Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2w05_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 2.A OE2 no hydrogen 3.479 N/A PHE 4.A N MET 1.A O no hydrogen 2.938 N/A GLN 5.A N ARG 22.A O no hydrogen 2.799 N/A VAL 7.A N LYS 20.A O no hydrogen 2.608 N/A GLU 8.A N LYS 20.A O no hydrogen 3.183 N/A GLY 11.A N VAL 18.A O no hydrogen 3.230 N/A GLY 16.A N GLY 13.A O no hydrogen 3.374 N/A VAL 17.A N LYS 34.A O no hydrogen 3.243 N/A VAL 18.A N GLY 11.A O no hydrogen 3.093 N/A TYR 19.A N LEU 32.A O no hydrogen 2.701 N/A LYS 20.A N GLU 8.A O no hydrogen 2.619 N/A ALA 21.A N VAL 30.A O no hydrogen 2.976 N/A ARG 22.A N GLN 5.A O no hydrogen 2.826 N/A ASN 23.A N GLU 28.A O no hydrogen 2.813 N/A LYS 24.A N ASN 3.A O no hydrogen 2.729 N/A LYS 24.A NZ PHE 4.A O no hydrogen 3.050 N/A LEU 25.A N ASN 23.A OD1 no hydrogen 2.885 N/A THR 26.A N ASN 23.A OD1 no hydrogen 3.264 N/A GLY 27.A N ASN 23.A O no hydrogen 2.615 N/A GLU 28.A N THR 26.A OG1 no hydrogen 3.053 N/A VAL 30.A N ALA 21.A O no hydrogen 2.819 N/A ALA 31.A N PHE 71.A O no hydrogen 2.980 N/A LEU 32.A N TYR 19.A O no hydrogen 2.700 N/A LYS 33.A N LEU 69.A O no hydrogen 2.848 N/A LYS 33.A NZ ASP 136.A OD2 no hydrogen 2.403 N/A LYS 34.A N VAL 17.A O no hydrogen 2.837 N/A ILE 35.A N LEU 67.A O no hydrogen 2.942 N/A ARG 36.A N TYR 15.A O no hydrogen 3.133 N/A ARG 41.A N SER 37.A O no hydrogen 3.432 N/A GLU 42.A N THR 38.A O no hydrogen 3.084 N/A ILE 43.A N ALA 39.A O no hydrogen 2.715 N/A SER 44.A N ILE 40.A O no hydrogen 2.951 N/A SER 44.A OG ILE 40.A O no hydrogen 2.855 N/A LEU 45.A N ARG 41.A O no hydrogen 3.074 N/A LEU 46.A N ILE 43.A O no hydrogen 2.963 N/A LYS 47.A N SER 44.A O no hydrogen 3.009 N/A LEU 49.A N LEU 46.A O no hydrogen 2.840 N/A ASN 50.A N GLU 48.A O no hydrogen 2.850 N/A ASN 50.A ND2 LYS 47.A O no hydrogen 3.486 N/A HIS 51.A NE2 ASN 53.A OD1 no hydrogen 3.120 N/A ASN 53.A ND2 GLN 101.A OE1 no hydrogen 3.199 N/A ASN 53.A ND2 ILE 132.A O no hydrogen 3.104 N/A ILE 54.A N HIS 51.A O no hydrogen 2.960 N/A VAL 55.A N LEU 134.A O no hydrogen 2.805 N/A LYS 56.A N GLU 72.A OE2 no hydrogen 3.026 N/A LEU 58.A N VAL 70.A O no hydrogen 2.727 N/A ASP 59.A N VAL 70.A O no hydrogen 3.216 N/A ILE 61.A N TYR 68.A O no hydrogen 2.757 N/A THR 63.A N LYS 66.A O no hydrogen 2.865 N/A THR 63.A OG1 GLU 64.A OE1 no hydrogen 3.524 N/A LYS 66.A N THR 63.A O no hydrogen 2.752 N/A TYR 68.A N ILE 61.A O no hydrogen 2.725 N/A LEU 69.A N LYS 33.A O no hydrogen 2.886 N/A VAL 70.A N ASP 59.A O no hydrogen 2.893 N/A PHE 71.A N ALA 31.A O no hydrogen 2.816 N/A GLU 72.A N LYS 56.A O no hydrogen 2.905 N/A LEU 78.A N LEU 124.A O no hydrogen 2.749 N/A LYS 79.A N PRO 121.A O no hydrogen 3.409 N/A LYS 79.A