Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1mqb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 74.A O no hydrogen 2.957 N/A CYS 8.A N HIS 5.A O no hydrogen 2.789 N/A THR 10.A N MET 27.A O no hydrogen 2.807 N/A GLN 12.A N LYS 25.A O no hydrogen 2.867 N/A LYS 13.A N LYS 25.A O no hydrogen 3.457 N/A ILE 15.A N VAL 23.A O no hydrogen 2.915 N/A GLY 18.A N GLY 21.A O no hydrogen 2.960 N/A VAL 23.A N GLY 16.A O no hydrogen 2.974 N/A TYR 24.A N ILE 38.A O no hydrogen 2.990 N/A LYS 25.A N LYS 13.A O no hydrogen 2.771 N/A LYS 25.A NZ GLN 12.A OE1 no hydrogen 2.564 N/A GLY 26.A N VAL 36.A O no hydrogen 2.826 N/A MET 27.A N THR 10.A O no hydrogen 3.077 N/A LEU 28.A N VAL 34.A O no hydrogen 2.923 N/A LYS 29.A N CYS 8.A O no hydrogen 2.698 N/A LYS 31.A NZ THR 30.A O no hydrogen 3.023 N/A LYS 31.A NZ THR 30.A OG1 no hydrogen 3.131 N/A VAL 34.A N LEU 28.A O no hydrogen 2.927 N/A VAL 36.A N GLY 26.A O no hydrogen 3.006 N/A ALA 37.A N THR 85.A O no hydrogen 3.032 N/A ILE 38.A N TYR 24.A O no hydrogen 2.775 N/A LYS 39.A N ILE 83.A O no hydrogen 2.860 N/A THR 40.A N GLU 22.A O no hydrogen 3.104 N/A THR 40.A OG1 GLU 22.A O no hydrogen 2.789 N/A LEU 41.A N MET 81.A O no hydrogen 2.918 N/A LYS 42.A N PHE 20.A O no hydrogen 2.904 N/A TYR 45.A N LYS 42.A O no hydrogen 3.056 N/A THR 46.A N GLN 49.A OE1 no hydrogen 3.022 N/A LYS 48.A NZ ASP 52.A OD1 no hydrogen 2.748 N/A LYS 48.A NZ ASP 52.A OD2 no hydrogen 3.455 N/A GLN 49.A N THR 46.A OG1 no hydrogen 3.136 N/A ARG 50.A N THR 46.A O no hydrogen 3.025 N/A ARG 50.A NH1 GLU 47.A OE2 no hydrogen 3.480 N/A VAL 51.A N GLU 47.A O no hydrogen 2.930 N/A ASP 52.A N LYS 48.A O no hydrogen 2.977 N/A PHE 53.A N GLN 49.A O no hydrogen 2.738 N/A LEU 54.A N ARG 50.A O no hydrogen 2.970 N/A GLY 55.A N VAL 51.A O no hydrogen 2.794 N/A GLU 56.A N ASP 52.A O no hydrogen 3.338 N/A GLY 58.A N LEU 54.A O no hydrogen 3.010 N/A ILE 59.A N GLY 55.A O no hydrogen 2.939 N/A ILE 59.A N GLU 56.A O no hydrogen 3.246 N/A MET 60.A N GLU 56.A O no hydrogen 2.965 N/A GLY 61.A N ALA 57.A O no hydrogen 2.838 N/A GLN 62.A N ILE 59.A O no hydrogen 3.242 N/A PHE 63.A N MET 60.A O no hydrogen 3.165 N/A SER 64.A N TYR 122.A OH no hydrogen 2.891 N/A ASN 67.A N HIS 65.A ND1 no hydrogen 3.252 N/A ILE 68.A N HIS 65.A O no hydrogen 3.066 N/A ILE 69.A N VAL 148.A O no hydrogen 3.103 N/A ARG 70.A N GLU 86.A OE1 no hydrogen 2.973 N/A GLU 72.A N ILE 84.A O no hydrogen 2.669 N/A GLY 73.A N ILE 84.A O no hydrogen 3.309 N/A VAL 74.A N THR 2.A O no hydrogen 2.843 N/A ILE 75.A N MET 82.A O no hydrogen 2.886 N/A SER 76.A N GLU 3.A OE1 no hydrogen 3.246 N/A SER 76.A N GLU 