Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vrh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A N ARG 8.A O no hydrogen 2.905 N/A CYS 3.A SG HIS 25.A ND1 no hydrogen 3.759 N/A LYS 4.A N TYR 20.A O no hydrogen 2.841 N/A ALA 10.A N MET 1.A O no hydrogen 2.922 N/A TYR 11.A N LEU 21.A O no hydrogen 2.540 N/A TYR 11.A OH ALA 206.A O no hydrogen 2.864 N/A ILE 12.A N LEU 21.A O no hydrogen 3.077 N/A ILE 14.A N MET 19.A O no hydrogen 2.798 N/A MET 19.A N ILE 14.A O no hydrogen 3.004 N/A LEU 21.A N ILE 12.A O no hydrogen 2.959 N/A CYS 22.A SG HIS 25.A ND1 no hydrogen 3.524 N/A PHE 26.A N CYS 22.A O no hydrogen 2.808 N/A LYS 27.A N GLU 23.A O no hydrogen 3.002 N/A LYS 27.A NZ GLU 24.A OE1 no hydrogen 3.447 N/A LYS 27.A NZ GLU 24.A OE2 no hydrogen 2.867 N/A GLU 28.A N GLU 24.A O no hydrogen 3.092 N/A TYR 29.A N HIS 25.A O no hydrogen 2.954 N/A TYR 29.A OH GLU 203.A OE2 no hydrogen 2.717 N/A PHE 30.A N PHE 26.A O no hydrogen 2.801 N/A GLU 31.A N LYS 27.A O no hydrogen 2.872 N/A ARG 32.A N GLU 28.A O no hydrogen 2.860 N/A ARG 32.A NE GLU 28.A OE2 no hydrogen 3.117 N/A ARG 32.A NH2 GLU 28.A OE2 no hydrogen 2.963 N/A LYS 33.A N TYR 29.A O no hydrogen 2.886 N/A LYS 33.A NZ TYR 29.A OH no hydrogen 3.020 N/A VAL 34.A N PHE 30.A O no hydrogen 3.018 N/A SER 35.A N GLU 31.A O no hydrogen 2.957 N/A ARG 36.A N ARG 32.A O no hydrogen 2.726 N/A THR 37.A N LYS 33.A O no hydrogen 2.903 N/A THR 37.A OG1 LYS 33.A O no hydrogen 3.047 N/A THR 37.A OG1 GLU 198.A OE1 no hydrogen 2.772 N/A ILE 38.A N VAL 34.A O no hydrogen 2.977 N/A GLU 39.A N SER 35.A O no hydrogen 3.053 N/A ARG 40.A N ARG 36.A O no hydrogen 2.888 N/A TYR 41.A N THR 37.A O no hydrogen 3.211 N/A LYS 42.A N GLU 39.A O no hydrogen 3.123 N/A LEU 43.A N ILE 38.A O no hydrogen 2.960 N/A THR 45.A N GLU 48.A OE1 no hydrogen 2.753 N/A THR 45.A OG1 ASP 47.A OD1 no hydrogen 2.343 N/A LYS 46.A NZ LEU 70.A O no hydrogen 3.136 N/A GLU 48.A N THR 45.A O no hydrogen 3.018 N/A ARG 49.A N ASP 149.A OD2 no hydrogen 3.001 N/A ARG 49.A NE GLU 75.A OE2 no hydrogen 3.083 N/A ARG 49.A NH1 ASN 146.A O no hydrogen 2.947 N/A ILE 50.A N ASN 73.A O no hydrogen 2.842 N/A LEU 51.A N ALA 150.A O no hydrogen 2.884 N/A VAL 52.A N GLU 75.A O no hydrogen 2.866 N/A VAL 54.A N LEU 77.A O no hydrogen 2.645 N/A SER 55.A N SER 60.A OG no hydrogen 3.197 N/A SER 55.A OG SER 60.A OG no hydrogen 3.343 N/A GLY 57.A N SER 55.A OG no hydrogen 2.881 N/A LYS 58.A NZ ASP 59.A OD1 no hydrogen 3.517 N/A LYS 58.A NZ ASP 59.A OD2 no hydrogen 3.084 N/A LYS 58.A NZ GLU 201.A OE2 no hydrogen 2.782 N/A SER 60.A