Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4bnk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N LEU 29.A O no hydrogen 3.082 N/A LYS 5.A N LEU 2.A O no hydrogen 2.902 N/A THR 6.A N ASP 86.A OD2 no hydrogen 2.789 N/A TYR 7.A N LYS 32.A O no hydrogen 3.156 N/A TYR 7.A OH LEU 232.A O no hydrogen 2.904 N/A VAL 8.A N GLY 87.A O no hydrogen 3.025 N/A ILE 9.A N VAL 34.A O no hydrogen 2.817 N/A MET 10.A N TYR 89.A O no hydrogen 2.973 N/A GLY 11.A N THR 36.A O no hydrogen 3.426 N/A ALA 13.A N SER 17.A OG no hydrogen 2.850 N/A ASN 14.A N SER 17.A OG no hydrogen 3.304 N/A ARG 16.A N ASN 14.A OD1 no hydrogen 2.956 N/A SER 17.A N ASN 14.A O no hydrogen 3.012 N/A SER 17.A OG ASN 14.A O no hydrogen 3.389 N/A PHE 20.A N SER 17.A O no hydrogen 3.001 N/A GLY 21.A N SER 17.A O no hydrogen 3.323 N/A VAL 22.A N ILE 18.A O no hydrogen 3.137 N/A ALA 23.A N ALA 19.A O no hydrogen 2.866 N/A LYS 24.A N PHE 20.A O no hydrogen 3.118 N/A VAL 25.A N GLY 21.A O no hydrogen 3.339 N/A LEU 26.A N VAL 22.A O no hydrogen 3.164 N/A ASP 27.A N ALA 23.A O no hydrogen 2.793 N/A GLN 28.A N LYS 24.A O no hydrogen 2.788 N/A LEU 29.A N VAL 25.A O no hydrogen 2.883 N/A GLY 30.A N LEU 26.A O no hydrogen 3.050 N/A GLY 30.A N ASP 27.A O no hydrogen 3.115 N/A ALA 31.A N LEU 26.A O no hydrogen 3.159 N/A LYS 32.A N LYS 5.A O no hydrogen 3.049 N/A LEU 33.A N GLN 55.A OE1 no hydrogen 2.805 N/A VAL 34.A N TYR 7.A O no hydrogen 3.137 N/A PHE 35.A N HIS 59.A O no hydrogen 2.843 N/A THR 36.A N ILE 9.A O no hydrogen 3.118 N/A TYR 37.A N TYR 61.A O no hydrogen 2.935 N/A ARG 41.A NE GLU 45.A OE2 no hydrogen 3.378 N/A ARG 41.A NH2 GLU 45.A OE2 no hydrogen 3.045 N/A SER 42.A N LYS 39.A O no hydrogen 3.027 N/A ARG 43.A N LYS 39.A O no hydrogen 3.368 N/A ARG 43.A NE GLU 40.A OE1.B no hydrogen 2.657 N/A ARG 43.A NH1 GLU 47.A OE2 no hydrogen 2.929 N/A ARG 43.A NH2 GLU 40.A OE1.B no hydrogen 2.648 N/A LYS 44.A N GLU 40.A O no hydrogen 3.152 N/A GLU 45.A N ARG 41.A O no hydrogen 3.116 N/A LEU 46.A N SER 42.A O no hydrogen 2.882 N/A GLU 47.A N ARG 43.A O no hydrogen 2.839 N/A LYS 48.A N LYS 44.A O no hydrogen 2.981 N/A LYS 48.A NZ GLU 45.A OE1 no hydrogen 2.921 N/A LYS 48.A NZ GLU 45.A OE2 no hydrogen 2.937 N/A LEU 49.A N GLU 45.A O no hydrogen 2.782 N/A LEU 50.A N LEU 46.A O no hydrogen 2.950 N/A GLN 52.A N LEU 49.A O no hydrogen 3.055 N/A LEU 53.A N LEU 