3.A OE2 no hydrogen 3.142 N/A SER 76.A OG GLU 3.A OE1 no hydrogen 2.477 N/A LYS 77.A N GLU 3.A OE2 no hydrogen 3.399 N/A MET 82.A N ILE 75.A O no hydrogen 3.081 N/A ILE 83.A N LYS 39.A O no hydrogen 2.883 N/A ILE 84.A N GLY 73.A O no hydrogen 2.839 N/A THR 85.A N ALA 37.A O no hydrogen 3.049 N/A THR 85.A OG1 GLU 86.A O no hydrogen 3.465 N/A GLU 86.A N ARG 70.A O no hydrogen 3.115 N/A ASN 90.A N VAL 140.A O no hydrogen 2.985 N/A GLY 91.A N MET 88.A O no hydrogen 3.176 N/A LEU 93.A N ILE 138.A O no hydrogen 2.865 N/A LYS 95.A NZ GLU 99.A OE1 no hydrogen 3.248 N/A PHE 96.A N ALA 92.A O no hydrogen 3.006 N/A LEU 97.A N LEU 93.A O no hydrogen 2.939 N/A ARG 98.A N ASP 94.A O no hydrogen 3.265 N/A ARG 98.A N LYS 95.A O no hydrogen 3.211 N/A ARG 98.A NH1 ASP 94.A OD2 no hydrogen 3.228 N/A ARG 98.A NH2 GLY 190.A O no hydrogen 2.846 N/A GLU 99.A N LYS 95.A O no hydrogen 3.161 N/A GLU 103.A N LYS 100.A O no hydrogen 2.906 N/A PHE 104.A N TYR 189.A OH no hydrogen 2.940 N/A SER 105.A N GLN 108.A OE1 no hydrogen 2.871 N/A SER 105.A OG GLN 108.A OE1 no hydrogen 3.320 N/A GLN 108.A N SER 105.A OG no hydrogen 3.093 N/A LEU 109.A N SER 105.A O no hydrogen 3.116 N/A VAL 110.A N VAL 106.A O no hydrogen 3.101 N/A GLY 111.A N LEU 107.A O no hydrogen 2.898 N/A MET 112.A N GLN 108.A O no hydrogen 3.067 N/A LEU 113.A N LEU 109.A O no hydrogen 3.067 N/A ARG 114.A N VAL 110.A O no hydrogen 2.886 N/A GLY 115.A N GLY 111.A O no hydrogen 3.063 N/A ILE 116.A N MET 112.A O no hydrogen 3.079 N/A ALA 117.A N LEU 113.A O no hydrogen 2.910 N/A ALA 118.A N ARG 114.A O no hydrogen 2.840 N/A GLY 119.A N GLY 115.A O no hydrogen 3.094 N/A MET 120.A N ILE 116.A O no hydrogen 2.923 N/A LYS 121.A N ALA 117.A O no hydrogen 2.742 N/A TYR 122.A N ALA 118.A O no hydrogen 2.830 N/A LEU 123.A N GLY 119.A O no hydrogen 2.943 N/A ALA 124.A N MET 120.A O no hydrogen 3.011 N/A ASN 125.A N LYS 121.A O no hydrogen 3.018 N/A MET 126.A N TYR 122.A O no hydrogen 3.063 N/A ASN 127.A N ALA 124.A O no hydrogen 3.237 N/A TYR 128.A N LEU 123.A O no hydrogen 2.901 N/A HIS 130.A N ASP 175.A OD2 no hydrogen 2.916 N/A HIS 130.A NE2 SER 149.A O no hydrogen 3.245 N/A ARG 131.A N ASP 175.A OD1 no hydrogen 3.034 N/A ASP 132.A N HIS 130.A ND1 no hydrogen 3.020 N/A ALA 135.A N GLU 185.A OE2 no hydrogen 2.939 N/A ARG 136.A NH2 ASP 132.A OD2 no hydrogen 3.075 N/A ASN 137.A N ALA 134.A O no hydrogen 2.927 N/A ASN 137.A ND2 ASP 132.A O no hydrogen 2.955 N/A ILE 138.A N ALA 135.A O no hydrogen 3.233 N/A LEU 139.A N LYS 147.A O no hydrogen 2.975 N/A VAL 140.A N GLY 91.A O no hydrogen 2.908 N/A ASN 141.A N VAL 145.A O no hydrogen 3.177 N/A