Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8six_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N LEU 18.A O no hydrogen 2.953 N/A GLN 6.A NE2 THR 7.A O no hydrogen 2.947 N/A LEU 8.A N VAL 16.A O no hydrogen 2.973 N/A GLY 9.A N VAL 16.A O no hydrogen 3.347 N/A GLY 11.A N GLY 14.A O no hydrogen 3.373 N/A GLU 15.A N ILE 32.A O no hydrogen 3.177 N/A VAL 16.A N GLY 9.A O no hydrogen 2.818 N/A GLN 17.A N VAL 30.A O no hydrogen 2.792 N/A GLN 17.A NE2 GLU 15.A OE1 no hydrogen 2.817 N/A LEU 18.A N GLN 6.A O no hydrogen 2.742 N/A ALA 19.A N VAL 28.A O no hydrogen 2.818 N/A VAL 20.A N ASP 3.A O no hydrogen 3.475 N/A ASN 21.A N GLU 26.A O no hydrogen 2.837 N/A ARG 22.A N ASP 1.A O no hydrogen 2.982 N/A VAL 23.A N ASN 21.A OD1 no hydrogen 2.944 N/A THR 24.A N ASN 21.A OD1 no hydrogen 2.980 N/A THR 24.A OG1 ASN 21.A OD1 no hydrogen 3.266 N/A GLU 25.A N ASN 21.A O no hydrogen 2.963 N/A VAL 28.A N ALA 19.A O no hydrogen 2.791 N/A ALA 29.A N MET 71.A O no hydrogen 3.150 N/A VAL 30.A N GLN 17.A O no hydrogen 2.827 N/A LYS 31.A N LEU 69.A O no hydrogen 2.880 N/A LYS 31.A NZ GLU 42.A OE1 no hydrogen 2.893 N/A LYS 31.A NZ GLU 42.A OE2 no hydrogen 3.032 N/A ILE 32.A N GLU 15.A O no hydrogen 2.818 N/A VAL 33.A N GLN 67.A O no hydrogen 2.912 N/A LYS 40.A N PRO 36.A O no hydrogen 3.390 N/A LYS 41.A N GLU 37.A O no hydrogen 3.318 N/A LYS 41.A NZ THR 140.A OG1 no hydrogen 2.815 N/A GLU 42.A N ASN 38.A O no hydrogen 2.887 N/A ILE 43.A N ILE 39.A O no hydrogen 2.956 N/A CYS 44.A N LYS 40.A O no hydrogen 3.183 N/A ILE 45.A N LYS 41.A O no hydrogen 3.058 N/A LEU 46.A N GLU 42.A O no hydrogen 2.953 N/A LYS 47.A N ILE 43.A O no hydrogen 3.105 N/A MET 48.A N ILE 45.A O no hydrogen 3.106 N/A ASN 50.A N TYR 107.A OH no hydrogen 2.744 N/A GLU 52.A N GLU 52.A OE2 no hydrogen 2.832 N/A ASN 53.A N HIS 51.A ND1 no hydrogen 2.910 N/A ASN 53.A ND2 LEU 131.A O no hydrogen 3.048 N/A VAL 54.A N HIS 51.A O no hydrogen 3.320 N/A ILE 55.A N ILE 133.A O no hydrogen 3.136 N/A LYS 56.A N GLU 72.A OE2 no hydrogen 3.079 N/A TYR 58.A N PHE 70.A O no hydrogen 2.866 N/A ARG 61.A N TYR 68.A O no hydrogen 3.229 N/A ARG 61.A NH1 HIS 60.A O no hydrogen 3.363 N/A GLU 63.A N ILE 66.A O no hydrogen 2.901 N/A ILE 66.A N GLU 63.A O no hydrogen 3.035 N/A GLN 67.A N VAL 33.A O no hydrogen 2.778 N/A TYR 68.A N ARG 61.A O no hydrogen 2.976 N/A LEU 69.A N LYS 31.A O no hydrogen 2.934 N/A PHE 70.A N GLY 59.A O no hydrogen 2.918 N/A MET 71.A N ALA 29.A O no hydrogen 2.890 N/A GLU 72.A N LYS 56.A O no hydrogen 2.820 N/A GLY 76.A N LEU 125.A O no hydrogen 2.827 N/A GLY 77.A N ALA 74.A O no hydrogen 3.214 N/A LEU 79.A N LEU 123.A O no hydrogen 2.830 N/A PHE 80.A N PRO 120.A O no hydrogen 3.171 N/A ASP 81.A N SER 78.A