Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nst_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N THR 1.A OG1 no hydrogen 2.322 N/A CYS 4.A SG TYR 6.A O no hydrogen 3.534 N/A TRP 5.A NE1 ASP 135.A OD2 no hydrogen 2.632 N/A TRP 7.A N LEU 180.A O no hydrogen 2.892 N/A ASP 8.A N ASP 11.A OD2 no hydrogen 3.281 N/A LYS 9.A NZ ASP 230.A OD1 no hydrogen 3.231 N/A LYS 9.A NZ ASP 230.A OD2 no hydrogen 2.890 N/A LEU 12.A N ASP 8.A O no hydrogen 2.925 N/A ALA 13.A N LYS 9.A O no hydrogen 2.982 N/A HIS 14.A N ASP 11.A O no hydrogen 2.922 N/A THR 15.A OG1 GLU 27.A OE1 no hydrogen 2.532 N/A THR 15.A OG1 GLU 27.A OE2 no hydrogen 3.073 N/A GLN 18.A NE2 LEU 12.A O no hydrogen 3.534 N/A GLN 18.A NE2 ALA 13.A O no hydrogen 3.430 N/A LEU 19.A N THR 15.A O no hydrogen 3.202 N/A GLU 20.A N PRO 16.A O no hydrogen 3.182 N/A GLY 21.A N GLN 18.A O no hydrogen 2.868 N/A LEU 22.A N SER 17.A O no hydrogen 3.160 N/A THR 26.A N ASP 23.A OD2 no hydrogen 3.373 N/A THR 26.A OG1 ASP 23.A OD2 no hydrogen 2.443 N/A GLU 27.A N ASP 23.A O no hydrogen 3.091 N/A ALA 28.A N PRO 24.A O no hydrogen 3.080 N/A ARG 29.A N ALA 25.A O no hydrogen 3.039 N/A ARG 29.A NE GLU 33.A OE2 no hydrogen 3.074 N/A TYR 30.A N THR 26.A O no hydrogen 2.969 N/A ARG 31.A N GLU 27.A O no hydrogen 2.928 N/A ARG 31.A NE GLU 27.A OE2 no hydrogen 3.384 N/A ARG 31.A NH1 HIS 60.A ND1 no hydrogen 3.185 N/A ARG 31.A NH1 HIS 60.A O no hydrogen 3.106 N/A ARG 31.A NH2 GLU 27.A OE2 no hydrogen 3.148 N/A ARG 32.A N ALA 28.A O no hydrogen 2.960 N/A GLU 33.A N ARG 29.A O no hydrogen 2.890 N/A GLY 34.A N TYR 30.A O no hydrogen 2.962 N/A ALA 35.A N ARG 31.A O no hydrogen 2.924 N/A ARG 36.A N ARG 32.A O no hydrogen 2.850 N/A PHE 37.A N GLU 33.A O no hydrogen 2.969 N/A ILE 38.A N GLY 34.A O no hydrogen 3.056 N/A PHE 39.A N ALA 35.A O no hydrogen 2.846 N/A ASP 40.A N ARG 36.A O no hydrogen 2.785 N/A VAL 41.A N PHE 37.A O no hydrogen 2.873 N/A GLY 42.A N ILE 38.A O no hydrogen 2.908 N/A THR 43.A N PHE 39.A O no hydrogen 2.944 N/A THR 43.A OG1 PHE 39.A O no hydrogen 2.755 N/A ARG 44.A N ASP 40.A O no hydrogen 3.127 N/A LEU 45.A N VAL 41.A O no hydrogen 3.182 N/A LEU 45.A N GLY 42.A O no hydrogen 3.084 N/A GLY 46.A N THR 43.A O no hydrogen 2.854 N/A LEU 47.A N GLY 42.A O no hydrogen 2.960 N/A THR 51.A OG1 THR 90.A OG1 no hydrogen 2.964 N/A LEU 52.A N HIS 48.A O no hydrogen 3.130 N/A ALA 53.A N TYR 49.A O no hydrogen 3.154 N/A THR 54.A N ASP 50.A O no hydrogen 2.902 N/A THR 54.A OG1 ASP 50.A O no hydrogen 3.036 N/A THR 54.A OG1 GLU 88.A OE2 no hydrogen 2.698 N/A THR 54.A OG1 HIS 140.A NE2 no hydrogen 2.705 N/A GLY 55.A N THR 51.A O no hydrogen 2.923 N/A ILE 56.A N LEU 