NZ ASP 83.A OD1 no hydrogen 2.757 N/A LYS 79.A NZ ASP 83.A OD2 no hydrogen 3.200 N/A LYS 80.A N ASP 77.A OD1 no hydrogen 2.642 N/A PHE 81.A N ASP 77.A O no hydrogen 3.231 N/A MET 82.A N LEU 78.A O no hydrogen 2.754 N/A ASP 83.A N LYS 79.A O no hydrogen 2.952 N/A ALA 84.A N LYS 80.A O no hydrogen 3.026 N/A SER 85.A N MET 82.A O no hydrogen 2.892 N/A SER 85.A OG PHE 81.A O no hydrogen 2.779 N/A GLY 89.A N SER 85.A O no hydrogen 2.385 N/A LEU 94.A N PRO 91.A O no hydrogen 2.835 N/A ILE 95.A N PRO 91.A O no hydrogen 3.002 N/A LYS 96.A N LEU 92.A O no hydrogen 2.798 N/A LYS 96.A NZ PHE 263.A O no hydrogen 3.157 N/A LYS 96.A NZ ASP 266.A OD1 no hydrogen 2.779 N/A SER 97.A N PRO 93.A O no hydrogen 3.071 N/A SER 97.A OG THR 268.A O no hydrogen 3.307 N/A TYR 98.A N LEU 94.A O no hydrogen 2.985 N/A LEU 99.A N ILE 95.A O no hydrogen 2.948 N/A PHE 100.A N LYS 96.A O no hydrogen 2.962 N/A GLN 101.A N SER 97.A O no hydrogen 2.962 N/A GLN 101.A NE2 SER 97.A O no hydrogen 3.464 N/A GLN 101.A NE2 SER 97.A OG no hydrogen 2.967 N/A GLN 101.A NE2 GLY 130.A O no hydrogen 2.962 N/A LEU 102.A N TYR 98.A O no hydrogen 2.941 N/A LEU 103.A N LEU 99.A O no hydrogen 2.945 N/A GLN 104.A N PHE 100.A O no hydrogen 3.054 N/A GLY 105.A N GLN 101.A O no hydrogen 2.896 N/A LEU 106.A N LEU 102.A O no hydrogen 2.689 N/A ALA 107.A N LEU 103.A O no hydrogen 2.700 N/A PHE 108.A N GLN 104.A O no hydrogen 3.175 N/A CYS 109.A N GLY 105.A O no hydrogen 3.186 N/A CYS 109.A SG.A GLY 105.A O no hydrogen 3.493 N/A CYS 109.A SG.A LEU 106.A O no hydrogen 3.046 N/A CYS 109.A SG.B GLY 105.A O no hydrogen 3.457 N/A HIS 110.A N LEU 106.A O no hydrogen 2.815 N/A HIS 110.A NE2 ASP 163.A OD2 no hydrogen 2.841 N/A SER 111.A N ALA 107.A O no hydrogen 3.072 N/A SER 111.A OG PHE 108.A O no hydrogen 2.712 N/A SER 111.A OG HIS 112.A ND1 no hydrogen 2.975 N/A HIS 112.A N PHE 108.A O no hydrogen 3.362 N/A HIS 112.A N CYS 109.A O no hydrogen 3.052 N/A HIS 112.A ND1 PHE 108.A O no hydrogen 3.047 N/A HIS 112.A ND1 SER 111.A OG no hydrogen 2.975 N/A ARG 113.A N HIS 110.A O no hydrogen 2.887 N/A VAL 114.A N CYS 109.A O no hydrogen 2.802 N/A HIS 116.A N ASP 163.A OD2 no hydrogen 2.942 N/A ARG 117.A N ASP 163.A OD1 no hydrogen 2.852 N/A ARG 117.A NH1 TYR 158.A OH no hydrogen 2.650 N/A LYS 120.A NZ ASP 118.A OD2 no hydrogen 3.224 N/A ASN 123.A N LYS 120.A O no hydrogen 2.859 N/A LEU 124.A N PRO 121.A O no hydrogen 3.252 N/A LEU 125.A N LYS 133.A O no hydrogen 2.886 N/A ILE 126.A N GLN 76.A O no hydrogen 2.880 N/A ASN 127.A N ALA 131.A O no hydrogen 3.264 N/A GLY 130.A N ASN 127.A O no hydrogen 3.456 N/A ALA 131.A N ASN 127.A OD1 no hydrogen 3.042 N/A ILE 132.A N GLN 101.A OE1 no hydrogen 3.288 N/A LYS 133.A N