Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kdc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N GLU 1.A O no hydrogen 3.357 N/A GLU 6.A N ILE 2.A O no hydrogen 2.919 N/A ALA 7.A N ALA 3.A O no hydrogen 2.968 N/A VAL 8.A N LYS 4.A O no hydrogen 3.137 N/A ALA 9.A N PHE 5.A O no hydrogen 2.952 N/A SER 10.A N GLU 6.A O no hydrogen 2.964 N/A SER 10.A OG ALA 7.A O no hydrogen 2.619 N/A ARG 11.A N VAL 8.A O no hydrogen 2.934 N/A TRP 12.A N ALA 9.A O no hydrogen 3.146 N/A TRP 13.A NE1 GLY 52.A O no hydrogen 2.798 N/A ASP 14.A N ARG 11.A O no hydrogen 3.127 N/A GLU 16.A N ASP 14.A OD1 no hydrogen 2.970 N/A GLY 17.A N ASP 14.A O no hydrogen 3.176 N/A LYS 20.A N GLY 17.A O no hydrogen 3.067 N/A LEU 22.A N PHE 19.A O no hydrogen 2.884 N/A HIS 23.A N PHE 19.A O no hydrogen 3.318 N/A HIS 23.A ND1 PHE 19.A O no hydrogen 3.164 N/A ARG 24.A N LYS 20.A O no hydrogen 2.984 N/A ILE 25.A N PRO 21.A O no hydrogen 2.978 N/A ASN 26.A N LEU 22.A O no hydrogen 3.166 N/A ASN 26.A ND2 SER 58.A OG no hydrogen 3.063 N/A LEU 28.A N ILE 25.A O no hydrogen 3.081 N/A ARG 29.A N ILE 25.A O no hydrogen 3.361 N/A ARG 29.A NH2 GLU 115.A OE1 no hydrogen 2.880 N/A LEU 30.A N ASN 26.A O no hydrogen 2.792 N/A GLY 31.A N PRO 27.A O no hydrogen 2.918 N/A TYR 32.A N LEU 28.A O no hydrogen 3.135 N/A ILE 33.A N ARG 29.A O no hydrogen 2.924 N/A ALA 34.A N LEU 30.A O no hydrogen 2.871 N/A GLU 35.A N GLY 31.A O no hydrogen 2.915 N/A ARG 36.A N TYR 32.A O no hydrogen 2.853 N/A ARG 36.A NE GLU 35.A OE2 no hydrogen 3.121 N/A ARG 36.A NH2 GLU 35.A OE2 no hydrogen 3.220 N/A ALA 37.A N ILE 33.A O no hydrogen 2.853 N/A GLY 38.A N GLU 35.A O no hydrogen 3.480 N/A GLY 39.A N ALA 34.A O no hydrogen 2.843 N/A GLY 42.A N GLY 63.A O no hydrogen 2.987 N/A LYS 43.A N LEU 40.A O no hydrogen 2.971 N/A LYS 43.A NZ GLY 39.A O no hydrogen 3.048 N/A LYS 44.A N ASP 109.A OD2 no hydrogen 2.773 N/A VAL 45.A N THR 65.A O no hydrogen 2.977 N/A LEU 46.A N VAL 110.A O no hydrogen 2.866 N/A ASP 47.A N THR 67.A O no hydrogen 2.748 N/A VAL 48.A N THR 112.A O no hydrogen 2.753 N/A GLY 49.A N LEU 69.A O no hydrogen 2.751 N/A CYS 50.A N LEU 69.A O no hydrogen 2.961 N/A CYS 50.A SG GLY 51.A O no hydrogen 3.872 N/A GLY 51.A N ASP 70.A OD2 no hydrogen 2.856 N/A GLY 53.A N CYS 50.A O no hydrogen 2.943 N/A GLU 57.A N GLY 53.A O no hydrogen 2.945 N/A SER 58.A N ILE 54.A O no hydrogen 3.357 N/A SER 58.A OG ILE 54.A O no hydrogen 3.441 N/A SER 58.A OG LEU 55.A O no hydrogen 2.713 N/A MET 59.A N LEU 55.A O no hydrogen 2.958 N/A ALA 60.A N ALA 56.A O no hydrogen 3.001 N/A ARG 61.A N GLU 57.A O no hydrogen 2.990 N/A GLU 62.A N MET 59.A O no hydrogen 3.116 N/A GLY 63.A N ALA 60.A O no hydrogen 2.998 N/A ALA 64.A N MET 59.A O no hydrogen 3.360 N/A THR 65.A N LYS 43.A O no hydrogen 2.892 N/A THR 67.A N VAL 45.A O no hydrogen 2.837 N/A THR 67.A OG1 TYR 108.A OH no hydrogen 3.413 N/A GLY 68.A N ASP 91.A O no hydrogen 2.715 N/A LEU 69.A N ASP 47.A O no hydrogen 2.903 N/A ASP 70.A N VAL 93.A O no hydrogen 3.240 N/A GLY 72.A N ASP 70.A OD1 no hydrogen 2.823 N/A LEU 76.A N GLY 72.A O no hydrogen 3.426 N/A