Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3o7w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 6.A N ASP 4.A OD1 no hydrogen 3.024 N/A SER 6.A OG ASP 4.A OD1 no hydrogen 2.885 N/A CYS 8.A N ASP 4.A O no hydrogen 3.107 N/A CYS 8.A SG ASP 4.A O no hydrogen 3.741 N/A LYS 9.A N ALA 5.A O no hydrogen 2.827 N/A LYS 9.A NZ GLU 170.A OE2 no hydrogen 2.777 N/A ARG 10.A N SER 6.A O no hydrogen 2.995 N/A ARG 10.A NE VAL 27.A O no hydrogen 3.126 N/A PHE 11.A N LEU 7.A O no hydrogen 2.959 N/A ALA 12.A N CYS 8.A O no hydrogen 2.957 N/A VAL 13.A N LYS 9.A O no hydrogen 2.890 N/A SER 14.A N ARG 10.A O no hydrogen 2.962 N/A SER 14.A OG PHE 11.A O no hydrogen 2.520 N/A ILE 15.A N PHE 11.A O no hydrogen 3.255 N/A ILE 15.A N ALA 12.A O no hydrogen 3.178 N/A GLY 16.A N ALA 12.A O no hydrogen 3.242 N/A GLY 16.A N VAL 13.A O no hydrogen 2.870 N/A TYR 17.A N ALA 12.A O no hydrogen 3.198 N/A TYR 17.A OH GLU 248.A OE1 no hydrogen 2.400 N/A TYR 22.A N ASP 20.A OD1 no hydrogen 2.930 N/A TYR 22.A OH ASP 82.A OD1 no hydrogen 3.340 N/A TYR 22.A OH ASP 82.A OD2 no hydrogen 2.626 N/A ILE 23.A N ASP 20.A OD1 no hydrogen 3.089 N/A HIS 25.A N TYR 22.A O no hydrogen 2.852 N/A PHE 26.A N ILE 23.A O no hydrogen 2.781 N/A VAL 27.A N ILE 23.A O no hydrogen 3.160 N/A ARG 28.A NH1 ARG 28.A O no hydrogen 3.160 N/A SER 30.A OG GLU 32.A OE2 no hydrogen 2.802 N/A GLU 32.A N SER 30.A OG no hydrogen 3.326 N/A ILE 38.A N ALA 35.A O no hydrogen 2.955 N/A ASN 39.A ND2 GLU 248.A OE1 no hydrogen 2.937 N/A ARG 40.A N PRO 36.A O no hydrogen 3.039 N/A ARG 40.A NH2 GLU 248.A O no hydrogen 3.156 N/A GLY 41.A N GLU 37.A O no hydrogen 2.933 N/A TYR 42.A N ILE 38.A O no hydrogen 2.916 N/A TYR 42.A OH GLU 3.A OE2 no hydrogen 2.518 N/A PHE 43.A N ASN 39.A O no hydrogen 2.886 N/A ALA 44.A N ARG 40.A O no hydrogen 2.937 N/A ARG 45.A N GLY 41.A O no hydrogen 2.954 N/A ARG 45.A NE GLU 170.A OE2 no hydrogen 2.747 N/A VAL 46.A N TYR 42.A O no hydrogen 2.991 N/A HIS 47.A N PHE 43.A O no hydrogen 2.838 N/A GLY 48.A N ALA 44.A O no hydrogen 2.833 N/A VAL 49.A N ARG 45.A O no hydrogen 3.064 N/A SER 50.A N VAL 46.A O no hydrogen 2.967 N/A GLN 51.A N HIS 47.A O no hydrogen 2.831 N/A LEU 52.A N GLY 48.A O no hydrogen 3.173 N/A ILE 53.A N VAL 49.A O no hydrogen 2.911 N/A LYS 54.A N SER 50.A O no hydrogen 2.876 N/A LYS 54.A NZ GLU 83.A OE1 no hydrogen 2.664 N/A ALA 55.A N GLN 51.A O no hydrogen 2.972 N/A PHE 56.A N LEU 52.A O no hydrogen 3.142 N/A LEU 57.A N ILE 53.A O no hydrogen 2.836 N/A ARG 58.A N LYS 54.A O no hydrogen 2.900 N/A LYS 59.A N ALA 55.A O no hydrogen 3.087 N/A THR 60.A N PHE 56.A O no hydrogen 3.038 N/A THR 60.A OG1 PHE 