Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1f4d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N GLN 2.A OE1 no hydrogen 3.434 N/A GLN 2.A N GLN 2.A OE1 no hydrogen 2.656 N/A GLN 2.A NE2 ARG 34.A O no hydrogen 2.957 N/A TYR 3.A OH VAL 169.A O no hydrogen 2.516 N/A GLU 5.A N LYS 1.A O no hydrogen 2.926 N/A LEU 6.A N GLN 2.A O no hydrogen 2.956 N/A MET 7.A N TYR 3.A O no hydrogen 2.872 N/A GLN 8.A N LEU 4.A O no hydrogen 2.969 N/A GLN 8.A NE2 GLN 8.A O no hydrogen 3.511 N/A GLN 8.A NE2 ASP 12.A OD1 no hydrogen 2.635 N/A LYS 9.A N GLU 5.A O no hydrogen 2.849 N/A LYS 9.A NZ GLU 13.A OE2 no hydrogen 3.166 N/A VAL 10.A N LEU 6.A O no hydrogen 2.974 N/A LEU 11.A N MET 7.A O no hydrogen 3.081 N/A ASP 12.A N GLN 8.A O no hydrogen 2.951 N/A GLU 13.A N LYS 9.A O no hydrogen 2.739 N/A GLY 14.A N VAL 10.A O no hydrogen 2.775 N/A THR 15.A N SER 27.A O no hydrogen 2.880 N/A LYS 17.A N THR 25.A O no hydrogen 2.783 N/A ARG 20.A NH2 ILE 263.A OXT no hydrogen 3.026 N/A THR 21.A OG1 ILE 263.A O no hydrogen 2.508 N/A GLY 22.A N ASP 19.A O no hydrogen 3.050 N/A THR 23.A N ASP 19.A OD1 no hydrogen 2.910 N/A THR 23.A OG1 ASP 19.A OD1 no hydrogen 2.375 N/A THR 25.A N LYS 17.A O no hydrogen 3.215 N/A LEU 26.A N LEU 207.A O no hydrogen 2.852 N/A SER 27.A N THR 15.A O no hydrogen 3.020 N/A ILE 28.A N THR 205.A O no hydrogen 2.772 N/A GLY 30.A N GLY 203.A O no hydrogen 3.217 N/A HIS 31.A N GLY 202.A O no hydrogen 3.176 N/A GLN 32.A NE2 THR 201.A OG1 no hydrogen 2.975 N/A MET 33.A N TRP 200.A O no hydrogen 2.880 N/A ARG 34.A NH1 ASP 197.A OD2 no hydrogen 2.852 N/A PHE 35.A N PHE 198.A O no hydrogen 2.864 N/A LEU 37.A N GLY 196.A O no hydrogen 2.933 N/A GLN 38.A N ASN 36.A OD1 no hydrogen 2.825 N/A ASP 39.A N ASN 36.A O no hydrogen 2.875 N/A GLY 40.A N LEU 37.A O no hydrogen 3.146 N/A PHE 41.A N PRO 227.A O no hydrogen 3.174 N/A LEU 43.A N PHE 41.A O no hydrogen 2.665 N/A THR 46.A OG1 GLN 218.A OE1 no hydrogen 2.979 N/A LYS 47.A NZ PHE 170.A O no hydrogen 2.999 N/A CYS 49.A N TYR 251.A OH no hydrogen 2.839 N/A CYS 49.A SG VAL 44.A O no hydrogen 3.984 N/A CYS 49.A SG LYS 47.A O no hydrogen 3.584 N/A ARG 52.A NH1 ASN 74.A O no hydrogen 2.327 N/A ARG 52.A NH1 ASN 75.A O no hydrogen 3.092 N/A ARG 52.A NH2 ASN 75.A O no hydrogen 2.604 N/A ILE 55.A N LEU 51.A O no hydrogen 2.975 N/A HIS 56.A N ARG 52.A O no hydrogen 3.177 N/A HIS 56.A ND1 TYR 70.A OH no hydrogen 2.682 N/A GLU 57.A N SER 53.A O no hydrogen 2.800 N/A LEU 58.A N ILE 54.A O no hydrogen 2.963 N/A LEU 59.A N ILE 55.A O no hydrogen 2.924 N/A TRP 60.A N HIS 56.A O no hydrogen 3.077 N/A TRP 60.A NE1 ASN 67.A O no hydrogen 2.886 N/A PHE 61.A N GLU 57.A O no hydrogen 2.833 N/A LEU 62.A N LEU 58.A O no hydrogen 3.007 N/A GLN 63.A N LEU 59.A O no hydrogen 3.096 N/A GLY 64.A N PHE 61.A O no hydrogen 2.861 N/A ASP 65.A