no hydrogen 3.101 N/A CYS 96.A SG PHE 92.A O no hydrogen 3.300 N/A ASN 97.A N GLU 93.A O no hydrogen 3.280 N/A ALA 98.A N ARG 94.A O no hydrogen 3.176 N/A ALA 98.A N ILE 95.A O no hydrogen 3.187 N/A GLY 99.A N CYS 96.A O no hydrogen 3.393 N/A PHE 101.A N MET 184.A O no hydrogen 2.824 N/A GLU 105.A N SER 102.A O no hydrogen 3.104 N/A GLU 105.A N SER 102.A OG no hydrogen 3.101 N/A ALA 106.A N SER 102.A O no hydrogen 2.994 N/A ARG 107.A N GLU 103.A O no hydrogen 2.989 N/A ARG 107.A NH1 TRP 250.A O no hydrogen 2.971 N/A ARG 107.A NH2 ASP 104.A OD1 no hydrogen 3.558 N/A PHE 108.A N ASP 104.A O no hydrogen 3.206 N/A PHE 109.A N GLU 105.A O no hydrogen 3.317 N/A PHE 109.A N ALA 106.A O no hydrogen 3.224 N/A PHE 110.A N ALA 106.A O no hydrogen 2.878 N/A GLN 111.A N ARG 107.A O no hydrogen 2.873 N/A GLN 111.A NE2 PHE 251.A O no hydrogen 3.145 N/A GLN 111.A NE2 LYS 253.A O no hydrogen 3.288 N/A GLN 112.A NE2 PHE 108.A O no hydrogen 3.021 N/A LEU 113.A N PHE 109.A O no hydrogen 2.786 N/A ILE 114.A N PHE 110.A O no hydrogen 2.922 N/A SER 115.A N GLN 111.A O no hydrogen 3.022 N/A SER 115.A OG HIS 63.A NE2 no hydrogen 2.932 N/A GLY 116.A N GLN 112.A O no hydrogen 2.906 N/A VAL 117.A N LEU 113.A O no hydrogen 2.933 N/A SER 118.A N ILE 114.A O no hydrogen 2.966 N/A TYR 119.A N SER 115.A O no hydrogen 3.159 N/A ALA 120.A N GLY 116.A O no hydrogen 3.093 N/A HIS 121.A N VAL 117.A O no hydrogen 3.007 N/A HIS 121.A N SER 118.A O no hydrogen 3.219 N/A HIS 121.A NE2 ASP 173.A OD1 no hydrogen 2.760 N/A ALA 122.A N SER 118.A O no hydrogen 3.128 N/A ALA 122.A N TYR 119.A O no hydrogen 3.046 N/A MET 123.A N ALA 120.A O no hydrogen 3.321 N/A GLN 124.A N HIS 121.A O no hydrogen 3.498 N/A ARG 128.A NH1 ASP 149.A OD2 no hydrogen 3.452 N/A LYS 131.A NZ ALA 148.A O no hydrogen 3.532 N/A GLU 133.A N GLU 133.A OE2 no hydrogen 2.858 N/A LEU 136.A N LYS 146.A O no hydrogen 2.864 N/A LEU 137.A N GLY 89.A O no hydrogen 3.054 N/A ASP 138.A N ARG 144.A O no hydrogen 2.966 N/A SER 140.A OG ASP 138.A OD1 no hydrogen 3.528 N/A SER 140.A OG ASP 138.A OD2 no hydrogen 3.190 N/A ARG 144.A N ASP 138.A OD1 no hydrogen 2.500 N/A LEU 145.A N GLN 112.A OE1 no hydrogen 2.686 N/A LYS 146.A N LEU 136.A O no hydrogen 2.866 N/A LYS 146.A NZ PRO 64.A O no hydrogen 2.818 N/A LYS 146.A NZ GLU 84.A OE1 no hydrogen 2.744 N/A LYS 146.A NZ GLU 84.A OE2 no hydrogen 3.535 N/A ILE 147.A N ASN 65.A O no hydrogen 2.841 N/A TYR 152.A OH HIS 58.A ND1 no hydrogen 3.106 N/A ILE 157.A N PRO 154.A O no hydrogen 3.035 N/A VAL 161.A N ALA 158.A O no hydrogen 3.053 N/A LEU 163.A N PRO 159.A O no hydrogen 2.861 N/A LYS 164.A N GLU 160.A O no hydrogen 2.847 N/A LYS 170.A N ASP 168.A OD2 no hydrogen 2.703 N/A LYS 170.A NZ HIS 121.A O no hydrogen 3.208 N/A VAL 171.A N ASP 168.A O no hydrogen 3.223 N/A ALA 172.A N ASP 168.A O no hydrogen 3.248 N/A ASP 173.A N GLY 169.A O no hydrogen 3.147 N/A VAL 174.A N LYS 170.A O no hydrogen 3.398 N/A TRP 175.A N VAL 171.A O no hydrogen 3.386 N/A SER 176.A N ALA 172.A O no hydrogen 3.187 N/A SER 176.A OG TYR 156.A O no hydrogen 2.804 N/A CYS 177.A N ASP 173.A O no hydrogen 2.819 N/A CYS 177.A SG ASP 173.A O no hydrogen 3.365 N/A GLY 178.A N VAL 174.A O no hydrogen 2.874 N/A GLY 178.A N TRP 175.A O no hydrogen 2.725 N/A VAL 179.A N TRP 175.A O no hydrogen 2.976 N/A THR 180.A N SER 176.A O no hydrogen 3.199 N/A THR 180.A OG1 SER 176.A O no hydrogen 3.317 N/A LEU 181.A N CYS 177.A O no hydrogen 3.143 N/A TYR 182.A N GLY 178.A O no hydrogen 2.866 