GLN 77.A N PHE 73.A O no hydrogen 3.153 N/A GLN 77.A N GLU 74.A O no hydrogen 3.037 N/A VAL 78.A N GLU 74.A O no hydrogen 3.164 N/A ALA 79.A N PRO 75.A O no hydrogen 2.916 N/A LYS 80.A N LEU 76.A O no hydrogen 3.039 N/A LEU 81.A N GLN 77.A O no hydrogen 2.881 N/A HIS 82.A N VAL 78.A O no hydrogen 2.997 N/A ALA 83.A N ALA 79.A O no hydrogen 3.075 N/A LEU 84.A N LYS 80.A O no hydrogen 2.998 N/A GLU 85.A N LEU 81.A O no hydrogen 2.985 N/A SER 86.A N HIS 82.A O no hydrogen 2.849 N/A SER 86.A OG GLU 57.A OE1 no hydrogen 3.370 N/A SER 86.A OG HIS 82.A O no hydrogen 2.800 N/A ILE 88.A N ALA 83.A O no hydrogen 3.235 N/A ASP 91.A N VAL 66.A O no hydrogen 3.061 N/A VAL 93.A N GLY 68.A O no hydrogen 2.766 N/A GLN 94.A NE2 MET 71.A O no hydrogen 2.983 N/A THR 96.A N GLU 99.A OE1 no hydrogen 3.097 N/A THR 96.A OG1 GLU 99.A OE1 no hydrogen 3.126 N/A GLU 98.A N GLU 98.A OE1 no hydrogen 2.896 N/A GLU 99.A N THR 96.A OG1 no hydrogen 2.921 N/A HIS 100.A N THR 96.A O no hydrogen 3.061 N/A HIS 100.A ND1 GLU 95.A OE2 no hydrogen 2.559 N/A HIS 100.A NE2 TYR 108.A OH no hydrogen 2.683 N/A ALA 101.A N VAL 97.A O no hydrogen 2.829 N/A ALA 102.A N GLU 98.A O no hydrogen 3.151 N/A LYS 103.A N HIS 100.A O no hydrogen 3.177 N/A LYS 103.A NZ GLU 95.A OE1 no hydrogen 3.261 N/A HIS 104.A N HIS 100.A O no hydrogen 2.875 N/A GLY 106.A N GLN 132.A O no hydrogen 2.789 N/A GLN 107.A N HIS 104.A O no hydrogen 3.352 N/A TYR 108.A N LEU 133.A O no hydrogen 3.025 N/A TYR 108.A OH THR 67.A OG1 no hydrogen 3.413 N/A TYR 108.A OH HIS 100.A NE2 no hydrogen 2.683 N/A VAL 110.A N LYS 44.A O no hydrogen 3.135 N/A VAL 111.A N ASP 139.A O no hydrogen 2.916 N/A THR 112.A N LEU 46.A O no hydrogen 2.782 N/A THR 112.A OG1 LEU 46.A O no hydrogen 3.456 N/A THR 112.A OG1 ASP 47.A OD1 no hydrogen 2.728 N/A CYS 113.A N PHE 141.A O no hydrogen 2.700 N/A GLU 118.A N GLU 118.A OE2 no hydrogen 2.767 N/A HIS 119.A N MET 116.A O no hydrogen 3.116 N/A SER 125.A N ASP 122.A O no hydrogen 3.081 N/A SER 125.A N ASP 122.A OD1 no hydrogen 3.362 N/A SER 125.A OG GLU 98.A OE2 no hydrogen 2.388 N/A VAL 126.A N ASP 122.A O no hydrogen 3.420 N/A VAL 127.A N PRO 123.A O no hydrogen 3.006 N/A ARG 128.A N GLN 124.A O no hydrogen 3.055 N/A ALA 129.A N SER 125.A O no hydrogen 2.977 N/A CYS 130.A N VAL 126.A O no hydrogen 2.906 N/A CYS 130.A SG VAL 126.A O no hydrogen 3.244 N/A ALA 131.A N VAL 127.A O no hydrogen 3.050 N/A GLN 132.A N ARG 128.A O no hydrogen 3.116 N/A LEU 133.A N ALA 129.A O no hydrogen 2.918 N/A LEU 133.A N CYS 130.A O no hydrogen 3.090 N/A LYS 135.A N TYR 108.A O no hydrogen 2.810 N/A LYS 135.A NZ ASP 109.A OD1 no hydrogen 3.049 N/A GLY 137.A N ASN 217.A O no hydrogen 3.255 N/A GLY 138.A N LYS 135.A O no hydrogen 2.990 N/A ASP 139.A N ASP 109.A O no hydrogen 3.059 N/A VAL 140.A N THR 215.A O no hydrogen 2.942 N/A PHE 141.A N VAL 111.A O no hydrogen 2.844 N/A PHE 142.A N LEU 213.A O no hydrogen 2.975 N/A SER 143.A N CYS 113.A O no hydrogen 3.068 N/A SER 143.A OG TYR 211.A O no hydrogen 3.338 N/A THR 144.A N TYR 211.A O no hydrogen 3.051 N/A THR 144.A OG1 GLU 118.A OE2 no hydrogen 