52.A O no hydrogen 2.916 N/A ILE 57.A N ALA 53.A O no hydrogen 2.800 N/A TYR 58.A N THR 54.A O no hydrogen 2.990 N/A TYR 58.A OH LEU 136.A O no hydrogen 2.754 N/A PHE 59.A N GLY 55.A O no hydrogen 3.132 N/A HIS 60.A N ILE 56.A O no hydrogen 3.040 N/A HIS 60.A NE2 LEU 174.A O no hydrogen 2.643 N/A ARG 61.A N ILE 57.A O no hydrogen 3.059 N/A PHE 62.A N TYR 58.A O no hydrogen 2.787 N/A TYR 63.A N PHE 59.A O no hydrogen 3.318 N/A TYR 63.A OH PHE 71.A O no hydrogen 2.730 N/A TYR 63.A OH THR 76.A OG1 no hydrogen 2.767 N/A MET 64.A N ARG 61.A O no hydrogen 2.904 N/A PHE 65.A N PHE 62.A O no hydrogen 3.065 N/A HIS 66.A N PHE 62.A O no hydrogen 3.054 N/A HIS 66.A NE2 THR 131.A OG1 no hydrogen 2.752 N/A SER 67.A OG GLU 20.A OE1 no hydrogen 2.783 N/A PHE 68.A N SER 17.A OG no hydrogen 2.858 N/A LYS 69.A N SER 67.A OG no hydrogen 2.898 N/A LYS 69.A NZ GLU 20.A O no hydrogen 2.603 N/A GLN 70.A N SER 67.A O no hydrogen 2.927 N/A GLN 70.A NE2 GLU 20.A OE1 no hydrogen 2.846 N/A GLN 70.A NE2 GLU 20.A OE2 no hydrogen 3.244 N/A PHE 71.A N SER 67.A O no hydrogen 2.978 N/A ARG 73.A NE GLU 33.A OE1 no hydrogen 2.882 N/A ARG 73.A NH2 GLU 33.A OE1 no hydrogen 2.888 N/A TYR 74.A N GLN 112.A OE1 no hydrogen 2.919 N/A THR 76.A N PRO 72.A O no hydrogen 3.330 N/A THR 76.A OG1 TYR 63.A OH no hydrogen 2.767 N/A THR 76.A OG1 PRO 72.A O no hydrogen 3.468 N/A GLY 77.A N ARG 73.A O no hydrogen 2.926 N/A ALA 78.A N TYR 74.A O no hydrogen 2.887 N/A CYS 79.A N VAL 75.A O no hydrogen 3.049 N/A CYS 79.A SG VAL 121.A O no hydrogen 3.437 N/A CYS 80.A N THR 76.A O no hydrogen 2.739 N/A CYS 80.A SG THR 76.A O no hydrogen 3.186 N/A LEU 81.A N GLY 77.A O no hydrogen 2.888 N/A PHE 82.A N ALA 78.A O no hydrogen 2.939 N/A LEU 83.A N CYS 79.A O no hydrogen 3.083 N/A ALA 84.A N CYS 80.A O no hydrogen 2.998 N/A GLY 85.A N LEU 81.A O no hydrogen 2.814 N/A LYS 86.A NZ GLU 125.A OE2 no hydrogen 2.790 N/A VAL 87.A N LEU 83.A O no hydrogen 2.992 N/A GLU 88.A N ALA 84.A O no hydrogen 2.923 N/A GLU 89.A N LYS 86.A O no hydrogen 3.129 N/A THR 90.A N GLY 85.A O no hydrogen 2.734 N/A THR 90.A OG1 THR 51.A OG1 no hydrogen 2.964 N/A LYS 92.A NZ LEU 45.A O no hydrogen 3.064 N/A ASP 96.A N LYS 93.A O no hydrogen 2.960 N/A ILE 97.A N LYS 93.A O no hydrogen 3.254 N/A ILE 98.A N CYS 94.A O no hydrogen 2.924 N/A LYS 99.A N LYS 95.A O no hydrogen 2.971 N/A THR 100.A N ASP 96.A O no hydrogen 2.995 N/A THR 100.A OG1 ASP 96.A O no hydrogen 2.803 N/A ALA 101.A N ILE 97.A O no hydrogen 2.973 N/A ARG 102.A N ILE 98.A O no hydrogen 2.820 N/A SER 103.A N LYS 99.A O no hydrogen 3.151 N/A LEU 104.A N THR 100.A O no hydrogen 3.041 N/A LEU 105.A N ALA 101.A O no hydrogen 