N TRP 60.A O no hydrogen 3.240 N/A THR 66.A OG1 GLY 90.A O no hydrogen 3.127 N/A ASN 67.A N ASP 65.A OD1 no hydrogen 2.859 N/A ASN 67.A ND2 ASN 86.A O no hydrogen 2.809 N/A ASN 67.A ND2 ASP 88.A OD1 no hydrogen 2.786 N/A ILE 68.A N GLY 87.A O no hydrogen 2.899 N/A ALA 69.A N ASN 67.A OD1 no hydrogen 2.731 N/A HIS 72.A N ILE 68.A O no hydrogen 2.633 N/A GLU 73.A N ALA 69.A O no hydrogen 2.882 N/A ASN 74.A N TYR 70.A O no hydrogen 3.418 N/A ASN 74.A ND2 TYR 70.A O no hydrogen 3.052 N/A ASN 75.A N HIS 72.A O no hydrogen 3.048 N/A ASN 75.A ND2 GLU 73.A O no hydrogen 3.039 N/A VAL 76.A N LEU 71.A O no hydrogen 2.727 N/A TRP 79.A NE1 GLU 57.A OE2 no hydrogen 2.865 N/A ASP 80.A N THR 77.A O no hydrogen 3.233 N/A TRP 82.A N TRP 79.A O no hydrogen 3.196 N/A ASP 84.A N ASP 88.A O no hydrogen 2.988 N/A ASN 86.A N ASP 84.A OD1 no hydrogen 2.854 N/A GLY 87.A N ASP 84.A O no hydrogen 3.068 N/A ASP 88.A N ASP 84.A OD1 no hydrogen 2.774 N/A LEU 89.A N THR 66.A O no hydrogen 3.098 N/A VAL 92.A N GLY 90.A O no hydrogen 2.789 N/A LYS 95.A N VAL 92.A O no hydrogen 2.901 N/A GLN 96.A NE2 PRO 91.A O no hydrogen 2.847 N/A GLN 96.A NE2 GLU 136.A OE1 no hydrogen 3.102 N/A TRP 97.A N TYR 93.A O no hydrogen 3.024 N/A ARG 98.A N GLY 94.A O no hydrogen 3.013 N/A ARG 98.A NE ASP 109.A OD1 no hydrogen 3.102 N/A ARG 98.A NE ASP 109.A OD2 no hydrogen 3.418 N/A ARG 98.A NH1 LEU 62.A O no hydrogen 2.846 N/A ARG 98.A NH2 ASP 109.A OD2 no hydrogen 2.843 N/A ALA 99.A N LYS 95.A O no hydrogen 2.802 N/A TRP 100.A N ILE 108.A O no hydrogen 3.033 N/A THR 102.A N ARG 106.A O no hydrogen 3.052 N/A ASP 104.A N THR 102.A OG1 no hydrogen 3.199 N/A GLY 105.A N THR 102.A O no hydrogen 3.320 N/A ARG 106.A N THR 102.A OG1 no hydrogen 3.171 N/A ILE 108.A N TRP 100.A O no hydrogen 2.652 N/A GLN 110.A N TRP 97.A O no hydrogen 2.977 N/A GLN 110.A NE2 GLN 96.A O no hydrogen 2.745 N/A GLN 110.A NE2 SER 130.A O no hydrogen 2.759 N/A ILE 111.A N ASP 109.A OD1 no hydrogen 3.277 N/A THR 112.A N ASP 109.A OD1 no hydrogen 3.176 N/A THR 112.A OG1 ASP 109.A OD2 no hydrogen 2.713 N/A THR 113.A N ASP 109.A O no hydrogen 2.988 N/A THR 113.A OG1 ASP 109.A O no hydrogen 2.648 N/A VAL 114.A N GLN 110.A O no hydrogen 2.987 N/A LEU 115.A N ILE 111.A O no hydrogen 2.873 N/A ASN 116.A N THR 112.A O no hydrogen 3.023 N/A GLN 117.A N THR 113.A O no hydrogen 3.006 N/A GLN 117.A NE2 ARG 126.A O no hydrogen 2.999 N/A LEU 118.A N VAL 114.A O no hydrogen 2.716 N/A LYS 119.A N LEU 115.A O no hydrogen 2.982 N/A ASN 120.A N ASN 116.A O no hydrogen 2.767 N/A ASP 121.A N GLN 117.A O no hydrogen 2.658 N/A SER 124.A N ASP 121.A O no hydrogen 2.889 N/A ARG 126.A N SER 124.A OG no hydrogen 3.061 N/A VAL 129.A N PHE 149.A O no hydrogen 3.027 N/A SER 130.A N GLN 110.A OE1 no hydrogen 2.829 N/A ALA 131.A N ALA 147.A O no hydrogen 2.854 N/A