Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nq5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ILE 12.A O no hydrogen 3.296 N/A ASN 5.A N ILE 10.A O no hydrogen 3.302 N/A SER 11.A N THR 23.A O no hydrogen 3.031 N/A ILE 12.A N ILE 3.A O no hydrogen 3.360 N/A SER 13.A N VAL 21.A O no hydrogen 3.013 N/A GLN 14.A N THR 1.A O no hydrogen 3.028 N/A LEU 15.A N VAL 19.A O no hydrogen 2.930 N/A ASN 16.A N VAL 19.A O no hydrogen 3.101 N/A ASN 18.A N ASN 16.A OD1 no hydrogen 2.812 N/A ASN 18.A ND2 ASN 36.A O no hydrogen 3.522 N/A VAL 19.A N ASN 16.A O no hydrogen 3.360 N/A TRP 20.A N VAL 34.A O no hydrogen 2.795 N/A VAL 21.A N SER 13.A O no hydrogen 2.889 N/A HIS 22.A N GLY 32.A O no hydrogen 3.059 N/A HIS 22.A ND1 GLU 24.A OE2 no hydrogen 2.600 N/A HIS 22.A NE2 VAL 44.A O no hydrogen 3.182 N/A THR 23.A N SER 11.A O no hydrogen 2.927 N/A THR 23.A OG1 ASN 31.A OD1 no hydrogen 3.258 N/A GLU 24.A N SER 30.A O no hydrogen 2.939 N/A LEU 25.A N THR 9.A O no hydrogen 3.157 N/A GLY 26.A N VAL 28.A O no hydrogen 2.913 N/A SER 30.A N GLU 24.A O no hydrogen 2.753 N/A ASN 31.A N GLY 198.A O no hydrogen 2.850 N/A ASN 31.A ND2 PRO 197.A O no hydrogen 3.059 N/A ASN 31.A ND2 GLY 200.A O no hydrogen 2.688 N/A GLY 32.A N HIS 22.A O no hydrogen 2.763 N/A LEU 33.A N VAL 44.A O no hydrogen 3.211 N/A VAL 34.A N TRP 20.A O no hydrogen 2.740 N/A LEU 35.A N VAL 42.A O no hydrogen 2.798 N/A ASN 36.A N ASN 18.A O no hydrogen 2.838 N/A THR 37.A N GLY 40.A O no hydrogen 3.241 N/A THR 37.A OG1 GLY 40.A O no hydrogen 2.540 N/A LYS 39.A N THR 37.A OG1 no hydrogen 3.113 N/A GLY 40.A N THR 37.A O no hydrogen 3.492 N/A LEU 41.A N ARG 67.A O no hydrogen 2.661 N/A VAL 42.A N LEU 35.A O no hydrogen 2.954 N/A LEU 43.A N ASP 70.A O no hydrogen 3.076 N/A VAL 44.A N LEU 33.A O no hydrogen 2.975 N/A ASP 45.A N ILE 72.A O no hydrogen 2.629 N/A SER 46.A N ARG 80.A O no hydrogen 3.314 N/A SER 46.A OG ARG 80.A O no hydrogen 2.776 N/A SER 47.A N THR 53.A OG1 no hydrogen 3.079 N/A SER 47.A OG GLU 24.A OE1 no hydrogen 2.400 N/A LEU 52.A N ASP 49.A OD1 no hydrogen 3.320 N/A THR 53.A N ASP 49.A O no hydrogen 3.116 N/A THR 53.A OG1 ASP 49.A O no hydrogen 3.080 N/A LYS 54.A N ASP 50.A O no hydrogen 2.769 N/A GLU 55.A N LYS 51.A O no hydrogen 3.056 N/A LEU 56.A N LEU 52.A O no hydrogen 3.021 N/A ILE 57.A N THR 53.A O no hydrogen 2.972 N/A GLU 58.A N LYS 54.A O no