Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nw6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 6.A N GLU 6.A OE2 no hydrogen 2.759 N/A TRP 7.A N ASP 5.A OD1 no hydrogen 3.180 N/A GLU 8.A N ASP 5.A O no hydrogen 3.127 N/A VAL 9.A N VAL 83.A O no hydrogen 2.826 N/A ARG 11.A NH1 PRO 89.A O no hydrogen 2.662 N/A ARG 11.A NH2 GLN 86.A O no hydrogen 2.582 N/A ARG 11.A NH2 PRO 89.A O no hydrogen 3.564 N/A LYS 13.A N ALA 10.A O no hydrogen 3.085 N/A ILE 14.A N ARG 11.A O no hydrogen 3.073 N/A THR 15.A N VAL 32.A O no hydrogen 2.956 N/A SER 17.A N GLU 30.A O no hydrogen 2.865 N/A LEU 20.A N VAL 28.A O no hydrogen 2.837 N/A GLY 21.A N VAL 28.A O no hydrogen 3.403 N/A GLN 22.A NE2 GLY 23.A O no hydrogen 3.214 N/A GLY 23.A N GLY 26.A O no hydrogen 2.617 N/A VAL 28.A N GLY 21.A O no hydrogen 2.884 N/A TYR 29.A N ILE 47.A O no hydrogen 2.794 N/A GLU 30.A N ARG 18.A O no hydrogen 2.717 N/A GLY 31.A N VAL 45.A O no hydrogen 2.933 N/A VAL 32.A N THR 15.A O no hydrogen 2.935 N/A ALA 33.A N THR 43.A O no hydrogen 3.021 N/A LYS 34.A N LYS 13.A O no hydrogen 3.025 N/A LYS 34.A NZ PRO 41.A O no hydrogen 3.338 N/A GLY 35.A N GLU 40.A O no hydrogen 2.908 N/A GLU 40.A N VAL 37.A O no hydrogen 2.904 N/A THR 43.A N ALA 33.A O no hydrogen 2.980 N/A THR 43.A OG1 GLU 40.A OE1 no hydrogen 3.161 N/A ARG 44.A NH2 GLU 30.A OE2 no hydrogen 2.453 N/A VAL 45.A N GLY 31.A O no hydrogen 3.015 N/A ALA 46.A N MET 94.A O no hydrogen 2.802 N/A ILE 47.A N TYR 29.A O no hydrogen 2.621 N/A LYS 48.A N VAL 92.A O no hydrogen 2.927 N/A LYS 48.A NZ ASP 168.A OD2 no hydrogen 2.919 N/A THR 49.A N MET 27.A O no hydrogen 3.224 N/A THR 49.A OG1 MET 27.A O no hydrogen 2.586 N/A ASN 51.A N PHE 25.A O no hydrogen 2.835 N/A ASN 51.A ND2 PHE 25.A O no hydrogen 2.924 N/A ALA 54.A N ASN 51.A O no hydrogen 3.238 N/A SER 55.A N GLU 58.A OE1 no hydrogen 3.257 N/A SER 55.A OG GLU 58.A OE1 no hydrogen 3.365 N/A ARG 59.A N SER 55.A O no hydrogen 3.134 N/A ARG 59.A NH1 GLU 52.A O no hydrogen 3.235 N/A ILE 60.A N MET 56.A O no hydrogen 3.063 N/A GLU 61.A N ARG 57.A O no hydrogen 2.979 N/A PHE 62.A N GLU 58.A O no hydrogen 3.082 N/A LEU 63.A N ARG 59.A O no hydrogen 3.029 N/A ASN 64.A N ILE 60.A O no hydrogen 2.973 N/A GLU 65.A N GLU 61.A O no hydrogen 2.933 N/A ALA 66.A N PHE 62.A O no hydrogen 3.040 N/A SER 67.A N LEU 63.A O no hydrogen 3.096 N/A SER 67.A OG LEU 63.A O no hydrogen 2.541 N/A VAL 68.A N GLU 65.A O no hydrogen 3.277 N/A MET 69.A N ALA 66.A O no hydrogen 2.996 N/A LYS 70.A N SER 67.A O no hydrogen 3.133 N/A LYS 70.A NZ ASP 5.A OD1 no hydrogen 3.153 N/A LYS 