Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6wto_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 2.A N VAL 71.A O no hydrogen 3.069 N/A HIS 6.A N GLU 3.A O no hydrogen 2.880 N/A LEU 7.A N GLU 4.A O no hydrogen 2.922 N/A LYS 8.A N ARG 25.A O no hydrogen 3.023 N/A LEU 10.A N MET 23.A O no hydrogen 2.732 N/A GLN 11.A N MET 23.A O no hydrogen 3.013 N/A GLN 12.A NE2 GLY 14.A O no hydrogen 3.061 N/A LEU 13.A N VAL 21.A O no hydrogen 2.813 N/A GLY 14.A N VAL 21.A O no hydrogen 3.054 N/A GLY 16.A N GLY 19.A O no hydrogen 2.710 N/A SER 20.A N LYS 38.A O no hydrogen 2.981 N/A VAL 21.A N GLY 14.A O no hydrogen 2.750 N/A GLU 22.A N VAL 36.A O no hydrogen 2.809 N/A MET 23.A N GLN 11.A O no hydrogen 2.571 N/A CYS 24.A N VAL 34.A O no hydrogen 3.058 N/A ARG 25.A N LYS 8.A O no hydrogen 2.947 N/A ARG 25.A NH1 THR 30.A O no hydrogen 2.843 N/A TYR 26.A N GLU 32.A O no hydrogen 2.853 N/A ASP 27.A N HIS 6.A O no hydrogen 3.076 N/A LEU 29.A N ASP 27.A OD1 no hydrogen 3.276 N/A GLU 32.A N TYR 26.A O no hydrogen 3.083 N/A VAL 34.A N CYS 24.A O no hydrogen 2.855 N/A ALA 35.A N MET 78.A O no hydrogen 3.277 N/A VAL 36.A N GLU 22.A O no hydrogen 2.862 N/A LYS 37.A N LEU 76.A O no hydrogen 2.706 N/A LYS 37.A NZ GLU 53.A OE2 no hydrogen 2.859 N/A LYS 37.A NZ ASP 143.A OD1 no hydrogen 2.654 N/A LYS 38.A N SER 20.A O no hydrogen 2.849 N/A GLN 40.A N PHE 18.A O no hydrogen 3.368 N/A GLN 40.A NE2 SER 20.A OG no hydrogen 2.902 N/A HIS 46.A ND1 HIS 41.A O no hydrogen 2.903 N/A LEU 47.A N THR 43.A O no hydrogen 2.753 N/A ARG 48.A N GLU 44.A O no hydrogen 3.014 N/A ASP 49.A N GLU 45.A O no hydrogen 2.901 N/A PHE 50.A N HIS 46.A O no hydrogen 2.799 N/A GLU 51.A N LEU 47.A O no hydrogen 2.891 N/A ARG 52.A N ARG 48.A O no hydrogen 3.219 N/A GLU 53.A N ASP 49.A O no hydrogen 2.915 N/A ILE 54.A N PHE 50.A O no hydrogen 2.917 N/A GLU 55.A N GLU 51.A O no hydrogen 3.095 N/A ILE 56.A N ARG 52.A O no hydrogen 2.882 N/A LEU 57.A N GLU 53.A O no hydrogen 2.995 N/A LYS 58.A N ILE 54.A O no hydrogen 3.013 N/A SER 59.A N GLU 55.A O no hydrogen 3.158 N/A SER 59.A N ILE 56.A O no hydrogen 3.222 N/A SER 59.A OG GLU 55.A O no hydrogen 3.540 N/A SER 59.A OG ILE 56.A O no hydrogen 2.532 N/A SER 59.A OG TYR 121.A OH no hydrogen 3.008 N/A LEU 60.A N LEU 57.A O no hydrogen 2.968 N/A GLN 61.A N TYR 115.A OH no hydrogen 3.016 N/A ASN 64.A N HIS 62.A ND1 no hydrogen 2.981 N/A ASN 64.A ND2 VAL 139.A O no hydrogen 