Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kyu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NE GLU 11.A OE2 no hydrogen 3.274 N/A GLY 8.A N ASP 12.A OD2 no hydrogen 2.665 N/A SER 9.A N ASP 12.A OD1 no hydrogen 2.871 N/A SER 9.A OG ASP 12.A OD1 no hydrogen 2.599 N/A GLU 11.A N SER 9.A OG no hydrogen 3.150 N/A ASN 13.A ND2 LEU 25.A O no hydrogen 2.906 N/A PHE 14.A N GLU 11.A O no hydrogen 3.245 N/A ARG 16.A N ASN 13.A O no hydrogen 3.071 N/A PHE 17.A N PHE 14.A O no hydrogen 3.044 N/A VAL 18.A N ALA 15.A O no hydrogen 3.487 N/A CYS 19.A SG LYS 177.A O no hydrogen 3.371 N/A CYS 19.A SG GLN 246.A OE1 no hydrogen 3.891 N/A LYS 20.A NZ ASN 22.A O no hydrogen 2.681 N/A GLY 23.A N LEU 35.A O no hydrogen 3.040 N/A LEU 25.A N ILE 33.A O no hydrogen 2.705 N/A PHE 26.A N ILE 33.A O no hydrogen 3.391 N/A ASN 28.A N LEU 31.A O no hydrogen 2.908 N/A LEU 30.A N ASN 28.A OD1 no hydrogen 2.807 N/A LEU 31.A N ASN 28.A OD1 no hydrogen 2.851 N/A GLN 32.A N GLY 51.A O no hydrogen 3.057 N/A GLN 32.A NE2 GLU 27.A OE1 no hydrogen 3.150 N/A ILE 33.A N PHE 26.A O no hydrogen 2.721 N/A GLY 34.A N PHE 49.A O no hydrogen 2.680 N/A LEU 35.A N GLY 23.A O no hydrogen 2.588 N/A LYS 36.A N PHE 47.A O no hydrogen 2.899 N/A LYS 36.A NZ ASN 22.A OD1 no hydrogen 3.113 N/A SER 37.A N ASN 21.A O no hydrogen 3.097 N/A GLU 38.A N ARG 45.A O no hydrogen 2.784 N/A ARG 40.A N LEU 43.A O no hydrogen 2.810 N/A ASN 42.A ND2 CYS 100.A O no hydrogen 3.154 N/A LEU 43.A N ARG 40.A O no hydrogen 2.850 N/A GLY 44.A N ILE 98.A O no hydrogen 2.915 N/A ARG 45.A N GLU 38.A O no hydrogen 2.631 N/A ARG 45.A NE ASN 97.A OD1 no hydrogen 3.291 N/A ARG 45.A NH2 ASN 97.A OD1 no hydrogen 3.445 N/A MET 46.A N VAL 96.A O no hydrogen 2.727 N/A PHE 47.A N LYS 36.A O no hydrogen 2.620 N/A ILE 48.A N GLN 94.A O no hydrogen 2.551 N/A PHE 49.A N GLY 34.A O no hydrogen 2.689 N/A TYR 50.A N VAL 92.A O no hydrogen 2.765 N/A TYR 50.A OH GLN 94.A OE1 no hydrogen 2.591 N/A GLY 51.A N GLN 32.A O no hydrogen 2.758 N/A ASN 52.A N ALA 90.A O no hydrogen 2.832 N/A ASN 52.A ND2 THR 56.A O no hydrogen 2.848 N/A ASN 52.A ND2 VAL 86.A O no hydrogen 2.719 N/A LYS 53.A N LEU 30.A O no hydrogen 2.980 N/A LYS 53.A NZ GLU 27.A OE2 no hydrogen 2.685 N/A LYS 53.A NZ ASN 28.A O no hydrogen 2.948 N/A THR 54.A N ASN 52.A OD1 no hydrogen 2.883 N/A THR 54.A OG1 ASN 52.A OD1 no hydrogen 2.846 N/A THR 56.A N THR 54.A OG1 no hydrogen 2.904 N/A GLN 57.A NE2 ASP 87.A OD1 no hydrogen 2.803 N/A PHE 58.A N VAL 86.A O no hydrogen 2.772 N/A LEU 59.A N ARG 115.A O no hydrogen 3.070 N/A PHE 61.A N PRO 84.A O no hydrogen 2.921 N/A THR 62.A N GLN 113.A O no hydrogen 2.679 N/A THR 62.A OG1 ASN 60.A O no hydrogen 2.878 N/A THR 64.A N ASN 111.A O