Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2r0o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N GLU 4.A OE2 no hydrogen 3.547 N/A GLU 4.A N PHE 1.A O no hydrogen 3.365 N/A LYS 5.A NZ ASP 200.A OD1 no hydrogen 3.122 N/A GLN 6.A N ALA 2.A O no hydrogen 3.426 N/A GLN 7.A N TRP 3.A O no hydrogen 2.883 N/A GLN 7.A NE2 ASP 208.A OD1 no hydrogen 3.241 N/A GLN 7.A NE2 ASP 208.A OD2 no hydrogen 2.997 N/A ARG 8.A N GLU 4.A O no hydrogen 2.875 N/A ARG 8.A NE ASP 30.A OD1 no hydrogen 3.079 N/A ARG 8.A NH2 ASP 30.A OD1 no hydrogen 3.203 N/A LYS 9.A N LYS 5.A O no hydrogen 3.197 N/A THR 10.A N GLN 6.A O no hydrogen 2.905 N/A THR 10.A OG1 GLN 6.A O no hydrogen 3.041 N/A THR 10.A OG1 MET 195.A O no hydrogen 2.643 N/A PHE 11.A N GLN 7.A O no hydrogen 2.831 N/A THR 12.A N ARG 8.A O no hydrogen 3.129 N/A THR 12.A OG1 ARG 8.A O no hydrogen 2.605 N/A ALA 13.A N LYS 9.A O no hydrogen 3.100 N/A TRP 14.A N THR 10.A O no hydrogen 2.891 N/A CYS 15.A N PHE 11.A O no hydrogen 2.923 N/A CYS 15.A SG PHE 11.A O no hydrogen 3.166 N/A ASN 16.A N THR 12.A O no hydrogen 2.874 N/A ASN 16.A ND2 ILE 26.A O no hydrogen 2.919 N/A SER 17.A N ALA 13.A O no hydrogen 2.959 N/A SER 17.A OG TRP 14.A O no hydrogen 2.497 N/A HIS 18.A N CYS 15.A O no hydrogen 3.217 N/A LEU 19.A N CYS 15.A O no hydrogen 2.825 N/A ARG 20.A N ASN 16.A O no hydrogen 3.095 N/A ARG 20.A NE SER 17.A O no hydrogen 2.922 N/A ARG 20.A NH1 ASP 191.A OD1 no hydrogen 2.874 N/A ARG 20.A NH2 ASP 191.A O no hydrogen 2.941 N/A ARG 20.A NH2 ASP 191.A OD1 no hydrogen 3.343 N/A LYS 21.A N HIS 18.A O no hydrogen 3.068 N/A LYS 21.A NZ HIS 18.A ND1 no hydrogen 2.869 N/A ALA 22.A N LEU 19.A O no hydrogen 2.898 N/A GLY 23.A N ARG 20.A O no hydrogen 3.072 N/A THR 24.A N LEU 19.A O no hydrogen 3.049 N/A THR 24.A OG1 GLN 25.A O no hydrogen 3.358 N/A GLN 25.A N THR 24.A OG1 no hydrogen 2.643 N/A ILE 26.A N ASN 16.A OD1 no hydrogen 2.766 N/A GLU 27.A N ASP 32.A OD2 no hydrogen 2.808 N/A ASN 28.A N ASP 32.A OD2 no hydrogen 2.748 N/A ASN 28.A ND2 ASP 30.A OD2 no hydrogen 2.566 N/A GLU 31.A N ASN 28.A O no hydrogen 3.014 N/A ASP 32.A N ASN 28.A O no hydrogen 2.814 N/A ARG 34.A N GLU 31.A O no hydrogen 3.205 N/A ARG 34.A NE VAL 90.A O no hydrogen 2.842 N/A ARG 34.A NH1 VAL 90.A O no hydrogen 3.418 N/A ARG 34.A NH2 GLU 31.A OE2.A no hydrogen 3.039 N/A GLY 36.A N PHE 33.A O no hydrogen 3.091 N/A LEU 37.A N ASP 35.A OD2 no hydrogen 2.995 N/A LYS 38.A NZ THR 24.A OG1 no hydrogen 3.123 N/A LYS 38.A NZ GLN 25.A O no hydrogen 2.717 N/A MET 40.A N GLY 36.A O no hydrogen 3.018 N/A LEU 41.A N LEU 37.A O no hydrogen 3.069 N/A LEU 42.A N LYS 38.A O no hydrogen 2.885 N/A LEU 