Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1f5q_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 7.A OG PHE 4.A O no hydrogen 2.452 N/A LEU 10.A N SER 7.A O no hydrogen 3.349 N/A ASN 11.A N ASP 14.A OD2 no hydrogen 3.059 N/A ASP 14.A N ASN 11.A O no hydrogen 2.663 N/A ASP 14.A N ASN 11.A OD1 no hydrogen 3.113 N/A CYS 15.A SG TYR 150.A O no hydrogen 3.533 N/A ARG 16.A N GLU 12.A O no hydrogen 2.942 N/A ARG 16.A NE GLU 12.A OE2 no hydrogen 2.742 N/A ARG 16.A NH1 SER 216.A OG no hydrogen 2.851 N/A ARG 16.A NH2 GLU 12.A OE2 no hydrogen 2.892 N/A ARG 16.A NH2 SER 216.A OG no hydrogen 2.856 N/A GLN 17.A N GLU 13.A O no hydrogen 2.926 N/A GLN 17.A NE2 GLU 13.A O no hydrogen 3.414 N/A MET 18.A N ASP 14.A O no hydrogen 3.169 N/A ILE 19.A N CYS 15.A O no hydrogen 3.098 N/A TYR 20.A N ARG 16.A O no hydrogen 2.853 N/A ARG 21.A N GLN 17.A O no hydrogen 2.998 N/A ARG 21.A N MET 18.A O no hydrogen 3.056 N/A SER 22.A N MET 18.A O no hydrogen 3.124 N/A SER 22.A N ILE 19.A O no hydrogen 3.009 N/A SER 22.A OG ILE 19.A O no hydrogen 2.916 N/A GLU 23.A N ILE 19.A O no hydrogen 2.978 N/A ARG 24.A N TYR 20.A O no hydrogen 3.130 N/A GLU 25.A N ARG 21.A O no hydrogen 3.147 N/A HIS 26.A N SER 22.A O no hydrogen 2.920 N/A ASP 27.A N GLU 23.A O no hydrogen 3.006 N/A ALA 28.A N ARG 24.A O no hydrogen 2.846 N/A ARG 29.A N GLU 25.A O no hydrogen 2.926 N/A MET 30.A N ASP 27.A O no hydrogen 2.656 N/A VAL 31.A N ASP 27.A O no hydrogen 2.799 N/A VAL 33.A N LEU 77.A O no hydrogen 3.283 N/A ASN 34.A ND2 GLN 37.A OE1 no hydrogen 2.564 N/A HIS 38.A N ASN 34.A O no hydrogen 3.195 N/A HIS 38.A N VAL 35.A O no hydrogen 3.062 N/A HIS 38.A ND1 TYR 43.A OH no hydrogen 2.428 N/A HIS 38.A NE2 ASP 73.A OD1 no hydrogen 3.054 N/A PHE 39.A N VAL 35.A O no hydrogen 3.283 N/A THR 40.A N ASP 36.A O no hydrogen 2.990 N/A THR 40.A OG1 ASP 36.A O no hydrogen 3.080 N/A THR 40.A OG1 GLN 37.A O no hydrogen 3.465 N/A SER 41.A N GLN 37.A O no hydrogen 3.156 N/A SER 41.A OG HIS 38.A O no hydrogen 2.736 N/A TYR 43.A OH HIS 38.A ND1 no hydrogen 2.428 N/A ARG 44.A N SER 41.A OG no hydrogen 3.262 N/A ARG 44.A NE ASP 73.A OD1 no hydrogen 3.048 N/A ARG 44.A NH1 LEU 177.A O no hydrogen 3.018 N/A ARG 44.A NH2 ASP 73.A OD1 no hydrogen 3.536 N/A ARG 44.A NH2 ASP 73.A OD2 no hydrogen 3.095 N/A ARG 44.A NH2 LEU 177.A O no hydrogen 3.068 N/A LYS 45.A N GLN 42.A O no hydrogen 3.213 N/A VAL 46.A N GLN 42.A O no