Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6jrk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A ND2 TYR 61.A OH no hydrogen 3.174 N/A ASN 5.A ND2 SER 65.A OG no hydrogen 3.182 N/A ALA 7.A N ASN 5.A OD1 no hydrogen 3.034 N/A LEU 12.A N ILE 77.A O no hydrogen 2.891 N/A GLU 16.A N LYS 13.A O no hydrogen 2.882 N/A PHE 17.A N GLU 14.A O no hydrogen 3.352 N/A LYS 18.A N LEU 35.A O no hydrogen 2.922 N/A LYS 19.A NZ GLU 51.A OE2 no hydrogen 3.555 N/A LYS 21.A N LYS 33.A O no hydrogen 3.049 N/A LEU 23.A N VAL 31.A O no hydrogen 2.732 N/A GLY 24.A N VAL 31.A O no hydrogen 3.308 N/A GLY 26.A N GLY 29.A O no hydrogen 2.601 N/A THR 30.A N GLU 51.A O no hydrogen 2.806 N/A VAL 31.A N GLY 24.A O no hydrogen 2.807 N/A TYR 32.A N ILE 49.A O no hydrogen 2.734 N/A TYR 32.A OH GLU 51.A OE1 no hydrogen 3.209 N/A GLY 34.A N VAL 47.A O no hydrogen 3.004 N/A LEU 35.A N LYS 18.A O no hydrogen 2.942 N/A TRP 36.A N ILE 45.A O no hydrogen 2.872 N/A ILE 37.A N GLU 16.A O no hydrogen 2.782 N/A GLU 39.A N GLU 16.A OE1 no hydrogen 3.245 N/A GLU 41.A N PRO 38.A O no hydrogen 3.276 N/A LYS 44.A N ASP 274.A O no hydrogen 3.408 N/A LYS 44.A NZ ASP 271.A O no hydrogen 3.379 N/A ILE 45.A N TRP 36.A O no hydrogen 2.878 N/A VAL 47.A N GLY 34.A O no hydrogen 3.220 N/A ALA 48.A N THR 87.A O no hydrogen 2.776 N/A ILE 49.A N TYR 32.A O no hydrogen 2.845 N/A LYS 50.A N LEU 85.A O no hydrogen 2.954 N/A GLU 51.A N THR 30.A O no hydrogen 3.022 N/A LEU 57.A N ASN 53.A O no hydrogen 2.944 N/A ASP 58.A N LYS 54.A O no hydrogen 2.933 N/A GLU 59.A N GLU 55.A O no hydrogen 2.886 N/A ALA 60.A N ILE 56.A O no hydrogen 3.009 N/A TYR 61.A N LEU 57.A O no hydrogen 2.787 N/A VAL 62.A N ASP 58.A O no hydrogen 3.109 N/A MET 63.A N GLU 59.A O no hydrogen 3.053 N/A ALA 64.A N ALA 60.A O no hydrogen 3.025 N/A SER 65.A N VAL 62.A O no hydrogen 2.886 N/A SER 65.A OG TYR 61.A O no hydrogen 2.617 N/A SER 65.A OG VAL 62.A O no hydrogen 3.501 N/A ASP 67.A N TYR 124.A OH no hydrogen 3.073 N/A HIS 70.A N ASN 68.A OD1 no hydrogen 3.077 N/A HIS 70.A ND1 VAL 148.A O no hydrogen 3.180 N/A VAL 71.A N ASN 68.A O no hydrogen 3.160 N/A CYS 72.A N ILE 150.A O no hydrogen 2.980 N/A CYS 72.A SG THR 151.A OG1 no hydrogen 2.973 N/A LEU 75.A N ILE 86.A O no hydrogen 2.797 N/A GLY 76.A N ILE 86.A O no hydrogen 3.228 N/A ILE 77.A N ARG 10.A O no hydrogen 2.792 N/A CYS 78.A N GLN 84.A O no hydrogen 2.795 N/A CYS 78.A SG LEU 12.A O no hydrogen 2.631 N/A THR 80.A OG1 GLU 14.A OE1 no hydrogen 3.563 N/A GLN 84.A N CYS 78.A O no hydrogen 3.064 N/A GLN 84.A NE2 GLU 14.A OE2 no hydrogen 2.918 N/A LEU 85.A N LYS 50.A O no hydrogen 3.036 N/A ILE 86.A N GLY 76.A O no hydrogen 2.864 N/A THR 87.A N ALA 48.A O no hydrogen 2.950 N/A THR 87.A OG1 GLN 88.A O no hydrogen 3.283 N/A GLN 88.A NE2 ASP 277.A OD1 no hydrogen 2.666 N/A GLN 88.A NE2 