Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4tts_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N HIS 24.A ND1 no hydrogen 2.872 N/A LYS 2.A N GLU 79.A OE1 no hydrogen 2.842 N/A ILE 3.A N MET 25.A O no hydrogen 2.886 N/A ALA 4.A N LEU 80.A O no hydrogen 3.004 N/A VAL 5.A N GLY 28.A O no hydrogen 3.000 N/A ILE 6.A N VAL 82.A O no hydrogen 2.814 N/A GLY 7.A N PHE 30.A O no hydrogen 3.057 N/A SER 9.A N ASP 40.A OD1 no hydrogen 2.851 N/A SER 9.A OG GLN 8.A O no hydrogen 2.422 N/A GLY 12.A N GLN 8.A O no hydrogen 3.011 N/A GLN 13.A N SER 9.A O no hydrogen 3.069 N/A GLU 14.A N LEU 10.A O no hydrogen 2.886 N/A VAL 15.A N PHE 11.A O no hydrogen 3.041 N/A TYR 16.A N GLY 12.A O no hydrogen 3.031 N/A TYR 16.A OH ASP 49.A OD2 no hydrogen 2.596 N/A LYS 17.A N GLN 13.A O no hydrogen 2.873 N/A LYS 17.A NZ GLU 14.A OE2 no hydrogen 2.992 N/A GLU 18.A N GLU 14.A O no hydrogen 3.005 N/A LEU 19.A N VAL 15.A O no hydrogen 3.016 N/A LYS 20.A N TYR 16.A O no hydrogen 3.005 N/A ASN 21.A N LYS 17.A O no hydrogen 3.022 N/A GLU 22.A N GLU 18.A O no hydrogen 2.983 N/A GLU 22.A N LEU 19.A O no hydrogen 3.122 N/A GLY 23.A N LYS 20.A O no hydrogen 3.065 N/A HIS 24.A N LEU 19.A O no hydrogen 3.167 N/A MET 25.A N MET 1.A O no hydrogen 2.932 N/A VAL 27.A N ILE 3.A O no hydrogen 2.902 N/A VAL 29.A N PRO 52.A O no hydrogen 2.878 N/A PHE 30.A N VAL 5.A O no hydrogen 2.856 N/A THR 31.A N PHE 54.A O no hydrogen 2.916 N/A THR 31.A OG1 GLY 7.A O no hydrogen 2.828 N/A LYS 35.A N LYS 38.A O no hydrogen 3.220 N/A LEU 42.A N ASP 40.A OD2 no hydrogen 2.747 N/A ALA 43.A N ASP 40.A O no hydrogen 3.017 N/A ILE 44.A N ASP 40.A O no hydrogen 3.238 N/A GLU 45.A N PRO 41.A O no hydrogen 3.254 N/A ALA 46.A N LEU 42.A O no hydrogen 3.156 N/A GLU 47.A N ALA 43.A O no hydrogen 3.009 N/A LYS 48.A N ILE 44.A O no hydrogen 3.157 N/A ASP 49.A N ALA 46.A O no hydrogen 2.893 N/A GLY 50.A N GLU 47.A O no hydrogen 3.008 N/A VAL 51.A N ALA 46.A O no hydrogen 2.989 N/A PHE 54.A N VAL 29.A O no hydrogen 2.782 N/A LEU 61.A N LYS 64.A O no hydrogen 2.803 N/A LYS 64.A N LEU 61.A O no hydrogen 2.898 N/A ASP 71.A N THR 67.A O no hydrogen 2.788 N/A TYR 73.A N VAL 69.A O no hydrogen 3.390 N/A TYR 73.A OH ASN 81.A OD1 no hydrogen 2.499 N/A TYR 73.A OH VAL 94.A O no hydrogen 3.335 N/A LYS 74.A N VAL 70.A O no hydrogen 2.811 N/A ALA 75.A N ASP 71.A O no hydrogen 3.157 N/A VAL 76.A N TYR 73.A O no hydrogen 3.309 N/A GLY 77.A N LYS 74.A O no hydrogen 3.307 N/A GLU 79.A