Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4htl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N THR 52.A OG1 no hydrogen 3.069 N/A LYS 1.A NZ ASP 50.A OD2 no hydrogen 2.959 N/A ILE 2.A N VAL 16.A O no hydrogen 2.795 N/A ALA 3.A N GLY 53.A O no hydrogen 2.816 N/A ALA 4.A N GLY 14.A O no hydrogen 2.813 N/A PHE 5.A N ALA 55.A O no hydrogen 2.831 N/A ASP 6.A N LYS 13.A O no hydrogen 2.843 N/A ILE 7.A N SER 57.A O no hydrogen 2.920 N/A GLY 8.A N ALA 11.A O no hydrogen 2.938 N/A LEU 12.A N ALA 28.A O no hydrogen 2.816 N/A LYS 13.A N ASP 6.A O no hydrogen 2.959 N/A LYS 13.A NZ ASN 268.A O no hydrogen 2.883 N/A VAL 15.A N LEU 24.A O no hydrogen 2.915 N/A VAL 16.A N ILE 2.A O no hydrogen 2.823 N/A LEU 17.A N GLU 21.A O no hydrogen 2.864 N/A HIS 19.A NE2.A GLU 21.A OE1 no hydrogen 3.094 N/A GLY 20.A N LEU 17.A O no hydrogen 2.934 N/A ILE 23.A N VAL 15.A O no hydrogen 2.835 N/A LYS 26.A NZ GLU 47.A OE1 no hydrogen 2.979 N/A LYS 26.A NZ GLU 47.A OE2 no hydrogen 3.397 N/A ALA 28.A N LEU 12.A O no hydrogen 3.026 N/A ILE 30.A N THR 10.A O no hydrogen 2.998 N/A SER 31.A N GLN 37.A OE1.B no hydrogen 3.348 N/A GLN 37.A N ASP 34.A OD1 no hydrogen 3.004 N/A GLN 37.A NE2.A GLU 41.A OE2 no hydrogen 3.277 N/A GLN 37.A NE2.B GLU 29.A O no hydrogen 3.100 N/A GLN 37.A NE2.B GLU 41.A OE2 no hydrogen 2.992 N/A ILE 38.A N ASP 34.A O no hydrogen 3.123 N/A LEU 39.A N GLY 35.A O no hydrogen 2.888 N/A ALA 40.A N ASP 36.A O no hydrogen 2.959 N/A GLU 41.A N GLN 37.A O no hydrogen 2.897 N/A LYS 42.A NZ GLU 89.A OE1 no hydrogen 2.482 N/A VAL 43.A N ALA 40.A O no hydrogen 2.981 N/A PHE 44.A N GLU 41.A O no hydrogen 2.953 N/A ALA 46.A N LYS 42.A O no hydrogen 3.107 N/A GLU 47.A N VAL 43.A O no hydrogen 3.157 N/A ASN 48.A N LEU 45.A O no hydrogen 3.019 N/A ASN 48.A ND2 PHE 44.A O no hydrogen 2.851 N/A VAL 51.A N ASN 48.A O no hydrogen 3.335 N/A THR 52.A N LYS 1.A O no hydrogen 2.725 N/A THR 52.A OG1 LYS 1.A O no hydrogen 3.128 N/A ILE 54.A N PRO 93.A O no hydrogen 2.942 N/A ALA 55.A N ALA 3.A O no hydrogen 2.804 N/A VAL 56.A N ALA 95.A O no hydrogen 2.879 N/A SER 57.A N PHE 5.A O no hydrogen 2.739 N/A SER 57.A OG ASP 6.A OD1 no hydrogen 2.924 N/A ALA 58.A N GLU 97.A O no hydrogen 3.019 N/A TYR 61.A OH GLU 148.A OE2 no hydrogen 2.631 N/A ASN 63.A N LEU 68.A O no hydrogen 2.949 N/A LYS 65.A N ASN 63.A OD1 no hydrogen 2.948 N/A THR 66.A N ASN 63.A OD1 no hydrogen 3.152 N/A GLY 67.A N ASN 63.A O no hydrogen 2.819 N/A LEU 68.A N THR 66.A OG1 no hydrogen 3.290 N/A ILE 69.A N PHE 80.A O no