Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ngx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N ILE 245.A O no hydrogen 2.860 N/A GLY 5.A N GLY 250.A O no hydrogen 2.880 N/A ALA 9.A N GLY 5.A O no hydrogen 2.965 N/A GLU 10.A N GLU 6.A O no hydrogen 2.903 N/A LYS 11.A N GLU 7.A O no hydrogen 3.119 N/A LYS 12.A N ILE 8.A O no hydrogen 3.093 N/A LYS 12.A NZ ASP 140.A OD1 no hydrogen 2.851 N/A LYS 12.A NZ ASP 140.A OD2 no hydrogen 2.710 N/A LYS 12.A NZ ASN 259.A OD1 no hydrogen 2.504 N/A LYS 12.A NZ GLU 262.A OE1 no hydrogen 2.872 N/A ALA 13.A N ALA 9.A O no hydrogen 2.898 N/A GLU 14.A N GLU 10.A O no hydrogen 3.002 N/A ASN 15.A N LYS 11.A O no hydrogen 3.083 N/A ASN 15.A ND2 LYS 11.A O no hydrogen 3.232 N/A LEU 16.A N LYS 12.A O no hydrogen 3.073 N/A HIS 17.A N ALA 13.A O no hydrogen 2.999 N/A GLY 18.A N GLU 14.A O no hydrogen 3.029 N/A ILE 19.A N ASN 15.A O no hydrogen 2.802 N/A ILE 20.A N LEU 16.A O no hydrogen 2.936 N/A GLU 21.A N HIS 17.A O no hydrogen 2.905 N/A ARG 22.A N GLY 18.A O no hydrogen 3.050 N/A SER 23.A N ILE 19.A O no hydrogen 3.069 N/A SER 23.A OG ILE 19.A O no hydrogen 3.144 N/A SER 28.A N ASN 85.A OD1 no hydrogen 3.070 N/A LEU 29.A N ALA 57.A O no hydrogen 2.764 N/A LYS 30.A N GLY 86.A O no hydrogen 2.926 N/A LYS 30.A NZ ASP 59.A OD2 no hydrogen 2.136 N/A LYS 30.A NZ GLU 61.A OE1 no hydrogen 2.880 N/A LEU 31.A N ASP 59.A O no hydrogen 2.730 N/A ILE 32.A N MET 88.A O no hydrogen 2.900 N/A GLN 33.A N GLU 61.A O no hydrogen 2.927 N/A GLN 33.A NE2 SER 41.A OG no hydrogen 3.167 N/A GLY 35.A N TYR 63.A O no hydrogen 3.194 N/A SER 41.A N ASN 37.A O no hydrogen 3.369 N/A SER 41.A OG ASN 37.A O no hydrogen 3.316 N/A ILE 42.A N GLU 38.A O no hydrogen 3.152 N/A TYR 43.A N ALA 39.A O no hydrogen 3.166 N/A ALA 44.A N ALA 40.A O no hydrogen 2.760 N/A ARG 45.A N SER 41.A O no hydrogen 3.022 N/A ALA 46.A N ILE 42.A O no hydrogen 2.896 N/A LYS 47.A N TYR 43.A O no hydrogen 3.098 N/A LYS 47.A NZ GLU 90.A OE1 no hydrogen 2.464 N/A LYS 47.A NZ GLU 90.A OE2 no hydrogen 3.210 N/A ILE 48.A N ALA 44.A O no hydrogen 2.889 N/A ARG 49.A N ARG 45.A O no hydrogen 2.786 N/A ARG 50.A N ALA 46.A O no hydrogen 2.925 N/A ARG 50.A NH1 PRO 254.A O no hydrogen 2.563 N/A ARG 50.A NH1 THR 258.A OG1 no hydrogen 2.970 N/A GLY 51.A N LYS 47.A O no hydrogen 2.969 N/A LYS 52.A N ILE 48.A O no hydrogen 2.862 N/A ILE 54.A N