N LYS 2.A O no hydrogen 2.704 N/A LEU 80.A N LYS 2.A O no hydrogen 3.090 N/A ASN 81.A N GLY 101.A O no hydrogen 3.054 N/A ASN 81.A ND2 VAL 94.A O no hydrogen 2.956 N/A ASN 81.A ND2 SER 102.A OG no hydrogen 2.984 N/A VAL 82.A N ALA 4.A O no hydrogen 2.910 N/A LEU 83.A N ILE 103.A O no hydrogen 2.868 N/A CYS 86.A SG GLN 88.A O no hydrogen 3.157 N/A GLN 88.A NE2 PRO 57.A O no hydrogen 3.408 N/A VAL 94.A N PRO 91.A O no hydrogen 2.962 N/A ILE 95.A N PRO 91.A O no hydrogen 3.043 N/A ASP 96.A N MET 92.A O no hydrogen 2.818 N/A HIS 97.A N VAL 94.A O no hydrogen 3.357 N/A HIS 100.A N GLU 79.A O no hydrogen 2.996 N/A GLY 101.A N PRO 98.A O no hydrogen 2.945 N/A SER 102.A OG ILE 95.A O no hydrogen 2.814 N/A ILE 103.A N ASN 81.A O no hydrogen 2.924 N/A ILE 104.A N PHE 135.A O no hydrogen 2.813 N/A TYR 105.A N LEU 83.A O no hydrogen 3.157 N/A HIS 106.A N THR 133.A O no hydrogen 2.929 N/A HIS 106.A NE2 HIS 113.A O no hydrogen 2.834 N/A SER 108.A N HIS 106.A O no hydrogen 2.815 N/A SER 108.A OG HIS 106.A NE2 no hydrogen 2.742 N/A SER 108.A OG ARG 112.A O no hydrogen 2.729 N/A SER 108.A OG HIS 113.A O no hydrogen 3.266 N/A LEU 110.A N THR 133.A OG1 no hydrogen 3.207 N/A ARG 112.A N LEU 109.A O no hydrogen 3.051 N/A ARG 112.A NE ASP 127.A OD2 no hydrogen 3.020 N/A ARG 112.A NH2 ASP 127.A OD1 no hydrogen 2.803 N/A ARG 112.A NH2 ASP 127.A OD2 no hydrogen 3.546 N/A HIS 113.A N THR 199.A OG1 no hydrogen 2.773 N/A HIS 113.A ND1 GLU 201.A OE1 no hydrogen 2.789 N/A HIS 113.A NE2 ASP 127.A OD2 no hydrogen 2.606 N/A ARG 114.A N THR 199.A O no hydrogen 2.831 N/A ARG 114.A NE ASP 142.A O no hydrogen 3.120 N/A ARG 114.A NE GLN 193.A OE1 no hydrogen 3.372 N/A ARG 114.A NH1 GLN 193.A OE1 no hydrogen 2.762 N/A GLY 115.A N ASP 142.A OD2 no hydrogen 2.852 N/A ASN 120.A ND2 ASN 227.A OD1 no hydrogen 3.378 N/A ASN 120.A ND2 VAL 230.A O no hydrogen 3.145 N/A TRP 121.A N SER 117.A O no hydrogen 3.070 N/A TRP 121.A NE1 CYS 202.A O no hydrogen 2.925 N/A THR 122.A N ALA 118.A O no hydrogen 2.945 N/A THR 122.A OG1 ALA 118.A O no hydrogen 2.685 N/A LEU 123.A N ILE 119.A O no hydrogen 3.379 N/A ILE 124.A N ASN 120.A O no hydrogen 2.882 N/A HIS 125.A N TRP 121.A O no hydrogen 2.994 N/A GLY 126.A N LEU 123.A O no hydrogen 2.890 N/A ASP 127.A N THR 122.A O no hydrogen 3.068 N/A LYS 129.A NZ ASP 153.A OD1 no hydrogen 2.888 N/A GLY 130.A N CYS 152.A O no hydrogen 2.914 N/A PHE 132.A N ARG 150.A O no hydrogen 3.062 N/A THR 133.A N HIS 106.A O no hydrogen 