Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3exf_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N PHE 180.A O no hydrogen 2.631 N/A THR 4.A OG1 ASP 7.A OD1 no hydrogen 3.000 N/A THR 4.A OG1 TYR 176.A O no hydrogen 3.539 N/A VAL 5.A N VAL 178.A O no hydrogen 3.181 N/A ARG 6.A N TYR 176.A O no hydrogen 3.197 N/A ARG 6.A NE TYR 37.A O no hydrogen 2.739 N/A ARG 6.A NH2 TYR 37.A O no hydrogen 2.656 N/A ASP 7.A N THR 4.A OG1 no hydrogen 3.368 N/A ALA 8.A N THR 4.A O no hydrogen 3.005 N/A ALA 8.A N VAL 5.A O no hydrogen 3.127 N/A ILE 9.A N VAL 5.A O no hydrogen 3.194 N/A ASN 10.A N ARG 6.A O no hydrogen 3.174 N/A ASN 10.A ND2 VAL 39.A O no hydrogen 2.797 N/A ASN 10.A ND2 ARG 41.A O no hydrogen 3.249 N/A GLN 11.A N ASP 7.A O no hydrogen 2.926 N/A GLY 12.A N ALA 8.A O no hydrogen 3.128 N/A MET 13.A N ILE 9.A O no hydrogen 2.988 N/A ASP 14.A N ASN 10.A O no hydrogen 3.135 N/A GLU 15.A N GLN 11.A O no hydrogen 2.780 N/A GLU 16.A N GLY 12.A O no hydrogen 2.772 N/A LEU 17.A N MET 13.A O no hydrogen 2.753 N/A GLU 18.A N ASP 14.A O no hydrogen 3.078 N/A ARG 19.A N GLU 15.A O no hydrogen 3.134 N/A ASP 20.A N GLU 16.A O no hydrogen 2.971 N/A ASP 20.A N LEU 17.A O no hydrogen 3.256 N/A LYS 22.A N ASP 20.A OD1 no hydrogen 2.385 N/A LYS 22.A NZ ASP 20.A OD2 no hydrogen 3.351 N/A LEU 25.A N ARG 51.A O no hydrogen 2.889 N/A LEU 26.A N ILE 77.A O no hydrogen 2.710 N/A GLY 27.A N ILE 53.A O no hydrogen 3.223 N/A ALA 31.A N ASP 54.A OD1 no hydrogen 2.782 N/A ASP 34.A N ALA 31.A O no hydrogen 3.341 N/A GLY 35.A N GLU 29.A O no hydrogen 2.509 N/A LYS 38.A N GLY 35.A O no hydrogen 2.745 N/A LYS 38.A NZ TYR 33.A O no hydrogen 2.867 N/A SER 40.A OG VAL 30.A O no hydrogen 3.059 N/A GLY 42.A N ASP 34.A OD2 no hydrogen 2.686 N/A LEU 43.A N SER 40.A O no hydrogen 3.254 N/A TRP 44.A NE1 ASP 49.A OD1 no hydrogen 2.404 N/A LYS 46.A N GLY 42.A O no hydrogen 3.166 N/A LYS 46.A NZ ASP 14.A OD1 no hydrogen 2.564 N/A LYS 46.A NZ ASP 14.A OD2 no hydrogen 3.522 N/A LYS 46.A NZ GLU 18.A OE1 no hydrogen 2.602 N/A LYS 46.A NZ TYR 47.A OH no hydrogen 3.199 N/A TYR 47.A N LEU 43.A O no hydrogen 2.963 N/A TYR 47.A OH ASP 14.A OD1 no hydrogen 2.710 N/A TYR 47.A OH GLU 18.A OE1 no hydrogen 3.357 N/A GLY 48.A N TRP 44.A O no hydrogen 2.485 N/A ARG 51.A N GLY 48.A O no hydrogen 3.216 N/A ARG 51.A NE VAL 23.A O no hydrogen 3.130 N/A ARG 51.A NH2 LEU 17.A