Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1vjr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N HIS 1.A O no hydrogen 3.070 N/A ASP 5.A N HIS 2.A O no hydrogen 3.002 N/A ILE 7.A N LEU 4.A O no hydrogen 3.152 N/A GLU 8.A N ARG 200.A O no hydrogen 2.591 N/A LEU 9.A N ARG 200.A O no hydrogen 3.097 N/A PHE 10.A N ARG 40.A O no hydrogen 2.802 N/A ILE 11.A N ALA 201.A O no hydrogen 2.801 N/A LEU 12.A N VAL 42.A O no hydrogen 2.789 N/A ASP 13.A N VAL 202.A O no hydrogen 2.988 N/A GLY 15.A N TYR 18.A O no hydrogen 2.709 N/A THR 16.A OG1 ASP 204.A OD1 no hydrogen 2.834 N/A LEU 19.A N SER 22.A O no hydrogen 2.728 N/A ASP 20.A N ASP 14.A OD1 no hydrogen 3.319 N/A SER 22.A N LEU 19.A O no hydrogen 3.335 N/A SER 22.A OG ASP 21.A OD2.C no hydrogen 3.303 N/A LEU 24.A N PHE 17.A O no hydrogen 3.035 N/A SER 27.A N LEU 24.A O no hydrogen 3.163 N/A SER 27.A OG PHE 17.A O no hydrogen 2.624 N/A SER 27.A OG LEU 24.A O no hydrogen 3.256 N/A PHE 30.A N GLY 26.A O no hydrogen 2.718 N/A LEU 31.A N SER 27.A O no hydrogen 3.174 N/A GLU 32.A N LEU 28.A O no hydrogen 2.920 N/A THR 33.A N GLU 29.A O no hydrogen 2.889 N/A THR 33.A OG1 GLU 29.A O no hydrogen 3.059 N/A THR 33.A OG1 GLU 29.A OE2.B no hydrogen 3.540 N/A LEU 34.A N PHE 30.A O no hydrogen 3.028 N/A LYS 35.A N LEU 31.A O no hydrogen 3.034 N/A GLU 36.A N GLU 32.A O no hydrogen 3.034 N/A LYS 37.A N THR 33.A O no hydrogen 3.009 N/A LYS 37.A N LEU 34.A O no hydrogen 3.166 N/A LYS 37.A NZ GLN 255.A OXT no hydrogen 2.972 N/A ASN 38.A N LYS 35.A O no hydrogen 3.261 N/A LYS 39.A N LEU 34.A O no hydrogen 2.775 N/A LYS 39.A NZ ASP 5.A O no hydrogen 3.223 N/A ARG 40.A N GLU 8.A O no hydrogen 2.797 N/A ARG 40.A NH2 PHE 194.A O no hydrogen 3.099 N/A VAL 42.A N PHE 10.A O no hydrogen 2.850 N/A PHE 43.A N ALA 69.A O no hydrogen 2.680 N/A PHE 44.A N LEU 12.A O no hydrogen 2.865 N/A THR 45.A N VAL 71.A O no hydrogen 3.058 N/A ASN 46.A ND2 ASP 148.A OD1 no hydrogen 2.823 N/A ASN 46.A ND2 LYS 181.A O no hydrogen 2.913 N/A ASN 47.A N THR 45.A OG1 no hydrogen 2.948 N/A SER 48.A OG THR 145.A OG1 no hydrogen 2.877 N/A SER 49.A N ASN 47.A OD1 no hydrogen 2.938 N/A SER 49.A OG ASN 47.A OD1 no hydrogen 2.542 N/A GLY 51.A N ASP 54.A OD2 no hydrogen 2.861 N/A ALA 52.A N GLU 75.A OE2 no hydrogen 2.899 N/A GLN 53.A NE2 ASP 67.A O no hydrogen 3.089 N/A ASP 54.A N GLY 51.A O no hydrogen 2.880 N/A TYR 55.A N GLY 51.A O no hydrogen 3.381 N/A TYR 55.A OH ASN 47.A O no hydrogen 2.892 N/A VAL 56.A N ALA 52.A O no hydrogen 2.893 N/A ARG 57.A N GLN 53.A O no hydrogen 2.931 N/A ARG 57.A NH1 ASP 54.A OD1 no hydrogen 2.732 N/A LYS 58.A N ASP 54.A O no hydrogen 2.998 N/A LYS 58.A NZ ASP 20.A O no hydrogen 3.058 N/A LYS 58.A NZ ASP 21.A OD1.A no hydrogen 2.690 N/A LYS 58.A NZ ASP 21.A OD2.B no hydrogen 2.510 N/A LEU 59.A N TYR 55.A O no hydrogen 3.018 N/A ARG 60.A N VAL 56.A O no hydrogen 