Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1w68_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N VAL 1.A O no hydrogen 3.220 N/A ARG 8.A N GLU 4.A O no hydrogen 2.754 N/A ASN 10.A ND2 GLN 88.A O no hydrogen 3.201 N/A ARG 12.A N ASN 10.A OD1 no hydrogen 3.130 N/A ARG 13.A N ASN 10.A O no hydrogen 3.279 N/A VAL 15.A N ARG 12.A O no hydrogen 2.948 N/A GLU 20.A N GLU 91.A OE2 no hydrogen 2.542 N/A TYR 21.A N GLU 91.A OE2 no hydrogen 2.885 N/A TYR 21.A OH GLU 20.A OE2 no hydrogen 2.851 N/A ILE 24.A N ASP 23.A OD1 no hydrogen 2.756 N/A TRP 25.A N TYR 21.A O no hydrogen 2.938 N/A GLN 26.A N HIS 22.A O no hydrogen 2.876 N/A MET 27.A N ASP 23.A O no hydrogen 3.332 N/A TYR 28.A N ILE 24.A O no hydrogen 3.186 N/A LYS 29.A N TRP 25.A O no hydrogen 3.012 N/A LYS 29.A NZ GLU 32.A OE1 no hydrogen 2.966 N/A LYS 30.A N GLN 26.A O no hydrogen 3.039 N/A ALA 31.A N MET 27.A O no hydrogen 3.201 N/A GLU 32.A N TYR 28.A O no hydrogen 2.888 N/A ALA 33.A N LYS 29.A O no hydrogen 3.040 N/A SER 34.A N ALA 31.A O no hydrogen 2.902 N/A SER 34.A OG LYS 30.A O no hydrogen 2.768 N/A PHE 35.A N GLU 32.A O no hydrogen 3.152 N/A TRP 36.A NE1 ASP 199.A OD2 no hydrogen 2.799 N/A THR 37.A N GLU 40.A OE2 no hydrogen 2.806 N/A THR 37.A OG1 GLU 40.A OE2 no hydrogen 2.927 N/A GLU 39.A N GLU 39.A OE1 no hydrogen 2.664 N/A GLU 40.A N THR 37.A O no hydrogen 3.079 N/A VAL 41.A N ALA 38.A O no hydrogen 2.784 N/A SER 44.A N ASP 42.A OD1 no hydrogen 3.420 N/A SER 44.A OG ASP 42.A OD1 no hydrogen 3.156 N/A SER 44.A OG ASP 42.A OD2 no hydrogen 3.018 N/A TRP 50.A N ASP 46.A O no hydrogen 2.958 N/A GLU 51.A N ILE 47.A O no hydrogen 3.011 N/A ALA 52.A N GLN 48.A O no hydrogen 2.944 N/A LEU 53.A N HIS 49.A O no hydrogen 3.149 N/A LYS 54.A N GLU 57.A OE1 no hydrogen 2.941 N/A ARG 58.A N LYS 54.A O no hydrogen 2.947 N/A ARG 58.A NE TRP 50.A O no hydrogen 2.499 N/A ARG 58.A NH2 GLU 51.A O no hydrogen 2.562 N/A HIS 59.A N PRO 55.A O no hydrogen 3.192 N/A PHE 60.A N ASP 56.A O no hydrogen 3.044 N/A ILE 61.A N GLU 57.A O no hydrogen 3.091 N/A SER 62.A N ARG 58.A O no hydrogen 2.866 N/A SER 62.A OG ARG 58.A O no hydrogen 3.053 N/A SER 62.A OG HIS 59.A O no hydrogen 2.852 N/A SER 62.A OG HIS 63.A ND1 no hydrogen 2.852 N/A HIS 63.A N HIS 59.A O no hydrogen 3.289 N/A HIS 63.A ND1 SER 62.A OG no hydrogen 2.852 N/A VAL 64.A N PHE 60.A O no hydrogen 2.888 N/A LEU 65.A N ILE 61.A O no hydrogen 2.890 N/A ALA 66.A N SER 62.A O no hydrogen 2.935 N/A PHE 67.A N HIS 63.A O no hydrogen 3.326 N/A PHE 68.A N VAL 64.A O no hydrogen 3.145 N/A ALA 69.A N LEU 65.A O no hydrogen 2.836 N/A SER 71.A N PHE 67.A O no hydrogen 3.273 N/A SER 71.A OG PHE 67.A O no hydrogen 3.301 N/A SER 71.A OG PHE 68.A O no hydrogen 3.001 N/A ILE 74.A N ALA 