Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1yqe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 6.A NZ GLU 72.A OE2 no hydrogen 3.122 N/A LYS 6.A NZ ILE 181.A O no hydrogen 3.194 N/A LEU 7.A N GLU 73.A O no hydrogen 2.981 N/A VAL 8.A N TYR 47.A O no hydrogen 2.950 N/A VAL 9.A N LEU 75.A O no hydrogen 2.983 N/A CYS 10.A N ALA 49.A O no hydrogen 3.044 N/A CYS 10.A SG ALA 49.A O no hydrogen 3.960 N/A SER 11.A OG GLU 53.A O no hydrogen 3.140 N/A GLU 12.A N THR 51.A O no hydrogen 2.848 N/A ASP 14.A N SER 11.A O no hydrogen 3.080 N/A GLY 17.A N ASP 14.A OD1 no hydrogen 2.764 N/A GLN 18.A N ASP 14.A O no hydrogen 2.803 N/A GLN 18.A NE2 SER 11.A O no hydrogen 2.921 N/A GLN 18.A NE2 GLU 50.A OE1 no hydrogen 2.531 N/A ASN 19.A N THR 15.A O no hydrogen 2.988 N/A ASN 19.A ND2 TRP 164.A O no hydrogen 3.205 N/A ILE 20.A N ALA 16.A O no hydrogen 3.009 N/A LYS 21.A N GLY 17.A O no hydrogen 2.903 N/A LYS 21.A NZ GLN 18.A OE1 no hydrogen 2.768 N/A LYS 21.A NZ GLU 50.A OE1 no hydrogen 2.831 N/A LYS 21.A NZ GLU 50.A OE2 no hydrogen 2.922 N/A ASP 22.A N GLN 18.A O no hydrogen 2.873 N/A ASN 23.A N ASN 19.A O no hydrogen 3.220 N/A ASN 23.A ND2 ASN 19.A O no hydrogen 2.706 N/A LEU 24.A N ILE 20.A O no hydrogen 2.968 N/A LEU 25.A N LYS 21.A O no hydrogen 2.937 N/A THR 26.A N ASN 23.A O no hydrogen 3.182 N/A THR 26.A OG1 ASN 23.A O no hydrogen 2.765 N/A PHE 27.A N LEU 24.A O no hydrogen 3.180 N/A GLU 31.A N LEU 42.A O no hydrogen 2.883 N/A LYS 33.A N LEU 40.A O no hydrogen 2.679 N/A PHE 38.A N VAL 35.A O no hydrogen 2.974 N/A LYS 39.A N GLU 50.A O no hydrogen 3.027 N/A LYS 39.A NZ GLU 32.A OE2 no hydrogen 2.886 N/A LYS 39.A NZ ASP 34.A OD1 no hydrogen 3.525 N/A LEU 40.A N LYS 33.A O no hydrogen 2.667 N/A TYR 41.A N ILE 48.A O no hydrogen 2.845 N/A TYR 41.A OH GLU 50.A OE2 no hydrogen 2.777 N/A LEU 42.A N GLU 31.A O no hydrogen 3.012 N/A SER 43.A OG PHE 46.A O no hydrogen 2.653 N/A GLU 45.A N SER 43.A OG no hydrogen 3.314 N/A PHE 46.A N SER 43.A OG no hydrogen 3.250 N/A TYR 47.A N LYS 6.A O no hydrogen 2.968 N/A ILE 48.A N TYR 41.A O no hydrogen 3.109 N/A ALA 49.A N VAL 8.A O no hydrogen 2.807 N/A GLU 50.A N LYS 39.A O no hydrogen 2.836 N/A THR 51.A N CYS 10.A O no hydrogen 3.154 N/A GLU 53.A N THR 51.A OG1 no hydrogen 3.229 N/A TYR 57.A N ARG 54.A O no hydrogen 3.050 N/A ALA 58.A N LEU 55.A O no hydrogen 2.789 N/A HIS 60.A N GLU 147.A O no hydrogen 2.808 N/A ILE 61.A N ALA 58.A O no hydrogen 3.072 N/A LYS 64.A N HIS 60.A O no hydrogen 3.252 N/A LYS 64.A NZ GLU 53.A OE1 no hydrogen 3.414 N/A LEU 65.A N ILE 61.A O no hydrogen 2.991 N/A ALA 66.A N ASP 62.A O no hydrogen 2.955 