70.A NZ ASP 5.A OD2 no hydrogen 2.613 N/A PHE 72.A N MET 69.A O no hydrogen 3.337 N/A ASN 73.A N TYR 140.A OH no hydrogen 2.797 N/A HIS 76.A ND1 ASP 136.A OD2 no hydrogen 2.717 N/A VAL 77.A N CYS 74.A O no hydrogen 3.291 N/A VAL 78.A N ILE 166.A O no hydrogen 2.753 N/A ARG 79.A N GLU 95.A OE1 no hydrogen 2.994 N/A LEU 81.A N ILE 93.A O no hydrogen 2.847 N/A GLY 82.A N ILE 93.A O no hydrogen 3.117 N/A VAL 83.A N TRP 7.A O no hydrogen 2.980 N/A VAL 84.A N LEU 91.A O no hydrogen 2.733 N/A SER 85.A N GLU 8.A OE2 no hydrogen 2.748 N/A SER 85.A OG GLU 8.A OE1 no hydrogen 2.731 N/A SER 85.A OG GLU 8.A OE2 no hydrogen 3.288 N/A GLN 86.A NE2 SER 85.A OG no hydrogen 3.226 N/A LEU 91.A N VAL 84.A O no hydrogen 2.940 N/A VAL 92.A N LYS 48.A O no hydrogen 3.140 N/A ILE 93.A N GLY 82.A O no hydrogen 2.781 N/A MET 94.A N ALA 46.A O no hydrogen 2.940 N/A GLU 95.A N ARG 79.A O no hydrogen 2.699 N/A THR 98.A OG1 GLU 160.A OE2 no hydrogen 2.940 N/A ARG 99.A N VAL 158.A O no hydrogen 3.018 N/A ARG 99.A NE GLU 160.A O no hydrogen 2.975 N/A GLY 100.A N MET 97.A O no hydrogen 3.406 N/A LEU 102.A N CYS 156.A O no hydrogen 2.747 N/A LYS 103.A NZ ASP 179.A OD1 no hydrogen 3.260 N/A LYS 103.A NZ ASP 179.A OD2 no hydrogen 2.947 N/A LYS 103.A NZ GLN 226.A OE1 no hydrogen 2.723 N/A SER 104.A N ASP 101.A OD1 no hydrogen 2.863 N/A SER 104.A OG ASP 101.A OD1 no hydrogen 3.230 N/A SER 104.A OG ASP 101.A OD2 no hydrogen 2.605 N/A SER 104.A OG TYR 176.A OH no hydrogen 2.685 N/A TYR 105.A N ASP 101.A O no hydrogen 2.962 N/A LEU 106.A N LEU 102.A O no hydrogen 2.912 N/A ARG 107.A N LYS 103.A O no hydrogen 3.008 N/A ARG 107.A NE ALA 224.A O no hydrogen 2.728 N/A ARG 107.A NH2 ALA 224.A O no hydrogen 2.922 N/A ARG 107.A NH2 GLN 226.A OE1 no hydrogen 2.781 N/A SER 108.A N SER 104.A O no hydrogen 2.893 N/A SER 108.A OG TYR 105.A O no hydrogen 2.649 N/A LEU 109.A N LEU 106.A O no hydrogen 3.098 N/A ARG 110.A N ARG 107.A O no hydrogen 3.124 N/A ASN 116.A ND2 GLU 114.A O no hydrogen 3.046 N/A LYS 126.A N SER 123.A OG no hydrogen 3.172 N/A MET 127.A N SER 123.A O no hydrogen 2.966 N/A ILE 128.A N LEU 124.A O no hydrogen 2.908 N/A GLN 129.A N SER 125.A O no hydrogen 3.102 N/A GLN 129.A NE2 GLU 133.A OE2 no hydrogen 2.990 N/A MET 130.A N LYS 126.A O no hydrogen 3.207 N/A ALA 131.A N MET 127.A O no hydrogen 2.829 N/A GLY 132.A N ILE 128.A O no hydrogen 2.811 N/A GLU 133.A N GLN 129.A O no hydrogen 3.213 N/A ILE 134.A N MET 130.A O no hydrogen 2.992 N/A ALA 135.A N ALA 131.A O no hydrogen 2.869 N/A ASP 136.A N GLY 132.A O no hydrogen 2.932 N/A GLY 137.A N GLU 133.A O no