2.788 N/A THR 133.A OG1 SER 108.A O no hydrogen 2.695 N/A VAL 134.A N LEU 148.A O no hydrogen 2.799 N/A PHE 135.A N ILE 104.A O no hydrogen 3.046 N/A TRP 136.A N PRO 145.A O no hydrogen 2.877 N/A TRP 136.A NE1 PRO 189.A O no hydrogen 2.735 N/A ALA 137.A N SER 102.A O no hydrogen 2.956 N/A GLY 140.A N ASP 138.A OD2 no hydrogen 3.060 N/A THR 143.A OG1 ASP 138.A OD2 no hydrogen 2.755 N/A ILE 146.A N ILE 191.A O no hydrogen 2.586 N/A LEU 147.A N VAL 134.A O no hydrogen 2.841 N/A LEU 148.A N VAL 134.A O no hydrogen 3.218 N/A GLN 149.A NE2 LEU 110.A O no hydrogen 3.058 N/A GLN 149.A NE2 THR 133.A OG1 no hydrogen 2.777 N/A ARG 150.A N PHE 132.A O no hydrogen 2.981 N/A ARG 150.A NH1 GLN 149.A O no hydrogen 2.943 N/A CYS 152.A N GLY 130.A O no hydrogen 2.799 N/A CYS 152.A SG ASP 153.A O no hydrogen 3.850 N/A VAL 154.A N LYS 128.A O no hydrogen 2.859 N/A GLU 155.A N ASP 158.A OD2 no hydrogen 2.798 N/A ASP 158.A N GLU 155.A O no hydrogen 2.973 N/A ASN 159.A N SER 162.A OG no hydrogen 3.021 N/A ASN 159.A ND2 ASP 228.A OD2 no hydrogen 2.931 N/A VAL 160.A N ARG 225.A O no hydrogen 3.309 N/A VAL 160.A N ASP 228.A O no hydrogen 2.805 N/A SER 162.A N ASN 159.A O no hydrogen 3.251 N/A SER 162.A N ASN 159.A OD1 no hydrogen 2.897 N/A SER 162.A OG ASP 158.A OD1 no hydrogen 2.647 N/A SER 162.A OG ASN 159.A O no hydrogen 3.430 N/A SER 162.A OG ASN 159.A OD1 no hydrogen 3.157 N/A ILE 163.A N ASN 159.A O no hydrogen 3.312 N/A TYR 164.A N VAL 160.A O no hydrogen 3.146 N/A LYS 165.A N ASN 161.A O no hydrogen 2.979 N/A ARG 166.A N SER 162.A O no hydrogen 2.871 N/A ARG 166.A NH1 ASP 158.A OD1 no hydrogen 2.879 N/A ARG 166.A NH2 ASP 153.A O no hydrogen 3.379 N/A ARG 166.A NH2 ASP 158.A OD1 no hydrogen 3.523 N/A ARG 166.A NH2 ASP 158.A OD2 no hydrogen 2.666 N/A PHE 167.A N ILE 163.A O no hydrogen 2.946 N/A LEU 168.A N ILE 163.A O no hydrogen 3.120 N/A PHE 169.A N TYR 164.A O no hydrogen 2.737 N/A GLU 171.A N PHE 167.A O no hydrogen 2.971 N/A VAL 173.A N PHE 169.A O no hydrogen 3.010 N/A LYS 174.A N PRO 170.A O no hydrogen 3.372 N/A LYS 174.A NZ GLU 171.A OE1 no hydrogen 2.884 N/A GLY 175.A N GLU 171.A O no hydrogen 2.858 N/A MET 176.A N GLY 172.A O no hydrogen 2.973 N/A VAL 177.A N VAL 173.A O no hydrogen 3.014 N/A GLU 178.A N LYS 174.A O no hydrogen 2.886 N/A ALA 179.A N GLY 175.A O no hydrogen 2.882 N/A VAL 180.A N MET 176.A O no hydrogen 3.204 N/A ARG 181.A N VAL 177.A O no hydrogen 3.047 N/A ARG 181.A NE GLU 178.A OE1 no hydrogen 