TRP 132.A N SER 130.A OG no hydrogen 2.945 N/A ASN 133.A N ALA 131.A O no hydrogen 2.796 N/A ASN 133.A ND2 GLN 96.A OE1 no hydrogen 2.831 N/A GLU 136.A N ASN 133.A O no hydrogen 2.860 N/A LYS 139.A N GLU 136.A O no hydrogen 2.945 N/A LYS 139.A NZ GLU 136.A OE2 no hydrogen 3.200 N/A MET 140.A N LEU 137.A O no hydrogen 2.996 N/A ALA 141.A N LEU 89.A O no hydrogen 2.808 N/A SER 145.A N TYR 93.A OH no hydrogen 2.800 N/A HIS 146.A N TYR 93.A OH no hydrogen 3.439 N/A HIS 146.A ND1 TYR 180.A OH no hydrogen 2.601 N/A ALA 147.A N TYR 163.A O no hydrogen 3.039 N/A PHE 148.A N TYR 163.A O no hydrogen 3.443 N/A PHE 149.A N VAL 129.A O no hydrogen 2.967 N/A GLN 150.A N GLN 161.A O no hydrogen 2.818 N/A PHE 151.A N ILE 127.A O no hydrogen 2.777 N/A TYR 152.A N SER 159.A O no hydrogen 3.081 N/A ALA 154.A N LYS 157.A O no hydrogen 3.272 N/A LYS 157.A N ALA 154.A O no hydrogen 2.986 N/A LYS 157.A NZ GLN 38.A OE1 no hydrogen 3.187 N/A LEU 158.A N GLU 194.A O no hydrogen 2.773 N/A SER 159.A N TYR 152.A O no hydrogen 2.867 N/A CYS 160.A N ASP 197.A O no hydrogen 2.900 N/A CYS 160.A SG GLN 150.A O no hydrogen 3.823 N/A GLN 161.A N GLN 150.A O no hydrogen 2.983 N/A LEU 162.A N VAL 199.A O no hydrogen 2.980 N/A TYR 163.A N PHE 148.A O no hydrogen 2.751 N/A GLN 164.A N THR 201.A O no hydrogen 2.923 N/A GLN 164.A NE2 SER 166.A O no hydrogen 3.211 N/A GLN 164.A NE2 ASN 176.A OD1 no hydrogen 2.926 N/A ARG 165.A N SER 145.A O no hydrogen 3.045 N/A ARG 165.A NE PRO 144.A O no hydrogen 2.744 N/A ARG 165.A NH2 ALA 143.A O no hydrogen 2.995 N/A ARG 165.A NH2 PRO 144.A O no hydrogen 3.106 N/A CYS 167.A N ASP 204.A O no hydrogen 2.893 N/A VAL 169.A N HIS 206.A O no hydrogen 2.757 N/A LEU 171.A N ASP 168.A OD1 no hydrogen 3.177 N/A GLY 172.A N ASP 168.A O no hydrogen 3.119 N/A LEU 173.A N ASP 168.A O no hydrogen 3.173 N/A PHE 175.A N GLY 172.A O no hydrogen 2.879 N/A ASN 176.A N GLY 172.A O no hydrogen 2.953 N/A ILE 177.A N LEU 173.A O no hydrogen 2.926 N/A ALA 178.A N PRO 174.A O no hydrogen 3.173 N/A SER 179.A N PHE 175.A O no hydrogen 2.861 N/A TYR 180.A N ASN 176.A O no hydrogen 3.149 N/A TYR 180.A OH HIS 146.A ND1 no hydrogen 2.601 N/A ALA 181.A N ILE 177.A O no hydrogen 2.948 N/A LEU 182.A N ALA 178.A O no hydrogen 3.178 N/A LEU 183.A N SER 179.A O no hydrogen 3.118 N/A VAL 184.A N TYR 180.A O no hydrogen 2.804 N/A HIS 185.A N ALA 181.A O no hydrogen 3.101 N/A MET 186.A N LEU 182.A O no hydrogen 2.948 N/A MET 187.A N LEU 183.A O no hydrogen 2.865 N/A ALA 188.A N VAL 184.A O no hydrogen 2.977 N/A GLN 189.A N HIS 185.A O no hydrogen 2.972 N/A GLN 189.A NE2 ARG 233.A O no hydrogen 3.163 N/A GLN 189.A NE2 TYR 241.A OH no hydrogen 2.557 N/A GLN 190.A N MET 186.A O no hydrogen 2.977 N/A GLN 190.A NE2 PRO 235.A O no hydrogen 3.173 N/A GLN 190.A NE2 TYR 241.A OH no hydrogen 2.875 N/A