Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7k1i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N ASN 1.A O no hydrogen 3.033 N/A ARG 6.A N LEU 79.A O no hydrogen 2.958 N/A LEU 8.A N ILE 81.A O no hydrogen 2.787 N/A LYS 9.A N GLU 12.A OE1 no hydrogen 2.777 N/A GLU 12.A N LYS 9.A O no hydrogen 3.427 N/A PHE 13.A N GLU 10.A O no hydrogen 3.426 N/A LYS 14.A N LEU 31.A O no hydrogen 2.980 N/A LYS 14.A NZ PHE 13.A O no hydrogen 3.298 N/A LYS 15.A NZ GLN 88.A OE1 no hydrogen 2.826 N/A ILE 16.A N LYS 29.A O no hydrogen 3.027 N/A LYS 17.A N LYS 29.A O no hydrogen 3.207 N/A LEU 19.A N VAL 27.A O no hydrogen 2.722 N/A GLY 20.A N VAL 27.A O no hydrogen 3.336 N/A GLY 22.A N GLY 25.A O no hydrogen 3.061 N/A GLY 25.A N GLY 22.A O no hydrogen 3.177 N/A THR 26.A N GLU 47.A O no hydrogen 2.950 N/A VAL 27.A N GLY 20.A O no hydrogen 2.728 N/A TYR 28.A N ILE 45.A O no hydrogen 2.632 N/A LYS 29.A N LYS 17.A O no hydrogen 2.754 N/A GLY 30.A N VAL 43.A O no hydrogen 2.894 N/A LEU 31.A N LYS 14.A O no hydrogen 2.914 N/A TRP 32.A N ILE 41.A O no hydrogen 2.509 N/A TRP 32.A NE1 GLU 12.A OE2 no hydrogen 3.302 N/A ILE 33.A N GLU 12.A O no hydrogen 2.870 N/A GLU 37.A N PRO 34.A O no hydrogen 3.003 N/A ILE 41.A N TRP 32.A O no hydrogen 2.859 N/A VAL 43.A N GLY 30.A O no hydrogen 2.628 N/A ALA 44.A N THR 91.A O no hydrogen 2.988 N/A ILE 45.A N TYR 28.A O no hydrogen 2.847 N/A LYS 46.A N LEU 89.A O no hydrogen 2.812 N/A LYS 46.A NZ ASP 156.A OD1 no hydrogen 3.460 N/A GLU 47.A N THR 26.A O no hydrogen 2.920 N/A LEU 48.A N VAL 87.A O no hydrogen 2.853 N/A ARG 49.A N PHE 24.A O no hydrogen 3.073 N/A ARG 49.A NH1 GLY 22.A O no hydrogen 2.735 N/A THR 52.A N SER 85.A O no hydrogen 2.670 N/A THR 52.A OG1 ASN 57.A OD1 no hydrogen 2.757 N/A THR 52.A OG1 SER 85.A O no hydrogen 3.509 N/A ALA 56.A N SER 53.A OG no hydrogen 3.054 N/A ASN 57.A N SER 53.A O no hydrogen 2.856 N/A LYS 58.A N LYS 55.A O no hydrogen 3.104 N/A LYS 58.A NZ ASP 62.A OD1 no hydrogen 3.526 N/A LYS 58.A NZ ASP 62.A OD2 no hydrogen 3.305 N/A ILE 60.A N ALA 56.A O no hydrogen 3.181 N/A LEU 61.A N ASN 57.A O no hydrogen 2.806 N/A ASP 62.A N LYS 58.A O no hydrogen 3.141 N/A GLU 63.A N GLU 59.A O no hydrogen 3.229 N/A ALA 64.A N ILE 60.A O no hydrogen 2.757 N/A TYR 65.A N LEU 61.A O no hydrogen 3.017 N/A VAL 66.A N GLU 63.A O no hydrogen 2.909 N/A MET 67.A N GLU 63.A O