2.848 N/A LEU 145.A N THR 144.A OG1 no hydrogen 2.727 N/A ASN 146.A N VAL 209.A O no hydrogen 2.694 N/A ASN 146.A ND2 VAL 207.A O no hydrogen 2.860 N/A ARG 147.A N ASN 146.A OD1 no hydrogen 2.786 N/A GLY 149.A N ASN 146.A O no hydrogen 2.911 N/A SER 151.A OG HIS 119.A NE2 no hydrogen 3.343 N/A MET 154.A N SER 151.A OG no hydrogen 3.414 N/A ALA 155.A N SER 151.A O no hydrogen 2.953 N/A VAL 156.A N TRP 152.A O no hydrogen 3.038 N/A VAL 156.A N LEU 153.A O no hydrogen 2.944 N/A VAL 157.A N LEU 153.A O no hydrogen 2.934 N/A GLY 158.A N MET 154.A O no hydrogen 2.793 N/A ILE 162.A N GLY 158.A O no hydrogen 3.364 N/A LEU 163.A N ALA 159.A O no hydrogen 3.259 N/A ARG 164.A N GLU 160.A O no hydrogen 3.296 N/A MET 165.A N TYR 161.A O no hydrogen 3.381 N/A VAL 166.A N LEU 163.A O no hydrogen 3.389 N/A ILE 170.A N LEU 145.A O no hydrogen 2.880 N/A LYS 171.A N GLU 174.A OE1 no hydrogen 3.366 N/A LEU 175.A N LYS 171.A O no hydrogen 3.058 N/A LEU 176.A N PRO 172.A O no hydrogen 2.856 N/A GLY 177.A N ALA 173.A O no hydrogen 2.968 N/A TRP 178.A N GLU 174.A O no hydrogen 2.983 N/A VAL 179.A N LEU 175.A O no hydrogen 2.858 N/A ASP 180.A N LEU 176.A O no hydrogen 2.878 N/A GLN 181.A N GLY 177.A O no hydrogen 3.332 N/A GLN 181.A N TRP 178.A O no hydrogen 3.267 N/A THR 182.A N VAL 179.A O no hydrogen 2.978 N/A THR 182.A OG1 VAL 179.A O no hydrogen 2.683 N/A SER 183.A OG ASN 217.A OD1 no hydrogen 2.488 N/A LEU 184.A N THR 182.A OG1 no hydrogen 3.021 N/A LYS 185.A N GLN 216.A O no hydrogen 2.693 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.843 N/A ARG 187.A N HIS 214.A O no hydrogen 2.797 N/A ARG 187.A NE GLN 216.A OE1 no hydrogen 3.057 N/A HIS 188.A N HIS 214.A O no hydrogen 3.292 N/A THR 190.A N MET 212.A O no hydrogen 3.027 N/A THR 190.A OG1 GLY 191.A O no hydrogen 3.197 N/A THR 190.A OG1 GLY 204.A O no hydrogen 3.317 N/A GLY 191.A N GLY 204.A O no hydrogen 2.645 N/A LEU 192.A N ASN 210.A O no hydrogen 2.892 N/A HIS 193.A N LYS 202.A O no hydrogen 2.786 N/A HIS 193.A NE2 GLY 204.A O no hydrogen 2.952 N/A HIS 193.A NE2 PRO 205.A O no hydrogen 3.073 N/A ASN 195.A N THR 200.A O no hydrogen 2.889 N/A ILE 197.A N ASN 195.A OD1 no hydrogen 2.926 N/A THR 198.A N ASN 195.A OD1 no hydrogen 3.450 N/A THR 198.A OG1 THR 200.A OG1 no hydrogen 2.557 N/A ASN 199.A ND2 TYR 194.A OH no hydrogen 2.772 N/A THR 200.A OG1 THR 198.A OG1 no hydrogen 2.557 N/A LYS 202.A N HIS 193.A O no hydrogen 2.864 N/A GLY 204.A N GLY 191.A O no hydrogen 2.956 N/A ASN 210.A ND2 LYS 150.A O no hydrogen 3.479 N/A TYR 211.A N THR 144.A O no hydrogen 2.962 N/A TYR 211.A OH ILE 170.A O no hydrogen 2.609 N/A MET 212.A N THR 190.A O no hydrogen 2.896 N/A LEU 213.A N PHE 142.A O no hydrogen 2.729 N/A HIS 214.A N HIS 188.A O no hydrogen 2.892 N/A HIS 214.A NE2 ASP 139.A OD1 no hydrogen 2.832 N/A THR 215.A N VAL 140.A O no hydrogen 2.856 N/A THR 215.A OG1 VAL 140.A O no hydrogen 2.760 N/A GLN 216.A N LYS 185.A O no hydrogen 2.836 N/A GLN 216.A NE2 ASP 139.A OD1 no hydrogen 2.991 N/A ASN 217.A N GLY 138.A O no hydrogen 2.879 N/A ASN 217.A ND2 LYS 135.A O no hydrogen 3.052 N/A