ASP 279.A OD2 no hydrogen 3.180 N/A LEU 89.A N PRO 46.A O no hydrogen 3.098 N/A PHE 92.A N VAL 142.A O no hydrogen 3.170 N/A GLY 93.A N MET 90.A O no hydrogen 3.138 N/A LEU 95.A N VAL 140.A O no hydrogen 2.704 N/A LEU 96.A N ALA 137.A O no hydrogen 3.214 N/A TYR 98.A N CYS 94.A O no hydrogen 2.973 N/A VAL 99.A N LEU 95.A O no hydrogen 2.795 N/A ARG 100.A N LEU 96.A O no hydrogen 3.097 N/A ARG 100.A NE GLY 193.A O no hydrogen 2.822 N/A ARG 100.A NH2 GLY 193.A O no hydrogen 2.802 N/A GLU 101.A N ASP 97.A O no hydrogen 2.834 N/A HIS 102.A N TYR 98.A O no hydrogen 3.035 N/A LYS 103.A NZ PHE 192.A O no hydrogen 3.453 N/A ASN 105.A N HIS 102.A O no hydrogen 2.743 N/A ILE 106.A N LYS 103.A O no hydrogen 3.169 N/A SER 108.A N ASP 266.A OD1 no hydrogen 3.409 N/A SER 108.A OG ASP 266.A OD2 no hydrogen 2.894 N/A GLN 109.A NE2 GLN 109.A O no hydrogen 3.449 N/A GLN 109.A NE2 ASN 113.A OD1 no hydrogen 3.317 N/A GLN 109.A NE2 ALA 254.A O no hydrogen 2.986 N/A LEU 111.A N GLY 107.A O no hydrogen 3.197 N/A LEU 112.A N SER 108.A O no hydrogen 3.004 N/A ASN 113.A N GLN 109.A O no hydrogen 3.051 N/A TRP 114.A N TYR 110.A O no hydrogen 2.974 N/A TRP 114.A NE1 PRO 145.A O no hydrogen 3.003 N/A CYS 115.A N LEU 111.A O no hydrogen 3.137 N/A CYS 115.A SG LEU 111.A O no hydrogen 3.421 N/A VAL 116.A N LEU 112.A O no hydrogen 3.113 N/A GLN 117.A N ASN 113.A O no hydrogen 3.028 N/A GLN 117.A NE2 GLN 146.A O no hydrogen 2.887 N/A ILE 118.A N TRP 114.A O no hydrogen 2.997 N/A ALA 119.A N CYS 115.A O no hydrogen 3.071 N/A LYS 120.A N VAL 116.A O no hydrogen 2.824 N/A GLY 121.A N GLN 117.A O no hydrogen 2.872 N/A MET 122.A N ILE 118.A O no hydrogen 2.822 N/A ASN 123.A N ALA 119.A O no hydrogen 2.837 N/A TYR 124.A N LYS 120.A O no hydrogen 2.866 N/A LEU 125.A N GLY 121.A O no hydrogen 3.047 N/A GLU 126.A N MET 122.A O no hydrogen 2.999 N/A ASP 127.A N ASN 123.A O no hydrogen 2.997 N/A ARG 128.A N TYR 124.A O no hydrogen 2.971 N/A ARG 129.A N GLU 126.A O no hydrogen 2.832 N/A LEU 130.A N LEU 125.A O no hydrogen 2.870 N/A VAL 131.A N LYS 157.A O no hydrogen 3.364 N/A HIS 132.A N ASP 178.A OD2 no hydrogen 2.811 N/A HIS 132.A NE2 THR 151.A O no hydrogen 2.889 N/A ARG 133.A N ASP 178.A OD1 no hydrogen 3.103 N/A ARG 133.A NE LEU 155.A O no hydrogen 2.926 N/A ASP 134.A N HIS 132.A ND1 no hydrogen 2.990 N/A ALA 137.A N GLU 188.A OE2 no hydrogen 2.740 N/A ARG 138.A NH1 ASP 134.A OD1 no hydrogen 3.192 N/A ARG 138.A NH1 ASP 134.A OD2 no hydrogen 3.129 N/A ARG 138.A NH2 ASP 134.A OD1 no hydrogen 3.366 N/A ASN 139.A N ALA 136.A O no hydrogen 2.936 N/A ASN 139.A ND2 ASP 134.A O no hydrogen 2.628 N/A VAL 140.A N ALA 137.A O no hydrogen 3.452 N/A LEU 141.A N LYS 149.A O no hydrogen 2.708 N/A VAL 142.A N GLY 93.A O no hydrogen 2.914 N/A LYS 143.A N HIS 147.A O no hydrogen 2.952 N/A LYS 143.A NZ ASP 