no hydrogen 3.169 N/A ALA 68.A N ALA 64.A O no hydrogen 2.896 N/A SER 69.A N VAL 66.A O no hydrogen 2.816 N/A SER 69.A OG VAL 66.A O no hydrogen 2.203 N/A ASP 71.A N TYR 128.A OH no hydrogen 2.633 N/A HIS 74.A N ASN 72.A OD1 no hydrogen 2.842 N/A VAL 75.A N ASN 72.A O no hydrogen 3.221 N/A CYS 76.A N ILE 154.A O no hydrogen 2.824 N/A ARG 77.A NH1 LEU 4.A O no hydrogen 2.715 N/A ARG 77.A NH1 ALA 68.A O no hydrogen 2.790 N/A LEU 78.A N MET 67.A O no hydrogen 3.066 N/A LEU 79.A N ILE 90.A O no hydrogen 3.039 N/A GLY 80.A N ILE 90.A O no hydrogen 3.190 N/A ILE 81.A N ARG 6.A O no hydrogen 2.895 N/A CYS 82.A N GLN 88.A O no hydrogen 2.912 N/A CYS 82.A SG LEU 8.A O no hydrogen 3.499 N/A THR 84.A OG1 THR 86.A O no hydrogen 2.335 N/A THR 86.A OG1 GLU 47.A OE2 no hydrogen 2.974 N/A GLN 88.A N CYS 82.A O no hydrogen 2.967 N/A GLN 88.A NE2 THR 84.A OG1 no hydrogen 3.414 N/A LEU 89.A N LYS 46.A O no hydrogen 2.616 N/A ILE 90.A N GLY 80.A O no hydrogen 3.197 N/A THR 91.A N ALA 44.A O no hydrogen 3.074 N/A GLY 97.A N MET 94.A O no hydrogen 2.962 N/A LEU 99.A N VAL 144.A O no hydrogen 2.516 N/A LEU 100.A N ALA 141.A O no hydrogen 2.834 N/A TYR 102.A N CYS 98.A O no hydrogen 3.067 N/A VAL 103.A N LEU 99.A O no hydrogen 2.804 N/A ARG 104.A N LEU 100.A O no hydrogen 3.129 N/A ARG 104.A NE GLY 192.A O no hydrogen 2.779 N/A ARG 104.A NH2 GLY 192.A O no hydrogen 3.147 N/A GLU 105.A N ASP 101.A O no hydrogen 3.138 N/A HIS 106.A N VAL 103.A O no hydrogen 3.241 N/A HIS 106.A ND1 TYR 102.A O no hydrogen 2.883 N/A ASN 109.A N HIS 106.A O no hydrogen 2.707 N/A SER 112.A N ASP 265.A OD1 no hydrogen 3.093 N/A SER 112.A OG ASP 265.A OD1 no hydrogen 3.395 N/A SER 112.A OG ASP 265.A OD2 no hydrogen 2.514 N/A GLN 113.A NE2 ALA 253.A O no hydrogen 2.534 N/A LEU 115.A N GLY 111.A O no hydrogen 3.258 N/A LEU 116.A N SER 112.A O no hydrogen 2.978 N/A ASN 117.A N GLN 113.A O no hydrogen 3.046 N/A ASN 117.A ND2 GLN 113.A O no hydrogen 2.680 N/A TRP 118.A N TYR 114.A O no hydrogen 2.970 N/A TRP 118.A NE1 PRO 149.A O no hydrogen 2.962 N/A CYS 119.A N LEU 115.A O no hydrogen 3.151 N/A CYS 119.A SG LEU 115.A O no hydrogen 3.027 N/A VAL 120.A N LEU 116.A O no hydrogen 3.015 N/A GLN 121.A N ASN 117.A O no hydrogen 2.780 N/A GLN 121.A NE2 GLN 150.A O no hydrogen 2.817 N/A ILE 122.A N TRP 118.A O no hydrogen 2.895 N/A ALA 123.A N CYS 119.A O no hydrogen 