LEU 125.A O no hydrogen 2.652 N/A LYS 133.A NZ GLU 72.A OE1 no hydrogen 2.758 N/A LYS 133.A NZ GLU 72.A OE2 no hydrogen 3.437 N/A LEU 134.A N ASN 53.A O no hydrogen 2.850 N/A ALA 135.A N ASN 123.A O no hydrogen 2.944 N/A TRP 145.A N THR 143.A OG1 no hydrogen 3.376 N/A TYR 146.A OH GLU 173.A OE2 no hydrogen 2.493 N/A ARG 147.A N LEU 144.A O no hydrogen 2.987 N/A GLU 150.A N GLU 150.A OE1 no hydrogen 2.664 N/A ILE 151.A N ALA 148.A O no hydrogen 3.119 N/A LEU 152.A N ALA 148.A O no hydrogen 3.286 N/A LEU 153.A N PRO 149.A O no hydrogen 2.838 N/A GLY 154.A N ILE 151.A O no hydrogen 2.987 N/A CYS 155.A N GLU 150.A O no hydrogen 2.845 N/A ALA 161.A N SER 159.A OG no hydrogen 3.260 N/A VAL 162.A N SER 159.A O no hydrogen 2.987 N/A ASP 163.A N THR 160.A O no hydrogen 2.992 N/A TRP 165.A N ALA 161.A O no hydrogen 3.123 N/A SER 166.A N VAL 162.A O no hydrogen 3.116 N/A SER 166.A OG TYR 146.A O no hydrogen 2.634 N/A SER 166.A OG VAL 162.A O no hydrogen 3.272 N/A LEU 167.A N ASP 163.A O no hydrogen 2.953 N/A GLY 168.A N ILE 164.A O no hydrogen 2.860 N/A CYS 169.A N TRP 165.A O no hydrogen 3.036 N/A CYS 169.A SG TRP 165.A O no hydrogen 3.449 N/A ILE 170.A N SER 166.A O no hydrogen 3.007 N/A PHE 171.A N LEU 167.A O no hydrogen 2.894 N/A ALA 172.A N GLY 168.A O no hydrogen 3.037 N/A GLU 173.A N CYS 169.A O no hydrogen 3.033 N/A MET 174.A N ILE 170.A O no hydrogen 2.937 N/A VAL 175.A N PHE 171.A O no hydrogen 3.133 N/A THR 176.A N ALA 172.A O no hydrogen 2.923 N/A THR 176.A OG1 ALA 172.A O no hydrogen 3.162 N/A ARG 177.A N GLU 173.A O no hydrogen 2.698 N/A ARG 177.A NH2 ALA 86.A O no hydrogen 3.194 N/A GLY 183.A N PHE 181.A O no hydrogen 2.995 N/A ASP 184.A N ASP 188.A OD2 no hydrogen 3.094 N/A ASP 188.A N SER 185.A OG no hydrogen 3.063 N/A GLN 189.A N SER 185.A O no hydrogen 2.907 N/A GLN 189.A NE2 TRP 145.A O no hydrogen 3.292 N/A GLN 189.A NE2 PHE 181.A O no hydrogen 3.012 N/A LEU 190.A N GLU 186.A O no hydrogen 3.051 N/A PHE 191.A N ILE 187.A O no hydrogen 2.879 N/A ARG 192.A N ASP 188.A O no hydrogen 2.822 N/A ARG 192.A NE ASP 188.A OD2 no hydrogen 2.810 N/A ILE 193.A N GLN 189.A O no hydrogen 3.118 N/A PHE 194.A N LEU 190.A O no hydrogen 2.919 N/A ARG 195.A N PHE 191.A O no hydrogen 2.984 N/A THR 196.A N ARG 192.A O no hydrogen 3.402 N/A THR 196.A N ILE 193.A O no hydrogen 3.242 N/A THR 196.A OG1 ARG 192.A O no hydrogen 3.397 N/A LEU 197.A N ILE 193.A O no hydrogen 2.836 N/A GLY 198.A N PHE 194.A O no hydrogen 2.621 N/A THR 199.A N TRP 221.A O no hydrogen 2.934 N/A THR 199.A OG1 PRO 219.A O no hydrogen 2.705 N/A VAL 203.A N ASP 201.A OD2 no hydrogen 3.096 N/A VAL 204.A N ASP 201.A OD2 no hydrogen 3.207 N/A TRP 205.A N ASP 201.A O no hydrogen 2.827 