Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1dqx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 267.A OD1 no hydrogen 3.093 N/A LYS 3.A NZ GLY 227.A O no hydrogen 2.919 N/A LYS 3.A NZ ASP 229.A OD1 no hydrogen 3.164 N/A LYS 3.A NZ ASP 229.A OD2 no hydrogen 3.026 N/A THR 5.A N GLU 8.A OE1 no hydrogen 2.992 N/A TYR 6.A N TYR 259.A OH no hydrogen 3.098 N/A TYR 6.A OH ASP 229.A O no hydrogen 2.594 N/A ARG 9.A N THR 5.A O no hydrogen 3.253 N/A ARG 9.A NE ASP 196.A OD1 no hydrogen 3.009 N/A ARG 9.A NH1 ASP 229.A OD1 no hydrogen 2.853 N/A ARG 9.A NH2 ASP 196.A OD1 no hydrogen 3.350 N/A ARG 9.A NH2 ASP 229.A OD1 no hydrogen 3.310 N/A ARG 9.A NH2 ASP 229.A OD2 no hydrogen 2.831 N/A ALA 10.A N TYR 6.A O no hydrogen 3.016 N/A THR 12.A OG1 GLU 8.A O no hydrogen 2.915 N/A HIS 13.A N ARG 9.A O no hydrogen 2.775 N/A SER 15.A N HIS 13.A ND1 no hydrogen 3.040 N/A ALA 19.A N SER 15.A O no hydrogen 3.060 N/A LYS 20.A N PRO 16.A O no hydrogen 3.054 N/A LEU 21.A N VAL 17.A O no hydrogen 2.898 N/A PHE 22.A N ALA 18.A O no hydrogen 2.962 N/A ASN 23.A N ALA 19.A O no hydrogen 2.929 N/A ILE 24.A N LYS 20.A O no hydrogen 2.779 N/A MET 25.A N LEU 21.A O no hydrogen 2.859 N/A HIS 26.A N PHE 22.A O no hydrogen 3.075 N/A GLU 27.A N ASN 23.A O no hydrogen 2.662 N/A LYS 28.A N ILE 24.A O no hydrogen 2.938 N/A LYS 28.A NZ GLY 52.A O no hydrogen 3.169 N/A LYS 28.A NZ ILE 55.A O no hydrogen 2.860 N/A LYS 28.A NZ TYR 84.A O no hydrogen 2.754 N/A LYS 28.A NZ ASN 85.A O no hydrogen 3.167 N/A GLN 29.A N HIS 26.A O no hydrogen 3.260 N/A THR 30.A N MET 25.A O no hydrogen 3.008 N/A THR 30.A OG1 LYS 28.A O no hydrogen 3.378 N/A THR 30.A OG1 LYS 54.A O no hydrogen 3.281 N/A ASN 31.A ND2 GLY 255.A O no hydrogen 2.883 N/A CYS 33.A N ILE 231.A O no hydrogen 2.887 N/A CYS 33.A SG ALA 34.A O no hydrogen 3.929 N/A CYS 33.A SG LEU 57.A O no hydrogen 3.862 N/A ALA 34.A N LEU 57.A O no hydrogen 3.138 N/A SER 35.A N VAL 233.A O no hydrogen 2.915 N/A SER 35.A OG ASP 37.A OD1 no hydrogen 3.227 N/A SER 35.A OG ASP 37.A OD2 no hydrogen 3.000 N/A VAL 38.A N LEU 36.A O no hydrogen 3.188 N/A THR 40.A OG1 GLU 43.A OE1 no hydrogen 2.958 N/A THR 41.A N ASP 67.A OD2 no hydrogen 2.813 N/A THR 41.A OG1 ASP 67.A O no hydrogen 3.366 N/A THR 41.A OG1 ASP 67.A OD2 no hydrogen 2.930 N/A THR 41.A OG1 THR 73.A OG1 no hydrogen 2.867 N/A LEU 44.A N THR 40.A O no hydrogen 3.054 