hydrogen 3.084 N/A MET 138.A N ILE 134.A O no hydrogen 3.004 N/A ALA 139.A N ALA 135.A O no hydrogen 2.820 N/A TYR 140.A N ASP 136.A O no hydrogen 3.028 N/A LEU 141.A N GLY 137.A O no hydrogen 3.076 N/A ASN 142.A N MET 138.A O no hydrogen 3.060 N/A ALA 143.A N ALA 139.A O no hydrogen 3.041 N/A ASN 144.A N TYR 140.A O no hydrogen 3.144 N/A ASN 144.A N LEU 141.A O no hydrogen 3.028 N/A ASN 144.A ND2 TYR 140.A O no hydrogen 2.891 N/A ASN 144.A ND2 GLU 299.A OE1 no hydrogen 3.135 N/A LYS 145.A N ASN 142.A O no hydrogen 2.942 N/A LYS 145.A NZ ASN 144.A O no hydrogen 3.457 N/A PHE 146.A N LEU 141.A O no hydrogen 3.059 N/A HIS 148.A N ASP 209.A OD2 no hydrogen 2.867 N/A ARG 149.A N ASP 209.A OD1 no hydrogen 3.053 N/A ASP 150.A N HIS 148.A ND1 no hydrogen 3.126 N/A ALA 153.A N GLU 219.A OE1 no hydrogen 3.115 N/A ARG 154.A NE TYR 180.A OH no hydrogen 2.774 N/A ARG 154.A NH2 ASP 150.A OD1 no hydrogen 2.889 N/A ASN 155.A N ALA 152.A O no hydrogen 2.808 N/A ASN 155.A ND2 ASP 150.A O no hydrogen 2.848 N/A ASN 155.A ND2 ASP 150.A OD2 no hydrogen 3.004 N/A CYS 156.A N ALA 153.A O no hydrogen 3.101 N/A CYS 156.A SG ALA 152.A O no hydrogen 3.740 N/A MET 157.A N LYS 165.A O no hydrogen 2.799 N/A VAL 158.A N GLY 100.A O no hydrogen 2.752 N/A ALA 159.A N THR 163.A O no hydrogen 2.820 N/A PHE 162.A N ALA 159.A O no hydrogen 2.923 N/A THR 163.A N ASP 161.A OD1 no hydrogen 3.039 N/A THR 163.A OG1 ASP 161.A OD1 no hydrogen 2.658 N/A THR 163.A OG1 ASP 161.A OD2 no hydrogen 3.335 N/A VAL 164.A N GLU 133.A OE1 no hydrogen 2.986 N/A LYS 165.A N MET 157.A O no hydrogen 2.969 N/A LYS 165.A NZ HIS 75.A O no hydrogen 2.990 N/A LYS 165.A NZ GLU 95.A OE2 no hydrogen 2.750 N/A ILE 166.A N HIS 76.A O no hydrogen 2.718 N/A GLY 167.A N ASN 155.A O no hydrogen 2.931 N/A THR 172.A OG1 GLY 170.A O no hydrogen 3.526 N/A TYR 176.A OH SER 104.A OG no hydrogen 2.685 N/A GLU 177.A N ASP 174.A O no hydrogen 3.248 N/A ASP 179.A N TYR 176.A O no hydrogen 2.880 N/A TYR 180.A N GLU 177.A O no hydrogen 3.226 N/A TYR 180.A OH ASP 150.A OD1 no hydrogen 3.276 N/A TYR 180.A OH ASP 150.A OD2 no hydrogen 2.531 N/A TYR 181.A N LEU 189.A O no hydrogen 2.783 N/A TYR 181.A OH GLU 234.A OE2 no hydrogen 2.461 N/A ARG 182.A NH2 GLY 184.A O no hydrogen 3.469 N/A LYS 183.A NZ LYS 183.A O no hydrogen 3.498 N/A LYS 183.A NZ GLU 234.A OE2 no hydrogen 2.949 N/A LEU 189.A N TYR 181.A O no hydrogen 2.914 N/A VAL 191.A N LEU 189.A O no hydrogen 2.904 N/A ARG 192.A NE ASN 233.A OD1 no hydrogen 3.081 N/A ARG 192.A NH1 PRO 227.A O no hydrogen 2.946 N/A ARG 192.A NH1 TYR 228.A O no hydrogen 