O no hydrogen 3.288 N/A ARG 51.A NH2 VAL 23.A O no hydrogen 2.779 N/A ILE 52.A N GLY 48.A O no hydrogen 3.132 N/A ILE 53.A N LEU 25.A O no hydrogen 3.087 N/A THR 55.A N GLY 27.A O no hydrogen 2.710 N/A THR 55.A OG1 PRO 56.A O no hydrogen 3.040 N/A SER 58.A N PRO 56.A O no hydrogen 2.783 N/A PHE 62.A N SER 58.A O no hydrogen 2.794 N/A ALA 63.A N GLU 59.A O no hydrogen 2.811 N/A GLY 64.A N MET 60.A O no hydrogen 3.377 N/A ILE 65.A N GLY 61.A O no hydrogen 3.047 N/A ALA 66.A N PHE 62.A O no hydrogen 3.093 N/A VAL 67.A N ALA 63.A O no hydrogen 3.105 N/A GLY 68.A N GLY 64.A O no hydrogen 2.885 N/A ALA 69.A N ILE 65.A O no hydrogen 2.753 N/A ALA 70.A N ALA 66.A O no hydrogen 2.922 N/A MET 71.A N VAL 67.A O no hydrogen 2.979 N/A ALA 72.A N GLY 68.A O no hydrogen 2.952 N/A GLY 73.A N ALA 70.A O no hydrogen 2.730 N/A LEU 74.A N ALA 69.A O no hydrogen 2.884 N/A ARG 75.A N LYS 22.A O no hydrogen 2.932 N/A ARG 75.A NE ILE 161.A O no hydrogen 3.204 N/A ARG 75.A NH2 ILE 161.A O no hydrogen 3.006 N/A ILE 77.A N PHE 24.A O no hydrogen 2.725 N/A CYS 78.A N VAL 113.A O no hydrogen 2.567 N/A GLU 79.A N LEU 26.A O no hydrogen 2.771 N/A PHE 80.A N ARG 115.A O no hydrogen 2.987 N/A PHE 83.A N PRO 117.A O no hydrogen 2.764 N/A ASN 84.A ND2 THR 82.A OG1 no hydrogen 2.881 N/A PHE 85.A N THR 82.A O no hydrogen 3.285 N/A SER 86.A N PHE 83.A O no hydrogen 2.934 N/A SER 86.A OG PHE 83.A O no hydrogen 3.151 N/A SER 86.A OG TYR 136.A OH no hydrogen 2.764 N/A GLN 88.A N PHE 85.A O no hydrogen 3.196 N/A ALA 89.A N SER 86.A O no hydrogen 3.112 N/A ILE 90.A N MET 87.A O no hydrogen 3.403 N/A GLN 92.A N ALA 89.A O no hydrogen 2.590 N/A VAL 93.A N ALA 89.A O no hydrogen 3.236 N/A ILE 94.A N ILE 90.A O no hydrogen 2.879 N/A ASN 95.A N ASP 91.A O no hydrogen 3.074 N/A ASN 95.A ND2 ASP 91.A OD1 no hydrogen 2.412 N/A SER 96.A OG GLN 92.A OE1 no hydrogen 2.809 N/A ALA 97.A N GLN 92.A O no hydrogen 3.180 N/A ALA 98.A N VAL 93.A O no hydrogen 2.936 N/A LYS 99.A N ILE 94.A O no hydrogen 3.253 N/A LYS 99.A NZ ASN 95.A OD1 no hydrogen 3.329 N/A THR 100.A N ALA 97.A O no hydrogen 3.176 N/A THR 100.A OG1 SER 96.A O no hydrogen 2.603 N/A TYR 102.A N LYS 99.A O no hydrogen 2.917 N/A MET 103.A N LYS 99.A O no hydrogen 3.115 N/A SER 104.A N THR 100.A O no hydrogen 3.013 N/A SER 104.A OG THR 100.A O no hydrogen 3.004 N/A SER 104.A OG TYR 101.A O no hydrogen 2.948 