Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1j6o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A ND1 GLU 33.A OE1 no hydrogen 2.805 N/A ASP 6.A N PHE 34.A O no hydrogen 3.211 N/A THR 7.A N LEU 202.A O no hydrogen 3.012 N/A THR 7.A OG1 LEU 202.A O no hydrogen 2.648 N/A HIS 8.A N ASP 6.A OD1 no hydrogen 3.057 N/A HIS 8.A NE2 GLU 94.A OE1 no hydrogen 2.825 N/A ALA 9.A N VAL 36.A O no hydrogen 2.953 N/A HIS 10.A ND1 VAL 38.A O no hydrogen 3.014 N/A HIS 10.A NE2 ASP 205.A OD1 no hydrogen 2.921 N/A LEU 11.A N ASN 37.A OD1 no hydrogen 2.858 N/A HIS 12.A NE2 ASP 44.A OD2 no hydrogen 2.801 N/A PHE 13.A N HIS 10.A O no hydrogen 3.098 N/A GLN 15.A N GLN 15.A OE1 no hydrogen 2.799 N/A PHE 16.A N PHE 13.A O no hydrogen 3.097 N/A ASP 17.A N HIS 14.A O no hydrogen 3.004 N/A ASP 19.A N PHE 16.A O no hydrogen 3.373 N/A ARG 20.A NE LEU 11.A O no hydrogen 2.730 N/A ARG 20.A NH1 ASP 17.A OD1 no hydrogen 3.513 N/A ARG 20.A NH2 LEU 11.A O no hydrogen 3.453 N/A ARG 20.A NH2 PHE 13.A O no hydrogen 2.814 N/A ARG 20.A NH2 ASP 17.A OD1 no hydrogen 2.826 N/A VAL 23.A N ASP 19.A O no hydrogen 2.937 N/A ILE 24.A N ARG 20.A O no hydrogen 2.918 N/A SER 25.A N ASN 21.A O no hydrogen 2.820 N/A SER 25.A OG ASN 21.A O no hydrogen 3.064 N/A SER 25.A OG ALA 22.A O no hydrogen 3.282 N/A SER 26.A N ALA 22.A O no hydrogen 3.058 N/A SER 26.A N VAL 23.A O no hydrogen 3.322 N/A SER 26.A OG ALA 22.A O no hydrogen 2.897 N/A SER 26.A OG VAL 23.A O no hydrogen 3.013 N/A PHE 27.A N ILE 24.A O no hydrogen 3.086 N/A ASN 30.A N SER 26.A O no hydrogen 3.026 N/A ASN 30.A N PHE 27.A O no hydrogen 2.990 N/A ASN 30.A ND2 SER 26.A O no hydrogen 3.205 N/A ASN 31.A N GLU 28.A O no hydrogen 2.929 N/A ILE 32.A N PHE 27.A O no hydrogen 2.961 N/A VAL 35.A N ARG 57.A O no hydrogen 2.764 N/A VAL 36.A N ASP 6.A O no hydrogen 2.811 N/A ASN 37.A N PHE 59.A O no hydrogen 2.768 N/A ASN 37.A ND2 HIS 12.A ND1 no hydrogen 2.869 N/A ASN 37.A ND2 SER 48.A OG no hydrogen 2.964 N/A VAL 38.A N ALA 9.A O no hydrogen 2.811 N/A GLY 39.A N SER 61.A O no hydrogen 2.938 N/A VAL 40.A N ASP 44.A OD2 no hydrogen 2.798 N/A ASN 41.A ND2 ASP 68.A OD2 no hydrogen 3.103 N/A ASP 44.A N ASN 41.A OD1 no hydrogen 2.707 N/A SER 45.A N ASN 41.A O no hydrogen 2.772 N/A SER 45.A OG ASN 41.A O no hydrogen 2.832 N/A SER 45.A OG GLY 63.A O no hydrogen 3.138 N/A LYS 46.A N LEU 42.A O no hydrogen 3.143 N/A LYS 46.A NZ ASP 50.A OD1 no hydrogen 3.488 N/A LYS 47.A N GLU 43.A O no hydrogen 3.253 N/A SER 48.A N ASP 44.A O no hydrogen 2.929 N/A SER 48.A OG ASN 37.A O