N/A LEU 45.A N THR 41.A O no hydrogen 2.857 N/A GLU 46.A N LYS 42.A O no hydrogen 3.120 N/A LEU 47.A N GLU 43.A O no hydrogen 2.794 N/A VAL 48.A N LEU 44.A O no hydrogen 2.866 N/A GLU 49.A N LEU 45.A O no hydrogen 3.064 N/A ALA 50.A N GLU 46.A O no hydrogen 3.206 N/A LEU 51.A N LEU 47.A O no hydrogen 2.879 N/A GLY 52.A N VAL 48.A O no hydrogen 2.578 N/A LYS 54.A N LEU 51.A O no hydrogen 2.706 N/A LYS 54.A NZ GLU 249.A OE2 no hydrogen 2.735 N/A CYS 56.A N LEU 32.A O no hydrogen 3.060 N/A CYS 56.A SG LEU 32.A O no hydrogen 3.844 N/A LEU 58.A N LEU 87.A O no hydrogen 2.941 N/A LYS 59.A N ALA 34.A O no hydrogen 2.941 N/A LYS 59.A NZ SER 35.A OG no hydrogen 2.977 N/A LYS 59.A NZ ASP 91.A OD2 no hydrogen 3.166 N/A THR 60.A N PHE 89.A O no hydrogen 2.587 N/A THR 60.A OG1 PHE 89.A O no hydrogen 3.393 N/A THR 60.A OG1 GLU 90.A OE1 no hydrogen 2.603 N/A VAL 62.A N GLU 90.A OE1 no hydrogen 3.402 N/A VAL 62.A N GLU 90.A OE2 no hydrogen 3.446 N/A ILE 64.A N HIS 61.A O no hydrogen 3.295 N/A LEU 65.A N VAL 62.A O no hydrogen 3.067 N/A THR 66.A N ARG 39.A O no hydrogen 2.613 N/A SER 69.A N THR 73.A OG1 no hydrogen 3.164 N/A GLY 72.A N SER 69.A OG no hydrogen 2.901 N/A THR 73.A N SER 69.A O no hydrogen 2.791 N/A THR 73.A OG1 THR 41.A OG1 no hydrogen 2.867 N/A THR 73.A OG1 SER 69.A O no hydrogen 3.320 N/A VAL 74.A N SER 69.A O no hydrogen 3.454 N/A LYS 75.A N MET 70.A O no hydrogen 2.974 N/A LEU 77.A N THR 73.A O no hydrogen 3.161 N/A LYS 78.A N VAL 74.A O no hydrogen 2.798 N/A ALA 79.A N LYS 75.A O no hydrogen 3.137 N/A LEU 80.A N PRO 76.A O no hydrogen 2.938 N/A SER 81.A N LEU 77.A O no hydrogen 2.843 N/A SER 81.A OG PHE 86.A O no hydrogen 2.391 N/A ALA 82.A N LYS 78.A O no hydrogen 2.990 N/A LYS 83.A N ALA 79.A O no hydrogen 2.685 N/A LYS 83.A NZ TYR 84.A OH no hydrogen 3.296 N/A TYR 84.A N LEU 80.A O no hydrogen 2.747 N/A TYR 84.A OH GLU 49.A OE1 no hydrogen 2.987 N/A PHE 86.A N SER 81.A O no hydrogen 3.173 N/A LEU 87.A N CYS 56.A O no hydrogen 3.284 N/A LEU 88.A N ASP 117.A OD2 no hydrogen 2.700 N/A PHE 89.A N LEU 58.A O no hydrogen 2.810 N/A GLU 90.A N ILE 118.A O no hydrogen 2.961 N/A ASP 91.A N THR 60.A O no hydrogen 2.791 N/A ARG 92.A NE ARG 92.A O no hydrogen 2.693 N/A LYS 93.A N ASN 120.A OD1 no hydrogen 2.788 N/A LYS 93.A NZ ASP 91.A OD1 no hydrogen 2.605 N/A LYS 93.A NZ ASP 91.A OD2 no hydrogen 2.623 N/A PHE 94.A N ASN 120.A