Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1w2f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 2.A NE1 GLN 62.A O no hydrogen 2.953 N/A LEU 5.A N SER 1.A O no hydrogen 2.877 N/A ALA 6.A N TRP 2.A O no hydrogen 2.801 N/A GLY 7.A N GLN 4.A O no hydrogen 3.246 N/A HIS 8.A NE2 ASP 225.A OD2 no hydrogen 2.646 N/A SER 11.A N THR 9.A OG1 no hydrogen 3.062 N/A SER 11.A OG TYR 58.A OH no hydrogen 3.124 N/A LYS 13.A N LEU 22.A O no hydrogen 3.101 N/A LEU 20.A N THR 17.A O no hydrogen 3.331 N/A ILE 21.A N LEU 61.A O no hydrogen 2.774 N/A LEU 22.A N LYS 13.A O no hydrogen 2.752 N/A LYS 23.A N LEU 59.A O no hydrogen 2.966 N/A LYS 23.A NZ GLU 29.A OE1 no hydrogen 2.542 N/A LYS 23.A NZ GLU 29.A OE2 no hydrogen 2.981 N/A CYS 25.A N SER 57.A O no hydrogen 2.744 N/A CYS 25.A SG SER 26.A O no hydrogen 3.825 N/A GLU 29.A N SER 26.A OG no hydrogen 3.222 N/A ARG 30.A N SER 26.A O no hydrogen 2.841 N/A TYR 31.A N GLU 27.A O no hydrogen 2.875 N/A TYR 31.A OH HIS 202.A NE2 no hydrogen 2.417 N/A CYS 32.A N PRO 28.A O no hydrogen 2.868 N/A CYS 32.A SG PRO 28.A O no hydrogen 3.199 N/A CYS 32.A SG PHE 226.A O no hydrogen 3.659 N/A CYS 32.A SG THR 229.A O no hydrogen 3.149 N/A LEU 33.A N GLU 29.A O no hydrogen 2.810 N/A ALA 34.A N ARG 30.A O no hydrogen 2.929 N/A ARG 35.A N TYR 31.A O no hydrogen 2.986 N/A LEU 36.A N CYS 32.A O no hydrogen 2.665 N/A ASP 38.A N LEU 36.A O no hydrogen 2.971 N/A LEU 40.A N ASP 38.A OD2 no hydrogen 2.837 N/A ARG 41.A N ASP 38.A O no hydrogen 2.901 N/A ARG 41.A NE ASP 38.A O no hydrogen 2.907 N/A CYS 43.A N LEU 40.A O no hydrogen 2.675 N/A ALA 46.A N GLN 62.A OE1 no hydrogen 2.858 N/A HIS 48.A N GLN 60.A O no hydrogen 2.794 N/A VAL 51.A N TYR 58.A O no hydrogen 2.865 N/A ARG 53.A N GLU 56.A O no hydrogen 3.108 N/A GLU 56.A N ARG 53.A O no hydrogen 3.252 N/A SER 57.A OG GLU 52.A OE2 no hydrogen 2.655 N/A TYR 58.A N VAL 51.A O no hydrogen 2.781 N/A TYR 58.A OH SER 11.A OG no hydrogen 3.124 N/A LEU 59.A N LYS 23.A O no hydrogen 2.706 N/A GLN 60.A N GLY 49.A O no hydrogen 2.737 N/A LEU 61.A N ILE 21.A O no hydrogen 2.726 N/A GLN 62.A N ALA 46.A O no hydrogen 2.796 N/A ASP 63.A N GLY 19.A O no hydrogen 2.927 N/A LEU 65.A N ASP 63.A OD1 no hydrogen 3.016 N/A ASP 66.A N ASP 63.A O no hydrogen 2.917 N/A PHE 68.A N LEU 65.A O no hydrogen 2.870 N/A ASP 69.A N ASP 214.A OD2 no hydrogen 2.691 N/A CYS 72.A N HIS 213.A O no hydrogen 2.638 N/A VAL 73.A N LYS 145.A O no hydrogen 2.684 N/A LEU 74.A N PHE 211.A O no hydrogen 2.846 N/A ASP 75.A N GLY 143.A O no hydrogen 2.845 N/A CYS 76.A