Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wlf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N LEU 23.A O no hydrogen 2.674 N/A GLN 6.A NE2 PRO 24.A O no hydrogen 3.005 N/A GLN 6.A NE2 TYR 127.A O no hydrogen 3.093 N/A TYR 7.A N GLN 126.A OE1 no hydrogen 3.429 N/A TYR 7.A OH PRO 335.A O no hydrogen 2.442 N/A GLY 8.A N ARG 20.A O no hydrogen 2.873 N/A PHE 9.A N TYR 124.A O no hydrogen 2.832 N/A VAL 10.A N LYS 18.A O no hydrogen 3.164 N/A PHE 11.A N TYR 60.A O no hydrogen 2.850 N/A ASN 12.A N GLY 16.A O no hydrogen 2.797 N/A LYS 13.A N ASP 58.A OD2 no hydrogen 3.277 N/A LYS 13.A NZ GLY 57.A O no hydrogen 3.531 N/A GLN 14.A N ASN 12.A OD1 no hydrogen 2.871 N/A GLY 16.A N ASN 12.A O no hydrogen 2.739 N/A LYS 18.A N VAL 10.A O no hydrogen 3.313 N/A ARG 20.A N GLY 8.A O no hydrogen 2.752 N/A ARG 20.A NE ASP 22.A OD1 no hydrogen 3.373 N/A ARG 20.A NH2 ASP 22.A OD2 no hydrogen 3.393 N/A LEU 23.A N GLN 6.A O no hydrogen 2.910 N/A VAL 25.A N SER 4.A O no hydrogen 3.253 N/A LYS 29.A N GLN 32.A OE1 no hydrogen 2.967 N/A GLN 32.A N LYS 29.A O no hydrogen 2.883 N/A LEU 33.A N VAL 130.A O no hydrogen 3.112 N/A LEU 34.A N ALA 72.A O no hydrogen 2.718 N/A LEU 35.A N LEU 128.A O no hydrogen 2.640 N/A LYS 36.A N THR 69.A O no hydrogen 2.862 N/A VAL 37.A N GLN 126.A O no hydrogen 3.006 N/A ASP 38.A N ALA 67.A O no hydrogen 2.914 N/A ALA 39.A N ALA 67.A O no hydrogen 3.020 N/A VAL 40.A N PHE 333.A O no hydrogen 2.944 N/A GLY 41.A N GLU 65.A O no hydrogen 2.976 N/A CYS 43.A N ASP 46.A OD2 no hydrogen 3.504 N/A CYS 43.A SG HIS 64.A NE2 no hydrogen 3.318 N/A CYS 43.A SG GLU 65.A OE2 no hydrogen 3.622 N/A CYS 43.A SG ASP 153.A OD2 no hydrogen 3.708 N/A ASP 46.A N CYS 43.A O no hydrogen 2.962 N/A HIS 48.A N HIS 44.A O no hydrogen 3.216 N/A ILE 50.A N ASP 46.A O no hydrogen 3.086 N/A TYR 51.A N LEU 47.A O no hydrogen 2.778 N/A GLU 52.A N LEU 47.A O no hydrogen 3.417 N/A LEU 54.A N HIS 48.A O no hydrogen 3.056 N/A GLY 57.A N ASP 55.A OD1 no hydrogen 2.913 N/A TYR 60.A N PHE 11.A O no hydrogen 3.250 N/A VAL 61.A N ASP 121.A OD1 no hydrogen 3.100 N/A MET 62.A N PHE 9.A O no hydrogen 3.179 N/A GLY 68.A N VAL 86.A O no hydrogen 3.039 N/A THR 69.A N LYS 36.A O no hydrogen 2.972 N/A THR 69.A OG1 ASP 38.A OD2 no hydrogen 2.974 N/A VAL 70.A N ASP 84.A O no hydrogen 2.846 N/A ALA 71.A N LEU 34.A O no hydrogen 2.827 N/A ALA 72.A N LEU 34.A O no hydrogen 3.281 N/A GLY 74.A N GLN 32.A O no hydrogen 3.030 N/A VAL 77.A N GLY 74.A O no hydrogen 3.238 N/A LYS 81.A N ASP 84.A OD2 no hydrogen 2.621 N/A LYS 81.A NZ VAL 82.A