O no hydrogen 3.104 N/A ILE 97.A N ASP 96.A OD1 no hydrogen 2.754 N/A VAL 101.A N ILE 97.A O no hydrogen 2.956 N/A LYS 102.A N GLY 98.A O no hydrogen 3.173 N/A LEU 103.A N THR 100.A O no hydrogen 3.139 N/A GLN 104.A N THR 100.A O no hydrogen 3.050 N/A TYR 105.A N VAL 101.A O no hydrogen 2.809 N/A SER 106.A N LYS 102.A O no hydrogen 3.197 N/A SER 106.A OG LYS 102.A O no hydrogen 2.573 N/A ALA 107.A N LEU 103.A O no hydrogen 3.147 N/A ARG 111.A N ALA 107.A O no hydrogen 2.924 N/A ARG 111.A NE GLU 114.A OE1 no hydrogen 3.315 N/A ARG 111.A NE GLU 114.A OE2 no hydrogen 3.219 N/A ARG 111.A NH2 GLU 114.A OE1 no hydrogen 3.111 N/A ALA 113.A N TYR 105.A O no hydrogen 2.811 N/A GLU 114.A N ARG 111.A O no hydrogen 2.943 N/A TRP 115.A N ILE 112.A O no hydrogen 3.279 N/A TRP 115.A NE1 TYR 110.A O no hydrogen 2.834 N/A ALA 116.A N ILE 112.A O no hydrogen 3.026 N/A ILE 118.A N LEU 88.A O no hydrogen 2.917 N/A THR 119.A N GLY 146.A O no hydrogen 3.169 N/A ASN 120.A ND2 ASP 91.A OD1 no hydrogen 2.735 N/A ALA 121.A N LEU 148.A O no hydrogen 3.150 N/A HIS 122.A N PHE 94.A O no hydrogen 2.919 N/A VAL 124.A N TYR 164.A OH no hydrogen 3.049 N/A GLY 126.A N GLY 123.A O no hydrogen 3.130 N/A VAL 130.A N PRO 127.A O no hydrogen 3.096 N/A SER 131.A OG GLY 128.A O no hydrogen 3.204 N/A GLY 132.A N GLY 128.A O no hydrogen 3.200 N/A LEU 133.A N ILE 129.A O no hydrogen 2.820 N/A LYS 134.A N VAL 130.A O no hydrogen 3.086 N/A LYS 134.A NZ ASP 175.A OD1 no hydrogen 3.529 N/A GLN 135.A N SER 131.A O no hydrogen 2.899 N/A ALA 136.A N GLY 132.A O no hydrogen 3.099 N/A ALA 137.A N LEU 133.A O no hydrogen 3.142 N/A GLU 138.A N LYS 134.A O no hydrogen 3.070 N/A GLU 139.A N GLN 135.A O no hydrogen 3.000 N/A VAL 140.A N ALA 137.A O no hydrogen 3.202 N/A THR 141.A N ALA 137.A O no hydrogen 2.883 N/A THR 141.A OG1 ALA 113.A O no hydrogen 3.485 N/A ARG 145.A NE PRO 144.A O no hydrogen 3.231 N/A ARG 145.A NH1 ALA 113.A O no hydrogen 2.406 N/A GLY 146.A N ASP 117.A O no hydrogen 3.016 N/A LEU 147.A N PHE 178.A O no hydrogen 2.829 N/A LEU 148.A N THR 119.A O no hydrogen 2.948 N/A MET 149.A N GLY 181.A O no hydrogen 3.131 N/A LEU 150.A N ALA 121.A O no hydrogen 3.186 N/A ALA 151.A N ILE 183.A O no hydrogen 3.010 N/A GLU 152.A N ILE 183.A O no hydrogen 3.394 N/A LYS 156.A N GLY 214.A O no hydrogen 2.685 N/A SER 158.A N CYS 155.A O no hydrogen 3.434 N/A SER 160.A