Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vu3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N MET 1.A O no hydrogen 3.015 N/A GLN 5.A N ARG 22.A O no hydrogen 2.867 N/A VAL 7.A N LYS 20.A O no hydrogen 2.746 N/A GLU 8.A N LYS 20.A O no hydrogen 3.302 N/A ILE 10.A N VAL 18.A O no hydrogen 2.772 N/A GLY 11.A N VAL 18.A O no hydrogen 3.258 N/A GLY 13.A N GLY 16.A O no hydrogen 2.894 N/A VAL 17.A N LYS 34.A O no hydrogen 2.897 N/A VAL 18.A N GLY 11.A O no hydrogen 2.783 N/A TYR 19.A N LEU 32.A O no hydrogen 2.811 N/A LYS 20.A N GLU 8.A O no hydrogen 2.773 N/A ALA 21.A N VAL 30.A O no hydrogen 2.928 N/A ARG 22.A N GLN 5.A O no hydrogen 2.759 N/A ASN 23.A N GLU 28.A O no hydrogen 2.690 N/A ASN 23.A ND2 GLU 28.A OE2 no hydrogen 2.711 N/A LYS 24.A N ASN 3.A O no hydrogen 2.819 N/A LYS 24.A NZ GLU 2.A O no hydrogen 3.026 N/A LEU 25.A N ASN 23.A OD1 no hydrogen 2.849 N/A THR 26.A N ASN 23.A OD1 no hydrogen 2.919 N/A GLY 27.A N ASN 23.A O no hydrogen 2.978 N/A GLU 28.A N THR 26.A OG1 no hydrogen 3.261 N/A VAL 30.A N ALA 21.A O no hydrogen 2.870 N/A ALA 31.A N PHE 71.A O no hydrogen 3.035 N/A LEU 32.A N TYR 19.A O no hydrogen 2.804 N/A LYS 33.A N LEU 69.A O no hydrogen 2.764 N/A LYS 33.A NZ ASP 136.A OD1 no hydrogen 3.147 N/A LYS 34.A N VAL 17.A O no hydrogen 2.863 N/A ILE 35.A N LEU 67.A O no hydrogen 2.957 N/A LEU 37.A N ASN 65.A O no hydrogen 3.218 N/A GLU 42.A N THR 38.A O no hydrogen 3.003 N/A ILE 43.A N ALA 39.A O no hydrogen 2.975 N/A SER 44.A N ILE 40.A O no hydrogen 3.147 N/A SER 44.A OG ILE 40.A O no hydrogen 3.078 N/A LEU 45.A N ARG 41.A O no hydrogen 3.027 N/A LEU 46.A N GLU 42.A O no hydrogen 3.172 N/A LYS 47.A N ILE 43.A O no hydrogen 3.021 N/A GLU 48.A N LEU 45.A O no hydrogen 2.905 N/A LEU 49.A N LEU 46.A O no hydrogen 2.967 N/A ASN 50.A ND2 LYS 47.A O no hydrogen 3.240 N/A HIS 51.A NE2 ASN 53.A OD1 no hydrogen 3.190 N/A ASN 53.A ND2 GLN 101.A OE1 no hydrogen 3.118 N/A ASN 53.A ND2 ILE 132.A O no hydrogen 2.969 N/A ILE 54.A N HIS 51.A O no hydrogen 3.072 N/A VAL 55.A N LEU 134.A O no hydrogen 2.919 N/A LYS 56.A N GLU 72.A OE2 no hydrogen 2.817 N/A LEU 58.A N VAL 70.A O no hydrogen 2.649 N/A ASP 59.A N VAL 70.A O no hydrogen 3.304 N/A ILE 61.A N TYR 68.A O no hydrogen 2.857 N/A THR 63.A N LYS 66.A O no hydrogen 3.051 N/A ASN 65.A N THR 63.A O no hydrogen 2.327 N/A LYS 66.A N THR 63.A O no hydrogen 2.574 N/A LYS 66.A NZ TYR 68.A OH no hydrogen 3.178 N/A LEU 67.A N ILE 35.A O no hydrogen 3.220 N/A TYR 68.A N ILE 61.A O no hydrogen 3.087 N/A LEU 69.A N LYS 33.A O no hydrogen 2.944 N/A VAL 70.A N ASP 59.A O no hydrogen 2.855 N/A PHE 71.A N ALA 31.A O no hydrogen 2.760 N/A GLU 72.A N LYS 56.A O no hydrogen 2.908 N/A LEU 78.A N LEU 124.A O no hydrogen 2.885 N/A LYS 80.A N ASP 77.A OD1 no hydrogen 2.900 N/A