Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7w7x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 4.A N ASP 2.A OD1 no hydrogen 3.161 N/A GLU 5.A N ASP 2.A O no hydrogen 3.327 N/A MET 6.A N VAL 71.A O no hydrogen 2.847 N/A ASP 10.A N GLU 7.A O no hydrogen 2.875 N/A ILE 11.A N ARG 8.A O no hydrogen 3.061 N/A THR 12.A N VAL 29.A O no hydrogen 2.896 N/A LYS 14.A N GLU 27.A O no hydrogen 2.727 N/A LEU 17.A N VAL 25.A O no hydrogen 2.634 N/A GLY 20.A N LEU 17.A O no hydrogen 2.838 N/A GLN 21.A N GLY 18.A O no hydrogen 3.313 N/A TYR 22.A OH ARG 134.A O no hydrogen 2.577 N/A GLY 23.A N GLY 20.A O no hydrogen 2.959 N/A VAL 25.A N GLY 23.A O no hydrogen 2.836 N/A TYR 26.A N VAL 39.A O no hydrogen 2.810 N/A TYR 26.A OH GLU 24.A OE1 no hydrogen 2.665 N/A GLU 27.A N HIS 15.A O no hydrogen 3.002 N/A GLY 28.A N VAL 37.A O no hydrogen 2.893 N/A VAL 29.A N THR 12.A O no hydrogen 2.823 N/A TRP 30.A N LEU 35.A O no hydrogen 2.795 N/A LYS 31.A N ASP 10.A O no hydrogen 3.120 N/A LYS 31.A NZ THR 9.A O no hydrogen 2.830 N/A TYR 33.A N TRP 30.A O no hydrogen 3.158 N/A SER 34.A N LYS 31.A O no hydrogen 3.122 N/A LEU 35.A N TRP 30.A O no hydrogen 3.042 N/A VAL 37.A N GLY 28.A O no hydrogen 2.856 N/A ALA 38.A N THR 82.A O no hydrogen 2.881 N/A VAL 39.A N TYR 26.A O no hydrogen 2.835 N/A LYS 40.A N ILE 80.A O no hydrogen 2.864 N/A THR 41.A N GLU 24.A O no hydrogen 2.983 N/A GLU 48.A N GLU 46.A OE2 no hydrogen 3.032 N/A GLU 49.A N GLU 46.A OE1 no hydrogen 3.031 N/A PHE 50.A N GLU 46.A O no hydrogen 3.277 N/A LEU 51.A N VAL 47.A O no hydrogen 2.975 N/A LYS 52.A N GLU 48.A O no hydrogen 2.947 N/A GLU 53.A N GLU 49.A O no hydrogen 2.955 N/A ALA 54.A N PHE 50.A O no hydrogen 3.105 N/A ALA 55.A N LEU 51.A O no hydrogen 2.970 N/A VAL 56.A N LYS 52.A O no hydrogen 2.918 N/A MET 57.A N GLU 53.A O no hydrogen 3.019 N/A LYS 58.A N ALA 54.A O no hydrogen 3.052 N/A LYS 58.A NZ ASP 2.A OD2 no hydrogen 2.498 N/A GLU 59.A N VAL 56.A O no hydrogen 2.918 N/A ILE 60.A N MET 57.A O no hydrogen 3.034 N/A LYS 61.A N TYR 120.A OH no hydrogen 3.009 N/A ASN 64.A N HIS 62.A ND1 no hydrogen 2.945 N/A ASN 64.A ND2 VAL 144.A O no hydrogen 2.946 N/A LEU 65.A N HIS 62.A O no hydrogen 3.228 N/A VAL 66.A N VAL 146.A O no hydrogen 3.152 N/A GLN 67.A N GLU 83.A OE2 no hydrogen 2.746 N/A GLN 67.A NE2 LEU 68.A O no hydrogen 2.807 N/A LEU 69.A N ILE 81.A O no hydrogen 2.689 N/A GLY 70.A N ILE 81.A O no hydrogen 2.993 N/A VAL 71.A N TRP 4.A O no hydrogen 2.994 N/A CYS 72.A N TYR 79.A O no hydrogen 2.913 N/A CYS 72.A SG MET 6.A O no hydrogen 3.261 N/A THR 73.A N GLU 5.A OE2 no hydrogen 2.678 N/A THR 73.A OG1 GLU 5.A OE1 no hydrogen 2.678 N/A ARG 74.A N GLU 5.A OE2 no hydrogen 3.228 N/A TYR 79.A N CYS 72.A O no hydrogen 2.941 N/A ILE 80.A N LYS 40.A O no hydrogen 2.903 N/A ILE 81.A N GLY 70.A O no hydrogen 2.862 N/A THR 82.A N ALA 38.A O no hydrogen 2.913 N/A THR 82.A OG1 GLU 