3.032 N/A LYS 124.A N VAL 120.A O no hydrogen 2.792 N/A GLY 125.A N GLN 121.A O no hydrogen 3.050 N/A MET 126.A N ILE 122.A O no hydrogen 2.948 N/A ASN 127.A N ALA 123.A O no hydrogen 2.705 N/A TYR 128.A N LYS 124.A O no hydrogen 2.785 N/A LEU 129.A N GLY 125.A O no hydrogen 2.953 N/A GLU 130.A N MET 126.A O no hydrogen 2.919 N/A ASP 131.A N ASN 127.A O no hydrogen 3.081 N/A ARG 132.A N TYR 128.A O no hydrogen 2.964 N/A ARG 132.A NH1 SER 69.A O no hydrogen 3.108 N/A ARG 132.A NH1 TYR 128.A OH no hydrogen 2.996 N/A ARG 132.A NH2 SER 69.A OG no hydrogen 3.100 N/A ARG 133.A N GLU 130.A O no hydrogen 2.971 N/A LEU 134.A N LEU 129.A O no hydrogen 2.795 N/A HIS 136.A N ASP 177.A OD2 no hydrogen 2.571 N/A ARG 137.A N ASP 177.A OD1 no hydrogen 3.157 N/A ASP 138.A N HIS 136.A ND1 no hydrogen 3.170 N/A ALA 141.A N GLU 187.A OE1 no hydrogen 2.830 N/A ASN 143.A N ALA 140.A O no hydrogen 3.019 N/A ASN 143.A ND2 ASP 138.A O no hydrogen 2.940 N/A LEU 145.A N LYS 153.A O no hydrogen 2.771 N/A VAL 146.A N GLY 97.A O no hydrogen 2.865 N/A LYS 147.A N HIS 151.A O no hydrogen 3.024 N/A LYS 147.A NZ ASP 284.A OD1 no hydrogen 2.893 N/A LYS 147.A NZ GLU 286.A OE2 no hydrogen 2.782 N/A THR 148.A N HIS 151.A O no hydrogen 3.233 N/A GLN 150.A NE2 TYR 114.A OH no hydrogen 3.279 N/A HIS 151.A N THR 148.A O no hydrogen 2.933 N/A HIS 151.A ND1 ASP 284.A OD1 no hydrogen 3.077 N/A HIS 151.A ND1 ASP 284.A OD2 no hydrogen 2.367 N/A HIS 151.A NE2 PRO 73.A O no hydrogen 2.691 N/A VAL 152.A N GLN 121.A OE1 no hydrogen 2.835 N/A LYS 153.A N LEU 145.A O no hydrogen 2.962 N/A LYS 153.A NZ GLU 286.A OE2 no hydrogen 2.446 N/A ILE 154.A N HIS 74.A O no hydrogen 3.200 N/A THR 155.A N ASN 143.A O no hydrogen 3.007 N/A THR 155.A OG1 ASP 156.A OD1 no hydrogen 2.956 N/A GLY 158.A N HIS 136.A O no hydrogen 3.133 N/A ILE 162.A N VAL 160.A O no hydrogen 2.970 N/A LYS 163.A NZ TYR 196.A O no hydrogen 3.020 N/A LYS 163.A NZ ILE 199.A O no hydrogen 3.004 N/A TRP 164.A N PRO 161.A O no hydrogen 2.939 N/A TRP 164.A NE1 GLU 187.A OE1 no hydrogen 2.929 N/A MET 165.A N ILE 162.A O no hydrogen 3.210 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.963 N/A SER 169.A N ALA 166.A O no hydrogen 2.927 N/A SER 169.A OG ILE 171.A O no hydrogen 2.605 N/A ILE 170.A N ALA 166.A O no hydrogen 3.125 N/A THR 173.A N SER 176.A OG no hydrogen 2.577 N/A GLN 175.A N THR 173.A