Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gkb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 4.A N ASP 2.A OD1 no hydrogen 2.882 N/A GLN 6.A NE2.A ASP 2.A OD1 no hydrogen 2.687 N/A ASP 7.A N ARG 31.A O no hydrogen 2.841 N/A LYS 8.A N LEU 5.A O no hydrogen 3.026 N/A VAL 9.A N ASP 85.A OD2 no hydrogen 2.841 N/A VAL 10.A N ILE 33.A O no hydrogen 2.994 N/A ILE 11.A N GLY 86.A O no hydrogen 3.009 N/A VAL 12.A N VAL 35.A O no hydrogen 2.929 N/A THR 13.A N VAL 88.A O no hydrogen 2.934 N/A GLY 14.A N PHE 37.A O no hydrogen 2.788 N/A GLY 21.A N SER 17.A O no hydrogen 2.986 N/A ALA 22.A N GLY 18.A O no hydrogen 3.073 N/A ILE 23.A N ILE 19.A O no hydrogen 2.945 N/A SER 24.A N GLY 20.A O no hydrogen 2.912 N/A SER 24.A OG GLY 15.A O no hydrogen 2.776 N/A SER 24.A OG GLY 20.A O no hydrogen 3.180 N/A MET 25.A N GLY 21.A O no hydrogen 2.913 N/A ARG 26.A N ALA 22.A O no hydrogen 2.919 N/A ARG 26.A NE ASP 215.A OD1 no hydrogen 2.565 N/A ARG 26.A NH1 ASP 211.A O no hydrogen 3.474 N/A ARG 26.A NH1 ASP 211.A OD1 no hydrogen 2.881 N/A ARG 26.A NH2 GLU 29.A OE1 no hydrogen 2.808 N/A LEU 27.A N ILE 23.A O no hydrogen 2.942 N/A ALA 28.A N SER 24.A O no hydrogen 3.044 N/A GLU 29.A N MET 25.A O no hydrogen 2.961 N/A GLU 30.A N ARG 26.A O no hydrogen 2.955 N/A ARG 31.A N ALA 28.A O no hydrogen 2.911 N/A ALA 32.A N LEU 27.A O no hydrogen 2.885 N/A ILE 33.A N LYS 8.A O no hydrogen 2.760 N/A VAL 35.A N VAL 10.A O no hydrogen 2.821 N/A VAL 36.A N THR 58.A O.A no hydrogen 2.884 N/A VAL 36.A N THR 58.A O.B no hydrogen 2.855 N/A PHE 37.A N VAL 12.A O no hydrogen 3.061 N/A ALA 38.A N LEU 60.A O no hydrogen 3.390 N/A ARG 39.A NE GLU 63.A OE1 no hydrogen 2.519 N/A ARG 39.A NH1 GLU 63.A OE1 no hydrogen 3.054 N/A ARG 39.A NH1 GLU 63.A OE2 no hydrogen 2.842 N/A PHE 46.A N ASP 43.A OD1.B no hydrogen 3.003 N/A LEU 47.A N ASP 43.A O.A no hydrogen 2.972 N/A LEU 47.A N ASP 43.A O.B no hydrogen 3.005 N/A ASP 48.A N GLY 44.A O no hydrogen 2.772 N/A ALA 49.A N ALA 45.A O no hydrogen 3.094 N/A LEU 50.A N PHE 46.A O no hydrogen 2.812 N/A ALA 51.A N LEU 47.A O no hydrogen 2.856 N/A GLN 52.A N ASP 48.A O no hydrogen 2.985 N/A ARG 53.A N LEU 50.A O no hydrogen 3.271 N/A ARG 53.A NE GLU 29.A OE2 no hydrogen 2.914 N/A ARG 53.A NH2 ALA 49.A O no hydrogen 2.765 N/A GLN 54.A N LEU 50.A O no hydrogen 2.832 