hydrogen 3.342 N/A LEU 47.A N TYR 43.A O no hydrogen 3.105 N/A THR 48.A N ARG 44.A O no hydrogen 3.119 N/A THR 48.A OG1 ARG 44.A O no hydrogen 3.088 N/A THR 48.A OG1 LYS 45.A O no hydrogen 3.341 N/A THR 49.A N LYS 45.A O no hydrogen 3.130 N/A THR 49.A OG1 LYS 45.A O no hydrogen 3.148 N/A THR 49.A OG1 VAL 46.A O no hydrogen 3.224 N/A TRP 50.A N VAL 46.A O no hydrogen 2.955 N/A MET 51.A N LEU 47.A O no hydrogen 3.108 N/A PHE 52.A N THR 48.A O no hydrogen 3.018 N/A CYS 53.A N.A THR 49.A O no hydrogen 3.123 N/A CYS 53.A N.A TRP 50.A O no hydrogen 3.021 N/A CYS 53.A N.B THR 49.A O no hydrogen 3.097 N/A CYS 53.A SG.A THR 49.A O no hydrogen 3.652 N/A CYS 53.A SG.A GLU 240.A O no hydrogen 3.310 N/A CYS 53.A SG.B ASP 57.A OD2 no hydrogen 3.394 N/A VAL 54.A N TRP 50.A O no hydrogen 2.930 N/A CYS 55.A N MET 51.A O no hydrogen 2.899 N/A CYS 55.A SG MET 51.A O no hydrogen 3.448 N/A LYS 56.A N PHE 52.A O no hydrogen 3.033 N/A LYS 56.A NZ GLU 240.A OE2 no hydrogen 2.878 N/A ASP 57.A N CYS 53.A O.A no hydrogen 2.730 N/A ASP 57.A N CYS 53.A O.B no hydrogen 2.794 N/A LEU 58.A N VAL 54.A O no hydrogen 2.929 N/A ARG 59.A N LYS 56.A O no hydrogen 3.106 N/A GLN 60.A N CYS 55.A O no hydrogen 2.868 N/A GLN 60.A NE2 MET 104.A O no hydrogen 3.417 N/A ASP 61.A N GLN 60.A OE1 no hydrogen 3.342 N/A ASN 63.A N ASP 61.A OD1 no hydrogen 2.257 N/A VAL 64.A N ASP 61.A O no hydrogen 3.132 N/A LEU 67.A N ASN 63.A O no hydrogen 3.333 N/A ALA 68.A N VAL 64.A O no hydrogen 2.832 N/A VAL 69.A N PHE 65.A O no hydrogen 2.969 N/A ALA 70.A N PRO 66.A O no hydrogen 3.172 N/A LEU 71.A N LEU 67.A O no hydrogen 2.883 N/A LEU 72.A N ALA 68.A O no hydrogen 2.987 N/A ASP 73.A N VAL 69.A O no hydrogen 3.147 N/A GLU 74.A N ALA 70.A O no hydrogen 3.381 N/A LEU 75.A N LEU 71.A O no hydrogen 3.239 N/A PHE 76.A N LEU 72.A O no hydrogen 2.993 N/A LEU 77.A N ASP 73.A O no hydrogen 2.929 N/A SER 78.A N GLU 74.A O no hydrogen 2.707 N/A SER 78.A OG GLU 74.A O no hydrogen 3.044 N/A THR 79.A OG1 LEU 75.A O no hydrogen 2.589 N/A ASN 85.A N ASP 82.A O no hydrogen 2.825 N/A TYR 86.A N ARG 83.A O no hydrogen 3.281 N/A GLN 87.A NE2 GLN 87.A O no hydrogen 3.293 N/A THR 89.A N ASN 85.A O no hydrogen 2.887 N/A THR 89.A OG1 ASN 85.A O no hydrogen 2.906 N/A ALA 90.A N TYR 86.A O no hydrogen 2.972 N/A ALA 91.A N GLN 87.A O no hydrogen 3.078 N/A VAL 92.A N SER 88.A O no hydrogen 3.022 N/A ALA 93.A N THR 89.A O no hydrogen 