N LEU 209.A O no hydrogen 2.789 N/A CYS 76.A SG ARG 140.A O no hydrogen 3.795 N/A LYS 77.A N ARG 140.A O no hydrogen 2.708 N/A VAL 79.A N ASP 251.A O no hydrogen 2.748 N/A ARG 80.A NH1 TYR 82.A O no hydrogen 2.746 N/A ARG 80.A NH1 GLU 203.A OE2 no hydrogen 2.596 N/A ARG 80.A NH2 GLU 203.A OE2 no hydrogen 2.497 N/A ARG 80.A NH2 GLU 250.A O no hydrogen 2.885 N/A THR 81.A N GLU 129.A OE2 no hydrogen 2.609 N/A THR 81.A OG1 GLU 129.A OE2 no hydrogen 2.357 N/A LEU 83.A N GLU 86.A OE1 no hydrogen 2.861 N/A GLU 86.A N LEU 83.A O no hydrogen 2.880 N/A LEU 87.A N LEU 83.A O no hydrogen 3.064 N/A THR 88.A N GLU 84.A O no hydrogen 2.812 N/A THR 88.A OG1 GLU 84.A O no hydrogen 3.000 N/A LYS 89.A N GLU 85.A O no hydrogen 2.885 N/A ALA 90.A N GLU 86.A O no hydrogen 2.762 N/A ARG 91.A N LEU 87.A O no hydrogen 3.181 N/A ARG 91.A N THR 88.A O no hydrogen 3.028 N/A ARG 91.A NH2 GLU 246.A OE1 no hydrogen 2.941 N/A GLU 92.A N THR 88.A O no hydrogen 2.982 N/A ARG 93.A N LYS 89.A O no hydrogen 2.662 N/A ARG 97.A N VAL 120.A O no hydrogen 2.694 N/A ARG 97.A NE ASP 99.A OD1 no hydrogen 3.042 N/A ARG 97.A NH2 ASP 99.A OD2 no hydrogen 2.900 N/A TYR 100.A OH HIS 115.A ND1 no hydrogen 2.612 N/A LYS 101.A N LYS 98.A O no hydrogen 2.863 N/A LYS 102.A N ASP 99.A O no hydrogen 2.957 N/A ALA 104.A N LYS 101.A O no hydrogen 2.920 N/A VAL 105.A N LYS 102.A O no hydrogen 3.192 N/A GLU 108.A N ASP 106.A OD1 no hydrogen 2.896 N/A ALA 109.A N ASP 106.A O no hydrogen 2.891 N/A THR 111.A N GLU 114.A OE1 no hydrogen 2.857 N/A THR 111.A OG1 GLU 113.A OE1 no hydrogen 3.431 N/A GLU 114.A N THR 111.A OG1 no hydrogen 2.935 N/A HIS 115.A N THR 111.A O no hydrogen 2.894 N/A HIS 115.A ND1 TYR 100.A OH no hydrogen 2.612 N/A ALA 116.A N GLU 112.A O no hydrogen 2.945 N/A GLN 117.A N GLU 113.A O no hydrogen 2.848 N/A ARG 118.A N HIS 115.A O no hydrogen 3.250 N/A ALA 119.A N GLU 114.A O no hydrogen 3.302 N/A VAL 120.A N ARG 97.A O no hydrogen 3.028 N/A ARG 124.A N THR 121.A OG1 no hydrogen 3.077 N/A ARG 124.A NE GLU 114.A OE1 no hydrogen 2.888 N/A ARG 124.A NE GLU 114.A OE2 no hydrogen 2.637 N/A ARG 124.A NH2 ALA 109.A O no hydrogen 2.592 N/A ARG 124.A NH2 GLU 114.A OE1 no hydrogen 2.805 N/A TYR 125.A N THR 121.A O no hydrogen 2.839 N/A GLN 126.A NE2 TYR 82.A OH no hydrogen 2.931 N/A TRP 127.A N ARG 124.A O no hydrogen 2.934 N/A ARG 128.A N TYR 125.A O no hydrogen 2.748 N/A GLY 130.A N GLN 126.A O no hydrogen 3.036 N/A GLY 130.A N TRP 127.A O no hydrogen 3.043 N/A ILE 131.A N TRP 127.A O no hydrogen 3.027 N/A SER 132.A N ARG 128.A O no