Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ng1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N ASP 249.A O no hydrogen 2.586 N/A SER 5.A N PHE 1.A O no hydrogen 3.112 N/A SER 5.A OG PHE 1.A O no hydrogen 2.753 N/A ALA 6.A N GLN 2.A O no hydrogen 3.129 N/A ARG 7.A N GLN 3.A O no hydrogen 2.988 N/A ARG 7.A NH1 ASP 39.A OD2 no hydrogen 2.488 N/A LEU 8.A N LEU 4.A O no hydrogen 2.840 N/A GLN 9.A N SER 5.A O no hydrogen 2.716 N/A GLN 9.A NE2 ILE 290.A O no hydrogen 3.071 N/A GLU 10.A N ALA 6.A O no hydrogen 3.116 N/A ALA 11.A N ARG 7.A O no hydrogen 2.935 N/A ILE 12.A N LEU 8.A O no hydrogen 3.193 N/A GLY 13.A N GLN 9.A O no hydrogen 2.924 N/A ARG 14.A N GLU 10.A O no hydrogen 2.761 N/A ARG 14.A NH1 GLU 32.A OE2 no hydrogen 2.612 N/A THR 22.A N ASP 25.A OD2 no hydrogen 2.827 N/A THR 22.A OG1 ASP 25.A OD2 no hydrogen 2.715 N/A GLU 24.A N THR 22.A OG1 no hydrogen 3.408 N/A ASP 25.A N THR 22.A O no hydrogen 3.258 N/A LEU 26.A N THR 22.A O no hydrogen 3.255 N/A LYS 27.A N GLU 23.A O no hydrogen 3.442 N/A LYS 27.A NZ GLU 24.A OE1 no hydrogen 3.241 N/A THR 29.A N ASP 25.A O no hydrogen 3.112 N/A THR 29.A OG1 ASP 25.A O no hydrogen 3.221 N/A LEU 30.A N LEU 26.A O no hydrogen 2.886 N/A ARG 31.A N LYS 27.A O no hydrogen 3.422 N/A GLU 32.A N ALA 28.A O no hydrogen 3.169 N/A ILE 33.A N THR 29.A O no hydrogen 2.865 N/A ARG 34.A N LEU 30.A O no hydrogen 2.788 N/A ARG 35.A N ARG 31.A O no hydrogen 2.731 N/A ALA 36.A N GLU 32.A O no hydrogen 2.948 N/A LEU 37.A N ILE 33.A O no hydrogen 3.058 N/A MET 38.A N ARG 34.A O no hydrogen 3.095 N/A ASP 39.A N ARG 35.A O no hydrogen 2.978 N/A ALA 40.A N LEU 37.A O no hydrogen 3.302 N/A ASP 41.A N MET 38.A O no hydrogen 2.858 N/A VAL 42.A N LEU 37.A O no hydrogen 3.124 N/A ASN 43.A N SER 257.A OG no hydrogen 2.842 N/A ASN 43.A ND2 GLN 223.A OE1 no hydrogen 3.455 N/A GLU 45.A N ASN 43.A OD1 no hydrogen 2.739 N/A VAL 46.A N ASN 43.A OD1 no hydrogen 3.081 N/A THR 47.A N ASN 43.A O no hydrogen 2.875 N/A THR 47.A OG1 ASN 43.A O no hydrogen 3.142 N/A ARG 48.A N LEU 44.A O no hydrogen 3.314 N/A ARG 48.A NE ASP 49.A OD1 no hydrogen 2.906 N/A ARG 48.A NH2 ASP 49.A OD1 no hydrogen 3.412 N/A ASP 49.A N GLU 45.A O no hydrogen 3.118 N/A PHE 50.A N VAL 46.A O no hydrogen 2.793 N/A VAL 51.A N THR 47.A O no hydrogen 3.193 N/A GLU 52.A N ARG 48.A O no hydrogen 2.944 N/A ARG 53.A N ASP 49.A O no hydrogen 2.683 N/A VAL 54.A N PHE 50.A O no hydrogen 2.990 N/A ARG 55.A N VAL 51.A O no hydrogen 2.975 N/A ARG 55.A NE GLU 52.A OE1 no hydrogen 3.331 N/A ARG 55.A NH2 GLU 52.A OE1 