50.A O no hydrogen 3.126 N/A ASN 54.A N ASP 27.A OD1 no hydrogen 2.940 N/A ASN 54.A N ASP 27.A OD2 no hydrogen 2.788 N/A GLN 55.A NE2 ASP 27.A OD1 no hydrogen 2.759 N/A GLN 55.A NE2 ALA 31.A O no hydrogen 2.818 N/A TYR 61.A N PHE 35.A O no hydrogen 2.771 N/A TYR 61.A OH ASP 81.A OD2 no hydrogen 2.560 N/A GLN 62.A NE2 ARG 38.A O no hydrogen 2.938 N/A ILE 63.A N TYR 37.A O no hydrogen 2.772 N/A ASP 64.A N GLU 70.A OE1 no hydrogen 2.805 N/A GLN 66.A N ASP 64.A OD1 no hydrogen 2.785 N/A GLN 66.A NE2 ASP 117.A OD2 no hydrogen 3.476 N/A SER 67.A N ASP 64.A O no hydrogen 3.003 N/A GLU 69.A N GLU 69.A OE1 no hydrogen 3.047 N/A GLU 70.A N SER 67.A O no hydrogen 3.269 N/A GLU 70.A N SER 67.A OG no hydrogen 3.020 N/A VAL 71.A N SER 67.A O no hydrogen 3.317 N/A ILE 72.A N ASP 68.A O no hydrogen 2.799 N/A ASN 73.A N GLU 69.A O no hydrogen 2.982 N/A GLY 74.A N GLU 70.A O no hydrogen 2.909 N/A PHE 75.A N VAL 71.A O no hydrogen 3.046 N/A GLU 76.A N ILE 72.A O no hydrogen 3.096 N/A GLN 77.A N ASN 73.A O no hydrogen 2.929 N/A GLN 77.A NE2 ASP 81.A OD2 no hydrogen 3.118 N/A ILE 78.A N GLY 74.A O no hydrogen 3.025 N/A GLY 79.A N PHE 75.A O no hydrogen 3.093 N/A LYS 80.A N GLU 76.A O no hydrogen 3.165 N/A ASP 81.A N GLN 77.A O no hydrogen 2.806 N/A VAL 82.A N ILE 78.A O no hydrogen 2.706 N/A GLY 83.A N GLY 79.A O no hydrogen 2.777 N/A ILE 85.A N LEU 133.A O no hydrogen 2.943 N/A ASP 86.A N THR 6.A O no hydrogen 2.694 N/A VAL 88.A N SER 139.A O no hydrogen 3.136 N/A TYR 89.A N VAL 8.A O no hydrogen 2.810 N/A TYR 89.A OH THR 143.A OG1 no hydrogen 2.527 N/A HIS 90.A N VAL 141.A O no hydrogen 2.628 N/A HIS 90.A NE2 SER 122.A OG no hydrogen 2.813 N/A SER 91.A N MET 10.A O no hydrogen 3.083 N/A PHE 94.A N SER 119.A OG no hydrogen 3.017 N/A ASP 99.A N ASN 96.A O no hydrogen 3.204 N/A LEU 100.A N MET 97.A O no hydrogen 2.887 N/A ARG 101.A NE MET 97.A O no hydrogen 3.406 N/A ARG 101.A NH2 GLY 198.A O no hydrogen 2.668 N/A GLU 106.A N ARG 103.A O no hydrogen 3.187 N/A THR 107.A N PHE 104.A O no hydrogen 3.035 N/A THR 107.A OG1 PHE 104.A O no hydrogen 2.509 N/A GLY 111.A N SER 108.A OG no hydrogen 2.881 N/A PHE 112.A N SER 108.A O no hydrogen 2.923 N/A LEU 113.A N ARG 109.A O no hydrogen 2.961 N/A LEU 114.A N GLU 110.A O no hydrogen 2.853 N/A GLN 116.A N PHE 112.A O no hydrogen 3.374 N/A GLN 116.A NE2 VAL 160.A O no hydrogen 3.229 