Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nkd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 VAL 59.A O no hydrogen 2.685 N/A ARG 2.A NH2 VAL 59.A O no hydrogen 2.738 N/A ILE 6.A N CYS 39.A O no hydrogen 3.164 N/A LEU 8.A N MET 41.A O no hydrogen 2.938 N/A TYR 10.A N PRO 44.A O no hydrogen 3.322 N/A GLY 11.A N GLY 45.A O no hydrogen 3.152 N/A GLN 12.A N ILE 23.A O no hydrogen 2.938 N/A ILE 13.A N ARG 47.A O no hydrogen 2.801 N/A ASP 14.A N VAL 21.A O no hydrogen 3.200 N/A VAL 15.A N ASP 14.A OD1 no hydrogen 2.711 N/A ILE 16.A N ALA 19.A O no hydrogen 3.058 N/A ALA 19.A N ILE 16.A O no hydrogen 3.153 N/A VAL 21.A N ASP 14.A O no hydrogen 3.011 N/A LEU 22.A N THR 30.A O no hydrogen 2.811 N/A ILE 23.A N GLN 12.A O no hydrogen 2.953 N/A ASP 24.A N ILE 28.A O no hydrogen 3.072 N/A THR 26.A N ASP 24.A OD1 no hydrogen 2.756 N/A GLY 27.A N ASP 24.A O no hydrogen 2.881 N/A GLY 27.A N ASP 24.A OD1 no hydrogen 3.160 N/A ILE 28.A N ASP 24.A OD1 no hydrogen 3.362 N/A THR 30.A N LEU 22.A O no hydrogen 2.779 N/A ILE 32.A N PHE 20.A O no hydrogen 2.962 N/A VAL 34.A N ILE 32.A O no hydrogen 2.885 N/A SER 36.A N PRO 33.A O no hydrogen 2.898 N/A VAL 37.A N VAL 34.A O no hydrogen 3.427 N/A ALA 38.A N SER 4.A O no hydrogen 2.836 N/A CYS 39.A SG LEU 62.A O no hydrogen 3.894 N/A ILE 40.A N LEU 62.A O no hydrogen 3.073 N/A MET 41.A N ILE 6.A O no hydrogen 2.883 N/A LEU 42.A N VAL 64.A O no hydrogen 2.841 N/A GLU 43.A N LEU 8.A O no hydrogen 2.803 N/A THR 46.A OG1 GLU 43.A O no hydrogen 2.857 N/A ARG 47.A N GLY 11.A O no hydrogen 3.124 N/A SER 49.A N ILE 13.A O no hydrogen 3.108 N/A SER 49.A OG ILE 13.A O no hydrogen 3.544 N/A SER 49.A OG ASP 14.A OD1 no hydrogen 2.797 N/A ALA 52.A N SER 49.A OG no hydrogen 3.020 N/A VAL 53.A N SER 49.A O no hydrogen 3.133 N/A ARG 54.A N HIS 50.A O no hydrogen 3.058 N/A LEU 55.A N ALA 51.A O no hydrogen 3.103 N/A ALA 56.A N ALA 52.A O no hydrogen 2.939 N/A ALA 57.A N VAL 53.A O no hydrogen 2.909 N/A GLN 58.A N ARG 54.A O no hydrogen 2.917 N/A VAL 59.A N LEU 55.A O no hydrogen 3.130 N/A GLY 60.A N ALA 57.A O no hydrogen 3.183 N/A THR 61.A N ALA 56.A O no hydrogen 2.967 N/A THR 61.A OG1 VAL 34.A O no hydrogen 2.633 N/A THR 61.A OG1 VAL 37.A O no hydrogen 3.213 N/A LEU 62.A N ALA 38.A O no hydrogen 3.122 N/A VAL 64.A N ILE 40.A O no hydrogen 3.187 N/A TRP 65.A N ALA 75.A O no hydrogen 2.900 N/A VAL 66.A N LEU 42.A O no hydrogen 2.917 N/A GLY 67.A N ARG 72.A O no hydrogen 2.862 N/A ALA 69.A N GLU 43.A OE1 no hydrogen 2.864 N/A GLY 70.A N GLY 67.A O no hydrogen 3.035 N/A VAL 71.A N GLU 68.A O no hydrogen 3.181 N/A ARG 72.A NH1 TYR 74.A OH no hydrogen 