no hydrogen 2.670 N/A THR 64.A OG1 ASN 111.A O no hydrogen 3.528 N/A ILE 66.A N VAL 109.A O no hydrogen 2.597 N/A GLN 72.A N ALA 68.A O no hydrogen 2.949 N/A THR 73.A N ASP 70.A O no hydrogen 3.017 N/A THR 73.A OG1 ASP 70.A O no hydrogen 2.768 N/A ASN 74.A N LEU 71.A O no hydrogen 2.956 N/A LEU 75.A N LEU 71.A O no hydrogen 2.824 N/A ASN 76.A N GLU 99.A O no hydrogen 2.920 N/A GLN 78.A N ASN 97.A O no hydrogen 2.863 N/A GLN 78.A NE2 ASN 76.A OD1 no hydrogen 3.522 N/A THR 79.A OG1 LYS 80.A O no hydrogen 3.342 N/A THR 79.A OG1 VAL 95.A O no hydrogen 2.597 N/A THR 85.A N ASP 83.A OD1 no hydrogen 2.661 N/A VAL 86.A N PHE 58.A O no hydrogen 3.134 N/A GLY 89.A N ASN 52.A O no hydrogen 2.898 N/A ALA 90.A N ASP 87.A O no hydrogen 2.880 N/A VAL 92.A N TYR 50.A O no hydrogen 2.954 N/A GLN 94.A N ILE 48.A O no hydrogen 2.751 N/A GLN 94.A NE2 LYS 80.A O no hydrogen 3.441 N/A VAL 96.A N MET 46.A O no hydrogen 2.618 N/A ASN 97.A N GLN 78.A O no hydrogen 2.556 N/A ILE 98.A N GLY 44.A O no hydrogen 2.694 N/A GLU 99.A N ASN 76.A O no hydrogen 2.971 N/A CYS 100.A N ASN 42.A O no hydrogen 2.853 N/A CYS 100.A SG ASN 74.A O no hydrogen 4.036 N/A CYS 100.A SG SER 102.A O no hydrogen 3.254 N/A ILE 101.A N ASN 74.A O no hydrogen 2.746 N/A SER 102.A N ASN 74.A O no hydrogen 3.167 N/A SER 102.A OG ASP 103.A OD1 no hydrogen 3.169 N/A VAL 109.A N ILE 66.A O no hydrogen 2.697 N/A LEU 110.A N VAL 125.A O no hydrogen 2.660 N/A ASN 111.A N THR 64.A O no hydrogen 2.639 N/A ASN 111.A ND2 ASN 122.A OD1 no hydrogen 2.938 N/A ASN 111.A ND2 SER 124.A OG no hydrogen 2.630 N/A ILE 112.A N VAL 123.A O no hydrogen 2.608 N/A GLN 113.A N THR 62.A O no hydrogen 2.961 N/A GLN 113.A NE2 ASN 111.A OD1 no hydrogen 2.725 N/A PHE 114.A N GLN 121.A O no hydrogen 3.035 N/A ARG 115.A N LEU 59.A O no hydrogen 2.861 N/A ARG 115.A NH1 ASN 60.A OD1 no hydrogen 2.658 N/A TYR 116.A N THR 119.A O no hydrogen 3.061 N/A THR 119.A N TYR 116.A O no hydrogen 2.801 N/A THR 119.A OG1 TYR 116.A O no hydrogen 2.906 N/A GLN 121.A N PHE 114.A O no hydrogen 2.777 N/A GLN 121.A NE2 THR 119.A OG1 no hydrogen 2.960 N/A VAL 123.A N ILE 112.A O no hydrogen 2.746 N/A VAL 125.A N LEU 110.A O no hydrogen 2.860 N/A LYS 126.A N SER 10.A O no hydrogen 2.629 N/A LYS 126.A NZ GLU 11.A OE1 no hydrogen 2.603 N/A LEU 127.A N PRO 108.A O no hydrogen 2.747 N/A ILE 129.A N LEU 127.A O no hydrogen 2.842 N/A THR 130.A OG1 ASN 132.A OD1 no hydrogen 2.540 N/A ASN 132.A ND2 VAL 18.A O no hydrogen 2.762 N/A ASN 132.A ND2 PHE 181.A O no hydrogen 2.853 N/A LYS 133.A N THR 130.A O no hydrogen 2.937 N/A LYS 133.A NZ PHE 17.A O no hydrogen 2.742 N/A LYS 133.A NZ VAL 18.A O no hydrogen 3.125 N/A LYS 133.A NZ LYS 20.A O no hydrogen 2.933 N/A LYS 133.A