N/A GLN 54.A NE2 ARG 31.A O no hydrogen 3.379 N/A GLN 54.A NE2 ALA 32.A O no hydrogen 3.053 N/A ARG 56.A N GLN 54.A OE1 no hydrogen 3.146 N/A ALA 57.A N GLN 54.A O no hydrogen 3.029 N/A THR 58.A N.A PRO 34.A O no hydrogen 3.254 N/A THR 58.A N.B PRO 34.A O no hydrogen 3.252 N/A TYR 59.A OH ALA 38.A O no hydrogen 2.959 N/A LEU 60.A N VAL 36.A O no hydrogen 2.819 N/A VAL 62.A N ALA 38.A O no hydrogen 2.875 N/A GLU 63.A N GLN 69.A OE1 no hydrogen 2.796 N/A GLN 65.A N GLU 63.A OE2 no hydrogen 3.106 N/A ASP 66.A N GLU 63.A O no hydrogen 2.866 N/A ALA 68.A N ASP 66.A OD1 no hydrogen 2.990 N/A GLN 69.A N ASP 66.A OD1 no hydrogen 3.371 N/A GLN 69.A NE2 ASP 66.A OD2 no hydrogen 3.330 N/A CYS 70.A N ASP 66.A O no hydrogen 3.187 N/A CYS 70.A SG LEU 64.A O no hydrogen 3.338 N/A CYS 70.A SG ASP 66.A O no hydrogen 3.728 N/A ARG 71.A N ASP 67.A O no hydrogen 3.009 N/A ARG 71.A NH1 TYR 123.A OH no hydrogen 3.040 N/A ASP 72.A N ALA 68.A O no hydrogen 2.858 N/A ALA 73.A N GLN 69.A O no hydrogen 2.856 N/A VAL 74.A N CYS 70.A O no hydrogen 3.013 N/A ALA 75.A N ARG 71.A O no hydrogen 3.028 N/A GLN 76.A N ASP 72.A O no hydrogen 2.887 N/A THR 77.A N ALA 73.A O no hydrogen 3.018 N/A THR 77.A OG1 ALA 73.A O no hydrogen 2.878 N/A ILE 78.A N VAL 74.A O no hydrogen 2.995 N/A ALA 79.A N ALA 75.A O no hydrogen 2.902 N/A THR 80.A N GLN 76.A O no hydrogen 2.937 N/A THR 80.A OG1 GLN 76.A O no hydrogen 2.827 N/A PHE 81.A N THR 77.A O no hydrogen 2.897 N/A GLY 82.A N ILE 78.A O no hydrogen 2.716 N/A ARG 83.A NE ASP 85.A OD1 no hydrogen 3.324 N/A ARG 83.A NE ASP 85.A OD2 no hydrogen 2.700 N/A ARG 83.A NH2 ASP 85.A OD1 no hydrogen 2.769 N/A ASP 85.A N VAL 9.A O no hydrogen 2.693 N/A GLY 86.A N VAL 9.A O no hydrogen 3.027 N/A LEU 87.A N ALA 134.A O no hydrogen 3.014 N/A VAL 88.A N ILE 11.A O no hydrogen 2.748 N/A ASN 89.A N VAL 136.A O no hydrogen 2.958 N/A ASN 89.A ND2 TYR 117.A O no hydrogen 3.274 N/A ASN 89.A ND2 ASN 137.A OD1 no hydrogen 3.000 N/A ASN 90.A N THR 13.A OG1 no hydrogen 2.903 N/A ASN 90.A ND2 THR 13.A O no hydrogen 3.072 N/A ALA 91.A N THR 13.A OG1 no hydrogen 3.186 N/A VAL 93.A N ASN 113.A OD1 no hydrogen 2.836 N/A ASN 94.A ND2 GLN 147.A OE1 no hydrogen 2.963 N/A ALA 101.A N GLY 98.A O no hydrogen 3.218 N/A PHE 106.A N GLY 102.A O no hydrogen 3.089 N/A VAL 107.A N ARG 103.A O no