hydrogen 2.961 N/A THR 70.A N TYR 61.A O no hydrogen 2.910 N/A THR 70.A OG1 TYR 61.A O no hydrogen 3.446 N/A ILE 74.A N GLY 71.A O no hydrogen 3.069 N/A ARG 75.A NE ASP 78.A OD2 no hydrogen 2.710 N/A ARG 75.A NH1 GLY 72.A O no hydrogen 2.935 N/A ARG 75.A NH2 GLY 72.A O no hydrogen 2.793 N/A ARG 75.A NH2 ASP 78.A OD1 no hydrogen 2.818 N/A ARG 75.A NH2 ASP 78.A OD2 no hydrogen 3.417 N/A ARG 76.A NE ASP 36.A OD1 no hydrogen 2.995 N/A ARG 76.A NH1 ARG 76.A O no hydrogen 2.985 N/A PHE 77.A N ILE 74.A O no hydrogen 2.981 N/A ASP 78.A N ARG 75.A O no hydrogen 3.054 N/A ASN 79.A N THR 70.A O no hydrogen 3.414 N/A PHE 80.A N ILE 69.A O no hydrogen 3.009 N/A ASN 81.A ND2 THR 66.A O no hydrogen 2.925 N/A LYS 83.A NZ LYS 65.A O no hydrogen 2.837 N/A GLU 84.A N ASN 81.A OD1 no hydrogen 2.772 N/A TRP 85.A N ASN 81.A O no hydrogen 3.048 N/A LEU 86.A N LEU 82.A O no hydrogen 3.015 N/A GLU 87.A N LYS 83.A O no hydrogen 2.922 N/A ALA 88.A N GLU 84.A O no hydrogen 2.980 N/A GLU 89.A N TRP 85.A O no hydrogen 2.899 N/A THR 90.A N LEU 86.A O no hydrogen 3.042 N/A THR 90.A OG1 LEU 86.A O no hydrogen 2.524 N/A GLY 91.A N GLU 87.A O no hydrogen 2.750 N/A LEU 92.A N THR 90.A OG1 no hydrogen 3.245 N/A ALA 95.A N ILE 54.A O no hydrogen 2.914 N/A GLU 97.A N VAL 56.A O no hydrogen 3.030 N/A ASN 98.A N GLU 97.A OE2 no hydrogen 2.805 N/A ASN 98.A ND2.A GLY 60.A O no hydrogen 2.586 N/A ASP 99.A N ALA 58.A O no hydrogen 2.838 N/A ALA 100.A N ASP 99.A OD1 no hydrogen 2.890 N/A ASN 101.A N ASN 98.A OD1.A no hydrogen 3.008 N/A ASN 101.A N ASN 98.A OD1.B no hydrogen 2.935 N/A ASN 101.A ND2 GLU 97.A OE2 no hydrogen 2.991 N/A CYS 102.A N ASN 98.A O no hydrogen 2.842 N/A CYS 102.A SG ASN 98.A O no hydrogen 3.405 N/A ALA 103.A N ASP 99.A O no hydrogen 3.078 N/A LEU 104.A N ALA 100.A O no hydrogen 2.967 N/A LEU 105.A N ASN 101.A O no hydrogen 2.915 N/A ALA 106.A N CYS 102.A O no hydrogen 2.918 N/A GLU 107.A N ALA 103.A O no hydrogen 3.229 N/A LYS 108.A N LEU 104.A O no hydrogen 2.961 N/A LYS 108.A NZ GLY 113.A O no hydrogen 3.317 N/A LYS 108.A NZ GLN 114.A O no hydrogen 2.905 N/A LYS 108.A NZ LEU 116.A O no hydrogen 2.984 N/A TRP 109.A N LEU 105.A O no hydrogen 2.831 N/A LEU 110.A N ALA 106.A O no hydrogen 2.874 N/A GLY 111.A N GLU 107.A O no hydrogen 3.034 N/A LYS 112.A N GLU 107.A OE1 no hydrogen 2.821 N/A LYS 112.A NZ GLU 262.A OE1 no hydrogen 2.792 N/A LYS 112.A NZ THR 263.A O no hydrogen 2.814 N/A GLY 113.A N GLU 107.A O no hydrogen 2.962 N/A GLN 114.A NE2 TRP 109.A O no hydrogen 2.939 N/A LEU 116.A