no hydrogen 3.173 N/A ARG 55.A NH2 GLU 52.A OE2 no hydrogen 3.225 N/A GLU 56.A N GLU 52.A O no hydrogen 2.797 N/A GLU 57.A N ARG 53.A O no hydrogen 2.965 N/A ALA 58.A N VAL 54.A O no hydrogen 2.944 N/A LEU 59.A N ARG 55.A O no hydrogen 3.094 N/A GLY 60.A N GLU 56.A O no hydrogen 3.043 N/A LYS 61.A N ALA 58.A O no hydrogen 2.692 N/A LYS 61.A NZ GLU 57.A O no hydrogen 2.494 N/A LYS 61.A NZ GLU 57.A OE1 no hydrogen 3.412 N/A GLN 62.A N LEU 59.A O no hydrogen 2.816 N/A VAL 63.A N ALA 58.A O no hydrogen 3.291 N/A GLU 65.A N GLN 62.A O no hydrogen 2.960 N/A SER 66.A N VAL 63.A O no hydrogen 3.065 N/A THR 68.A N SER 66.A OG no hydrogen 3.007 N/A GLU 71.A N THR 68.A O no hydrogen 3.300 N/A VAL 72.A N PRO 69.A O no hydrogen 2.954 N/A ILE 73.A N PRO 69.A O no hydrogen 2.996 N/A LEU 74.A N ALA 70.A O no hydrogen 2.992 N/A ALA 75.A N GLU 71.A O no hydrogen 3.029 N/A THR 76.A N VAL 72.A O no hydrogen 2.793 N/A THR 76.A OG1 VAL 72.A O no hydrogen 3.329 N/A THR 76.A OG1 ILE 73.A O no hydrogen 3.006 N/A VAL 77.A N ILE 73.A O no hydrogen 2.718 N/A TYR 78.A N LEU 74.A O no hydrogen 3.004 N/A GLU 79.A N ALA 75.A O no hydrogen 3.216 N/A ALA 80.A N THR 76.A O no hydrogen 2.966 N/A LEU 81.A N VAL 77.A O no hydrogen 2.829 N/A LYS 82.A N TYR 78.A O no hydrogen 2.829 N/A GLU 83.A N GLU 79.A O no hydrogen 2.865 N/A ALA 84.A N ALA 80.A O no hydrogen 3.118 N/A LEU 85.A N LEU 81.A O no hydrogen 2.990 N/A GLY 86.A N LYS 82.A O no hydrogen 3.237 N/A GLY 86.A N GLU 83.A O no hydrogen 2.962 N/A GLY 87.A N LYS 82.A O no hydrogen 2.640 N/A ASN 98.A N ASP 181.A O no hydrogen 3.250 N/A LEU 99.A N ASP 211.A OD2 no hydrogen 2.670 N/A TRP 100.A N ILE 183.A O no hydrogen 2.725 N/A PHE 101.A N GLU 212.A O no hydrogen 2.923 N/A LEU 102.A N VAL 185.A O no hydrogen 2.817 N/A VAL 103.A N LEU 214.A O no hydrogen 2.830 N/A GLN 106.A N ARG 190.A O no hydrogen 3.073 N/A SER 108.A N LEU 105.A O no hydrogen 3.065 N/A SER 108.A OG LEU 105.A O no hydrogen 2.475 N/A LYS 110.A N SER 108.A OG no hydrogen 3.217 N/A LYS 110.A NZ ASP 186.A OD1 no hydrogen 2.557 N/A LYS 110.A NZ ASP 186.A OD2 no hydrogen 3.467 N/A LYS 110.A NZ THR 187.A O no hydrogen 2.826 N/A THR 111.A OG1 ASP 186.A OD2 no hydrogen 2.690 N/A THR 113.A N GLY 109.A O no hydrogen 2.833 N/A THR 113.A OG1 GLY 109.A O no hydrogen 2.614 N/A ALA 114.A N LYS 110.A O no hydrogen 3.139 N/A ALA 115.A N THR 111.A O no hydrogen 3.380 N/A LYS 116.A N THR 112.A O no hydrogen 2.987 N/A LYS 116.A NZ LYS 274.A O no hydrogen 3.059 N/A LEU 117.A N THR 113.A O no hydrogen 2.729 N/A ALA 118.A N ALA 