N/A LYS 67.A N LYS 64.A O no hydrogen 3.420 N/A TYR 68.A N LEU 65.A O no hydrogen 3.021 N/A ILE 69.A N LEU 65.A O no hydrogen 3.276 N/A GLU 72.A N MET 5.A O no hydrogen 2.849 N/A ILE 74.A N PRO 151.A O no hydrogen 2.904 N/A LEU 75.A N LEU 7.A O no hydrogen 2.786 N/A PHE 76.A N ALA 153.A O no hydrogen 2.928 N/A ALA 77.A N VAL 9.A O no hydrogen 2.818 N/A SER 78.A N TYR 155.A O no hydrogen 3.208 N/A SER 78.A OG ASP 14.A OD2 no hydrogen 3.272 N/A SER 78.A OG ARG 79.A O no hydrogen 2.807 N/A ARG 79.A N ASP 14.A OD2 no hydrogen 3.123 N/A HIS 80.A N ILE 157.A O no hydrogen 2.872 N/A HIS 80.A NE2 TYR 199.A OH no hydrogen 3.227 N/A SER 82.A N SER 159.A O no hydrogen 3.135 N/A SER 82.A OG ASP 84.A OD2 no hydrogen 2.670 N/A SER 82.A OG TYR 199.A OH no hydrogen 3.346 N/A ASP 84.A N SER 82.A OG no hydrogen 3.377 N/A GLY 85.A N SER 82.A O no hydrogen 3.309 N/A ARG 86.A N ASP 84.A OD1 no hydrogen 2.702 N/A LYS 87.A NZ GLU 163.A OE2 no hydrogen 2.654 N/A ILE 88.A N GLY 158.A O no hydrogen 2.671 N/A PHE 89.A N GLU 135.A O no hydrogen 3.024 N/A THR 90.A N GLU 156.A O no hydrogen 3.075 N/A THR 90.A OG1 GLU 139.A OE2 no hydrogen 2.519 N/A HIS 92.A N PHE 154.A O no hydrogen 3.240 N/A SER 94.A OG PRO 145.A O no hydrogen 2.564 N/A GLY 95.A N HIS 143.A O no hydrogen 2.862 N/A ASN 96.A N SER 108.A O no hydrogen 2.830 N/A ASN 96.A ND2 GLY 103.A O no hydrogen 2.975 N/A ASN 96.A ND2 LYS 105.A O no hydrogen 3.061 N/A LYS 105.A N SER 146.A OG no hydrogen 2.879 N/A TYR 107.A N VAL 97.A O no hydrogen 2.741 N/A SER 108.A OG GLU 147.A OE2 no hydrogen 2.524 N/A ALA 110.A N SER 94.A O no hydrogen 3.206 N/A LYS 111.A N ILE 148.A O no hydrogen 3.054 N/A LYS 111.A NZ LEU 237.A O no hydrogen 2.944 N/A LYS 111.A NZ GLU 239.A OE1 no hydrogen 2.889 N/A SER 113.A OG GLU 73.A OE2 no hydrogen 2.830 N/A GLN 115.A NE2 TRP 188.A O no hydrogen 3.197 N/A THR 116.A OG1 GLU 73.A OE1 no hydrogen 2.651 N/A THR 116.A OG1 GLU 73.A OE2 no hydrogen 3.169 N/A MET 117.A N SER 113.A O no hydrogen 2.995 N/A LYS 118.A N PRO 114.A O no hydrogen 3.108 N/A LYS 118.A NZ MET 207.A O no hydrogen 2.686 N/A LYS 118.A NZ THR 210.A O no hydrogen 2.708 N/A LYS 118.A NZ PHE 212.A O no hydrogen 2.922 N/A ASN 119.A N GLN 115.A O no hydrogen 2.933 N/A ASN 119.A ND2 LYS 185.A O no hydrogen 2.929 N/A TYR 120.A N THR 116.A O no hydrogen 2.826 N/A VAL 121.A N MET 117.A O no hydrogen 2.997 N/A LEU 122.A N LYS 118.A O no hydrogen 3.025 N/A ALA 123.A N ASN 119.A O no hydrogen 3.074 N/A LEU 124.A N TYR 120.A O no hydrogen 2.863 N/A ARG 125.A N VAL 121.A O no hydrogen 2.843 N/A ARG 125.A NH1 LEU 208.A O no hydrogen 2.743 N/A GLU 126.A N LEU 122.A