83.A O no hydrogen 2.941 N/A GLU 83.A N GLN 67.A O no hydrogen 3.118 N/A THR 86.A OG1 GLU 140.A OE2 no hydrogen 2.938 N/A TYR 87.A N VAL 138.A O no hydrogen 2.841 N/A GLY 88.A N MET 85.A O no hydrogen 3.160 N/A ASN 89.A ND2 ASP 92.A OD2 no hydrogen 2.954 N/A LEU 90.A N CYS 136.A O no hydrogen 2.764 N/A ASP 92.A N ASN 89.A OD1 no hydrogen 2.930 N/A TYR 93.A N ASN 89.A O no hydrogen 3.114 N/A TYR 93.A OH HIS 142.A ND1 no hydrogen 2.828 N/A LEU 94.A N LEU 90.A O no hydrogen 2.871 N/A ARG 95.A N LEU 91.A O no hydrogen 2.992 N/A ARG 95.A NE GLY 202.A O no hydrogen 2.667 N/A ARG 95.A NH2 GLY 202.A O no hydrogen 2.880 N/A GLU 96.A N ASP 92.A O no hydrogen 2.933 N/A CYS 97.A SG LEU 94.A O no hydrogen 3.336 N/A GLN 100.A N ASN 98.A OD1 no hydrogen 2.886 N/A GLU 101.A N ASN 98.A O no hydrogen 2.988 N/A VAL 102.A N ASN 98.A O no hydrogen 2.857 N/A VAL 106.A N ASN 103.A OD1 no hydrogen 3.444 N/A LEU 107.A N ASN 103.A O no hydrogen 3.017 N/A LEU 108.A N ALA 104.A O no hydrogen 3.045 N/A TYR 109.A N VAL 105.A O no hydrogen 2.943 N/A MET 110.A N VAL 106.A O no hydrogen 2.871 N/A ALA 111.A N LEU 107.A O no hydrogen 3.015 N/A THR 112.A N LEU 108.A O no hydrogen 2.902 N/A THR 112.A OG1 LEU 108.A O no hydrogen 2.759 N/A GLN 113.A N TYR 109.A O no hydrogen 2.974 N/A GLN 113.A NE2 TYR 109.A O no hydrogen 3.321 N/A GLN 113.A NE2 HIS 142.A O no hydrogen 3.033 N/A ILE 114.A N MET 110.A O no hydrogen 3.010 N/A SER 115.A N ALA 111.A O no hydrogen 2.920 N/A SER 115.A OG ALA 111.A O no hydrogen 3.029 N/A SER 115.A OG THR 112.A O no hydrogen 2.965 N/A SER 116.A N THR 112.A O no hydrogen 2.903 N/A SER 116.A OG HIS 62.A NE2 no hydrogen 3.012 N/A ALA 117.A N GLN 113.A O no hydrogen 3.056 N/A MET 118.A N ILE 114.A O no hydrogen 2.982 N/A GLU 119.A N SER 115.A O no hydrogen 2.877 N/A TYR 120.A N SER 116.A O no hydrogen 3.003 N/A LEU 121.A N ALA 117.A O no hydrogen 2.965 N/A GLU 122.A N MET 118.A O no hydrogen 2.873 N/A LYS 123.A N GLU 119.A O no hydrogen 2.951 N/A LYS 123.A NZ GLU 119.A OE2 no hydrogen 3.235 N/A LYS 124.A N TYR 120.A O no hydrogen 2.930 N/A PHE 126.A N LEU 121.A O no hydrogen 2.989 N/A ILE 127.A N SER 152.A O no hydrogen 3.000 N/A HIS 128.A N ASP 187.A OD2 no hydrogen 2.682 N/A HIS 128.A NE2 ALA 147.A O no hydrogen 2.718 N/A ARG 129.A N ASP 187.A OD1 no hydrogen 2.842 N/A ARG 129.A NH2 SER 152.A OG no hydrogen 3.003 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 3.059 N/A ALA 133.A N GLU 197.A OE1 no hydrogen 2.840 N/A ARG 134.A NH2 ASP 130.A OD1 no hydrogen 3.094 N/A ASN 135.A N ALA 132.A O no hydrogen 2.976 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.763 N/A CYS 136.A N ALA 133.A O no hydrogen 3.094 N/A CYS 136.A SG ALA 132.A O no hydrogen 3.647 N/A LEU 137.A N LYS 145.A O no hydrogen 2.821 N/A VAL 138.A N GLY 88.A O no hydrogen 2.861 N/A GLY 139.A N LEU 143.A O no hydrogen 2.877 N/A GLU 140.A N GLU 140.A OE1 no