LYS 80.A NZ ASP 77.A OD2 no hydrogen 2.459 N/A PHE 81.A N ASP 77.A O no hydrogen 3.227 N/A MET 82.A N LEU 78.A O no hydrogen 2.784 N/A ASP 83.A N LYS 79.A O no hydrogen 2.957 N/A ALA 84.A N LYS 80.A O no hydrogen 2.687 N/A SER 85.A N MET 82.A O no hydrogen 3.210 N/A SER 85.A OG PHE 81.A O no hydrogen 2.880 N/A ALA 86.A N ASP 83.A O no hydrogen 3.312 N/A GLY 89.A N SER 85.A O no hydrogen 2.446 N/A ILE 95.A N PRO 91.A O no hydrogen 3.093 N/A LYS 96.A N LEU 92.A O no hydrogen 2.842 N/A LYS 96.A NZ PHE 272.A O no hydrogen 3.357 N/A LYS 96.A NZ ASP 275.A OD1 no hydrogen 2.799 N/A SER 97.A N PRO 93.A O no hydrogen 2.981 N/A TYR 98.A N LEU 94.A O no hydrogen 2.880 N/A LEU 99.A N ILE 95.A O no hydrogen 2.849 N/A PHE 100.A N LYS 96.A O no hydrogen 2.974 N/A GLN 101.A N SER 97.A O no hydrogen 3.055 N/A GLN 101.A NE2 SER 97.A O no hydrogen 3.450 N/A GLN 101.A NE2 SER 97.A OG no hydrogen 3.000 N/A GLN 101.A NE2 GLY 130.A O no hydrogen 2.917 N/A LEU 102.A N TYR 98.A O no hydrogen 3.043 N/A LEU 103.A N LEU 99.A O no hydrogen 2.916 N/A GLN 104.A N PHE 100.A O no hydrogen 2.899 N/A GLY 105.A N GLN 101.A O no hydrogen 2.869 N/A LEU 106.A N LEU 102.A O no hydrogen 2.836 N/A ALA 107.A N LEU 103.A O no hydrogen 2.757 N/A PHE 108.A N GLN 104.A O no hydrogen 3.045 N/A CYS 109.A N GLY 105.A O no hydrogen 3.005 N/A CYS 109.A SG GLY 105.A O no hydrogen 3.468 N/A HIS 110.A N LEU 106.A O no hydrogen 2.861 N/A HIS 110.A NE2 ASP 172.A OD2 no hydrogen 2.884 N/A SER 111.A N ALA 107.A O no hydrogen 3.047 N/A SER 111.A OG ALA 107.A O no hydrogen 3.395 N/A SER 111.A OG PHE 108.A O no hydrogen 2.771 N/A SER 111.A OG HIS 112.A ND1 no hydrogen 3.398 N/A HIS 112.A N PHE 108.A O no hydrogen 3.363 N/A HIS 112.A N CYS 109.A O no hydrogen 3.043 N/A HIS 112.A ND1 PHE 108.A O no hydrogen 2.984 N/A ARG 113.A N HIS 110.A O no hydrogen 2.858 N/A VAL 114.A N CYS 109.A O no hydrogen 2.885 N/A HIS 116.A N ASP 172.A OD2 no hydrogen 2.857 N/A HIS 116.A NE2 ALA 135.A O no hydrogen 2.742 N/A ARG 117.A N ASP 172.A OD1 no hydrogen 2.817 N/A ASP 118.A N HIS 116.A ND1 no hydrogen 3.112 N/A LYS 120.A N ASN 123.A OD1.B no hydrogen 3.095 N/A ASN 123.A N LYS 120.A O no hydrogen 2.901 N/A ASN 123.A ND2.A ASP 118.A O no hydrogen 2.656 N/A ASN 123.A ND2.B ASP 118.A O no hydrogen 2.938 N/A LEU 124.A N PRO 121.A O no hydrogen 3.113 N/A LEU 125.A N LYS 133.A O no hydrogen 2.991 N/A ILE 126.A N GLN 76.A O no hydrogen 2.901 N/A ASN 127.A N ALA 131.A O no hydrogen 3.317 N/A THR 128.A OG1 GLU 129.A OE1 no hydrogen 2.788 N/A GLU 129.A N ASN 127.A OD1 no hydrogen 2.865 N/A GLY 130.A N ASN 127.A O no hydrogen 3.401 N/A ALA 131.A N ASN 127.A OD1 no hydrogen 3.048 N/A ILE 132.A N GLN 101.A OE1 no hydrogen 3.088 N/A LYS 133.A N LEU 125.A O no hydrogen 2.768 N/A LYS 133.A NZ GLU 72.A OE1 no