2.918 N/A ARG 181.A NE GLU 178.A OE2 no hydrogen 3.303 N/A ARG 181.A NH2 GLU 178.A OE2 no hydrogen 2.830 N/A LEU 182.A N GLU 178.A O no hydrogen 2.870 N/A ILE 183.A N ALA 179.A O no hydrogen 2.995 N/A ALA 184.A N VAL 180.A O no hydrogen 2.706 N/A THR 185.A N ARG 181.A O no hydrogen 2.981 N/A THR 185.A OG1 ARG 181.A O no hydrogen 2.856 N/A THR 185.A OG1 LEU 182.A O no hydrogen 3.391 N/A GLY 186.A N ILE 183.A O no hydrogen 2.962 N/A LYS 187.A N LEU 182.A O no hydrogen 2.783 N/A ILE 191.A N ILE 146.A O no hydrogen 2.867 N/A GLN 193.A NE2 ASP 142.A O no hydrogen 2.953 N/A GLN 193.A NE2 GLY 144.A O no hydrogen 2.794 N/A ALA 198.A N GLU 195.A O no hydrogen 3.357 N/A THR 199.A N PRO 111.A O no hydrogen 3.083 N/A THR 199.A OG1 GLU 201.A OE2 no hydrogen 2.857 N/A GLU 201.A N ARG 114.A O no hydrogen 3.174 N/A CYS 202.A SG ILE 203.A O no hydrogen 3.965 N/A CYS 202.A SG GLN 204.A OE1 no hydrogen 3.752 N/A GLN 204.A N SER 117.A OG no hydrogen 2.732 N/A GLN 204.A NE2 ASN 208.A O no hydrogen 3.400 N/A GLN 204.A NE2 ASN 227.A OD1 no hydrogen 3.104 N/A LYS 205.A N ASN 208.A OD1 no hydrogen 2.690 N/A LYS 206.A NZ PRO 231.A O no hydrogen 2.971 N/A LYS 206.A NZ GLY 232.A O no hydrogen 2.871 N/A LYS 206.A NZ SER 243.A OG no hydrogen 2.857 N/A ASN 208.A ND2 ILE 203.A O no hydrogen 2.995 N/A SER 209.A N LYS 206.A O no hydrogen 3.133 N/A SER 209.A OG LYS 206.A O no hydrogen 2.931 N/A SER 209.A OG GLY 232.A O no hydrogen 2.993 N/A ILE 211.A N TRP 234.A O no hydrogen 2.819 N/A ASN 214.A N ASP 212.A OD1 no hydrogen 3.016 N/A GLN 215.A NE2 ASP 212.A O no hydrogen 2.858 N/A ALA 217.A N ASP 284.A OD1 no hydrogen 3.123 N/A ILE 220.A N PRO 216.A O no hydrogen 3.170 N/A HIS 221.A N ALA 217.A O no hydrogen 2.863 N/A HIS 221.A ND1 SER 247.A OG no hydrogen 2.714 N/A HIS 221.A NE2 PRO 156.A O no hydrogen 2.958 N/A ASN 222.A N GLU 218.A O no hydrogen 2.916 N/A TRP 223.A N ALA 219.A O no hydrogen 2.907 N/A TRP 223.A NE1 SER 209.A O no hydrogen 3.129 N/A ILE 224.A N ILE 220.A O no hydrogen 2.850 N/A ARG 225.A N HIS 221.A O no hydrogen 2.949 N/A ARG 225.A NE ASN 222.A OD1 no hydrogen 2.984 N/A ARG 225.A NH1 GLU 155.A O no hydrogen 3.013 N/A ARG 225.A NH1 ASP 158.A O no hydrogen 2.958 N/A ARG 225.A NH2 ASN 222.A OD1 no hydrogen 3.156 N/A GLY 226.A N ASN 222.A O no hydrogen 2.823 N/A ASN 227.A N ILE 224.A O no hydrogen 3.099 N/A ASN 227.A ND2 TRP 223.A O no hydrogen 2.921 N/A ASP 228.A N ARG 225.A O no hydrogen 3.362 N/A ARG 229.A N ASN 161.A OD1 no