Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1yfi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLN 58.A OE1 no hydrogen 3.054 N/A ARG 2.A NE GLU 213.A OE1 no hydrogen 3.159 N/A ARG 2.A NH1 ASP 16.A OD2 no hydrogen 3.129 N/A ARG 2.A NH2 ASP 16.A OD1 no hydrogen 3.144 N/A ARG 2.A NH2 GLU 213.A OE2 no hydrogen 3.350 N/A THR 3.A OG1 GLU 59.A OE1 no hydrogen 2.630 N/A LEU 6.A N THR 3.A OG1 no hydrogen 3.330 N/A SER 7.A N THR 3.A O no hydrogen 2.796 N/A LYS 8.A N GLU 4.A O no hydrogen 3.191 N/A LYS 8.A NZ ASP 12.A OD2 no hydrogen 3.164 N/A LEU 9.A N LEU 5.A O no hydrogen 3.058 N/A TYR 10.A N LEU 6.A O no hydrogen 2.839 N/A TYR 10.A OH TYR 34.A OH no hydrogen 2.687 N/A TYR 10.A OH ARG 212.A O no hydrogen 2.537 N/A ASP 11.A N SER 7.A O no hydrogen 2.953 N/A ASP 12.A N LYS 8.A O no hydrogen 2.865 N/A PHE 13.A N LEU 9.A O no hydrogen 2.768 N/A GLY 14.A N ASP 11.A O no hydrogen 2.987 N/A ILE 15.A N TYR 10.A O no hydrogen 3.002 N/A GLN 17.A N GLY 14.A O no hydrogen 3.041 N/A LEU 18.A N ILE 15.A O no hydrogen 3.378 N/A THR 21.A N PRO 19.A O no hydrogen 2.548 N/A GLN 22.A N PRO 19.A O no hydrogen 2.803 N/A THR 26.A N GLN 22.A O no hydrogen 3.019 N/A THR 26.A OG1 GLN 22.A O no hydrogen 2.774 N/A SER 27.A N HIS 23.A O no hydrogen 2.969 N/A SER 27.A N GLY 24.A O no hydrogen 3.165 N/A ASP 28.A N GLY 24.A O no hydrogen 3.230 N/A ARG 29.A N VAL 25.A O no hydrogen 2.951 N/A LEU 30.A N THR 26.A O no hydrogen 2.994 N/A GLY 31.A N SER 27.A O no hydrogen 2.990 N/A LYS 32.A N ASP 28.A O no hydrogen 2.930 N/A LYS 32.A NZ GLU 35.A OE1 no hydrogen 2.914 N/A LYS 32.A NZ GLU 35.A OE2 no hydrogen 3.383 N/A LEU 33.A N ARG 29.A O no hydrogen 2.549 N/A TYR 34.A N LEU 30.A O no hydrogen 2.762 N/A TYR 34.A OH TYR 10.A OH no hydrogen 2.687 N/A GLU 35.A N LYS 32.A O no hydrogen 3.332 N/A LYS 36.A N LYS 32.A O no hydrogen 3.272 N/A LYS 36.A NZ ASP 40.A OD1 no hydrogen 3.164 N/A LYS 36.A NZ ASP 40.A OD2 no hydrogen 3.117 N/A TYR 37.A N LEU 33.A O no hydrogen 3.049 N/A TYR 37.A OH GLU 59.A OE1 no hydrogen 2.645 N/A LEU 39.A N GLU 35.A O no hydrogen 2.996 N/A ASP 40.A N LYS 36.A O no hydrogen 2.644 N/A ILE 41.A N TYR 37.A O no hydrogen 3.008 N/A PHE 42.A N ILE 38.A O no hydrogen 3.077 N/A LYS 43.A N ASP 40.A O no hydrogen 3.043 N/A SER 47.A N ASP 44.A OD2 no hydrogen 2.706 N/A SER 47.A OG ASP 44.A OD2 no hydrogen 2.892 N/A LEU 48.A N ASP 44.A