3.130 N/A ILE 65.A N HIS 62.A O no hydrogen 3.101 N/A VAL 66.A N ILE 141.A O no hydrogen 3.069 N/A LYS 67.A N GLU 79.A OE1 no hydrogen 3.448 N/A LYS 69.A N ILE 77.A O no hydrogen 2.979 N/A LYS 69.A NZ GLU 32.A OE1 no hydrogen 2.929 N/A GLY 70.A N ILE 77.A O no hydrogen 3.123 N/A CYS 72.A N LYS 75.A O no hydrogen 3.070 N/A CYS 72.A SG PHE 2.A O no hydrogen 3.256 N/A LYS 75.A N CYS 72.A O no hydrogen 2.844 N/A LEU 76.A N LYS 37.A O no hydrogen 2.828 N/A ILE 77.A N GLY 70.A O no hydrogen 2.693 N/A MET 78.A N ALA 35.A O no hydrogen 2.814 N/A GLU 79.A N LYS 67.A O no hydrogen 3.353 N/A TYR 83.A N VAL 133.A O no hydrogen 3.341 N/A GLY 84.A N LEU 81.A O no hydrogen 3.337 N/A LEU 86.A N ILE 131.A O no hydrogen 2.752 N/A ARG 87.A NH1.B THR 128.A OG1 no hydrogen 3.243 N/A ASP 88.A N SER 85.A OG no hydrogen 3.366 N/A TYR 89.A N SER 85.A O no hydrogen 3.035 N/A LEU 90.A N LEU 86.A O no hydrogen 2.761 N/A GLN 91.A N ARG 87.A O no hydrogen 3.103 N/A LYS 92.A N ASP 88.A O no hydrogen 2.969 N/A HIS 93.A N TYR 89.A O no hydrogen 2.923 N/A HIS 93.A ND1 TYR 89.A O no hydrogen 3.080 N/A ARG 96.A N HIS 93.A O no hydrogen 2.736 N/A ILE 97.A N LYS 94.A O no hydrogen 3.157 N/A LYS 101.A N ASP 98.A OD2 no hydrogen 2.996 N/A LYS 101.A NZ GLN 104.A OE1 no hydrogen 2.989 N/A LYS 101.A NZ GLU 136.A O no hydrogen 3.014 N/A LEU 102.A N ASP 98.A O no hydrogen 2.981 N/A LEU 103.A N HIS 99.A O no hydrogen 2.946 N/A GLN 104.A N ILE 100.A O no hydrogen 3.092 N/A GLN 104.A NE2 ASN 137.A OD1 no hydrogen 3.380 N/A TYR 105.A N LYS 101.A O no hydrogen 3.078 N/A TYR 105.A OH GLU 136.A O no hydrogen 2.752 N/A THR 106.A N LEU 102.A O no hydrogen 2.868 N/A THR 106.A OG1 LEU 102.A O no hydrogen 2.771 N/A SER 107.A N LEU 103.A O no hydrogen 2.838 N/A SER 107.A OG ASP 267.A OD1 no hydrogen 2.770 N/A GLN 108.A N GLN 104.A O no hydrogen 3.112 N/A GLN 108.A NE2 ASN 137.A O no hydrogen 2.937 N/A ILE 109.A N TYR 105.A O no hydrogen 2.942 N/A CYS 110.A N THR 106.A O no hydrogen 2.924 N/A CYS 110.A SG.B PHE 259.A O no hydrogen 3.093 N/A LYS 111.A N SER 107.A O no hydrogen 2.969 N/A LYS 111.A NZ SER 107.A OG no hydrogen 3.250 N/A LYS 111.A NZ ASP 267.A OD2 no hydrogen 3.037 N/A GLY 112.A N GLN 108.A O no hydrogen 3.042 N/A MET 113.A N ILE 109.A O no hydrogen 2.981 N/A GLU 114.A N CYS 110.A O no hydrogen 2.813 N/A TYR 115.A N LYS 111.A O no hydrogen 3.050 N/A LEU 116.A N GLY 112.A O no hydrogen 2.955 N/A GLY 117.A N MET 113.A