2.894 N/A ARG 60.A NE VAL 65.A O no hydrogen 3.045 N/A ARG 60.A NH2 VAL 65.A O no hydrogen 2.695 N/A ARG 60.A NH2 ASP 67.A OD1 no hydrogen 2.885 N/A ASN 61.A N ARG 57.A O no hydrogen 2.932 N/A VAL 63.A N LEU 59.A O no hydrogen 3.053 N/A ALA 69.A N PRO 66.A O no hydrogen 3.287 N/A VAL 71.A N PHE 43.A O no hydrogen 2.796 N/A THR 72.A N GLU 75.A OE1 no hydrogen 2.874 N/A THR 72.A OG1 GLU 75.A OE1 no hydrogen 2.452 N/A SER 73.A N THR 45.A O no hydrogen 3.013 N/A SER 73.A OG ASN 46.A O no hydrogen 2.690 N/A GLY 74.A N THR 72.A OG1 no hydrogen 3.107 N/A ILE 76.A N THR 72.A O no hydrogen 3.078 N/A THR 77.A N SER 73.A O no hydrogen 2.848 N/A THR 77.A OG1 SER 73.A O no hydrogen 2.735 N/A ALA 78.A N GLY 74.A O no hydrogen 2.812 N/A GLU 79.A N GLU 75.A O no hydrogen 2.919 N/A HIS 80.A N ILE 76.A O no hydrogen 2.884 N/A LYS 82.A N GLU 79.A O no hydrogen 2.888 N/A ARG 83.A N HIS 80.A O no hydrogen 3.005 N/A GLY 85.A N LEU 81.A O no hydrogen 2.976 N/A CYS 87.A N HIS 106.A ND1 no hydrogen 3.058 N/A CYS 87.A SG GLY 85.A O no hydrogen 3.293 N/A ARG 88.A NE ASP 109.A OD2 no hydrogen 2.808 N/A ARG 88.A NH2 ASP 109.A OD2 no hydrogen 2.879 N/A ILE 89.A N VAL 107.A O no hydrogen 2.927 N/A PHE 90.A N PHE 115.A O no hydrogen 2.786 N/A LEU 92.A N VAL 117.A O no hydrogen 2.800 N/A THR 94.A OG1 SER 49.A O no hydrogen 2.690 N/A THR 94.A OG1 GLN 96.A OE1 no hydrogen 3.220 N/A GLN 96.A N GLN 96.A OE1 no hydrogen 2.773 N/A LEU 97.A N THR 94.A OG1 no hydrogen 3.207 N/A LYS 98.A N THR 94.A O no hydrogen 2.885 N/A LYS 99.A N PRO 95.A O no hydrogen 3.036 N/A VAL 100.A N GLN 96.A O no hydrogen 3.156 N/A PHE 101.A N LEU 97.A O no hydrogen 3.046 N/A GLU 102.A N LYS 98.A O no hydrogen 2.956 N/A ALA 103.A N LYS 99.A O no hydrogen 2.848 N/A ALA 103.A N VAL 100.A O no hydrogen 3.143 N/A TYR 104.A N PHE 101.A O no hydrogen 3.141 N/A GLY 105.A N GLU 102.A O no hydrogen 3.017 N/A HIS 106.A N PHE 101.A O no hydrogen 3.186 N/A HIS 106.A NE2 ALA 78.A O no hydrogen 2.839 N/A VAL 107.A N CYS 87.A O no hydrogen 2.829 N/A ASP 109.A N ILE 89.A O no hydrogen 2.939 N/A GLU 111.A N ASP 109.A OD1 no hydrogen 3.095 N/A ASN 112.A N ASP 109.A OD1 no hydrogen 2.966 N/A ASP 114.A N ARG 88.A O no hydrogen 2.748 N/A PHE 115.A N ARG 88.A O no hydrogen 3.293 N/A VAL 116.A N PHE 141.A O no hydrogen 2.796 N/A VAL 117.A N PHE 90.A O no hydrogen 2.788 N/A LEU 118.A N ILE 143.A O no hydrogen 2.756 N/A GLY 119.A N LEU 92.A O no hydrogen 2.811 N/A PHE 120.A N SER 48.A OG no hydrogen 2.992 N/A LYS 122.A N PHE 120.A O no hydrogen 3.019 N/A THR 123.A N ASP 121.A OD1 no hydrogen 2.933 N/A THR 123.A OG1 ASP 121.A OD1 no hydrogen 2.719 N/A LEU 124.A N ASP 121.A O no hydrogen 2.977 N/A ARG 128.A N THR 125.A OG1 no hydrogen 3.164 N/A ARG 128.A NH1 GLY 93.A O no hydrogen 2.933 N/A ARG 128.A NH1 ASP 121.A OD2 no hydrogen 2.632 N/A LEU 129.A N THR 125.A O no hydrogen 2.975 N/A