no hydrogen 2.980 N/A LEU 49.A N SER 45.A O no hydrogen 2.854 N/A ASP 50.A N LYS 46.A O no hydrogen 2.941 N/A LEU 51.A N LYS 47.A O no hydrogen 2.965 N/A SER 52.A N SER 48.A O no hydrogen 2.920 N/A SER 52.A OG LEU 49.A O no hydrogen 2.766 N/A LYS 53.A N LEU 49.A O no hydrogen 3.077 N/A LYS 53.A NZ ASP 86.A OD2 no hydrogen 3.180 N/A THR 54.A N LEU 51.A O no hydrogen 2.893 N/A THR 54.A OG1 LEU 51.A O no hydrogen 2.607 N/A SER 55.A N SER 52.A O no hydrogen 3.317 N/A ARG 57.A N SER 55.A OG no hydrogen 2.989 N/A ARG 57.A NH1 ILE 32.A O no hydrogen 2.800 N/A ILE 58.A N SER 55.A O no hydrogen 3.294 N/A PHE 59.A N VAL 35.A O no hydrogen 2.985 N/A CYS 60.A N LYS 88.A O no hydrogen 2.757 N/A CYS 60.A SG SER 48.A OG no hydrogen 3.561 N/A CYS 60.A SG SER 61.A O no hydrogen 3.798 N/A SER 61.A N ASN 37.A O no hydrogen 2.952 N/A SER 61.A OG GLY 93.A O no hydrogen 2.807 N/A VAL 62.A N ALA 91.A O no hydrogen 3.280 N/A GLY 63.A N SER 45.A OG no hydrogen 3.080 N/A VAL 64.A N GLN 116.A OE1 no hydrogen 2.934 N/A HIS 65.A N VAL 40.A O no hydrogen 2.835 N/A HIS 67.A N HIS 65.A ND1 no hydrogen 2.944 N/A ASP 68.A N HIS 65.A O no hydrogen 2.921 N/A ALA 69.A N PRO 66.A O no hydrogen 2.992 N/A LYS 70.A N SER 104.A OG no hydrogen 3.118 N/A LYS 70.A NZ GLU 71.A OE2 no hydrogen 2.535 N/A GLU 71.A N ASP 68.A O no hydrogen 3.059 N/A PHE 76.A N PRO 73.A O no hydrogen 3.109 N/A HIS 79.A N ASP 75.A O no hydrogen 3.049 N/A LEU 80.A N PHE 76.A O no hydrogen 2.990 N/A GLU 81.A N ILE 77.A O no hydrogen 2.875 N/A LYS 82.A N GLU 78.A O no hydrogen 2.933 N/A PHE 83.A N HIS 79.A O no hydrogen 3.176 N/A ALA 84.A N LEU 80.A O no hydrogen 2.918 N/A LYS 85.A N LYS 82.A O no hydrogen 3.224 N/A ASP 86.A N PHE 83.A O no hydrogen 2.911 N/A GLU 87.A N GLU 87.A OE1 no hydrogen 2.414 N/A LYS 88.A N ASP 86.A OD1 no hydrogen 2.946 N/A LYS 88.A NZ SER 52.A O no hydrogen 2.959 N/A LYS 88.A NZ SER 55.A O no hydrogen 2.561 N/A LYS 88.A NZ ILE 58.A O no hydrogen 2.709 N/A VAL 89.A N ASP 86.A O no hydrogen 3.058 N/A VAL 90.A N CYS 60.A O no hydrogen 2.771 N/A ILE 92.A N PRO 126.A O no hydrogen 3.037 N/A GLY 93.A N VAL 62.A O no hydrogen 2.782 N/A GLU 94.A N GLY 39.A O no hydrogen 3.106 N/A THR 95.A N VAL 128.A O no hydrogen 3.296 N/A LEU 97.A N HIS 130.A O no hydrogen 3.044 N/A ASP 98.A N GLN 109.A OE1 no hydrogen 2.782 N/A PHE 99.A N ARG 132.A O no hydrogen 3.038 N/A PHE 100.A N ASP 98.A OD1 no hydrogen 2.745 N/A ARG 101.A N ASP 98.A OD1 no hydrogen 2.873 N/A SER 104.A OG PRO 66.A O no hydrogen 3.175 N/A SER 104.A OG HIS 67.A O no