N/A GLY 105.A N TYR 102.A O no hydrogen 3.123 N/A GLY 106.A N TYR 101.A O no hydrogen 2.857 N/A LEU 107.A N SER 104.A O no hydrogen 3.119 N/A GLN 108.A N SER 104.A OG no hydrogen 2.834 N/A GLN 108.A NE2 MET 71.A O no hydrogen 3.143 N/A GLN 108.A NE2 PRO 109.A O no hydrogen 3.068 N/A ILE 112.A N VAL 110.A O no hydrogen 2.776 N/A VAL 113.A N PRO 76.A O no hydrogen 3.164 N/A PHE 114.A N VAL 167.A O no hydrogen 3.174 N/A ARG 115.A N CYS 78.A O no hydrogen 3.281 N/A ARG 115.A NE GLU 171.A OE2 no hydrogen 2.402 N/A ARG 115.A NH1 GLU 79.A OE1 no hydrogen 2.803 N/A ARG 115.A NH2 GLU 171.A OE1 no hydrogen 2.942 N/A ARG 115.A NH2 GLU 171.A OE2 no hydrogen 3.183 N/A ASN 118.A N GLU 171.A O no hydrogen 2.648 N/A GLY 119.A N GLN 130.A O no hydrogen 3.197 N/A SER 121.A OG GLU 173.A OE1 no hydrogen 3.296 N/A GLY 123.A N GLU 309.A OE2 no hydrogen 3.283 N/A HIS 128.A N ALA 125.A O no hydrogen 3.242 N/A SER 129.A OG ALA 125.A O no hydrogen 3.275 N/A GLN 130.A N ASN 84.A OD1 no hydrogen 2.988 N/A CYS 131.A SG ASN 118.A OD1 no hydrogen 3.303 N/A TYR 136.A N PHE 132.A O no hydrogen 3.095 N/A TYR 136.A OH SER 86.A OG no hydrogen 2.764 N/A GLY 137.A N ALA 133.A O no hydrogen 2.924 N/A HIS 138.A N ALA 134.A O no hydrogen 3.381 N/A CYS 139.A N TYR 136.A O no hydrogen 3.162 N/A CYS 139.A SG TRP 135.A O no hydrogen 3.889 N/A CYS 139.A SG TYR 136.A O no hydrogen 3.891 N/A LEU 142.A N CYS 139.A O no hydrogen 3.512 N/A LYS 143.A N PRO 166.A O no hydrogen 3.221 N/A LYS 143.A NZ ASP 163.A OD1 no hydrogen 3.228 N/A LYS 143.A NZ ASP 163.A OD2 no hydrogen 2.447 N/A VAL 144.A N ARG 242.A O no hydrogen 2.933 N/A VAL 145.A N VAL 168.A O no hydrogen 2.964 N/A SER 146.A N ARG 239.A O no hydrogen 2.583 N/A SER 146.A OG LEU 170.A O no hydrogen 3.452 N/A SER 146.A OG HIS 212.A ND1 no hydrogen 3.149 N/A TRP 148.A N ASP 152.A OD2 no hydrogen 2.596 N/A ASN 149.A N ASP 152.A OD2 no hydrogen 3.118 N/A SER 150.A OG VAL 3.A O no hydrogen 3.058 N/A ASP 152.A N ASN 149.A OD1 no hydrogen 2.974 N/A ALA 153.A N SER 150.A O no hydrogen 2.797 N/A LYS 154.A N SER 150.A O no hydrogen 3.154 N/A LYS 154.A NZ GLN 11.A OE1 no hydrogen 2.757 N/A LYS 154.A NZ GLU 15.A OE2 no hydrogen 2.820 N/A LYS 154.A NZ ALA 186.A O no hydrogen 2.784 N/A LYS 154.A NZ GLN 187.A O no hydrogen 3.247 N/A GLY 155.A N GLU 151.A O no hydrogen 3.160 N/A LEU 156.A N ASP 152.A O no hydrogen 2.743 N/A ILE 