Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nup_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N LYS 14.A O no hydrogen 2.579 N/A ALA 6.A N LYS 14.A O no hydrogen 3.191 N/A ILE 8.A N VAL 12.A O no hydrogen 2.698 N/A GLY 9.A N VAL 12.A O no hydrogen 2.980 N/A PHE 13.A N LEU 27.A O no hydrogen 2.770 N/A LYS 14.A N ALA 6.A O no hydrogen 2.716 N/A ALA 15.A N VAL 25.A O no hydrogen 3.057 N/A ARG 16.A NE GLY 22.A O no hydrogen 3.154 N/A ARG 16.A NH2 GLY 22.A O no hydrogen 3.055 N/A ASP 17.A N ARG 23.A O no hydrogen 2.758 N/A ASN 20.A N ASP 17.A O no hydrogen 2.753 N/A GLY 22.A N ASP 17.A O no hydrogen 3.034 N/A ARG 23.A N ASN 20.A O no hydrogen 3.415 N/A ARG 23.A NE ASP 17.A OD2 no hydrogen 2.751 N/A ARG 23.A NH2 ASP 17.A OD2 no hydrogen 2.749 N/A VAL 25.A N ALA 15.A O no hydrogen 3.093 N/A ALA 26.A N PHE 66.A O no hydrogen 2.872 N/A LEU 27.A N PHE 13.A O no hydrogen 2.867 N/A LYS 28.A N LEU 64.A O no hydrogen 2.874 N/A LYS 28.A NZ ASP 131.A OD2 no hydrogen 3.341 N/A ARG 29.A N LYS 11.A O no hydrogen 3.444 N/A VAL 30.A N LEU 62.A O no hydrogen 2.513 N/A ARG 35.A N LEU 31.A O no hydrogen 2.860 N/A GLU 36.A N SER 32.A O no hydrogen 2.807 N/A VAL 37.A N THR 33.A O no hydrogen 3.020 N/A ALA 38.A N ILE 34.A O no hydrogen 3.061 N/A VAL 39.A N ARG 35.A O no hydrogen 2.993 N/A LEU 40.A N GLU 36.A O no hydrogen 3.112 N/A ARG 41.A N VAL 37.A O no hydrogen 2.898 N/A HIS 42.A N ALA 38.A O no hydrogen 2.824 N/A LEU 43.A N VAL 39.A O no hydrogen 2.716 N/A GLU 44.A N LEU 40.A O no hydrogen 2.987 N/A THR 45.A N ARG 41.A O no hydrogen 3.288 N/A THR 45.A N HIS 42.A O no hydrogen 3.247 N/A THR 45.A OG1 HIS 42.A O no hydrogen 2.881 N/A PHE 46.A N LEU 43.A O no hydrogen 3.144 N/A GLU 47.A N GLU 44.A O no hydrogen 2.642 N/A ASN 50.A N HIS 48.A ND1 no hydrogen 3.038 N/A VAL 52.A N LEU 129.A O no hydrogen 3.048 N/A ARG 53.A N GLU 67.A OE1 no hydrogen 2.918 N/A ARG 53.A NE GLU 44.A OE1 no hydrogen 3.287 N/A ARG 53.A NE GLU 44.A OE2 no hydrogen 3.348 N/A ARG 53.A NH1 HIS 48.A O no hydrogen 2.712 N/A ARG 53.A NH2 HIS 48.A O no hydrogen 2.420 N/A LEU 54.A N GLU 44.A OE1 no hydrogen 3.003 N/A ASP 56.A N VAL 65.A O no hydrogen 3.192 N/A CYS 58.A N THR 63.A O no hydrogen 2.840 N/A CYS 58.A SG ASP 56.A OD2 no hydrogen 3.027 N/A THR 63.A N CYS 58.A O no hydrogen 3.033 N/A LEU 64.A N LYS 28.A O no hydrogen 2.677 N/A VAL 65.A N ASP 56.A O no hydrogen 2.651 N/A PHE 66.A