SER 142.A OG GLU 89.A OE2 no hydrogen 3.378 N/A LEU 144.A N ASN 141.A O no hydrogen 2.754 N/A CYS 146.A SG MET 112.A O no hydrogen 3.966 N/A CYS 146.A SG LEU 144.A O no hydrogen 3.778 N/A LYS 147.A N LEU 139.A O no hydrogen 2.852 N/A LYS 147.A NZ HIS 66.A O no hydrogen 2.594 N/A LYS 147.A NZ GLU 86.A OE1 no hydrogen 3.131 N/A LYS 147.A NZ GLU 86.A OE2 no hydrogen 3.045 N/A VAL 148.A N ASN 67.A O no hydrogen 2.958 N/A SER 149.A N ASN 137.A O no hydrogen 2.931 N/A PHE 151.A N GLU 56.A OE2 no hydrogen 3.149 N/A ARG 158.A NE PRO 193.A O no hydrogen 3.403 N/A ARG 158.A NH1 PRO 193.A O no hydrogen 3.546 N/A ARG 158.A NH1 TRP 195.A O no hydrogen 2.843 N/A ARG 158.A NH1 LEU 197.A O no hydrogen 2.735 N/A ARG 158.A NH2 LEU 197.A O no hydrogen 2.785 N/A ARG 158.A NH2 ASN 199.A OD1 no hydrogen 3.405 N/A TRP 159.A NE1 GLU 185.A OE2 no hydrogen 2.839 N/A THR 160.A N ILE 157.A O no hydrogen 2.912 N/A THR 160.A OG1 PRO 156.A O no hydrogen 2.624 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.904 N/A ILE 165.A N ALA 161.A O no hydrogen 3.033 N/A SER 166.A N PRO 162.A O no hydrogen 2.964 N/A SER 166.A OG PRO 162.A O no hydrogen 3.322 N/A TYR 167.A N GLU 163.A O no hydrogen 2.942 N/A ALA 173.A N THR 171.A OG1 no hydrogen 3.075 N/A SER 174.A N THR 171.A OG1 no hydrogen 3.420 N/A ASP 175.A N THR 171.A O no hydrogen 3.174 N/A VAL 176.A N SER 172.A O no hydrogen 3.123 N/A TRP 177.A N ALA 173.A O no hydrogen 3.276 N/A SER 178.A N SER 174.A O no hydrogen 3.324 N/A SER 178.A OG TRP 159.A O no hydrogen 2.560 N/A PHE 179.A N ASP 175.A O no hydrogen 2.868 N/A GLY 180.A N VAL 176.A O no hydrogen 3.047 N/A ILE 181.A N TRP 177.A O no hydrogen 3.289 N/A VAL 182.A N SER 178.A O no hydrogen 2.949 N/A MET 183.A N PHE 179.A O no hydrogen 2.873 N/A TRP 184.A N GLY 180.A O no hydrogen 3.089 N/A TRP 184.A NE1 PRO 213.A O no hydrogen 2.826 N/A GLU 185.A N ILE 181.A O no hydrogen 2.868 N/A VAL 186.A N VAL 182.A O no hydrogen 2.798 N/A MET 187.A N MET 183.A O no hydrogen 2.865 N/A THR 188.A N TRP 184.A O no hydrogen 2.976 N/A THR 188.A OG1 TRP 184.A O no hydrogen 2.657 N/A THR 188.A OG1 GLU 185.A O no hydrogen 3.228 N/A TYR 189.A N VAL 186.A O no hydrogen 3.020 N/A GLY 190.A N GLU 185.A O no hydrogen 2.846 N/A GLU 191.A N THR 188.A OG1 no hydrogen 3.248 N/A ARG 192.A N GLU 191.A OE1 no hydrogen 2.692 N/A ARG 192.A NE TRP 195.A O no hydrogen 2.910 N/A TRP 195.A N ARG 192.A O no hydrogen 2.799 N/A LEU 197.A N TYR 194.A O no hydrogen 2.883 N/A SER 198.A N GLU 201.A OE1 no hydrogen 3.170 N/A GLU 201.A N SER 198.A OG no hydrogen 3.318 N/A VAL 202.A N SER 198.A O no hydrogen 2.919 N/A MET 203.A N