O no hydrogen 3.018 N/A LYS 49.A N ILE 45.A O no hydrogen 3.080 N/A LYS 50.A N GLU 46.A O no hydrogen 2.996 N/A TYR 51.A N SER 47.A O no hydrogen 2.754 N/A ASN 52.A N LYS 49.A O no hydrogen 3.373 N/A THR 53.A N LYS 50.A O no hydrogen 3.339 N/A THR 53.A OG1 LYS 50.A O no hydrogen 3.084 N/A ALA 55.A N THR 53.A OG1 no hydrogen 3.313 N/A PHE 56.A N THR 53.A O no hydrogen 3.279 N/A GLN 58.A NE2 MET 1.A O no hydrogen 3.172 N/A GLN 58.A NE2 TYR 37.A OH no hydrogen 2.980 N/A GLU 59.A N GLU 59.A OE2 no hydrogen 2.730 N/A LYS 60.A N PHE 56.A O no hydrogen 2.824 N/A LYS 60.A NZ ASN 54.A OD1 no hydrogen 2.820 N/A ASP 61.A N PRO 57.A O no hydrogen 3.007 N/A ILE 62.A N GLN 58.A O no hydrogen 3.044 N/A SER 63.A N GLU 59.A O no hydrogen 2.851 N/A SER 63.A OG ASN 52.A OD1 no hydrogen 2.946 N/A SER 63.A OG GLU 59.A O no hydrogen 3.019 N/A SER 63.A OG LYS 60.A O no hydrogen 3.157 N/A SER 64.A N LYS 60.A O no hydrogen 2.913 N/A SER 64.A OG LYS 60.A O no hydrogen 2.844 N/A LYS 65.A N ASP 61.A O no hydrogen 2.963 N/A LYS 65.A NZ ASP 61.A OD2 no hydrogen 2.904 N/A LYS 65.A NZ VAL 217.A O no hydrogen 2.881 N/A LEU 66.A N ILE 62.A O no hydrogen 3.004 N/A LEU 67.A N SER 63.A O no hydrogen 2.932 N/A LYS 68.A N SER 64.A O no hydrogen 2.783 N/A ALA 69.A N LYS 65.A O no hydrogen 2.975 N/A LEU 70.A N LEU 66.A O no hydrogen 3.268 N/A LEU 70.A N LEU 67.A O no hydrogen 3.059 N/A ASN 71.A N LYS 68.A O no hydrogen 3.115 N/A LEU 72.A N LEU 67.A O no hydrogen 3.004 N/A ASN 76.A N ASP 73.A O no hydrogen 3.006 N/A ILE 77.A N LEU 74.A O no hydrogen 3.154 N/A ILE 78.A N THR 105.A O no hydrogen 2.626 N/A ASP 79.A N THR 105.A O no hydrogen 3.120 N/A SER 81.A N ARG 103.A O no hydrogen 3.224 N/A SER 82.A OG LEU 39.A O no hydrogen 2.710 N/A SER 82.A OG PHE 42.A O no hydrogen 3.010 N/A SER 83.A N THR 101.A O no hydrogen 3.147 N/A THR 85.A N ASP 99.A O no hydrogen 3.008 N/A ILE 91.A N GLY 94.A O no hydrogen 2.860 N/A GLY 94.A N ILE 91.A O no hydrogen 2.764 N/A THR 98.A OG1 ILE 198.A O no hydrogen 2.943 N/A ASP 99.A N LEU 116.A O no hydrogen 2.759 N/A ALA 100.A N LEU 116.A O no hydrogen 3.395 N/A THR 101.A N SER 83.A O no hydrogen 3.025 N/A ILE 102.A N VAL 114.A O no hydrogen 3.151 N/A ARG 103.A N SER 81.A O no hydrogen 2.953 N/A ARG 103.A NH1 SER 111.A OG no hydrogen 3.186 N/A PHE 104.A N ARG 112.A O no hydrogen 3.146 N/A THR 105.A N ASP 79.A O no hydrogen 