N ALA 26.A O no hydrogen 2.989 N/A GLU 67.A N ARG 53.A O no hydrogen 3.063 N/A LEU 73.A N ILE 119.A O no hydrogen 2.925 N/A THR 75.A N ASP 72.A OD1 no hydrogen 2.892 N/A THR 75.A OG1 ASP 72.A OD1 no hydrogen 3.059 N/A TYR 76.A N ASP 72.A O no hydrogen 2.978 N/A LEU 77.A N LEU 73.A O no hydrogen 2.812 N/A ASP 78.A N THR 74.A O no hydrogen 2.886 N/A LYS 79.A N THR 75.A O no hydrogen 3.076 N/A VAL 80.A N TYR 76.A O no hydrogen 3.200 N/A GLY 84.A N PRO 81.A O no hydrogen 3.111 N/A THR 89.A N PRO 86.A O no hydrogen 2.620 N/A ILE 90.A N PRO 86.A O no hydrogen 3.119 N/A LYS 91.A N THR 87.A O no hydrogen 3.189 N/A LYS 91.A NZ TYR 251.A O no hydrogen 2.465 N/A ASP 92.A N GLU 88.A O no hydrogen 3.265 N/A MET 93.A N THR 89.A O no hydrogen 2.987 N/A MET 94.A N ILE 90.A O no hydrogen 2.843 N/A PHE 95.A N LYS 91.A O no hydrogen 3.094 N/A GLN 96.A N ASP 92.A O no hydrogen 2.916 N/A GLN 96.A NE2 GLY 125.A O no hydrogen 3.676 N/A LEU 97.A N MET 93.A O no hydrogen 2.990 N/A LEU 98.A N MET 94.A O no hydrogen 2.909 N/A ARG 99.A N PHE 95.A O no hydrogen 2.791 N/A GLY 100.A N GLN 96.A O no hydrogen 3.221 N/A LEU 101.A N LEU 97.A O no hydrogen 3.037 N/A ASP 102.A N LEU 98.A O no hydrogen 2.866 N/A PHE 103.A N ARG 99.A O no hydrogen 3.155 N/A LEU 104.A N GLY 100.A O no hydrogen 3.104 N/A HIS 105.A N LEU 101.A O no hydrogen 2.764 N/A HIS 105.A NE2 ASP 155.A OD2 no hydrogen 3.012 N/A SER 106.A N ASP 102.A O no hydrogen 2.754 N/A SER 106.A OG ASP 102.A O no hydrogen 3.130 N/A SER 106.A OG PHE 103.A O no hydrogen 2.446 N/A HIS 107.A N PHE 103.A O no hydrogen 3.225 N/A ARG 108.A N HIS 105.A O no hydrogen 2.759 N/A VAL 109.A N LEU 104.A O no hydrogen 2.917 N/A HIS 111.A N ASP 155.A OD2 no hydrogen 2.655 N/A HIS 111.A NE2 ALA 130.A O no hydrogen 2.945 N/A ARG 112.A N ASP 155.A OD1 no hydrogen 2.835 N/A ARG 112.A NH1 TYR 150.A O no hydrogen 2.489 N/A ASP 113.A N HIS 111.A ND1 no hydrogen 3.159 N/A LYS 115.A N ASN 118.A OD1 no hydrogen 3.347 N/A LYS 115.A NZ ASP 113.A OD2 no hydrogen 3.469 N/A ASN 118.A N LYS 115.A O no hydrogen 3.046 N/A ASN 118.A ND2 ASP 113.A O no hydrogen 2.870 N/A ILE 119.A N PRO 116.A O no hydrogen 3.354 N/A LEU 120.A N LYS 128.A O no hydrogen 2.877 N/A VAL 121.A N GLN 71.A O no hydrogen 2.851 N/A THR 122.A N GLN 126.A O no hydrogen 2.799 N/A THR 122.A OG1 GLN 126.A O no hydrogen 3.033 N/A GLY 125.A N THR 122.A O no hydrogen 2.694 N/A ILE 127.A N GLN 