hydrogen 2.868 N/A MET 59.A N GLU 55.A O no hydrogen 2.897 N/A VAL 60.A N LEU 56.A O no hydrogen 3.061 N/A GLU 61.A N ILE 57.A O no hydrogen 2.905 N/A LYS 62.A N GLU 58.A O no hydrogen 3.186 N/A LYS 63.A N MET 59.A O no hydrogen 3.158 N/A PHE 64.A N VAL 60.A O no hydrogen 2.994 N/A GLN 65.A N LYS 62.A O no hydrogen 3.344 N/A GLN 65.A NE2 LYS 62.A O no hydrogen 2.656 N/A LYS 66.A NZ ASN 36.A OD1 no hydrogen 2.801 N/A ARG 67.A NH2 GLU 61.A OE1 no hydrogen 3.069 N/A VAL 68.A N GLU 61.A OE2 no hydrogen 2.792 N/A THR 69.A N LEU 41.A O no hydrogen 2.868 N/A THR 69.A OG1 ASP 70.A OD1 no hydrogen 2.680 N/A VAL 71.A N LYS 93.A O no hydrogen 2.668 N/A ILE 72.A N LEU 43.A O no hydrogen 2.839 N/A ILE 73.A N HIS 95.A O no hydrogen 2.948 N/A THR 74.A N ASP 45.A OD1 no hydrogen 2.698 N/A THR 74.A OG1 ASP 45.A OD1 no hydrogen 2.986 N/A THR 74.A OG1 ASP 45.A OD2 no hydrogen 2.471 N/A HIS 77.A NE2 ASP 172.A OD2 no hydrogen 2.710 N/A ARG 80.A N HIS 77.A O no hydrogen 2.982 N/A ARG 80.A NE ASP 79.A OD2 no hydrogen 3.188 N/A ARG 80.A NH1 ASN 31.A O no hydrogen 3.238 N/A ARG 80.A NH1 ASP 79.A OD2 no hydrogen 3.117 N/A ARG 80.A NH2 ASN 31.A O no hydrogen 3.056 N/A ARG 80.A NH2 ASP 45.A OD2 no hydrogen 2.950 N/A ILE 81.A N HIS 77.A O no hydrogen 2.944 N/A GLY 82.A N ALA 78.A O no hydrogen 2.725 N/A GLY 83.A N SER 46.A OG no hydrogen 3.287 N/A ILE 84.A N ILE 81.A O no hydrogen 3.001 N/A THR 86.A N ASP 50.A OD1 no hydrogen 3.111 N/A THR 86.A OG1 ASP 50.A OD1 no hydrogen 2.728 N/A LEU 87.A N GLY 83.A O no hydrogen 3.198 N/A LYS 88.A N ILE 84.A O no hydrogen 2.995 N/A GLU 89.A N LYS 85.A O no hydrogen 3.178 N/A ARG 90.A N THR 86.A O no hydrogen 3.084 N/A ARG 90.A N LEU 87.A O no hydrogen 2.974 N/A GLY 91.A N LYS 88.A O no hydrogen 3.400 N/A ILE 92.A N LEU 87.A O no hydrogen 3.089 N/A LYS 93.A N THR 69.A O no hydrogen 3.034 N/A HIS 95.A N VAL 71.A O no hydrogen 2.815 N/A HIS 95.A ND1 ASP 115.A OD2 no hydrogen 2.541 N/A HIS 95.A NE2 ASP 70.A OD2 no hydrogen 2.597 N/A SER 96.A N ASP 115.A OD1 no hydrogen 2.995 N/A SER 96.A OG THR 97.A O no hydrogen 2.839 N/A THR 97.A OG1 THR 100.A OG1 no hydrogen 2.994 N/A THR 100.A N THR 97.A OG1 no hydrogen 3.069 N/A THR 100.A OG1 THR 97.A OG1 no hydrogen 2.994 N/A THR 100.A OG1 ASP 141.A OD2 no hydrogen 2.754 N/A ALA 101.A N THR 97.A O no hydrogen 2.965 N/A GLU 102.A N ALA 98.A O no hydrogen 2.817 N/A LEU 103.A N