43.A N LEU 39.A O no hydrogen 3.159 N/A GLU 44.A N MET 40.A O no hydrogen 3.045 N/A VAL 45.A N LEU 41.A O no hydrogen 3.080 N/A ILE 46.A N LEU 42.A O no hydrogen 3.126 N/A SER 47.A N LEU 43.A O no hydrogen 3.155 N/A SER 47.A OG LEU 43.A O no hydrogen 2.686 N/A GLY 48.A N GLU 44.A O no hydrogen 2.878 N/A GLU 49.A N SER 47.A OG no hydrogen 3.124 N/A LEU 51.A N GLU 44.A OE2 no hydrogen 2.816 N/A GLU 55.A N ASN 66.A OD1 no hydrogen 2.823 N/A MET 59.A N HIS 62.A ND1 no hydrogen 3.156 N/A ARG 60.A NE ASP 91.A OD1 no hydrogen 2.892 N/A ARG 60.A NH1 ASP 91.A OD1 no hydrogen 3.510 N/A ARG 60.A NH1 ASP 91.A OD2 no hydrogen 2.888 N/A LYS 63.A N MET 59.A O no hydrogen 3.370 N/A ILE 64.A N ARG 60.A O no hydrogen 2.983 N/A ASN 65.A N VAL 61.A O no hydrogen 2.769 N/A ASN 65.A ND2 GLU 55.A OE2 no hydrogen 2.839 N/A ASN 66.A N HIS 62.A O no hydrogen 2.826 N/A ASN 66.A ND2 ASP 35.A O no hydrogen 3.007 N/A ASN 66.A ND2 GLU 55.A O no hydrogen 2.900 N/A VAL 67.A N LYS 63.A O no hydrogen 2.916 N/A ASN 68.A N ILE 64.A O no hydrogen 2.840 N/A LYS 69.A N ASN 65.A O no hydrogen 2.997 N/A LYS 69.A NZ LYS 53.A O no hydrogen 2.733 N/A ALA 70.A N ASN 66.A O no hydrogen 3.175 N/A LEU 71.A N VAL 67.A O no hydrogen 2.902 N/A ASP 72.A N ASN 68.A O no hydrogen 2.765 N/A PHE 73.A N LYS 69.A O no hydrogen 3.126 N/A ILE 74.A N ALA 70.A O no hydrogen 3.050 N/A ALA 75.A N LEU 71.A O no hydrogen 2.917 N/A SER 76.A N ASP 72.A O no hydrogen 2.950 N/A SER 76.A OG PHE 73.A O no hydrogen 2.749 N/A LYS 77.A N ILE 74.A O no hydrogen 3.117 N/A LYS 77.A NZ GLU 49.A OE1 no hydrogen 2.923 N/A GLY 78.A N ALA 75.A O no hydrogen 2.961 N/A ILE 89.A N GLY 85.A O no hydrogen 3.375 N/A VAL 90.A N ALA 86.A O no hydrogen 2.942 N/A ASP 91.A N GLU 87.A O no hydrogen 2.838 N/A GLY 92.A N ILE 89.A O no hydrogen 3.125 N/A ASN 93.A N GLU 88.A O no hydrogen 2.880 N/A ASN 93.A ND2 GLU 88.A OE1 no hydrogen 2.731 N/A MET 96.A N ASN 93.A OD1 no hydrogen 3.048 N/A THR 97.A N ASN 93.A O no hydrogen 2.975 N/A THR 97.A OG1 ASN 93.A O no hydrogen 2.701 N/A LEU 98.A N ALA 94.A O no hydrogen 2.943 N/A GLY 99.A N LYS 95.A O no hydrogen 2.988 N/A MET 100.A N MET 96.A O no hydrogen 2.841 N/A ILE 101.A N THR 97.A O no hydrogen 2.981 N/A TRP 102.A N LEU 98.A O no hydrogen 2.968 N/A THR 103.A N GLY 99.A O no hydrogen 3.118 N/A THR 103.A OG1 GLY 99.A O no hydrogen 3.057 N/A ILE 104.A N MET 100.A O no hydrogen 3.128 N/A ILE 105.A N ILE 101.A O no hydrogen 2.970 N/A LEU 106.A N TRP 102.A O no hydrogen 2.867 N/A ARG 107.A N THR 103.A O no hydrogen 3.065 N/A ARG 107.A NE LYS 77.A O no hydrogen 2.786 N/A ARG 107.A NH1 ARG 107.A O no hydrogen 2.888 N/A ARG 107.A NH1 