O no hydrogen 3.182 N/A ASP 81.A N SER 78.A OG no hydrogen 3.336 N/A ARG 82.A N LEU 79.A O no hydrogen 2.928 N/A ARG 82.A NH1 GLY 76.A O no hydrogen 3.012 N/A ARG 82.A NH1 ASP 129.A OD1 no hydrogen 3.038 N/A ARG 82.A NH2 ASP 129.A OD1 no hydrogen 2.734 N/A ARG 82.A NH2 ASP 129.A OD2 no hydrogen 3.341 N/A ILE 83.A N PHE 80.A O no hydrogen 3.311 N/A GLU 84.A N GLY 88.A O no hydrogen 2.809 N/A ASP 86.A N GLY 191.A O no hydrogen 2.801 N/A ILE 87.A N GLU 84.A O no hydrogen 2.966 N/A GLY 88.A N GLU 84.A O no hydrogen 2.793 N/A ALA 94.A N PRO 90.A O no hydrogen 3.121 N/A GLN 95.A N GLU 91.A O no hydrogen 2.812 N/A GLN 95.A NE2 TRP 251.A O no hydrogen 2.807 N/A GLN 95.A NE2 LYS 254.A O no hydrogen 2.776 N/A ARG 96.A N PRO 92.A O no hydrogen 3.104 N/A ARG 96.A NH1 ARG 128.A O no hydrogen 3.208 N/A ARG 96.A NH1 ASP 129.A O no hydrogen 3.456 N/A ARG 96.A NH2 ASP 129.A O no hydrogen 2.901 N/A PHE 97.A N ASP 93.A O no hydrogen 3.021 N/A PHE 98.A N ALA 94.A O no hydrogen 2.885 N/A HIS 99.A N GLN 95.A O no hydrogen 2.819 N/A HIS 99.A NE2 TYR 252.A O no hydrogen 2.713 N/A GLN 100.A N ARG 96.A O no hydrogen 2.979 N/A LEU 101.A N PHE 97.A O no hydrogen 2.886 N/A MET 102.A N PHE 98.A O no hydrogen 2.927 N/A ALA 103.A N HIS 99.A O no hydrogen 3.029 N/A GLY 104.A N GLN 100.A O no hydrogen 2.979 N/A VAL 105.A N LEU 101.A O no hydrogen 2.852 N/A VAL 106.A N MET 102.A O no hydrogen 2.771 N/A TYR 107.A N ALA 103.A O no hydrogen 3.113 N/A TYR 107.A OH MET 48.A O no hydrogen 3.334 N/A LEU 108.A N GLY 104.A O no hydrogen 3.032 N/A HIS 109.A N VAL 105.A O no hydrogen 2.815 N/A HIS 109.A NE2 ASP 177.A OD2 no hydrogen 2.777 N/A GLY 110.A N VAL 106.A O no hydrogen 2.785 N/A ILE 111.A N TYR 107.A O no hydrogen 3.172 N/A ILE 111.A N LEU 108.A O no hydrogen 3.066 N/A GLY 112.A N HIS 109.A O no hydrogen 3.115 N/A ILE 113.A N LEU 108.A O no hydrogen 2.981 N/A THR 114.A N THR 140.A O no hydrogen 2.964 N/A THR 114.A OG1 ASP 177.A OD2 no hydrogen 2.700 N/A HIS 115.A N ASP 177.A OD2 no hydrogen 3.249 N/A HIS 115.A NE2 ALA 134.A O no hydrogen 2.811 N/A ARG 116.A N ASP 177.A OD1 no hydrogen 3.119 N/A ARG 116.A NE LEU 138.A O no hydrogen 2.753 N/A ARG 116.A NH2 LEU 138.A O no hydrogen 3.068 N/A ASP 117.A N HIS 115.A ND1 no hydrogen 3.059 N/A LYS 119.A N ASN 122.A OD1 no hydrogen 3.149 N/A LYS 119.A NZ THR 157.A OG1 no hydrogen 2.819 N/A ASN 122.A N LYS 119.A O no hydrogen 3.093 N/A ASN 122.A ND2 ASP 117.A O no hydrogen 2.909 N/A LEU 124.A N LYS 132.A O no hydrogen 2.922 N/A LEU 125.A N GLY 77.A O no hydrogen 2.774 N/A ASP 126.A N ASN 130.A O no hydrogen 3.030 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.813 N/A ARG 128.A N ASP 126.A OD1 no hydrogen 3.042 N/A ASP 129.A N ASP 126.A O no hydrogen 