3.066 N/A ASN 106.A N GLN 109.A OE1 no hydrogen 2.969 N/A GLN 109.A N ASN 106.A OD1 no hydrogen 2.828 N/A PHE 110.A N ASN 106.A O no hydrogen 2.827 N/A GLY 111.A N VAL 108.A O no hydrogen 3.193 N/A GLN 112.A N GLN 109.A O no hydrogen 3.319 N/A PHE 113.A N PHE 110.A O no hydrogen 3.176 N/A GLY 114.A N GLY 111.A O no hydrogen 3.156 N/A GLU 120.A N ASP 116.A O no hydrogen 3.080 N/A VAL 121.A N PRO 117.A O no hydrogen 3.339 N/A MET 122.A N LYS 118.A O no hydrogen 3.091 N/A VAL 123.A N GLU 119.A O no hydrogen 2.945 N/A GLU 125.A N MET 122.A O no hydrogen 3.218 N/A LEU 128.A N LEU 124.A O no hydrogen 2.891 N/A LEU 129.A N GLU 125.A O no hydrogen 3.020 N/A GLN 130.A N ARG 126.A O no hydrogen 3.140 N/A THR 131.A N ILE 127.A O no hydrogen 2.894 N/A THR 131.A OG1 HIS 66.A NE2 no hydrogen 2.752 N/A THR 131.A OG1 ILE 127.A O no hydrogen 2.661 N/A ILE 132.A N LEU 128.A O no hydrogen 3.056 N/A LYS 133.A N GLN 130.A O no hydrogen 3.109 N/A PHE 134.A N LEU 129.A O no hydrogen 3.163 N/A ASP 135.A N ILE 132.A O no hydrogen 3.162 N/A HIS 140.A NE2 THR 54.A OG1 no hydrogen 2.705 N/A TYR 142.A OH ASN 171.A OD1 no hydrogen 2.720 N/A PHE 144.A N PRO 141.A O no hydrogen 2.951 N/A LEU 145.A N PRO 141.A O no hydrogen 2.931 N/A LEU 146.A N TYR 142.A O no hydrogen 3.061 N/A LYS 147.A N GLN 143.A O no hydrogen 3.166 N/A TYR 148.A N PHE 144.A O no hydrogen 2.899 N/A ALA 149.A N LEU 145.A O no hydrogen 2.853 N/A LYS 150.A N LEU 146.A O no hydrogen 3.125 N/A GLN 151.A N TYR 148.A O no hydrogen 3.128 N/A LEU 152.A N ALA 149.A O no hydrogen 3.202 N/A LYS 153.A N TRP 206.A O no hydrogen 2.840 N/A LYS 158.A N ASP 155.A OD1 no hydrogen 3.289 N/A ILE 159.A N ASP 155.A O no hydrogen 3.062 N/A GLN 160.A N LYS 156.A O no hydrogen 2.937 N/A LYS 161.A N ASN 157.A O no hydrogen 3.124 N/A LEU 162.A N LYS 158.A O no hydrogen 2.897 N/A VAL 163.A N ILE 159.A O no hydrogen 3.087 N/A GLN 164.A N GLN 160.A O no hydrogen 2.929 N/A MET 165.A N LYS 161.A O no hydrogen 3.084 N/A ALA 166.A N LEU 162.A O no hydrogen 2.942 N/A TRP 167.A N VAL 163.A O no hydrogen 2.856 N/A THR 168.A N GLN 164.A O no hydrogen 3.182 N/A PHE 169.A N MET 165.A O no hydrogen 3.012 N/A VAL 170.A N ALA 166.A O no hydrogen 2.985 N/A ASN 171.A N TRP 167.A O no hydrogen 3.094 N/A ASP 172.A N THR 168.A O no hydrogen 3.038 N/A SER 173.A N PHE 169.A O no hydrogen 2.905 N/A SER 173.A OG VAL 170.A O no hydrogen 2.571 N/A LEU 174.A N VAL 170.A O no hydrogen 3.236 N/A LEU 174.A N ASN 171.A O no hydrogen 3.317 N/A CYS 175.A N ASP 172.A O no hydrogen 2.970 N/A THR 176.A N SER 173.A O no hydrogen 3.003 N/A THR 176.A OG1 SER 173.A O no hydrogen 2.499 N/A THR 177.A OG1 GLN 181.A OE1 no