Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k0x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ILE 31.A O no hydrogen 3.115 N/A GLY 5.A N LEU 33.A O no hydrogen 3.016 N/A ASN 7.A ND2 HIS 6.A O no hydrogen 2.452 N/A ILE 10.A N ASN 7.A OD1 no hydrogen 2.659 N/A HIS 11.A N ASN 7.A O no hydrogen 3.057 N/A GLN 12.A N GLN 8.A O no hydrogen 3.033 N/A TYR 13.A N VAL 9.A O no hydrogen 2.930 N/A PHE 14.A N ILE 10.A O no hydrogen 3.264 N/A ASP 15.A N HIS 11.A O no hydrogen 3.117 N/A GLU 16.A N GLN 12.A O no hydrogen 2.943 N/A LYS 17.A N PHE 14.A O no hydrogen 3.086 N/A LYS 17.A NZ GLU 230.A OE2 no hydrogen 2.774 N/A ASN 18.A N.A ASP 15.A O no hydrogen 2.819 N/A ASN 18.A N.B ASP 15.A O no hydrogen 2.801 N/A THR 19.A OG1 GLU 218.A O no hydrogen 2.696 N/A SER 20.A N THR 19.A OG1 no hydrogen 2.851 N/A GLY 21.A N ASN 36.A OD1 no hydrogen 2.872 N/A VAL 22.A N ASN 216.A O no hydrogen 2.878 N/A LEU 23.A N TYR 34.A O no hydrogen 2.811 N/A VAL 24.A N ALA 214.A O no hydrogen 2.830 N/A ILE 25.A N ASN 32.A O no hydrogen 2.862 N/A GLN 26.A N ALA 212.A O no hydrogen 2.848 N/A GLN 26.A NE2 GLU 148.A OE1.A no hydrogen 3.146 N/A THR 27.A N LYS 30.A O no hydrogen 2.914 N/A THR 27.A OG1 LYS 30.A O no hydrogen 3.451 N/A LYS 29.A N THR 27.A OG1 no hydrogen 3.249 N/A LYS 30.A N THR 27.A OG1 no hydrogen 3.040 N/A ASN 32.A N ILE 25.A O no hydrogen 2.893 N/A LEU 33.A N VAL 3.A O no hydrogen 2.823 N/A TYR 34.A N LEU 23.A O no hydrogen 2.843 N/A ASN 36.A ND2 ASP 15.A OD1 no hydrogen 2.880 N/A ASN 36.A ND2 THR 19.A O no hydrogen 2.791 N/A ALA 37.A N GLY 21.A O no hydrogen 3.063 N/A ARG 40.A N ALA 37.A O no hydrogen 3.042 N/A ARG 40.A NE ASN 216.A OD1 no hydrogen 2.905 N/A ARG 40.A NH2 ASN 216.A OD1 no hydrogen 2.848 N/A ALA 41.A N LEU 38.A O no hydrogen 3.116 N/A THR 43.A N ARG 40.A O no hydrogen 3.045 N/A THR 43.A OG1 SER 39.A O no hydrogen 2.788 N/A TYR 45.A N VAL 141.A O no hydrogen 2.924 N/A ALA 48.A N TRP 134.A O no hydrogen 2.745 N/A SER 49.A OG SER 95.A OG no hydrogen 3.091 N/A THR 50.A N PRO 47.A O no hydrogen 3.257 N/A THR 50.A OG1 PRO 47.A O no hydrogen 2.689 N/A THR 50.A OG1 GLU 146.A OE1 no hydrogen 2.652 N/A THR 50.A OG1 GLU 146.A OE2 no hydrogen 3.410 N/A PHE 51.A N ALA 48.A O no hydrogen 3.024 N/A ASN 54.A N PHE 51.A O no hydrogen 2.859 N/A ASN 54.A ND2 TYR 100.A O no hydrogen 3.137 N/A LEU 56.A N MET 52.A O no hydrogen 3.163 N/A ILE 57.A N LEU 53.A O no hydrogen 2.944 N/A GLY 58.A N ASN 54.A O no hydrogen 2.848 N/A LEU 59.A N ALA 55.A O no hydrogen 2.892 N/A GLU 60.A N LEU 56.A O no hydrogen 2.848 N/A ASN 61.A N ILE 57.A O no hydrogen 3.133 N/A ASN 61.A ND2 ILE 57.A O no hydrogen 2.928 N/A ASN 61.A ND2 GLU 115.A OE2 no hydrogen 2.859 N/A GLN 62.A N LEU 59.A O no hydrogen 3.118 N/A LYS 63.A N GLY 58.A O no hydrogen 2.918 N/A THR 64.A OG1 ASP 