Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kyd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NH2 GLU 11.A OE2 no hydrogen 2.916 N/A GLY 8.A N ASP 12.A OD2 no hydrogen 2.675 N/A SER 9.A N ASP 12.A OD1 no hydrogen 2.834 N/A SER 9.A OG ASP 12.A OD1 no hydrogen 2.773 N/A GLU 11.A N SER 9.A OG no hydrogen 3.084 N/A ASN 13.A ND2 LEU 25.A O no hydrogen 2.637 N/A PHE 14.A N GLU 11.A O no hydrogen 3.364 N/A ARG 16.A N ASN 13.A O no hydrogen 3.012 N/A PHE 17.A N PHE 14.A O no hydrogen 3.000 N/A CYS 19.A SG LYS 177.A O no hydrogen 3.419 N/A CYS 19.A SG GLN 246.A OE1 no hydrogen 3.704 N/A LYS 20.A NZ ASN 22.A O no hydrogen 3.065 N/A GLY 23.A N LEU 35.A O no hydrogen 3.109 N/A LEU 25.A N ILE 33.A O no hydrogen 2.889 N/A PHE 26.A N ILE 33.A O no hydrogen 3.274 N/A ASN 28.A N LEU 31.A O no hydrogen 3.005 N/A LEU 30.A N ASN 28.A OD1 no hydrogen 2.883 N/A LEU 31.A N ASN 28.A OD1 no hydrogen 2.871 N/A GLN 32.A N GLY 51.A O no hydrogen 2.992 N/A GLN 32.A NE2 GLU 27.A OE1 no hydrogen 3.031 N/A ILE 33.A N PHE 26.A O no hydrogen 2.655 N/A GLY 34.A N PHE 49.A O no hydrogen 2.894 N/A LEU 35.A N GLY 23.A O no hydrogen 2.800 N/A LYS 36.A N PHE 47.A O no hydrogen 3.069 N/A LYS 36.A NZ ASN 22.A OD1 no hydrogen 3.141 N/A GLU 38.A N ARG 45.A O no hydrogen 2.917 N/A ARG 40.A N LEU 43.A O no hydrogen 2.886 N/A ASN 42.A ND2 CYS 100.A O no hydrogen 3.045 N/A LEU 43.A N ARG 40.A O no hydrogen 2.929 N/A GLY 44.A N ILE 98.A O no hydrogen 2.917 N/A ARG 45.A N GLU 38.A O no hydrogen 2.879 N/A ARG 45.A NE ASN 97.A OD1 no hydrogen 3.260 N/A ARG 45.A NH1 GLU 38.A OE2 no hydrogen 3.417 N/A ARG 45.A NH2 ASN 97.A OD1 no hydrogen 3.416 N/A MET 46.A N VAL 96.A O no hydrogen 2.916 N/A PHE 47.A N LYS 36.A O no hydrogen 2.562 N/A ILE 48.A N GLN 94.A O no hydrogen 2.749 N/A PHE 49.A N GLY 34.A O no hydrogen 2.911 N/A TYR 50.A N VAL 92.A O no hydrogen 2.814 N/A TYR 50.A OH GLN 94.A OE1 no hydrogen 2.621 N/A GLY 51.A N GLN 32.A O no hydrogen 2.763 N/A ASN 52.A N ALA 90.A O no hydrogen 2.877 N/A ASN 52.A ND2 THR 56.A O no hydrogen 2.821 N/A ASN 52.A ND2 VAL 86.A O no hydrogen 2.911 N/A LYS 53.A N LEU 30.A O no hydrogen 2.833 N/A LYS 53.A NZ GLU 27.A OE2 no hydrogen 2.456 N/A LYS 53.A NZ ASN 28.A O no hydrogen 2.993 N/A THR 54.A N ASN 52.A OD1 no hydrogen 2.870 N/A THR 54.A OG1 ASN 52.A OD1 no hydrogen 2.910 N/A THR 56.A N THR 54.A OG1 no hydrogen 2.870 N/A GLN 57.A NE2 ASP 87.A OD1 no hydrogen 2.753 N/A PHE 58.A N VAL 86.A O no hydrogen 2.704 N/A LEU 59.A N ARG 115.A O no hydrogen 3.078 N/A PHE 61.A N PRO 84.A O no hydrogen 2.726 N/A THR 62.A N GLN 113.A O no hydrogen 2.699 N/A THR 62.A OG1 ASN 60.A O no hydrogen 2.905 N/A THR 64.A N ASN 111.A O no hydrogen 2.722 N/A ILE 66.A N VAL 109.A