2.824 N/A PHE 106.A N SER 110.A O no hydrogen 2.897 N/A GLN 109.A N PHE 106.A O no hydrogen 3.195 N/A SER 110.A N ASN 108.A OD1 no hydrogen 2.954 N/A SER 110.A OG ASN 108.A OD1 no hydrogen 2.714 N/A ARG 112.A N PHE 104.A O no hydrogen 2.827 N/A ARG 112.A NE LEU 113.A O no hydrogen 3.068 N/A ARG 112.A NH2 ASP 202.A OD2 no hydrogen 3.019 N/A VAL 114.A N ILE 102.A O no hydrogen 2.820 N/A LEU 116.A N ALA 100.A O no hydrogen 2.558 N/A ASN 117.A N LEU 203.A O no hydrogen 3.154 N/A ASN 117.A ND2 LYS 97.A O no hydrogen 2.605 N/A ILE 118.A N ASP 99.A OD2 no hydrogen 2.844 N/A LYS 119.A N ILE 205.A O no hydrogen 2.973 N/A LYS 119.A NZ SER 127.A O no hydrogen 3.474 N/A SER 121.A N PHE 207.A O no hydrogen 3.020 N/A SER 121.A OG LYS 123.A O no hydrogen 3.424 N/A LYS 123.A N SER 121.A OG no hydrogen 2.914 N/A LYS 125.A NZ GLU 232.A OE1 no hydrogen 2.819 N/A LYS 125.A NZ GLU 232.A OE2 no hydrogen 3.102 N/A LYS 125.A NZ GLY 244.A O no hydrogen 3.569 N/A VAL 126.A N GLY 262.A O no hydrogen 3.103 N/A ILE 128.A N PHE 260.A O no hydrogen 2.782 N/A TYR 131.A N MET 258.A O no hydrogen 2.832 N/A TYR 131.A OH CYS 186.A O no hydrogen 2.719 N/A VAL 133.A N GLN 155.A OE1 no hydrogen 2.639 N/A GLU 134.A N ASP 132.A OD2 no hydrogen 2.946 N/A ILE 136.A N ASP 132.A O no hydrogen 3.320 N/A CYS 137.A N VAL 133.A O no hydrogen 3.028 N/A CYS 137.A SG VAL 133.A O no hydrogen 3.426 N/A THR 138.A N GLU 134.A O no hydrogen 2.931 N/A THR 138.A OG1 GLU 134.A O no hydrogen 2.869 N/A GLY 139.A N THR 135.A O no hydrogen 2.822 N/A VAL 140.A N ILE 136.A O no hydrogen 2.757 N/A GLY 141.A N CYS 137.A O no hydrogen 2.827 N/A ILE 142.A N CYS 137.A O no hydrogen 2.773 N/A LYS 148.A NZ GLU 134.A OE1 no hydrogen 2.867 N/A LYS 148.A NZ GLU 134.A OE2 no hydrogen 3.350 N/A LYS 148.A NZ ASP 144.A OD1 no hydrogen 3.034 N/A GLU 149.A N GLY 145.A O no hydrogen 3.140 N/A LEU 150.A N GLU 146.A O no hydrogen 3.042 N/A ILE 151.A N LEU 147.A O no hydrogen 3.039 N/A ARG 152.A N LYS 148.A O no hydrogen 2.777 N/A ARG 152.A NE GLU 149.A OE1 no hydrogen 3.311 N/A ARG 152.A NH2 GLU 134.A OE2 no hydrogen 3.212 N/A ARG 152.A NH2 GLU 149.A OE2 no hydrogen 3.322 N/A LYS 153.A N GLU 149.A O no hydrogen 2.828 N/A LYS 153.A NZ ASP 157.A OD2 no hydrogen 3.535 N/A HIS 154.A N LEU 150.A O no hydrogen 3.084 N/A GLN 155.A N ILE 151.A O no hydrogen 2.921 N/A GLN 155.A NE2 ASP 132.A OD1 no hydrogen 