N/A TYR 182.A OH ALA 213.A O no hydrogen 3.421 N/A VAL 183.A N VAL 179.A O no hydrogen 2.965 N/A MET 184.A N THR 180.A O no hydrogen 3.058 N/A LEU 185.A N LEU 181.A O no hydrogen 3.066 N/A LEU 185.A N TYR 182.A O no hydrogen 2.980 N/A VAL 186.A N TYR 182.A O no hydrogen 2.792 N/A GLY 187.A N VAL 183.A O no hydrogen 2.827 N/A ASN 199.A N GLU 196.A O no hydrogen 3.416 N/A LYS 202.A N ASN 199.A OD1 no hydrogen 3.047 N/A THR 203.A OG1 PHE 191.A O no hydrogen 2.796 N/A ILE 204.A N PHE 200.A O no hydrogen 2.866 N/A HIS 205.A N ARG 201.A O no hydrogen 2.998 N/A ARG 206.A N LYS 202.A O no hydrogen 3.048 N/A ILE 207.A N THR 203.A O no hydrogen 3.031 N/A LEU 208.A N ILE 204.A O no hydrogen 3.035 N/A ASN 209.A N HIS 205.A O no hydrogen 3.202 N/A ASN 209.A N ARG 206.A O no hydrogen 3.049 N/A VAL 210.A N ILE 207.A O no hydrogen 2.932 N/A GLN 211.A N ARG 206.A O no hydrogen 3.077 N/A VAL 218.A N PRO 215.A O no hydrogen 3.146 N/A SER 221.A N GLU 103.A OE2 no hydrogen 2.897 N/A SER 221.A OG GLU 103.A OE1 no hydrogen 2.693 N/A CYS 224.A N SER 221.A OG no hydrogen 3.369 N/A ARG 225.A N SER 221.A O no hydrogen 3.119 N/A HIS 226.A N PRO 222.A O no hydrogen 2.890 N/A HIS 226.A ND1 HIS 248.A NE2 no hydrogen 2.985 N/A LEU 227.A N GLU 223.A O no hydrogen 3.217 N/A ILE 228.A N CYS 224.A O no hydrogen 3.176 N/A SER 229.A N ARG 225.A O no hydrogen 3.378 N/A SER 229.A OG HIS 226.A O no hydrogen 2.544 N/A ARG 230.A N HIS 226.A O no hydrogen 2.990 N/A ARG 230.A N LEU 227.A O no hydrogen 2.910 N/A ARG 230.A NH1 LYS 238.A O no hydrogen 3.144 N/A ILE 231.A N LEU 227.A O no hydrogen 3.084 N/A ILE 231.A N ILE 228.A O no hydrogen 3.115 N/A PHE 232.A N ILE 228.A O no hydrogen 3.035 N/A VAL 233.A N ILE 231.A O no hydrogen 2.849 N/A ALA 237.A N ASP 235.A OD1 no hydrogen 3.080 N/A LYS 238.A N ASP 235.A O no hydrogen 2.828 N/A ARG 239.A N PRO 236.A O no hydrogen 3.227 N/A ARG 239.A NE VAL 233.A O no hydrogen 2.998 N/A ARG 239.A NH1 GLU 160.A OE2 no hydrogen 2.420 N/A ARG 239.A NH1 VAL 171.A O no hydrogen 2.979 N/A ARG 239.A NH2 GLU 160.A OE2 no hydrogen 2.918 N/A ARG 239.A NH2 VAL 233.A O no hydrogen 2.716 N/A ILE 240.A N ARG 230.A O no hydrogen 3.133 N/A SER 241.A N GLU 244.A OE1 no hydrogen 2.885 N/A SER 241.A OG GLU 244.A OE1 no hydrogen 3.081 N/A GLU 244.A N SER 241.A OG no hydrogen 3.362 N/A ILE 245.A N SER 241.A O no hydrogen 2.862 N/A ARG 246.A N ILE 242.A O no hydrogen 3.021 N/A ASN 247.A N GLU 244.A O no hydrogen 2.929 N/A ASN 247.A ND2 PRO 243.A O no hydrogen 3.502 N/A HIS 248.A N ILE 245.A O no hydrogen 3.123 N/A HIS 248.A NE2 HIS 226.A ND1 no hydrogen 2.985 N/A TRP 250.A N HIS 248.A ND1 no hydrogen 2.963 N/A TRP 250.A NE1 GLU 103.A OE1 no hydrogen 2.703 N/A PHE 251.A N HIS 248.A O no hydrogen 2.807 N/A LEU 252.A N HIS 248.A O no hydrogen 3.000 N/A LEU 252.A N GLU 249.A O no hydrogen 3.291 N/A LYS 253.A N GLU 249.A O no hydrogen 3.395 N/A LEU 255.A N LEU 252.A O no hydrogen 3.053 N/A ILE 266.A N SER 262.A O no hydrogen 3.036 N/A MET 267.A N ILE 263.A O no hydrogen 3.092 N/A GLN 268.A N GLU 264.A O no hydrogen 2.678 N/A ILE 269.A N GLU 265.A O no hydrogen 3.163 N/A ILE 269.A N ILE 266.A O no hydrogen 3.052 N/A ILE 270.A N ILE 266.A O no hydrogen 3.083 N/A ALA 271.A N MET 267.A O no hydrogen 3.274 N/A ALA 273.A N ILE 269.A O no hydrogen 3.360 N/A THR 274.A N ILE 270.A O no hydrogen 3.271 N/A THR 274.A N ALA 271.A O no hydrogen 2.707 N/A THR 274.A OG1 ALA 271.A O no hydrogen 2.194 N/A VAL 275.A N GLU 272.A O no hydrogen 2.695 N/A