96.A OE1 no hydrogen 2.943 N/A LYS 128.A N LEU 120.A O no hydrogen 2.848 N/A LYS 128.A NZ PRO 49.A O no hydrogen 3.025 N/A LYS 128.A NZ VAL 51.A O no hydrogen 3.260 N/A LEU 129.A N ASN 50.A O no hydrogen 3.243 N/A ALA 130.A N ASN 118.A O no hydrogen 2.901 N/A TRP 138.A NE1 GLY 175.A O no hydrogen 3.103 N/A TYR 139.A OH GLU 165.A OE1 no hydrogen 2.576 N/A ARG 140.A N LEU 137.A O no hydrogen 3.114 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.748 N/A VAL 144.A N ALA 141.A O no hydrogen 2.943 N/A LEU 145.A N ALA 141.A O no hydrogen 3.123 N/A LEU 146.A N PRO 142.A O no hydrogen 2.897 N/A GLN 147.A N VAL 144.A O no hydrogen 2.918 N/A SER 148.A N GLU 143.A O no hydrogen 2.745 N/A ASP 155.A N THR 152.A O no hydrogen 3.139 N/A LEU 156.A N PRO 153.A O no hydrogen 2.821 N/A TRP 157.A N PRO 153.A O no hydrogen 3.194 N/A SER 158.A N VAL 154.A O no hydrogen 3.450 N/A SER 158.A OG TYR 139.A O no hydrogen 2.970 N/A SER 158.A OG VAL 154.A O no hydrogen 3.402 N/A VAL 159.A N ASP 155.A O no hydrogen 3.054 N/A GLY 160.A N LEU 156.A O no hydrogen 2.937 N/A CYS 161.A N TRP 157.A O no hydrogen 3.066 N/A CYS 161.A SG TRP 138.A O no hydrogen 3.965 N/A CYS 161.A SG TRP 157.A O no hydrogen 3.517 N/A ILE 162.A N SER 158.A O no hydrogen 2.814 N/A PHE 163.A N VAL 159.A O no hydrogen 2.747 N/A ALA 164.A N GLY 160.A O no hydrogen 2.908 N/A GLU 165.A N CYS 161.A O no hydrogen 3.187 N/A MET 166.A N PHE 163.A O no hydrogen 3.128 N/A PHE 167.A N ALA 164.A O no hydrogen 3.042 N/A ARG 168.A N ALA 164.A O no hydrogen 3.040 N/A ARG 168.A NE LYS 170.A O no hydrogen 3.061 N/A ARG 168.A NE PRO 171.A O no hydrogen 3.402 N/A ARG 168.A NH1 PHE 217.A O no hydrogen 2.741 N/A ARG 168.A NH2 PRO 171.A O no hydrogen 3.014 N/A ARG 169.A N GLU 165.A O no hydrogen 2.855 N/A ARG 174.A NH2 PRO 171.A O no hydrogen 3.233 N/A GLY 175.A N GLN 181.A OE1 no hydrogen 2.687 N/A SER 176.A N ASP 180.A OD2 no hydrogen 2.684 N/A SER 176.A OG ASP 180.A OD2 no hydrogen 3.513 N/A ASP 180.A N SER 177.A OG no hydrogen 3.229 N/A GLN 181.A N SER 177.A O no hydrogen 2.622 N/A GLN 181.A NE2 PHE 173.A O no hydrogen 3.260 N/A LEU 182.A N ASP 178.A O no hydrogen 2.936 N/A GLY 183.A N VAL 179.A O no hydrogen 2.932 N/A LYS 184.A N ASP 180.A O no hydrogen 2.835 N/A LYS 184.A NZ ARG 174.A O no hydrogen 3.205 N/A ILE 185.A N GLN 181.A O no hydrogen 3.114 N/A LEU 186.A N LEU 182.A O no hydrogen 3.241 N/A ASP 187.A N GLY 