Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1dwq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ ASP 258.A O no hydrogen 3.340 N/A VAL 6.A N ASP 258.A OD1 no hydrogen 2.767 N/A ALA 8.A N HIS 35.A ND1 no hydrogen 3.055 N/A HIS 9.A NE2 THR 38.A OG1 no hydrogen 2.658 N/A PHE 10.A N LYS 36.A O no hydrogen 2.968 N/A VAL 11.A N ILE 79.A O no hydrogen 2.797 N/A LEU 12.A N THR 38.A O no hydrogen 2.872 N/A ILE 13.A N VAL 81.A O no hydrogen 2.717 N/A HIS 14.A ND1 LEU 40.A O no hydrogen 3.297 N/A THR 15.A N GLU 83.A OE1 no hydrogen 2.795 N/A THR 15.A OG1 SER 84.A OG no hydrogen 3.225 N/A CYS 17.A SG MET 150.A O no hydrogen 3.961 N/A HIS 18.A N THR 15.A O no hydrogen 3.217 N/A HIS 18.A ND1 ILE 16.A O no hydrogen 2.860 N/A ALA 20.A N ASP 41.A OD1 no hydrogen 2.816 N/A ILE 22.A N GLY 19.A O no hydrogen 3.232 N/A TRP 23.A N ALA 20.A O no hydrogen 3.007 N/A HIS 24.A N TRP 21.A O no hydrogen 3.039 N/A HIS 24.A ND1 TRP 21.A O no hydrogen 2.891 N/A LYS 27.A N TRP 23.A O no hydrogen 2.862 N/A LYS 27.A NZ GLU 31.A OE2 no hydrogen 2.756 N/A ALA 29.A N LYS 25.A O no hydrogen 3.402 N/A LEU 30.A N LEU 26.A O no hydrogen 2.980 N/A GLU 31.A N LYS 27.A O no hydrogen 3.027 N/A ARG 32.A N PRO 28.A O no hydrogen 2.840 N/A GLY 34.A N GLU 31.A O no hydrogen 2.832 N/A HIS 35.A N LEU 30.A O no hydrogen 3.229 N/A LYS 36.A N ALA 8.A O no hydrogen 2.863 N/A LYS 36.A NZ THR 38.A OG1 no hydrogen 3.081 N/A THR 38.A N PHE 10.A O no hydrogen 2.899 N/A THR 38.A OG1 HIS 9.A NE2 no hydrogen 2.658 N/A ALA 43.A N TYR 61.A O no hydrogen 3.000 N/A ALA 44.A N ASP 48.A OD2 no hydrogen 2.865 N/A SER 45.A N MET 42.A O no hydrogen 3.096 N/A SER 45.A OG MET 42.A O no hydrogen 3.376 N/A SER 45.A OG ALA 43.A O no hydrogen 2.756 N/A GLY 46.A N HIS 18.A O no hydrogen 3.279 N/A ILE 47.A N ASP 41.A OD2 no hydrogen 3.063 N/A ASP 48.A N SER 45.A O no hydrogen 2.924 N/A ARG 50.A N ASP 48.A OD2 no hydrogen 3.047 N/A ARG 50.A NE ASP 48.A OD2 no hydrogen 3.056 N/A ARG 50.A NH1 GLU 63.A OE1 no hydrogen 2.943 N/A ARG 50.A NH2 ASP 48.A OD1 no hydrogen 2.853 N/A ARG 50.A NH2 GLU 63.A OE1 no hydrogen 2.924 N/A GLN 51.A N GLN 54.A OE1 no hydrogen 3.216 N/A GLN 54.A N GLN 51.A O no hydrogen 3.100 N/A ILE 55.A N ILE 52.A O no hydrogen 2.876 N/A ASN 56.A N GLU 60.A OE2 no hydrogen 2.905 N/A GLU 60.A N SER 57.A OG no hydrogen 3.020 N/A TYR 61.A N SER 57.A O no hydrogen 2.955 N/A TYR 61.A OH HIS 14.A NE2 no hydrogen 3.247 