N/A ASP 117.A N LEU 113.A O no hydrogen 2.960 N/A ILE 118.A N LEU 114.A O no hydrogen 3.162 N/A SER 119.A N ALA 115.A O no hydrogen 2.913 N/A SER 119.A OG ALA 115.A O no hydrogen 2.719 N/A SER 120.A N GLN 116.A O no hydrogen 2.969 N/A SER 120.A OG SER 164.A OG no hydrogen 2.842 N/A TYR 121.A N GLN 116.A O no hydrogen 2.756 N/A SER 122.A N ASP 117.A O no hydrogen 2.997 N/A SER 122.A OG HIS 90.A NE2 no hydrogen 2.813 N/A SER 122.A OG ILE 118.A O no hydrogen 2.519 N/A LEU 123.A N SER 120.A O no hydrogen 2.985 N/A THR 124.A N TYR 121.A O no hydrogen 2.926 N/A THR 124.A OG1 TYR 121.A O no hydrogen 3.252 N/A THR 124.A OG1 ASN 168.A OD1 no hydrogen 3.033 N/A VAL 126.A N SER 122.A O no hydrogen 3.097 N/A ALA 127.A N LEU 123.A O no hydrogen 2.915 N/A HIS 128.A N THR 124.A O no hydrogen 2.955 N/A HIS 128.A ND1 GLU 129.A OE2 no hydrogen 3.111 N/A GLU 129.A N ILE 125.A O no hydrogen 2.905 N/A ALA 130.A N VAL 126.A O no hydrogen 2.712 N/A LYS 131.A N ALA 127.A O no hydrogen 2.808 N/A LYS 131.A NZ ASP 179.A OD2 no hydrogen 3.213 N/A LYS 132.A N GLU 129.A O no hydrogen 3.408 N/A LYS 132.A NZ GLU 129.A OE1 no hydrogen 2.958 N/A LEU 133.A N ALA 130.A O no hydrogen 2.872 N/A MET 134.A N LYS 131.A O no hydrogen 3.252 N/A GLY 137.A N MET 134.A O no hydrogen 2.742 N/A GLY 138.A N ASN 180.A O no hydrogen 2.990 N/A SER 139.A N ASP 86.A O no hydrogen 3.187 N/A SER 139.A OG LEU 231.A O no hydrogen 2.728 N/A ILE 140.A N ARG 182.A O no hydrogen 2.736 N/A VAL 141.A N VAL 88.A O no hydrogen 3.004 N/A ALA 142.A N ASN 184.A O no hydrogen 3.145 N/A THR 143.A OG1 TYR 89.A OH no hydrogen 2.527 N/A THR 143.A OG1 HIS 90.A O no hydrogen 3.009 N/A THR 144.A N ILE 186.A O no hydrogen 2.600 N/A THR 144.A OG1 GLU 166.A OE2 no hydrogen 2.740 N/A TYR 145.A N THR 144.A OG1 no hydrogen 2.819 N/A GLY 148.A N TYR 145.A O no hydrogen 3.110 N/A GLU 149.A N LEU 146.A O no hydrogen 2.940 N/A PHE 150.A N LEU 146.A O no hydrogen 3.118 N/A TYR 155.A N GLN 153.A O no hydrogen 3.063 N/A ASN 156.A ND2 ARG 101.A O no hydrogen 3.444 N/A ASN 156.A ND2 GLY 102.A O no hydrogen 3.423 N/A MET 158.A N TYR 155.A O no hydrogen 2.760 N/A GLY 159.A N ASN 156.A O no hydrogen 2.994 N/A ALA 161.A N VAL 157.A O no hydrogen 3.320 N/A LYS 162.A N MET 158.A O no hydrogen 2.519 N/A LYS 162.A NZ THR 143.A O no hydrogen 2.739 N/A ALA 163.A N GLY 159.A O no hydrogen 2.753 N/A SER 