Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5v3q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N GLY 1.A O no hydrogen 2.957 N/A ARG 5.A N GLU 2.A O no hydrogen 2.957 N/A ARG 5.A NE GLU 2.A OE2 no hydrogen 3.322 N/A ARG 5.A NH2 GLU 2.A OE2 no hydrogen 3.520 N/A SER 6.A N ASP 236.A OD1 no hydrogen 2.692 N/A SER 6.A OG ASP 236.A OD1 no hydrogen 3.166 N/A SER 6.A OG ASP 236.A OD2 no hydrogen 2.685 N/A LEU 7.A N ASN 51.A O no hydrogen 2.760 N/A LYS 9.A N ASN 56.A O no hydrogen 2.923 N/A LYS 9.A NZ ASN 56.A OD1 no hydrogen 2.895 N/A GLY 10.A N GLU 59.A OE2 no hydrogen 3.048 N/A SER 11.A N GLY 8.A O no hydrogen 2.980 N/A SER 11.A OG GLY 8.A O no hydrogen 2.567 N/A SER 21.A N PRO 18.A O no hydrogen 3.197 N/A ILE 22.A N ARG 46.A O no hydrogen 3.345 N/A ARG 23.A N GLU 74.A O no hydrogen 2.849 N/A ARG 23.A NE GLU 48.A OE2 no hydrogen 2.727 N/A ARG 23.A NH1 GLY 15.A O no hydrogen 2.860 N/A ARG 23.A NH1 TYR 25.A OH no hydrogen 3.183 N/A ARG 23.A NH2 GLY 15.A O no hydrogen 3.199 N/A ARG 23.A NH2 GLU 48.A OE2 no hydrogen 2.586 N/A ILE 24.A N GLU 48.A O no hydrogen 2.864 N/A TYR 25.A N VAL 72.A O no hydrogen 2.725 N/A TYR 25.A OH GLU 74.A OE1 no hydrogen 2.438 N/A SER 26.A N ILE 50.A O no hydrogen 2.812 N/A ARG 28.A NH1 TYR 237.A O no hydrogen 3.501 N/A ARG 28.A NH2 CYS 235.A O no hydrogen 3.028 N/A ARG 28.A NH2 TYR 237.A O no hydrogen 2.856 N/A CYS 30.A N MET 27.A O no hydrogen 3.057 N/A ALA 33.A N CYS 30.A O no hydrogen 3.297 N/A GLU 34.A N CYS 30.A O no hydrogen 2.956 N/A ARG 35.A N PRO 31.A O no hydrogen 3.345 N/A ARG 35.A NE LEU 174.A O no hydrogen 2.810 N/A ARG 35.A NH1 SER 84.A OG no hydrogen 2.864 N/A ARG 35.A NH2 LEU 174.A O no hydrogen 3.173 N/A THR 36.A OG1 THR 87.A OG1 no hydrogen 2.688 N/A ARG 37.A N ALA 33.A O no hydrogen 2.954 N/A LEU 38.A N GLU 34.A O no hydrogen 2.692 N/A VAL 39.A N ARG 35.A O no hydrogen 3.048 N/A LEU 40.A N THR 36.A O no hydrogen 2.857 N/A LYS 41.A N ARG 37.A O no hydrogen 2.939 N/A ALA 42.A N LEU 38.A O no hydrogen 2.923 N/A LYS 43.A N VAL 39.A O no hydrogen 3.055 N/A LYS 43.A NZ ASP 92.A O no hydrogen 3.466 N/A LYS 43.A NZ ASP 92.A OD1 no hydrogen 2.669 N/A LYS 43.A NZ LYS 98.A O no hydrogen 2.531 N/A GLY 44.A N LYS 41.A O no hydrogen 3.116 N/A ILE 45.A N LEU 40.A O no hydrogen 2.971 N/A HIS 47.A ND1 ILE 45.A O no hydrogen 2.680 N/A GLU 48.A N ILE 22.A O no hydrogen 2.997 N/A ILE 50.A N ILE 24.A O no hydrogen 2.977 N/A ASN 51.A ND2 ALA 4.A O no hydrogen 2.989 N/A ILE 52.A N SER 26.A O no hydrogen 2.758 N/A ASN 53.A N LEU 7.A O no hydrogen 2.894 N/A ASN 53.A ND2 PRO 232.A O no hydrogen 2.750 N/A LYS 55.A N ASN 53.A OD1 no hydrogen 2.998 N/A LYS 55.A NZ ASN 230.A OD1 no hydrogen 2.739 N/A ASN 56.A N ASN 53.A O no hydrogen 