hydrogen 2.739 N/A GLN 109.A N PRO 105.A O no hydrogen 2.947 N/A GLN 109.A NE2 ASP 98.A O no hydrogen 3.110 N/A GLN 109.A NE2 SER 104.A O no hydrogen 2.748 N/A LYS 110.A N ALA 106.A O no hydrogen 2.894 N/A LYS 110.A NZ GLU 107.A OE2 no hydrogen 3.158 N/A ARG 111.A N GLU 107.A O no hydrogen 3.068 N/A VAL 112.A N VAL 108.A O no hydrogen 3.198 N/A PHE 113.A N GLN 109.A O no hydrogen 2.899 N/A VAL 114.A N LYS 110.A O no hydrogen 2.885 N/A GLU 115.A N ARG 111.A O no hydrogen 2.909 N/A GLN 116.A N VAL 112.A O no hydrogen 3.206 N/A GLN 116.A N PHE 113.A O no hydrogen 3.109 N/A GLN 116.A NE2 VAL 64.A O no hydrogen 3.023 N/A GLN 116.A NE2 VAL 112.A O no hydrogen 3.254 N/A ILE 117.A N PHE 113.A O no hydrogen 2.965 N/A GLU 118.A N VAL 114.A O no hydrogen 2.934 N/A LEU 119.A N GLU 115.A O no hydrogen 3.049 N/A ALA 120.A N GLN 116.A O no hydrogen 2.847 N/A GLY 121.A N ILE 117.A O no hydrogen 2.982 N/A LYS 122.A N GLU 118.A O no hydrogen 3.015 N/A LYS 122.A NZ GLU 81.A OE1 no hydrogen 3.114 N/A LYS 122.A NZ GLU 81.A OE2 no hydrogen 2.596 N/A LEU 123.A N LEU 119.A O no hydrogen 2.922 N/A ASN 124.A N GLY 121.A O no hydrogen 3.240 N/A ASN 124.A ND2 GLU 149.A OE1 no hydrogen 2.989 N/A ASN 124.A ND2 GLU 259.A O no hydrogen 2.937 N/A LEU 125.A N ALA 120.A O no hydrogen 2.989 N/A LEU 127.A N ARG 151.A O no hydrogen 2.868 N/A VAL 128.A N ILE 92.A O no hydrogen 2.891 N/A VAL 129.A N VAL 153.A O no hydrogen 2.882 N/A HIS 130.A N THR 95.A O no hydrogen 2.835 N/A HIS 130.A ND1 HIS 155.A NE2 no hydrogen 3.359 N/A ARG 132.A N LEU 97.A O no hydrogen 2.968 N/A ARG 132.A NH2 ALA 156.A O no hydrogen 3.324 N/A TYR 135.A OH SER 158.A OG no hydrogen 2.876 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.719 N/A ALA 138.A N ALA 134.A O no hydrogen 2.824 N/A TYR 139.A N TYR 135.A O no hydrogen 2.822 N/A GLU 140.A N SER 136.A O no hydrogen 3.076 N/A ILE 141.A N GLU 137.A O no hydrogen 3.181 N/A LEU 142.A N ALA 138.A O no hydrogen 2.865 N/A ARG 143.A N TYR 139.A O no hydrogen 2.942 N/A THR 144.A N GLU 140.A O no hydrogen 3.156 N/A THR 144.A N ILE 141.A O no hydrogen 3.101 N/A THR 144.A OG1 GLU 140.A O no hydrogen 2.561 N/A GLU 145.A N LEU 142.A O no hydrogen 3.361 N/A GLU 149.A N ASN 124.A OD1 no hydrogen 3.312 N/A LYS 150.A NZ ARG 252.A O no hydrogen 2.955 N/A ARG 151.A NE LEU 170.A O no hydrogen 2.522 N/A ARG 151.A NH1 PRO 148.A O no hydrogen 2.829 N/A VAL 153.A N LEU 127.A O no hydrogen 2.932 N/A ILE 154.A N LEU 173.A O no hydrogen 2.931 N/A HIS 155.A N VAL 129.A O no hydrogen 2.832 N/A HIS 155.A ND1 GLU 