3.243 N/A ASN 130.A N ASP 126.A OD1 no hydrogen 2.790 N/A LEU 131.A N GLN 100.A OE1 no hydrogen 2.793 N/A LYS 132.A N LEU 124.A O no hydrogen 2.734 N/A LYS 132.A NZ GLU 52.A O no hydrogen 3.085 N/A ILE 133.A N ASN 53.A O no hydrogen 2.970 N/A ALA 134.A N ASN 122.A O no hydrogen 2.771 N/A TYR 136.A OH ILE 133.A O no hydrogen 2.809 N/A SER 137.A OG ASP 135.A OD1 no hydrogen 2.825 N/A ALA 139.A N TYR 136.A O no hydrogen 3.298 N/A THR 140.A N THR 114.A O no hydrogen 3.088 N/A PHE 142.A N GLY 112.A O no hydrogen 2.843 N/A ARG 143.A N GLY 112.A O no hydrogen 3.368 N/A ARG 143.A NH1 HIS 109.A O no hydrogen 2.760 N/A ARG 143.A NH2 HIS 109.A O no hydrogen 3.236 N/A TYR 144.A N ARG 147.A O no hydrogen 3.046 N/A ARG 147.A N TYR 144.A O no hydrogen 2.936 N/A ARG 149.A N PHE 142.A O no hydrogen 2.797 N/A LEU 151.A N PHE 171.A O no hydrogen 2.866 N/A THR 157.A OG1 ASP 117.A OD1 no hydrogen 2.713 N/A TYR 160.A N THR 157.A O no hydrogen 2.838 N/A VAL 161.A N LEU 158.A O no hydrogen 3.315 N/A GLU 164.A N GLU 164.A OE2 no hydrogen 2.814 N/A LEU 165.A N ALA 162.A O no hydrogen 3.244 N/A LEU 166.A N PRO 163.A O no hydrogen 3.092 N/A LYS 167.A N GLU 164.A O no hydrogen 3.141 N/A LYS 167.A NZ GLU 235.A OE2 no hydrogen 3.269 N/A ARG 168.A N GLU 164.A O no hydrogen 2.765 N/A PHE 171.A N LEU 151.A O no hydrogen 3.041 N/A HIS 172.A ND1 GLU 148.A OE1 no hydrogen 2.767 N/A VAL 176.A N ALA 173.A O no hydrogen 3.233 N/A ASP 177.A N ALA 173.A O no hydrogen 3.434 N/A VAL 178.A N GLU 174.A O no hydrogen 3.063 N/A TRP 179.A N PRO 175.A O no hydrogen 2.962 N/A SER 180.A N VAL 176.A O no hydrogen 3.137 N/A SER 180.A OG ASP 177.A O no hydrogen 2.890 N/A CYS 181.A N ASP 177.A O no hydrogen 3.093 N/A CYS 181.A SG ASP 177.A O no hydrogen 3.254 N/A GLY 182.A N VAL 178.A O no hydrogen 3.088 N/A ILE 183.A N TRP 179.A O no hydrogen 3.146 N/A VAL 184.A N SER 180.A O no hydrogen 2.887 N/A LEU 185.A N CYS 181.A O no hydrogen 2.945 N/A THR 186.A N GLY 182.A O no hydrogen 2.931 N/A THR 186.A OG1 GLY 182.A O no hydrogen 3.004 N/A ALA 187.A N ILE 183.A O no hydrogen 2.938 N/A MET 188.A N VAL 184.A O no hydrogen 2.866 N/A LEU 189.A N LEU 185.A O no hydrogen 3.008 N/A LEU 189.A N THR 186.A O no hydrogen 3.137 N/A ALA 190.A N THR 186.A O no hydrogen 2.845 N/A GLY 191.A N ALA 187.A O no hydrogen 2.787 N/A GLN 197.A NE2 SER 199.A OG no hydrogen 2.805 N/A SER 199.A N GLN 197.A O no hydrogen 2.948 N/A SER 199.A OG SER 201.A OG no hydrogen 3.236 N/A SER 201.A OG SER 199.A OG no hydrogen 3.236 N/A CYS 202.A N SER 199.A O no hydrogen 2.945 N/A CYS 202.A SG GLN 197.A O no hydrogen 3.477 N/A CYS 202.A SG GLU 204.A OE1 no hydrogen 3.850 N/A TYR 205.A N CYS 202.A O no hydrogen 3.018 N/A TYR 205.A OH GLU 235.A OE2 no