ASP 112.A OD2 no hydrogen 3.020 N/A ARG 107.A NH2 LYS 77.A O no hydrogen 3.285 N/A PHE 108.A N ILE 104.A O no hydrogen 2.924 N/A ALA 109.A N ILE 105.A O no hydrogen 2.873 N/A ILE 110.A N ILE 105.A O no hydrogen 3.286 N/A GLN 111.A N LEU 106.A O no hydrogen 2.742 N/A ILE 113.A N ILE 110.A O no hydrogen 2.997 N/A VAL 115.A N THR 118.A O no hydrogen 2.912 N/A THR 118.A N VAL 115.A O no hydrogen 2.877 N/A THR 118.A OG1 VAL 115.A O no hydrogen 2.781 N/A ALA 120.A N ILE 113.A O no hydrogen 2.977 N/A GLY 123.A N SER 119.A O no hydrogen 3.012 N/A LEU 124.A N ALA 120.A O no hydrogen 2.925 N/A LEU 125.A N LYS 121.A O no hydrogen 3.047 N/A LEU 126.A N GLU 122.A O no hydrogen 3.079 N/A TRP 127.A N GLY 123.A O no hydrogen 2.977 N/A CYS 128.A N LEU 124.A O no hydrogen 3.122 N/A CYS 128.A SG LEU 124.A O no hydrogen 3.257 N/A GLN 129.A N LEU 125.A O no hydrogen 2.930 N/A GLN 129.A NE2 VAL 140.A O no hydrogen 2.842 N/A ARG 130.A N LEU 126.A O no hydrogen 2.786 N/A ARG 130.A NE GLU 116.A OE1 no hydrogen 2.831 N/A ARG 130.A NH2 GLU 116.A OE1 no hydrogen 3.509 N/A ARG 130.A NH2 GLU 116.A OE2 no hydrogen 2.822 N/A LYS 131.A N TRP 127.A O no hydrogen 3.025 N/A THR 132.A N CYS 128.A O no hydrogen 3.019 N/A THR 132.A OG1 CYS 128.A O no hydrogen 2.560 N/A ALA 133.A N ARG 130.A O no hydrogen 3.466 N/A TYR 135.A N THR 132.A O no hydrogen 3.171 N/A TYR 135.A OH HIS 158.A ND1 no hydrogen 2.543 N/A VAL 138.A N TYR 135.A O no hydrogen 3.279 N/A GLN 141.A N SER 146.A OG no hydrogen 2.878 N/A GLN 141.A NE2 ASN 139.A OD1 no hydrogen 3.240 N/A HIS 144.A N ASN 142.A OD1 no hydrogen 2.854 N/A ILE 145.A N HIS 144.A ND1 no hydrogen 3.005 N/A SER 146.A N ASN 142.A OD1 no hydrogen 3.082 N/A SER 146.A OG ASN 139.A O no hydrogen 3.235 N/A TRP 147.A N HIS 144.A O no hydrogen 2.972 N/A TRP 147.A NE1 ASN 142.A O no hydrogen 2.785 N/A LYS 148.A N ILE 145.A O no hydrogen 3.377 N/A LYS 148.A NZ ILE 201.A O no hydrogen 3.176 N/A LYS 148.A NZ THR 204.A O no hydrogen 3.118 N/A GLY 150.A N TRP 147.A O no hydrogen 3.275 N/A LEU 151.A N ASP 149.A OD1 no hydrogen 3.099 N/A ASN 154.A N GLY 150.A O no hydrogen 3.307 N/A ASN 154.A ND2 GLY 150.A O no hydrogen 2.879 N/A ASN 154.A ND2 ASN 178.A O no hydrogen 2.826 N/A ALA 155.A N LEU 151.A O no hydrogen 2.760 N/A LEU 156.A N ALA 152.A O no hydrogen 2.832 N/A ILE 157.A N PHE 153.A O no hydrogen 3.137 N/A HIS 158.A N ASN 154.A O no hydrogen 2.872 N/A HIS 158.A ND1 TYR 135.A OH no hydrogen 2.543 N/A ARG 159.A N ALA 155.A O no hydrogen 2.922 N/A HIS 160.A N ILE 157.A O no hydrogen 3.247 N/A HIS 160.A ND1 LEU 156.A O no hydrogen 2.730 N/A ARG 161.A N ILE 157.A O no hydrogen 2.834 N/A ARG 161.A