O no hydrogen 3.257 N/A GLY 83.A N VAL 70.A O no hydrogen 2.980 N/A ASP 84.A N LYS 81.A O no hydrogen 2.982 N/A ARG 85.A NH1 VAL 143.A O no hydrogen 2.860 N/A ARG 85.A NH2 PRO 140.A O no hydrogen 3.230 N/A ARG 85.A NH2 VAL 143.A O no hydrogen 3.173 N/A VAL 86.A N GLY 68.A O no hydrogen 2.965 N/A ALA 87.A N SER 137.A O no hydrogen 2.780 N/A CYS 88.A N ILE 66.A O no hydrogen 3.400 N/A VAL 89.A N ASN 135.A O no hydrogen 2.990 N/A ASN 92.A N VAL 89.A O no hydrogen 2.868 N/A ASN 92.A ND2 ASP 114.A O no hydrogen 3.087 N/A GLY 102.A N TYR 99.A O no hydrogen 3.053 N/A ILE 104.A N TYR 99.A O no hydrogen 3.144 N/A ASN 106.A ND2 PHE 284.A O no hydrogen 2.977 N/A VAL 107.A N ILE 104.A O no hydrogen 3.361 N/A PHE 112.A N LYS 109.A O no hydrogen 3.268 N/A ASP 114.A N ALA 111.A O no hydrogen 2.764 N/A PHE 116.A N GLY 90.A O no hydrogen 3.062 N/A GLY 117.A N ASP 121.A O no hydrogen 3.298 N/A LEU 118.A N TRP 115.A O no hydrogen 3.088 N/A TYR 120.A N TRP 115.A O no hydrogen 2.856 N/A TYR 120.A OH LEU 129.A O no hydrogen 2.571 N/A GLY 123.A N GLY 63.A O no hydrogen 3.009 N/A TYR 124.A N MET 62.A O no hydrogen 2.887 N/A TYR 124.A OH GLY 41.A O no hydrogen 3.127 N/A GLN 125.A N GLY 123.A O no hydrogen 2.537 N/A GLN 125.A NE2 GLY 122.A O no hydrogen 2.789 N/A TYR 127.A N GLN 6.A OE1 no hydrogen 2.549 N/A LEU 128.A N LEU 35.A O no hydrogen 2.685 N/A VAL 130.A N LEU 33.A O no hydrogen 2.673 N/A ARG 132.A NE GLY 93.A O no hydrogen 2.930 N/A ARG 132.A NH1 ASN 92.A O no hydrogen 2.742 N/A ARG 132.A NH1 ASP 114.A OD2 no hydrogen 2.820 N/A ARG 134.A NH1 ASP 105.A OD2 no hydrogen 2.929 N/A ARG 134.A NH2 ASP 105.A OD2 no hydrogen 3.100 N/A ARG 134.A NH2 ASN 135.A OD1 no hydrogen 2.691 N/A ASN 135.A N ARG 132.A O no hydrogen 2.951 N/A ASN 135.A ND2 ASN 92.A OD1 no hydrogen 2.822 N/A ASN 135.A ND2 GLY 93.A O no hydrogen 3.028 N/A SER 137.A N ALA 87.A O no hydrogen 2.865 N/A SER 137.A OG ASP 292.A OD1 no hydrogen 3.303 N/A ILE 139.A N ARG 85.A O no hydrogen 2.988 N/A ASN 142.A ND2 SER 299.A O no hydrogen 2.831 N/A VAL 143.A N PRO 140.A O no hydrogen 3.031 N/A VAL 147.A N SER 144.A OG no hydrogen 3.336 N/A ALA 148.A N SER 144.A O no hydrogen 2.994 N/A ALA 149.A N ALA 145.A O no hydrogen 3.019 N/A ALA 150.A N ASP 146.A O no hydrogen 3.120 N/A SER 151.A N ALA 148.A O no hydrogen 2.822 N/A SER 151.A OG VAL 147.A O no hydrogen 3.040 N/A THR 152.A N ALA 148.A O no hydrogen 3.184 N/A THR 152.A N ALA 149.A O no hydrogen 3.195 N/A THR 152.A OG1 ALA 149.A O no hydrogen 2.637 N/A LEU 156.A N SER 151.A O no hydrogen 2.968 N/A THR 157.A