hydrogen 2.886 N/A ALA 108.A N ASP 104.A O no hydrogen 3.003 N/A SER 109.A N ALA 105.A O no hydrogen 3.032 N/A SER 109.A OG ASP 95.A OD1 no hydrogen 2.933 N/A SER 109.A OG ASP 95.A OD2 no hydrogen 3.061 N/A LEU 110.A N PHE 106.A O no hydrogen 3.051 N/A GLU 111.A N VAL 107.A O no hydrogen 2.948 N/A ARG 112.A N ALA 108.A O no hydrogen 3.026 N/A ARG 112.A NE ASP 95.A OD2 no hydrogen 2.871 N/A ARG 112.A NH2 ASP 95.A OD2 no hydrogen 2.821 N/A ASN 113.A N LEU 110.A O no hydrogen 3.374 N/A ASN 113.A ND2 VAL 93.A O no hydrogen 3.083 N/A ASN 113.A ND2 SER 109.A O no hydrogen 3.183 N/A LEU 114.A N LEU 110.A O no hydrogen 2.806 N/A ILE 115.A N LEU 110.A O no hydrogen 2.876 N/A HIS 116.A NE2 ARG 112.A O no hydrogen 2.850 N/A TYR 117.A N LEU 114.A O no hydrogen 2.992 N/A TYR 117.A OH ILE 138.A O no hydrogen 2.658 N/A ALA 119.A N ILE 115.A O no hydrogen 2.927 N/A MET 120.A N HIS 116.A O no hydrogen 2.892 N/A ALA 121.A N TYR 117.A O no hydrogen 3.112 N/A HIS 122.A N TYR 118.A O no hydrogen 2.794 N/A TYR 123.A N ALA 119.A O no hydrogen 3.103 N/A TYR 123.A OH ASP 67.A OD2 no hydrogen 2.550 N/A CYS 124.A N MET 120.A O no hydrogen 2.864 N/A CYS 124.A SG MET 120.A O no hydrogen 3.265 N/A VAL 125.A N ALA 121.A O no hydrogen 2.855 N/A LEU 128.A N CYS 124.A O no hydrogen 2.950 N/A LYS 129.A N VAL 125.A O no hydrogen 2.893 N/A ALA 130.A N HIS 127.A O no hydrogen 3.125 N/A THR 131.A N LEU 128.A O no hydrogen 3.239 N/A THR 131.A OG1 LEU 84.A O no hydrogen 2.656 N/A THR 131.A OG1 LEU 128.A O no hydrogen 3.321 N/A ARG 132.A N LYS 129.A O no hydrogen 3.354 N/A GLY 133.A N LEU 128.A O no hydrogen 2.920 N/A ALA 134.A N ASP 85.A O no hydrogen 3.076 N/A ILE 135.A N ARG 177.A O no hydrogen 2.855 N/A VAL 136.A N LEU 87.A O no hydrogen 2.864 N/A ASN 137.A N ASN 179.A O no hydrogen 2.822 N/A ASN 137.A ND2 THR 164.A OG1 no hydrogen 2.963 N/A ILE 138.A N ASN 89.A O no hydrogen 2.846 N/A SER 139.A N VAL 181.A O no hydrogen 2.842 N/A SER 139.A OG LYS 157.A O no hydrogen 2.896 N/A SER 140.A OG THR 142.A OG1.A no hydrogen 2.922 N/A LYS 141.A N PRO 183.A O no hydrogen 2.863 N/A LYS 141.A NZ GLU 185.A OE2 no hydrogen 2.697 N/A THR 142.A N.A SER 140.A OG no hydrogen 3.165 N/A THR 142.A N.B SER 140.A OG no hydrogen 3.140 N/A THR 142.A OG1.A SER 140.A OG no hydrogen 2.922 N/A ALA 143.A N SER 140.A O no hydrogen 