O no hydrogen 2.853 N/A LEU 71.A N ALA 68.A O no hydrogen 2.904 N/A GLN 72.A N ASP 69.A O no hydrogen 2.619 N/A THR 73.A N ASP 70.A O no hydrogen 2.998 N/A ASN 74.A N ASP 70.A O no hydrogen 3.057 N/A LEU 75.A N LEU 71.A O no hydrogen 3.058 N/A ASN 76.A N GLU 99.A O no hydrogen 2.816 N/A GLN 78.A N ASN 97.A O no hydrogen 2.893 N/A GLN 78.A NE2 ASN 76.A OD1 no hydrogen 3.106 N/A THR 79.A OG1 LYS 80.A O no hydrogen 3.558 N/A THR 79.A OG1 VAL 95.A O no hydrogen 2.566 N/A THR 85.A N ASP 83.A OD1 no hydrogen 2.988 N/A VAL 86.A N PHE 58.A O no hydrogen 3.031 N/A ALA 90.A N ASP 87.A O no hydrogen 3.041 N/A VAL 92.A N TYR 50.A O no hydrogen 3.062 N/A GLN 94.A N ILE 48.A O no hydrogen 2.883 N/A GLN 94.A NE2 THR 79.A OG1 no hydrogen 3.339 N/A GLN 94.A NE2 LYS 80.A O no hydrogen 3.621 N/A VAL 96.A N MET 46.A O no hydrogen 2.874 N/A ASN 97.A N GLN 78.A O no hydrogen 2.680 N/A ILE 98.A N GLY 44.A O no hydrogen 2.733 N/A GLU 99.A N ASN 76.A O no hydrogen 2.848 N/A CYS 100.A N ASN 42.A O no hydrogen 2.831 N/A CYS 100.A SG SER 102.A O no hydrogen 3.146 N/A ILE 101.A N ASN 74.A O no hydrogen 2.650 N/A SER 102.A N ASN 74.A O no hydrogen 3.297 N/A SER 102.A OG ASP 103.A OD1 no hydrogen 3.418 N/A VAL 109.A N ILE 66.A O no hydrogen 2.666 N/A LEU 110.A N VAL 125.A O no hydrogen 2.798 N/A ASN 111.A N THR 64.A O no hydrogen 2.996 N/A ASN 111.A ND2 ASN 122.A OD1 no hydrogen 3.045 N/A ILE 112.A N VAL 123.A O no hydrogen 2.653 N/A GLN 113.A N THR 62.A O no hydrogen 3.010 N/A GLN 113.A NE2 ASN 111.A OD1 no hydrogen 3.017 N/A PHE 114.A N GLN 121.A O no hydrogen 3.056 N/A ARG 115.A N LEU 59.A O no hydrogen 2.838 N/A TYR 116.A N THR 119.A O no hydrogen 3.082 N/A THR 119.A N TYR 116.A O no hydrogen 3.012 N/A THR 119.A OG1 TYR 116.A O no hydrogen 2.911 N/A GLN 121.A N PHE 114.A O no hydrogen 2.829 N/A GLN 121.A NE2 THR 119.A OG1 no hydrogen 2.971 N/A VAL 123.A N ILE 112.A O no hydrogen 2.809 N/A VAL 125.A N LEU 110.A O no hydrogen 2.920 N/A LYS 126.A N SER 10.A O no hydrogen 2.672 N/A LYS 126.A NZ GLU 11.A OE1 no hydrogen 3.011 N/A LEU 127.A N PRO 108.A O no hydrogen 2.929 N/A ILE 129.A N LEU 127.A O no hydrogen 2.896 N/A THR 130.A OG1 ASN 132.A OD1 no hydrogen 2.694 N/A ASN 132.A ND2 VAL 18.A O no hydrogen 2.884 N/A ASN 132.A ND2 PHE 181.A O no hydrogen 3.010 N/A LYS 133.A N THR 130.A O no hydrogen 3.003 N/A LYS 133.A NZ PHE 17.A O no hydrogen 2.971 N/A LYS 133.A NZ VAL 18.A O no hydrogen 3.192 N/A LYS 133.A NZ LYS 20.A O no hydrogen 3.075 N/A LYS 133.A NZ ASN 21.A OD1 no hydrogen 2.660 N/A PHE 134.A N LEU 131.A O no hydrogen 3.179 N/A PHE 135.A N ASN 132.A O no hydrogen 3.253 N/A GLN 136.A N ILE 201.A O no hydrogen 2.873 N/A THR 138.A N ALA 199.A O no hydrogen 3.243 N/A GLN 143.A