2.841 N/A ARG 192.A NH1 LEU 231.A O no hydrogen 3.326 N/A ARG 192.A NH2 LEU 231.A O no hydrogen 3.006 N/A ARG 192.A NH2 ASN 233.A OD1 no hydrogen 2.859 N/A TRP 193.A N PRO 190.A O no hydrogen 3.002 N/A TRP 193.A NE1 GLU 219.A OE1 no hydrogen 2.891 N/A MET 194.A N VAL 191.A O no hydrogen 3.275 N/A SER 195.A OG SER 198.A OG no hydrogen 3.083 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 3.036 N/A SER 198.A N SER 195.A OG no hydrogen 3.209 N/A SER 198.A OG SER 195.A OG no hydrogen 3.083 N/A SER 198.A OG VAL 203.A O no hydrogen 2.629 N/A LEU 199.A N SER 195.A O no hydrogen 3.210 N/A LYS 200.A N PRO 196.A O no hydrogen 3.185 N/A LYS 200.A N GLU 197.A O no hydrogen 3.189 N/A LYS 200.A NZ TYR 266.A OH no hydrogen 3.007 N/A ASP 201.A N GLU 197.A O no hydrogen 2.898 N/A GLY 202.A N SER 198.A O no hydrogen 2.841 N/A VAL 203.A N ASP 201.A OD1 no hydrogen 3.061 N/A THR 205.A N SER 208.A OG no hydrogen 2.831 N/A TYR 207.A N THR 205.A OG1 no hydrogen 3.231 N/A SER 208.A N THR 205.A O no hydrogen 3.119 N/A SER 208.A OG THR 205.A O no hydrogen 2.798 N/A ASP 209.A N THR 205.A O no hydrogen 3.126 N/A VAL 210.A N THR 206.A O no hydrogen 2.988 N/A TRP 211.A N TYR 207.A O no hydrogen 3.237 N/A SER 212.A N SER 208.A O no hydrogen 3.143 N/A SER 212.A OG TRP 193.A O no hydrogen 2.524 N/A SER 212.A OG SER 208.A O no hydrogen 3.051 N/A PHE 213.A N ASP 209.A O no hydrogen 2.788 N/A GLY 214.A N VAL 210.A O no hydrogen 3.096 N/A VAL 215.A N TRP 211.A O no hydrogen 3.241 N/A VAL 216.A N SER 212.A O no hydrogen 2.956 N/A LEU 217.A N PHE 213.A O no hydrogen 3.045 N/A TRP 218.A N GLY 214.A O no hydrogen 3.171 N/A TRP 218.A NE1 ASP 247.A O no hydrogen 2.889 N/A GLU 219.A N VAL 215.A O no hydrogen 2.899 N/A ILE 220.A N VAL 216.A O no hydrogen 2.895 N/A ALA 221.A N LEU 217.A O no hydrogen 3.011 N/A THR 222.A N TRP 218.A O no hydrogen 2.847 N/A THR 222.A OG1 TRP 218.A O no hydrogen 2.641 N/A THR 222.A OG1 GLU 219.A O no hydrogen 3.369 N/A ALA 224.A N GLU 219.A O no hydrogen 2.655 N/A GLU 225.A N THR 222.A OG1 no hydrogen 3.419 N/A GLN 226.A NE2 ASP 179.A OD1 no hydrogen 2.954 N/A LEU 231.A N TYR 228.A O no hydrogen 2.995 N/A SER 232.A N GLN 235.A OE1 no hydrogen 2.891 N/A SER 232.A OG GLN 235.A OE1 no hydrogen 3.359 N/A GLN 235.A N SER 232.A OG no hydrogen 3.294 N/A VAL 236.A N SER 232.A O no hydrogen 3.071 N/A LEU 237.A N ASN 233.A O no hydrogen 3.496 N/A ARG 238.A N GLU 234.A O no hydrogen 3.496 N/A PHE 239.A N GLN 235.A O no hydrogen 2.819 N/A VAL 240.A N VAL 236.A O no hydrogen 2.764 N/A MET 241.A N LEU 237.A O no hydrogen 3.087 N/A GLU 242.A N