114.A O no hydrogen 3.010 N/A LEU 119.A N ALA 115.A O no hydrogen 3.098 N/A TYR 120.A N LYS 116.A O no hydrogen 2.812 N/A TYR 121.A N LEU 117.A O no hydrogen 3.046 N/A LYS 122.A N ALA 118.A O no hydrogen 2.873 N/A LYS 122.A NZ GLY 152.A O no hydrogen 2.882 N/A GLY 123.A N LEU 119.A O no hydrogen 3.171 N/A LYS 124.A N TYR 121.A O no hydrogen 2.779 N/A GLY 125.A N LYS 122.A O no hydrogen 3.043 N/A ARG 126.A N TYR 121.A O no hydrogen 2.908 N/A ARG 127.A N ASP 181.A OD1 no hydrogen 2.759 N/A LEU 129.A N LEU 182.A O no hydrogen 2.939 N/A LEU 130.A N PRO 154.A O no hydrogen 2.856 N/A VAL 131.A N LEU 184.A O no hydrogen 2.811 N/A ALA 132.A N LEU 156.A O no hydrogen 2.774 N/A ALA 133.A N ASP 186.A O no hydrogen 3.152 N/A GLN 136.A N ASP 134.A OD1 no hydrogen 3.077 N/A ARG 137.A N ASP 134.A OD1 no hydrogen 3.069 N/A ALA 140.A N ARG 137.A O no hydrogen 2.955 N/A ARG 141.A N ARG 137.A O no hydrogen 3.463 N/A ARG 141.A NH1 ASP 134.A O no hydrogen 2.648 N/A ARG 141.A NH1 ASP 160.A OD1 no hydrogen 2.970 N/A ARG 141.A NH2 ASP 160.A OD1 no hydrogen 2.618 N/A GLU 142.A N PRO 138.A O no hydrogen 2.836 N/A GLN 143.A N ALA 139.A O no hydrogen 2.976 N/A LEU 144.A N ALA 140.A O no hydrogen 3.374 N/A ARG 145.A N ARG 141.A O no hydrogen 2.927 N/A LEU 146.A N GLU 142.A O no hydrogen 3.092 N/A LEU 147.A N GLN 143.A O no hydrogen 2.981 N/A GLY 148.A N LEU 144.A O no hydrogen 2.807 N/A GLU 149.A N ARG 145.A O no hydrogen 3.028 N/A LYS 150.A N LEU 146.A O no hydrogen 3.087 N/A VAL 151.A N LEU 147.A O no hydrogen 3.188 N/A GLY 152.A N GLU 149.A O no hydrogen 3.174 N/A VAL 153.A N GLY 148.A O no hydrogen 2.900 N/A LEU 156.A N LEU 130.A O no hydrogen 2.796 N/A VAL 158.A N ALA 132.A O no hydrogen 3.067 N/A MET 159.A N GLU 162.A OE1 no hydrogen 2.782 N/A GLY 161.A N THR 135.A O no hydrogen 2.633 N/A GLU 162.A N MET 159.A O no hydrogen 2.938 N/A GLU 165.A N GLU 165.A OE1 no hydrogen 2.797 N/A SER 166.A N SER 163.A OG no hydrogen 3.234 N/A SER 166.A OG GLU 162.A OE2 no hydrogen 2.677 N/A ILE 167.A N SER 163.A O no hydrogen 2.793 N/A ARG 168.A N PRO 164.A O no hydrogen 2.712 N/A ARG 169.A N GLU 165.A O no hydrogen 3.132 N/A ARG 170.A N SER 166.A O no hydrogen 3.034 N/A ARG 170.A NE GLU 162.A OE2 no hydrogen 2.993 N/A ARG 170.A NH2 GLU 157.A O no hydrogen 3.029 N/A ARG 170.A NH2 GLU 162.A OE1 no hydrogen 2.717 N/A VAL 171.A N ILE 167.A O no hydrogen 2.902 N/A GLU 172.A N ARG 168.A O no hydrogen 2.889 N/A GLU 173.A N ARG 169.A O no hydrogen 3.001 N/A LYS 174.A N ARG 170.A O no hydrogen 3.021 N/A LYS 174.A NZ GLU 178.A OE2 no