2.803 N/A TYR 74.A N TRP 65.A O no hydrogen 2.738 N/A ALA 75.A N TRP 65.A O no hydrogen 3.433 N/A SER 76.A OG GLY 77.A O no hydrogen 3.232 N/A GLY 77.A N LEU 63.A O no hydrogen 2.786 N/A GLY 81.A N GLN 78.A O no hydrogen 2.955 N/A ARG 83.A NE ASP 85.A OD1 no hydrogen 3.112 N/A ARG 83.A NH2 ASP 85.A OD1 no hydrogen 3.531 N/A ARG 83.A NH2 ASP 85.A OD2 no hydrogen 2.816 N/A LYS 86.A N ASP 85.A OD1 no hydrogen 2.732 N/A LEU 87.A N ARG 83.A O no hydrogen 3.202 N/A LEU 88.A N SER 84.A O no hydrogen 2.886 N/A TYR 89.A N ASP 85.A O no hydrogen 2.931 N/A GLN 90.A N LYS 86.A O no hydrogen 3.051 N/A ALA 91.A N LEU 87.A O no hydrogen 3.040 N/A LYS 92.A N LEU 88.A O no hydrogen 3.025 N/A LEU 93.A N TYR 89.A O no hydrogen 3.171 N/A ALA 94.A N GLN 90.A O no hydrogen 2.966 N/A LEU 95.A N ALA 91.A O no hydrogen 2.933 N/A ASP 96.A N LYS 92.A O no hydrogen 3.320 N/A LEU 99.A N ASP 96.A OD1 no hydrogen 2.995 N/A ARG 100.A N ASP 96.A O no hydrogen 2.780 N/A ARG 100.A NE PHE 188.A O no hydrogen 2.893 N/A ARG 100.A NH1 GLU 97.A OE1 no hydrogen 3.232 N/A ARG 100.A NH1 GLU 97.A OE2 no hydrogen 3.544 N/A ARG 100.A NH2 PHE 188.A O no hydrogen 2.918 N/A LEU 101.A N GLU 97.A O no hydrogen 3.068 N/A LYS 102.A N ASP 98.A O no hydrogen 3.209 N/A VAL 103.A N LEU 99.A O no hydrogen 3.088 N/A VAL 104.A N ARG 100.A O no hydrogen 2.956 N/A ARG 105.A N LEU 101.A O no hydrogen 2.851 N/A ARG 105.A NH1 PRO 117.A O no hydrogen 3.004 N/A ARG 105.A NH2 ALA 116.A O no hydrogen 3.114 N/A LYS 106.A N LYS 102.A O no hydrogen 3.055 N/A MET 107.A N VAL 103.A O no hydrogen 2.913 N/A PHE 108.A N VAL 104.A O no hydrogen 2.874 N/A GLU 109.A N ARG 105.A O no hydrogen 3.048 N/A LEU 110.A N LYS 106.A O no hydrogen 3.015 N/A ARG 111.A N MET 107.A O no hydrogen 3.128 N/A ARG 111.A NH1 THR 136.A OG1 no hydrogen 3.224 N/A ARG 111.A NH2 ARG 111.A O no hydrogen 2.987 N/A ARG 111.A NH2 THR 136.A OG1 no hydrogen 3.186 N/A PHE 112.A N PHE 108.A O no hydrogen 2.896 N/A GLY 113.A N GLU 109.A O no hydrogen 2.887 N/A ARG 120.A NH1 ARG 119.A O no hydrogen 3.095 N/A SER 121.A N GLN 124.A OE1 no hydrogen 2.912 N/A GLN 124.A N SER 121.A OG no hydrogen 3.116 N/A LEU 125.A N SER 121.A O no hydrogen 2.984 N/A ARG 126.A N VAL 122.A O no hydrogen 3.149 N/A GLY 127.A N GLU 123.A O no hydrogen 3.129 N/A ILE 128.A N GLN 124.A O no hydrogen 2.944 N/A GLU 129.A N LEU 125.A O no hydrogen 2.906 N/A GLY 130.A N ARG 126.A O no hydrogen 3.079 N/A SER 131.A N GLY 127.A O no hydrogen 2.860 N/A SER 131.A OG GLY 127.A O no hydrogen 3.539 N/A ARG 132.A N GLU 129.A O no hydrogen 3.243 N/A THR 136.A N ARG 132.A O no hydrogen 3.268 N/A THR 136.A OG1 ARG 132.A O no hydrogen 