N GLN 143.A OE1 no hydrogen 2.763 N/A PHE 145.A N ALA 141.A O no hydrogen 3.006 N/A PHE 146.A N SER 142.A O no hydrogen 2.937 N/A GLN 147.A N GLN 143.A O no hydrogen 3.078 N/A ARG 148.A N ASP 144.A O no hydrogen 3.097 N/A TRP 149.A N PHE 145.A O no hydrogen 2.823 N/A LYS 150.A N PHE 146.A O no hydrogen 2.976 N/A GLN 151.A N ARG 148.A O no hydrogen 3.096 N/A GLN 156.A N ASN 154.A OD1 no hydrogen 2.998 N/A GLN 157.A N ASN 154.A O no hydrogen 2.900 N/A GLU 158.A N PRO 155.A O no hydrogen 3.133 N/A VAL 159.A N LEU 228.A O no hydrogen 2.881 N/A GLN 160.A NE2 GLU 158.A OE1 no hydrogen 3.308 N/A ASN 161.A N LEU 226.A O no hydrogen 2.901 N/A ASN 161.A ND2 SER 244.A OG no hydrogen 2.840 N/A PHE 163.A N TYR 224.A O no hydrogen 3.033 N/A ALA 165.A N GLN 222.A O no hydrogen 2.780 N/A LYS 166.A N PHE 247.A O no hydrogen 2.853 N/A LYS 166.A N PHE 247.A OXT no hydrogen 2.809 N/A LYS 166.A NZ SER 244.A O no hydrogen 2.690 N/A LYS 166.A NZ PHE 247.A O no hydrogen 2.617 N/A HIS 167.A N PHE 247.A OXT no hydrogen 3.019 N/A ILE 173.A N ASP 170.A OD1 no hydrogen 2.836 N/A THR 174.A N ASP 170.A O no hydrogen 2.855 N/A THR 174.A OG1 ASP 170.A O no hydrogen 2.867 N/A LYS 175.A N THR 171.A O no hydrogen 2.985 N/A LYS 175.A NZ GLU 187.A OE1 no hydrogen 3.434 N/A ALA 176.A N GLU 172.A O no hydrogen 3.005 N/A LYS 177.A N ILE 173.A O no hydrogen 2.858 N/A LYS 177.A NZ GLN 246.A O no hydrogen 2.871 N/A ILE 178.A N THR 174.A O no hydrogen 3.029 N/A ILE 179.A N LYS 175.A O no hydrogen 3.085 N/A GLY 180.A N ALA 176.A O no hydrogen 2.968 N/A PHE 181.A N LYS 177.A O no hydrogen 2.710 N/A GLY 182.A N ILE 178.A O no hydrogen 3.212 N/A GLY 182.A N ILE 179.A O no hydrogen 3.046 N/A SER 183.A OG ALA 184.A O no hydrogen 2.995 N/A ALA 184.A N ALA 199.A O no hydrogen 2.830 N/A LEU 186.A N VAL 197.A O no hydrogen 2.710 N/A ASN 192.A N ASP 190.A OD1 no hydrogen 2.957 N/A ALA 194.A N ASN 192.A OD1 no hydrogen 2.947 N/A ASN 195.A N ASN 192.A O no hydrogen 3.247 N/A ASN 195.A ND2 ASP 190.A OD2 no hydrogen 3.014 N/A PHE 196.A N LEU 215.A O no hydrogen 2.916 N/A GLY 198.A N LEU 213.A O no hydrogen 2.896 N/A ALA 199.A N ALA 184.A O no hydrogen 3.344 N/A GLY 200.A N CYS 211.A O no hydrogen 2.902 N/A ILE 201.A N GLN 136.A O no hydrogen 2.870 N/A ILE 202.A N ILE 209.A O no hydrogen 2.701 N/A HIS 203.A N PHE 134.A O no hydrogen 2.917 N/A HIS 203.A ND1 GLN 208.A OE1 no hydrogen 2.822 N/A HIS 203.A NE2 GLN 136.A OE1 no hydrogen 2.602 N/A THR 204.A N THR 207.A O no hydrogen 3.247 N/A THR 204.A N GLN 208.A OE1 no hydrogen 3.319 N/A THR 204.A OG1 ILE 101.A O no hydrogen 3.247 N/A THR 204.A OG1 THR 207.A O no hydrogen 2.855 N/A LYS 205.A N CYS 100.A O no hydrogen 2.976 N/A THR 206.A N ILE 101.A O no hydrogen 