N SER 158.A OG no hydrogen 2.989 N/A THR 161.A OG1 LEU 159.A O no hydrogen 3.506 N/A THR 165.A N THR 161.A O no hydrogen 3.225 N/A THR 165.A OG1 ALA 151.A O no hydrogen 3.181 N/A LYS 166.A N GLY 162.A O no hydrogen 2.887 N/A LYS 166.A N GLU 163.A O no hydrogen 2.963 N/A GLY 167.A N GLU 163.A O no hydrogen 3.043 N/A THR 168.A N TYR 164.A O no hydrogen 3.021 N/A THR 168.A OG1 TYR 164.A O no hydrogen 2.862 N/A VAL 169.A N THR 165.A O no hydrogen 2.982 N/A ASP 170.A N LYS 166.A O no hydrogen 2.931 N/A ILE 171.A N GLY 167.A O no hydrogen 3.177 N/A ALA 172.A N THR 168.A O no hydrogen 3.306 N/A LYS 173.A N ASP 170.A O no hydrogen 3.273 N/A LYS 173.A NZ ASP 170.A OD2 no hydrogen 3.533 N/A LYS 173.A NZ GLU 193.A OE2 no hydrogen 3.283 N/A SER 174.A N ILE 171.A O no hydrogen 3.366 N/A SER 174.A OG ILE 171.A O no hydrogen 3.030 N/A LYS 176.A NZ GLU 193.A O no hydrogen 3.316 N/A LYS 176.A NZ GLY 194.A O no hydrogen 2.975 N/A ASP 177.A N ASP 175.A OD2 no hydrogen 3.219 N/A PHE 178.A N ASP 175.A OD2 no hydrogen 3.175 N/A VAL 179.A N ASP 175.A O no hydrogen 2.840 N/A ILE 180.A N LEU 147.A O no hydrogen 2.875 N/A PHE 182.A N LEU 198.A O no hydrogen 2.682 N/A ILE 183.A N MET 149.A O no hydrogen 2.873 N/A ALA 184.A N MET 200.A O no hydrogen 3.339 N/A GLN 185.A N GLU 152.A OE2 no hydrogen 3.050 N/A ASP 187.A N THR 226.A O no hydrogen 3.087 N/A GLY 189.A N ASP 187.A OD2 no hydrogen 2.861 N/A GLU 193.A N GLY 190.A O no hydrogen 2.701 N/A GLY 194.A N ARG 191.A O no hydrogen 3.114 N/A TYR 195.A N GLY 190.A O no hydrogen 3.188 N/A TYR 195.A OH LYS 173.A O no hydrogen 2.772 N/A LEU 198.A N ILE 180.A O no hydrogen 2.937 N/A ILE 199.A N ASP 229.A OD2 no hydrogen 3.019 N/A MET 200.A N PHE 182.A O no hydrogen 3.018 N/A THR 201.A N ILE 230.A O no hydrogen 2.958 N/A THR 201.A OG1 PRO 202.A O no hydrogen 3.520 N/A GLY 205.A N ARG 218.A O no hydrogen 3.094 N/A LEU 206.A N TYR 251.A OH no hydrogen 2.884 N/A ASP 211.A N GLN 215.A O no hydrogen 2.562 N/A GLY 214.A N ASP 211.A OD2 no hydrogen 3.430 N/A GLN 215.A NE2 SER 154.A O no hydrogen 3.600 N/A GLN 215.A NE2 SER 154.A OG no hydrogen 3.021 N/A GLN 216.A NE2 SER 154.A O no hydrogen 3.151 N/A TYR 217.A N LYS 209.A O no hydrogen 3.389 N/A ARG 218.A N GLY 203.A O no hydrogen 2.995 N/A ARG 218.A NE ASP 222.A OD1 no hydrogen 3.094 N/A ARG 218.A NH1 GLN 185.A O no hydrogen 2.812 N/A ARG 218.A NH2 ASP 222.A