ARG 238.A O no hydrogen 2.954 N/A GLY 243.A N VAL 240.A O no hydrogen 3.055 N/A GLY 244.A N PHE 239.A O no hydrogen 2.762 N/A LYS 248.A NZ ASP 254.A OD1 no hydrogen 3.494 N/A CYS 252.A N PRO 249.A O no hydrogen 3.182 N/A CYS 252.A SG PRO 253.A O no hydrogen 3.686 N/A LEU 256.A N PRO 253.A O no hydrogen 2.968 N/A PHE 257.A N PRO 253.A O no hydrogen 3.171 N/A GLU 258.A N ASP 254.A O no hydrogen 2.655 N/A LEU 259.A N MET 255.A O no hydrogen 3.457 N/A MET 260.A N LEU 256.A O no hydrogen 3.082 N/A ARG 261.A N PHE 257.A O no hydrogen 2.850 N/A MET 262.A N GLU 258.A O no hydrogen 2.964 N/A CYS 263.A N LEU 259.A O no hydrogen 3.084 N/A CYS 263.A SG LEU 259.A O no hydrogen 3.302 N/A TRP 264.A N MET 260.A O no hydrogen 2.990 N/A TRP 264.A N ARG 261.A O no hydrogen 3.240 N/A TYR 266.A OH MET 241.A O no hydrogen 2.589 N/A LYS 269.A N ASN 267.A OD1 no hydrogen 3.063 N/A MET 270.A N ASN 267.A O no hydrogen 3.111 N/A ARG 271.A N PRO 268.A O no hydrogen 3.223 N/A ARG 271.A NE GLN 265.A O no hydrogen 2.690 N/A ARG 271.A NH1 GLU 197.A OE1 no hydrogen 3.530 N/A ARG 271.A NH1 GLU 197.A OE2 no hydrogen 3.114 N/A ARG 271.A NH1 TYR 207.A O no hydrogen 2.951 N/A ARG 271.A NH2 GLU 197.A OE1 no hydrogen 2.800 N/A ARG 271.A NH2 GLN 265.A O no hydrogen 3.261 N/A ARG 271.A NH2 TYR 266.A O no hydrogen 3.303 N/A SER 273.A N GLU 276.A OE1 no hydrogen 3.452 N/A GLU 276.A N SER 273.A OG no hydrogen 2.849 N/A ILE 277.A N SER 273.A O no hydrogen 3.010 N/A ILE 278.A N PHE 274.A O no hydrogen 3.030 N/A SER 279.A N LEU 275.A O no hydrogen 3.058 N/A SER 280.A N GLU 276.A O no hydrogen 3.329 N/A SER 280.A OG ILE 277.A O no hydrogen 2.753 N/A ILE 281.A N ILE 278.A O no hydrogen 2.969 N/A LYS 282.A NZ SER 279.A O no hydrogen 2.699 N/A LYS 282.A NZ SER 279.A OG no hydrogen 3.371 N/A LYS 282.A NZ GLU 283.A OE2 no hydrogen 3.084 N/A GLU 284.A N ILE 281.A O no hydrogen 2.929 N/A MET 285.A N LYS 282.A O no hydrogen 3.433 N/A GLU 286.A N GLN 129.A OE1 no hydrogen 2.822 N/A PHE 289.A N GLU 286.A O no hydrogen 2.870 N/A ARG 290.A N PRO 287.A O no hydrogen 3.295 N/A GLU 291.A N GLY 288.A O no hydrogen 2.976 N/A VAL 292.A N GLY 288.A O no hydrogen 3.270 N/A SER 293.A N PHE 289.A O no hydrogen 3.053 N/A SER 293.A OG PHE 289.A O no hydrogen 2.659 N/A PHE 294.A N ASP 136.A OD2 no hydrogen 2.834 N/A TYR 295.A N ASP 136.A OD1 no hydrogen 2.731 N/A TYR 296.A N SER 293.A OG no hydrogen 3.265 N/A SER 297.A N PHE 294.A O no hydrogen 2.950 N/A SER 297.A OG PHE 294.A O no hydrogen 2.610 N/A ASN 300.A N SER 297.A O no hydrogen 2.897 N/A ASN 300.A ND2 TYR 295.A O no hydrogen 2.578 N/A