ARG 50.A O no hydrogen 3.063 N/A GLY 55.A N GLY 51.A O no hydrogen 3.073 N/A ILE 56.A N GLY 51.A O no hydrogen 2.750 N/A ALA 57.A N PRO 27.A O no hydrogen 2.980 N/A ASP 59.A N LEU 29.A O no hydrogen 2.778 N/A GLU 61.A N LEU 31.A O no hydrogen 2.798 N/A LYS 62.A NZ ASP 36.A OD2 no hydrogen 2.552 N/A TYR 63.A N GLN 33.A O no hydrogen 2.884 N/A TYR 63.A OH GLU 61.A OE2 no hydrogen 2.523 N/A ASP 70.A N SER 67.A OG no hydrogen 3.128 N/A LEU 71.A N SER 67.A O no hydrogen 3.015 N/A LEU 72.A N MET 68.A O no hydrogen 2.863 N/A LYS 73.A N LYS 69.A O no hydrogen 3.119 N/A LYS 73.A NZ ASP 77.A OD1 no hydrogen 2.792 N/A LYS 73.A NZ ASP 77.A OD2 no hydrogen 3.284 N/A ARG 74.A N ASP 70.A O no hydrogen 2.750 N/A ARG 74.A NE GLU 61.A OE2 no hydrogen 2.962 N/A ARG 74.A NH2 GLU 61.A OE1 no hydrogen 2.773 N/A ILE 75.A N LEU 71.A O no hydrogen 2.927 N/A ASP 76.A N LEU 72.A O no hydrogen 2.918 N/A ASP 77.A N LYS 73.A O no hydrogen 2.945 N/A LEU 78.A N ARG 74.A O no hydrogen 3.046 N/A ALA 79.A N ILE 75.A O no hydrogen 2.670 N/A LYS 80.A N ASP 76.A O no hydrogen 3.264 N/A LYS 80.A N ASP 77.A O no hydrogen 3.240 N/A LYS 80.A NZ ASP 76.A OD1 no hydrogen 3.189 N/A LYS 80.A NZ ASP 76.A OD2 no hydrogen 3.397 N/A ASP 81.A N ASP 77.A O no hydrogen 3.228 N/A ASP 81.A N LEU 78.A O no hydrogen 3.293 N/A GLN 83.A N ASP 81.A OD1 no hydrogen 2.818 N/A ILE 84.A N ASP 81.A O no hydrogen 2.724 N/A ASN 85.A N SER 28.A O no hydrogen 3.040 N/A ASN 85.A ND2 GLN 271.A OE1 no hydrogen 2.583 N/A GLY 86.A N SER 28.A O no hydrogen 2.948 N/A ILE 87.A N LYS 110.A O no hydrogen 2.934 N/A MET 88.A N LYS 30.A O no hydrogen 2.971 N/A GLU 90.A N ILE 32.A O no hydrogen 2.922 N/A PHE 97.A N PRO 94.A O no hydrogen 3.372 N/A TYR 100.A N ASP 98.A OD1 no hydrogen 3.013 N/A GLU 101.A N ASP 98.A O no hydrogen 3.126 N/A ILE 102.A N ASP 98.A O no hydrogen 3.194 N/A VAL 103.A N TYR 99.A O no hydrogen 2.902 N/A ASN 105.A N ILE 102.A O no hydrogen 3.000 N/A ASN 105.A ND2 ILE 102.A O no hydrogen 3.130 N/A ILE 106.A N VAL 103.A O no hydrogen 3.041 N/A LYS 110.A N PRO 107.A O no hydrogen 2.561 N/A LYS 110.A NZ LEU 78.A O no hydrogen 3.290 N/A LYS 110.A NZ ALA 79.A O no hydrogen 3.128 N/A LYS 110.A NZ ILE 84.A O no hydrogen 2.694 N/A ASP 111.A N TYR 108.A O no hydrogen 3.240 N/A SER 116.A N ASP 111.A OD2 no hydrogen 3.177 N/A SER 116.A OG ASP 111.A OD2 no hydrogen 2.473 N/A ASN 119.A