N ASP 153.A O no hydrogen 3.139 N/A THR 157.A OG1 ASP 153.A O no hydrogen 3.187 N/A THR 157.A OG1 ASP 153.A OD1 no hydrogen 2.851 N/A TYR 159.A N VAL 155.A O no hydrogen 2.923 N/A TYR 159.A OH ASP 293.A OD2 no hydrogen 3.155 N/A HIS 160.A N LEU 156.A O no hydrogen 2.946 N/A ALA 161.A N THR 157.A O no hydrogen 3.200 N/A ILE 162.A N PRO 158.A O no hydrogen 2.891 N/A LYS 163.A N TYR 159.A O no hydrogen 2.878 N/A MET 164.A N HIS 160.A O no hydrogen 2.882 N/A ALA 165.A N ALA 161.A O no hydrogen 3.079 N/A GLN 166.A N LYS 163.A O no hydrogen 2.804 N/A SER 168.A N SER 171.A OG no hydrogen 2.690 N/A SER 171.A N SER 168.A O no hydrogen 2.850 N/A SER 171.A OG SER 168.A O no hydrogen 3.310 N/A ASN 172.A N SER 231.A OG no hydrogen 2.977 N/A ILE 173.A N LYS 195.A O no hydrogen 3.256 N/A LEU 174.A N ALA 232.A O no hydrogen 2.863 N/A LEU 175.A N THR 197.A O no hydrogen 2.778 N/A ILE 176.A N PHE 234.A O no hydrogen 2.909 N/A GLY 177.A N LEU 199.A O no hydrogen 2.615 N/A ALA 178.A N ASP 200.A OD2 no hydrogen 2.731 N/A GLY 182.A N GLY 179.A O no hydrogen 3.338 N/A ASN 184.A ND2 ALA 154.A O no hydrogen 3.137 N/A ALA 185.A N LEU 181.A O no hydrogen 3.002 N/A ILE 186.A N GLY 182.A O no hydrogen 3.158 N/A ILE 186.A N GLY 183.A O no hydrogen 2.949 N/A GLN 187.A N GLY 183.A O no hydrogen 3.415 N/A GLN 187.A NE2 LYS 304.A O no hydrogen 3.641 N/A VAL 188.A N ASN 184.A O no hydrogen 2.977 N/A ALA 189.A N ALA 185.A O no hydrogen 2.847 N/A LYS 190.A N ILE 186.A O no hydrogen 2.944 N/A LYS 190.A NZ GLY 213.A O no hydrogen 3.243 N/A ALA 191.A N GLN 187.A O no hydrogen 2.896 N/A PHE 192.A N VAL 188.A O no hydrogen 3.288 N/A PHE 192.A N ALA 189.A O no hydrogen 3.008 N/A GLY 193.A N LYS 190.A O no hydrogen 2.758 N/A ALA 194.A N ALA 189.A O no hydrogen 3.464 N/A LYS 195.A N SER 171.A O no hydrogen 3.091 N/A VAL 196.A N ASP 215.A OD2 no hydrogen 2.869 N/A THR 197.A N ILE 173.A O no hydrogen 3.060 N/A VAL 198.A N ALA 216.A O no hydrogen 2.822 N/A LEU 199.A N LEU 175.A O no hydrogen 2.854 N/A ASP 200.A N TYR 218.A O no hydrogen 3.117 N/A LYS 201.A NZ GLU 219.A O no hydrogen 2.858 N/A LYS 201.A NZ GLU 219.A OE2 no hydrogen 3.425 N/A ARG 206.A NH1 LYS 201.A O no hydrogen 2.903 N/A ASP 207.A N LYS 203.A O no hydrogen 3.393 N/A GLN 208.A N GLU 204.A O no hydrogen 2.768 N/A GLN 208.A NE2 GLU 328.A OE2 no hydrogen 3.429 N/A ALA 209.A N ALA 205.A O no hydrogen 2.688 N/A LYS 210.A N ARG 206.A O no hydrogen 2.803 N/A LYS 211.A N ASP 207.A O no hydrogen 3.081 N/A LEU 212.A N GLN 208.A O no hydrogen 2.838 N/A GLY 213.A N ALA 209.A O no hydrogen 