hydrogen 3.042 N/A SER 132.A OG ARG 128.A O no hydrogen 2.572 N/A SER 132.A OG GLU 129.A O no hydrogen 3.313 N/A SER 132.A OG SER 134.A OG no hydrogen 3.348 N/A SER 133.A OG PHE 139.A O no hydrogen 2.520 N/A SER 133.A OG THR 158.A O no hydrogen 3.512 N/A SER 134.A N SER 132.A OG no hydrogen 3.275 N/A SER 134.A OG SER 132.A OG no hydrogen 3.348 N/A THR 135.A N GLU 129.A O no hydrogen 2.998 N/A THR 136.A OG1 SER 133.A O no hydrogen 3.405 N/A LEU 137.A N SER 133.A O no hydrogen 2.693 N/A GLY 138.A N SER 133.A O no hydrogen 3.286 N/A GLY 138.A N SER 134.A O no hydrogen 2.720 N/A ARG 140.A N LYS 77.A O no hydrogen 2.774 N/A ARG 140.A NE GLU 142.A OE2 no hydrogen 2.575 N/A GLU 142.A N ASP 75.A O no hydrogen 2.749 N/A ILE 144.A N SER 152.A O no hydrogen 2.729 N/A LYS 145.A N VAL 73.A O no hydrogen 2.714 N/A LYS 146.A N SER 150.A O no hydrogen 2.767 N/A GLY 149.A N LYS 146.A O no hydrogen 2.959 N/A SER 150.A N ASP 148.A OD1 no hydrogen 2.842 N/A SER 150.A OG ASP 148.A OD1 no hydrogen 2.583 N/A CYS 151.A SG GLY 149.A O no hydrogen 3.822 N/A SER 152.A N ILE 144.A O no hydrogen 2.734 N/A ASP 154.A N SER 152.A OG no hydrogen 2.910 N/A PHE 155.A N THR 153.A O no hydrogen 2.749 N/A LYS 156.A NZ THR 153.A O no hydrogen 2.704 N/A THR 158.A N PHE 155.A O no hydrogen 2.903 N/A THR 158.A OG1 PHE 155.A O no hydrogen 3.150 N/A ARG 159.A N GLN 163.A OE1 no hydrogen 2.800 N/A ARG 159.A NH1 GLY 130.A O no hydrogen 2.887 N/A SER 160.A N GLN 163.A OE1 no hydrogen 2.855 N/A ARG 161.A NH1 SER 266.A OG no hydrogen 3.407 N/A ARG 161.A NH2 SER 266.A OG no hydrogen 2.716 N/A GLN 163.A N SER 160.A OG no hydrogen 2.887 N/A GLN 163.A NE2 THR 157.A O no hydrogen 3.429 N/A VAL 164.A N SER 160.A O no hydrogen 2.918 N/A LEU 165.A N ARG 161.A O no hydrogen 2.797 N/A ARG 166.A N GLU 162.A O no hydrogen 2.690 N/A VAL 167.A N GLN 163.A O no hydrogen 2.908 N/A PHE 168.A N VAL 164.A O no hydrogen 2.923 N/A GLU 169.A N LEU 165.A O no hydrogen 2.719 N/A GLU 170.A N ARG 166.A O no hydrogen 2.900 N/A PHE 171.A N VAL 167.A O no hydrogen 2.777 N/A VAL 172.A N PHE 168.A O no hydrogen 2.840 N/A GLN 173.A N GLU 169.A O no hydrogen 2.988 N/A ASP 175.A N VAL 172.A O no hydrogen 2.885 N/A GLU 176.A N GLU 176.A OE1 no hydrogen 2.688 N/A VAL 178.A N ASP 175.A OD1 no hydrogen 3.062 N/A LEU 179.A N ASP 175.A O no hydrogen 2.984 N/A ARG 180.A N GLU 176.A O no hydrogen 2.762 N/A ARG 181.A N GLU 177.A O no hydrogen 2.674 N/A ARG 181.A NH1 HIS 217.A O no hydrogen 2.775 N/A TYR 182.A N VAL 178.A O no hydrogen 2.706 N/A LEU 183.A N LEU 179.A O no hydrogen 