2.886 N/A LEU 94.A N ALA 90.A O no hydrogen 3.245 N/A HIS 95.A N ALA 91.A O no hydrogen 2.751 N/A HIS 95.A ND1 GLU 128.A OE2 no hydrogen 2.382 N/A ILE 96.A N VAL 92.A O no hydrogen 2.729 N/A ALA 97.A N ALA 93.A O no hydrogen 3.053 N/A GLY 98.A N LEU 94.A O no hydrogen 3.158 N/A LYS 99.A N HIS 95.A O no hydrogen 3.363 N/A LYS 99.A NZ GLU 128.A OE1 no hydrogen 2.886 N/A VAL 100.A N ALA 97.A O no hydrogen 3.056 N/A ARG 101.A N ALA 97.A O no hydrogen 2.900 N/A ARG 101.A NE ASP 140.A OD1 no hydrogen 2.790 N/A ARG 101.A NH1 ASP 146.A OD1 no hydrogen 3.391 N/A ARG 101.A NH1 ASP 146.A OD2 no hydrogen 3.470 N/A ARG 101.A NH2 ASP 140.A OD1 no hydrogen 3.086 N/A ARG 101.A NH2 ARG 141.A O no hydrogen 2.910 N/A ARG 101.A NH2 ASP 146.A OD2 no hydrogen 2.615 N/A ALA 102.A N GLY 98.A O no hydrogen 2.796 N/A LEU 111.A N LYS 107.A O no hydrogen 2.951 N/A ALA 112.A N ALA 108.A O no hydrogen 2.730 N/A TYR 113.A N THR 109.A O no hydrogen 3.109 N/A LEU 114.A N GLN 110.A O no hydrogen 2.967 N/A CYS 115.A N LEU 111.A O no hydrogen 2.870 N/A CYS 115.A SG LEU 111.A O no hydrogen 3.559 N/A GLY 116.A N ALA 112.A O no hydrogen 2.864 N/A THR 119.A OG1 GLY 116.A O no hydrogen 3.183 N/A LYS 123.A N THR 120.A OG1 no hydrogen 3.305 N/A LEU 124.A N THR 120.A O no hydrogen 3.044 N/A LEU 125.A N ALA 121.A O no hydrogen 2.898 N/A THR 126.A N ASP 122.A O no hydrogen 3.199 N/A LEU 127.A N LYS 123.A O no hydrogen 3.078 N/A GLU 128.A N LEU 124.A O no hydrogen 2.885 N/A VAL 129.A N LEU 125.A O no hydrogen 3.331 N/A LYS 130.A N THR 126.A O no hydrogen 3.497 N/A SER 131.A N LEU 127.A O no hydrogen 2.980 N/A SER 131.A OG LEU 127.A O no hydrogen 2.658 N/A LEU 132.A N GLU 128.A O no hydrogen 2.861 N/A ASP 133.A N VAL 129.A O no hydrogen 2.918 N/A THR 134.A N LYS 130.A O no hydrogen 3.326 N/A THR 134.A OG1 LYS 130.A O no hydrogen 3.141 N/A LEU 135.A N SER 131.A O no hydrogen 3.043 N/A SER 136.A N ASP 133.A O no hydrogen 3.251 N/A TRP 137.A N LEU 132.A O no hydrogen 2.717 N/A TRP 137.A NE1 ASP 133.A OD1 no hydrogen 3.069 N/A VAL 138.A N LEU 135.A O no hydrogen 3.021 N/A ARG 141.A NH1 VAL 138.A O no hydrogen 2.988 N/A ARG 141.A NH1 ASP 140.A O no hydrogen 3.194 N/A ARG 141.A NH2 GLU 74.A OE1 no hydrogen 2.954 N/A CYS 142.A N GLU 25.A OE1 no hydrogen 2.922 N/A CYS 142.A SG MET 18.A O no hydrogen 3.708 N/A LEU 143.A N ASP 146.A OD2 no hydrogen 3.230 N/A SER 144.A OG PRO 187.A O no hydrogen 3.112 N/A THR 