157.A N ALA 153.A O no hydrogen 2.875 N/A ILE 157.A N LYS 154.A O no hydrogen 3.106 N/A LYS 158.A N LYS 154.A O no hydrogen 3.032 N/A LYS 158.A NZ GLU 15.A OE1 no hydrogen 2.731 N/A LYS 158.A NZ GLU 16.A OE2 no hydrogen 2.943 N/A LYS 158.A NZ LYS 189.A O no hydrogen 3.137 N/A SER 159.A N GLY 155.A O no hydrogen 2.915 N/A SER 159.A OG GLY 155.A O no hydrogen 3.414 N/A SER 159.A OG ILE 193.A O no hydrogen 2.722 N/A ILE 161.A N ILE 157.A O no hydrogen 2.916 N/A ARG 162.A N LYS 158.A O no hydrogen 3.045 N/A ARG 162.A NH1 GLU 16.A OE1 no hydrogen 2.885 N/A ASP 163.A N ALA 160.A O no hydrogen 3.364 N/A ASN 165.A N ASP 163.A OD1 no hydrogen 2.878 N/A ASN 165.A ND2 ASP 163.A OD1 no hydrogen 3.124 N/A VAL 168.A N LYS 143.A O no hydrogen 2.716 N/A VAL 169.A N PHE 114.A O no hydrogen 2.896 N/A LEU 170.A N VAL 145.A O no hydrogen 3.222 N/A GLU 171.A N GLY 116.A O no hydrogen 2.814 N/A MET 175.A N ASN 172.A O no hydrogen 3.078 N/A TYR 176.A N GLU 173.A O no hydrogen 3.239 N/A TYR 176.A OH GLU 171.A OE1 no hydrogen 2.462 N/A VAL 178.A N MET 175.A O no hydrogen 2.825 N/A PHE 180.A N VAL 3.A O no hydrogen 3.086 N/A PHE 182.A N LEU 1.A O no hydrogen 3.025 N/A ALA 186.A N PRO 183.A O no hydrogen 2.962 N/A GLN 187.A N PRO 184.A O no hydrogen 2.905 N/A GLN 187.A NE2 PRO 184.A O no hydrogen 3.319 N/A ASP 190.A N SER 188.A OG no hydrogen 2.815 N/A GLY 196.A N THR 240.A OG1 no hydrogen 2.627 N/A LYS 197.A N PRO 194.A O no hydrogen 3.296 N/A LYS 197.A NZ GLY 196.A O no hydrogen 3.351 N/A ALA 198.A N ASP 245.A OD2 no hydrogen 2.998 N/A LYS 199.A N ASN 237.A O no hydrogen 3.110 N/A LYS 199.A NZ GLU 201.A OE1 no hydrogen 3.286 N/A GLU 201.A N VAL 235.A O no hydrogen 2.828 N/A ARG 202.A NH1 GLN 203.A O no hydrogen 3.249 N/A ARG 202.A NH1 GLU 232.A OE1 no hydrogen 2.978 N/A ARG 202.A NH1 CYS 233.A O no hydrogen 3.350 N/A ARG 202.A NH2 GLU 232.A OE1 no hydrogen 3.384 N/A GLY 204.A N GLU 234.A OE1 no hydrogen 2.753 N/A HIS 206.A N GLU 232.A O no hydrogen 2.902 N/A THR 208.A N HIS 258.A O no hydrogen 2.947 N/A THR 208.A OG1 SER 252.A OG no hydrogen 2.723 N/A THR 208.A OG1 THR 256.A OG1 no hydrogen 2.667 N/A THR 208.A OG1 HIS 258.A O no hydrogen 3.399 N/A VAL 209.A N GLU 234.A O no hydrogen 3.113 N/A VAL 210.A N VAL 260.A O no hydrogen 2.882 N/A SER 211.A N ILE 236.A O no hydrogen 3.079 N/A SER 211.A OG VAL 262.A O no hydrogen 2.616 N/A HIS 212.A