70.A O no hydrogen 2.916 N/A VAL 75.A N SER 71.A O no hydrogen 3.121 N/A ASN 76.A N ASP 72.A O no hydrogen 2.913 N/A GLU 77.A N GLY 73.A O no hydrogen 2.873 N/A ASN 78.A N ILE 74.A O no hydrogen 3.116 N/A ASN 78.A N VAL 75.A O no hydrogen 2.943 N/A LEU 79.A N VAL 75.A O no hydrogen 2.939 N/A VAL 80.A N ASN 76.A O no hydrogen 2.912 N/A GLU 81.A N GLU 77.A O no hydrogen 3.205 N/A ARG 82.A N ASN 78.A O no hydrogen 2.798 N/A ARG 82.A NE ILE 148.A O no hydrogen 2.977 N/A ARG 82.A NH2 ILE 148.A O no hydrogen 3.087 N/A ARG 82.A NH2 ASP 150.A O no hydrogen 2.414 N/A PHE 83.A N ASN 78.A O no hydrogen 3.351 N/A SER 84.A N LEU 79.A O no hydrogen 2.848 N/A SER 84.A OG LEU 79.A O no hydrogen 2.487 N/A SER 84.A OG VAL 80.A O no hydrogen 3.504 N/A GLN 85.A NE2 VAL 80.A O no hydrogen 2.542 N/A GLU 86.A N ARG 82.A O no hydrogen 2.677 N/A VAL 87.A N PHE 83.A O no hydrogen 2.938 N/A GLN 88.A N LEU 6.A O no hydrogen 2.913 N/A THR 90.A OG1 ARG 13.A O no hydrogen 2.593 N/A THR 90.A OG1 VAL 15.A O no hydrogen 3.232 N/A GLU 91.A N GLU 91.A OE1 no hydrogen 2.544 N/A ARG 93.A N VAL 89.A O no hydrogen 3.059 N/A ARG 93.A NH2 VAL 87.A O no hydrogen 2.719 N/A CYS 94.A N THR 90.A O no hydrogen 3.003 N/A CYS 94.A SG THR 90.A O no hydrogen 3.466 N/A PHE 95.A N GLU 91.A O no hydrogen 3.127 N/A TYR 96.A N ALA 92.A O no hydrogen 2.899 N/A TYR 96.A OH TYR 155.A OH no hydrogen 2.710 N/A GLY 97.A N ARG 93.A O no hydrogen 2.838 N/A PHE 98.A N CYS 94.A O no hydrogen 3.063 N/A GLN 99.A N PHE 95.A O no hydrogen 2.865 N/A GLN 99.A NE2 GLU 103.A OE2 no hydrogen 3.321 N/A GLN 99.A NE2 GLU 166.A OE1 no hydrogen 3.134 N/A ILE 100.A N TYR 96.A O no hydrogen 3.001 N/A ALA 101.A N GLY 97.A O no hydrogen 3.171 N/A MET 102.A N PHE 98.A O no hydrogen 2.842 N/A GLU 103.A N GLN 99.A O no hydrogen 2.785 N/A ASN 104.A N ILE 100.A O no hydrogen 3.186 N/A ILE 105.A N ALA 101.A O no hydrogen 3.333 N/A HIS 106.A N MET 102.A O no hydrogen 2.836 N/A HIS 106.A NE2 ASP 199.A OD2 no hydrogen 2.534 N/A SER 107.A N GLU 103.A O no hydrogen 2.780 N/A GLU 108.A N ASN 104.A O no hydrogen 2.902 N/A MET 109.A N ILE 105.A O no hydrogen 2.808 N/A TYR 110.A N HIS 106.A O no hydrogen 3.040 N/A SER 111.A N SER 107.A O no hydrogen 3.210 N/A LEU 112.A N GLU 108.A O no hydrogen 2.940 N/A LEU 113.A N MET 109.A O no hydrogen 3.069 N/A ILE 114.A N TYR 110.A O no hydrogen 3.088 N/A ASP 115.A N SER 111.A O no hydrogen 2.828 N/A THR 116.A N LEU 112.A O no hydrogen 2.645 N/A THR 116.A OG1 LEU 112.A O no hydrogen 2.788 N/A TYR 117.A N LEU 113.A O no hydrogen 2.892 N/A TYR 117.A OH ASP 46.A OD2 no hydrogen 3.217 N/A ILE 118.A N ILE 114.A O no hydrogen 2.891 N/A LYS 119.A NZ ASP 115.A O no hydrogen 2.672 N/A LYS 122.A N ASP 120.A OD1 no hydrogen 3.332 N/A GLU 