2.995 N/A VAL 144.A N LYS 141.A O no hydrogen 2.872 N/A THR 145.A N LYS 141.A O no hydrogen 2.857 N/A THR 145.A OG1 LYS 141.A O no hydrogen 3.166 N/A THR 145.A OG1 GLY 146.A O no hydrogen 2.798 N/A GLY 146.A N THR 142.A O.A no hydrogen 3.032 N/A GLY 146.A N THR 142.A O.B no hydrogen 2.985 N/A THR 150.A OG1 ASN 94.A OD1 no hydrogen 2.629 N/A GLY 152.A N ILE 97.A O no hydrogen 3.171 N/A CYS 154.A N THR 150.A O no hydrogen 2.886 N/A CYS 154.A SG THR 142.A O.A no hydrogen 3.333 N/A CYS 154.A SG THR 142.A O.B no hydrogen 3.411 N/A ALA 155.A N SER 151.A O no hydrogen 2.867 N/A SER 156.A N GLY 152.A O no hydrogen 3.060 N/A SER 156.A OG GLY 152.A O no hydrogen 2.912 N/A LYS 157.A N TYR 153.A O no hydrogen 2.852 N/A LYS 157.A NZ ILE 138.A O no hydrogen 3.056 N/A LYS 157.A NZ GLN 160.A OE1 no hydrogen 3.063 N/A GLY 158.A N CYS 154.A O no hydrogen 2.893 N/A ALA 159.A N ALA 155.A O no hydrogen 2.909 N/A GLN 160.A N SER 156.A O no hydrogen 3.012 N/A GLN 160.A NE2 ASN 113.A O no hydrogen 2.970 N/A LEU 161.A N LYS 157.A O no hydrogen 3.300 N/A ALA 162.A N GLY 158.A O no hydrogen 3.066 N/A LEU 163.A N ALA 159.A O no hydrogen 2.810 N/A THR 164.A N GLN 160.A O no hydrogen 3.061 N/A THR 164.A OG1 GLN 160.A O no hydrogen 2.787 N/A ARG 165.A N LEU 161.A O no hydrogen 3.383 N/A ARG 165.A NE GLY 230.A O no hydrogen 2.719 N/A GLU 166.A N ALA 162.A O no hydrogen 2.959 N/A TRP 167.A N LEU 163.A O no hydrogen 2.802 N/A ALA 168.A N THR 164.A O no hydrogen 3.115 N/A VAL 169.A N ARG 165.A O no hydrogen 3.084 N/A ALA 170.A N GLU 166.A O no hydrogen 2.879 N/A LEU 171.A N TRP 167.A O no hydrogen 2.946 N/A ARG 172.A N VAL 169.A O no hydrogen 3.372 N/A ARG 172.A NH2 VAL 169.A O no hydrogen 2.807 N/A HIS 174.A N LEU 171.A O no hydrogen 2.993 N/A GLY 175.A N ARG 172.A O no hydrogen 3.131 N/A VAL 176.A N LEU 171.A O no hydrogen 3.464 N/A ARG 177.A NH1 LEU 220.A O no hydrogen 2.887 N/A ARG 177.A NH1 THR 228.A O no hydrogen 3.358 N/A ARG 177.A NH2 LEU 220.A O no hydrogen 3.092 N/A VAL 178.A N THR 229.A OG1 no hydrogen 3.064 N/A ASN 179.A N ILE 135.A O no hydrogen 2.997 N/A ASN 179.A ND2 THR 228.A O no hydrogen 2.914 N/A ALA 180.A N GLU 231.A O no hydrogen 2.810 N/A VAL 181.A N ASN 137.A O no hydrogen 2.971 N/A ILE 182.A N LEU 233.A O no hydrogen 2.805 N/A TYR 191.A N THR 188.A OG1 no hydrogen 3.133 N/A