NE GLU 163.A OE2 no hydrogen 2.794 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.805 N/A LEU 164.A N ARG 161.A O no hydrogen 3.111 N/A ILE 165.A N PRO 162.A O no hydrogen 3.411 N/A TYR 167.A OH LYS 136.A O no hydrogen 2.700 N/A LYS 169.A N GLU 166.A O no hydrogen 3.268 N/A LEU 170.A N TYR 167.A O no hydrogen 3.226 N/A LYS 172.A NZ ASP 149.A OD2 no hydrogen 2.851 N/A ASP 173.A N ASP 173.A OD1 no hydrogen 2.409 N/A ASP 174.A N ARG 171.A O no hydrogen 2.854 N/A THR 177.A OG1 ASP 174.A OD1 no hydrogen 2.950 N/A THR 177.A OG1 ASP 174.A OD2 no hydrogen 2.975 N/A ASN 178.A N ASP 174.A O no hydrogen 3.187 N/A ASN 178.A ND2 ASP 149.A O no hydrogen 3.121 N/A ASN 178.A ND2 ARG 171.A O no hydrogen 2.792 N/A LEU 179.A N PRO 175.A O no hydrogen 2.940 N/A ASN 180.A N VAL 176.A O no hydrogen 3.139 N/A ASN 181.A N THR 177.A O no hydrogen 2.967 N/A ASN 181.A ND2 ASN 154.A OD1 no hydrogen 2.863 N/A ALA 182.A N ASN 178.A O no hydrogen 3.177 N/A PHE 183.A N LEU 179.A O no hydrogen 2.984 N/A GLU 184.A N ASN 180.A O no hydrogen 2.911 N/A VAL 185.A N ASN 181.A O no hydrogen 2.992 N/A ALA 186.A N ALA 182.A O no hydrogen 2.930 N/A GLU 187.A N PHE 183.A O no hydrogen 2.990 N/A LYS 188.A N GLU 184.A O no hydrogen 3.061 N/A LYS 188.A NZ TYR 189.A OH no hydrogen 3.427 N/A TYR 189.A N VAL 185.A O no hydrogen 2.866 N/A LEU 190.A N ALA 186.A O no hydrogen 3.101 N/A ILE 192.A N ALA 186.A O no hydrogen 3.063 N/A ASP 200.A N ASP 197.A OD2 no hydrogen 3.277 N/A ILE 201.A N ASP 197.A O no hydrogen 3.114 N/A VAL 202.A N ALA 198.A O no hydrogen 3.055 N/A ASN 203.A N GLU 199.A O no hydrogen 2.677 N/A THR 204.A OG1 ASP 200.A O no hydrogen 2.376 N/A ARG 206.A NE.B PRO 207.A O no hydrogen 3.031 N/A ARG 206.A NH2.B PRO 207.A O no hydrogen 3.135 N/A ASP 208.A N GLN 6.A OE1 no hydrogen 3.107 N/A GLU 210.A N GLU 210.A OE1 no hydrogen 3.138 N/A ALA 211.A N ASP 208.A OD2 no hydrogen 3.045 N/A ILE 212.A N ASP 208.A O no hydrogen 3.169 N/A MET 213.A N GLU 209.A O no hydrogen 2.837 N/A THR 214.A N GLU 210.A O no hydrogen 2.989 N/A THR 214.A OG1 GLU 210.A O no hydrogen 2.605 N/A TYR 215.A N ALA 211.A O no hydrogen 3.274 N/A VAL 216.A N ILE 212.A O no hydrogen 2.895 N/A SER 217.A N MET 213.A O no hydrogen 2.808 N/A SER 217.A OG MET 213.A O no hydrogen 3.427 N/A SER 217.A OG THR 214.A O no hydrogen 2.849 N/A SER 218.A N TYR 215.A O no hydrogen 3.096 N/A TYR 220.A N VAL 216.A O no hydrogen 3.040 N/A HIS 221.A N SER 217.A O no hydrogen 3.013 N/A HIS 221.A NE2 ALA 109.A O no hydrogen 2.583 N/A ALA 222.A N SER 218.A O no hydrogen 2.981 N/A PHE 223.A N PHE 219.A O no hydrogen 3.058 N/A SER 224.A OG HIS 221.A O no hydrogen 3.288 N/A