2.791 N/A ASN 184.A N ARG 180.A O no hydrogen 2.775 N/A ARG 185.A N ARG 181.A O no hydrogen 2.732 N/A ARG 185.A NE VAL 221.A O no hydrogen 2.771 N/A ARG 185.A NH1 GLY 42.A O no hydrogen 3.523 N/A ARG 185.A NH1 GLN 188.A OE1 no hydrogen 2.757 N/A ARG 185.A NH2 GLY 42.A O no hydrogen 2.739 N/A ARG 185.A NH2 VAL 221.A O no hydrogen 2.903 N/A LEU 186.A N TYR 182.A O no hydrogen 2.715 N/A GLN 187.A N LEU 183.A O no hydrogen 2.782 N/A GLN 188.A N ASN 184.A O no hydrogen 2.921 N/A ILE 189.A N ARG 185.A O no hydrogen 2.641 N/A ARG 190.A N LEU 186.A O no hydrogen 2.689 N/A ARG 190.A NH1 ASP 258.A OD1 no hydrogen 2.696 N/A ARG 190.A NH2 GLN 187.A OE1 no hydrogen 2.809 N/A ASP 191.A N GLN 187.A O no hydrogen 2.926 N/A THR 192.A N GLN 188.A O no hydrogen 2.871 N/A THR 192.A OG1 GLN 188.A O no hydrogen 2.721 N/A LEU 193.A N ILE 189.A O no hydrogen 2.639 N/A GLU 194.A N ARG 190.A O no hydrogen 2.759 N/A VAL 195.A N THR 192.A O no hydrogen 3.106 N/A SER 196.A N LEU 193.A O no hydrogen 3.081 N/A SER 196.A OG ASP 38.A OD1 no hydrogen 3.240 N/A SER 196.A OG ASP 38.A OD2 no hydrogen 2.467 N/A PHE 198.A N ASP 38.A OD1 no hydrogen 2.896 N/A PHE 199.A N SER 196.A OG no hydrogen 2.805 N/A ARG 200.A N SER 196.A O no hydrogen 3.043 N/A ARG 201.A N GLU 197.A O no hydrogen 3.249 N/A ARG 201.A N PHE 198.A O no hydrogen 3.093 N/A HIS 202.A N PHE 199.A O no hydrogen 3.385 N/A HIS 202.A ND1 PHE 198.A O no hydrogen 2.417 N/A HIS 202.A NE2 TYR 31.A OH no hydrogen 2.417 N/A GLU 203.A N THR 230.A O no hydrogen 2.737 N/A VAL 204.A N ASP 251.A OD2 no hydrogen 2.832 N/A SER 208.A N ILE 224.A O no hydrogen 2.841 N/A SER 208.A OG ASP 75.A OD1 no hydrogen 2.445 N/A LEU 209.A N CYS 76.A O no hydrogen 2.770 N/A LEU 210.A N TRP 222.A O no hydrogen 2.643 N/A PHE 211.A N LEU 74.A O no hydrogen 2.792 N/A VAL 212.A N GLY 220.A O no hydrogen 2.797 N/A HIS 213.A N CYS 72.A O no hydrogen 2.834 N/A HIS 213.A NE2 PHE 171.A O no hydrogen 3.043 N/A ASP 214.A N ARG 218.A O no hydrogen 2.983 N/A HIS 215.A ND1 ASP 69.A O no hydrogen 2.996 N/A HIS 217.A N ASP 214.A O no hydrogen 2.790 N/A HIS 217.A ND1 ASP 175.A OD1 no hydrogen 2.937 N/A HIS 217.A ND1 ASP 175.A OD2 no hydrogen 2.621 N/A ARG 218.A N ASP 214.A OD1 no hydrogen 2.992 N/A ARG 218.A NE ASP 214.A OD2 no hydrogen 2.733 N/A GLY 220.A N VAL 212.A O no hydrogen 2.712 N/A TRP 222.A N LEU 210.A O no hydrogen 2.943 N/A LEU 223.A N CYS 43.A O no hydrogen 2.755 N/A ILE 224.A N SER 208.A O no hydrogen 2.816 N/A PHE 226.A N GLU 29.A OE2 no hydrogen 2.919 N/A GLY 227.A N ASP 225.A OD1 no