ND2 TYR 108.A O no hydrogen 2.958 N/A ASN 119.A ND2 ASP 111.A OD2 no hydrogen 3.152 N/A GLN 120.A N SER 116.A O no hydrogen 3.147 N/A GLY 121.A N PRO 117.A O no hydrogen 2.698 N/A LEU 122.A N TYR 118.A O no hydrogen 2.988 N/A ILE 123.A N ASN 119.A O no hydrogen 3.089 N/A ALA 124.A N GLN 120.A O no hydrogen 3.086 N/A LEU 125.A N GLY 121.A O no hydrogen 2.922 N/A ASN 126.A N ILE 123.A O no hydrogen 2.915 N/A ARG 127.A N LEU 122.A O no hydrogen 2.676 N/A VAL 131.A N ASN 263.A OD1 no hydrogen 3.417 N/A ARG 136.A N PRO 132.A O no hydrogen 3.111 N/A ALA 137.A N ALA 133.A O no hydrogen 2.921 N/A VAL 138.A N THR 134.A O no hydrogen 2.853 N/A ILE 139.A N PRO 135.A O no hydrogen 3.152 N/A ASP 140.A N ARG 136.A O no hydrogen 2.864 N/A ILE 141.A N ALA 137.A O no hydrogen 3.184 N/A ILE 141.A N VAL 138.A O no hydrogen 3.239 N/A MET 142.A N VAL 138.A O no hydrogen 3.239 N/A ASP 143.A N ILE 139.A O no hydrogen 2.727 N/A TYR 144.A N ASP 140.A O no hydrogen 2.971 N/A TYR 144.A OH GLU 7.A OE2 no hydrogen 3.016 N/A TYR 145.A N ILE 141.A O no hydrogen 3.051 N/A TYR 145.A OH ARG 4.A O no hydrogen 2.848 N/A GLY 146.A N MET 142.A O no hydrogen 3.040 N/A TYR 147.A N MET 142.A O no hydrogen 3.113 N/A TYR 147.A OH GLU 243.A OE2 no hydrogen 2.682 N/A VAL 152.A N THR 175.A O no hydrogen 2.863 N/A THR 153.A N ILE 195.A O no hydrogen 2.948 N/A THR 153.A OG1 MET 189.A O no hydrogen 3.006 N/A THR 153.A OG1 SER 193.A OG no hydrogen 2.425 N/A ILE 154.A N SER 177.A O no hydrogen 2.753 N/A VAL 155.A N VAL 197.A O no hydrogen 2.797 N/A ASN 156.A N CYS 179.A O no hydrogen 2.978 N/A ASN 156.A ND2 ALA 199.A O no hydrogen 2.735 N/A SER 158.A N ASN 156.A OD1 no hydrogen 2.951 N/A SER 158.A OG ASN 156.A OD1 no hydrogen 3.350 N/A VAL 160.A N SER 158.A OG no hydrogen 3.349 N/A GLY 162.A N ASN 156.A OD1 no hydrogen 2.957 N/A ARG 163.A N SER 158.A O no hydrogen 3.099 N/A ARG 163.A NE ARG 157.A O no hydrogen 2.728 N/A LEU 165.A N VAL 161.A O no hydrogen 3.026 N/A SER 166.A N GLY 162.A O no hydrogen 3.004 N/A SER 166.A OG ARG 163.A O no hydrogen 2.930 N/A MET 167.A N ARG 163.A O no hydrogen 3.413 N/A MET 168.A N PRO 164.A O no hydrogen 2.849 N/A LEU 169.A N LEU 165.A O no hydrogen 2.850 N/A LEU 170.A N SER 166.A O no hydrogen 2.950 N/A ASN 171.A N MET 167.A O no hydrogen 2.925 N/A ASN 171.A ND2 ILE 123.A O no hydrogen 3.230 N/A ASN 171.A ND2 GLU 128.A OE2 no