3.361 N/A TYR 137.A N VAL 133.A O no hydrogen 3.345 N/A ALA 138.A N ARG 134.A O no hydrogen 3.237 N/A LEU 139.A N ALA 135.A O no hydrogen 2.831 N/A LEU 140.A N THR 136.A O no hydrogen 3.055 N/A ALA 141.A N TYR 137.A O no hydrogen 2.878 N/A LYS 142.A N ALA 138.A O no hydrogen 3.205 N/A GLN 143.A N LEU 139.A O no hydrogen 2.989 N/A TYR 144.A N LEU 140.A O no hydrogen 3.087 N/A VAL 146.A N ALA 141.A O no hydrogen 2.880 N/A ARG 151.A NH1 ASN 159.A O no hydrogen 3.101 N/A ARG 151.A NH1 ASN 159.A OD1 no hydrogen 2.812 N/A ARG 151.A NH1 SER 163.A OG no hydrogen 3.384 N/A ARG 151.A NH2 SER 163.A OG no hydrogen 2.980 N/A ARG 152.A N ASN 159.A OD1 no hydrogen 2.885 N/A ASN 159.A ND2 GLY 150.A O no hydrogen 3.088 N/A GLN 160.A N ASP 156.A O no hydrogen 2.962 N/A CYS 161.A N THR 157.A O no hydrogen 3.048 N/A CYS 161.A SG ALA 214.A O no hydrogen 3.585 N/A ILE 162.A N ILE 158.A O no hydrogen 2.819 N/A SER 163.A N ASN 159.A O no hydrogen 3.207 N/A SER 163.A OG ASN 159.A O no hydrogen 2.948 N/A ALA 164.A N GLN 160.A O no hydrogen 2.896 N/A ALA 165.A N CYS 161.A O no hydrogen 2.776 N/A THR 166.A N ILE 162.A O no hydrogen 3.063 N/A THR 166.A N SER 163.A O no hydrogen 3.266 N/A THR 166.A OG1 ILE 162.A O no hydrogen 3.124 N/A SER 167.A N ALA 164.A O no hydrogen 3.123 N/A SER 167.A OG ALA 164.A O no hydrogen 2.672 N/A CYS 168.A SG ALA 69.A O no hydrogen 3.491 N/A CYS 168.A SG SER 167.A OG no hydrogen 3.565 N/A CYS 168.A SG ARG 234.A O no hydrogen 3.855 N/A LEU 169.A N THR 166.A O no hydrogen 3.157 N/A VAL 172.A N CYS 168.A O no hydrogen 2.993 N/A THR 173.A N LEU 169.A O no hydrogen 3.008 N/A THR 173.A OG1 LEU 169.A O no hydrogen 2.727 N/A GLU 174.A N TYR 170.A O no hydrogen 2.988 N/A ALA 175.A N GLY 171.A O no hydrogen 2.896 N/A ALA 176.A N VAL 172.A O no hydrogen 2.861 N/A ILE 177.A N THR 173.A O no hydrogen 3.003 N/A LEU 178.A N GLU 174.A O no hydrogen 3.024 N/A ALA 179.A N ALA 175.A O no hydrogen 2.864 N/A ALA 180.A N ALA 176.A O no hydrogen 2.854 N/A GLY 181.A N ILE 177.A O no hydrogen 3.023 N/A GLY 181.A N LEU 178.A O no hydrogen 3.138 N/A TYR 182.A N ILE 177.A O no hydrogen 2.894 N/A TYR 182.A OH GLU 251.A OE1 no hydrogen 3.163 N/A TYR 182.A OH GLU 251.A OE2 no hydrogen 2.870 N/A ILE 186.A N ALA 183.A O no hydrogen 3.302 N/A PHE 188.A N ASP 200.A OD2 no hydrogen 2.674 N/A VAL 189.A N ASP 200.A OD1 no hydrogen 3.315 N/A VAL 189.A N ASP 200.A OD2 no hydrogen 3.134 N/A HIS 190.A N ASP 200.A OD1 no hydrogen 2.775 N/A HIS 190.A ND1 ASP 200.A OD1 no hydrogen 2.700 N/A LYS 193.A N SER 196.A OG no hydrogen 2.831 N/A SER 196.A N LYS 193.A O no hydrogen 3.322 N/A SER 196.A OG LYS 193.A O no hydrogen 