164.A N VAL 160.A O no hydrogen 3.203 N/A SER 164.A OG GLN 116.A OE1 no hydrogen 2.634 N/A SER 164.A OG SER 120.A OG no hydrogen 2.842 N/A LEU 165.A N ALA 161.A O no hydrogen 2.898 N/A GLU 166.A N LYS 162.A O no hydrogen 2.922 N/A ALA 167.A N ALA 163.A O no hydrogen 3.095 N/A ASN 168.A N SER 164.A O no hydrogen 2.992 N/A ASN 168.A ND2 SER 120.A OG no hydrogen 3.279 N/A ASN 168.A ND2 THR 124.A OG1 no hydrogen 3.206 N/A VAL 169.A N LEU 165.A O no hydrogen 2.869 N/A LYS 170.A N GLU 166.A O no hydrogen 3.198 N/A TYR 171.A N ALA 167.A O no hydrogen 2.873 N/A LEU 172.A N ASN 168.A O no hydrogen 2.868 N/A ALA 173.A N VAL 169.A O no hydrogen 2.981 N/A LEU 174.A N LYS 170.A O no hydrogen 3.226 N/A ASP 175.A N TYR 171.A O no hydrogen 3.038 N/A LEU 176.A N LEU 172.A O no hydrogen 2.857 N/A GLY 177.A N ALA 173.A O no hydrogen 3.024 N/A ASP 179.A N LEU 176.A O no hydrogen 2.940 N/A ASN 180.A N GLY 177.A O no hydrogen 3.212 N/A ASN 180.A ND2 GLU 136.A O no hydrogen 3.604 N/A ILE 181.A N LEU 176.A O no hydrogen 3.344 N/A ARG 182.A N GLY 138.A O no hydrogen 2.679 N/A ARG 182.A NH1 LEU 231.A O no hydrogen 3.568 N/A ARG 182.A NH1 SER 236.A OG no hydrogen 2.833 N/A ARG 182.A NH1 VAL 239.A O no hydrogen 3.120 N/A ARG 182.A NH2 LEU 231.A O no hydrogen 3.309 N/A VAL 183.A N THR 240.A OG1 no hydrogen 2.962 N/A ASN 184.A N ILE 140.A O no hydrogen 3.018 N/A ASN 184.A ND2 VAL 239.A O no hydrogen 3.170 N/A ALA 185.A N GLU 242.A O no hydrogen 2.804 N/A ILE 186.A N ALA 142.A O no hydrogen 2.879 N/A SER 187.A N ILE 244.A O no hydrogen 2.906 N/A ALA 188.A N THR 144.A O no hydrogen 3.077 N/A GLY 189.A N VAL 246.A O no hydrogen 2.618 N/A ARG 192.A NH1 ASN 203.A OD1 no hydrogen 2.892 N/A ARG 192.A NH2 ASN 203.A OD1 no hydrogen 3.341 N/A ALA 196.A N THR 193.A OG1 no hydrogen 3.239 N/A LYS 197.A N LEU 194.A O no hydrogen 3.228 N/A GLY 198.A N SER 195.A O no hydrogen 3.118 N/A VAL 199.A N ALA 196.A O no hydrogen 3.015 N/A PHE 202.A N VAL 199.A O no hydrogen 3.243 N/A ILE 205.A N GLY 201.A O no hydrogen 3.075 N/A LEU 206.A N PHE 202.A O no hydrogen 2.978 N/A LYS 207.A N ASN 203.A O no hydrogen 3.119 N/A LYS 207.A N THR 204.A O no hydrogen 3.244 N/A GLU 208.A N THR 204.A O no hydrogen 2.861 N/A ILE 209.A N ILE 205.A O no hydrogen 3.237 N/A GLU 210.A N LEU 206.A O no hydrogen 3.362 N/A GLU 211.A N LYS 207.A O no hydrogen 3.188 N/A ARG 212.A