hydrogen 2.595 N/A ARG 172.A N LEU 169.A O no hydrogen 3.029 N/A ARG 172.A NH1 GLU 128.A OE1 no hydrogen 3.169 N/A ARG 172.A NH1 GLU 128.A OE2 no hydrogen 2.672 N/A ARG 172.A NH1 MET 168.A O no hydrogen 2.972 N/A ARG 172.A NH2 GLU 128.A OE1 no hydrogen 2.912 N/A ASN 173.A N LEU 170.A O no hydrogen 3.162 N/A TYR 174.A N LEU 169.A O no hydrogen 3.009 N/A TYR 174.A OH TYR 147.A O no hydrogen 2.554 N/A THR 175.A N ASN 150.A O no hydrogen 3.039 N/A SER 177.A N VAL 152.A O no hydrogen 2.889 N/A CYS 179.A N ILE 154.A O no hydrogen 2.937 N/A CYS 179.A SG ILE 154.A O no hydrogen 3.876 N/A HIS 180.A N THR 183.A OG1 no hydrogen 2.933 N/A LYS 182.A N HIS 180.A ND1 no hydrogen 3.283 N/A THR 183.A N HIS 180.A O no hydrogen 2.710 N/A THR 183.A OG1 HIS 180.A O no hydrogen 3.139 N/A SER 188.A N ASP 185.A OD1 no hydrogen 3.256 N/A MET 189.A N ILE 186.A O no hydrogen 2.840 N/A THR 190.A N ILE 186.A O no hydrogen 2.984 N/A THR 190.A OG1 ILE 186.A O no hydrogen 3.531 N/A THR 190.A OG1 GLY 187.A O no hydrogen 3.340 N/A THR 190.A OG1 MET 210.A O no hydrogen 2.559 N/A ARG 191.A N GLY 187.A O no hydrogen 3.033 N/A ARG 191.A NH1 GLU 209.A O no hydrogen 2.669 N/A SER 192.A N MET 189.A O no hydrogen 3.216 N/A SER 192.A OG SER 188.A O no hydrogen 3.260 N/A SER 192.A OG MET 189.A O no hydrogen 3.261 N/A SER 193.A OG THR 153.A OG1 no hydrogen 2.425 N/A LYS 194.A N THR 151.A OG1 no hydrogen 2.756 N/A LYS 194.A NZ GLY 214.A O no hydrogen 2.744 N/A LYS 194.A NZ GLU 243.A OE1 no hydrogen 2.659 N/A LYS 194.A NZ GLU 243.A OE2 no hydrogen 3.464 N/A ILE 195.A N THR 151.A O no hydrogen 2.999 N/A VAL 196.A N VAL 216.A O no hydrogen 2.984 N/A VAL 197.A N THR 153.A O no hydrogen 2.807 N/A VAL 198.A N ILE 218.A O no hydrogen 2.976 N/A ALA 199.A N VAL 155.A O no hydrogen 3.133 N/A VAL 200.A N ASP 232.A OD2 no hydrogen 2.676 N/A GLY 201.A N ASP 232.A OD2 no hydrogen 3.057 N/A ARG 202.A N ASP 232.A OD1 no hydrogen 2.742 N/A PHE 205.A N ARG 202.A O no hydrogen 3.216 N/A LEU 206.A N ASP 232.A O no hydrogen 2.922 N/A ARG 208.A N ASP 237.A OD2 no hydrogen 3.070 N/A ARG 208.A NH1 ASP 237.A O no hydrogen 2.859 N/A GLU 209.A N ASN 207.A OD1 no hydrogen 2.935 N/A MET 210.A N ASN 207.A O no hydrogen 2.944 N/A VAL 211.A N ARG 208.A O no hydrogen 3.329 N/A SER 215.A N THR 212.A O no hydrogen 3.165 N/A SER 215.A OG THR 212.A O no hydrogen 2.863 N/A VAL 216.A N LYS 194.A