hydrogen 2.745 N/A HIS 142.A ND1 TYR 93.A OH no hydrogen 2.828 N/A LEU 143.A N GLU 140.A O no hydrogen 3.208 N/A VAL 144.A N GLN 113.A OE1 no hydrogen 2.850 N/A LYS 145.A N LEU 137.A O no hydrogen 2.880 N/A LYS 145.A NZ GLU 83.A OE1 no hydrogen 2.877 N/A LYS 145.A NZ GLU 83.A OE2 no hydrogen 2.782 N/A VAL 146.A N ASN 64.A O no hydrogen 2.719 N/A ALA 147.A N ASN 135.A O no hydrogen 2.982 N/A SER 152.A N ILE 127.A O no hydrogen 3.098 N/A ARG 153.A NH1 GLU 59.A OE1 no hydrogen 2.770 N/A ARG 153.A NH1 GLU 59.A OE2 no hydrogen 3.130 N/A ARG 153.A NH2 GLU 59.A OE2 no hydrogen 2.643 N/A LEU 154.A N ASN 125.A O no hydrogen 2.929 N/A THR 156.A N ASN 125.A OD1 no hydrogen 2.755 N/A THR 156.A OG1 GLU 122.A O no hydrogen 2.410 N/A THR 156.A OG1 ASN 125.A OD1 no hydrogen 3.093 N/A ASP 158.A N MET 155.A O no hydrogen 2.682 N/A ALA 161.A N ASN 180.A O no hydrogen 2.790 N/A ALA 165.A N HIS 162.A O no hydrogen 3.137 N/A LYS 170.A NZ PRO 205.A O no hydrogen 3.468 N/A LYS 170.A NZ TYR 206.A O no hydrogen 2.744 N/A LYS 170.A NZ ILE 209.A O no hydrogen 3.160 N/A TRP 171.A N PRO 168.A O no hydrogen 2.967 N/A TRP 171.A NE1 GLU 197.A OE1 no hydrogen 2.891 N/A THR 172.A N ILE 169.A O no hydrogen 3.047 N/A THR 172.A OG1 PRO 168.A O no hydrogen 2.582 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.796 N/A SER 176.A OG LYS 181.A O no hydrogen 2.609 N/A LEU 177.A N ALA 173.A O no hydrogen 2.904 N/A ALA 178.A N PRO 174.A O no hydrogen 2.905 N/A TYR 179.A N GLU 175.A O no hydrogen 2.938 N/A ASN 180.A N SER 176.A O no hydrogen 2.883 N/A ASN 180.A ND2 ALA 161.A O no hydrogen 3.115 N/A LYS 181.A N GLU 175.A O no hydrogen 3.326 N/A SER 183.A N SER 186.A OG no hydrogen 2.792 N/A LYS 185.A N SER 183.A OG no hydrogen 3.064 N/A LYS 185.A NZ ARG 249.A O no hydrogen 3.004 N/A SER 186.A N SER 183.A O no hydrogen 3.005 N/A SER 186.A OG SER 183.A O no hydrogen 2.732 N/A ASP 187.A N SER 183.A O no hydrogen 3.204 N/A VAL 188.A N ILE 184.A O no hydrogen 2.916 N/A TRP 189.A N LYS 185.A O no hydrogen 3.029 N/A ALA 190.A N SER 186.A O no hydrogen 3.039 N/A PHE 191.A N ASP 187.A O no hydrogen 2.864 N/A GLY 192.A N VAL 188.A O no hydrogen 2.985 N/A VAL 193.A N TRP 189.A O no hydrogen 3.125 N/A LEU 194.A N ALA 190.A O no hydrogen 2.864 N/A LEU 195.A N PHE 191.A O no hydrogen 2.834 N/A TRP 196.A N GLY 192.A O no hydrogen 3.057 N/A GLU 197.A N VAL 193.A O no hydrogen 2.897 N/A ILE 198.A N LEU 194.A O no hydrogen 2.895 N/A ALA 199.A N LEU 195.A O no hydrogen 2.928 N/A THR 200.A N TRP 196.A O no hydrogen 3.063 N/A THR 200.A OG1 TRP 196.A O no hydrogen 2.932 N/A THR 200.A OG1 GLU 197.A O no hydrogen 3.209 N/A TYR 201.A N ILE 198.A O no hydrogen 3.076 N/A TYR 201.A OH VAL 102.A O no hydrogen 2.578 N/A GLY 202.A N GLU 197.A O no hydrogen 2.691 N/A MET 203.A N THR 200.A OG1 no hydrogen 3.173 N/A ILE 209.A N TYR 206.A O no hydrogen 3.092 N/A SER 212.A N ASP 210.A OD1 no hydrogen 