65.A O.A no hydrogen 3.456 N/A THR 64.A OG1 ASP 65.A O.B no hydrogen 3.466 N/A THR 64.A OG1 GLU 68.A OE1 no hydrogen 2.742 N/A ASP 65.A N.A THR 64.A OG1 no hydrogen 2.767 N/A ASN 67.A N ASP 65.A OD1.A no hydrogen 2.873 N/A ASN 67.A N ASP 65.A OD1.B no hydrogen 2.920 N/A GLU 68.A N ASP 65.A O.A no hydrogen 3.247 N/A GLU 68.A N ASP 65.A O.B no hydrogen 3.239 N/A PHE 70.A N MET 86.A O no hydrogen 2.777 N/A TRP 72.A N ASP 85.A OD1 no hydrogen 2.963 N/A TRP 72.A NE1 GLU 75.A O no hydrogen 2.732 N/A ARG 77.A N GLU 83.A OE2.B no hydrogen 2.591 N/A ARG 77.A NH1 TRP 82.A O no hydrogen 2.789 N/A TRP 82.A N PHE 79.A O no hydrogen 3.051 N/A TRP 82.A NE1 LEU 94.A O no hydrogen 3.015 N/A GLU 83.A N THR 80.A O no hydrogen 3.268 N/A MET 86.A N PHE 70.A O no hydrogen 3.033 N/A THR 87.A N GLU 90.A OE1 no hydrogen 2.973 N/A GLU 90.A N THR 87.A OG1 no hydrogen 3.103 N/A ALA 91.A N THR 87.A O no hydrogen 2.972 N/A MET 92.A N LEU 88.A O no hydrogen 2.956 N/A MET 92.A N GLY 89.A O no hydrogen 3.146 N/A LYS 93.A N GLY 89.A O no hydrogen 3.373 N/A LYS 93.A N GLU 90.A O no hydrogen 3.243 N/A LEU 94.A N GLU 90.A O no hydrogen 3.179 N/A SER 95.A N MET 92.A O no hydrogen 3.071 N/A ALA 96.A N ALA 91.A O no hydrogen 2.861 N/A VAL 99.A N ALA 96.A O no hydrogen 3.112 N/A TYR 100.A OH LEU 88.A O no hydrogen 2.814 N/A GLN 101.A N VAL 97.A O no hydrogen 2.766 N/A GLN 101.A NE2 ASP 131.A O no hydrogen 2.863 N/A GLU 102.A N PRO 98.A O no hydrogen 2.964 N/A LEU 103.A N VAL 99.A O no hydrogen 2.910 N/A ALA 104.A N TYR 100.A O no hydrogen 2.901 N/A ARG 105.A N.A GLN 101.A O no hydrogen 3.019 N/A ARG 105.A N.B GLN 101.A O no hydrogen 3.002 N/A ARG 105.A NE.A ASP 131.A OD2 no hydrogen 2.766 N/A ARG 105.A NH1.A ASP 131.A OD2 no hydrogen 2.987 N/A ARG 105.A NH2.B ASP 131.A OD2 no hydrogen 3.036 N/A ARG 106.A N GLU 102.A O no hydrogen 3.115 N/A ARG 106.A NH1 LYS 63.A O no hydrogen 2.809 N/A ARG 106.A NH1 GLU 68.A OE1 no hydrogen 2.889 N/A ARG 106.A NH1 GLU 68.A OE2 no hydrogen 3.197 N/A ARG 106.A NH2 GLU 68.A OE2 no hydrogen 2.812 N/A ARG 106.A NH2 GLU 102.A OE2 no hydrogen 2.974 N/A ILE 107.A N LEU 103.A O no hydrogen 2.937 N/A GLY 108.A N ALA 104.A O no hydrogen 2.878 N/A MET 112.A N GLY 108.A O no hydrogen 3.019 N/A GLN 113.A N LEU 109.A O no hydrogen 2.900 N/A GLN 113.A NE2 GLN 113.A O no hydrogen 2.953 N/A GLN 113.A NE2 ALA 124.A O no hydrogen 2.744 N/A LYS 114.A N ASP 110.A O no hydrogen 3.014 N/A GLU 115.A N LEU 111.A O no hydrogen 2.905 N/A VAL 116.A N MET 112.A O no hydrogen 2.910 N/A LYS 117.A N GLN 113.A O no hydrogen 2.928 N/A ARG 118.A N LYS 114.A O no hydrogen 2.882 N/A ARG 118.A NE GLU 115.A OE1 no hydrogen 3.145 N/A ARG 118.A NH1 PRO 159.A O no hydrogen 2.895 N/A ARG 118.A NH2 GLU 115.A OE1 no hydrogen 2.822 N/A ARG 118.A NH2 PRO 159.A O no hydrogen 3.029 N/A ILE 