N GLY 113.A O no hydrogen 3.200 N/A PHE 119.A N PHE 133.A O no hydrogen 2.955 N/A LEU 120.A N HIS 231.A O no hydrogen 3.096 N/A CYS 121.A N GLY 131.A O no hydrogen 2.981 N/A LEU 122.A N PHE 233.A O no hydrogen 2.869 N/A THR 123.A N GLY 129.A O no hydrogen 2.887 N/A ILE 124.A N GLY 235.A O no hydrogen 2.896 N/A GLY 125.A N GLY 127.A O no hydrogen 2.920 N/A ILE 128.A N ASN 167.A OD1 no hydrogen 3.182 N/A GLY 129.A N THR 123.A O no hydrogen 2.833 N/A GLY 131.A N CYS 121.A O no hydrogen 2.935 N/A PHE 133.A N PHE 119.A O no hydrogen 2.917 N/A SER 134.A N GLU 137.A O no hydrogen 2.979 N/A ASN 135.A N ASP 118.A OD2 no hydrogen 3.146 N/A GLY 136.A N ASP 117.A O no hydrogen 2.917 N/A GLU 137.A N SER 134.A O no hydrogen 3.109 N/A VAL 139.A N ILE 132.A O no hydrogen 2.898 N/A ARG 140.A NE GLU 97.A OE1 no hydrogen 2.829 N/A PHE 144.A N GLY 141.A O no hydrogen 3.278 N/A ALA 146.A N ARG 140.A O no hydrogen 2.842 N/A PHE 149.A N GLY 147.A O no hydrogen 2.850 N/A TYR 151.A N GLU 148.A O no hydrogen 3.052 N/A SER 153.A N TYR 164.A O no hydrogen 2.886 N/A SER 153.A OG TYR 164.A O no hydrogen 3.327 N/A SER 153.A OG THR 169.A OG1 no hydrogen 2.680 N/A PHE 159.A N TYR 164.A OH no hydrogen 3.222 N/A ARG 160.A NH1 GLU 168.A OE2 no hydrogen 2.750 N/A ARG 160.A NH2 GLU 168.A OE1 no hydrogen 2.785 N/A ARG 160.A NH2 GLU 168.A OE2 no hydrogen 3.484 N/A LYS 163.A N ARG 160.A O no hydrogen 3.103 N/A TYR 164.A N PRO 161.A O no hydrogen 2.936 N/A THR 165.A N GLY 162.A O no hydrogen 3.113 N/A THR 165.A OG1 GLY 150.A O no hydrogen 3.327 N/A THR 165.A OG1 GLY 162.A O no hydrogen 2.688 N/A ASN 167.A N GLY 150.A O no hydrogen 2.841 N/A GLU 168.A N THR 165.A O no hydrogen 2.884 N/A THR 169.A N LEU 166.A O no hydrogen 3.187 N/A THR 169.A OG1 SER 153.A OG no hydrogen 2.680 N/A THR 169.A OG1 THR 165.A O no hydrogen 3.192 N/A THR 169.A OG1 THR 170.A OG1 no hydrogen 2.744 N/A THR 170.A N LEU 166.A O no hydrogen 2.843 N/A THR 170.A OG1 THR 169.A OG1 no hydrogen 2.744 N/A THR 171.A OG1 THR 126.A O no hydrogen 3.399 N/A VAL 173.A N THR 171.A OG1 no hydrogen 2.967 N/A LEU 174.A N THR 171.A O no hydrogen 3.014 N/A ARG 175.A NE ILE 189.A O no hydrogen 2.852 N/A ARG 175.A NH2 ILE 189.A O no hydrogen 3.309 N/A ARG 176.A N LEU 172.A O no hydrogen 2.891 N/A GLN 177.A N VAL 173.A O no hydrogen 2.777 N/A TYR 178.A N LEU 174.A O no hydrogen 2.905 N/A ALA 179.A N ARG 175.A O no hydrogen 2.889 N/A GLU 180.A N ARG 176.A O no hydrogen 3.054 N/A LEU 181.A N GLN 177.A O no hydrogen 2.885 N/A THR 182.A N TYR 178.A O no