3.176 N/A THR 206.A OG1 ILE 101.A O no hydrogen 2.928 N/A THR 207.A N THR 204.A OG1 no hydrogen 3.122 N/A GLN 208.A NE2 THR 204.A O no hydrogen 2.771 N/A ILE 209.A N ILE 202.A O no hydrogen 2.885 N/A GLY 210.A N SER 231.A OG no hydrogen 3.105 N/A CYS 211.A N GLY 200.A O no hydrogen 2.731 N/A CYS 211.A SG ILE 209.A O no hydrogen 3.519 N/A LEU 212.A N ARG 229.A O no hydrogen 2.779 N/A LEU 213.A N GLY 198.A O no hydrogen 2.888 N/A ARG 214.A N THR 227.A O no hydrogen 3.034 N/A ARG 214.A NE ASP 190.A OD2 no hydrogen 2.794 N/A ARG 214.A NH2 ASP 190.A OD2 no hydrogen 3.080 N/A LEU 215.A N PHE 196.A O no hydrogen 2.767 N/A GLU 216.A N ARG 225.A O no hydrogen 2.785 N/A ASN 218.A N MET 223.A O no hydrogen 2.634 N/A ALA 221.A N ASN 218.A OD1 no hydrogen 2.941 N/A GLN 222.A NE2 LEU 219.A O no hydrogen 3.225 N/A MET 223.A N ASN 218.A O no hydrogen 3.034 N/A TYR 224.A N PHE 163.A O no hydrogen 2.914 N/A ARG 225.A N GLU 216.A O no hydrogen 2.803 N/A ARG 225.A NE GLN 160.A OE1 no hydrogen 2.953 N/A ARG 225.A NH2 GLN 160.A OE1 no hydrogen 2.823 N/A LEU 226.A N ASN 161.A O no hydrogen 2.875 N/A THR 227.A N ARG 214.A O no hydrogen 2.879 N/A LEU 228.A N VAL 159.A O no hydrogen 2.811 N/A ARG 229.A N LEU 212.A O no hydrogen 2.932 N/A ARG 229.A NE GLU 158.A OE2 no hydrogen 2.845 N/A ARG 229.A NH1 TRP 149.A O no hydrogen 2.695 N/A ARG 229.A NH2 GLU 158.A OE2 no hydrogen 3.080 N/A THR 230.A N GLN 157.A O no hydrogen 3.282 N/A THR 230.A OG1 SER 236.A OG no hydrogen 2.629 N/A SER 231.A N GLY 210.A O no hydrogen 3.038 N/A LYS 232.A N THR 230.A OG1 no hydrogen 3.060 N/A LYS 232.A NZ ASP 103.A OD1 no hydrogen 2.665 N/A THR 234.A N ASP 233.A OD1 no hydrogen 2.817 N/A THR 234.A OG1 ASP 103.A OD2 no hydrogen 2.519 N/A VAL 235.A N LYS 232.A O no hydrogen 2.900 N/A SER 236.A N LYS 232.A O no hydrogen 3.096 N/A SER 236.A OG GLN 157.A O no hydrogen 2.833 N/A SER 236.A OG THR 230.A OG1 no hydrogen 2.629 N/A SER 236.A OG LYS 232.A O no hydrogen 3.329 N/A GLN 237.A N ASP 233.A O no hydrogen 2.987 N/A GLN 237.A NE2 GLU 241.A OE1 no hydrogen 2.788 N/A ARG 238.A N THR 234.A O no hydrogen 2.967 N/A ARG 238.A NH1 GLU 241.A OE2 no hydrogen 3.358 N/A LEU 239.A N VAL 235.A O no hydrogen 2.858 N/A CYS 240.A N SER 236.A O no hydrogen 3.005 N/A CYS 240.A SG VAL 159.A O no hydrogen 4.036 N/A GLU 241.A N GLN 237.A O no hydrogen 3.055 N/A LEU 242.A N ARG 238.A O no hydrogen 2.944 N/A LEU 243.A N LEU 239.A O no hydrogen 2.930 N/A SER 244.A N CYS 240.A O no hydrogen 3.053 N/A SER 244.A OG CYS 240.A O no hydrogen 2.727 N/A GLU 245.A N GLU 241.A O no hydrogen 3.293 N/A GLU 245.A N LEU 242.A O no hydrogen 3.224 N/A GLN 246.A N LEU 243.A O no hydrogen 2.995 N/A GLN 246.A NE2 ALA 15.A O no hydrogen 3.086 N/A