3.078 N/A PHE 197.A N PRO 184.A O no hydrogen 2.948 N/A TYR 199.A N LEU 195.A O no hydrogen 2.992 N/A ASP 200.A N SER 196.A O no hydrogen 3.179 N/A ILE 201.A N PHE 197.A O no hydrogen 3.158 N/A ALA 202.A N VAL 198.A O no hydrogen 2.811 N/A ASP 203.A N TYR 199.A O no hydrogen 3.080 N/A ILE 205.A N ILE 201.A O no hydrogen 3.044 N/A LYS 206.A N ALA 202.A O no hydrogen 2.827 N/A LYS 206.A NZ TYR 137.A OH no hydrogen 3.502 N/A ASP 208.A N ILE 204.A O no hydrogen 2.948 N/A VAL 210.A N ILE 205.A O no hydrogen 3.164 N/A VAL 211.A N LYS 206.A O no hydrogen 2.912 N/A LYS 213.A N THR 209.A O no hydrogen 3.034 N/A LYS 213.A NZ ILE 236.A O no hydrogen 3.409 N/A LYS 213.A NZ THR 242.A OG1 no hydrogen 2.969 N/A ALA 214.A N VAL 210.A O no hydrogen 2.895 N/A PHE 215.A N VAL 211.A O no hydrogen 2.943 N/A GLU 216.A N PRO 212.A O no hydrogen 2.899 N/A ILE 217.A N LYS 213.A O no hydrogen 2.986 N/A ALA 218.A N ALA 214.A O no hydrogen 2.905 N/A ARG 219.A N PHE 215.A O no hydrogen 2.878 N/A ARG 220.A N GLU 216.A O no hydrogen 3.095 N/A ASN 221.A N ILE 217.A O no hydrogen 3.264 N/A GLU 224.A N ASN 221.A OD1 no hydrogen 2.814 N/A VAL 229.A N PRO 225.A O no hydrogen 3.168 N/A ARG 230.A N ASP 226.A O no hydrogen 2.949 N/A ARG 230.A NH1 GLN 160.A OE1 no hydrogen 3.464 N/A LEU 231.A N ARG 227.A O no hydrogen 3.171 N/A ALA 232.A N GLU 228.A O no hydrogen 2.985 N/A CYS 233.A N VAL 229.A O no hydrogen 2.930 N/A CYS 233.A SG VAL 229.A O no hydrogen 3.177 N/A ARG 234.A N ARG 230.A O no hydrogen 2.961 N/A ASP 235.A N LEU 231.A O no hydrogen 3.179 N/A ILE 236.A N CYS 233.A O no hydrogen 3.394 N/A ARG 238.A N ASP 235.A O no hydrogen 3.047 N/A ARG 238.A NE ASP 235.A OD1 no hydrogen 3.401 N/A ARG 238.A NH1 GLU 43.A OE2 no hydrogen 2.956 N/A ARG 238.A NH2 GLU 43.A OE1 no hydrogen 2.813 N/A ARG 238.A NH2 GLU 43.A OE2 no hydrogen 3.561 N/A SER 239.A OG THR 242.A OG1 no hydrogen 3.294 N/A THR 242.A N SER 239.A OG no hydrogen 3.138 N/A THR 242.A OG1 SER 239.A OG no hydrogen 3.294 N/A LEU 243.A N SER 239.A O no hydrogen 3.002 N/A ALA 244.A N SER 240.A O no hydrogen 2.995 N/A LYS 245.A N THR 242.A O no hydrogen 3.143 N/A LEU 246.A N LEU 243.A O no hydrogen 3.174 N/A LEU 249.A N LYS 245.A O no hydrogen 3.049 N/A ILE 250.A N LEU 246.A O no hydrogen 3.065 N/A GLU 251.A N ILE 247.A O no hydrogen 2.961 N/A ASP 252.A N PRO 248.A O no hydrogen 2.844 N/A VAL 253.A N LEU 249.A O no hydrogen 2.877 N/A LEU 254.A N ILE 250.A O no hydrogen 3.168 N/A ALA 255.A N GLU 251.A O no hydrogen 2.852 N/A ALA 256.A N VAL 253.A O no hydrogen 3.401 N/A GLY 257.A N LEU 254.A O no hydrogen 3.146 N/A GLU 258.A N ALA 255.A O no hydrogen 3.055 N/A