123.A N ASP 120.A OD2 no hydrogen 3.047 N/A ARG 124.A N ASP 120.A O no hydrogen 3.064 N/A ARG 124.A NE ILE 118.A O no hydrogen 2.549 N/A ARG 124.A NH2 ASP 115.A O no hydrogen 2.740 N/A GLU 125.A N PRO 121.A O no hydrogen 2.941 N/A TYR 126.A N LYS 122.A O no hydrogen 3.103 N/A LEU 127.A N GLU 123.A O no hydrogen 2.858 N/A PHE 128.A N ARG 124.A O no hydrogen 2.826 N/A ASN 129.A N GLU 125.A O no hydrogen 3.011 N/A ALA 130.A N LEU 127.A O no hydrogen 3.282 N/A GLU 132.A N ASN 129.A O no hydrogen 2.875 N/A THR 133.A N ALA 130.A O no hydrogen 3.081 N/A THR 133.A OG1 TYR 126.A O no hydrogen 2.819 N/A THR 133.A OG1 ASN 129.A O no hydrogen 2.935 N/A MET 134.A N ALA 130.A O no hydrogen 2.681 N/A VAL 137.A N MET 134.A O no hydrogen 2.971 N/A LYS 138.A N MET 134.A O no hydrogen 2.822 N/A LYS 138.A NZ ASP 142.A OD1 no hydrogen 2.921 N/A LYS 138.A NZ ASP 142.A OD2 no hydrogen 3.153 N/A LYS 139.A N PRO 135.A O no hydrogen 3.302 N/A LYS 139.A NZ GLU 236.A OE1 no hydrogen 2.492 N/A LYS 140.A NZ PHE 169.A O no hydrogen 2.925 N/A LYS 140.A NZ GLU 234.A OE1 no hydrogen 2.790 N/A ALA 141.A N VAL 137.A O no hydrogen 3.032 N/A ASP 142.A N LYS 138.A O no hydrogen 2.951 N/A TRP 143.A N LYS 139.A O no hydrogen 3.021 N/A ALA 144.A N LYS 140.A O no hydrogen 3.113 N/A LEU 145.A N ALA 141.A O no hydrogen 2.753 N/A ARG 146.A N ASP 142.A O no hydrogen 3.014 N/A ARG 146.A NH2 ASP 150.A OD2 no hydrogen 3.480 N/A TRP 147.A N ALA 144.A O no hydrogen 3.079 N/A ILE 148.A N LEU 145.A O no hydrogen 2.981 N/A GLY 149.A N LEU 145.A O no hydrogen 3.249 N/A ASP 150.A N ARG 146.A O no hydrogen 2.870 N/A GLU 152.A N ASP 150.A OD1 no hydrogen 2.721 N/A ALA 153.A N ASP 150.A OD1 no hydrogen 2.659 N/A THR 154.A N GLU 157.A OE1 no hydrogen 3.149 N/A TYR 155.A OH TYR 96.A OH no hydrogen 2.710 N/A GLU 157.A N THR 154.A OG1 no hydrogen 3.233 N/A ARG 158.A N THR 154.A O no hydrogen 2.787 N/A ARG 158.A NH1 GLU 86.A OE2 no hydrogen 2.901 N/A ARG 158.A NH2 GLU 86.A OE1 no hydrogen 2.437 N/A ARG 158.A NH2 GLU 86.A OE2 no hydrogen 2.887 N/A VAL 159.A N TYR 155.A O no hydrogen 2.630 N/A VAL 160.A N GLY 156.A O no hydrogen 3.245 N/A ALA 161.A N GLU 157.A O no hydrogen 2.945 N/A PHE 162.A N ARG 158.A O no hydrogen 3.075 N/A ALA 163.A N VAL 159.A O no hydrogen 3.075 N/A ALA 163.A N VAL 160.A O no hydrogen 3.116 N/A ALA 164.A N VAL 160.A O no hydrogen 3.133 N/A ALA 164.A N ALA 161.A O no hydrogen 3.138 N/A VAL 165.A N ALA 161.A O no hydrogen 2.894 N/A GLU 166.A N PHE 162.A O no hydrogen 2.861 N/A GLY 167.A N ALA 164.A O no hydrogen 3.267 N/A PHE 169.A N ALA 164.A O no hydrogen 3.034 N/A PHE 170.A N GLY 167.A O no hydrogen 3.367 N/A SER 171.A N GLY 167.A O no hydrogen 2.865 N/A SER 171.A OG ILE 168.A O no hydrogen 2.538 N/A PHE 174.A N