ASN 199.A O no hydrogen 3.053 N/A LYS 204.A N HIS 200.A O no hydrogen 2.876 N/A LYS 204.A NZ ASP 208.A OD1 no hydrogen 2.780 N/A ALA 205.A N GLU 201.A O no hydrogen 2.791 N/A ILE 206.A N VAL 202.A O no hydrogen 3.127 N/A ASN 207.A N MET 203.A O no hydrogen 2.930 N/A ASN 207.A ND2 MET 203.A O no hydrogen 3.094 N/A ASP 208.A N LYS 204.A O no hydrogen 2.929 N/A GLY 209.A N ILE 206.A O no hydrogen 3.336 N/A PHE 210.A N ALA 205.A O no hydrogen 3.148 N/A ARG 211.A NE TRP 230.A O no hydrogen 2.789 N/A ARG 211.A NH1 ILE 206.A O no hydrogen 2.910 N/A ARG 211.A NH1 PHE 210.A O no hydrogen 3.002 N/A ARG 211.A NH2 TRP 230.A O no hydrogen 2.889 N/A THR 214.A OG1 PRO 215.A O no hydrogen 2.914 N/A CYS 218.A N PRO 215.A O no hydrogen 3.274 N/A CYS 218.A SG PRO 219.A O no hydrogen 3.540 N/A SER 220.A N THR 259.A O no hydrogen 2.880 N/A TYR 223.A N PRO 219.A O no hydrogen 3.067 N/A TYR 223.A OH LEU 212.A O no hydrogen 3.063 N/A GLN 224.A N SER 220.A O no hydrogen 3.050 N/A LEU 225.A N ALA 221.A O no hydrogen 2.969 N/A MET 226.A N ILE 222.A O no hydrogen 3.098 N/A MET 227.A N TYR 223.A O no hydrogen 3.055 N/A GLN 228.A N GLN 224.A O no hydrogen 2.768 N/A CYS 229.A N LEU 225.A O no hydrogen 2.962 N/A CYS 229.A SG LEU 225.A O no hydrogen 3.215 N/A TRP 230.A N MET 226.A O no hydrogen 3.000 N/A TRP 230.A N MET 227.A O no hydrogen 3.300 N/A GLN 232.A NE2 ASN 207.A OD1 no hydrogen 3.430 N/A ARG 236.A N GLU 233.A O no hydrogen 3.107 N/A ARG 237.A N ARG 234.A O no hydrogen 3.114 N/A ARG 237.A NE GLN 231.A O no hydrogen 2.893 N/A ARG 237.A NH1 GLU 163.A OE1 no hydrogen 3.521 N/A ARG 237.A NH1 GLU 163.A OE2 no hydrogen 2.774 N/A ARG 237.A NH1 ALA 173.A O no hydrogen 3.091 N/A ARG 237.A NH2 GLU 163.A OE1 no hydrogen 2.897 N/A ARG 237.A NH2 GLN 231.A O no hydrogen 3.089 N/A LYS 239.A N ASP 242.A OD2 no hydrogen 3.108 N/A ILE 243.A N LYS 239.A O no hydrogen 3.153 N/A VAL 244.A N PHE 240.A O no hydrogen 2.958 N/A SER 245.A N ALA 241.A O no hydrogen 3.307 N/A ILE 246.A N ASP 242.A O no hydrogen 2.853 N/A LEU 247.A N ILE 243.A O no hydrogen 3.010 N/A ASP 248.A N VAL 244.A O no hydrogen 2.917 N/A LYS 249.A N SER 245.A O no hydrogen 2.995 N/A LEU 250.A N ILE 246.A O no hydrogen 3.205 N/A ILE 251.A N LEU 247.A O no hydrogen 2.903 N/A ARG 252.A N ASP 248.A O no hydrogen 2.851 N/A ALA 253.A N LYS 249.A O no hydrogen 2.910 N/A SER 256.A N ALA 253.A O no hydrogen 2.927 N/A SER 256.A OG LEU 250.A O no hydrogen 3.470 N/A SER 256.A OG ALA 253.A O no hydrogen 2.859 N/A LEU 257.A N PRO 254.A O no hydrogen 2.934 N/A LYS 258.A N ASP 255.A O no hydrogen 3.217 N/A ALA 261.A N CYS 218.A O no hydrogen 2.936 N/A