ND1 SER 146.A OG no hydrogen 3.149 N/A VAL 216.A N SER 213.A O no hydrogen 2.947 N/A GLY 217.A N ARG 214.A O no hydrogen 3.096 N/A CYS 219.A N PRO 215.A O no hydrogen 2.976 N/A CYS 219.A SG PRO 215.A O no hydrogen 3.841 N/A LEU 220.A N VAL 216.A O no hydrogen 3.379 N/A GLU 221.A N GLY 217.A O no hydrogen 2.917 N/A ALA 222.A N HIS 218.A O no hydrogen 2.691 N/A ALA 223.A N CYS 219.A O no hydrogen 2.744 N/A ALA 224.A N LEU 220.A O no hydrogen 3.030 N/A ALA 224.A N GLU 221.A O no hydrogen 3.048 N/A VAL 225.A N GLU 221.A O no hydrogen 3.353 N/A LEU 226.A N ALA 222.A O no hydrogen 2.922 N/A SER 227.A N ALA 223.A O no hydrogen 2.821 N/A SER 227.A N ALA 224.A O no hydrogen 3.187 N/A SER 227.A OG GLU 232.A OE2 no hydrogen 3.200 N/A LYS 228.A N ALA 224.A O no hydrogen 3.259 N/A LYS 228.A N VAL 225.A O no hydrogen 3.184 N/A GLU 229.A N LEU 226.A O no hydrogen 3.146 N/A GLY 230.A N SER 227.A O no hydrogen 2.942 N/A VAL 231.A N LEU 226.A O no hydrogen 3.293 N/A GLU 232.A N HIS 206.A ND1 no hydrogen 3.051 N/A GLU 234.A N ILE 207.A O no hydrogen 2.784 N/A ILE 236.A N VAL 209.A O no hydrogen 2.645 N/A ASN 237.A N LYS 199.A O no hydrogen 2.816 N/A MET 238.A N SER 211.A O no hydrogen 2.692 N/A ARG 239.A NE ASP 152.A OD1 no hydrogen 2.949 N/A ARG 239.A NH2 ASP 152.A OD1 no hydrogen 3.083 N/A ILE 241.A N VAL 144.A O no hydrogen 2.720 N/A ARG 242.A N VAL 144.A O no hydrogen 3.269 N/A ARG 242.A NH1 GLY 137.A O no hydrogen 2.754 N/A THR 248.A N ASP 245.A OD1 no hydrogen 3.356 N/A THR 248.A OG1 ASP 245.A OD2 no hydrogen 2.972 N/A GLU 250.A N MET 246.A O no hydrogen 2.551 N/A ALA 251.A N GLU 247.A O no hydrogen 2.852 N/A SER 252.A N ILE 249.A O no hydrogen 2.882 N/A SER 252.A OG THR 208.A OG1 no hydrogen 2.723 N/A SER 252.A OG GLU 234.A OE2 no hydrogen 3.494 N/A VAL 253.A N ILE 249.A O no hydrogen 2.957 N/A MET 254.A N GLU 250.A O no hydrogen 3.151 N/A LYS 255.A N SER 252.A O no hydrogen 2.930 N/A LYS 255.A NZ GLY 204.A O no hydrogen 3.347 N/A LYS 255.A NZ GLU 234.A OE1 no hydrogen 3.354 N/A LYS 255.A NZ GLU 234.A OE2 no hydrogen 3.364 N/A THR 256.A N SER 252.A O no hydrogen 2.949 N/A THR 256.A OG1 THR 208.A OG1 no hydrogen 2.667 N/A THR 256.A OG1 SER 252.A O no hydrogen 2.997 N/A THR 256.A OG1 VAL 253.A O no hydrogen 3.529 N/A THR 256.A OG1 HIS 258.A O no hydrogen 3.311 N/A ASN 257.A N VAL 253.A O no hydrogen 2.635 N/A HIS 258.A ND1 THR 