O no hydrogen 2.929 N/A THR 118.A N GLU 114.A O no hydrogen 3.309 N/A THR 118.A OG1 TYR 115.A O no hydrogen 2.599 N/A LYS 119.A N LEU 116.A O no hydrogen 3.096 N/A ARG 120.A N GLY 117.A O no hydrogen 2.891 N/A ARG 120.A NH2 PRO 151.A O no hydrogen 3.015 N/A TYR 121.A N LEU 116.A O no hydrogen 3.193 N/A TYR 121.A OH SER 59.A OG no hydrogen 3.008 N/A ILE 122.A N LYS 148.A O no hydrogen 2.913 N/A HIS 123.A N ASP 179.A OD2 no hydrogen 2.784 N/A HIS 123.A NE2 ASP 143.A O no hydrogen 2.732 N/A ARG 124.A N ASP 179.A OD1 no hydrogen 3.068 N/A ARG 124.A NH1 LEU 146.A O no hydrogen 2.854 N/A ASP 125.A N HIS 123.A ND1 no hydrogen 3.125 N/A THR 128.A N GLU 189.A OE2 no hydrogen 2.974 N/A THR 128.A OG1 GLU 189.A OE1 no hydrogen 2.549 N/A ASN 130.A N ALA 127.A O no hydrogen 2.928 N/A ASN 130.A ND2 ASP 125.A O no hydrogen 2.795 N/A ASN 130.A ND2 ASP 125.A OD2 no hydrogen 2.950 N/A ILE 131.A N THR 128.A O no hydrogen 3.171 N/A LEU 132.A N LYS 140.A O no hydrogen 2.794 N/A VAL 133.A N GLY 84.A O no hydrogen 2.858 N/A GLU 134.A N ARG 138.A O no hydrogen 2.923 N/A ASN 135.A N ARG 138.A O no hydrogen 3.458 N/A ASN 137.A N ASN 135.A OD1 no hydrogen 2.794 N/A ARG 138.A N ASN 135.A O no hydrogen 3.251 N/A VAL 139.A N GLN 108.A OE1 no hydrogen 2.909 N/A LYS 140.A N LEU 132.A O no hydrogen 2.835 N/A LYS 140.A NZ GLU 79.A OE1 no hydrogen 2.761 N/A ILE 141.A N ASN 64.A O no hydrogen 2.958 N/A GLY 142.A N ASN 130.A O no hydrogen 2.797 N/A GLY 145.A N ASP 143.A OD2 no hydrogen 2.992 N/A THR 147.A N PHE 144.A O no hydrogen 3.114 N/A THR 147.A OG1 HIS 123.A O no hydrogen 3.400 N/A THR 147.A OG1 PHE 144.A O no hydrogen 3.339 N/A LYS 148.A N ILE 122.A O no hydrogen 2.874 N/A LEU 150.A N ARG 120.A O no hydrogen 2.909 N/A LYS 154.A N PRO 151.A O no hydrogen 3.317 N/A LYS 156.A NZ GLU 171.A O no hydrogen 3.039 N/A VAL 157.A N SER 172.A O no hydrogen 3.093 N/A TRP 163.A N PRO 160.A O no hydrogen 2.931 N/A TRP 163.A NE1 GLU 189.A OE2 no hydrogen 2.952 N/A TYR 164.A N ILE 161.A O no hydrogen 3.074 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.744 N/A SER 168.A OG LYS 173.A O no hydrogen 2.918 N/A LEU 169.A N ALA 165.A O no hydrogen 3.032 N/A THR 170.A N PRO 166.A O no hydrogen 2.888 N/A THR 170.A OG1 PRO 166.A O no hydrogen 3.170 N/A GLU 171.A N GLU 167.A O no hydrogen 2.814 N/A SER 172.A N SER 168.A O no hydrogen 3.128 N/A LYS 173.A N GLU 167.A O no hydrogen 3.394 N/A LYS 173.A NZ GLU 171.A OE2 no