TYR 191.A OH GLU 185.A OE1 no hydrogen 2.685 N/A GLU 196.A N ALA 192.A O no hydrogen 3.082 N/A ILE 197.A N LYS 193.A O no hydrogen 3.213 N/A ALA 198.A N LEU 194.A O no hydrogen 2.902 N/A ALA 199.A N ALA 195.A O no hydrogen 3.071 N/A LYS 200.A N ILE 197.A O no hydrogen 3.016 N/A VAL 201.A N ALA 198.A O no hydrogen 3.055 N/A LEU 203.A N GLY 237.A O no hydrogen 2.911 N/A ARG 205.A NE VAL 247.A O no hydrogen 2.761 N/A ARG 205.A NH1 VAL 247.A O no hydrogen 3.415 N/A ARG 205.A NH1 VAL 247.A OXT no hydrogen 2.846 N/A ARG 206.A NH1 GLU 212.A OE2 no hydrogen 2.866 N/A ARG 206.A NH2 PHE 207.A O no hydrogen 2.987 N/A ARG 206.A NH2 GLU 212.A OE1 no hydrogen 2.855 N/A ARG 206.A NH2 GLU 212.A OE2 no hydrogen 3.449 N/A THR 208.A N GLU 185.A O no hydrogen 2.894 N/A THR 208.A OG1 GLU 185.A O no hydrogen 3.487 N/A THR 209.A N GLU 212.A OE1 no hydrogen 2.949 N/A THR 209.A OG1 GLU 212.A OE1 no hydrogen 3.351 N/A GLU 212.A N THR 209.A OG1 no hydrogen 3.093 N/A ILE 213.A N THR 209.A O no hydrogen 3.255 N/A ALA 214.A N PRO 210.A O no hydrogen 2.834 N/A ASP 215.A N ASP 211.A O no hydrogen 2.885 N/A THR 216.A N GLU 212.A O no hydrogen 3.479 N/A ALA 217.A N ILE 213.A O no hydrogen 2.959 N/A VAL 218.A N ALA 214.A O no hydrogen 2.846 N/A PHE 219.A N ASP 215.A O no hydrogen 3.126 N/A LEU 220.A N THR 216.A O no hydrogen 3.000 N/A LEU 221.A N ALA 217.A O no hydrogen 3.127 N/A LEU 221.A N VAL 218.A O no hydrogen 3.161 N/A SER 222.A N PHE 219.A O no hydrogen 3.069 N/A SER 222.A OG PHE 219.A O no hydrogen 2.770 N/A ARG 224.A N SER 222.A OG no hydrogen 3.087 N/A ARG 224.A NH2 ASP 2.A O no hydrogen 2.689 N/A ALA 225.A N SER 222.A O no hydrogen 3.019 N/A SER 226.A OG PRO 223.A O no hydrogen 3.016 N/A THR 228.A N ALA 225.A O no hydrogen 2.987 N/A GLY 230.A N VAL 178.A O no hydrogen 2.679 N/A GLU 231.A N ASN 179.A OD1 no hydrogen 2.948 N/A TRP 232.A NE1 LEU 161.A O no hydrogen 3.012 N/A LEU 233.A N ALA 180.A O no hydrogen 2.869 N/A VAL 235.A N ILE 182.A O no hydrogen 3.003 N/A GLY 238.A N ASP 236.A OD1 no hydrogen 2.940 N/A TYR 239.A N ASP 236.A O no hydrogen 3.108 N/A THR 240.A N ASP 236.A OD2 no hydrogen 2.882 N/A THR 240.A OG1 ASP 236.A OD2 no hydrogen 2.748 N/A LEU 242.A N GLY 238.A O no hydrogen 3.103 N/A ALA 245.A N ASP 243.A OD1 no hydrogen 3.507 N/A LEU 246.A N ASP 243.A O no hydrogen 3.273 N/A