hydrogen 2.892 N/A SER 206.A N CYS 202.A O no hydrogen 3.104 N/A SER 206.A OG CYS 202.A O no hydrogen 3.458 N/A ASP 207.A N GLN 203.A O no hydrogen 2.811 N/A TRP 208.A N GLU 204.A O no hydrogen 3.149 N/A TRP 208.A NE1 LEU 233.A O no hydrogen 2.931 N/A LYS 209.A N TYR 205.A O no hydrogen 3.088 N/A LYS 209.A NZ ASP 200.A OD1 no hydrogen 2.780 N/A LYS 209.A NZ ASP 200.A OD2 no hydrogen 3.560 N/A LYS 209.A NZ GLU 235.A OE1 no hydrogen 3.244 N/A LYS 209.A NZ GLU 235.A OE2 no hydrogen 2.992 N/A GLU 210.A N SER 206.A O no hydrogen 3.029 N/A LYS 211.A N TRP 208.A O no hydrogen 2.930 N/A LYS 212.A N ASP 207.A O no hydrogen 3.084 N/A LYS 212.A NZ ASP 207.A OD1 no hydrogen 3.365 N/A LYS 212.A NZ GLU 210.A OE2 no hydrogen 3.455 N/A THR 213.A N LYS 211.A O no hydrogen 2.853 N/A LEU 215.A N LYS 212.A O no hydrogen 3.251 N/A LYS 219.A N LEU 215.A O no hydrogen 3.120 N/A LYS 220.A N PRO 217.A O no hydrogen 3.044 N/A LYS 220.A NZ ASP 86.A O no hydrogen 2.851 N/A LYS 220.A NZ ASP 86.A OD1 no hydrogen 2.924 N/A LYS 220.A NZ ALA 190.A O no hydrogen 2.908 N/A LYS 220.A NZ GLU 192.A OE2 no hydrogen 2.962 N/A ILE 221.A N TRP 218.A O no hydrogen 2.939 N/A LEU 226.A N ASP 222.A O no hydrogen 3.035 N/A ALA 227.A N SER 223.A O no hydrogen 2.878 N/A LEU 228.A N ALA 224.A O no hydrogen 3.354 N/A LEU 229.A N PRO 225.A O no hydrogen 2.968 N/A HIS 230.A N LEU 226.A O no hydrogen 2.955 N/A LYS 231.A N LEU 228.A O no hydrogen 2.903 N/A LYS 231.A NZ ASP 249.A OD1 no hydrogen 2.782 N/A ILE 232.A N LEU 228.A O no hydrogen 3.014 N/A LEU 233.A N LEU 229.A O no hydrogen 2.888 N/A SER 238.A N ASN 236.A OD1 no hydrogen 3.374 N/A SER 238.A OG ASN 236.A OD1 no hydrogen 3.006 N/A ALA 239.A N ASN 236.A O no hydrogen 2.975 N/A ARG 240.A N ASN 236.A O no hydrogen 3.211 N/A ARG 240.A NE VAL 234.A O no hydrogen 2.985 N/A ARG 240.A NH1 GLU 164.A OE1 no hydrogen 3.517 N/A ARG 240.A NH1 GLU 164.A OE2 no hydrogen 2.749 N/A ARG 240.A NH1 VAL 234.A O no hydrogen 3.029 N/A ARG 240.A NH1 GLU 235.A O no hydrogen 3.219 N/A ARG 240.A NH2 GLU 164.A OE1 no hydrogen 2.842 N/A ARG 240.A NH2 PRO 175.A O no hydrogen 2.806 N/A ILE 241.A N LYS 231.A O no hydrogen 3.253 N/A ILE 246.A N THR 242.A O no hydrogen 2.954 N/A LYS 247.A N ILE 243.A O no hydrogen 3.028 N/A LYS 248.A N ASP 245.A O no hydrogen 2.911 N/A LYS 248.A NZ ASP 245.A OD1 no hydrogen 3.205 N/A ASP 249.A N ILE 246.A O no hydrogen 3.066 N/A TRP 251.A NE1 GLU 91.A OE1 no hydrogen 2.924 N/A TYR 252.A N ASP 249.A OD2 no hydrogen 2.922 N/A ASN 253.A N ASP 249.A O no hydrogen 3.007 N/A ASN 253.A N ARG 250.A O no hydrogen 3.228 N/A ASN 253.A ND2 LYS 247.A O no hydrogen 2.833 N/A ASN 253.A ND2 ASP 249.A O no hydrogen 2.958 N/A LYS 254.A N TRP 251.A O no hydrogen 2.981 N/A