203.A OE2 no hydrogen 2.567 N/A HIS 155.A NE2 GLU 94.A OE2 no hydrogen 3.063 N/A ALA 156.A N GLU 203.A OE1 no hydrogen 2.779 N/A PHE 157.A N GLY 175.A O no hydrogen 2.964 N/A SER 158.A N TYR 135.A OH no hydrogen 2.820 N/A SER 158.A OG TYR 135.A OH no hydrogen 2.876 N/A TRP 163.A N ASP 160.A OD1 no hydrogen 3.310 N/A ALA 164.A N ASP 160.A O no hydrogen 2.967 N/A LYS 165.A N TYR 161.A O no hydrogen 2.830 N/A LYS 165.A NZ ASP 169.A OD2 no hydrogen 3.475 N/A LYS 166.A N GLU 162.A O no hydrogen 3.130 N/A PHE 167.A N TRP 163.A O no hydrogen 3.023 N/A ILE 168.A N ALA 164.A O no hydrogen 2.825 N/A ASP 169.A N LYS 165.A O no hydrogen 2.801 N/A LEU 170.A N LYS 166.A O no hydrogen 3.218 N/A LEU 170.A N PHE 167.A O no hydrogen 2.956 N/A GLY 171.A N ILE 168.A O no hydrogen 2.844 N/A PHE 172.A N PHE 167.A O no hydrogen 3.133 N/A LEU 173.A N GLY 152.A O no hydrogen 2.968 N/A LEU 174.A N TYR 199.A O no hydrogen 2.859 N/A GLY 175.A N ILE 154.A O no hydrogen 2.930 N/A ILE 176.A N VAL 201.A O no hydrogen 2.999 N/A VAL 180.A N GLY 177.A O no hydrogen 3.112 N/A THR 181.A N GLY 178.A O no hydrogen 2.988 N/A THR 181.A OG1 GLY 178.A O no hydrogen 2.771 N/A TYR 182.A N PRO 179.A O no hydrogen 3.040 N/A TYR 182.A OH PRO 210.A O no hydrogen 2.716 N/A ASN 185.A N TYR 182.A O no hydrogen 2.911 N/A ASN 185.A ND2 PRO 179.A O no hydrogen 2.710 N/A GLU 186.A N LYS 184.A O no hydrogen 2.951 N/A ARG 189.A N ASN 185.A O no hydrogen 3.428 N/A ARG 189.A NH1 VAL 180.A O no hydrogen 2.920 N/A ARG 189.A NH1 TYR 182.A O no hydrogen 2.662 N/A ARG 189.A NH2 TYR 182.A O no hydrogen 3.268 N/A ARG 189.A NH2 PRO 183.A O no hydrogen 2.876 N/A GLU 190.A N GLU 186.A O no hydrogen 3.120 N/A VAL 191.A N ALA 187.A O no hydrogen 3.024 N/A VAL 192.A N LEU 188.A O no hydrogen 2.933 N/A LYS 193.A N ARG 189.A O no hydrogen 2.924 N/A ARG 194.A N GLU 190.A O no hydrogen 3.031 N/A VAL 195.A N VAL 191.A O no hydrogen 2.891 N/A GLY 196.A N VAL 192.A O no hydrogen 3.029 N/A VAL 201.A N LEU 174.A O no hydrogen 3.040 N/A GLU 203.A N ILE 176.A O no hydrogen 3.071 N/A THR 204.A N ASP 6.A OD1 no hydrogen 2.932 N/A THR 204.A OG1 ASP 6.A OD1 no hydrogen 3.464 N/A THR 204.A OG1 ASP 6.A OD2 no hydrogen 2.486 N/A ASP 205.A N HIS 8.A O no hydrogen 2.693 N/A CYS 206.A N THR 204.A OG1 no hydrogen 2.900 N/A CYS 206.A SG THR 204.A OG1 no hydrogen 3.384 N/A PHE 208.A N ASP 205.A O no hydrogen 2.851 N/A GLN 212.A N THR 181.A OG1 no hydrogen 2.790 N/A PHE 214.A N PRO 211.A O no hydrogen 2.744 N/A ARG 215.A N GLN 212.A O no hydrogen 3.257 N/A LYS 217.A N