O no hydrogen 3.262 N/A ARG 127.A N LEU 124.A O no hydrogen 2.740 N/A ARG 127.A NE GLU 175.A OE1 no hydrogen 2.738 N/A ARG 127.A NH1 ALA 123.A O no hydrogen 2.768 N/A ARG 127.A NH1 ASP 179.A OD2 no hydrogen 2.802 N/A ARG 127.A NH2 GLU 175.A OE1 no hydrogen 3.520 N/A ARG 127.A NH2 ASP 179.A OD2 no hydrogen 2.644 N/A LEU 128.A N ARG 125.A O no hydrogen 3.366 N/A ARG 130.A N ARG 127.A O no hydrogen 2.941 N/A ARG 130.A NH1 GLU 171.A OE1 no hydrogen 3.052 N/A ARG 130.A NH1 GLU 175.A OE2 no hydrogen 3.276 N/A ARG 130.A NH2 GLU 168.A OE2 no hydrogen 2.763 N/A ARG 130.A NH2 GLU 171.A OE1 no hydrogen 3.215 N/A LYS 131.A N LEU 128.A O no hydrogen 3.113 N/A LYS 131.A NZ GLU 133.A OE2 no hydrogen 2.879 N/A LYS 131.A NZ ASP 166.A OD1 no hydrogen 3.418 N/A LYS 131.A NZ ASP 166.A OD2 no hydrogen 2.908 N/A GLU 133.A N GLU 133.A OE1 no hydrogen 2.536 N/A PHE 134.A N LYS 131.A O no hydrogen 2.860 N/A GLU 135.A N LYS 87.A O no hydrogen 3.169 N/A THR 137.A N PHE 89.A O no hydrogen 3.093 N/A THR 137.A OG1 MET 138.A O no hydrogen 3.093 N/A MET 138.A N THR 204.A OG1 no hydrogen 2.923 N/A GLU 139.A N VAL 91.A O no hydrogen 2.919 N/A VAL 140.A N HIS 198.A O no hydrogen 3.074 N/A THR 141.A N ASN 217.A O no hydrogen 2.792 N/A THR 141.A OG1 HIS 216.A ND1 no hydrogen 2.739 N/A THR 141.A OG1 ASN 217.A O no hydrogen 3.362 N/A HIS 142.A NE2 GLU 139.A OE1 no hydrogen 2.716 N/A GLY 144.A N PHE 102.A O no hydrogen 3.008 N/A SER 146.A N ASP 59.A OD2 no hydrogen 2.886 N/A SER 146.A OG GLU 147.A OE2 no hydrogen 2.491 N/A GLU 147.A N ASP 59.A OD2 no hydrogen 3.030 N/A SER 149.A N ASP 62.A OD1 no hydrogen 2.825 N/A LYS 150.A N ASP 62.A OD1 no hydrogen 3.155 N/A LYS 150.A NZ PHE 71.A O no hydrogen 2.899 N/A SER 152.A N LYS 111.A O no hydrogen 2.722 N/A SER 152.A OG LYS 111.A O no hydrogen 3.453 N/A PHE 154.A N HIS 92.A O no hydrogen 2.718 N/A TYR 155.A N PHE 76.A O no hydrogen 2.810 N/A GLU 156.A N THR 90.A O no hydrogen 3.007 N/A ILE 157.A N SER 78.A O no hydrogen 3.375 N/A GLY 158.A N ILE 88.A O no hydrogen 2.639 N/A SER 159.A N GLU 163.A OE1 no hydrogen 3.214 N/A SER 159.A OG ASP 84.A OD1 no hydrogen 3.345 N/A SER 159.A OG ARG 86.A O no hydrogen 2.838 N/A THR 160.A N GLU 163.A OE1 no hydrogen 2.774 N/A THR 160.A OG1 GLU 163.A OE1 no hydrogen 2.720 N/A GLU 162.A N THR 160.A OG1 no hydrogen 3.160 N/A GLU 163.A N THR 160.A O no hydrogen 2.964 N/A TRP 164.A N THR 160.A O no hydrogen 2.998 N/A TRP 164.A NE1 HIS 80.A O no hydrogen 3.072 N/A LYS 165.A N GLU 161.A O no hydrogen 3.060 N/A LYS 165.A NZ GLU 161.A OE2 no hydrogen 3.119 N/A ASP 166.A N GLU 163.A O no hydrogen 3.029 N/A ALA 169.A N ASP 166.A