PHE 170.A O no hydrogen 2.822 N/A ALA 175.A N SER 171.A O no hydrogen 2.909 N/A SER 176.A N GLY 172.A O no hydrogen 3.152 N/A SER 176.A OG GLY 172.A O no hydrogen 2.943 N/A ILE 177.A N SER 173.A O no hydrogen 3.099 N/A PHE 178.A N PHE 174.A O no hydrogen 2.936 N/A TRP 179.A N ALA 175.A O no hydrogen 2.807 N/A TRP 179.A NE1 ILE 247.A O no hydrogen 3.076 N/A LEU 180.A N SER 176.A O no hydrogen 3.169 N/A LYS 181.A N ILE 177.A O no hydrogen 3.068 N/A LYS 181.A NZ GLU 194.A OE2 no hydrogen 2.632 N/A LYS 182.A N PHE 178.A O no hydrogen 3.008 N/A ARG 183.A N TRP 179.A O no hydrogen 3.007 N/A ARG 183.A NH1 GLU 57.A OE2 no hydrogen 3.119 N/A ARG 183.A NH2 GLU 57.A OE2 no hydrogen 2.763 N/A GLY 184.A N LYS 181.A O no hydrogen 2.950 N/A LEU 185.A N LEU 180.A O no hydrogen 3.057 N/A GLY 188.A N ASP 46.A OD2 no hydrogen 2.785 N/A THR 190.A N MET 186.A O no hydrogen 2.953 N/A THR 190.A OG1 MET 186.A O no hydrogen 3.527 N/A THR 190.A OG1 PRO 187.A O no hydrogen 3.391 N/A PHE 191.A N PRO 187.A O no hydrogen 3.052 N/A SER 192.A N GLY 188.A O no hydrogen 3.122 N/A SER 192.A OG GLY 188.A O no hydrogen 3.244 N/A SER 192.A OG LEU 189.A O no hydrogen 3.160 N/A ASN 193.A N LEU 189.A O no hydrogen 3.067 N/A ASN 193.A ND2 PHE 174.A O no hydrogen 3.444 N/A GLU 194.A N THR 190.A O no hydrogen 3.220 N/A GLU 194.A N PHE 191.A O no hydrogen 3.204 N/A LEU 195.A N PHE 191.A O no hydrogen 3.345 N/A ILE 196.A N SER 192.A O no hydrogen 2.793 N/A SER 197.A N ASN 193.A O no hydrogen 3.003 N/A SER 197.A OG ASN 193.A O no hydrogen 3.279 N/A SER 197.A OG GLU 194.A O no hydrogen 2.771 N/A ARG 198.A N GLU 194.A O no hydrogen 3.206 N/A ASP 199.A N LEU 195.A O no hydrogen 3.238 N/A GLU 200.A N ILE 196.A O no hydrogen 2.771 N/A GLY 201.A N SER 197.A O no hydrogen 2.879 N/A LEU 202.A N ARG 198.A O no hydrogen 3.423 N/A HIS 203.A N ASP 199.A O no hydrogen 2.873 N/A CYS 204.A N GLU 200.A O no hydrogen 2.967 N/A CYS 204.A SG ALA 163.A O no hydrogen 3.614 N/A CYS 204.A SG GLU 200.A O no hydrogen 3.556 N/A ASP 205.A N GLY 201.A O no hydrogen 2.955 N/A PHE 206.A N LEU 202.A O no hydrogen 2.905 N/A ALA 207.A N HIS 203.A O no hydrogen 3.101 N/A CYS 208.A N CYS 204.A O no hydrogen 3.091 N/A CYS 208.A SG CYS 204.A O no hydrogen 3.532 N/A LEU 209.A N ASP 205.A O no hydrogen 2.899 N/A MET 210.A N PHE 206.A O no hydrogen 2.783 N/A PHE 211.A N ALA 207.A O no hydrogen 2.947 N/A LYS 212.A N CYS 208.A O no hydrogen 3.016 N/A LYS 212.A NZ GLU 268.A O no hydrogen 2.914 N/A HIS 213.A N LEU 209.A O no hydrogen 3.056 N/A HIS 213.A NE2 ASP 23.A OD2 no hydrogen 2.580 N/A LEU 214.A N PHE 211.A O no hydrogen 2.960 N/A VAL 215.A N GLU 4.A OE1 no hydrogen 2.912 N/A HIS 216.A N GLU 4.A OE2 no hydrogen 2.971 N/A LYS 217.A NZ PHE 211.A O no hydrogen 