hydrogen 2.962 N/A ALA 175.A N VAL 171.A O no hydrogen 2.857 N/A ARG 176.A N GLU 172.A O no hydrogen 2.802 N/A LEU 177.A N GLU 173.A O no hydrogen 2.800 N/A GLU 178.A N LYS 174.A O no hydrogen 2.884 N/A ALA 179.A N ARG 176.A O no hydrogen 3.277 N/A ARG 180.A N ALA 175.A O no hydrogen 3.053 N/A ARG 180.A NE GLU 178.A O no hydrogen 2.821 N/A ARG 180.A NH1 PRO 128.A O no hydrogen 2.686 N/A ARG 180.A NH2 GLU 178.A O no hydrogen 2.877 N/A ASP 181.A N ARG 127.A O no hydrogen 2.747 N/A ILE 183.A N ASN 98.A O no hydrogen 2.572 N/A LEU 184.A N LEU 129.A O no hydrogen 2.950 N/A VAL 185.A N TRP 100.A O no hydrogen 2.833 N/A ASP 186.A N VAL 131.A O no hydrogen 2.895 N/A THR 187.A N LEU 102.A O no hydrogen 3.091 N/A THR 187.A OG1 LEU 102.A O no hydrogen 2.940 N/A ARG 190.A NH1 ASP 134.A OD2 no hydrogen 2.756 N/A ARG 190.A NH1 GLY 189.A O no hydrogen 2.895 N/A ARG 190.A NH2 ASP 134.A OD1 no hydrogen 3.148 N/A ARG 190.A NH2 ASP 134.A OD2 no hydrogen 3.400 N/A ARG 190.A NH2 GLN 136.A OE1 no hydrogen 3.134 N/A LEU 197.A N ASP 194.A OD2 no hydrogen 2.800 N/A MET 198.A N ASP 194.A O no hydrogen 2.703 N/A GLY 199.A N GLU 195.A O no hydrogen 2.935 N/A GLU 200.A N PRO 196.A O no hydrogen 2.884 N/A LEU 201.A N LEU 197.A O no hydrogen 2.652 N/A ALA 202.A N MET 198.A O no hydrogen 2.861 N/A ARG 203.A N GLY 199.A O no hydrogen 2.961 N/A ARG 203.A NH1 GLU 206.A OE1 no hydrogen 3.016 N/A ARG 203.A NH2 GLU 165.A OE2 no hydrogen 2.972 N/A LEU 204.A N GLU 200.A O no hydrogen 2.844 N/A LYS 205.A N LEU 201.A O no hydrogen 2.994 N/A LYS 205.A NZ VAL 236.A O no hydrogen 3.087 N/A GLU 206.A N ALA 202.A O no hydrogen 2.952 N/A VAL 207.A N ARG 203.A O no hydrogen 2.977 N/A LEU 208.A N LEU 204.A O no hydrogen 2.983 N/A GLY 209.A N LYS 205.A O no hydrogen 2.719 N/A ASP 211.A N LEU 99.A O no hydrogen 2.749 N/A VAL 213.A N THR 239.A OG1 no hydrogen 2.712 N/A LEU 214.A N PHE 101.A O no hydrogen 2.819 N/A LEU 215.A N GLY 240.A O no hydrogen 3.152 N/A VAL 216.A N VAL 103.A O no hydrogen 2.701 N/A LEU 217.A N VAL 242.A O no hydrogen 2.888 N/A ALA 219.A N THR 244.A O no hydrogen 2.880 N/A MET 220.A N ASP 218.A OD1 no hydrogen 2.759 N/A THR 221.A N ASP 218.A O no hydrogen 3.304 N/A THR 221.A OG1 ASP 218.A O no hydrogen 3.174 N/A GLN 223.A N ASP 41.A OD2 no hydrogen 2.881 N/A GLU 224.A N THR 221.A O no hydrogen 3.184 N/A ALA 225.A N GLY 222.A O no hydrogen 3.237 N/A SER 227.A N GLU 224.A O no hydrogen 2.851 N/A SER 227.A OG GLU 224.A O no hydrogen 2.611 N/A SER 227.A OG GLU 224.A OE2 no hydrogen 2.447 N/A VAL 228.A N ALA 225.A O no hydrogen 