OD2 no hydrogen 2.731 N/A ARG 218.A NH2 THR 226.A OG1 no hydrogen 2.765 N/A ASP 222.A N THR 219.A OG1 no hydrogen 3.098 N/A VAL 223.A N THR 219.A O no hydrogen 3.126 N/A VAL 224.A N VAL 220.A O no hydrogen 3.151 N/A SER 225.A N ASP 221.A O no hydrogen 3.188 N/A SER 225.A OG ASP 221.A O no hydrogen 2.975 N/A SER 225.A OG ASP 222.A O no hydrogen 2.712 N/A THR 226.A N VAL 223.A O no hydrogen 2.784 N/A THR 226.A OG1 ASP 222.A O no hydrogen 2.875 N/A GLY 227.A N VAL 224.A O no hydrogen 2.682 N/A SER 228.A N VAL 224.A O no hydrogen 3.332 N/A SER 228.A OG VAL 223.A O no hydrogen 2.845 N/A ASP 229.A N ILE 199.A O no hydrogen 2.821 N/A ILE 230.A N ILE 199.A O no hydrogen 3.140 N/A ILE 231.A N ASN 31.A O no hydrogen 2.744 N/A ILE 232.A N THR 201.A O no hydrogen 2.951 N/A VAL 233.A N CYS 33.A O no hydrogen 3.124 N/A LEU 237.A N GLY 234.A O no hydrogen 2.844 N/A ALA 239.A N ARG 235.A O no hydrogen 3.135 N/A ARG 242.A N ALA 239.A O no hydrogen 2.818 N/A ARG 242.A NE ARG 235.A O no hydrogen 3.067 N/A ARG 242.A NH2 ASP 208.A OD1 no hydrogen 2.680 N/A LYS 245.A N ASP 243.A OD2 no hydrogen 3.001 N/A GLU 247.A N ASP 243.A O no hydrogen 2.857 N/A GLY 248.A N ALA 244.A O no hydrogen 2.763 N/A GLU 249.A N LYS 245.A O no hydrogen 3.409 N/A ARG 250.A N VAL 246.A O no hydrogen 2.945 N/A ARG 250.A NH1 ASP 207.A OD2 no hydrogen 2.581 N/A ARG 250.A NH1 GLU 247.A OE2 no hydrogen 3.232 N/A ARG 250.A NH2 ASP 207.A OD1 no hydrogen 3.389 N/A TYR 251.A N GLU 247.A O no hydrogen 2.714 N/A ARG 252.A N GLY 248.A O no hydrogen 2.921 N/A ARG 252.A NE GLN 29.A O no hydrogen 2.863 N/A ARG 252.A NH2 GLN 29.A O no hydrogen 3.086 N/A LYS 253.A N GLU 249.A O no hydrogen 3.076 N/A ALA 254.A N ARG 250.A O no hydrogen 2.930 N/A GLY 255.A N TYR 251.A O no hydrogen 2.864 N/A TRP 256.A N ARG 252.A O no hydrogen 2.966 N/A GLU 257.A N LYS 253.A O no hydrogen 3.095 N/A ALA 258.A N ALA 254.A O no hydrogen 3.382 N/A TYR 259.A N TRP 256.A O no hydrogen 3.246 N/A LEU 260.A N TRP 256.A O no hydrogen 3.025 N/A ARG 261.A N GLU 257.A O no hydrogen 3.117 N/A ARG 261.A NH1 ASP 221.A OD1 no hydrogen 2.779 N/A ARG 262.A NH1 VAL 224.A O no hydrogen 3.182 N/A CYS 263.A N TYR 259.A O no hydrogen 2.963 N/A CYS 263.A SG LYS 3.A O no hydrogen 3.998 N/A GLY 264.A N ARG 261.A O no hydrogen 3.293 N/A GLN 265.A N ARG 262.A O no hydrogen 3.137 N/A GLN 266.A NE2 GLY 264.A O no hydrogen 3.308 N/A