56.A O no hydrogen 3.018 N/A THR 60.A OG1 LEU 57.A O no hydrogen 3.202 N/A GLU 61.A N ARG 58.A O no hydrogen 3.425 N/A CYS 62.A N LEU 57.A O no hydrogen 2.973 N/A CYS 62.A N THR 60.A OG1 no hydrogen 3.282 N/A HIS 63.A N THR 60.A O no hydrogen 2.944 N/A CYS 64.A N SER 88.A OG no hydrogen 3.375 N/A CYS 64.A SG THR 60.A OG1 no hydrogen 3.277 N/A GLN 65.A N PRO 164.A O no hydrogen 2.855 N/A GLN 65.A NE2 ASN 160.A O no hydrogen 2.931 N/A GLN 65.A NE2 THR 165.A OG1 no hydrogen 2.718 N/A ILE 66.A N LYS 89.A O no hydrogen 3.260 N/A VAL 67.A N LEU 166.A O no hydrogen 2.650 N/A ASN 68.A N PHE 91.A O no hydrogen 2.839 N/A LEU 69.A N ILE 168.A O no hydrogen 2.698 N/A GLY 70.A N VAL 93.A O no hydrogen 2.652 N/A ALA 71.A N VAL 93.A O no hydrogen 3.007 N/A GLY 72.A N ASP 94.A OD2 no hydrogen 2.977 N/A ASP 74.A N ALA 71.A O no hydrogen 3.077 N/A THR 75.A OG1 ASP 20.A OD1 no hydrogen 3.274 N/A THR 75.A OG1 ASP 20.A OD2 no hydrogen 2.479 N/A THR 76.A OG1 ASP 74.A OD1 no hydrogen 3.243 N/A TRP 78.A N THR 75.A O no hydrogen 2.940 N/A TRP 78.A NE1 LEU 112.A O no hydrogen 2.901 N/A ARG 79.A N THR 75.A O no hydrogen 3.233 N/A ARG 79.A NE THR 75.A OG1 no hydrogen 3.213 N/A ARG 79.A NH2 THR 75.A OG1 no hydrogen 3.243 N/A LEU 80.A N THR 76.A O no hydrogen 2.885 N/A LYS 81.A N PHE 77.A O no hydrogen 3.034 N/A LYS 81.A NZ GLU 118.A OE1 no hydrogen 3.320 N/A LYS 81.A NZ GLU 118.A OE2 no hydrogen 3.526 N/A ASP 82.A N TRP 78.A O no hydrogen 3.260 N/A GLU 83.A N ARG 79.A O no hydrogen 3.107 N/A ASP 84.A N LYS 81.A O no hydrogen 2.792 N/A LEU 85.A N LEU 80.A O no hydrogen 2.797 N/A SER 88.A OG CYS 62.A O no hydrogen 3.285 N/A SER 88.A OG CYS 64.A O no hydrogen 3.479 N/A LYS 89.A NZ ASP 133.A OD1 no hydrogen 2.615 N/A LYS 89.A NZ SER 134.A O no hydrogen 2.953 N/A LYS 89.A NZ CYS 157.A O no hydrogen 2.722 N/A TYR 90.A N ARG 136.A O no hydrogen 2.769 N/A PHE 91.A N ILE 66.A O no hydrogen 2.757 N/A GLU 92.A N ALA 138.A O no hydrogen 2.764 N/A VAL 93.A N ASN 68.A O no hydrogen 3.011 N/A ASP 94.A N ILE 140.A O no hydrogen 3.185 N/A PHE 95.A N ASP 94.A OD1 no hydrogen 2.623 N/A VAL 99.A N PHE 95.A O no hydrogen 2.945 N/A THR 100.A N PRO 96.A O no hydrogen 2.870 N/A THR 100.A OG1 PRO 96.A O no hydrogen 2.990 N/A ARG 101.A N MET 97.A O no hydrogen 3.182 N/A ARG 101.A NH1 ARG 101.A O no hydrogen 3.390 N/A ARG 101.A NH1 SER 105.A OG no hydrogen 2.609 N/A ARG 101.A NH2 PHE 26.A O no hydrogen 2.444 N/A LYS 102.A N ILE 98.A O no hydrogen 2.965 N/A LYS 102.A NZ GLY 72.A O no hydrogen 2.884 N/A LYS 102.A NZ ASP 74.A O no hydrogen 2.896 N/A LYS 102.A NZ GLU 92.A OE1 no hydrogen 2.831 N/A LYS 102.A NZ GLU 92.A OE2 no hydrogen 