Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kfq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N TYR 170.A O no hydrogen 2.737 N/A TRP 7.A N VAL 168.A O no hydrogen 2.823 N/A TRP 7.A NE1 VAL 126.A O no hydrogen 2.695 N/A ARG 8.A N ASP 6.A OD2 no hydrogen 2.984 N/A ARG 8.A NE ASP 6.A OD1 no hydrogen 3.354 N/A ARG 8.A NE ASP 6.A OD2 no hydrogen 2.952 N/A ARG 8.A NH2 ASP 6.A OD1 no hydrogen 2.906 N/A LYS 9.A N ASP 6.A O no hydrogen 3.127 N/A LYS 10.A N TRP 7.A O no hydrogen 3.054 N/A GLY 11.A N ARG 8.A O no hydrogen 3.182 N/A TYR 12.A N TRP 7.A O no hydrogen 3.385 N/A THR 14.A OG1 GLU 34.A OE1 no hydrogen 2.722 N/A LYS 17.A NZ GLU 34.A OE2 no hydrogen 2.768 N/A LYS 17.A NZ SER 46.A OG no hydrogen 2.951 N/A LYS 17.A NZ LEU 47.A O no hydrogen 3.221 N/A LYS 17.A NZ GLU 49.A OE1 no hydrogen 2.692 N/A GLN 19.A N SER 188.A O no hydrogen 2.822 N/A GLN 19.A NE2 SER 188.A OG no hydrogen 2.765 N/A LYS 20.A N ASN 18.A OD1 no hydrogen 2.863 N/A GLY 23.A N CYS 64.A O no hydrogen 2.844 N/A SER 24.A OG TYR 90.A OH no hydrogen 2.703 N/A TRP 25.A NE1 GLY 63.A O no hydrogen 3.155 N/A ALA 26.A N SER 24.A O no hydrogen 2.807 N/A PHE 27.A N SER 24.A O no hydrogen 3.292 N/A SER 28.A OG VAL 165.A O no hydrogen 2.572 N/A ALA 29.A N TRP 25.A O no hydrogen 2.981 N/A THR 30.A N ALA 26.A O no hydrogen 2.800 N/A THR 30.A OG1 ALA 26.A O no hydrogen 3.093 N/A THR 30.A OG1 PHE 27.A O no hydrogen 3.133 N/A THR 30.A OG1 GLU 49.A OE1 no hydrogen 2.660 N/A GLY 31.A N PHE 27.A O no hydrogen 2.919 N/A ALA 32.A N SER 28.A O no hydrogen 2.993 N/A LEU 33.A N ALA 29.A O no hydrogen 2.919 N/A GLU 34.A N THR 30.A O no hydrogen 2.678 N/A GLY 35.A N GLY 31.A O no hydrogen 3.149 N/A GLN 36.A N ALA 32.A O no hydrogen 3.012 N/A GLN 36.A NE2 VAL 129.A O no hydrogen 2.953 N/A MET 37.A N LEU 33.A O no hydrogen 2.828 N/A PHE 38.A N GLU 34.A O no hydrogen 2.984 N/A ARG 39.A N GLY 35.A O no hydrogen 2.869 N/A ARG 39.A NH1 VAL 220.A OXT no hydrogen 3.402 N/A ARG 39.A NH2 GLN 36.A OE1 no hydrogen 2.778 N/A LYS 40.A N GLN 36.A O no hydrogen 2.934 N/A LYS 40.A NZ VAL 220.A O no hydrogen 3.333 N/A THR 41.A N MET 37.A O no hydrogen 2.984 N/A THR 41.A OG1 MET 37.A O no hydrogen 2.923 N/A GLY 42.A N PHE 38.A O no hydrogen 2.671 N/A LYS 43.A N THR 41.A OG1 no hydrogen 2.914 N/A LEU 47.A N GLU 34.A OE2 no hydrogen 2.831 N/A SER 48.A N ASP 83.A O no hydrogen 3.084 N/A SER 48.A OG TYR 88.A O no hydrogen 2.654 N/A ASN 51.A N SER 48.A OG no hydrogen 2.832 N/A VAL 53.A N GLU 49.A O no hydrogen 2.893 N/A ASP 54.A N GLN 50.A O no hydrogen 2.821 N/A CYS 55.A N ASN 51.A O no hydrogen 3.048 N/A CYS 55.A SG ASN 51.A O no hydrogen 3.227 N/A CYS 55.A SG ASN 51.A OD1 no hydrogen 3.489 N/A CYS 55.A SG TYR 88.A OH no hydrogen 3.853 N/A SER 56.A N LEU 52.A O no hydrogen 3.204 N/A SER 56.A OG LEU 52.A O no hydrogen 2.637 N/A SER 56.A OG ASN 61.A OD1 no hydrogen 3.009 N/A ARG 57.A NH2 ASP 94.A OD2 no hydrogen 2.455 N/A GLN 59.A NE2 GLU 78.A OE1 no hydrogen 2.874 N/A GLY 60.A N ARG 57.A O no hydrogen 2.836 N/A ASN 61.A N SER 56.A O no hydrogen 3.301 N/A ASN 61.A ND2 PHE 68.A O no