hydrogen 3.227 N/A LYS 228.A NZ GLU 86.A OE1 no hydrogen 2.680 N/A LYS 228.A NZ GLU 86.A OE2 no hydrogen 3.046 N/A THR 229.A N PHE 226.A O no hydrogen 3.138 N/A THR 230.A N GLU 203.A O no hydrogen 2.882 N/A LEU 232.A N ARG 201.A O no hydrogen 2.766 N/A GLN 236.A N PRO 233.A O no hydrogen 2.853 N/A LEU 238.A N ARG 200.A O no hydrogen 3.029 N/A ASP 239.A N GLU 250.A OE2 no hydrogen 3.244 N/A HIS 240.A N GLU 250.A OE1 no hydrogen 2.918 N/A HIS 240.A ND1 ASP 251.A OD1 no hydrogen 2.652 N/A HIS 240.A NE2 PHE 199.A O no hydrogen 2.419 N/A ARG 241.A N ASP 239.A OD1 no hydrogen 2.894 N/A ARG 241.A NE ASP 258.A OD2 no hydrogen 2.605 N/A ARG 241.A NH1 GLU 194.A OE2 no hydrogen 3.267 N/A ARG 241.A NH2 GLU 194.A OE2 no hydrogen 2.646 N/A ARG 241.A NH2 ASP 258.A OD1 no hydrogen 3.035 N/A ARG 241.A NH2 ASP 258.A OD2 no hydrogen 3.395 N/A ARG 242.A N ASP 239.A OD1 no hydrogen 3.032 N/A ARG 242.A NH1 GLU 250.A OE2 no hydrogen 3.400 N/A TRP 244.A NE1 GLU 84.A OE2 no hydrogen 2.660 N/A GLU 245.A N ASN 248.A OD1 no hydrogen 3.161 N/A GLY 247.A N GLU 84.A OE1 no hydrogen 3.202 N/A GLY 247.A N GLU 84.A OE2 no hydrogen 2.862 N/A ASN 248.A N GLU 245.A O no hydrogen 2.840 N/A ASN 248.A ND2 PRO 243.A O no hydrogen 2.919 N/A ARG 249.A N GLU 84.A OE2 no hydrogen 2.884 N/A ARG 249.A NE GLU 203.A OE1 no hydrogen 2.888 N/A ARG 249.A NH2 GLU 203.A OE1 no hydrogen 2.923 N/A ARG 249.A NH2 PRO 231.A O no hydrogen 3.009 N/A GLU 250.A N ASN 248.A OD1 no hydrogen 2.903 N/A TYR 253.A N ASP 251.A OD1 no hydrogen 2.860 N/A LEU 254.A N HIS 240.A O no hydrogen 2.665 N/A LEU 255.A N HIS 240.A O no hydrogen 3.145 N/A GLY 256.A N GLY 252.A O no hydrogen 2.835 N/A LEU 257.A N TYR 253.A O no hydrogen 2.862 N/A ASP 258.A N LEU 254.A O no hydrogen 2.646 N/A ASN 259.A N LEU 255.A O no hydrogen 2.875 N/A LEU 260.A N GLY 256.A O no hydrogen 2.677 N/A ILE 261.A N LEU 257.A O no hydrogen 2.787 N/A GLY 262.A N ASP 258.A O no hydrogen 2.887 N/A ILE 263.A N ASN 259.A O no hydrogen 2.694 N/A LEU 264.A N LEU 260.A O no hydrogen 2.766 N/A ALA 265.A N ILE 261.A O no hydrogen 2.601 N/A SER 266.A N GLY 262.A O no hydrogen 2.702 N/A SER 266.A OG GLY 262.A O no hydrogen 2.999 N/A LEU 267.A N ILE 263.A O no hydrogen 2.713 N/A ALA 268.A N LEU 264.A O no hydrogen 2.739 N/A GLU 269.A N ALA 265.A O no hydrogen 3.211 N/A GLU 269.A N SER 266.A O no hydrogen 2.996 N/A ARG 270.A N LEU 267.A O no hydrogen 3.113 N/A ARG 270.A NH1 GLU 162.A OE1 no hydrogen 2.795 N/A ARG 270.A NH1 GLU 162.A OE2 no hydrogen 3.316 N/A ARG 270.A NH2 GLU 162.A OE2 no hydrogen 2.885 N/A