OD1 no hydrogen 2.931 N/A ALA 170.A N ASP 166.A O no hydrogen 3.247 N/A GLU 171.A N ARG 167.A O no hydrogen 3.042 N/A VAL 172.A N GLU 168.A O no hydrogen 2.862 N/A VAL 173.A N ALA 169.A O no hydrogen 3.067 N/A ALA 174.A N ALA 170.A O no hydrogen 2.919 N/A GLU 175.A N GLU 171.A O no hydrogen 3.025 N/A ALA 176.A N VAL 172.A O no hydrogen 3.027 N/A MET 177.A N VAL 173.A O no hydrogen 2.846 N/A LEU 178.A N ALA 174.A O no hydrogen 2.954 N/A ASP 179.A N GLU 175.A O no hydrogen 3.061 N/A ALA 180.A N ALA 176.A O no hydrogen 2.964 N/A ILE 181.A N MET 177.A O no hydrogen 2.806 N/A ARG 182.A N LEU 178.A O no hydrogen 3.075 N/A ARG 182.A NE GLU 45.A OE1 no hydrogen 2.777 N/A ALA 183.A N ALA 180.A O no hydrogen 3.266 N/A LYS 185.A NZ ASP 187.A OD1 no hydrogen 2.749 N/A TRP 188.A N GLN 115.A OE1 no hydrogen 2.930 N/A TRP 188.A NE1 ASN 119.A OD1 no hydrogen 3.062 N/A ASN 189.A N THR 211.A O no hydrogen 3.009 N/A ASN 189.A ND2 THR 211.A O no hydrogen 3.506 N/A ASN 189.A ND2 THR 211.A OG1 no hydrogen 3.141 N/A ALA 191.A N THR 213.A O no hydrogen 3.011 N/A VAL 192.A N TYR 242.A O no hydrogen 3.074 N/A GLY 193.A N HIS 216.A O no hydrogen 2.944 N/A VAL 194.A N ILE 244.A O no hydrogen 2.950 N/A GLY 195.A N PHE 218.A O no hydrogen 2.816 N/A GLY 196.A N SER 249.A OG no hydrogen 2.686 N/A TYR 199.A OH HIS 80.A NE2 no hydrogen 3.227 N/A TYR 199.A OH SER 82.A OG no hydrogen 3.346 N/A TYR 199.A OH ASP 84.A OD2 no hydrogen 2.783 N/A ALA 200.A N THR 197.A O no hydrogen 2.836 N/A ARG 202.A NE GLU 205.A OE1 no hydrogen 2.930 N/A ARG 202.A NH2 GLU 205.A OE1 no hydrogen 3.276 N/A ARG 202.A NH2 GLU 205.A OE2 no hydrogen 3.094 N/A GLN 203.A N GLN 203.A OE1 no hydrogen 2.719 N/A GLN 203.A NE2 GLY 195.A O no hydrogen 3.132 N/A GLN 203.A NE2 ASN 217.A OD1 no hydrogen 3.165 N/A THR 204.A N ALA 200.A O no hydrogen 2.886 N/A THR 204.A OG1 TYR 199.A O no hydrogen 3.308 N/A THR 204.A OG1 ALA 200.A O no hydrogen 2.809 N/A GLU 205.A N PRO 201.A O no hydrogen 3.116 N/A ILE 206.A N ARG 202.A O no hydrogen 2.941 N/A MET 207.A N GLN 203.A O no hydrogen 2.841 N/A LEU 208.A N THR 204.A O no hydrogen 3.051 N/A THR 209.A N GLU 205.A O no hydrogen 2.974 N/A THR 209.A OG1 GLU 205.A O no hydrogen 2.880 N/A THR 210.A N ILE 206.A O no hydrogen 3.083 N/A THR 210.A OG1 ILE 206.A O no hydrogen 2.575 N/A THR 211.A N PHE 279.A O no hydrogen 2.908 N/A PHE 212.A N THR 210.A OG1 no hydrogen 3.201 N/A THR 213.A N ASN 189.A O no hydrogen 2.762 N/A THR 213.A OG1 PRO 114.A O no hydrogen 2.675 N/A GLY 215.A N ALA 191.A O no hydrogen 3.005 N/A HIS 216.A ND1 THR 141.A OG1 no hydrogen 2.739 N/A HIS 216.A NE2 ALA 110.A O no hydrogen 