LYS 130.A N TYR 126.A O no hydrogen 2.805 N/A LYS 131.A N GLU 127.A O no hydrogen 2.963 N/A LYS 131.A NZ GLU 127.A OE2 no hydrogen 3.046 N/A ALA 132.A N ARG 128.A O no hydrogen 3.082 N/A CYS 133.A N LEU 129.A O no hydrogen 2.973 N/A CYS 133.A SG LEU 129.A O no hydrogen 3.355 N/A ILE 134.A N LYS 130.A O no hydrogen 2.918 N/A LEU 135.A N LYS 131.A O no hydrogen 3.018 N/A LEU 136.A N ALA 132.A O no hydrogen 2.857 N/A ARG 137.A N CYS 133.A O no hydrogen 2.979 N/A ARG 137.A NH2 SER 170.A O no hydrogen 2.752 N/A LYS 138.A N LEU 135.A O no hydrogen 2.943 N/A GLY 139.A N LEU 136.A O no hydrogen 2.893 N/A LYS 140.A N LEU 135.A O no hydrogen 3.432 N/A LYS 140.A NZ PRO 113.A O no hydrogen 3.134 N/A PHE 141.A N ASP 114.A O no hydrogen 3.315 N/A TYR 142.A N ASP 176.A OD2 no hydrogen 2.940 N/A ILE 143.A N VAL 116.A O no hydrogen 2.858 N/A ALA 144.A N LEU 177.A O no hydrogen 2.873 N/A THR 145.A N LEU 118.A O no hydrogen 2.864 N/A THR 145.A OG1 SER 48.A OG no hydrogen 2.877 N/A THR 145.A OG1 HIS 146.A ND1 no hydrogen 2.661 N/A HIS 146.A ND1 THR 145.A OG1 no hydrogen 2.661 N/A HIS 146.A NE2 ASP 160.A OD1 no hydrogen 2.711 N/A CYS 151.A N VAL 158.A O no hydrogen 2.799 N/A CYS 151.A SG PRO 152.A O no hydrogen 3.538 N/A SER 153.A OG GLY 156.A O no hydrogen 2.604 N/A GLU 155.A N SER 153.A OG no hydrogen 2.969 N/A GLY 156.A N SER 153.A O no hydrogen 2.947 N/A VAL 158.A N CYS 151.A O no hydrogen 2.963 N/A ASP 160.A N ILE 149.A O no hydrogen 2.781 N/A ALA 161.A N ASP 160.A OD1 no hydrogen 2.620 N/A GLY 162.A N ASP 148.A O no hydrogen 2.712 N/A SER 163.A N ASP 160.A O no hydrogen 3.001 N/A SER 163.A OG ILE 149.A O no hydrogen 2.704 N/A ILE 164.A N ASP 160.A O no hydrogen 3.428 N/A ALA 166.A N SER 163.A O no hydrogen 3.357 N/A ILE 167.A N ILE 164.A O no hydrogen 2.937 N/A ALA 169.A N ALA 165.A O no hydrogen 3.026 N/A SER 170.A N ALA 166.A O no hydrogen 2.994 N/A THR 171.A N ILE 167.A O no hydrogen 2.773 N/A THR 171.A OG1 ILE 167.A O no hydrogen 2.690 N/A GLY 172.A N GLU 168.A O no hydrogen 2.712 N/A ARG 173.A N THR 171.A OG1 no hydrogen 3.172 N/A ARG 173.A NH1 LEU 136.A O no hydrogen 2.834 N/A ARG 173.A NH1 LYS 140.A O no hydrogen 2.691 N/A ARG 173.A NH2 LYS 140.A O no hydrogen 2.852 N/A LYS 174.A NZ GLU 168.A OE1 no hydrogen 3.458 N/A LYS 174.A NZ GLU 168.A OE2 no hydrogen 3.516 N/A ASP 176.A N TYR 142.A O no hydrogen 2.615 N/A LEU 177.A N TYR 142.A O no hydrogen 3.326 N/A ALA 179.A N ALA 144.A O no hydrogen 3.017 N/A LYS 181.A N ASN 46.A OD1 no hydrogen 3.038 N/A LYS 181.A NZ ASP 209.A OD1 no hydrogen 2.788 N/A ASN 183.A N GLY 180.A O no hydrogen 2.868 N/A ASN 183.A ND2 ILE 178.A O no hydrogen 2.809 N/A LEU 185.A N ASN 183.A OD1 no hydrogen 2.973 N/A VAL 186.A N ASN 183.A O no hydrogen 3.428 N/A ASP 188.A N PRO 184.A O no hydrogen 2.981 N/A VAL 189.A N LEU 185.A O no hydrogen 2.828 N/A ILE 190.A N VAL 186.A O no