3.066 N/A ASN 156.A N ARG 152.A O no hydrogen 2.944 N/A ASP 157.A N LYS 153.A O no hydrogen 2.946 N/A GLN 158.A N GLN 155.A O no hydrogen 3.052 N/A SER 159.A N HIS 154.A O no hydrogen 3.180 N/A PHE 163.A N ALA 160.A O no hydrogen 2.995 N/A THR 164.A N GLN 167.A OE1 no hydrogen 3.088 N/A THR 164.A OG1 GLN 167.A OE1 no hydrogen 3.286 N/A GLN 167.A N THR 164.A OG1 no hydrogen 3.011 N/A LYS 168.A N THR 164.A O no hydrogen 2.920 N/A GLN 169.A N PRO 165.A O no hydrogen 3.081 N/A ARG 170.A N VAL 166.A O no hydrogen 2.834 N/A ARG 170.A NE GLU 146.A OE2 no hydrogen 2.539 N/A ARG 170.A NH1 GLU 173.A OE1 no hydrogen 2.589 N/A ARG 170.A NH2 GLU 146.A OE1 no hydrogen 2.906 N/A LEU 171.A N GLN 167.A O no hydrogen 2.929 N/A THR 172.A N LYS 168.A O no hydrogen 2.961 N/A THR 172.A OG1 LYS 168.A O no hydrogen 3.191 N/A GLU 173.A N GLN 169.A O no hydrogen 2.956 N/A LEU 174.A N ARG 170.A O no hydrogen 2.924 N/A LEU 175.A N LEU 171.A O no hydrogen 2.978 N/A GLU 176.A N THR 172.A O no hydrogen 3.131 N/A GLU 176.A N GLU 173.A O no hydrogen 3.295 N/A TYR 178.A N LEU 175.A O no hydrogen 2.685 N/A ARG 179.A NE GLU 176.A O no hydrogen 2.855 N/A ARG 181.A NH2 PRO 177.A O no hydrogen 3.056 N/A PHE 182.A N TYR 178.A O no hydrogen 2.791 N/A ILE 183.A N ARG 179.A O no hydrogen 2.905 N/A ARG 184.A N GLU 180.A O no hydrogen 2.884 N/A ARG 184.A NH1 ASP 223.A OD1 no hydrogen 3.441 N/A ARG 184.A NH2 ASP 223.A OD1 no hydrogen 3.231 N/A TRP 185.A N ARG 181.A O no hydrogen 2.867 N/A CYS 186.A N PHE 182.A O no hydrogen 2.903 N/A CYS 186.A SG PHE 182.A O no hydrogen 3.481 N/A VAL 187.A N ILE 183.A O no hydrogen 3.197 N/A THR 188.A N ARG 184.A O no hydrogen 2.812 N/A THR 188.A OG1 ARG 184.A O no hydrogen 2.725 N/A LEU 189.A N TRP 185.A O no hydrogen 2.615 N/A LYS 193.A NZ ASP 223.A OD1 no hydrogen 3.034 N/A GLY 196.A N ASP 202.A OD2 no hydrogen 2.945 N/A LEU 199.A N ASN 197.A OD1 no hydrogen 2.800 N/A HIS 200.A N ASN 197.A O no hydrogen 3.032 N/A HIS 200.A ND1 THR 188.A O no hydrogen 2.889 N/A ASP 202.A N PRO 115.A O no hydrogen 2.840 N/A LEU 204.A N LYS 220.A O no hydrogen 2.740 N/A ILE 205.A N ASN 117.A O no hydrogen 2.708 N/A ARG 206.A N THR 218.A O no hydrogen 2.792 N/A ARG 206.A NH1 GLY 262.A O no hydrogen 2.934 N/A ARG 206.A NH1 GLY 262.A OXT no hydrogen 3.265 N/A ARG 206.A NH2 GLY 262.A OXT no hydrogen 2.809 N/A PHE 207.A N LYS 119.A O no hydrogen 