PHE 214.A O no hydrogen 3.020 N/A ARG 218.A NH1 GLN 15.A O no hydrogen 3.013 N/A ARG 218.A NH1 ASP 19.A OD1 no hydrogen 2.800 N/A ARG 218.A NH1 ASP 19.A OD2 no hydrogen 3.522 N/A ARG 218.A NH2 ASP 19.A OD2 no hydrogen 2.971 N/A ARG 218.A NH2 GLU 220.A OE2 no hydrogen 3.184 N/A ASN 219.A N PRO 207.A O no hydrogen 3.000 N/A ASN 219.A ND2 PHE 208.A O no hydrogen 2.776 N/A GLU 220.A N ASN 219.A OD1 no hydrogen 2.954 N/A TYR 223.A N GLU 220.A O no hydrogen 3.009 N/A LEU 224.A N PRO 221.A O no hydrogen 2.914 N/A TYR 226.A N TYR 223.A O no hydrogen 3.260 N/A VAL 227.A N LEU 224.A O no hydrogen 2.900 N/A VAL 228.A N LEU 224.A O no hydrogen 3.112 N/A GLU 229.A N LYS 225.A O no hydrogen 2.929 N/A THR 230.A N TYR 226.A O no hydrogen 3.086 N/A THR 230.A OG1 TYR 226.A O no hydrogen 3.340 N/A ILE 231.A N VAL 227.A O no hydrogen 3.000 N/A SER 232.A N VAL 228.A O no hydrogen 2.792 N/A SER 232.A OG VAL 228.A O no hydrogen 3.389 N/A SER 232.A OG GLU 229.A O no hydrogen 2.628 N/A GLN 233.A N GLU 229.A O no hydrogen 2.976 N/A VAL 234.A N THR 230.A O no hydrogen 2.839 N/A LEU 235.A N ILE 231.A O no hydrogen 2.998 N/A GLY 236.A N GLN 233.A O no hydrogen 3.255 N/A VAL 237.A N SER 232.A O no hydrogen 3.012 N/A LYS 241.A N PRO 238.A O no hydrogen 2.892 N/A VAL 242.A N PRO 238.A O no hydrogen 3.371 N/A ASP 243.A N GLU 239.A O no hydrogen 2.932 N/A GLU 244.A N ALA 240.A O no hydrogen 2.989 N/A ALA 245.A N LYS 241.A O no hydrogen 3.179 N/A THR 246.A N VAL 242.A O no hydrogen 2.957 N/A THR 246.A OG1 VAL 242.A O no hydrogen 2.746 N/A THR 246.A OG1 ASP 243.A O no hydrogen 3.459 N/A THR 247.A N ASP 243.A O no hydrogen 3.022 N/A THR 247.A OG1 HIS 4.A O no hydrogen 2.640 N/A THR 247.A OG1 ASP 243.A O no hydrogen 3.006 N/A GLU 248.A N GLU 244.A O no hydrogen 2.947 N/A ASN 249.A N ALA 245.A O no hydrogen 2.915 N/A ASN 249.A ND2 LEU 197.A O no hydrogen 3.013 N/A ASN 249.A ND2 GLU 198.A O no hydrogen 3.548 N/A ASN 249.A ND2 ILE 200.A O no hydrogen 3.056 N/A ALA 250.A N THR 246.A O no hydrogen 2.853 N/A ARG 251.A N THR 247.A O no hydrogen 2.753 N/A ARG 251.A NE GLU 33.A OE2 no hydrogen 2.710 N/A ARG 251.A NH2 GLU 33.A OE1 no hydrogen 2.813 N/A ARG 251.A NH2 GLU 33.A OE2 no hydrogen 3.337 N/A ARG 252.A N GLU 248.A O no hydrogen 2.916 N/A ARG 252.A NH1 ASN 249.A OD1 no hydrogen 3.250 N/A ILE 253.A N ASN 249.A O no hydrogen 3.092 N/A PHE 254.A N ALA 250.A O no hydrogen 3.037 N/A LEU 255.A N ARG 251.A O no hydrogen 2.861 N/A LYS 258.A NZ ILE 253.A O no hydrogen 2.648 N/A LYS 258.A NZ GLU 256.A O no hydrogen 3.315 N/A