hydrogen 2.908 N/A ARG 229.A NH2 ASP 228.A OD2 no hydrogen 2.956 N/A GLY 232.A N ASN 227.A O no hydrogen 2.701 N/A TRP 234.A NE1 LYS 206.A O no hydrogen 2.706 N/A ALA 235.A N VAL 242.A O no hydrogen 2.896 N/A ILE 237.A N LYS 240.A O no hydrogen 2.753 N/A LYS 240.A N ILE 237.A O no hydrogen 3.048 N/A VAL 242.A N ALA 235.A O no hydrogen 2.804 N/A SER 243.A N GLN 294.A O no hydrogen 2.781 N/A PHE 244.A N ALA 233.A O no hydrogen 2.886 N/A TYR 245.A N ASN 292.A O no hydrogen 2.961 N/A TYR 245.A OH GLN 294.A OE1 no hydrogen 3.046 N/A GLY 246.A N ASP 228.A OD1 no hydrogen 2.909 N/A SER 247.A OG HIS 221.A ND1 no hydrogen 2.714 N/A THR 248.A N LEU 289.A O no hydrogen 2.967 N/A LEU 250.A N MET 287.A O no hydrogen 3.145 N/A ASN 252.A ND2 GLU 251.A O no hydrogen 3.085 N/A ASN 252.A ND2 ASP 253.A O no hydrogen 2.424 N/A ASN 258.A ND2 ASN 258.A O no hydrogen 2.490 N/A GLN 260.A N VAL 273.A O no hydrogen 3.066 N/A LEU 262.A N ALA 271.A O no hydrogen 2.817 N/A ALA 267.A N ILE 264.A O no hydrogen 2.950 N/A ARG 269.A NE ALA 270.A O no hydrogen 2.888 N/A ARG 269.A NH1 ALA 270.A O no hydrogen 2.971 N/A ALA 271.A N LEU 262.A O no hydrogen 2.799 N/A LEU 272.A N VAL 279.A O no hydrogen 2.926 N/A VAL 273.A N GLN 260.A O no hydrogen 2.847 N/A THR 274.A N GLY 277.A O no hydrogen 2.871 N/A THR 274.A OG1 GLY 277.A O no hydrogen 2.714 N/A GLY 277.A N THR 274.A O no hydrogen 2.963 N/A LEU 278.A N VAL 290.A O no hydrogen 2.837 N/A VAL 279.A N LEU 272.A O no hydrogen 2.771 N/A LEU 280.A N LEU 288.A O no hydrogen 2.922 N/A GLY 282.A N LYS 286.A O no hydrogen 2.862 N/A ASN 283.A N GLN 215.A O no hydrogen 2.813 N/A ASN 283.A ND2 ASN 214.A OD1 no hydrogen 2.892 N/A GLY 285.A N GLY 282.A O no hydrogen 3.423 N/A LYS 286.A N ASP 284.A OD1 no hydrogen 3.221 N/A LEU 288.A N LEU 280.A O no hydrogen 2.931 N/A LEU 289.A N THR 248.A O no hydrogen 2.767 N/A VAL 290.A N LEU 278.A O no hydrogen 2.812 N/A LYS 291.A N GLY 246.A O no hydrogen 2.994 N/A LYS 291.A NZ GLY 246.A O no hydrogen 3.256 N/A ASN 292.A N TYR 245.A O no hydrogen 3.043 N/A LEU 293.A N ILE 301.A O no hydrogen 2.670 N/A GLN 294.A N SER 243.A O no hydrogen 3.020 N/A ILE 301.A N LEU 293.A O no hydrogen 2.721 N/A GLY 303.A N LYS 291.A O no hydrogen 2.679 N/A GLN 305.A N PRO 302.A O no hydrogen 2.888 N/A GLN 305.A NE2 SER 304.A OG no hydrogen 3.064 N/A TYR 306.A N GLY 303.A O no hydrogen 3.226 N/A LYS 308.A N GLN 305.A O no hydrogen 2.910 N/A LYS 308.A NZ GLN 305.A OE1 no hydrogen 3.239 N/A