2.715 N/A ASN 217.A N THR 141.A OG1 no hydrogen 3.061 N/A PHE 218.A N GLY 193.A O no hydrogen 2.879 N/A LYS 220.A N GLY 196.A O no hydrogen 2.870 N/A THR 222.A N ALA 219.A O no hydrogen 2.901 N/A THR 222.A OG1 ALA 219.A O no hydrogen 2.667 N/A PHE 223.A N LYS 220.A O no hydrogen 3.174 N/A HIS 225.A N THR 222.A O no hydrogen 2.940 N/A LEU 226.A N PHE 223.A O no hydrogen 3.284 N/A PHE 230.A N THR 227.A OG1 no hydrogen 3.024 N/A LEU 231.A N THR 227.A O no hydrogen 3.095 N/A VAL 232.A N ALA 228.A O no hydrogen 3.033 N/A LYS 233.A N GLU 229.A O no hydrogen 3.036 N/A LYS 233.A NZ TYR 107.A O no hydrogen 2.851 N/A ALA 234.A N PHE 230.A O no hydrogen 3.003 N/A VAL 235.A N LEU 231.A O no hydrogen 2.945 N/A LYS 236.A N VAL 232.A O no hydrogen 2.963 N/A LEU 237.A N LYS 233.A O no hydrogen 2.936 N/A SER 238.A N ALA 234.A O no hydrogen 2.839 N/A SER 238.A OG ALA 234.A O no hydrogen 2.801 N/A GLU 239.A N LYS 236.A O no hydrogen 3.206 N/A ALA 240.A N VAL 235.A O no hydrogen 3.005 N/A GLU 241.A N VAL 190.A O no hydrogen 3.028 N/A ILE 243.A N GLU 268.A O no hydrogen 2.999 N/A ILE 244.A N VAL 192.A O no hydrogen 2.957 N/A ILE 245.A N LEU 270.A O no hydrogen 3.011 N/A ASP 246.A N VAL 194.A O no hydrogen 3.109 N/A GLU 247.A N GLU 247.A OE1 no hydrogen 2.643 N/A LYS 248.A N ASP 246.A OD1 no hydrogen 3.202 N/A SER 249.A N ASP 246.A O no hydrogen 2.645 N/A VAL 250.A N ASP 246.A O no hydrogen 3.000 N/A VAL 254.A N ASN 251.A OD1 no hydrogen 2.744 N/A LYS 255.A N ASN 251.A O no hydrogen 2.959 N/A LYS 256.A N SER 252.A O no hydrogen 3.170 N/A LYS 256.A N ALA 253.A O no hydrogen 3.272 N/A VAL 258.A N VAL 254.A O no hydrogen 2.933 N/A ASN 259.A N LYS 255.A O no hydrogen 2.927 N/A GLU 260.A N LYS 256.A O no hydrogen 2.914 N/A ALA 261.A N ILE 257.A O no hydrogen 2.877 N/A ALA 262.A N VAL 258.A O no hydrogen 2.818 N/A GLU 263.A N ASN 259.A O no hydrogen 3.038 N/A VAL 264.A N GLU 260.A O no hydrogen 3.032 N/A ALA 265.A N ALA 261.A O no hydrogen 2.934 N/A GLY 266.A N GLU 263.A O no hydrogen 3.269 N/A VAL 267.A N ALA 262.A O no hydrogen 2.913 N/A GLU 268.A N GLU 241.A O no hydrogen 3.288 N/A LEU 270.A N ILE 243.A O no hydrogen 2.941 N/A SER 272.A N ILE 245.A O no hydrogen 3.014 N/A SER 272.A OG GLU 247.A OE1 no hydrogen 2.465 N/A LYS 273.A N GLU 247.A OE2 no hydrogen 3.023 N/A VAL 275.A N LYS 271.A O no hydrogen 3.145 N/A LYS 276.A N SER 272.A O no hydrogen 3.005 N/A LYS 276.A NZ GLU 205.A OE1 no hydrogen 2.702 N/A LYS 277.A N LYS 273.A O no hydrogen 3.091 N/A ASP 278.A N LYS 274.A O no hydrogen 2.813 N/A PHE 279.A N VAL 275.A O no hydrogen 3.038 N/A LEU 281.A N THR 209.A O no hydrogen 2.868 N/A