hydrogen 3.250 N/A LYS 133.A NZ GLU 72.A OE2 no hydrogen 3.205 N/A LEU 134.A N ASN 53.A O no hydrogen 2.770 N/A ALA 135.A N ASN 123.A O no hydrogen 2.965 N/A GLY 138.A N HIS 116.A O no hydrogen 2.798 N/A VAL 141.A N ARG 36.A O no hydrogen 2.678 N/A VAL 143.A N THR 14.A O no hydrogen 3.272 N/A THR 145.A OG1 GLU 12.A OE1 no hydrogen 2.875 N/A THR 145.A OG1 GLU 12.A OE2 no hydrogen 3.000 N/A TYR 146.A N VAL 143.A O no hydrogen 3.215 N/A TYR 146.A OH GLU 149.A OE1 no hydrogen 3.225 N/A THR 147.A OG1 THR 145.A O no hydrogen 3.082 N/A THR 152.A N GLU 149.A O no hydrogen 3.241 N/A THR 152.A OG1 GLU 149.A O no hydrogen 2.678 N/A TRP 154.A N VAL 151.A O no hydrogen 3.258 N/A TYR 155.A OH GLU 182.A OE1 no hydrogen 2.536 N/A ARG 156.A N LEU 153.A O no hydrogen 3.054 N/A GLU 159.A N GLU 159.A OE1 no hydrogen 2.723 N/A ILE 160.A N ALA 157.A O no hydrogen 3.192 N/A LEU 161.A N ALA 157.A O no hydrogen 3.325 N/A LEU 162.A N PRO 158.A O no hydrogen 2.936 N/A GLY 163.A N ILE 160.A O no hydrogen 3.050 N/A CYS 164.A N GLU 159.A O no hydrogen 2.901 N/A ALA 170.A N SER 168.A OG no hydrogen 3.120 N/A VAL 171.A N SER 168.A O no hydrogen 3.114 N/A ASP 172.A N THR 169.A O no hydrogen 2.970 N/A TRP 174.A N ALA 170.A O no hydrogen 3.077 N/A SER 175.A N VAL 171.A O no hydrogen 3.194 N/A SER 175.A OG TYR 155.A O no hydrogen 2.664 N/A SER 175.A OG VAL 171.A O no hydrogen 3.223 N/A LEU 176.A N ASP 172.A O no hydrogen 2.981 N/A GLY 177.A N ILE 173.A O no hydrogen 2.858 N/A CYS 178.A N TRP 174.A O no hydrogen 2.920 N/A CYS 178.A SG TRP 174.A O no hydrogen 3.474 N/A ILE 179.A N SER 175.A O no hydrogen 2.977 N/A PHE 180.A N LEU 176.A O no hydrogen 2.893 N/A ALA 181.A N GLY 177.A O no hydrogen 3.062 N/A GLU 182.A N CYS 178.A O no hydrogen 3.131 N/A MET 183.A N ILE 179.A O no hydrogen 2.898 N/A VAL 184.A N PHE 180.A O no hydrogen 3.148 N/A THR 185.A N ALA 181.A O no hydrogen 2.921 N/A THR 185.A OG1 ALA 181.A O no hydrogen 3.098 N/A ARG 186.A N GLU 182.A O no hydrogen 2.893 N/A ARG 186.A NE ALA 86.A O no hydrogen 2.961 N/A ARG 186.A NH2 ALA 86.A O no hydrogen 2.822 N/A ARG 187.A N THR 185.A OG1 no hydrogen 3.311 N/A GLY 192.A N PHE 190.A O no hydrogen 3.076 N/A GLY 192.A N GLN 198.A OE1 no hydrogen 2.920 N/A ASP 193.A N ASP 197.A OD2 no hydrogen 3.004 N/A ASP 197.A N SER 194.A OG no hydrogen 3.254 N/A GLN 198.A N SER 194.A O no hydrogen 2.778 N/A GLN 198.A NE2 TRP 154.A O no hydrogen 3.189 N/A GLN 198.A NE2 PHE 190.A O no hydrogen 2.908 N/A LEU 199.A N GLU 195.A O no hydrogen 2.879 N/A PHE 200.A N ILE 196.A O no hydrogen 2.898 N/A ARG 201.A N ASP 197.A O no hydrogen 2.922 N/A ARG 201.A NE ASP 197.A OD2 no hydrogen 3.100 N/A ILE 202.A N GLN 198.A O no hydrogen 3.139 N/A PHE 203.A N LEU 199.A O no hydrogen 2.901 N/A ARG 204.A N PHE 200.A O no hydrogen 2.884 N/A