OG SER 55.A OG no hydrogen 3.343 N/A ALA 61.A N GLY 57.A O no hydrogen 3.376 N/A VAL 62.A N LYS 58.A O no hydrogen 2.915 N/A THR 63.A N ASP 59.A O no hydrogen 3.021 N/A THR 63.A OG1 ASP 59.A O no hydrogen 2.731 N/A ALA 64.A N SER 60.A O no hydrogen 3.009 N/A TYR 65.A N ALA 61.A O no hydrogen 2.939 N/A VAL 66.A N VAL 62.A O no hydrogen 2.843 N/A LEU 67.A N THR 63.A O no hydrogen 2.984 N/A LYS 68.A N ALA 64.A O no hydrogen 3.151 N/A LYS 69.A N TYR 65.A O no hydrogen 3.019 N/A LYS 69.A NZ GLU 31.A OE1 no hydrogen 2.740 N/A LYS 69.A NZ GLU 31.A OE2 no hydrogen 3.360 N/A LEU 70.A N VAL 66.A O no hydrogen 2.762 N/A GLY 71.A N LYS 68.A O no hydrogen 2.940 N/A TYR 72.A N LEU 67.A O no hydrogen 2.886 N/A GLU 75.A N ILE 50.A O no hydrogen 2.896 N/A CYS 76.A N PRO 104.A O no hydrogen 2.815 N/A LEU 77.A N VAL 52.A O no hydrogen 2.847 N/A HIS 78.A N HIS 106.A O no hydrogen 2.839 N/A HIS 78.A ND1 VAL 54.A O no hydrogen 2.754 N/A ASN 80.A N VAL 108.A O no hydrogen 2.832 N/A ASN 80.A ND2 GLU 91.A OE1 no hydrogen 2.794 N/A GLY 82.A N ASN 80.A OD1 no hydrogen 2.840 N/A ILE 83.A N SER 87.A OG no hydrogen 2.952 N/A GLY 85.A N GLU 88.A OE2 no hydrogen 3.445 N/A TYR 86.A N ILE 83.A O no hydrogen 3.041 N/A TYR 86.A OH GLU 218.A O no hydrogen 2.261 N/A SER 87.A N ILE 83.A O no hydrogen 2.940 N/A GLU 88.A N GLU 88.A OE1 no hydrogen 2.847 N/A SER 90.A N TYR 86.A O no hydrogen 3.289 N/A SER 90.A OG TYR 86.A O no hydrogen 3.299 N/A GLU 91.A N SER 87.A O no hydrogen 2.823 N/A GLU 92.A N GLU 88.A O no hydrogen 3.063 N/A TYR 93.A N LYS 89.A O no hydrogen 3.001 N/A ALA 94.A N SER 90.A O no hydrogen 3.052 N/A LYS 95.A N GLU 91.A O no hydrogen 2.881 N/A LYS 95.A NZ GLU 92.A OE1 no hydrogen 3.500 N/A LYS 95.A NZ GLU 92.A OE2 no hydrogen 2.764 N/A LYS 96.A N GLU 92.A O no hydrogen 3.000 N/A LYS 96.A NZ GLU 214.A OE2 no hydrogen 3.016 N/A GLN 97.A N TYR 93.A O no hydrogen 2.978 N/A GLN 97.A NE2 GLY 56.A O no hydrogen 2.926 N/A GLN 97.A NE2 GLU 214.A O no hydrogen 2.697 N/A CYS 98.A N ALA 94.A O no hydrogen 2.978 N/A CYS 98.A SG ALA 94.A O no hydrogen 3.495 N/A LYS 99.A N LYS 95.A O no hydrogen 2.948 N/A LEU 100.A N LYS 96.A O no hydrogen 2.968 N/A ILE 101.A N GLN 97.A O no hydrogen 2.774 N/A GLY 102.A N CYS 98.A O no hydrogen 2.624 N/A ALA 103.A N CYS 98.A O no hydrogen 3.041 N/A HIS 106.A N CYS 76.A O no hydrogen 2.738 N/A HIS 106.A NE2 GLU 75.A OE1 no hydrogen 2.714 N/A VAL 108.A N HIS 78.A O no hydrogen 3.126 N/A ARG 109.A NE GLU 91.A OE1 no hydrogen 2.867 N/A ARG 109.A NH1 GLU 112.A OE2 no hydrogen 2.997 N/A ARG 109.A NH2 GLU 91.A OE1 