3.418 N/A ALA 229.A N LEU 226.A O no hydrogen 3.164 N/A ARG 230.A NH1 ARG 230.A O no hydrogen 3.088 N/A PHE 232.A N VAL 228.A O no hydrogen 3.382 N/A ASP 233.A N ALA 229.A O no hydrogen 2.892 N/A GLU 234.A N ARG 230.A O no hydrogen 2.806 N/A LYS 235.A N ALA 231.A O no hydrogen 2.818 N/A LYS 235.A NZ GLU 195.A O no hydrogen 3.220 N/A LYS 235.A NZ GLU 195.A OE1 no hydrogen 2.948 N/A GLY 237.A N PHE 232.A O no hydrogen 3.169 N/A VAL 238.A N ASP 233.A OD1 no hydrogen 2.970 N/A THR 239.A N VAL 213.A O no hydrogen 2.763 N/A THR 239.A OG1 GLU 212.A OE1 no hydrogen 2.630 N/A THR 239.A OG1 VAL 213.A O no hydrogen 3.199 N/A LEU 241.A N PRO 265.A O no hydrogen 2.865 N/A VAL 242.A N LEU 215.A O no hydrogen 3.075 N/A LEU 243.A N PHE 268.A O no hydrogen 3.125 N/A THR 244.A N LEU 217.A O no hydrogen 2.943 N/A THR 244.A OG1 SER 108.A O no hydrogen 2.517 N/A THR 244.A OG1 LEU 217.A O no hydrogen 3.522 N/A LYS 245.A NZ GLY 107.A O no hydrogen 3.016 N/A LYS 245.A NZ ASP 218.A OD2 no hydrogen 3.044 N/A LEU 246.A N GLY 270.A O no hydrogen 2.848 N/A GLY 248.A N LYS 245.A O no hydrogen 3.064 N/A ASP 249.A N LEU 246.A O no hydrogen 2.983 N/A LEU 256.A N GLY 252.A O no hydrogen 3.250 N/A SER 257.A N GLY 253.A O no hydrogen 2.847 N/A SER 257.A N ALA 254.A O no hydrogen 3.172 N/A SER 257.A OG GLY 253.A O no hydrogen 2.466 N/A ALA 258.A N ALA 254.A O no hydrogen 2.828 N/A HIS 260.A N SER 257.A O no hydrogen 2.926 N/A VAL 261.A N SER 257.A O no hydrogen 2.683 N/A THR 262.A N ALA 258.A O no hydrogen 2.678 N/A THR 262.A OG1 ALA 258.A O no hydrogen 2.875 N/A GLY 263.A N ARG 259.A O no hydrogen 3.115 N/A LYS 264.A N THR 262.A OG1 no hydrogen 2.974 N/A LYS 264.A NZ ASP 233.A OD1 no hydrogen 3.046 N/A LYS 264.A NZ ASP 233.A OD2 no hydrogen 3.073 N/A LYS 264.A NZ VAL 238.A O no hydrogen 2.749 N/A TYR 267.A N LEU 241.A O no hydrogen 3.006 N/A ALA 269.A N GLU 279.A O no hydrogen 2.831 N/A GLY 270.A N LEU 243.A O no hydrogen 2.741 N/A VAL 271.A N GLY 277.A O no hydrogen 2.883 N/A GLU 273.A N GLU 273.A OE1 no hydrogen 2.717 N/A LYS 274.A N SER 272.A OG no hydrogen 3.133 N/A GLY 277.A N LYS 274.A O no hydrogen 2.643 N/A GLU 279.A N ALA 269.A O no hydrogen 2.913 N/A PHE 281.A N TYR 267.A O no hydrogen 2.758 N/A LEU 286.A N TYR 282.A O no hydrogen 2.878 N/A ALA 287.A N PRO 283.A O no hydrogen 2.941 N/A GLY 288.A N GLU 284.A O no hydrogen 3.012 N/A ARG 289.A N ARG 285.A O no hydrogen 2.977 N/A ILE 290.A N LEU 286.A O no hydrogen 2.983 N/A LEU 291.A N ALA 287.A O no hydrogen 3.122 N/A GLY 292.A N ARG 289.A O no hydrogen 2.760 N/A