NZ ASN 21.A OD1 no hydrogen 2.801 N/A PHE 134.A N LEU 131.A O no hydrogen 3.226 N/A PHE 135.A N ASN 132.A O no hydrogen 3.145 N/A GLN 136.A N ILE 201.A O no hydrogen 2.921 N/A THR 138.A N ALA 199.A O no hydrogen 3.145 N/A PHE 145.A N ALA 141.A O no hydrogen 3.248 N/A PHE 146.A N SER 142.A O no hydrogen 3.155 N/A GLN 147.A N GLN 143.A O no hydrogen 3.187 N/A ARG 148.A N ASP 144.A O no hydrogen 3.186 N/A TRP 149.A N PHE 145.A O no hydrogen 2.904 N/A LYS 150.A N PHE 146.A O no hydrogen 3.009 N/A GLN 151.A N ARG 148.A O no hydrogen 3.109 N/A GLN 156.A N ASN 154.A OD1 no hydrogen 2.750 N/A GLN 157.A N ASN 154.A O no hydrogen 2.957 N/A GLU 158.A N PRO 155.A O no hydrogen 3.214 N/A VAL 159.A N LEU 228.A O no hydrogen 3.030 N/A ASN 161.A N LEU 226.A O no hydrogen 2.895 N/A ASN 161.A ND2 SER 244.A OG no hydrogen 2.875 N/A PHE 163.A N TYR 224.A O no hydrogen 3.079 N/A ALA 165.A N GLN 222.A O no hydrogen 2.663 N/A LYS 166.A N PHE 247.A O no hydrogen 2.847 N/A LYS 166.A N PHE 247.A OXT no hydrogen 3.119 N/A LYS 166.A NZ GLU 245.A OE1 no hydrogen 2.459 N/A HIS 167.A N PHE 247.A OXT no hydrogen 2.880 N/A THR 174.A N ASP 170.A O no hydrogen 2.803 N/A THR 174.A OG1 ASP 170.A O no hydrogen 3.318 N/A LYS 175.A N THR 171.A O no hydrogen 2.800 N/A LYS 175.A NZ GLU 187.A OE1 no hydrogen 3.319 N/A LYS 175.A NZ GLU 187.A OE2 no hydrogen 3.495 N/A ALA 176.A N GLU 172.A O no hydrogen 2.936 N/A LYS 177.A N ILE 173.A O no hydrogen 2.669 N/A LYS 177.A NZ GLN 246.A O no hydrogen 3.286 N/A LYS 177.A NZ GLN 246.A OE1 no hydrogen 3.526 N/A ILE 178.A N THR 174.A O no hydrogen 2.810 N/A ILE 179.A N LYS 175.A O no hydrogen 2.806 N/A GLY 180.A N ALA 176.A O no hydrogen 2.625 N/A PHE 181.A N LYS 177.A O no hydrogen 2.571 N/A GLY 182.A N ILE 178.A O no hydrogen 3.188 N/A GLY 182.A N ILE 179.A O no hydrogen 3.066 N/A SER 183.A OG ALA 184.A O no hydrogen 3.085 N/A ALA 184.A N ALA 199.A O no hydrogen 2.924 N/A LEU 186.A N VAL 197.A O no hydrogen 2.990 N/A ASN 192.A N ASP 190.A OD1 no hydrogen 2.680 N/A ALA 194.A N ASN 192.A OD1 no hydrogen 3.032 N/A ASN 195.A N ASN 192.A O no hydrogen 2.989 N/A ASN 195.A ND2 ASP 190.A OD2 no hydrogen 2.776 N/A PHE 196.A N LEU 215.A O no hydrogen 3.030 N/A GLY 198.A N LEU 213.A O no hydrogen 3.048 N/A ALA 199.A N ALA 184.A O no hydrogen 3.212 N/A GLY 200.A N CYS 211.A O no hydrogen 2.988 N/A ILE 201.A N GLN 136.A O no hydrogen 3.072 N/A ILE 202.A N ILE 209.A O no hydrogen 2.935 N/A HIS 203.A N PHE 134.A O no hydrogen 2.841 N/A HIS 203.A ND1 GLN 208.A OE1 no hydrogen 2.718 N/A HIS 203.A NE2 GLN 136.A OE1 no hydrogen 2.554 N/A THR 204.A OG1 ILE 101.A O no hydrogen 3.284 N/A THR 204.A OG1 THR 207.A O no hydrogen 2.556 N/A LYS 205.A N CYS 100.A O no hydrogen 