279.A OD2 no hydrogen 2.449 N/A THR 144.A N HIS 147.A O no hydrogen 3.357 N/A THR 144.A OG1 GLN 146.A OE1 no hydrogen 3.458 N/A GLN 146.A N THR 144.A OG1 no hydrogen 3.143 N/A GLN 146.A NE2 TYR 110.A OH no hydrogen 2.636 N/A HIS 147.A N THR 144.A O no hydrogen 2.875 N/A HIS 147.A NE2 PRO 69.A O no hydrogen 2.785 N/A VAL 148.A N GLN 117.A OE1 no hydrogen 2.862 N/A LYS 149.A N LEU 141.A O no hydrogen 2.784 N/A LYS 149.A NZ GLN 88.A OE1 no hydrogen 2.684 N/A LYS 149.A NZ ASP 279.A OD1 no hydrogen 2.781 N/A LYS 149.A NZ ASP 279.A OD2 no hydrogen 3.321 N/A ILE 150.A N HIS 70.A O no hydrogen 2.961 N/A THR 151.A N ASN 139.A O no hydrogen 2.962 N/A GLY 154.A N ASP 152.A OD1 no hydrogen 3.376 N/A ALA 156.A N PHE 153.A O no hydrogen 3.494 N/A LYS 157.A N VAL 131.A O no hydrogen 3.355 N/A LYS 161.A NZ TYR 197.A O no hydrogen 3.184 N/A LYS 161.A NZ ILE 200.A O no hydrogen 2.949 N/A TRP 162.A N PRO 159.A O no hydrogen 2.984 N/A TRP 162.A NE1 GLU 188.A OE2 no hydrogen 2.813 N/A MET 163.A N ILE 160.A O no hydrogen 3.043 N/A GLU 166.A N GLU 166.A OE2 no hydrogen 2.582 N/A SER 167.A OG ILE 172.A O no hydrogen 2.475 N/A ILE 168.A N ALA 164.A O no hydrogen 3.071 N/A LEU 169.A N LEU 165.A O no hydrogen 3.091 N/A HIS 170.A N GLU 166.A O no hydrogen 2.920 N/A ARG 171.A N SER 167.A O no hydrogen 3.076 N/A THR 174.A N SER 177.A OG no hydrogen 2.610 N/A GLN 176.A NE2 ALA 237.A O no hydrogen 3.262 N/A GLN 176.A NE2 PRO 241.A O no hydrogen 3.195 N/A SER 177.A OG THR 174.A O no hydrogen 2.758 N/A ASP 178.A N THR 174.A O no hydrogen 2.969 N/A VAL 179.A N HIS 175.A O no hydrogen 3.003 N/A TRP 180.A N GLN 176.A O no hydrogen 3.292 N/A SER 181.A N SER 177.A O no hydrogen 3.499 N/A SER 181.A OG TRP 162.A O no hydrogen 2.670 N/A SER 181.A OG SER 177.A O no hydrogen 3.535 N/A TYR 182.A N ASP 178.A O no hydrogen 2.898 N/A TYR 182.A OH CYS 115.A O no hydrogen 2.644 N/A GLY 183.A N VAL 179.A O no hydrogen 2.952 N/A VAL 184.A N TRP 180.A O no hydrogen 2.954 N/A THR 185.A N SER 181.A O no hydrogen 2.649 N/A THR 185.A OG1 SER 181.A O no hydrogen 2.796 N/A VAL 186.A N TYR 182.A O no hydrogen 2.796 N/A TRP 187.A N GLY 183.A O no hydrogen 2.923 N/A TRP 187.A NE1 PRO 216.A O no hydrogen 2.796 N/A GLU 188.A N VAL 184.A O no hydrogen 2.953 N/A LEU 189.A N THR 185.A O no hydrogen 3.061 N/A MET 190.A N VAL 186.A O no hydrogen 2.925 N/A THR 191.A N TRP 187.A O no hydrogen 3.116 N/A THR 191.A OG1 TRP 187.A O no hydrogen 2.752 N/A THR 191.A OG1 GLU 188.A O no hydrogen 3.181 N/A PHE 192.A N LEU 189.A O no hydrogen 2.894 N/A GLY 193.A N GLU 188.A O no hydrogen 2.753 N/A SER 194.A N THR 191.A OG1 no hydrogen 3.368 N/A SER 194.A OG THR 191.A O no hydrogen 3.006 N/A GLU 204.A N PRO 201.A O no hydrogen 3.020 N/A ILE 205.A N ALA 202.A O no hydrogen 2.970 N/A SER 207.A OG GLU 204.A O no hydrogen 2.655 N/A ILE 