no hydrogen 3.565 N/A ARG 109.A NH2 GLU 91.A OE2 no hydrogen 2.785 N/A ILE 110.A N ASN 80.A O no hydrogen 2.922 N/A LYS 111.A NZ GLU 120.A OE1 no hydrogen 3.173 N/A ILE 113.A N ARG 109.A O no hydrogen 3.158 N/A LEU 114.A N ILE 110.A O no hydrogen 2.833 N/A GLY 115.A N LYS 111.A O no hydrogen 2.941 N/A GLY 117.A N GLU 120.A OE1 no hydrogen 2.876 N/A ILE 118.A N LEU 81.A O no hydrogen 2.824 N/A GLY 119.A N TYR 130.A OH no hydrogen 2.705 N/A GLU 120.A N GLY 117.A O no hydrogen 2.866 N/A VAL 121.A N TYR 130.A OH no hydrogen 3.471 N/A THR 123.A N VAL 121.A O no hydrogen 2.901 N/A ARG 125.A N THR 123.A OG1 no hydrogen 3.026 N/A ARG 125.A NH1 SER 129.A O no hydrogen 3.319 N/A ARG 125.A NH1 SER 129.A OG no hydrogen 3.143 N/A SER 129.A N PRO 126.A O no hydrogen 2.800 N/A TYR 130.A N PRO 126.A O no hydrogen 3.228 N/A CYS 131.A N PRO 127.A O no hydrogen 2.846 N/A GLY 132.A N CYS 128.A O no hydrogen 3.063 N/A LEU 133.A N SER 129.A O no hydrogen 3.312 N/A THR 134.A N TYR 130.A O no hydrogen 2.949 N/A THR 134.A OG1 TYR 130.A O no hydrogen 2.625 N/A LYS 135.A N CYS 131.A O no hydrogen 2.798 N/A LYS 135.A NZ GLU 219.A OE1 no hydrogen 3.075 N/A LYS 135.A NZ GLU 219.A OE2 no hydrogen 2.718 N/A ARG 136.A N GLY 132.A O no hydrogen 3.021 N/A TYR 137.A N LEU 133.A O no hydrogen 3.094 N/A ILE 138.A N THR 134.A O no hydrogen 3.073 N/A MET 139.A N LYS 135.A O no hydrogen 2.943 N/A ASN 140.A N ARG 136.A O no hydrogen 3.135 N/A ASN 140.A ND2 LYS 188.A O no hydrogen 3.058 N/A LYS 141.A N TYR 137.A O no hydrogen 2.843 N/A LYS 141.A NZ ASP 145.A OD1 no hydrogen 3.011 N/A LYS 141.A NZ ASP 145.A OD2 no hydrogen 2.874 N/A LYS 141.A NZ GLU 284.A OE1 no hydrogen 2.872 N/A LYS 141.A NZ ILE 285.A O no hydrogen 2.767 N/A PHE 142.A N ILE 138.A O no hydrogen 2.886 N/A ALA 143.A N MET 139.A O no hydrogen 3.039 N/A TYR 144.A N ASN 140.A O no hydrogen 2.897 N/A ASP 145.A N LYS 141.A O no hydrogen 2.831 N/A ASN 146.A N PHE 142.A O no hydrogen 3.248 N/A ASN 146.A ND2 PHE 142.A O no hydrogen 2.953 N/A ASN 146.A ND2 PHE 287.A O no hydrogen 2.860 N/A GLY 147.A N TYR 144.A O no hydrogen 3.017 N/A PHE 148.A N ALA 143.A O no hydrogen 2.841 N/A ASP 149.A N ARG 49.A O no hydrogen 2.925 N/A ILE 151.A N LYS 191.A O no hydrogen 2.709 N/A ALA 152.A N LEU 51.A O no hydrogen 2.902 N/A THR 153.A N VAL 193.A O no hydrogen 2.963 N/A THR 153.A OG1 HIS 155.A ND1 no hydrogen 2.890 N/A HIS 155.A ND1 THR 153.A OG1 no hydrogen 2.890 N/A ASN 156.A N ASP 159.A OD2 no hydrogen 2.872 N/A LEU 157.A N VAL 199.A O no hydrogen 2.882 N/A ASP 159.A N ASN 156.A OD1 no hydrogen 