LEU 99.A O no hydrogen 2.920 N/A ALA 104.A N THR 100.A O no hydrogen 2.868 N/A LYS 105.A N ALA 101.A O no hydrogen 2.919 N/A LYS 106.A N GLU 102.A O no hydrogen 2.847 N/A ASN 107.A N LEU 103.A O no hydrogen 2.975 N/A GLY 108.A N LYS 105.A O no hydrogen 3.197 N/A TYR 109.A N ALA 104.A O no hydrogen 3.037 N/A LEU 113.A N ALA 94.A O no hydrogen 2.858 N/A GLY 114.A N SER 96.A OG no hydrogen 3.253 N/A ASP 115.A N ASP 115.A OD1 no hydrogen 2.589 N/A LEU 116.A N SER 96.A O no hydrogen 2.893 N/A GLN 117.A N THR 120.A OG1 no hydrogen 2.787 N/A GLN 117.A NE2 ASP 115.A O no hydrogen 2.950 N/A THR 120.A N THR 131.A O no hydrogen 2.921 N/A LEU 122.A N VAL 129.A O no hydrogen 2.712 N/A PHE 124.A N MET 127.A O no hydrogen 2.791 N/A MET 127.A N PHE 124.A O no hydrogen 2.750 N/A VAL 129.A N LEU 122.A O no hydrogen 2.982 N/A GLU 130.A N TRP 146.A O no hydrogen 2.886 N/A THR 131.A N THR 120.A O no hydrogen 2.865 N/A THR 131.A OG1 THR 120.A O no hydrogen 3.465 N/A PHE 132.A N VAL 144.A O no hydrogen 3.040 N/A TYR 133.A N THR 118.A O no hydrogen 2.842 N/A TYR 133.A OH GLU 140.A O no hydrogen 2.701 N/A GLY 137.A N THR 139.A O no hydrogen 2.901 N/A THR 139.A N ASN 142.A OD1 no hydrogen 3.074 N/A THR 139.A OG1 ASP 141.A OD1 no hydrogen 2.665 N/A ASP 141.A N ASP 141.A OD1 no hydrogen 2.537 N/A ASN 142.A ND2 GLY 135.A O no hydrogen 2.856 N/A ASN 142.A ND2 ASN 142.A O no hydrogen 2.491 N/A ILE 143.A N THR 74.A O no hydrogen 3.199 N/A VAL 144.A N PHE 132.A O no hydrogen 2.729 N/A VAL 145.A N VAL 154.A O no hydrogen 3.025 N/A TRP 146.A N GLU 130.A O no hydrogen 2.657 N/A LEU 147.A N ILE 152.A O no hydrogen 2.775 N/A GLN 149.A NE2 ASN 126.A O no hydrogen 2.871 N/A TYR 150.A N LEU 147.A O no hydrogen 3.191 N/A TYR 150.A OH ASN 18.A OD1 no hydrogen 3.118 N/A ASN 151.A N PRO 148.A O no hydrogen 3.198 N/A ASN 151.A ND2 ASN 191.A O no hydrogen 2.718 N/A ASN 151.A ND2 ASN 191.A OD1 no hydrogen 3.609 N/A ILE 152.A N LEU 147.A O no hydrogen 3.033 N/A LEU 153.A N ALA 194.A O no hydrogen 3.094 N/A VAL 154.A N VAL 145.A O no hydrogen 2.866 N/A GLY 155.A N VAL 196.A O no hydrogen 2.769 N/A CYS 157.A SG ASP 79.A OD2 no hydrogen 3.686 N/A CYS 157.A SG HIS 199.A NE2 no hydrogen 3.635 N/A VAL 159.A N GLY 156.A O no hydrogen 3.002 N/A LYS 160.A N THR 211.A OG1 no hydrogen 3.175 N/A LYS 160.A NZ LEU 167.A O no hydrogen 2.893 N/A SER 161.A OG SER 163.A OG no hydrogen 