3.237 N/A ALA 214.A N ALA 209.A O no hydrogen 3.006 N/A ALA 216.A N VAL 196.A O no hydrogen 2.998 N/A TYR 218.A N VAL 198.A O no hydrogen 3.067 N/A THR 220.A OG1 GLU 219.A O no hydrogen 2.646 N/A THR 220.A OG1 GLU 219.A OE1 no hydrogen 2.844 N/A THR 220.A OG1 GLU 219.A OE2 no hydrogen 3.326 N/A GLY 228.A N LYS 248.A O no hydrogen 2.846 N/A SER 229.A N TYR 249.A O no hydrogen 2.884 N/A SER 229.A OG SER 226.A O no hydrogen 2.572 N/A PHE 230.A N TYR 249.A O no hydrogen 2.903 N/A SER 231.A N ASN 172.A O no hydrogen 2.773 N/A SER 231.A OG ASN 172.A O no hydrogen 3.162 N/A CYS 233.A N VAL 255.A O no hydrogen 2.927 N/A CYS 233.A SG CYS 246.A O no hydrogen 3.784 N/A PHE 234.A N LEU 174.A O no hydrogen 2.916 N/A ASP 235.A N MET 257.A O no hydrogen 2.961 N/A PHE 236.A N ILE 176.A O no hydrogen 3.149 N/A VAL 237.A N ASP 235.A OD1 no hydrogen 2.961 N/A SER 238.A N ASP 235.A OD1 no hydrogen 2.486 N/A SER 238.A OG ASP 235.A O no hydrogen 2.858 N/A VAL 239.A N THR 242.A OG1 no hydrogen 2.634 N/A GLN 240.A NE2 SER 267.A O no hydrogen 3.529 N/A THR 242.A OG1 ASP 235.A OD1 no hydrogen 3.375 N/A THR 242.A OG1 ASP 235.A OD2 no hydrogen 2.763 N/A THR 242.A OG1 VAL 239.A O no hydrogen 2.528 N/A PHE 243.A N VAL 239.A O no hydrogen 2.651 N/A ASP 244.A N GLN 240.A O no hydrogen 2.786 N/A VAL 245.A N ALA 241.A O no hydrogen 3.349 N/A CYS 246.A N THR 242.A O no hydrogen 3.253 N/A CYS 246.A SG THR 242.A O no hydrogen 3.601 N/A GLN 247.A N PHE 243.A O no hydrogen 3.077 N/A GLN 247.A NE2 ASN 269.A O no hydrogen 3.089 N/A GLN 247.A NE2 ASP 272.A OD2 no hydrogen 3.292 N/A LYS 248.A N ASP 244.A O no hydrogen 2.982 N/A LYS 248.A N VAL 245.A O no hydrogen 3.107 N/A TYR 249.A N VAL 245.A O no hydrogen 2.884 N/A VAL 250.A N CYS 246.A O no hydrogen 2.761 N/A GLU 251.A N PHE 230.A O no hydrogen 2.699 N/A LYS 253.A N ARG 276.A O no hydrogen 2.740 N/A LYS 253.A NZ GLU 277.A OE1 no hydrogen 3.213 N/A GLY 254.A N GLU 251.A O no hydrogen 2.737 N/A VAL 255.A N SER 231.A O no hydrogen 3.279 N/A ILE 256.A N ARG 279.A O no hydrogen 2.884 N/A MET 257.A N CYS 233.A O no hydrogen 2.642 N/A VAL 259.A N ASP 235.A O no hydrogen 2.997 N/A ALA 263.A N SER 238.A O no hydrogen 3.222 N/A SER 267.A N GLN 240.A OE1 no hydrogen 2.615 N/A SER 267.A OG GLN 240.A OE1 no hydrogen 3.130 N/A ASN 269.A N GLN 247.A OE1 no hydrogen 2.932 N/A ASP 272.A N ASN 269.A OD1 no hydrogen 2.731 N/A LEU 273.A N ASN 269.A O no hydrogen 2.941 N/A ALA 274.A N LEU 270.A O no hydrogen 2.837 N/A LEU 275.A N GLY 271.A O no hydrogen 3.060 N/A ARG 276.A N ASP 272.A O no hydrogen 