N/A SER 62.A N PHE 58.A O no hydrogen 3.027 N/A SER 62.A N ASP 59.A O no hydrogen 3.121 N/A SER 62.A OG PHE 58.A O no hydrogen 2.846 N/A SER 62.A OG ASN 88.A OD1 no hydrogen 2.772 N/A GLU 63.A N GLU 60.A O no hydrogen 3.177 N/A LEU 65.A N SER 62.A O no hydrogen 2.909 N/A LEU 66.A N SER 62.A O no hydrogen 3.307 N/A THR 67.A N GLU 63.A O no hydrogen 2.979 N/A THR 67.A OG1 GLU 63.A O no hydrogen 3.202 N/A THR 67.A OG1 GLU 63.A OE2 no hydrogen 2.765 N/A PHE 68.A N PRO 64.A O no hydrogen 3.111 N/A LEU 69.A N LEU 65.A O no hydrogen 2.807 N/A GLU 70.A N LEU 66.A O no hydrogen 2.723 N/A LYS 71.A N THR 67.A O no hydrogen 2.826 N/A LEU 72.A N LEU 69.A O no hydrogen 3.257 N/A GLU 76.A N PRO 73.A O no hydrogen 2.832 N/A VAL 78.A N LYS 99.A O no hydrogen 2.740 N/A ILE 79.A N HIS 9.A O no hydrogen 2.893 N/A ILE 80.A N ALA 102.A O no hydrogen 3.320 N/A VAL 81.A N VAL 11.A O no hydrogen 2.854 N/A GLY 82.A N VAL 104.A O no hydrogen 3.012 N/A GLU 83.A N ILE 13.A O no hydrogen 3.060 N/A SER 84.A OG THR 15.A OG1 no hydrogen 3.225 N/A ILE 89.A N ALA 85.A O no hydrogen 3.059 N/A ALA 90.A N GLY 86.A O no hydrogen 3.037 N/A ILE 91.A N LEU 87.A O no hydrogen 2.871 N/A ALA 92.A N ASN 88.A O no hydrogen 2.934 N/A ALA 93.A N ILE 89.A O no hydrogen 2.889 N/A ASP 94.A N ALA 90.A O no hydrogen 3.339 N/A ARG 95.A N ALA 92.A O no hydrogen 2.995 N/A TYR 96.A N ALA 92.A O no hydrogen 2.750 N/A TYR 96.A OH GLU 70.A OE1 no hydrogen 2.921 N/A LYS 99.A N TYR 96.A O no hydrogen 2.770 N/A LYS 99.A NZ LEU 69.A O no hydrogen 3.121 N/A ILE 100.A N VAL 97.A O no hydrogen 3.072 N/A ALA 101.A N VAL 78.A O no hydrogen 2.853 N/A GLY 103.A N LYS 202.A O no hydrogen 2.834 N/A VAL 104.A N ILE 80.A O no hydrogen 2.885 N/A PHE 105.A N VAL 204.A O no hydrogen 2.794 N/A HIS 106.A N GLY 82.A O no hydrogen 2.907 N/A HIS 106.A ND1 HIS 106.A O no hydrogen 2.764 N/A ASN 107.A N ILE 206.A O no hydrogen 2.910 N/A ASN 107.A ND2 ASP 238.A O no hydrogen 3.654 N/A ASN 107.A ND2 HIS 239.A O no hydrogen 2.762 N/A SER 108.A OG SER 84.A O no hydrogen 2.974 N/A SER 108.A OG LEU 109.A O no hydrogen 2.809 N/A LEU 109.A N SER 84.A O no hydrogen 2.844 N/A LEU 110.A N GLN 222.A OE1 no hydrogen 2.811 N/A THR 113.A OG1 GLU 195.A OE2 no hydrogen 3.091 N/A HIS 115.A N ASP 112.A OD1 no hydrogen 2.677 N/A HIS 115.A ND1 ASP 112.A OD2 no hydrogen 2.754 N/A SER 116.A OG SER 118.A OG no hydrogen 2.911 N/A SER 118.A N SER 116.A OG no hydrogen 