hydrogen 2.998 N/A LEU 178.A N THR 176.A OG1 no hydrogen 3.158 N/A LEU 180.A N THR 177.A O no hydrogen 2.905 N/A GLN 181.A N LEU 178.A O no hydrogen 3.060 N/A TRP 182.A N LEU 178.A O no hydrogen 3.044 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.775 N/A ILE 186.A N GLU 183.A O no hydrogen 2.974 N/A ILE 187.A N GLU 183.A O no hydrogen 3.253 N/A ALA 188.A N PRO 184.A O no hydrogen 2.915 N/A VAL 189.A N GLU 185.A O no hydrogen 3.219 N/A ALA 190.A N ILE 186.A O no hydrogen 2.892 N/A VAL 191.A N ILE 187.A O no hydrogen 2.969 N/A MET 192.A N ALA 188.A O no hydrogen 3.194 N/A TYR 193.A N VAL 189.A O no hydrogen 2.905 N/A TYR 193.A OH GLU 229.A OE2 no hydrogen 2.396 N/A LEU 194.A N ALA 190.A O no hydrogen 2.814 N/A ALA 195.A N VAL 191.A O no hydrogen 2.934 N/A GLY 196.A N MET 192.A O no hydrogen 2.796 N/A ARG 197.A N TYR 193.A O no hydrogen 3.004 N/A ARG 197.A NH1 GLU 229.A OE1 no hydrogen 3.520 N/A ARG 197.A NH2 GLU 229.A OE1 no hydrogen 2.640 N/A LEU 198.A N LEU 194.A O no hydrogen 3.053 N/A CYS 199.A N ALA 195.A O no hydrogen 2.856 N/A LYS 200.A N ARG 197.A O no hydrogen 3.172 N/A PHE 201.A N GLY 196.A O no hydrogen 2.932 N/A GLN 204.A N GLN 204.A OE1 no hydrogen 2.860 N/A GLU 205.A N GLU 202.A O no hydrogen 2.804 N/A TRP 206.A N ILE 203.A O no hydrogen 2.743 N/A THR 207.A N GLN 204.A O no hydrogen 3.259 N/A THR 207.A OG1 GLN 204.A O no hydrogen 2.627 N/A LYS 209.A N THR 207.A OG1 no hydrogen 3.251 N/A TYR 212.A N LYS 209.A O no hydrogen 2.522 N/A TYR 212.A OH GLU 217.A OE1 no hydrogen 2.772 N/A TRP 216.A NE1 VAL 223.A O no hydrogen 2.791 N/A GLU 217.A N ARG 214.A O no hydrogen 3.198 N/A PHE 219.A N TRP 216.A O no hydrogen 2.732 N/A VAL 220.A N TRP 216.A O no hydrogen 2.994 N/A GLU 229.A N VAL 225.A O no hydrogen 2.950 N/A ASP 230.A N ASP 226.A O no hydrogen 3.009 N/A ILE 231.A N VAL 227.A O no hydrogen 3.188 N/A CYS 232.A N LEU 228.A O no hydrogen 2.924 N/A CYS 232.A SG ALA 190.A O no hydrogen 3.952 N/A CYS 232.A SG LEU 228.A O no hydrogen 3.229 N/A HIS 233.A N GLU 229.A O no hydrogen 2.860 N/A GLN 234.A N ASP 230.A O no hydrogen 3.167 N/A GLN 234.A NE2 ASP 230.A OD1 no hydrogen 3.088 N/A ILE 235.A N ILE 231.A O no hydrogen 3.040 N/A LEU 236.A N CYS 232.A O no hydrogen 2.783 N/A ASP 237.A N HIS 233.A O no hydrogen 2.978 N/A LEU 238.A N ILE 235.A O no hydrogen 3.007 N/A TYR 239.A N LEU 236.A O no hydrogen 2.662 N/A TYR 239.A OH ASP 172.A OD2 no hydrogen 1.706 N/A SER 240.A OG ASP 237.A O no hydrogen 3.506 N/A LYS 243.A N SER 240.A O no hydrogen 3.270 N/A LYS 243.A NZ ASP 237.A O no hydrogen 2.441 N/A LYS 243.A NZ SER 240.A O no hydrogen 2.291 N/A LYS 243.A NZ SER 240.A OG no hydrogen 2.299 N/A