2.977 N/A GLN 208.A N ASP 216.A O no hydrogen 2.840 N/A VAL 209.A N SER 121.A O no hydrogen 2.901 N/A ILE 210.A N GLU 213.A O no hydrogen 3.103 N/A ARG 212.A NH1 LEU 18.A O no hydrogen 2.853 N/A ARG 212.A NH2 LEU 18.A O no hydrogen 3.170 N/A ARG 212.A NH2 PRO 19.A O no hydrogen 3.126 N/A GLU 213.A N ILE 210.A O no hydrogen 2.851 N/A VAL 217.A N ASP 216.A OD1 no hydrogen 2.449 N/A THR 218.A N ARG 206.A O no hydrogen 2.893 N/A LYS 220.A N LEU 204.A O no hydrogen 3.108 N/A LYS 220.A NZ ASP 228.A OD2 no hydrogen 2.803 N/A ASN 221.A ND2 ALA 69.A O no hydrogen 3.068 N/A ASN 221.A ND2 ASP 224.A OD2 no hydrogen 3.118 N/A ILE 222.A N ASP 202.A O no hydrogen 3.078 N/A ASP 224.A N ASN 221.A OD1 no hydrogen 2.735 N/A TYR 225.A N ASN 221.A O no hydrogen 3.037 N/A TYR 225.A OH GLY 262.A OXT no hydrogen 2.492 N/A VAL 226.A N ILE 222.A O no hydrogen 2.847 N/A SER 227.A N ASP 223.A O no hydrogen 2.948 N/A SER 227.A OG ASP 223.A O no hydrogen 2.786 N/A ASP 228.A N ASP 224.A O no hydrogen 2.745 N/A ARG 229.A N TYR 225.A O no hydrogen 2.865 N/A ARG 229.A NE GLU 232.A OE1 no hydrogen 2.814 N/A ARG 229.A NH2 GLU 232.A OE1 no hydrogen 3.002 N/A ILE 230.A N VAL 226.A O no hydrogen 2.693 N/A ALA 231.A N SER 227.A O no hydrogen 2.796 N/A GLU 232.A N ASP 228.A O no hydrogen 2.802 N/A GLY 233.A N ARG 229.A O no hydrogen 2.890 N/A SER 234.A N ALA 231.A O no hydrogen 2.758 N/A SER 234.A OG ILE 230.A O no hydrogen 2.750 N/A LYS 238.A N LYS 235.A O no hydrogen 2.960 N/A LYS 238.A NZ SER 234.A O no hydrogen 3.296 N/A GLY 242.A N PRO 239.A O no hydrogen 3.030 N/A THR 243.A N GLY 240.A O no hydrogen 3.000 N/A THR 243.A OG1 GLY 240.A O no hydrogen 2.909 N/A GLY 244.A N PRO 239.A O no hydrogen 3.181 N/A LEU 245.A N THR 243.A OG1 no hydrogen 3.073 N/A ASN 246.A N LYS 261.A O no hydrogen 2.804 N/A TRP 247.A NE1 THR 243.A OG1 no hydrogen 3.192 N/A THR 248.A N GLN 259.A O no hydrogen 2.884 N/A TYR 249.A N THR 248.A OG1 no hydrogen 2.492 N/A ALA 250.A N LYS 257.A O no hydrogen 2.941 N/A LYS 257.A NZ GLU 130.A OE2 no hydrogen 2.951 N/A MET 258.A N TYR 131.A O no hydrogen 2.907 N/A GLN 259.A N THR 248.A O no hydrogen 2.806 N/A PHE 260.A N ALA 129.A O no hydrogen 2.788 N/A LYS 261.A N ASN 246.A O no hydrogen 2.858 N/A LYS 261.A NZ SER 127.A OG no hydrogen 2.714 N/A LYS 261.A NZ GLN 259.A OE1 no hydrogen 2.700 N/A GLY 262.A N VAL 126.A O no hydrogen 2.826 N/A