hydrogen 2.922 N/A THR 182.A OG1 TYR 178.A O no hydrogen 2.744 N/A GLY 183.A N ALA 179.A O no hydrogen 2.700 N/A ARG 184.A N THR 182.A OG1 no hydrogen 3.365 N/A ARG 184.A NH1 GLU 193.A OE2 no hydrogen 2.617 N/A ARG 184.A NH2 GLU 193.A OE1 no hydrogen 3.445 N/A ARG 184.A NH2 GLU 193.A OE2 no hydrogen 3.264 N/A GLU 187.A N GLU 187.A OE2 no hydrogen 2.774 N/A GLU 188.A N PRO 185.A O no hydrogen 3.023 N/A ILE 189.A N LEU 186.A O no hydrogen 3.032 N/A THR 190.A N GLU 193.A OE1 no hydrogen 3.086 N/A GLU 193.A N THR 190.A OG1 no hydrogen 2.964 N/A ILE 194.A N THR 190.A O no hydrogen 3.463 N/A PHE 195.A N GLY 191.A O no hydrogen 3.130 N/A ALA 196.A N GLU 192.A O no hydrogen 2.871 N/A ASN 197.A N GLU 193.A O no hydrogen 2.864 N/A ASN 197.A ND2.B TYR 178.A OH no hydrogen 2.993 N/A TYR 198.A N ILE 194.A O no hydrogen 2.891 N/A ASP 199.A N PHE 195.A O no hydrogen 2.879 N/A ALA 200.A N ALA 196.A O no hydrogen 3.011 N/A HIS 201.A N TYR 198.A O no hydrogen 2.906 N/A ASP 202.A N ASN 197.A O no hydrogen 3.050 N/A SER 205.A N ASP 202.A OD2 no hydrogen 3.025 N/A SER 205.A OG ASP 202.A OD2 no hydrogen 2.777 N/A GLU 206.A N ASP 202.A O no hydrogen 2.793 N/A ARG 207.A N ALA 203.A O no hydrogen 3.017 N/A LEU 208.A N VAL 204.A O no hydrogen 3.123 N/A ILE 209.A N SER 205.A O no hydrogen 2.933 N/A THR 210.A N GLU 206.A O no hydrogen 2.897 N/A THR 210.A OG1 GLU 206.A O no hydrogen 2.728 N/A GLU 211.A N ARG 207.A O no hydrogen 2.936 N/A PHE 212.A N LEU 208.A O no hydrogen 2.958 N/A TYR 213.A N ILE 209.A O no hydrogen 2.895 N/A TYR 213.A OH GLU 247.A OE1 no hydrogen 2.936 N/A THR 214.A N THR 210.A O no hydrogen 2.953 N/A THR 214.A OG1 THR 210.A O no hydrogen 3.113 N/A THR 214.A OG1 HIS 251.A NE2.A no hydrogen 2.843 N/A GLY 215.A N GLU 211.A O no hydrogen 3.027 N/A ILE 216.A N PHE 212.A O no hydrogen 2.972 N/A CYS 217.A N TYR 213.A O no hydrogen 2.833 N/A CYS 217.A SG TYR 213.A O no hydrogen 3.350 N/A THR 218.A N THR 214.A O no hydrogen 2.910 N/A THR 218.A OG1 THR 214.A O no hydrogen 2.812 N/A GLY 219.A N GLY 215.A O no hydrogen 3.116 N/A LEU 220.A N ILE 216.A O no hydrogen 2.780 N/A TYR 221.A N CYS 217.A O no hydrogen 2.929 N/A ASN 222.A N THR 218.A O no hydrogen 3.128 N/A LEU 223.A N GLY 219.A O no hydrogen 2.961 N/A ILE 224.A N LEU 220.A O no hydrogen 2.851 N/A TYR 225.A N TYR 221.A O no hydrogen 3.107 N/A LEU 226.A N ASN 222.A O no hydrogen 2.975 N/A PHE 227.A N LEU 223.A O no hydrogen 2.948 N/A ASP 228.A N ILE 224.A O no hydrogen 2.906 N/A THR 230.A N ASP 118.A O no hydrogen 2.925 N/A