3.264 N/A LEU 103.A N VAL 99.A O no hydrogen 2.793 N/A HIS 104.A N THR 100.A O no hydrogen 2.814 N/A SER 105.A N ARG 101.A O no hydrogen 3.238 N/A ILE 106.A N LYS 102.A O no hydrogen 3.031 N/A LYS 107.A N LEU 103.A O no hydrogen 2.836 N/A CYS 108.A N HIS 104.A O no hydrogen 3.100 N/A CYS 108.A N SER 105.A O no hydrogen 3.227 N/A CYS 108.A SG HIS 104.A NE2 no hydrogen 3.772 N/A CYS 108.A SG HIS 104.A O no hydrogen 3.314 N/A LYS 109.A N ILE 106.A O no hydrogen 3.228 N/A LEU 112.A N LYS 109.A O no hydrogen 2.711 N/A SER 113.A N LYS 109.A O no hydrogen 3.003 N/A SER 114.A N PRO 110.A O no hydrogen 2.829 N/A LEU 117.A N SER 113.A O no hydrogen 3.226 N/A GLU 118.A N SER 114.A O no hydrogen 2.843 N/A LEU 119.A N PRO 115.A O no hydrogen 3.373 N/A HIS 120.A N LEU 117.A O no hydrogen 2.995 N/A ILE 131.A N ASP 128.A O no hydrogen 3.431 N/A LEU 132.A N VAL 139.A O no hydrogen 2.823 N/A SER 134.A N TYR 137.A O no hydrogen 2.913 N/A SER 134.A OG TYR 137.A O no hydrogen 2.467 N/A LYS 135.A N HIS 120.A ND1 no hydrogen 3.066 N/A ARG 136.A NE SER 88.A O no hydrogen 2.787 N/A ARG 136.A NH2 PRO 87.A O no hydrogen 3.306 N/A TYR 137.A N SER 134.A OG no hydrogen 3.317 N/A TYR 137.A OH GLU 92.A OE1 no hydrogen 2.616 N/A ALA 138.A N TYR 90.A O no hydrogen 2.957 N/A VAL 139.A N LEU 132.A O no hydrogen 2.804 N/A ILE 140.A N GLU 92.A O no hydrogen 2.807 N/A GLY 141.A N HIS 130.A O no hydrogen 2.726 N/A ALA 142.A N ASP 94.A O no hydrogen 2.865 N/A ASP 143.A N GLU 149.A OE1 no hydrogen 2.982 N/A ASP 143.A N GLU 149.A OE2 no hydrogen 3.405 N/A ARG 145.A N ASP 143.A OD1 no hydrogen 2.856 N/A ARG 145.A NE ASP 143.A OD1 no hydrogen 2.855 N/A ARG 145.A NE ASP 143.A OD2 no hydrogen 3.419 N/A ARG 145.A NH2 ASP 143.A OD2 no hydrogen 2.762 N/A ASP 146.A N ASP 143.A O no hydrogen 2.887 N/A SER 148.A OG ASP 146.A OD1 no hydrogen 3.515 N/A GLU 149.A N ASP 146.A OD1 no hydrogen 3.010 N/A LEU 150.A N ASP 146.A O no hydrogen 2.906 N/A GLU 151.A N LEU 147.A O no hydrogen 2.962 N/A GLU 152.A N SER 148.A O no hydrogen 3.000 N/A LYS 153.A N GLU 149.A O no hydrogen 2.990 N/A LYS 153.A NZ GLY 141.A O no hydrogen 3.194 N/A LEU 154.A N LEU 150.A O no hydrogen 3.059 N/A LYS 155.A N GLU 151.A O no hydrogen 3.017 N/A LYS 155.A NZ GLU 151.A OE2 no hydrogen 2.764 N/A LYS 156.A N GLU 152.A O no hydrogen 3.011 N/A CYS 157.A N LYS 153.A O no hydrogen 3.281 N/A CYS 157.A N LEU 154.A O no hydrogen 2.911 N/A CYS 157.A SG LYS 153.A O no hydrogen 3.558 N/A ASN 158.A N LYS 155.A O no hydrogen 2.814 N/A MET 159.A N LEU 154.A O no hydrogen 3.108 N/A ASN 160.A N GLN 65.A OE1 no hydrogen 2.855 N/A GLN 162.A N ASN 160.A OD1 no hydrogen 2.734 N/A