145.A OG1 ASN 63.A OD1 no hydrogen 2.931 N/A THR 145.A OG1 ASP 146.A OD1 no hydrogen 3.337 N/A LEU 147.A N LEU 143.A O no hydrogen 2.883 N/A ILE 148.A N SER 144.A O no hydrogen 3.190 N/A ILE 151.A N LEU 147.A O no hydrogen 3.063 N/A LEU 152.A N ILE 148.A O no hydrogen 3.329 N/A HIS 153.A N CYS 149.A O no hydrogen 3.152 N/A HIS 153.A NE2 LEU 10.A O no hydrogen 2.475 N/A ILE 154.A N TYR 150.A O no hydrogen 3.285 N/A MET 155.A N ILE 151.A O no hydrogen 3.146 N/A HIS 156.A N HIS 153.A O no hydrogen 2.691 N/A ALA 157.A N LEU 152.A O no hydrogen 2.996 N/A ASP 161.A N PRO 158.A O no hydrogen 2.893 N/A ILE 165.A N ASP 161.A O no hydrogen 3.204 N/A TYR 166.A N TYR 162.A O no hydrogen 2.668 N/A ASN 167.A N LEU 163.A O no hydrogen 2.995 N/A LEU 168.A N ASN 164.A O no hydrogen 3.159 N/A LEU 168.A N ILE 165.A O no hydrogen 3.011 N/A CYS 169.A N ILE 165.A O no hydrogen 3.012 N/A CYS 169.A SG ILE 165.A O no hydrogen 3.521 N/A CYS 169.A SG THR 198.A OG1 no hydrogen 3.662 N/A ARG 170.A N TYR 166.A O no hydrogen 2.941 N/A ILE 173.A N CYS 169.A O no hydrogen 3.029 N/A PHE 174.A N ARG 170.A O no hydrogen 3.072 N/A CYS 175.A N PRO 171.A O no hydrogen 3.318 N/A CYS 175.A SG PRO 171.A O no hydrogen 3.332 N/A ALA 176.A N LYS 172.A O no hydrogen 2.997 N/A LEU 177.A N ILE 173.A O no hydrogen 2.964 N/A CYS 178.A N PHE 174.A O no hydrogen 3.357 N/A CYS 178.A N CYS 175.A O no hydrogen 3.208 N/A CYS 178.A SG PHE 174.A O no hydrogen 3.315 N/A ASP 179.A N ALA 176.A O no hydrogen 3.140 N/A SER 182.A N ASP 179.A O no hydrogen 3.082 N/A SER 182.A OG ALA 176.A O no hydrogen 2.724 N/A SER 182.A OG ASP 179.A O no hydrogen 3.183 N/A ALA 183.A N ASP 179.A O no hydrogen 2.687 N/A ARG 186.A NE GLU 23.A OE1 no hydrogen 2.908 N/A ILE 190.A N ARG 186.A O no hydrogen 3.267 N/A THR 191.A N PRO 187.A O no hydrogen 2.933 N/A THR 191.A OG1 SER 144.A O no hydrogen 2.941 N/A THR 191.A OG1 PRO 187.A O no hydrogen 2.826 N/A LEU 192.A N VAL 188.A O no hydrogen 2.547 N/A ALA 193.A N LEU 189.A O no hydrogen 2.875 N/A CYS 194.A N ILE 190.A O no hydrogen 2.988 N/A CYS 194.A SG ILE 190.A O no hydrogen 3.177 N/A MET 195.A N THR 191.A O no hydrogen 2.826 N/A HIS 196.A N LEU 192.A O no hydrogen 2.737 N/A HIS 196.A ND1 TYR 206.A OH no hydrogen 2.688 N/A LEU 197.A N ALA 193.A O no hydrogen 2.966 N/A THR 198.A N CYS 194.A O no hydrogen 3.085 N/A THR 198.A N MET 195.A O no hydrogen 3.202 N/A THR 198.A OG1 CYS 194.A O