3.255 N/A SER 118.A OG SER 116.A OG no hydrogen 2.911 N/A SER 118.A OG GLU 122.A OE1 no hydrogen 2.977 N/A TYR 119.A N SER 116.A O no hydrogen 3.224 N/A GLU 122.A N SER 118.A O no hydrogen 2.922 N/A LYS 123.A N TYR 119.A O no hydrogen 2.966 N/A LYS 123.A NZ GLU 126.A OE2 no hydrogen 3.288 N/A LEU 124.A N THR 120.A O no hydrogen 2.816 N/A LEU 125.A N VAL 121.A O no hydrogen 2.907 N/A GLU 126.A N GLU 122.A O no hydrogen 2.991 N/A SER 127.A N LYS 123.A O no hydrogen 2.974 N/A PHE 128.A N LEU 124.A O no hydrogen 2.638 N/A TRP 131.A NE1 PHE 128.A O no hydrogen 3.017 N/A ARG 132.A N ASP 130.A OD2 no hydrogen 3.313 N/A ARG 132.A NE ASN 160.A OD1 no hydrogen 3.207 N/A ARG 132.A NH1 GLU 159.A OE1 no hydrogen 3.426 N/A ARG 132.A NH2 GLU 159.A OE1 no hydrogen 2.787 N/A ARG 132.A NH2 ASN 160.A OD1 no hydrogen 2.940 N/A THR 134.A N TRP 131.A O no hydrogen 3.076 N/A THR 134.A OG1 TRP 131.A O no hydrogen 2.745 N/A GLU 135.A N LYS 151.A O no hydrogen 3.098 N/A PHE 137.A N THR 149.A O no hydrogen 2.794 N/A PHE 139.A N ILE 147.A O no hydrogen 2.966 N/A ASN 141.A N GLU 145.A O no hydrogen 2.862 N/A ASN 141.A ND2 THR 143.A OG1 no hydrogen 3.201 N/A THR 143.A OG1 GLU 145.A OE2 no hydrogen 3.410 N/A GLY 144.A N ASN 141.A O no hydrogen 2.796 N/A ILE 147.A N PHE 139.A O no hydrogen 2.921 N/A THR 149.A N PHE 137.A O no hydrogen 2.701 N/A MET 150.A N GLY 180.A O no hydrogen 2.948 N/A LYS 151.A N GLU 135.A O no hydrogen 2.954 N/A LYS 151.A NZ LEU 152.A O no hydrogen 2.897 N/A GLY 153.A N THR 134.A OG1 no hydrogen 3.227 N/A VAL 155.A N ASP 133.A OD2 no hydrogen 3.040 N/A LEU 156.A N ASP 133.A OD1 no hydrogen 3.034 N/A LEU 157.A N GLY 153.A O no hydrogen 2.880 N/A ARG 158.A N PHE 154.A O no hydrogen 2.832 N/A ARG 158.A NH1 CYS 165.A O no hydrogen 3.337 N/A GLU 159.A N VAL 155.A O no hydrogen 2.748 N/A ASN 160.A N LEU 156.A O no hydrogen 2.868 N/A ASN 160.A ND2 LYS 212.A O no hydrogen 2.958 N/A LEU 161.A N LEU 156.A O no hydrogen 3.288 N/A PHE 162.A N LEU 157.A O no hydrogen 2.712 N/A THR 163.A OG1 GLU 159.A O no hydrogen 2.790 N/A LYS 164.A N ASP 238.A OD2 no hydrogen 2.918 N/A CYS 165.A N PHE 162.A O no hydrogen 2.900 N/A CYS 165.A SG ASP 238.A OD2 no hydrogen 3.291 N/A GLU 169.A N THR 166.A O no hydrogen 2.999 N/A TYR 170.A N THR 166.A O no hydrogen 2.833 N/A TYR 170.A OH PHE 154.A O no hydrogen 3.060 N/A GLU 171.A N ASP 167.A O no hydrogen 2.809 N/A LEU 172.A N GLY 168.A O no hydrogen 