LEU 163.A N ASN 160.A O no hydrogen 3.273 N/A THR 165.A N ARG 194.A O no hydrogen 3.078 N/A THR 165.A OG1 LEU 163.A O no hydrogen 2.853 N/A LEU 166.A N GLN 65.A O no hydrogen 2.847 N/A LEU 167.A N MET 196.A O no hydrogen 2.955 N/A ILE 168.A N VAL 67.A O no hydrogen 2.822 N/A ALA 169.A N ILE 198.A O no hydrogen 2.763 N/A CYS 171.A N TYR 200.A O no hydrogen 2.721 N/A TYR 175.A N VAL 172.A O no hydrogen 3.112 N/A MET 176.A N LEU 173.A O no hydrogen 3.233 N/A THR 177.A N GLN 180.A OE1 no hydrogen 2.871 N/A GLN 180.A N THR 177.A OG1 no hydrogen 3.052 N/A SER 181.A N THR 177.A O no hydrogen 3.035 N/A SER 181.A OG THR 177.A O no hydrogen 3.117 N/A SER 181.A OG PRO 178.A O no hydrogen 3.157 N/A ALA 182.A N PRO 178.A O no hydrogen 2.879 N/A ASN 183.A N GLU 179.A O no hydrogen 2.870 N/A LEU 184.A N GLN 180.A O no hydrogen 2.901 N/A LEU 185.A N SER 181.A O no hydrogen 2.912 N/A LYS 186.A N ALA 182.A O no hydrogen 2.862 N/A TRP 187.A N ASN 183.A O no hydrogen 2.961 N/A TRP 187.A NE1 GLU 151.A OE1 no hydrogen 2.911 N/A ALA 188.A N LEU 184.A O no hydrogen 2.932 N/A ALA 189.A N LEU 185.A O no hydrogen 3.079 N/A ASN 190.A N LYS 186.A O no hydrogen 2.851 N/A SER 191.A N TRP 187.A O no hydrogen 2.930 N/A SER 191.A OG TRP 187.A O no hydrogen 2.505 N/A ARG 194.A NH1 GLU 274.A OE2 no hydrogen 3.487 N/A ARG 194.A NH2 GLN 162.A O no hydrogen 2.786 N/A ALA 195.A N LYS 270.A O no hydrogen 3.016 N/A MET 196.A N THR 165.A O no hydrogen 3.075 N/A PHE 197.A N ALA 268.A O no hydrogen 2.776 N/A ILE 198.A N LEU 167.A O no hydrogen 2.887 N/A ASN 199.A N CYS 266.A O no hydrogen 2.889 N/A ASN 199.A ND2 GLU 201.A OE2 no hydrogen 3.099 N/A TYR 200.A N ALA 169.A O no hydrogen 3.098 N/A GLU 201.A N CYS 264.A O no hydrogen 3.164 N/A VAL 203.A N HIS 262.A O no hydrogen 2.714 N/A LYS 207.A N ASN 204.A O no hydrogen 3.060 N/A SER 208.A N SER 211.A OG no hydrogen 3.113 N/A SER 211.A N SER 208.A OG no hydrogen 3.268 N/A SER 211.A OG SER 208.A O no hydrogen 3.125 N/A GLN 212.A N SER 208.A O no hydrogen 2.974 N/A GLN 212.A NE2 GLU 201.A OE2 no hydrogen 2.816 N/A LYS 213.A N LEU 209.A O no hydrogen 2.832 N/A GLU 214.A N GLU 210.A O no hydrogen 2.914 N/A ARG 215.A N SER 211.A O no hydrogen 2.826 N/A ARG 215.A NH1 GLU 201.A OE2 no hydrogen 2.647 N/A ARG 215.A NH1 GLN 212.A OE1 no hydrogen 3.238 N/A ARG 215.A NH2 SER 181.A OG no hydrogen 2.609 N/A LEU 217.A N LYS 213.A O no hydrogen 2.931 N/A SER 218.A N GLU 214.A O no hydrogen 2.689 N/A SER 218.A OG GLU 214.A O no hydrogen 3.013 N/A SER 218.A OG ASN 219.A OD1 no hydrogen 3.441 N/A ASN 219.A N LEU 216.A O no hydrogen 3.076 N/A TRP 221.A N LEU 216.A O no hydrogen 3.200 N/A TRP 