O no hydrogen 3.020 N/A VAL 217.A N ALA 244.A O no hydrogen 2.718 N/A ILE 218.A N VAL 196.A O no hydrogen 2.903 N/A ASP 219.A N THR 246.A OG1 no hydrogen 2.709 N/A VAL 220.A N VAL 198.A O no hydrogen 2.766 N/A GLY 221.A N ASP 219.A OD1 no hydrogen 3.092 N/A ASN 223.A N VAL 230.A O no hydrogen 2.814 N/A VAL 225.A N LYS 228.A O no hydrogen 3.025 N/A LYS 228.A N VAL 225.A O no hydrogen 3.137 N/A VAL 230.A N ASN 223.A O no hydrogen 2.725 N/A ASP 232.A N ASP 219.A OD1 no hydrogen 2.783 N/A ALA 233.A N ASP 219.A OD2 no hydrogen 2.886 N/A ASN 234.A N LEU 206.A O no hydrogen 2.785 N/A LEU 238.A N ASN 234.A O no hydrogen 2.803 N/A SER 239.A N PHE 235.A O no hydrogen 2.828 N/A SER 239.A OG PHE 235.A O no hydrogen 3.294 N/A TYR 241.A N LEU 238.A O no hydrogen 2.768 N/A TYR 241.A OH VAL 211.A O no hydrogen 3.206 N/A VAL 242.A N LEU 238.A O no hydrogen 2.867 N/A GLU 243.A N SER 215.A O no hydrogen 2.901 N/A ALA 244.A N SER 215.A O no hydrogen 3.423 N/A ILE 245.A N LYS 1.A O no hydrogen 3.074 N/A THR 246.A N VAL 217.A O no hydrogen 2.931 N/A THR 246.A OG1 VAL 217.A O no hydrogen 3.487 N/A ILE 255.A N VAL 252.A O no hydrogen 3.129 N/A THR 256.A N GLY 253.A O no hydrogen 3.319 N/A THR 256.A OG1 VAL 252.A O no hydrogen 3.410 N/A THR 256.A OG1 GLY 253.A O no hydrogen 3.223 N/A ASN 259.A N ILE 255.A O no hydrogen 2.985 N/A ASN 259.A ND2 ALA 133.A O no hydrogen 3.026 N/A ASN 259.A ND2 ASP 140.A OD2 no hydrogen 3.028 N/A ILE 260.A N THR 256.A O no hydrogen 3.068 N/A LEU 261.A N ALA 257.A O no hydrogen 3.142 N/A GLU 262.A N THR 258.A O no hydrogen 2.757 N/A ASN 263.A N ASN 259.A O no hydrogen 3.193 N/A ASN 263.A ND2 VAL 112.A O no hydrogen 2.632 N/A ASN 263.A ND2 VAL 131.A O no hydrogen 2.831 N/A VAL 264.A N ILE 260.A O no hydrogen 3.031 N/A VAL 265.A N LEU 261.A O no hydrogen 3.048 N/A LYS 266.A N GLU 262.A O no hydrogen 3.067 N/A ALA 267.A N ASN 263.A O no hydrogen 2.724 N/A ALA 268.A N VAL 264.A O no hydrogen 3.017 N/A GLU 269.A N VAL 265.A O no hydrogen 2.844 N/A PHE 270.A N LYS 266.A O no hydrogen 2.919 N/A GLN 271.A N ALA 267.A O no hydrogen 2.960 N/A GLN 271.A NE2 ASN 85.A O no hydrogen 2.876 N/A GLN 271.A NE2 TYR 109.A O no hydrogen 2.926 N/A LYS 272.A N ALA 268.A O no hydrogen 3.135 N/A LYS 272.A NZ SER 23.A O no hydrogen 3.007 N/A ASN 273.A N GLU 269.A O no hydrogen 3.110 N/A LEU 275.A N GLN 271.A O no hydrogen 2.698 N/A