183.A O no hydrogen 3.180 N/A VAL 188.A N ILE 185.A O no hydrogen 2.819 N/A ILE 189.A N ILE 185.A O no hydrogen 3.208 N/A GLY 190.A N LEU 186.A O no hydrogen 2.875 N/A ASP 196.A N GLY 193.A O no hydrogen 2.706 N/A TRP 197.A N GLU 194.A O no hydrogen 2.994 N/A TRP 197.A NE1 LEU 203.A O no hydrogen 2.798 N/A GLN 206.A NE2 GLU 194.A OE1 no hydrogen 3.174 N/A ALA 207.A N PRO 204.A O no hydrogen 2.903 N/A PHE 208.A N ARG 205.A O no hydrogen 3.261 N/A GLN 212.A N VAL 188.A O no hydrogen 3.175 N/A GLN 212.A NE2 ASP 187.A O no hydrogen 3.125 N/A LYS 216.A N PRO 213.A O no hydrogen 3.301 N/A LYS 216.A NZ GLN 212.A OE1 no hydrogen 3.017 N/A PHE 217.A N ILE 214.A O no hydrogen 2.912 N/A VAL 218.A N ILE 214.A O no hydrogen 2.998 N/A LYS 226.A N ASP 222.A O no hydrogen 3.195 N/A ASP 227.A N GLU 223.A O no hydrogen 2.998 N/A LEU 228.A N LEU 224.A O no hydrogen 2.871 N/A LEU 229.A N GLY 225.A O no hydrogen 2.889 N/A LEU 230.A N LYS 226.A O no hydrogen 3.154 N/A LYS 231.A N ASP 227.A O no hydrogen 2.990 N/A LYS 231.A NZ ASP 227.A OD2 no hydrogen 3.367 N/A CYS 232.A N LEU 228.A O no hydrogen 3.016 N/A CYS 232.A SG LEU 228.A O no hydrogen 3.407 N/A LEU 233.A N LEU 229.A O no hydrogen 3.054 N/A THR 234.A OG1 LEU 230.A O no hydrogen 2.858 N/A THR 234.A OG1 LYS 231.A O no hydrogen 3.167 N/A ASN 236.A ND2 ASP 196.A OD1 no hydrogen 2.920 N/A ALA 238.A N ASN 236.A OD1 no hydrogen 3.124 N/A LYS 239.A N ASN 236.A O no hydrogen 2.813 N/A LYS 239.A NZ ASP 196.A OD1 no hydrogen 2.515 N/A ARG 240.A N PRO 237.A O no hydrogen 3.228 N/A ARG 240.A NE THR 234.A O no hydrogen 2.922 N/A ARG 240.A NH1 GLU 143.A OE1 no hydrogen 3.553 N/A ARG 240.A NH1 GLU 143.A OE2 no hydrogen 2.923 N/A ARG 240.A NH1 PRO 153.A O no hydrogen 2.976 N/A ARG 240.A NH2 GLU 143.A OE1 no hydrogen 2.669 N/A ARG 240.A NH2 THR 234.A O no hydrogen 3.156 N/A ARG 240.A NH2 PHE 235.A O no hydrogen 3.343 N/A ILE 241.A N LYS 231.A O no hydrogen 3.179 N/A SER 242.A OG SER 245.A OG no hydrogen 2.705 N/A SER 245.A N SER 242.A OG no hydrogen 3.302 N/A SER 245.A OG SER 242.A OG no hydrogen 2.705 N/A ALA 246.A N SER 242.A O no hydrogen 2.926 N/A LEU 247.A N ALA 243.A O no hydrogen 2.860 N/A SER 248.A N SER 245.A O no hydrogen 3.258 N/A HIS 249.A N ALA 246.A O no hydrogen 3.128 N/A HIS 249.A NE2 ASP 227.A OD2 no hydrogen 2.840 N/A TYR 251.A N HIS 249.A ND1 no hydrogen 2.952 N/A PHE 252.A N HIS 249.A O no hydrogen 2.959 N/A