2.883 N/A LYS 57.A NZ GLY 68.A O no hydrogen 2.710 N/A TRP 60.A NE1 SER 11.A OG no hydrogen 3.228 N/A PHE 61.A N PRO 58.A O no hydrogen 2.916 N/A PHE 62.A N GLU 59.A O no hydrogen 3.178 N/A LYS 63.A N TRP 60.A O no hydrogen 2.996 N/A LYS 64.A N PHE 61.A O no hydrogen 2.991 N/A LYS 64.A NZ TYR 25.A OH no hydrogen 3.354 N/A LYS 64.A NZ GLU 74.A OE1 no hydrogen 2.978 N/A ASN 65.A N PHE 61.A O no hydrogen 3.121 N/A ASN 65.A ND2 LEU 69.A O no hydrogen 2.876 N/A PHE 67.A N ASN 65.A OD1 no hydrogen 2.998 N/A GLY 68.A N ASN 65.A O no hydrogen 2.988 N/A VAL 72.A N TYR 25.A O no hydrogen 3.256 N/A LEU 73.A N ILE 81.A O no hydrogen 2.929 N/A GLU 74.A N ARG 23.A O no hydrogen 2.941 N/A ASN 75.A N GLN 79.A O no hydrogen 3.232 N/A ASN 75.A ND2 GLN 79.A OE1 no hydrogen 2.734 N/A ASN 75.A ND2 TYR 90.A OH no hydrogen 3.417 N/A SER 76.A OG GLN 77.A OE1 no hydrogen 3.012 N/A GLN 77.A N GLN 77.A OE1 no hydrogen 2.742 N/A GLY 78.A N ASN 75.A O no hydrogen 2.930 N/A GLN 79.A N ASN 75.A OD1 no hydrogen 2.784 N/A ILE 81.A N LEU 73.A O no hydrogen 3.060 N/A ALA 85.A N GLU 83.A OE1.B no hydrogen 3.111 N/A THR 87.A N GLU 83.A O no hydrogen 2.817 N/A THR 87.A OG1 THR 36.A OG1 no hydrogen 2.688 N/A THR 87.A OG1 SER 84.A O no hydrogen 2.638 N/A CYS 88.A N SER 84.A O no hydrogen 2.933 N/A CYS 88.A SG SER 84.A O no hydrogen 3.332 N/A GLU 89.A N ALA 85.A O no hydrogen 3.025 N/A TYR 90.A N ILE 86.A O no hydrogen 3.012 N/A LEU 91.A N THR 87.A O no hydrogen 3.048 N/A ASP 92.A N CYS 88.A O no hydrogen 3.113 N/A GLU 93.A N GLU 89.A O no hydrogen 2.993 N/A ALA 94.A N TYR 90.A O no hydrogen 2.817 N/A TYR 95.A N LEU 91.A O no hydrogen 3.233 N/A LYS 99.A NZ ASP 92.A O no hydrogen 2.700 N/A LYS 99.A NZ GLU 93.A O no hydrogen 3.501 N/A LYS 99.A NZ TYR 95.A O no hydrogen 3.468 N/A LEU 100.A N ASP 92.A OD1 no hydrogen 2.859 N/A LEU 101.A N ASP 92.A OD2 no hydrogen 2.986 N/A GLU 107.A N ASP 104.A OD2 no hydrogen 2.917 N/A LYS 108.A N ASP 104.A O no hydrogen 2.802 N/A ALA 109.A N PRO 105.A O no hydrogen 2.842 N/A CYS 110.A N TYR 106.A O no hydrogen 2.927 N/A CYS 110.A SG TYR 106.A O no hydrogen 3.544 N/A GLN 111.A N GLU 107.A O no hydrogen 3.195 N/A GLN 111.A NE2 SER 169.A OG no hydrogen 3.046 N/A LYS 112.A N LYS 108.A O no hydrogen 3.236 N/A LYS 112.A NZ GLU 89.A OE2 no hydrogen 3.139 N/A MET 113.A N ALA 109.A O no hydrogen 2.742 N/A ILE 114.A N CYS 110.A O no hydrogen 2.845 N/A LEU 115.A N GLN 111.A O no hydrogen 3.000 N/A GLU 116.A N LYS 112.A O no hydrogen 3.026 N/A LEU 117.A N MET 113.A O no hydrogen 2.966 N/A PHE 118.A N ILE 114.A O no hydrogen 3.236 N/A PHE 118.A N LEU 115.A O no hydrogen 3.077 N/A SER 119.A N GLU 116.A O no hydrogen 3.167 N/A SER 119.A OG GLU 116.A O no hydrogen 2.797 N/A VAL 121.A