hydrogen 3.442 N/A GLN 62.A N GLY 66.A O no hydrogen 2.634 N/A CYS 64.A N ASP 94.A OD1 no hydrogen 2.712 N/A CYS 64.A SG ASP 94.A OD1 no hydrogen 3.457 N/A ASN 65.A N GLN 62.A O no hydrogen 2.872 N/A GLY 66.A N GLY 63.A O no hydrogen 3.148 N/A ARG 71.A NH1 GLY 60.A O no hydrogen 2.842 N/A ALA 72.A N PHE 68.A O no hydrogen 3.100 N/A PHE 73.A N MET 69.A O no hydrogen 2.966 N/A GLN 74.A N ALA 70.A O no hydrogen 3.023 N/A TYR 75.A N ARG 71.A O no hydrogen 2.973 N/A TYR 75.A OH ASN 51.A OD1 no hydrogen 2.957 N/A VAL 76.A N ALA 72.A O no hydrogen 3.003 N/A LYS 77.A N PHE 73.A O no hydrogen 3.042 N/A LYS 77.A NZ THR 109.A O no hydrogen 3.295 N/A GLU 78.A N GLN 74.A O no hydrogen 2.844 N/A ASN 79.A N TYR 75.A O no hydrogen 2.712 N/A GLY 80.A N LYS 77.A O no hydrogen 3.234 N/A LEU 82.A N SER 104.A OG no hydrogen 3.092 N/A LEU 82.A N ALA 106.A O no hydrogen 3.172 N/A SER 84.A OG SER 87.A OG no hydrogen 3.283 N/A GLU 85.A N SER 46.A O no hydrogen 2.925 N/A SER 87.A N SER 84.A O no hydrogen 3.197 N/A SER 87.A N SER 84.A OG no hydrogen 3.009 N/A SER 87.A OG SER 84.A O no hydrogen 3.206 N/A SER 87.A OG SER 84.A OG no hydrogen 3.283 N/A TYR 88.A N SER 84.A O no hydrogen 3.078 N/A TYR 88.A N GLU 85.A O no hydrogen 3.082 N/A TYR 88.A OH ASP 54.A OD2 no hydrogen 2.724 N/A TYR 90.A N GLU 85.A OE2 no hydrogen 3.042 N/A TYR 90.A OH GLN 19.A O no hydrogen 2.598 N/A TYR 90.A OH SER 24.A OG no hydrogen 2.703 N/A GLU 95.A N ASP 54.A OD1 no hydrogen 2.857 N/A LYS 98.A N TYR 88.A OH no hydrogen 2.810 N/A LYS 98.A NZ ILE 96.A O no hydrogen 2.797 N/A ARG 100.A N ASP 83.A OD2 no hydrogen 2.954 N/A GLU 102.A N GLU 102.A OE2 no hydrogen 2.787 N/A ASN 103.A N ARG 100.A O no hydrogen 3.101 N/A SER 104.A N PRO 101.A O no hydrogen 3.103 N/A SER 104.A OG LEU 82.A O no hydrogen 3.500 N/A VAL 105.A N LEU 82.A O no hydrogen 2.873 N/A THR 109.A N ASN 219.A O no hydrogen 2.927 N/A THR 109.A OG1 ASN 219.A O no hydrogen 3.411 N/A GLY 110.A N ASP 108.A OD2 no hydrogen 3.275 N/A THR 112.A N TYR 217.A O no hydrogen 2.837 N/A THR 112.A OG1 ASN 219.A OD1 no hydrogen 2.608 N/A VAL 114.A N ALA 215.A O no hydrogen 2.995 N/A GLY 117.A N ALA 212.A O no hydrogen 2.677 N/A LYS 118.A N ALA 115.A O no hydrogen 3.158 N/A LEU 122.A N LYS 118.A O no hydrogen 3.001 N/A MET 123.A N GLU 119.A O no hydrogen 2.927 N/A LYS 124.A N LYS 120.A O no hydrogen 3.005 N/A ALA 125.A N ALA 121.A O no hydrogen 2.850 N/A VAL 126.A N LEU 122.A O no hydrogen 2.897 N/A ALA 127.A N MET 123.A O no hydrogen 2.946 N/A THR 128.A N LYS 124.A O no hydrogen 2.965 N/A THR 128.A OG1 LYS 124.A O no hydrogen 2.854 N/A VAL 129.A N ALA 125.A O no hydrogen 2.761 N/A ILE 132.A N VAL 167.A O no hydrogen 3.020 N/A SER 133.A N SER 216.A O no hydrogen 2.956 N/A SER 133.A OG SER 28.A O no hydrogen 3.026 N/A SER 133.A OG SER 28.A OG no hydrogen 3.197 N/A VAL 134.A N VAL 165.A O no hydrogen 3.052 N/A MET 136.A N HIS 163.A O no hydrogen 2.820 N/A ASP 137.A N CYS 209.A O no hydrogen 2.870 N/A ALA 138.A N ASP 162.A OD1 no hydrogen 2.800 N/A GLY 139.A N ASP 137.A OD1 no hydrogen 3.344 N/A HIS 140.A NE2 ASP 137.A