NH1 GLU 208.A OE1.A no hydrogen 2.967 N/A ARG 212.A NH2 LYS 254.A OXT no hydrogen 3.368 N/A ALA 213.A N ILE 209.A O no hydrogen 3.178 N/A LEU 215.A N SER 248.A O no hydrogen 3.086 N/A LYS 216.A N ALA 213.A O no hydrogen 2.750 N/A LYS 216.A NZ ALA 213.A O no hydrogen 3.220 N/A ARG 217.A NH1 ASN 218.A O no hydrogen 3.100 N/A ARG 217.A NH1 GLU 223.A OE1 no hydrogen 2.973 N/A ARG 217.A NH1 GLU 223.A OE2 no hydrogen 3.512 N/A ARG 217.A NH2 GLU 223.A OE2 no hydrogen 3.177 N/A ASN 218.A ND2 LEU 206.A O no hydrogen 2.880 N/A ASP 220.A N GLU 223.A OE1 no hydrogen 3.275 N/A GLN 221.A N GLN 221.A OE1 no hydrogen 2.766 N/A GLN 221.A NE2 ARG 16.A O no hydrogen 2.880 N/A GLU 223.A N ASP 220.A O no hydrogen 3.029 N/A GLU 223.A N ASP 220.A OD1 no hydrogen 2.950 N/A VAL 224.A N ASP 220.A O no hydrogen 3.305 N/A GLY 225.A N GLN 221.A O no hydrogen 2.781 N/A LYS 226.A N VAL 222.A O no hydrogen 2.980 N/A LYS 226.A N GLU 223.A O no hydrogen 3.195 N/A THR 227.A N GLU 223.A O no hydrogen 3.362 N/A ALA 228.A N VAL 224.A O no hydrogen 2.923 N/A ALA 229.A N GLY 225.A O no hydrogen 2.869 N/A TYR 230.A N LYS 226.A O no hydrogen 3.132 N/A LEU 231.A N THR 227.A O no hydrogen 2.923 N/A LEU 232.A N ALA 228.A O no hydrogen 2.787 N/A SER 233.A N TYR 230.A O no hydrogen 3.317 N/A SER 233.A OG ALA 229.A O no hydrogen 3.241 N/A SER 233.A OG TYR 230.A O no hydrogen 3.227 N/A LEU 235.A N SER 233.A OG no hydrogen 3.122 N/A SER 236.A N SER 233.A O no hydrogen 3.405 N/A SER 236.A OG TYR 230.A O no hydrogen 2.914 N/A SER 236.A OG LEU 231.A O no hydrogen 2.984 N/A SER 236.A OG SER 233.A O no hydrogen 3.197 N/A SER 237.A N ASP 234.A O no hydrogen 3.094 N/A SER 237.A OG ASP 234.A O no hydrogen 3.465 N/A VAL 239.A N SER 236.A O no hydrogen 2.978 N/A THR 240.A OG1 VAL 183.A O no hydrogen 3.384 N/A GLY 241.A N VAL 183.A O no hydrogen 2.810 N/A GLU 242.A N ASN 184.A OD1 no hydrogen 2.829 N/A ASN 243.A N GLU 242.A OE1 no hydrogen 3.124 N/A ILE 244.A N ALA 185.A O no hydrogen 3.063 N/A HIS 245.A NE2 GLU 149.A OE1 no hydrogen 2.911 N/A VAL 246.A N SER 187.A O no hydrogen 3.051 N/A SER 248.A OG ARG 217.A O no hydrogen 2.768 N/A GLY 249.A N ASP 247.A OD1 no hydrogen 3.279 N/A PHE 250.A N ASP 247.A O no hydrogen 3.406 N/A HIS 251.A N ASP 247.A OD2 no hydrogen 3.044 N/A ALA 252.A N GLY 249.A O no hydrogen 2.652 N/A ILE 253.A N PHE 250.A O no hydrogen 3.245 N/A