119.A N GLU 115.A O no hydrogen 2.939 N/A GLY 120.A N VAL 116.A O no hydrogen 2.880 N/A PHE 121.A N VAL 116.A O no hydrogen 3.294 N/A ASN 123.A N LYS 140.A O no hydrogen 2.825 N/A ASN 123.A ND2 PRO 138.A O no hydrogen 2.998 N/A ALA 124.A N PHE 121.A O no hydrogen 2.887 N/A GLU 125.A N ASN 123.A OD1 no hydrogen 3.046 N/A ILE 126.A N GLN 113.A OE1 no hydrogen 3.064 N/A GLY 127.A N GLU 125.A OE2.A no hydrogen 2.859 N/A GLN 129.A NE2 ASP 131.A OD1 no hydrogen 2.832 N/A LEU 135.A N ASN 132.A O no hydrogen 2.945 N/A VAL 136.A N ASN 132.A O no hydrogen 3.378 N/A LYS 140.A N ASN 123.A OD1 no hydrogen 3.170 N/A VAL 141.A N TYR 45.A O no hydrogen 2.826 N/A THR 142.A N GLN 145.A OE1 no hydrogen 2.905 N/A THR 142.A OG1 GLN 145.A OE1 no hydrogen 3.468 N/A ILE 144.A N ALA 41.A O no hydrogen 3.138 N/A GLN 145.A N THR 142.A OG1 no hydrogen 2.912 N/A GLN 145.A NE2 GLY 122.A O no hydrogen 3.680 N/A GLU 146.A N THR 142.A O no hydrogen 2.854 N/A VAL 147.A N PRO 143.A O no hydrogen 2.916 N/A GLU 148.A N ILE 144.A O no hydrogen 3.119 N/A PHE 149.A N GLN 145.A O no hydrogen 2.988 N/A VAL 150.A N GLU 146.A O no hydrogen 2.985 N/A SER 151.A N VAL 147.A O no hydrogen 2.860 N/A GLN 152.A N GLU 148.A O no hydrogen 2.975 N/A LEU 153.A N PHE 149.A O no hydrogen 2.943 N/A ALA 154.A N VAL 150.A O no hydrogen 2.883 N/A HIS 155.A N SER 151.A O no hydrogen 3.044 N/A HIS 155.A N GLN 152.A O no hydrogen 3.222 N/A HIS 155.A ND1 SER 151.A O no hydrogen 2.896 N/A THR 156.A N LEU 153.A O no hydrogen 2.999 N/A GLN 157.A N GLN 152.A O no hydrogen 2.783 N/A LEU 158.A N GLN 165.A OE1 no hydrogen 3.102 N/A PHE 160.A N LEU 158.A O no hydrogen 2.884 N/A SER 161.A N GLU 60.A OE1 no hydrogen 2.794 N/A VAL 164.A N SER 161.A OG no hydrogen 2.980 N/A GLN 165.A N SER 161.A O no hydrogen 2.988 N/A GLN 165.A NE2 LEU 158.A O no hydrogen 2.974 N/A GLN 165.A NE2 PHE 160.A O no hydrogen 2.948 N/A GLN 165.A NE2 SER 161.A O no hydrogen 3.602 N/A ALA 166.A N GLU 162.A O no hydrogen 2.917 N/A ASN 167.A N LYS 163.A O no hydrogen 2.846 N/A VAL 168.A N VAL 164.A O no hydrogen 2.973 N/A LYS 169.A N GLN 165.A O no hydrogen 2.917 N/A LYS 169.A NZ ALA 154.A O no hydrogen 3.096 N/A ASN 170.A N ALA 166.A O no hydrogen 2.969 N/A MET 171.A N VAL 168.A O no hydrogen 2.923 N/A LEU 172.A N LYS 169.A O no hydrogen 2.993 N/A LEU 174.A N ILE 182.A O no hydrogen 2.840 N/A GLU 175.A N ILE 182.A O no hydrogen 3.264 N/A GLU 176.A N GLU 175.A OE1 no hydrogen 2.959 N/A SER 177.A N TYR 180.A O no hydrogen 2.896 N/A TYR 180.A N SER 177.A O no hydrogen 2.876 N/A LYS 181.A N GLU 204.A O no hydrogen 2.993 N/A ILE 182.A N GLU 175.A O no hydrogen 2.882 N/A PHE 183.A N TRP 202.A O no hydrogen 2.838 N/A GLY 184.A N LEU 172.A O no hydrogen 2.837 N/A LYS 185.A N THR 200.A O no hydrogen 2.832 N/A LYS 185.A NZ SER 95.A OG no hydrogen 