2.837 N/A THR 206.A N ILE 101.A O no hydrogen 2.979 N/A THR 206.A OG1 ILE 101.A O no hydrogen 2.981 N/A THR 207.A N THR 204.A OG1 no hydrogen 2.952 N/A GLN 208.A NE2 THR 204.A O no hydrogen 2.859 N/A ILE 209.A N ILE 202.A O no hydrogen 3.054 N/A GLY 210.A N SER 231.A OG no hydrogen 3.081 N/A CYS 211.A N GLY 200.A O no hydrogen 2.809 N/A CYS 211.A SG ILE 209.A O no hydrogen 3.368 N/A LEU 212.A N ARG 229.A O no hydrogen 2.930 N/A LEU 213.A N GLY 198.A O no hydrogen 2.956 N/A ARG 214.A N THR 227.A O no hydrogen 3.070 N/A ARG 214.A NE ASP 190.A OD2 no hydrogen 2.877 N/A ARG 214.A NH2 ASP 190.A OD2 no hydrogen 3.308 N/A LEU 215.A N PHE 196.A O no hydrogen 2.906 N/A GLU 216.A N ARG 225.A O no hydrogen 2.865 N/A ASN 218.A N MET 223.A O no hydrogen 2.638 N/A ALA 221.A N ASN 218.A OD1 no hydrogen 2.940 N/A GLN 222.A N LEU 219.A O no hydrogen 3.180 N/A GLN 222.A NE2 LEU 219.A O no hydrogen 2.596 N/A MET 223.A N ASN 218.A O no hydrogen 3.099 N/A TYR 224.A N PHE 163.A O no hydrogen 2.832 N/A ARG 225.A N GLU 216.A O no hydrogen 2.814 N/A ARG 225.A NE GLN 160.A OE1 no hydrogen 2.903 N/A ARG 225.A NH2 GLN 160.A OE1 no hydrogen 2.522 N/A LEU 226.A N ASN 161.A O no hydrogen 2.844 N/A THR 227.A N ARG 214.A O no hydrogen 2.927 N/A LEU 228.A N VAL 159.A O no hydrogen 2.883 N/A ARG 229.A N LEU 212.A O no hydrogen 3.057 N/A ARG 229.A NE GLU 158.A OE2 no hydrogen 2.797 N/A ARG 229.A NH1 TRP 149.A O no hydrogen 2.829 N/A ARG 229.A NH2 GLU 158.A OE2 no hydrogen 3.007 N/A THR 230.A N GLN 157.A O no hydrogen 3.516 N/A THR 230.A OG1 SER 236.A OG no hydrogen 2.711 N/A SER 231.A N GLY 210.A O no hydrogen 3.173 N/A LYS 232.A N THR 230.A OG1 no hydrogen 3.098 N/A LYS 232.A NZ ASP 103.A OD1 no hydrogen 2.641 N/A THR 234.A N ASP 233.A OD1 no hydrogen 2.703 N/A THR 234.A OG1 ASP 103.A OD2 no hydrogen 2.479 N/A VAL 235.A N LYS 232.A O no hydrogen 2.930 N/A SER 236.A N LYS 232.A O no hydrogen 3.003 N/A SER 236.A OG GLN 157.A O no hydrogen 2.594 N/A SER 236.A OG THR 230.A OG1 no hydrogen 2.711 N/A SER 236.A OG LYS 232.A O no hydrogen 3.223 N/A GLN 237.A N ASP 233.A O no hydrogen 2.976 N/A GLN 237.A NE2 GLU 241.A OE1 no hydrogen 2.981 N/A ARG 238.A N THR 234.A O no hydrogen 2.985 N/A ARG 238.A NH1 GLU 241.A OE2 no hydrogen 3.322 N/A LEU 239.A N VAL 235.A O no hydrogen 2.899 N/A CYS 240.A N SER 236.A O no hydrogen 3.038 N/A GLU 241.A N GLN 237.A O no hydrogen 2.932 N/A LEU 242.A N ARG 238.A O no hydrogen 2.932 N/A LEU 243.A N LEU 239.A O no hydrogen 2.938 N/A SER 244.A N CYS 240.A O no hydrogen 2.995 N/A SER 244.A OG CYS 240.A O no hydrogen 2.524 N/A GLU 245.A N LEU 242.A O no hydrogen 3.144 N/A GLN 246.A N LEU 243.A O no hydrogen 3.006 N/A GLN 246.A NE2 ALA 15.A O no hydrogen 3.031 N/A