N PHE 118.A O no hydrogen 2.853 N/A SER 123.A OG LYS 120.A O no hydrogen 3.408 N/A LEU 124.A N LYS 120.A O no hydrogen 3.225 N/A VAL 125.A N VAL 121.A O no hydrogen 3.100 N/A GLY 126.A N PRO 122.A O no hydrogen 3.072 N/A SER 127.A N SER 123.A O no hydrogen 3.004 N/A SER 127.A OG LEU 124.A O no hydrogen 3.328 N/A PHE 128.A N LEU 124.A O no hydrogen 2.744 N/A PHE 128.A N VAL 125.A O no hydrogen 2.841 N/A ILE 129.A N GLY 126.A O no hydrogen 2.680 N/A ARG 130.A N SER 127.A O no hydrogen 3.130 N/A GLN 132.A N ASP 136.A OD2 no hydrogen 3.014 N/A ASP 136.A N ASN 133.A OD1 no hydrogen 2.970 N/A TYR 137.A N ASN 133.A O no hydrogen 3.135 N/A TYR 137.A OH LYS 186.A O no hydrogen 2.675 N/A TYR 137.A OH GLU 189.A OE1 no hydrogen 3.260 N/A ALA 138.A N LYS 134.A O no hydrogen 3.059 N/A GLY 139.A N GLU 135.A O no hydrogen 3.087 N/A LEU 140.A N ASP 136.A O no hydrogen 3.105 N/A LYS 141.A N TYR 137.A O no hydrogen 2.945 N/A LYS 141.A NZ GLU 189.A OE1 no hydrogen 3.510 N/A GLU 142.A N ALA 138.A O no hydrogen 3.116 N/A GLU 143.A N GLY 139.A O no hydrogen 3.001 N/A PHE 144.A N LEU 140.A O no hydrogen 3.074 N/A ARG 145.A N LYS 141.A O no hydrogen 2.926 N/A ARG 145.A NH1 GLU 142.A OE2 no hydrogen 3.194 N/A ARG 145.A NH2 GLU 189.A O no hydrogen 3.130 N/A LYS 146.A N GLU 142.A O no hydrogen 3.086 N/A LYS 146.A NZ GLU 142.A OE1 no hydrogen 2.595 N/A GLU 147.A N GLU 143.A O no hydrogen 3.304 N/A PHE 148.A N PHE 144.A O no hydrogen 2.905 N/A THR 149.A N ARG 145.A O no hydrogen 2.924 N/A THR 149.A OG1 LYS 146.A O no hydrogen 3.455 N/A LYS 150.A NZ GLU 147.A OE2 no hydrogen 2.978 N/A GLU 152.A N PHE 148.A O no hydrogen 2.878 N/A GLU 153.A N THR 149.A O no hydrogen 3.080 N/A LEU 155.A N LEU 151.A O no hydrogen 3.161 N/A THR 156.A N GLU 152.A O no hydrogen 2.923 N/A THR 156.A OG1 GLU 152.A O no hydrogen 3.030 N/A ASN 157.A N GLU 153.A O no hydrogen 2.831 N/A LYS 158.A N VAL 154.A O no hydrogen 2.960 N/A LYS 159.A N LEU 155.A O no hydrogen 2.734 N/A LYS 159.A NZ THR 156.A O no hydrogen 2.899 N/A THR 160.A OG1 PHE 162.A O no hydrogen 2.784 N/A THR 161.A N ASN 166.A OD1 no hydrogen 3.224 N/A THR 161.A OG1 ASN 166.A OD1 no hydrogen 3.396 N/A PHE 162.A N GLY 165.A O no hydrogen 3.022 N/A PHE 163.A N ASP 172.A OD1 no hydrogen 3.037 N/A GLY 165.A N PHE 162.A O no hydrogen 3.352 N/A SER 169.A N ASP 172.A OD2 no hydrogen 2.901 N/A MET 170.A N LEU 100.A O no hydrogen 3.013 N/A ILE 171.A N GLN 111.A OE1 no hydrogen 2.967 N/A ASP 172.A N SER 169.A O no hydrogen 2.985 N/A TYR 173.A N SER 169.A O no hydrogen 3.264 N/A TYR 173.A OH ASP 207.A OD2 no hydrogen 2.722 N/A LEU 174.A N MET 170.A O no hydrogen 2.912 N/A ILE 175.A N ILE 171.A O no hydrogen 3.197 N/A ILE 175.A N ASP 172.A O no hydrogen 3.254 N/A