N/A GLY 207.A N GLU 202.A OE1 no hydrogen 2.732 N/A VAL 208.A N TRP 205.A O no hydrogen 3.040 N/A THR 209.A N GLU 202.A OE2 no hydrogen 2.853 N/A THR 209.A OG1 GLU 202.A OE2 no hydrogen 2.489 N/A SER 210.A N GLY 207.A O no hydrogen 2.820 N/A SER 210.A OG GLY 207.A O no hydrogen 2.813 N/A MET 211.A N VAL 208.A O no hydrogen 3.138 N/A ASP 213.A N LEU 153.A O no hydrogen 2.919 N/A TYR 214.A N MET 211.A O no hydrogen 2.999 N/A LYS 215.A NZ ASP 213.A O no hydrogen 3.021 N/A PHE 218.A N LYS 215.A O no hydrogen 2.807 N/A TRP 221.A N THR 199.A OG1 no hydrogen 2.675 N/A ARG 223.A NH1 LEU 197.A O no hydrogen 3.167 N/A GLN 224.A N THR 196.A O no hydrogen 3.088 N/A LYS 228.A N ASP 225.A O no hydrogen 2.958 N/A VAL 229.A N PHE 226.A O no hydrogen 3.126 N/A VAL 230.A N PHE 226.A O no hydrogen 3.145 N/A LEU 233.A N VAL 230.A O no hydrogen 2.875 N/A GLY 237.A N ASP 234.A OD2 no hydrogen 2.929 N/A ARG 238.A N ASP 234.A O no hydrogen 2.993 N/A ARG 238.A NH2 GLU 235.A OE1 no hydrogen 2.458 N/A SER 239.A N GLU 235.A O no hydrogen 2.925 N/A SER 239.A OG HIS 261.A NE2 no hydrogen 3.298 N/A LEU 240.A N ASP 236.A O no hydrogen 2.997 N/A LEU 241.A N GLY 237.A O no hydrogen 2.786 N/A SER 242.A N ARG 238.A O no hydrogen 3.005 N/A SER 242.A OG ARG 238.A O no hydrogen 3.463 N/A SER 242.A OG SER 239.A O no hydrogen 2.695 N/A GLN 243.A N SER 239.A O no hydrogen 3.339 N/A GLN 243.A NE2 SER 239.A O no hydrogen 3.466 N/A MET 244.A N LEU 240.A O no hydrogen 3.039 N/A MET 244.A N LEU 241.A O no hydrogen 2.928 N/A LEU 245.A N SER 242.A O no hydrogen 3.315 N/A TYR 247.A OH GLY 198.A O no hydrogen 2.674 N/A ASN 250.A N ASP 248.A OD1 no hydrogen 2.911 N/A LYS 251.A N ASP 248.A O no hydrogen 2.766 N/A ARG 252.A N ASP 248.A O no hydrogen 2.896 N/A ARG 252.A NE HIS 246.A O no hydrogen 2.771 N/A ARG 252.A NH1 GLU 150.A OE1 no hydrogen 3.421 N/A ARG 252.A NH1 GLU 150.A OE2 no hydrogen 2.857 N/A ARG 252.A NH1 ALA 161.A O no hydrogen 2.931 N/A ARG 252.A NH2 GLU 150.A OE1 no hydrogen 2.813 N/A ARG 252.A NH2 GLU 150.A OE2 no hydrogen 3.512 N/A ARG 252.A NH2 HIS 246.A O no hydrogen 3.180 N/A ARG 252.A NH2 TYR 247.A O no hydrogen 3.039 N/A ILE 253.A N GLN 243.A O no hydrogen 2.960 N/A ALA 257.A N SER 254.A OG no hydrogen 3.061 N/A ALA 258.A N SER 254.A O no hydrogen 2.909 N/A LEU 259.A N ALA 255.A O no hydrogen 2.917 N/A LEU 259.A N LYS 256.A O no hydrogen 3.164 N/A ALA 260.A N ALA 257.A O no hydrogen 3.036 N/A HIS 261.A N ALA 258.A O no hydrogen 3.081 N/A HIS 261.A NE2 SER 239.A OG no hydrogen 3.298 N/A PHE 263.A N HIS 261.A ND1 no hydrogen 3.015 N/A PHE 264.A N HIS 261.A O no hydrogen 3.067 N/A GLN 265.A N PRO 262.A O no hydrogen 2.679 N/A VAL 267.A N PHE 264.A O no hydrogen 3.279 N/A