2.986 N/A ARG 276.A NE ASP 272.A OD1 no hydrogen 2.675 N/A ARG 276.A NE ASP 272.A OD2 no hydrogen 3.340 N/A ARG 276.A NH1 VAL 250.A O no hydrogen 3.251 N/A ARG 276.A NH1 ASP 272.A OD2 no hydrogen 2.869 N/A ARG 276.A NH2 VAL 250.A O no hydrogen 2.765 N/A GLU 277.A N ALA 274.A O no hydrogen 3.057 N/A ILE 278.A N LEU 273.A O no hydrogen 2.757 N/A ARG 279.A N GLY 254.A O no hydrogen 3.154 N/A ARG 279.A NE LYS 253.A O no hydrogen 3.072 N/A LEU 281.A N ILE 256.A O no hydrogen 3.228 N/A TRP 285.A NE1 THR 152.A O no hydrogen 3.132 N/A THR 287.A N ASP 290.A OD2 no hydrogen 2.802 N/A THR 288.A N ASP 105.A OD1 no hydrogen 3.351 N/A THR 288.A OG1 ASP 105.A OD2 no hydrogen 2.641 N/A ASP 290.A N THR 287.A OG1 no hydrogen 3.110 N/A LEU 291.A N THR 287.A O no hydrogen 3.209 N/A LEU 291.A N THR 288.A O no hydrogen 3.037 N/A ASP 292.A N THR 288.A O no hydrogen 3.424 N/A ASP 293.A N ASN 289.A O no hydrogen 3.134 N/A VAL 294.A N ASP 290.A O no hydrogen 2.862 N/A LEU 295.A N LEU 291.A O no hydrogen 2.991 N/A LYS 296.A N ASP 292.A O no hydrogen 3.252 N/A LYS 296.A N ASP 293.A O no hydrogen 3.090 N/A LEU 297.A N ASP 293.A O no hydrogen 2.972 N/A VAL 298.A N VAL 294.A O no hydrogen 2.937 N/A SER 299.A N LEU 295.A O no hydrogen 2.964 N/A SER 299.A OG ASN 142.A OD1 no hydrogen 2.573 N/A GLU 300.A N LYS 296.A O no hydrogen 2.852 N/A GLY 301.A N VAL 298.A O no hydrogen 2.735 N/A LYS 302.A N LEU 297.A O no hydrogen 2.828 N/A LYS 302.A NZ GLU 300.A OE2 no hydrogen 3.453 N/A LYS 304.A N GLN 187.A OE1 no hydrogen 2.586 N/A LYS 304.A NZ GLY 301.A O no hydrogen 2.612 N/A ARG 308.A N ARG 330.A O no hydrogen 3.246 N/A ALA 310.A N VAL 332.A O no hydrogen 3.129 N/A LYS 311.A N GLU 314.A OE2 no hydrogen 3.249 N/A LEU 312.A N ASN 334.A O no hydrogen 3.316 N/A GLU 314.A N LYS 311.A O no hydrogen 3.011 N/A LEU 315.A N LEU 312.A O no hydrogen 2.974 N/A TYR 318.A N GLU 314.A O no hydrogen 3.106 N/A TYR 318.A N LEU 315.A O no hydrogen 2.873 N/A ILE 319.A N LEU 315.A O no hydrogen 2.786 N/A GLU 320.A N PRO 316.A O no hydrogen 3.402 N/A LEU 322.A N TYR 318.A O no hydrogen 3.117 N/A ARG 323.A N ILE 319.A O no hydrogen 3.267 N/A ASN 324.A N GLU 320.A O no hydrogen 3.324 N/A ASN 324.A N LYS 321.A O no hydrogen 3.241 N/A ASN 325.A N LYS 321.A O no hydrogen 3.211 N/A ALA 326.A N LYS 321.A O no hydrogen 2.953 N/A ARG 330.A NE GLU 65.A OE2 no hydrogen 3.260 N/A ARG 330.A NH2 ASP 153.A OD2 no hydrogen 3.475 N/A VAL 332.A N ARG 308.A O no hydrogen 2.871 N/A PHE 333.A N VAL 40.A O no hydrogen 2.741 N/A ASN 334.A N ALA 310.A O no hydrogen 2.849 N/A