hydrogen 2.831 N/A SER 175.A N SER 178.A OG no hydrogen 2.849 N/A SER 178.A N SER 175.A OG no hydrogen 3.172 N/A SER 178.A OG SER 175.A O no hydrogen 3.000 N/A ASP 179.A N SER 175.A O no hydrogen 3.064 N/A VAL 180.A N VAL 176.A O no hydrogen 2.899 N/A TRP 181.A N ALA 177.A O no hydrogen 3.092 N/A SER 182.A N SER 178.A O no hydrogen 3.111 N/A SER 182.A OG TRP 163.A O no hydrogen 2.831 N/A SER 182.A OG SER 178.A O no hydrogen 3.208 N/A PHE 183.A N ASP 179.A O no hydrogen 2.823 N/A GLY 184.A N VAL 180.A O no hydrogen 2.995 N/A VAL 185.A N TRP 181.A O no hydrogen 3.257 N/A VAL 186.A N SER 182.A O no hydrogen 2.891 N/A LEU 187.A N PHE 183.A O no hydrogen 2.855 N/A TYR 188.A N GLY 184.A O no hydrogen 3.065 N/A TYR 188.A OH LYS 198.A O no hydrogen 2.674 N/A GLU 189.A N VAL 185.A O no hydrogen 2.835 N/A LEU 190.A N VAL 186.A O no hydrogen 2.866 N/A PHE 191.A N LEU 187.A O no hydrogen 3.083 N/A THR 192.A N TYR 188.A O no hydrogen 2.978 N/A THR 192.A OG1 TYR 188.A O no hydrogen 3.131 N/A THR 192.A OG1 GLU 189.A O no hydrogen 2.992 N/A TYR 193.A N LEU 190.A O no hydrogen 2.873 N/A TYR 193.A OH ILE 97.A O no hydrogen 2.599 N/A ILE 194.A N GLU 189.A O no hydrogen 3.151 N/A GLU 195.A N THR 192.A O no hydrogen 3.114 N/A SER 197.A OG GLU 195.A OE2 no hydrogen 3.358 N/A LYS 198.A N GLU 195.A O no hydrogen 2.867 N/A LYS 198.A NZ GLU 195.A OE1 no hydrogen 2.512 N/A LYS 198.A NZ GLU 195.A OE2 no hydrogen 2.988 N/A SER 199.A N LYS 196.A O no hydrogen 3.040 N/A SER 199.A OG LYS 196.A O no hydrogen 2.807 N/A GLU 203.A N SER 199.A O no hydrogen 2.908 N/A PHE 204.A N PRO 200.A O no hydrogen 2.898 N/A MET 205.A N PRO 201.A O no hydrogen 3.033 N/A ARG 206.A N ALA 202.A O no hydrogen 3.092 N/A ARG 206.A NH1 SER 197.A O no hydrogen 2.907 N/A ARG 206.A NH2 SER 197.A O no hydrogen 2.954 N/A MET 207.A N GLU 203.A O no hydrogen 3.061 N/A ILE 208.A N PHE 204.A O no hydrogen 2.802 N/A GLY 209.A N MET 205.A O no hydrogen 2.677 N/A MET 216.A N GLN 213.A O no hydrogen 3.295 N/A PHE 219.A N GLN 215.A O no hydrogen 3.194 N/A HIS 220.A N MET 216.A O no hydrogen 2.848 N/A LEU 221.A N ILE 217.A O no hydrogen 2.841 N/A ILE 222.A N VAL 218.A O no hydrogen 2.950 N/A GLU 223.A N PHE 219.A O no hydrogen 3.107 N/A LEU 224.A N HIS 220.A O no hydrogen 2.857 N/A LEU 225.A N LEU 221.A O no hydrogen 2.868 N/A LYS 226.A N ILE 222.A O no hydrogen 2.820 N/A ASN 227.A N GLU 223.A O no hydrogen 3.006 N/A ASN 227.A N LEU 224.A