OG1 no hydrogen 3.218 N/A GLN 175.A NE2 ALA 236.A O no hydrogen 3.387 N/A GLN 175.A NE2 PRO 240.A O no hydrogen 3.510 N/A SER 176.A N THR 173.A OG1 no hydrogen 3.273 N/A SER 176.A OG THR 173.A O no hydrogen 2.325 N/A ASP 177.A N THR 173.A O no hydrogen 3.081 N/A VAL 178.A N HIS 174.A O no hydrogen 3.039 N/A TRP 179.A N GLN 175.A O no hydrogen 3.363 N/A SER 180.A N SER 176.A O no hydrogen 3.286 N/A SER 180.A OG TRP 164.A O no hydrogen 2.667 N/A SER 180.A OG SER 176.A O no hydrogen 3.394 N/A TYR 181.A N ASP 177.A O no hydrogen 2.670 N/A TYR 181.A OH CYS 119.A O no hydrogen 2.859 N/A GLY 182.A N VAL 178.A O no hydrogen 2.988 N/A VAL 183.A N TRP 179.A O no hydrogen 3.075 N/A THR 184.A N SER 180.A O no hydrogen 2.875 N/A THR 184.A OG1 SER 180.A O no hydrogen 2.749 N/A VAL 185.A N TYR 181.A O no hydrogen 2.841 N/A TRP 186.A N GLY 182.A O no hydrogen 2.890 N/A TRP 186.A NE1 PRO 215.A O no hydrogen 2.762 N/A GLU 187.A N VAL 183.A O no hydrogen 2.995 N/A LEU 188.A N THR 184.A O no hydrogen 3.131 N/A MET 189.A N VAL 185.A O no hydrogen 2.954 N/A THR 190.A N TRP 186.A O no hydrogen 3.011 N/A THR 190.A OG1 TRP 186.A O no hydrogen 2.760 N/A THR 190.A OG1 GLU 187.A O no hydrogen 3.240 N/A PHE 191.A N LEU 188.A O no hydrogen 2.806 N/A GLY 192.A N GLU 187.A O no hydrogen 2.708 N/A SER 193.A N THR 190.A OG1 no hydrogen 3.194 N/A SER 193.A OG THR 190.A O no hydrogen 3.081 N/A ILE 199.A N TYR 196.A O no hydrogen 3.213 N/A GLU 203.A N PRO 200.A O no hydrogen 3.061 N/A ILE 204.A N ALA 201.A O no hydrogen 3.116 N/A LEU 208.A N ILE 204.A O no hydrogen 2.988 N/A GLU 209.A N SER 205.A O no hydrogen 3.193 N/A LYS 210.A N SER 206.A O no hydrogen 3.204 N/A GLY 211.A N LEU 208.A O no hydrogen 3.179 N/A GLU 212.A N ILE 207.A O no hydrogen 3.054 N/A ARG 213.A NE TRP 232.A O no hydrogen 3.037 N/A ARG 213.A NH1 LEU 208.A O no hydrogen 3.002 N/A ARG 213.A NH1 GLU 212.A O no hydrogen 2.920 N/A ARG 213.A NH2 TRP 232.A O no hydrogen 2.957 N/A GLN 216.A NE2 CYS 220.A O no hydrogen 2.942 N/A CYS 220.A N PRO 217.A O no hydrogen 3.071 N/A THR 221.A OG1 TYR 259.A O no hydrogen 3.158 N/A TYR 225.A N THR 221.A O no hydrogen 3.183 N/A TYR 225.A OH LEU 214.A O no hydrogen 2.396 N/A MET 226.A N ILE 222.A O no hydrogen 2.668 N/A MET 228.A N VAL 224.A O no hydrogen 3.211 N/A ARG 229.A N TYR 225.A O no hydrogen 3.023 N/A ARG 229.A NH2 TYR 225.A OH no hydrogen 