hydrogen 3.094 N/A SER 191.A N VAL 187.A O no hydrogen 2.785 N/A SER 191.A OG VAL 196.A O no hydrogen 2.561 N/A GLU 192.A N ASP 188.A O no hydrogen 2.968 N/A LYS 193.A N VAL 189.A O no hydrogen 2.775 N/A PHE 194.A N ILE 190.A O no hydrogen 3.014 N/A GLY 195.A N GLU 192.A O no hydrogen 3.329 N/A VAL 196.A N SER 191.A O no hydrogen 3.193 N/A LYS 198.A NZ ALA 216.A O no hydrogen 2.772 N/A ARG 200.A N PRO 197.A O no hydrogen 2.809 N/A GLY 203.A N ILE 221.A O no hydrogen 2.886 N/A ASP 204.A N ASP 13.A OD2 no hydrogen 3.071 N/A ARG 205.A N ASP 209.A OD2 no hydrogen 3.150 N/A LEU 206.A N THR 228.A OG1 no hydrogen 3.232 N/A ASP 209.A N ARG 205.A O no hydrogen 2.893 N/A VAL 210.A N LEU 206.A O no hydrogen 3.412 N/A LYS 211.A N TYR 207.A O no hydrogen 3.035 N/A LEU 212.A N THR 208.A O no hydrogen 2.835 N/A GLY 213.A N ASP 209.A O no hydrogen 3.117 N/A LYS 214.A N VAL 210.A O no hydrogen 2.893 N/A ASN 215.A N LYS 211.A O no hydrogen 2.715 N/A ASN 215.A ND2 PRO 182.A O no hydrogen 2.804 N/A ALA 216.A N LEU 212.A O no hydrogen 2.817 N/A GLY 217.A N GLY 213.A O no hydrogen 2.689 N/A GLY 217.A N LYS 214.A O no hydrogen 3.366 N/A ILE 218.A N GLY 213.A O no hydrogen 3.000 N/A SER 220.A N ASP 241.A OD2 no hydrogen 2.742 N/A SER 220.A OG ASP 241.A OD2 no hydrogen 3.293 N/A LEU 222.A N PHE 242.A O no hydrogen 2.867 N/A VAL 223.A N GLY 203.A O no hydrogen 2.813 N/A LEU 224.A N LYS 245.A O no hydrogen 3.204 N/A THR 225.A OG1 GLY 15.A O no hydrogen 2.813 N/A GLU 227.A N ASP 204.A OD2 no hydrogen 2.746 N/A THR 228.A OG1 ASP 204.A O no hydrogen 2.538 N/A THR 229.A N ASP 232.A OD2 no hydrogen 3.185 N/A THR 229.A OG1 GLU 231.A OE1.B no hydrogen 3.484 N/A ASP 232.A N THR 229.A OG1 no hydrogen 3.181 N/A LEU 233.A N THR 229.A O no hydrogen 3.014 N/A GLU 234.A N PRO 230.A O no hydrogen 3.027 N/A ARG 235.A N GLU 231.A O no hydrogen 3.259 N/A ARG 235.A NE.A GLU 231.A OE2.A no hydrogen 3.385 N/A ARG 235.A NH1.A ASP 232.A OD1 no hydrogen 3.192 N/A ARG 235.A NH2.A GLU 231.A OE2.A no hydrogen 2.762 N/A ARG 235.A NH2.A ASP 232.A OD1 no hydrogen 2.998 N/A ALA 236.A N ASP 232.A O no hydrogen 2.894 N/A ALA 236.A N LEU 233.A O no hydrogen 3.309 N/A LYS 239.A NZ LEU 233.A O no hydrogen 2.816 N/A LYS 239.A NZ ALA 236.A O no hydrogen 2.872 N/A ASP 241.A N SER 220.A OG no hydrogen 3.108 N/A PHE 242.A N SER 220.A O no hydrogen 3.017 N/A PHE 244.A N LEU 222.A O no hydrogen 2.879 N/A GLU 249.A N ASN 246.A O no hydrogen 2.992 N/A GLU 249.A N ASN 246.A OD1 no hydrogen 3.062 N/A LEU 250.A N ASN 246.A O no hydrogen 3.067 N/A ALA 251.A N LEU 247.A O no hydrogen 2.807 N/A LYS 252.A N GLY 248.A O no hydrogen 3.162 N/A LYS 252.A NZ GLU 29.A OE2.A no hydrogen 3.051 N/A ALA 253.A N GLU 249.A O no hydrogen 3.106 N/A VAL 254.A N ALA 251.A O no hydrogen 3.062 N/A GLN 255.A N ALA 251.A O no hydrogen 2.988 N/A GLN 255.A NE2 THR 33.A OG1 no hydrogen 3.137 N/A