3.123 N/A GLU 160.A N ASN 156.A O no hydrogen 3.058 N/A ALA 161.A N LEU 157.A O no hydrogen 2.932 N/A SER 162.A N ASP 158.A O no hydrogen 2.997 N/A SER 162.A OG ASP 158.A O no hydrogen 3.117 N/A SER 162.A OG ASP 159.A O no hydrogen 3.005 N/A PHE 163.A N ASP 159.A O no hydrogen 2.874 N/A LEU 164.A N GLU 160.A O no hydrogen 2.786 N/A LEU 165.A N ALA 161.A O no hydrogen 2.856 N/A ASN 166.A N SER 162.A O no hydrogen 2.898 N/A ASN 167.A N PHE 163.A O no hydrogen 2.959 N/A ASN 167.A ND2 PHE 163.A O no hydrogen 3.012 N/A ILE 168.A N LEU 164.A O no hydrogen 3.033 N/A LEU 169.A N LEU 165.A O no hydrogen 2.968 N/A HIS 170.A N ASN 166.A O no hydrogen 3.156 N/A TRP 171.A N ILE 168.A O no hydrogen 3.063 N/A ASN 172.A N ASN 167.A O no hydrogen 2.740 N/A ASN 172.A ND2 ASN 167.A OD1 no hydrogen 2.612 N/A LEU 176.A N ASN 172.A O no hydrogen 3.031 N/A ALA 177.A N THR 173.A O no hydrogen 3.105 N/A ALA 177.A N GLU 174.A O no hydrogen 3.078 N/A LYS 178.A N TYR 175.A O no hydrogen 2.984 N/A GLY 180.A N GLU 160.A OE2 no hydrogen 2.765 N/A LEU 183.A N LYS 192.A O no hydrogen 2.805 N/A GLN 186.A N PHE 189.A O no hydrogen 2.952 N/A LYS 188.A NZ GLU 260.A OE2 no hydrogen 3.303 N/A LYS 188.A NZ ARG 265.A O no hydrogen 3.170 N/A PHE 189.A N GLN 186.A O no hydrogen 3.181 N/A ILE 190.A N ASN 140.A OD1 no hydrogen 2.779 N/A LYS 191.A NZ LEU 43.A O no hydrogen 2.565 N/A LYS 191.A NZ GLU 48.A OE2 no hydrogen 2.975 N/A LYS 192.A N LEU 183.A O no hydrogen 3.042 N/A VAL 193.A N ILE 151.A O no hydrogen 2.834 N/A LYS 194.A N PRO 181.A O no hydrogen 2.900 N/A TYR 197.A N LYS 194.A O no hydrogen 3.107 N/A TYR 197.A OH GLU 160.A OE2 no hydrogen 2.594 N/A VAL 199.A N LEU 196.A O no hydrogen 3.241 N/A THR 200.A N GLU 203.A OE1 no hydrogen 3.035 N/A GLU 201.A N ASP 158.A OD1 no hydrogen 2.543 N/A ARG 202.A NH1 LYS 13.A O no hydrogen 3.044 N/A ARG 202.A NH2 LYS 13.A O no hydrogen 2.770 N/A GLU 203.A N THR 200.A OG1 no hydrogen 3.027 N/A VAL 204.A N THR 200.A O no hydrogen 2.980 N/A VAL 205.A N GLU 201.A O no hydrogen 2.915 N/A ALA 206.A N ARG 202.A O no hydrogen 2.991 N/A TYR 207.A N GLU 203.A O no hydrogen 2.835 N/A TYR 207.A OH GLU 31.A OE1 no hydrogen 2.629 N/A ALA 208.A N VAL 204.A O no hydrogen 2.983 N/A LEU 209.A N VAL 205.A O no hydrogen 3.206 N/A ALA 210.A N ALA 206.A O no hydrogen 3.053 N/A VAL 211.A N TYR 207.A O no hydrogen 2.972 N/A GLY 212.A N LEU 209.A O no hydrogen 3.365 N/A LEU 213.A N ALA 208.A O no hydrogen 2.883 N/A ILE 216.A N GLY 56.A O no hydrogen 3.053 N/A MET 227.A N THR 223.A O no hydrogen 2.726 N/A LYS 228.A N THR 224.A O no