CYS 191.A N MET 187.A O no hydrogen 2.974 N/A CYS 191.A N ALA 188.A O no hydrogen 3.221 N/A CYS 191.A SG MET 187.A O no hydrogen 3.379 N/A ASP 192.A N GLN 189.A O no hydrogen 3.288 N/A LEU 193.A N ALA 188.A O no hydrogen 2.709 N/A GLU 194.A N GLY 156.A O no hydrogen 2.783 N/A GLY 196.A N LEU 158.A O no hydrogen 2.681 N/A ASP 197.A N SER 159.A OG no hydrogen 3.037 N/A PHE 198.A N PHE 35.A O no hydrogen 2.919 N/A VAL 199.A N CYS 160.A O no hydrogen 2.585 N/A TRP 200.A N MET 33.A O no hydrogen 2.746 N/A TRP 200.A NE1 GLN 164.A OE1 no hydrogen 2.784 N/A THR 201.A N LEU 162.A O no hydrogen 3.028 N/A THR 201.A OG1 GLN 161.A OE1 no hydrogen 2.677 N/A GLY 202.A N HIS 31.A O no hydrogen 2.896 N/A GLY 203.A N GLN 164.A O no hydrogen 2.820 N/A ASP 204.A N ARG 165.A O no hydrogen 2.998 N/A THR 205.A N ILE 28.A O no hydrogen 3.002 N/A THR 205.A OG1 GLY 203.A O no hydrogen 3.210 N/A HIS 206.A N CYS 167.A O no hydrogen 2.973 N/A HIS 206.A ND1 ASP 204.A OD1 no hydrogen 2.703 N/A LEU 207.A N LEU 26.A O no hydrogen 2.936 N/A SER 209.A N GLY 24.A O no hydrogen 2.994 N/A SER 209.A OG GLY 24.A O no hydrogen 3.282 N/A HIS 211.A N TYR 208.A O no hydrogen 2.863 N/A HIS 211.A NE2 PRO 260.A O no hydrogen 2.690 N/A MET 212.A N SER 209.A O no hydrogen 3.312 N/A GLN 214.A N GLN 214.A OE1 no hydrogen 2.691 N/A THR 215.A N HIS 211.A O no hydrogen 2.878 N/A THR 215.A OG1 HIS 211.A O no hydrogen 2.916 N/A HIS 216.A N MET 212.A O no hydrogen 3.099 N/A HIS 216.A ND1 MET 212.A O no hydrogen 2.895 N/A LEU 217.A N ASP 213.A O no hydrogen 2.877 N/A GLN 218.A N GLN 214.A O no hydrogen 2.977 N/A LEU 219.A N THR 215.A O no hydrogen 2.946 N/A SER 220.A N HIS 216.A O no hydrogen 3.145 N/A SER 220.A N LEU 217.A O no hydrogen 3.052 N/A SER 220.A OG LEU 217.A O no hydrogen 2.642 N/A ARG 221.A N GLN 218.A O no hydrogen 2.859 N/A ARG 221.A NH1 THR 46.A O no hydrogen 2.794 N/A ARG 221.A NH1 PRO 255.A O no hydrogen 2.925 N/A ARG 224.A N THR 45.A OG1 no hydrogen 2.912 N/A ARG 224.A NH1 ASP 252.A O no hydrogen 2.953 N/A LYS 228.A N GLU 249.A O no hydrogen 2.777 N/A ILE 230.A N GLU 247.A O no hydrogen 2.742 N/A LYS 232.A N ASP 245.A O no hydrogen 2.969 N/A ARG 233.A NE ASP 245.A OD1 no hydrogen 2.941 N/A ARG 233.A NH2 ASP 240.A O no hydrogen 3.064 N/A ARG 233.A NH2 ASP 245.A OD2 no hydrogen 2.719 N/A SER 237.A OG ASP 240.A OD2 no hydrogen 2.900 N/A PHE 239.A N SER 237.A OG no hydrogen 3.154 N/A ASP 240.A N SER 237.A O no hydrogen 3.196 N/A ARG 242.A N ASP 245.A OD2 no hydrogen 2.725 N/A ASP 245.A N ARG 242.A O no hydrogen 2.998 N/A PHE 246.A N PHE 243.A O no hydrogen 3.369 N/A GLU 247.A N ILE 230.A O no hydrogen 2.878 N/A GLU 249.A N LYS 228.A O no hydrogen 2.725 N/A TYR 251.A OH VAL 44.A O no hydrogen 2.605 N/A HIS 254.A N THR 45.A O no hydrogen 2.788 N/A HIS 254.A NE2 GLU 222.A O no hydrogen 2.705 N/A