3.040 N/A SER 161.A OG HIS 199.A O no hydrogen 3.487 N/A SER 163.A OG SER 161.A OG no hydrogen 3.040 N/A SER 163.A OG GLU 201.A OE1 no hydrogen 3.274 N/A SER 163.A OG GLU 201.A OE2 no hydrogen 2.821 N/A ALA 164.A N SER 161.A O no hydrogen 3.118 N/A LYS 165.A NZ THR 162.A O no hydrogen 3.103 N/A ALA 173.A N VAL 170.A O no hydrogen 2.912 N/A TYR 174.A N GLY 137.A O no hydrogen 2.808 N/A GLU 177.A N GLU 177.A OE2 no hydrogen 2.886 N/A TRP 178.A N TYR 174.A O no hydrogen 3.061 N/A TRP 178.A NE1 LEU 158.A O no hydrogen 2.836 N/A SER 181.A N GLU 177.A O no hydrogen 2.858 N/A SER 181.A OG PRO 134.A O no hydrogen 3.379 N/A SER 181.A OG LYS 136.A O no hydrogen 2.649 N/A SER 181.A OG GLU 177.A O no hydrogen 2.980 N/A ILE 182.A N TRP 178.A O no hydrogen 3.049 N/A GLU 183.A N SER 179.A O no hydrogen 3.065 N/A ASN 184.A N THR 180.A O no hydrogen 2.871 N/A ASN 184.A ND2 PRO 134.A O no hydrogen 3.000 N/A VAL 185.A N SER 181.A O no hydrogen 3.199 N/A LEU 186.A N ILE 182.A O no hydrogen 2.886 N/A LYS 187.A N GLU 183.A O no hydrogen 2.852 N/A ARG 188.A N ASN 184.A O no hydrogen 3.161 N/A ARG 188.A NE GLU 130.A OE2 no hydrogen 2.795 N/A ARG 188.A NE TYR 189.A OH no hydrogen 3.423 N/A ARG 188.A NH2 GLU 130.A OE1 no hydrogen 2.825 N/A ARG 188.A NH2 GLU 130.A OE2 no hydrogen 3.085 N/A TYR 189.A N VAL 185.A O no hydrogen 3.004 N/A TYR 189.A OH GLU 130.A OE2 no hydrogen 2.264 N/A ASN 193.A N ASN 151.A O no hydrogen 3.002 N/A ASN 193.A ND2 TYR 150.A O no hydrogen 3.485 N/A VAL 195.A N GLY 203.A O no hydrogen 2.843 N/A VAL 196.A N LEU 153.A O no hydrogen 2.740 N/A GLY 198.A N GLY 156.A O no hydrogen 2.765 N/A HIS 199.A ND1 PRO 29.A O no hydrogen 2.742 N/A GLY 203.A N VAL 195.A O no hydrogen 3.048 N/A GLY 206.A N ASP 204.A OD1 no hydrogen 2.953 N/A LEU 207.A N ASP 204.A O no hydrogen 2.961 N/A LEU 208.A N LYS 205.A O no hydrogen 3.118 N/A LEU 209.A N LYS 205.A O no hydrogen 3.407 N/A HIS 210.A N GLY 206.A O no hydrogen 2.714 N/A HIS 210.A NE2 ALA 164.A O no hydrogen 2.667 N/A THR 211.A N LEU 207.A O no hydrogen 2.896 N/A THR 211.A OG1 LEU 207.A O no hydrogen 2.668 N/A LEU 212.A N LEU 208.A O no hydrogen 2.978 N/A ASP 213.A N LEU 209.A O no hydrogen 2.873 N/A LEU 214.A N HIS 210.A O no hydrogen 2.952 N/A LEU 215.A N THR 211.A O no hydrogen 3.267 N/A LEU 215.A N LEU 212.A O no hydrogen 3.208 N/A LYS 216.A N ASP 213.A O no hydrogen 3.270 N/A