TRP 176.A N ASP 172.A O no hydrogen 2.889 N/A TRP 176.A NE1 GLU 180.A OE1 no hydrogen 3.005 N/A TRP 178.A N ILE 175.A O no hydrogen 3.429 N/A GLU 180.A N TRP 176.A O no hydrogen 2.839 N/A ARG 181.A NH1 GLU 34.A OE1 no hydrogen 2.623 N/A ARG 181.A NH1 PRO 177.A O no hydrogen 2.807 N/A ARG 181.A NH2 GLU 34.A OE1 no hydrogen 3.250 N/A LEU 182.A N PHE 179.A O no hydrogen 3.276 N/A MET 185.A N ARG 181.A O no hydrogen 2.967 N/A LYS 186.A N GLU 183.A O no hydrogen 2.858 N/A LYS 186.A NZ GLU 183.A O no hydrogen 3.353 N/A LYS 186.A NZ GLU 217.A OE1 no hydrogen 3.332 N/A LEU 187.A N LEU 182.A O no hydrogen 2.873 N/A CYS 190.A N LEU 187.A O no hydrogen 3.062 N/A CYS 190.A SG LYS 141.A O no hydrogen 3.535 N/A VAL 191.A N ASN 188.A O no hydrogen 3.267 N/A ASP 192.A N GLU 189.A O no hydrogen 3.459 N/A THR 194.A N VAL 191.A O no hydrogen 3.011 N/A THR 194.A OG1 VAL 191.A O no hydrogen 2.641 N/A LYS 196.A N GLU 152.A OE2 no hydrogen 2.965 N/A LEU 197.A N GLU 152.A OE1 no hydrogen 2.807 N/A LYS 198.A N THR 194.A O no hydrogen 3.033 N/A LYS 198.A NZ ASP 192.A OD1 no hydrogen 3.366 N/A LEU 199.A N PRO 195.A O no hydrogen 3.128 N/A TRP 200.A N LYS 196.A O no hydrogen 2.806 N/A TRP 200.A NE1 ASP 172.A OD1 no hydrogen 2.919 N/A MET 201.A N LEU 197.A O no hydrogen 3.031 N/A ALA 202.A N LYS 198.A O no hydrogen 3.370 N/A ALA 203.A N LEU 199.A O no hydrogen 3.081 N/A MET 204.A N TRP 200.A O no hydrogen 2.822 N/A LYS 205.A N MET 201.A O no hydrogen 3.159 N/A GLU 206.A N ALA 202.A O no hydrogen 3.397 N/A ASP 207.A N ALA 203.A O no hydrogen 3.236 N/A ASP 207.A N MET 204.A O no hydrogen 2.973 N/A VAL 210.A N ASP 207.A OD2 no hydrogen 3.267 N/A SER 211.A N ASP 207.A O no hydrogen 2.931 N/A ALA 212.A N PRO 208.A O no hydrogen 3.024 N/A LEU 213.A N THR 209.A O no hydrogen 3.332 N/A THR 215.A N GLU 180.A OE2 no hydrogen 2.928 N/A ASP 219.A N SER 216.A OG no hydrogen 3.193 N/A TRP 220.A N SER 216.A O no hydrogen 3.124 N/A GLN 221.A N GLU 217.A O no hydrogen 3.002 N/A GLY 222.A N LYS 218.A O no hydrogen 3.229 N/A PHE 223.A N ASP 219.A O no hydrogen 3.109 N/A LEU 224.A N TRP 220.A O no hydrogen 2.824 N/A GLU 225.A N GLN 221.A O no hydrogen 3.022 N/A LEU 226.A N GLY 222.A O no hydrogen 3.415 N/A TYR 227.A N PHE 223.A O no hydrogen 2.748 N/A LEU 228.A N LEU 224.A O no hydrogen 2.940 N/A GLN 229.A N LEU 226.A O no hydrogen 3.007 N/A ASN 230.A N TYR 227.A O no hydrogen 2.822 N/A SER 231.A N LEU 226.A O no hydrogen 3.256 N/A SER 231.A OG GLU 233.A OE2 no hydrogen 3.506 N/A GLU 233.A N SER 231.A OG no hydrogen 2.852 N/A ALA 234.A N SER 231.A O no hydrogen 3.050 N/A ASP 236.A N GLU 233.A O no hydrogen 3.135 N/A TYR 237.A N ALA 234.A O no hydrogen 2.992 N/A LEU 239.A N ASP 236.A O no hydrogen 2.830 N/A