O no hydrogen 3.201 N/A ASN 228.A N LEU 225.A O no hydrogen 2.966 N/A GLY 229.A N LEU 224.A O no hydrogen 2.918 N/A ARG 230.A NE TRP 249.A O no hydrogen 2.901 N/A ARG 230.A NH1 LEU 225.A O no hydrogen 3.090 N/A ARG 230.A NH1 GLY 229.A O no hydrogen 2.939 N/A ARG 230.A NH2 TRP 249.A O no hydrogen 2.647 N/A ARG 230.A NH2 ASN 251.A OD1 no hydrogen 2.904 N/A ARG 233.A NH1 CYS 237.A O no hydrogen 3.117 N/A CYS 237.A N PRO 234.A O no hydrogen 2.969 N/A CYS 237.A SG PRO 238.A O no hydrogen 3.491 N/A ILE 241.A N PRO 238.A O no hydrogen 3.032 N/A TYR 242.A N PRO 238.A O no hydrogen 3.107 N/A TYR 242.A OH LEU 231.A O no hydrogen 2.694 N/A MET 243.A N ASP 239.A O no hydrogen 2.890 N/A ILE 244.A N GLU 240.A O no hydrogen 3.262 N/A MET 245.A N ILE 241.A O no hydrogen 3.136 N/A THR 246.A N TYR 242.A O no hydrogen 2.942 N/A THR 246.A OG1 MET 243.A O no hydrogen 2.726 N/A GLU 247.A N MET 243.A O no hydrogen 2.980 N/A CYS 248.A N ILE 244.A O no hydrogen 2.993 N/A CYS 248.A SG ILE 244.A O no hydrogen 3.390 N/A TRP 249.A N MET 245.A O no hydrogen 3.036 N/A ASN 251.A ND2 LEU 225.A O no hydrogen 3.053 N/A ASN 252.A N ASN 250.A OD1 no hydrogen 2.878 N/A GLN 255.A N ASN 252.A O no hydrogen 2.992 N/A ARG 256.A N VAL 253.A O no hydrogen 3.322 N/A ARG 256.A NE ASN 250.A O no hydrogen 2.780 N/A ARG 256.A NH1 GLU 167.A OE2 no hydrogen 2.836 N/A ARG 256.A NH1 ALA 177.A O no hydrogen 3.122 N/A ARG 256.A NH2 GLU 167.A OE1 no hydrogen 2.964 N/A ARG 256.A NH2 ASN 250.A O no hydrogen 3.010 N/A ASP 261.A N SER 258.A OG no hydrogen 3.073 N/A LEU 262.A N SER 258.A O no hydrogen 2.815 N/A ALA 263.A N PHE 259.A O no hydrogen 2.841 N/A LEU 264.A N ARG 260.A O no hydrogen 3.079 N/A ARG 265.A N ASP 261.A O no hydrogen 2.967 N/A ARG 265.A NH1 GLU 247.A OE1 no hydrogen 2.584 N/A VAL 266.A N LEU 262.A O no hydrogen 2.853 N/A ASP 267.A N ALA 263.A O no hydrogen 2.945 N/A GLN 268.A N LEU 264.A O no hydrogen 3.000 N/A ILE 269.A N ARG 265.A O no hydrogen 2.846 N/A ARG 270.A N VAL 266.A O no hydrogen 2.920 N/A ARG 270.A NE ILE 100.A O no hydrogen 2.810 N/A ASP 271.A N ASP 267.A O no hydrogen 2.967 N/A ASN 272.A N GLN 268.A O no hydrogen 2.871 N/A MET 273.A N ILE 269.A O no hydrogen 2.806 N/A ALA 274.A N ARG 270.A O no hydrogen 2.912 N/A GLY 275.A N ASP 271.A O no hydrogen 2.974 N/A GLY 276.A N ASN 272.A O no hydrogen 3.017 N/A SER 277.A N ASN 272.A O no hydrogen 3.282 N/A SER 277.A OG ASN 272.A O no hydrogen 3.452 N/A