256.A O no hydrogen 2.835 N/A VAL 260.A N THR 208.A O no hydrogen 2.904 N/A THR 261.A N VAL 293.A O no hydrogen 3.071 N/A VAL 262.A N VAL 210.A O no hydrogen 2.766 N/A GLU 263.A N VAL 295.A O no hydrogen 2.834 N/A TRP 266.A NE1 VAL 300.A O no hydrogen 3.151 N/A VAL 271.A N GLU 263.A OE1 no hydrogen 3.262 N/A GLY 272.A N GLU 263.A OE2 no hydrogen 2.508 N/A GLU 274.A N GLY 270.A O no hydrogen 3.282 N/A ILE 275.A N VAL 271.A O no hydrogen 3.138 N/A CYS 276.A N GLY 272.A O no hydrogen 3.038 N/A CYS 276.A SG GLY 272.A O no hydrogen 3.118 N/A ALA 277.A N ALA 273.A O no hydrogen 3.128 N/A ARG 278.A N GLU 274.A O no hydrogen 3.143 N/A ILE 279.A N ILE 275.A O no hydrogen 3.076 N/A MET 280.A N CYS 276.A O no hydrogen 2.944 N/A GLU 281.A N ALA 277.A O no hydrogen 2.818 N/A GLY 282.A N ILE 279.A O no hydrogen 2.976 N/A PHE 285.A N GLY 282.A O no hydrogen 3.126 N/A PHE 287.A N ALA 284.A O no hydrogen 2.605 N/A LEU 288.A N PHE 285.A O no hydrogen 3.008 N/A ASP 289.A N ASN 257.A O no hydrogen 2.890 N/A VAL 293.A N LEU 259.A O no hydrogen 3.293 N/A VAL 295.A N THR 261.A O no hydrogen 2.745 N/A THR 296.A OG1 GLY 297.A O no hydrogen 2.878 N/A GLY 297.A N GLY 265.A O no hydrogen 3.105 N/A ALA 298.A N SER 312.A O no hydrogen 2.731 N/A LYS 306.A NZ ASP 310.A OD1 no hydrogen 2.824 N/A LYS 306.A NZ ASP 310.A OD2 no hydrogen 3.196 N/A LEU 308.A N ALA 305.A O no hydrogen 3.259 N/A GLU 309.A N ALA 305.A O no hydrogen 2.827 N/A ASP 310.A N LYS 306.A O no hydrogen 2.852 N/A ASN 311.A N LEU 308.A O no hydrogen 3.132 N/A ASN 311.A ND2 ILE 307.A O no hydrogen 2.595 N/A SER 312.A N GLU 309.A O no hydrogen 2.844 N/A SER 312.A OG LEU 308.A O no hydrogen 2.855 N/A GLN 315.A N ASP 318.A OD2 no hydrogen 2.955 N/A ASP 318.A N GLN 315.A O no hydrogen 3.074 N/A ILE 319.A N GLN 315.A O no hydrogen 3.364 N/A ILE 320.A N VAL 316.A O no hydrogen 3.095 N/A PHE 321.A N LYS 317.A O no hydrogen 2.901 N/A ALA 322.A N ASP 318.A O no hydrogen 3.022 N/A ILE 323.A N ILE 319.A O no hydrogen 2.963 N/A LYS 324.A N ILE 320.A O no hydrogen 3.120 N/A LYS 324.A N PHE 321.A O no hydrogen 3.047 N/A LYS 324.A NZ GLU 229.A OE1 no hydrogen 3.329 N/A LYS 325.A N PHE 321.A O no hydrogen 3.068 N/A THR 326.A N ALA 322.A O no hydrogen 2.836 N/A THR 326.A OG1 ALA 322.A O no hydrogen 3.406 N/A LEU 327.A N ILE 323.A O no hydrogen 3.048 N/A ASN 328.A N LYS 325.A O no hydrogen 3.172 N/A