hydrogen 2.669 N/A LYS 228.A NZ ASP 159.A OD1 no hydrogen 2.622 N/A LYS 228.A NZ GLU 201.A OE1 no hydrogen 2.635 N/A LYS 228.A NZ GLU 201.A OE2 no hydrogen 3.508 N/A GLY 229.A N LEU 225.A O no hydrogen 3.102 N/A VAL 230.A N ASP 226.A O no hydrogen 3.042 N/A LEU 231.A N MET 227.A O no hydrogen 2.861 N/A ASN 232.A N LYS 228.A O no hydrogen 2.750 N/A GLU 233.A N GLY 229.A O no hydrogen 2.810 N/A LEU 234.A N VAL 230.A O no hydrogen 2.900 N/A GLU 235.A N LEU 231.A O no hydrogen 2.823 N/A GLU 236.A N ASN 232.A O no hydrogen 3.096 N/A LYS 237.A N GLU 233.A O no hydrogen 3.190 N/A LYS 237.A NZ GLU 233.A OE2 no hydrogen 3.531 N/A ARG 238.A N LEU 234.A O no hydrogen 2.687 N/A GLY 240.A N GLU 235.A OE1 no hydrogen 2.748 N/A THR 241.A N ARG 238.A O no hydrogen 3.154 N/A THR 241.A OG1 ARG 238.A O no hydrogen 2.567 N/A LYS 242.A N GLU 235.A OE2 no hydrogen 2.841 N/A LYS 242.A NZ ASP 158.A OD2 no hydrogen 2.846 N/A LYS 242.A NZ ASN 232.A OD1 no hydrogen 2.422 N/A ASN 244.A N GLY 240.A O no hydrogen 3.078 N/A PHE 245.A N THR 241.A O no hydrogen 2.911 N/A VAL 246.A N LYS 242.A O no hydrogen 3.155 N/A ARG 247.A N PHE 243.A O no hydrogen 2.901 N/A GLY 248.A N ASN 244.A O no hydrogen 2.897 N/A TYR 249.A N PHE 245.A O no hydrogen 2.962 N/A TYR 249.A OH LEU 176.A O no hydrogen 2.440 N/A LEU 250.A N VAL 246.A O no hydrogen 2.958 N/A LYS 251.A N ARG 247.A O no hydrogen 3.313 N/A LYS 252.A N TYR 249.A O no hydrogen 3.102 N/A LYS 253.A NZ ALA 177.A O no hydrogen 3.532 N/A LEU 255.A N LYS 252.A O no hydrogen 2.924 N/A PHE 256.A N LYS 253.A O no hydrogen 3.082 N/A GLU 257.A N LYS 254.A O no hydrogen 3.069 N/A CYS 261.A N MET 266.A O no hydrogen 2.986 N/A LYS 262.A N ASP 271.A O no hydrogen 2.878 N/A CYS 264.A SG TYR 137.A OH no hydrogen 2.848 N/A ARG 265.A N CYS 261.A O no hydrogen 2.920 N/A SER 268.A N LYS 259.A O no hydrogen 3.418 N/A SER 268.A OG GLY 270.A O no hydrogen 2.437 N/A ILE 272.A N ASP 271.A OD1 no hydrogen 2.848 N/A LYS 277.A N CYS 273.A O no hydrogen 2.800 N/A PHE 278.A N ALA 274.A O no hydrogen 2.842 N/A TRP 279.A N PHE 275.A O no hydrogen 2.934 N/A TRP 279.A NE1 THR 134.A OG1 no hydrogen 3.094 N/A GLY 280.A N LYS 277.A O no hydrogen 3.206 N/A LEU 281.A N CYS 276.A O no hydrogen 2.942 N/A PHE 287.A N ASP 145.A OD2 no hydrogen 2.721 N/A LYS 288.A N ASN 286.A OD1 no hydrogen 3.194 N/A LYS 288.A NZ VAL 289.A O no hydrogen 2.823 N/A VAL 289.A N ASN 146.A OD1 no hydrogen 2.945 N/A SER 291.A OG PRO 296.A O no hydrogen 3.534 N/A GLU 295.A N THR 292.A OG1 no hydrogen 2.724 N/A GLY 298.A N GLU 295.A O no hydrogen 3.116 N/A