3.057 N/A LYS 230.A N MET 226.A O no hydrogen 2.969 N/A CYS 231.A N ILE 227.A O no hydrogen 3.095 N/A CYS 231.A SG ILE 227.A O no hydrogen 3.321 N/A TRP 232.A N ARG 229.A O no hydrogen 2.986 N/A MET 233.A N LYS 230.A O no hydrogen 3.437 N/A SER 238.A N ASP 235.A O no hydrogen 3.202 N/A SER 238.A OG ASP 235.A OD2 no hydrogen 2.921 N/A ARG 239.A N ALA 236.A O no hydrogen 3.051 N/A ARG 239.A NE MET 233.A O no hydrogen 2.702 N/A ARG 239.A NH1 GLU 168.A OE1 no hydrogen 3.403 N/A ARG 239.A NH1 GLU 168.A OE2 no hydrogen 2.893 N/A ARG 239.A NH1 GLN 175.A O no hydrogen 3.103 N/A ARG 239.A NH2 GLU 168.A OE1 no hydrogen 2.906 N/A ARG 239.A NH2 MET 233.A O no hydrogen 2.769 N/A LYS 241.A N GLU 244.A OE1 no hydrogen 3.315 N/A LYS 241.A NZ GLU 130.A OE1 no hydrogen 3.482 N/A LYS 241.A NZ GLU 130.A OE2 no hydrogen 2.494 N/A LEU 245.A N LYS 241.A O no hydrogen 2.974 N/A ILE 246.A N PHE 242.A O no hydrogen 2.995 N/A GLU 248.A N GLU 244.A O no hydrogen 2.993 N/A PHE 249.A N LEU 245.A O no hydrogen 3.019 N/A SER 250.A N ILE 246.A O no hydrogen 2.857 N/A SER 250.A OG ILE 246.A O no hydrogen 2.851 N/A LYS 251.A N ILE 247.A O no hydrogen 3.008 N/A MET 252.A N GLU 248.A O no hydrogen 3.086 N/A ALA 253.A N PHE 249.A O no hydrogen 3.053 N/A ALA 253.A N SER 250.A O no hydrogen 3.015 N/A ARG 254.A N SER 250.A O no hydrogen 3.178 N/A ARG 254.A N LYS 251.A O no hydrogen 3.199 N/A ASP 255.A N MET 252.A O no hydrogen 3.251 N/A ARG 258.A N ASP 255.A O no hydrogen 3.215 N/A TYR 259.A N PRO 256.A O no hydrogen 2.791 N/A LEU 260.A N PRO 256.A O no hydrogen 2.989 N/A VAL 261.A N ILE 219.A O no hydrogen 2.899 N/A ASP 265.A N ILE 262.A O no hydrogen 3.122 N/A ARG 267.A N GLY 264.A O no hydrogen 3.024 N/A MET 268.A N GLY 264.A O no hydrogen 3.081 N/A ASP 275.A N SER 272.A O no hydrogen 2.839 N/A SER 276.A N SER 272.A O no hydrogen 3.165 N/A ASN 277.A N PRO 273.A O no hydrogen 3.195 N/A PHE 278.A N THR 274.A O no hydrogen 3.412 N/A TYR 279.A N ASP 275.A O no hydrogen 2.970 N/A ARG 280.A N SER 276.A O no hydrogen 2.865 N/A ARG 280.A NH2 GLU 286.A O no hydrogen 2.419 N/A ARG 280.A NH2 ASP 287.A O no hydrogen 2.416 N/A ALA 281.A N ASN 277.A O no hydrogen 3.194 N/A MET 283.A N TYR 279.A O no hydrogen 3.069 N/A MET 283.A N ARG 280.A O no hydrogen 3.277 N/A ASP 284.A N ARG 280.A O no hydrogen 2.601 N/A ASP 287.A N ASP 287.A OD1 no hydrogen 2.313 N/A