3.068 N/A LYS 217.A NZ LEU 214.A O no hydrogen 3.515 N/A ARG 222.A NE GLU 157.A OE2 no hydrogen 3.093 N/A ARG 222.A NH1 GLU 225.A OE1 no hydrogen 3.252 N/A VAL 223.A N ALA 219.A O no hydrogen 3.124 N/A ARG 224.A N GLU 220.A O no hydrogen 2.809 N/A GLU 225.A N GLN 221.A O no hydrogen 3.052 N/A ILE 226.A N ARG 222.A O no hydrogen 3.154 N/A ILE 227.A N VAL 223.A O no hydrogen 3.018 N/A THR 228.A N ARG 224.A O no hydrogen 2.762 N/A THR 228.A OG1 ARG 224.A O no hydrogen 2.713 N/A ASN 229.A N GLU 225.A O no hydrogen 2.782 N/A ALA 230.A N ILE 226.A O no hydrogen 3.109 N/A VAL 231.A N ILE 227.A O no hydrogen 2.932 N/A ARG 232.A N THR 228.A O no hydrogen 2.997 N/A ARG 232.A NH1 GLN 235.A OE1 no hydrogen 2.721 N/A ARG 232.A NH1 GLU 259.A OE2 no hydrogen 2.925 N/A ILE 233.A N ASN 229.A O no hydrogen 3.114 N/A GLU 234.A N ALA 230.A O no hydrogen 2.922 N/A GLN 235.A N VAL 231.A O no hydrogen 2.911 N/A GLN 235.A NE2 LYS 255.A O no hydrogen 2.856 N/A GLN 235.A NE2 GLU 259.A OE2 no hydrogen 3.034 N/A GLU 236.A N ARG 232.A O no hydrogen 2.813 N/A PHE 237.A N ILE 233.A O no hydrogen 2.939 N/A LEU 238.A N GLU 234.A O no hydrogen 3.021 N/A THR 239.A OG1 GLN 235.A O no hydrogen 2.843 N/A GLU 240.A N GLU 236.A O no hydrogen 3.063 N/A ALA 241.A N GLU 236.A O no hydrogen 3.258 N/A LEU 242.A N PHE 237.A O no hydrogen 2.812 N/A VAL 244.A N LEU 238.A O no hydrogen 3.266 N/A LEU 246.A N PRO 243.A O no hydrogen 3.107 N/A ILE 247.A N VAL 244.A O no hydrogen 3.029 N/A GLY 248.A N LYS 245.A O no hydrogen 2.670 N/A MET 249.A N VAL 244.A O no hydrogen 3.048 N/A THR 252.A N ASN 250.A OD1 no hydrogen 2.861 N/A MET 254.A N ASN 250.A O no hydrogen 3.114 N/A LYS 255.A N CYS 251.A O no hydrogen 3.206 N/A GLN 256.A N THR 252.A O no hydrogen 3.239 N/A GLN 256.A NE2 GLU 278.A O no hydrogen 2.683 N/A TYR 257.A N LEU 253.A O no hydrogen 3.059 N/A ILE 258.A N MET 254.A O no hydrogen 3.195 N/A GLU 259.A N LYS 255.A O no hydrogen 3.461 N/A PHE 260.A N GLN 256.A O no hydrogen 2.929 N/A VAL 261.A N TYR 257.A O no hydrogen 2.881 N/A ALA 262.A N ILE 258.A O no hydrogen 2.843 N/A ASP 263.A N GLU 259.A O no hydrogen 2.791 N/A ARG 264.A N PHE 260.A O no hydrogen 2.986 N/A ARG 264.A NE PHE 260.A O no hydrogen 3.571 N/A LEU 265.A N VAL 261.A O no hydrogen 3.037 N/A MET 266.A N ALA 262.A O no hydrogen 3.075 N/A LEU 267.A N ASP 263.A O no hydrogen 3.116 N/A GLU 268.A N ARG 264.A O no hydrogen 3.028 N/A LEU 269.A N LEU 265.A O no hydrogen 2.809 N/A GLY 270.A N LEU 267.A O no hydrogen 2.748 N/A PHE 271.A N MET 266.A O no hydrogen 2.854 N/A ILE 274.A N ASP 263.A OD1 no hydrogen 2.833 N/A PHE 275.A N ASP 263.A OD1 no hydrogen 2.935 N/A ARG 276.A N ASP 263.A OD2 no hydrogen 2.609 N/A PHE 281.A N ASN 279.A OD1 no hydrogen 2.704 N/A