THR 230.A OG1 ASP 118.A O no hydrogen 3.218 N/A THR 230.A OG1 HIS 231.A ND1 no hydrogen 2.755 N/A HIS 231.A ND1 THR 230.A OG1 no hydrogen 2.755 N/A ILE 232.A N ILE 260.A O no hydrogen 2.828 N/A PHE 233.A N LEU 120.A O no hydrogen 2.877 N/A ILE 234.A N GLU 262.A O no hydrogen 2.846 N/A GLY 235.A N LEU 122.A O no hydrogen 2.911 N/A ILE 238.A N ILE 124.A O no hydrogen 2.994 N/A THR 239.A N GLY 236.A O no hydrogen 3.013 N/A THR 239.A OG1 GLY 236.A O no hydrogen 3.090 N/A SER 240.A N GLY 237.A O no hydrogen 2.868 N/A SER 240.A OG GLY 237.A O no hydrogen 2.815 N/A ARG 241.A N ILE 238.A O no hydrogen 2.913 N/A ARG 241.A NE GLU 247.A OE1 no hydrogen 2.598 N/A ARG 241.A NH1 ASP 199.A OD2 no hydrogen 2.957 N/A ARG 241.A NH2 ASP 199.A OD1 no hydrogen 2.815 N/A ARG 241.A NH2 GLU 247.A OE1 no hydrogen 3.367 N/A ARG 241.A NH2 GLU 247.A OE2 no hydrogen 3.080 N/A THR 243.A OG1 GLU 247.A OE1 no hydrogen 3.123 N/A PHE 244.A N ARG 241.A O no hydrogen 3.118 N/A GLU 247.A N THR 243.A O no hydrogen 2.985 N/A LEU 248.A N PHE 244.A O no hydrogen 2.871 N/A LYS 249.A N ILE 245.A O no hydrogen 2.854 N/A HIS 250.A N ALA 246.A O no hydrogen 3.015 N/A HIS 251.A N GLU 247.A O no hydrogen 3.079 N/A HIS 251.A NE2.A THR 214.A OG1 no hydrogen 2.843 N/A SER 253.A N HIS 251.A O no hydrogen 3.263 N/A ARG 257.A NE ARG 257.A O no hydrogen 3.279 N/A THR 259.A N LEU 256.A O no hydrogen 2.995 N/A THR 259.A OG1 LEU 256.A O no hydrogen 2.782 N/A ILE 260.A N THR 230.A O no hydrogen 2.931 N/A GLU 262.A N ILE 232.A O no hydrogen 3.302 N/A ALA 264.A N ILE 234.A O no hydrogen 2.946 N/A THR 265.A N GLU 107.A OE2 no hydrogen 2.885 N/A THR 265.A OG1 GLU 107.A OE1 no hydrogen 2.543 N/A THR 265.A OG1 GLU 107.A OE2 no hydrogen 3.392 N/A THR 265.A OG1 HIS 266.A ND1 no hydrogen 2.865 N/A HIS 266.A ND1 THR 265.A OG1 no hydrogen 2.865 N/A LYS 267.A NZ GLY 236.A O no hydrogen 2.929 N/A GLN 269.A N HIS 266.A O no hydrogen 3.228 N/A ALA 270.A N HIS 266.A O no hydrogen 2.760 N/A LEU 273.A N GLN 269.A O no hydrogen 2.904 N/A GLY 274.A N ALA 270.A O no hydrogen 2.798 N/A ALA 275.A N GLY 271.A O no hydrogen 2.989 N/A VAL 276.A N LEU 272.A O no hydrogen 3.074 N/A TYR 277.A N LEU 273.A O no hydrogen 2.911 N/A HIS 278.A N GLY 274.A O no hydrogen 2.932 N/A PHE 279.A N ALA 275.A O no hydrogen 2.941 N/A LEU 280.A N VAL 276.A O no hydrogen 2.807 N/A GLN 281.A N TYR 277.A O no hydrogen 2.984 N/A GLN 281.A NE2.B TYR 277.A O no hydrogen 3.634 N/A GLU 282.A N HIS 278.A O no hydrogen 2.941 N/A GLU 283.A N PHE 279.A O no hydrogen 2.905 N/A