3.068 N/A SER 212.A OG ASP 210.A OD1 no hydrogen 2.865 N/A SER 212.A OG ASP 210.A OD2 no hydrogen 2.593 N/A GLN 213.A N ASP 210.A O no hydrogen 2.932 N/A GLN 213.A NE2 ASP 210.A OD2 no hydrogen 3.162 N/A VAL 214.A N LEU 211.A O no hydrogen 3.082 N/A LEU 217.A N GLN 213.A O no hydrogen 2.941 N/A LEU 218.A N VAL 214.A O no hydrogen 2.899 N/A GLU 219.A N TYR 215.A O no hydrogen 2.950 N/A LYS 220.A N GLU 216.A O no hydrogen 3.290 N/A LYS 220.A N LEU 217.A O no hydrogen 3.001 N/A ASP 221.A N LEU 218.A O no hydrogen 3.078 N/A TYR 222.A N LEU 217.A O no hydrogen 3.014 N/A ARG 223.A NE TRP 242.A O no hydrogen 2.929 N/A ARG 223.A NH1 LEU 218.A O no hydrogen 3.023 N/A ARG 223.A NH1 TYR 222.A O no hydrogen 2.808 N/A ARG 223.A NH2 TRP 242.A O no hydrogen 2.967 N/A ARG 226.A NH1 CYS 230.A O no hydrogen 2.941 N/A CYS 230.A N PRO 227.A O no hydrogen 3.043 N/A CYS 230.A SG PRO 231.A O no hydrogen 3.674 N/A TYR 235.A N PRO 231.A O no hydrogen 3.073 N/A TYR 235.A OH MET 224.A O no hydrogen 2.637 N/A GLU 236.A N GLU 232.A O no hydrogen 2.867 N/A LEU 237.A N LYS 233.A O no hydrogen 3.041 N/A MET 238.A N VAL 234.A O no hydrogen 2.915 N/A ARG 239.A N TYR 235.A O no hydrogen 2.869 N/A ARG 239.A NH1 TYR 235.A OH no hydrogen 2.935 N/A ALA 240.A N GLU 236.A O no hydrogen 2.911 N/A CYS 241.A N LEU 237.A O no hydrogen 2.964 N/A CYS 241.A SG LEU 237.A O no hydrogen 3.324 N/A TRP 242.A N MET 238.A O no hydrogen 3.166 N/A TRP 242.A N ARG 239.A O no hydrogen 3.068 N/A GLN 243.A N ALA 240.A O no hydrogen 3.266 N/A SER 247.A N ASN 245.A OD1 no hydrogen 3.368 N/A ASP 248.A N ASN 245.A O no hydrogen 2.835 N/A ARG 249.A N PRO 246.A O no hydrogen 3.123 N/A ARG 249.A NE GLN 243.A O no hydrogen 2.791 N/A ARG 249.A NH1 GLU 175.A OE2 no hydrogen 2.799 N/A ARG 249.A NH1 LYS 185.A O no hydrogen 2.998 N/A ARG 249.A NH2 GLU 175.A OE1 no hydrogen 2.840 N/A ARG 249.A NH2 GLN 243.A O no hydrogen 3.203 N/A ARG 249.A NH2 TRP 244.A O no hydrogen 2.983 N/A SER 251.A N GLU 254.A OE1 no hydrogen 3.006 N/A PHE 252.A N GLU 122.A OE2 no hydrogen 2.749 N/A ALA 253.A N GLU 122.A OE1 no hydrogen 3.167 N/A GLU 254.A N SER 251.A OG no hydrogen 3.135 N/A ILE 255.A N SER 251.A O no hydrogen 3.069 N/A HIS 256.A N PHE 252.A O no hydrogen 2.849 N/A GLN 257.A N ALA 253.A O no hydrogen 2.988 N/A GLN 257.A NE2 GLN 257.A O no hydrogen 3.015 N/A GLN 257.A NE2 THR 261.A OG1 no hydrogen 3.338 N/A ALA 258.A N GLU 254.A O no hydrogen 2.990 N/A PHE 259.A N ILE 255.A O no hydrogen 2.965 N/A GLU 260.A N HIS 256.A O no hydrogen 2.829 N/A THR 261.A N GLN 257.A O no hydrogen 2.981 N/A THR 261.A OG1 GLN 257.A O no hydrogen 3.123 N/A MET 262.A N ALA 258.A O no hydrogen 3.001 N/A PHE 263.A N PHE 259.A O no hydrogen 2.813 N/A GLN 264.A N GLU 260.A O no hydrogen 2.896 N/A GLU 265.A N THR 261.A O no hydrogen 2.888 N/A SER 266.A N PHE 263.A O no hydrogen 3.072 N/A SER 266.A OG MET 262.A O no hydrogen 3.095 N/A