no hydrogen 3.114 N/A THR 198.A OG1 MET 195.A O no hydrogen 3.201 N/A MET 199.A N MET 195.A O no hydrogen 2.554 N/A ASN 200.A N HIS 196.A O no hydrogen 2.833 N/A LYS 202.A N MET 199.A O no hydrogen 3.013 N/A TYR 203.A N MET 199.A O no hydrogen 3.327 N/A TYR 205.A OH ASP 161.A OD2 no hydrogen 2.539 N/A TYR 206.A OH HIS 196.A ND1 no hydrogen 2.688 N/A GLU 207.A N TYR 203.A O no hydrogen 3.455 N/A ASN 208.A N ASP 204.A O no hydrogen 3.060 N/A ARG 209.A N TYR 205.A O no hydrogen 3.186 N/A ARG 209.A N TYR 206.A O no hydrogen 3.208 N/A ILE 210.A N TYR 206.A O no hydrogen 2.908 N/A VAL 213.A N ARG 209.A O no hydrogen 3.132 N/A CYS 214.A N ILE 210.A O no hydrogen 2.988 N/A CYS 214.A SG ILE 210.A O no hydrogen 3.260 N/A LYS 215.A N ASP 211.A O no hydrogen 2.942 N/A SER 216.A N GLY 212.A O no hydrogen 2.788 N/A SER 216.A OG GLY 212.A O no hydrogen 3.283 N/A SER 216.A OG VAL 213.A O no hydrogen 2.700 N/A LEU 217.A N VAL 213.A O no hydrogen 3.155 N/A LEU 217.A N CYS 214.A O no hydrogen 3.141 N/A TYR 218.A N LYS 215.A O no hydrogen 3.089 N/A ILE 219.A N CYS 214.A O no hydrogen 2.645 N/A GLU 223.A N THR 220.A OG1 no hydrogen 3.085 N/A LEU 224.A N THR 220.A O no hydrogen 3.294 N/A HIS 225.A N LYS 221.A O no hydrogen 3.104 N/A GLN 226.A N GLU 222.A O no hydrogen 2.984 N/A CYS 227.A N GLU 223.A O no hydrogen 2.965 N/A CYS 227.A SG LEU 189.A O no hydrogen 3.636 N/A CYS 228.A N LEU 224.A O no hydrogen 2.976 N/A CYS 228.A SG ALA 193.A O no hydrogen 3.786 N/A CYS 228.A SG LEU 224.A O no hydrogen 3.268 N/A ASP 229.A N HIS 225.A O no hydrogen 3.363 N/A ASP 229.A N GLN 226.A O no hydrogen 2.836 N/A LEU 230.A N GLN 226.A O no hydrogen 2.986 N/A VAL 231.A N CYS 227.A O no hydrogen 2.857 N/A ASP 232.A N CYS 228.A O no hydrogen 3.055 N/A ILE 233.A N ASP 229.A O no hydrogen 3.070 N/A ALA 234.A N LEU 230.A O no hydrogen 2.840 N/A ILE 235.A N VAL 231.A O no hydrogen 2.794 N/A VAL 236.A N ASP 232.A O no hydrogen 3.198 N/A SER 237.A N ILE 233.A O no hydrogen 2.992 N/A SER 237.A OG ASP 179.A OD1 no hydrogen 3.483 N/A SER 237.A OG ILE 233.A O no hydrogen 2.790 N/A ASN 241.A N ASP 239.A OD1 no hydrogen 2.572 N/A TYR 242.A N ASP 239.A O no hydrogen 3.256 N/A PHE 243.A N THR 49.A OG1 no hydrogen 3.293 N/A LYS 244.A N ASN 241.A O no hydrogen 2.822 N/A ILE 245.A N ASN 241.A O no hydrogen 2.954 N/A ASN 246.A N TYR 242.A O no hydrogen 3.138 N/A ASN 246.A ND2 TYR 242.A O no hydrogen 2.617 N/A