THR 205.A N ARG 201.A O no hydrogen 3.380 N/A THR 205.A N ILE 202.A O no hydrogen 3.171 N/A THR 205.A OG1 ARG 201.A O no hydrogen 3.472 N/A LEU 206.A N ILE 202.A O no hydrogen 2.886 N/A THR 208.A N TRP 230.A O no hydrogen 2.962 N/A THR 208.A OG1 PRO 228.A O no hydrogen 2.620 N/A VAL 212.A N ASP 210.A OD1 no hydrogen 3.121 N/A VAL 213.A N ASP 210.A OD1 no hydrogen 3.403 N/A TRP 214.A N ASP 210.A O no hydrogen 2.994 N/A GLY 216.A N GLU 211.A OE1 no hydrogen 2.728 N/A VAL 217.A N TRP 214.A O no hydrogen 2.875 N/A THR 218.A N GLU 211.A OE2 no hydrogen 2.922 N/A THR 218.A OG1 GLU 211.A OE2 no hydrogen 2.515 N/A SER 219.A N GLY 216.A O no hydrogen 3.012 N/A MET 220.A N VAL 217.A O no hydrogen 3.068 N/A ASP 222.A N LEU 162.A O no hydrogen 2.842 N/A TYR 223.A N MET 220.A O no hydrogen 3.113 N/A PHE 227.A N LYS 224.A O no hydrogen 2.875 N/A TRP 230.A N THR 208.A OG1 no hydrogen 2.987 N/A GLN 233.A N THR 205.A O no hydrogen 2.869 N/A LYS 237.A N ASP 234.A O no hydrogen 2.847 N/A VAL 238.A N PHE 235.A O no hydrogen 3.016 N/A VAL 239.A N PHE 235.A O no hydrogen 3.204 N/A LEU 242.A N VAL 239.A O no hydrogen 3.037 N/A GLY 246.A N ASP 243.A OD1 no hydrogen 2.928 N/A ARG 247.A N ASP 243.A O no hydrogen 2.877 N/A ARG 247.A NH1 LEU 242.A O no hydrogen 2.835 N/A SER 248.A N GLU 244.A O no hydrogen 2.876 N/A SER 248.A OG HIS 270.A NE2 no hydrogen 3.256 N/A LEU 249.A N ASP 245.A O no hydrogen 2.975 N/A LEU 250.A N GLY 246.A O no hydrogen 2.866 N/A SER 251.A N ARG 247.A O no hydrogen 2.902 N/A GLN 252.A N SER 248.A O no hydrogen 3.223 N/A MET 253.A N LEU 249.A O no hydrogen 3.053 N/A LEU 254.A N SER 251.A O no hydrogen 3.294 N/A TYR 256.A OH GLY 207.A O no hydrogen 2.594 N/A ASN 259.A N ASP 257.A OD1 no hydrogen 2.912 N/A LYS 260.A N ASP 257.A O no hydrogen 2.890 N/A LYS 260.A NZ VAL 213.A O no hydrogen 2.964 N/A LYS 260.A NZ ASP 257.A OD2 no hydrogen 3.105 N/A ARG 261.A N ASP 257.A O no hydrogen 3.041 N/A ARG 261.A NE HIS 255.A O no hydrogen 2.904 N/A ARG 261.A NH1 GLU 159.A OE1 no hydrogen 3.397 N/A ARG 261.A NH1 GLU 159.A OE2 no hydrogen 2.822 N/A ARG 261.A NH1 ALA 170.A O no hydrogen 2.848 N/A ARG 261.A NH2 GLU 159.A OE1 no hydrogen 2.840 N/A ARG 261.A NH2 HIS 255.A O no hydrogen 3.226 N/A ARG 261.A NH2 TYR 256.A O no hydrogen 3.050 N/A ILE 262.A N GLN 252.A O no hydrogen 3.023 N/A ALA 266.A N SER 263.A OG no hydrogen 3.058 N/A ALA 267.A N SER 263.A O no hydrogen 2.936 N/A LEU 268.A N ALA 264.A O no hydrogen 3.122 N/A ALA 269.A N ALA 266.A O no hydrogen 3.156 N/A HIS 270.A N ALA 267.A O no hydrogen 3.002 N/A HIS 270.A NE2 SER 248.A OG no hydrogen 3.256 N/A PHE 272.A N HIS 270.A ND1 no hydrogen 2.975 N/A PHE 273.A N HIS 270.A O no hydrogen 2.937 N/A GLN 274.A N PRO 271.A O no hydrogen 3.024 N/A VAL 276.A N PHE 273.A O no hydrogen 3.096 N/A