208.A N GLU 204.A O no hydrogen 3.049 N/A LEU 209.A N ILE 205.A O no hydrogen 3.038 N/A GLU 210.A N SER 206.A O no hydrogen 3.181 N/A LYS 211.A N SER 207.A O no hydrogen 2.957 N/A GLY 212.A N LEU 209.A O no hydrogen 3.189 N/A GLU 213.A N ILE 208.A O no hydrogen 3.368 N/A ARG 214.A NE TRP 233.A O no hydrogen 2.657 N/A ARG 214.A NH1 TRP 233.A O no hydrogen 2.875 N/A ARG 214.A NH2 LEU 209.A O no hydrogen 3.000 N/A ARG 214.A NH2 GLU 213.A O no hydrogen 2.525 N/A GLN 217.A NE2 CYS 221.A O no hydrogen 2.707 N/A CYS 221.A N PRO 218.A O no hydrogen 2.841 N/A THR 222.A N TYR 260.A O no hydrogen 3.130 N/A THR 222.A OG1 TYR 260.A O no hydrogen 2.626 N/A TYR 226.A N THR 222.A O no hydrogen 3.127 N/A TYR 226.A OH LEU 215.A O no hydrogen 2.515 N/A MET 227.A N ILE 223.A O no hydrogen 2.831 N/A ILE 228.A N VAL 225.A O no hydrogen 2.853 N/A MET 229.A N VAL 225.A O no hydrogen 3.204 N/A VAL 230.A N TYR 226.A O no hydrogen 2.850 N/A LYS 231.A N MET 227.A O no hydrogen 3.022 N/A CYS 232.A N ILE 228.A O no hydrogen 3.230 N/A CYS 232.A SG VAL 179.A O no hydrogen 3.831 N/A CYS 232.A SG ILE 228.A O no hydrogen 3.447 N/A TRP 233.A N VAL 230.A O no hydrogen 2.972 N/A ASP 238.A N ASP 236.A OD1 no hydrogen 3.217 N/A SER 239.A N ASP 236.A O no hydrogen 3.151 N/A SER 239.A OG ASP 236.A OD2 no hydrogen 3.210 N/A ARG 240.A NE MET 234.A O no hydrogen 2.818 N/A ARG 240.A NH1 GLU 166.A OE1 no hydrogen 2.394 N/A ARG 240.A NH1 GLN 176.A O no hydrogen 3.336 N/A ARG 240.A NH2 GLU 166.A OE2 no hydrogen 2.769 N/A ARG 240.A NH2 MET 234.A O no hydrogen 2.848 N/A LYS 242.A N GLU 245.A OE1 no hydrogen 2.721 N/A LYS 242.A NZ GLU 126.A OE1 no hydrogen 2.885 N/A LYS 242.A NZ GLN 176.A OE1 no hydrogen 3.091 N/A GLU 245.A N LYS 242.A O no hydrogen 2.866 N/A LEU 246.A N LYS 242.A O no hydrogen 3.030 N/A ILE 247.A N PHE 243.A O no hydrogen 2.943 N/A ILE 248.A N ARG 244.A O no hydrogen 3.408 N/A GLU 249.A N GLU 245.A O no hydrogen 2.727 N/A PHE 250.A N LEU 246.A O no hydrogen 2.913 N/A SER 251.A N ILE 247.A O no hydrogen 2.881 N/A SER 251.A OG ILE 247.A O no hydrogen 2.650 N/A LYS 252.A N ILE 248.A O no hydrogen 2.913 N/A LYS 252.A NZ GLU 249.A OE1 no hydrogen 2.984 N/A MET 253.A N GLU 249.A O no hydrogen 3.164 N/A ALA 254.A N PHE 250.A O no hydrogen 2.884 N/A ARG 255.A N LYS 252.A O no hydrogen 3.029 N/A ASP 256.A N MET 253.A O no hydrogen 3.213 N/A ARG 259.A N ASP 256.A O no hydrogen 3.102 N/A TYR 260.A N PRO 257.A O no hydrogen 3.132 N/A LEU 261.A N PRO 257.A O no hydrogen 3.140 N/A VAL 262.A N ILE 220.A O no hydrogen 2.932 N/A ASP 266.A N ILE 263.A O no hydrogen 2.931 N/A ARG 268.A N GLY 265.A O no hydrogen 3.373 N/A VAL 276.A N LYS 44.A O no hydrogen 3.081 N/A GLU 280.A N ASP 277.A O no hydrogen 2.858 N/A TYR 281.A N ALA 278.A O no hydrogen 2.970 N/A TYR 281.A OH GLU 41.A OE1 no hydrogen 2.396 N/A