3.052 N/A ALA 173.A N GLU 169.A O no hydrogen 2.995 N/A LYS 174.A N TYR 170.A O no hydrogen 3.215 N/A LYS 174.A NZ GLU 171.A OE1 no hydrogen 3.128 N/A MET 175.A N GLU 171.A O no hydrogen 3.053 N/A VAL 176.A N LEU 172.A O no hydrogen 3.167 N/A VAL 176.A N ALA 173.A O no hydrogen 3.347 N/A MET 177.A N ALA 173.A O no hydrogen 2.854 N/A ARG 178.A N CYS 17.A O no hydrogen 2.798 N/A ARG 178.A NH1 GLY 46.A O no hydrogen 2.872 N/A ARG 178.A NH1 ASP 48.A O no hydrogen 2.763 N/A ARG 178.A NH2 ASP 48.A O no hydrogen 3.338 N/A ARG 178.A NH2 ARG 50.A O no hydrogen 2.808 N/A LYS 179.A NZ GLU 53.A OE2 no hydrogen 3.521 N/A GLY 180.A N MET 150.A O no hydrogen 3.108 N/A SER 181.A OG THR 148.A O no hydrogen 2.690 N/A PHE 183.A N SER 181.A OG no hydrogen 2.808 N/A GLN 184.A NE2 GLU 122.A OE1 no hydrogen 3.490 N/A ASN 185.A ND2 THR 146.A O no hydrogen 3.179 N/A VAL 186.A N PHE 183.A O no hydrogen 2.938 N/A LEU 187.A N PHE 183.A O no hydrogen 2.797 N/A ALA 188.A N GLN 184.A O no hydrogen 2.993 N/A GLN 189.A N ASN 185.A O no hydrogen 3.362 N/A GLN 189.A N VAL 186.A O no hydrogen 3.168 N/A ARG 190.A N LEU 187.A O no hydrogen 2.970 N/A ARG 190.A NE ASP 59.A OD1 no hydrogen 2.965 N/A ARG 190.A NH1 PRO 191.A O no hydrogen 2.743 N/A ARG 190.A NH2 ASP 59.A OD2 no hydrogen 3.130 N/A LYS 192.A NZ VAL 114.A O no hydrogen 2.862 N/A THR 194.A N ASP 94.A OD1 no hydrogen 3.165 N/A THR 194.A N ASP 94.A OD2 no hydrogen 2.992 N/A THR 194.A OG1 ASP 94.A OD1 no hydrogen 2.980 N/A GLY 197.A N THR 194.A OG1 no hydrogen 3.077 N/A TYR 198.A N ASP 94.A OD1 no hydrogen 2.925 N/A TYR 198.A OH PRO 111.A O no hydrogen 2.789 N/A GLY 199.A N THR 194.A O no hydrogen 2.708 N/A SER 200.A N GLY 197.A O no hydrogen 2.946 N/A SER 200.A OG LYS 196.A O no hydrogen 2.467 N/A SER 200.A OG GLY 197.A O no hydrogen 2.734 N/A ILE 201.A N TYR 198.A O no hydrogen 3.139 N/A LYS 203.A N ASP 229.A OD2 no hydrogen 3.116 N/A LYS 203.A NZ TYR 198.A O no hydrogen 2.902 N/A LYS 203.A NZ GLY 199.A O no hydrogen 3.434 N/A LYS 203.A NZ ILE 201.A O no hydrogen 2.803 N/A VAL 204.A N GLY 103.A O no hydrogen 3.011 N/A TYR 205.A N LYS 230.A O no hydrogen 2.814 N/A TYR 205.A OH GLN 219.A OE1 no hydrogen 2.652 N/A ILE 206.A N PHE 105.A O no hydrogen 2.789 N/A TRP 207.A N TYR 232.A O no hydrogen 3.102 N/A THR 208.A OG1 VAL 234.A O no hydrogen 3.099 N/A THR 208.A OG1 GLY 236.A O no hydrogen 2.570 N/A GLN 210.A N THR 208.A OG1 no hydrogen 2.964 