OD2 no hydrogen 2.590 N/A SER 142.A OG TYR 151.A OH no hydrogen 2.717 N/A SER 142.A OG GLU 153.A OE1 no hydrogen 2.593 N/A PHE 143.A N HIS 140.A O no hydrogen 2.973 N/A GLN 144.A N HIS 140.A O no hydrogen 3.376 N/A PHE 145.A N SER 141.A O no hydrogen 3.091 N/A TYR 146.A N PHE 143.A O no hydrogen 3.034 N/A TYR 146.A OH GLY 149.A O no hydrogen 2.646 N/A TYR 151.A N LYS 200.A O no hydrogen 2.787 N/A TYR 151.A OH SER 142.A OG no hydrogen 2.717 N/A GLU 153.A N HIS 208.A NE2 no hydrogen 2.770 N/A ASP 155.A N GLU 153.A OE2 no hydrogen 2.788 N/A CYS 156.A N GLU 153.A O no hydrogen 2.952 N/A CYS 156.A SG ASP 137.A O no hydrogen 3.378 N/A SER 157.A N ASP 137.A OD2 no hydrogen 2.831 N/A SER 158.A OG ASN 207.A O no hydrogen 2.842 N/A LYS 159.A N SER 157.A OG no hydrogen 2.964 N/A ASN 160.A N SER 157.A OG no hydrogen 2.899 N/A ASP 162.A N MET 136.A O no hydrogen 2.896 N/A HIS 163.A N MET 136.A O no hydrogen 3.208 N/A HIS 163.A NE2 ASN 187.A OD1 no hydrogen 2.670 N/A VAL 165.A N VAL 134.A O no hydrogen 2.807 N/A LEU 166.A N LYS 186.A O no hydrogen 3.325 N/A VAL 167.A N ILE 132.A O no hydrogen 2.851 N/A VAL 168.A N LEU 184.A O no hydrogen 2.843 N/A TYR 170.A N VAL 5.A O no hydrogen 2.874 N/A TYR 170.A OH PRO 2.A O no hydrogen 2.722 N/A GLY 171.A N TYR 182.A O no hydrogen 3.023 N/A GLU 173.A N SER 180.A O no hydrogen 2.889 N/A ASP 178.A N ASN 176.A OD1 no hydrogen 3.144 N/A ASN 179.A N ASN 176.A O no hydrogen 2.832 N/A LYS 181.A NZ ASP 178.A OD1 no hydrogen 3.241 N/A LYS 181.A NZ ASP 204.A OD2 no hydrogen 2.721 N/A TYR 182.A N GLY 171.A O no hydrogen 2.940 N/A TRP 183.A N ILE 201.A O no hydrogen 2.813 N/A TRP 183.A NE1 GLU 119.A OE1 no hydrogen 2.927 N/A LEU 184.A N GLY 169.A O no hydrogen 2.890 N/A VAL 185.A N VAL 199.A O no hydrogen 2.981 N/A LYS 186.A N LEU 166.A O no hydrogen 2.701 N/A LYS 186.A NZ THR 14.A O no hydrogen 2.890 N/A LYS 186.A NZ PRO 15.A O no hydrogen 3.278 N/A ASN 187.A N GLY 197.A O no hydrogen 3.169 N/A SER 188.A N ASN 187.A OD1 no hydrogen 2.833 N/A GLY 190.A N LYS 17.A O no hydrogen 2.909 N/A TRP 193.A N GLY 190.A O no hydrogen 3.293 N/A SER 195.A N TYR 198.A O no hydrogen 2.869 N/A GLY 197.A N TRP 193.A O no hydrogen 2.702 N/A TYR 198.A N SER 195.A O no hydrogen 3.021 N/A VAL 199.A N VAL 185.A O no hydrogen 3.068 N/A LYS 200.A N TYR 146.A OH no hydrogen 3.226 N/A LYS 200.A NZ TYR 182.A OH no hydrogen 3.463 N/A ILE 201.A N TRP 183.A O no hydrogen 2.887 N/A ALA 202.A N TYR 151.A O no hydrogen 3.031 N/A LYS 203.A N LYS 181.A O no hydrogen 2.996 N/A LYS 203.A NZ ASP 204.A OD2 no hydrogen 3.080 N/A ASP 204.A N GLU 119.A OE1 no hydrogen 2.883 N/A ASN 207.A N GLU 119.A OE2 no hydrogen 2.760 N/A CYS 209.A SG ASP 137.A O no hydrogen 3.891 N/A GLY 210.A N ASN 207.A O no hydrogen 3.170 N/A ILE 211.A N HIS 208.A O no hydrogen 3.358 N/A THR 213.A N GLY 210.A O no hydrogen 2.825 N/A THR 213.A OG1 SER 158.A O no hydrogen 2.612 N/A THR 213.A OG1 ASN 207.A OD1 no hydrogen 2.804 N/A SER 216.A N SER 133.A O no hydrogen 2.857 N/A TYR 217.A N THR 112.A O no hydrogen 3.041 N/A ASN 219.A N GLY 110.A O no hydrogen 2.887 N/A