2.937 N/A LYS 185.A NZ THR 186.A O no hydrogen 2.869 N/A LYS 185.A NZ THR 186.A OG1 no hydrogen 3.421 N/A GLY 187.A N TRP 198.A O no hydrogen 2.975 N/A TRP 188.A NE1 GLN 195.A OE1 no hydrogen 2.737 N/A ALA 189.A N VAL 196.A O no hydrogen 2.851 N/A GLN 195.A NE2 SER 221.A OG no hydrogen 3.100 N/A VAL 196.A N ALA 189.A O no hydrogen 3.388 N/A GLY 197.A N MET 217.A O no hydrogen 2.780 N/A TRP 198.A N GLY 187.A O no hydrogen 2.772 N/A TRP 198.A NE1 VAL 46.A O no hydrogen 2.803 N/A LEU 199.A N LEU 215.A O no hydrogen 2.950 N/A THR 200.A N LYS 185.A O no hydrogen 3.098 N/A THR 200.A OG1 GLU 146.A OE2 no hydrogen 2.826 N/A GLY 201.A N PHE 213.A O no hydrogen 2.880 N/A TRP 202.A N PHE 183.A O no hydrogen 2.869 N/A TRP 202.A NE1 GLU 204.A OE1.B no hydrogen 2.957 N/A VAL 203.A N VAL 211.A O no hydrogen 2.813 N/A GLU 204.A N LYS 181.A O no hydrogen 2.864 N/A GLN 205.A N LYS 209.A O no hydrogen 2.836 N/A GLN 205.A NE2 ILE 241.A O no hydrogen 2.923 N/A GLY 208.A N GLN 205.A O no hydrogen 2.865 N/A LYS 209.A N ASP 207.A OD1 no hydrogen 3.075 N/A LYS 209.A NZ ASP 207.A OD2 no hydrogen 2.831 N/A VAL 211.A N VAL 203.A O no hydrogen 3.003 N/A ALA 212.A N GLN 26.A O no hydrogen 2.891 N/A PHE 213.A N GLY 201.A O no hydrogen 2.842 N/A ALA 214.A N VAL 24.A O no hydrogen 2.904 N/A LEU 215.A N LEU 199.A O no hydrogen 2.736 N/A ASN 216.A N VAL 22.A O no hydrogen 2.958 N/A MET 217.A N GLY 197.A O no hydrogen 2.924 N/A GLU 218.A N SER 20.A O no hydrogen 2.887 N/A MET 219.A N GLN 195.A O no hydrogen 3.233 N/A ARG 220.A NE GLU 222.A OE2 no hydrogen 2.830 N/A ARG 220.A NH1 ASN 18.A O.A no hydrogen 2.848 N/A ARG 220.A NH1 ASN 18.A O.B no hydrogen 2.867 N/A ARG 220.A NH2 LYS 17.A O no hydrogen 3.434 N/A ARG 220.A NH2 ASN 18.A O.A no hydrogen 3.055 N/A ARG 220.A NH2 ASN 18.A O.B no hydrogen 3.021 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.784 N/A MET 223.A N ARG 220.A O no hydrogen 2.963 N/A ILE 227.A N PRO 224.A O no hydrogen 2.996 N/A ARG 228.A N ALA 225.A O no hydrogen 3.511 N/A ARG 228.A NE ALA 225.A O no hydrogen 2.961 N/A ARG 228.A NH1 ALA 225.A O no hydrogen 3.281 N/A ARG 228.A NH2 GLY 187.A O no hydrogen 2.838 N/A GLU 230.A N SER 226.A O no hydrogen 2.892 N/A LEU 231.A N ILE 227.A O no hydrogen 3.005 N/A LEU 232.A N ARG 228.A O no hydrogen 2.965 N/A MET 233.A N ASN 229.A O no hydrogen 2.840 N/A LYS 234.A N GLU 230.A O no hydrogen 3.021 N/A SER 235.A N LEU 231.A O no hydrogen 3.031 N/A SER 235.A OG LEU 231.A O no hydrogen 2.703 N/A LEU 236.A N LEU 232.A O no hydrogen 2.850 N/A LYS 237.A N MET 233.A O no hydrogen 2.976 N/A GLN 238.A N LYS 234.A O no hydrogen 3.079 N/A LEU 239.A N SER 235.A O no hydrogen 2.945 N/A ASN 240.A N LYS 237.A O no hydrogen 2.974 N/A ILE 241.A N LEU 236.A O no hydrogen 2.917 N/A ILE 242.A N LEU 236.A O no hydrogen 3.474 N/A