N/A GLN 210.A NE2 ASP 209.A OD1 no hydrogen 2.986 N/A ASP 211.A N THR 208.A O no hydrogen 3.487 N/A ILE 213.A N ASP 211.A OD1 no hydrogen 2.926 N/A PHE 214.A N ASP 211.A OD1 no hydrogen 2.885 N/A PHE 218.A N LEU 215.A O no hydrogen 2.757 N/A GLN 219.A N LEU 215.A O no hydrogen 2.907 N/A GLN 219.A NE2 ASN 107.A OD1 no hydrogen 3.093 N/A GLN 219.A NE2 PHE 214.A O no hydrogen 2.986 N/A ARG 220.A N PRO 216.A O no hydrogen 2.935 N/A TRP 221.A N ASP 217.A O no hydrogen 3.313 N/A GLN 222.A N PHE 218.A O no hydrogen 2.893 N/A GLN 222.A NE2 SER 108.A O no hydrogen 2.729 N/A GLN 222.A NE2 TYR 205.A OH no hydrogen 2.759 N/A ILE 223.A N GLN 219.A O no hydrogen 3.088 N/A ALA 224.A N ARG 220.A O no hydrogen 2.887 N/A ASN 225.A N TRP 221.A O no hydrogen 2.700 N/A ASN 225.A ND2 ASP 112.A OD2 no hydrogen 2.954 N/A TYR 226.A N GLN 222.A O no hydrogen 3.015 N/A ASP 229.A N LYS 203.A O no hydrogen 2.700 N/A LYS 230.A N LYS 203.A O no hydrogen 3.291 N/A TYR 232.A N TYR 205.A O no hydrogen 2.762 N/A TYR 232.A OH GLU 255.A OE2 no hydrogen 2.948 N/A VAL 234.A N TRP 207.A O no hydrogen 2.778 N/A ASP 238.A N THR 244.A OG1 no hydrogen 3.300 N/A HIS 239.A ND1 ASP 211.A OD2 no hydrogen 2.792 N/A LYS 240.A NZ HIS 18.A NE2 no hydrogen 3.088 N/A LYS 240.A NZ GLU 83.A OE1 no hydrogen 3.412 N/A LYS 240.A NZ GLU 83.A OE2 no hydrogen 2.837 N/A GLN 242.A N GLN 242.A OE1 no hydrogen 2.835 N/A GLN 242.A NE2 GLU 83.A OE2 no hydrogen 2.944 N/A LEU 243.A N LYS 240.A O no hydrogen 3.052 N/A THR 244.A N LYS 240.A O no hydrogen 2.814 N/A THR 244.A OG1 ASP 238.A OD1 no hydrogen 2.782 N/A THR 244.A OG1 LYS 240.A O no hydrogen 2.903 N/A LYS 245.A N LEU 241.A O no hydrogen 2.807 N/A THR 246.A OG1 GLN 242.A O no hydrogen 2.725 N/A THR 246.A OG1 LEU 243.A O no hydrogen 3.263 N/A VAL 249.A N LYS 245.A O no hydrogen 2.948 N/A ALA 250.A N THR 246.A O no hydrogen 2.978 N/A HIS 251.A N GLU 247.A O no hydrogen 2.803 N/A ILE 252.A N GLU 248.A O no hydrogen 2.948 N/A LEU 253.A N VAL 249.A O no hydrogen 2.860 N/A GLN 254.A N ALA 250.A O no hydrogen 2.960 N/A GLU 255.A N HIS 251.A O no hydrogen 3.166 N/A VAL 256.A N ILE 252.A O no hydrogen 3.033 N/A ALA 257.A N LEU 253.A O no hydrogen 2.964 N/A ASP 258.A N GLN 254.A O no hydrogen 2.887 N/A ALA 259.A N GLU 255.A O no hydrogen 2.958 N/A TYR 260.A N VAL 256.A O no hydrogen 2.906 N/A TYR 260.A N ALA 257.A O no hydrogen 3.182 N/A ALA 261.A N ALA 257.A O no hydrogen 2.781 N/A