221.A NE1 LEU 185.A O no hydrogen 3.021 N/A GLU 222.A N THR 269.A O no hydrogen 2.907 N/A THR 223.A N THR 269.A O no hydrogen 2.947 N/A THR 223.A OG1 THR 269.A OG1 no hydrogen 2.640 N/A SER 225.A N TRP 267.A O no hydrogen 2.899 N/A VAL 227.A N LEU 265.A O no hydrogen 3.033 N/A ASP 228.A N GLU 231.A OE1 no hydrogen 3.285 N/A MET 229.A N TYR 263.A O no hydrogen 2.881 N/A MET 230.A N ASP 228.A OD1 no hydrogen 2.964 N/A GLU 231.A N ASP 228.A OD1 no hydrogen 3.275 N/A LEU 232.A N ASP 228.A O no hydrogen 3.150 N/A TYR 233.A N MET 229.A O no hydrogen 2.826 N/A TYR 233.A OH GLU 245.A OE1 no hydrogen 2.802 N/A ASN 234.A N MET 230.A O no hydrogen 2.889 N/A ARG 235.A N LEU 232.A O no hydrogen 2.951 N/A ARG 235.A NE TYR 282.A OH no hydrogen 2.678 N/A LEU 236.A N TYR 233.A O no hydrogen 3.112 N/A ARG 238.A NE LEU 236.A O no hydrogen 3.286 N/A ARG 238.A NH2 LEU 236.A O no hydrogen 2.850 N/A VAL 241.A N PRO 237.A O no hydrogen 3.012 N/A SER 242.A N ARG 238.A O no hydrogen 2.872 N/A SER 242.A OG ARG 238.A O no hydrogen 3.125 N/A ARG 243.A N ALA 239.A O no hydrogen 2.831 N/A ARG 243.A NE GLU 240.A OE2 no hydrogen 2.771 N/A ARG 243.A NH1 TYR 17.A O no hydrogen 2.838 N/A ARG 243.A NH1 GLU 240.A OE1 no hydrogen 2.698 N/A ARG 243.A NH1 GLU 240.A OE2 no hydrogen 3.327 N/A ARG 243.A NH2 GLY 16.A O no hydrogen 2.976 N/A ARG 243.A NH2 TYR 17.A O no hydrogen 3.080 N/A ILE 244.A N GLU 240.A O no hydrogen 2.802 N/A GLU 245.A N VAL 241.A O no hydrogen 2.793 N/A LEU 247.A N ILE 244.A O no hydrogen 3.317 N/A GLU 252.A N GLU 252.A OE1 no hydrogen 2.438 N/A LEU 259.A N LEU 255.A O no hydrogen 3.118 N/A MET 260.A N LEU 256.A O no hydrogen 2.943 N/A ARG 261.A N GLU 257.A O no hydrogen 3.313 N/A HIS 262.A N LEU 259.A O no hydrogen 3.283 N/A HIS 262.A ND1 GLN 258.A O no hydrogen 2.931 N/A TYR 263.A N MET 260.A O no hydrogen 3.051 N/A CYS 264.A N GLU 201.A O no hydrogen 2.950 N/A CYS 264.A SG GLU 201.A O no hydrogen 3.565 N/A LEU 265.A N VAL 227.A O no hydrogen 2.900 N/A CYS 266.A N ASN 199.A O no hydrogen 2.850 N/A CYS 266.A SG ASN 199.A O no hydrogen 3.807 N/A TRP 267.A N SER 225.A O no hydrogen 3.034 N/A TRP 267.A NE1 ILE 280.A O no hydrogen 2.899 N/A ALA 268.A N PHE 197.A O no hydrogen 2.879 N/A THR 269.A N THR 223.A O no hydrogen 3.072 N/A THR 269.A OG1 THR 223.A OG1 no hydrogen 2.640 N/A LYS 270.A N ALA 195.A O no hydrogen 2.982 N/A LYS 270.A NZ PHE 192.A O no hydrogen 2.793 N/A GLY 271.A N GLU 222.A OE2 no hydrogen 2.964 N/A GLY 276.A N ASN 273.A O no hydrogen 3.011 N/A LEU 277.A N GLY 272.A O no hydrogen 3.159 N/A GLU 279.A N GLY 276.A O no hydrogen 3.257 N/A ILE 280.A N LEU 277.A O no hydrogen 3.077 N/A