Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1yqk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 2.A OE1 no hydrogen 3.013 N/A HIS 5.A N ASP 163.A OD1 no hydrogen 3.099 N/A HIS 5.A ND1 ASP 163.A OD1 no hydrogen 2.901 N/A HIS 5.A NE2 TYR 167.A OH no hydrogen 2.568 N/A ARG 6.A N TYR 70.A OH no hydrogen 2.738 N/A ARG 6.A NE THR 68.A OG1 no hydrogen 2.987 N/A ARG 6.A NH2 THR 68.A OG1 no hydrogen 2.869 N/A THR 7.A N SER 10.A OG no hydrogen 3.243 N/A LEU 8.A N HIS 46.A NE2 no hydrogen 3.289 N/A SER 10.A N THR 7.A OG1 no hydrogen 3.070 N/A SER 10.A OG THR 7.A O no hydrogen 3.292 N/A SER 10.A OG THR 7.A OG1 no hydrogen 2.889 N/A THR 11.A N THR 7.A O no hydrogen 3.312 N/A LEU 14.A N THR 11.A O no hydrogen 2.983 N/A TRP 15.A N PRO 12.A O no hydrogen 3.103 N/A ALA 16.A N CYS 67.A O no hydrogen 3.109 N/A SER 17.A OG GLN 64.A OE1 no hydrogen 2.983 N/A ILE 18.A N LEU 65.A O no hydrogen 2.878 N/A CYS 20.A N GLU 63.A O no hydrogen 2.731 N/A CYS 20.A SG PRO 21.A O no hydrogen 3.770 N/A GLU 24.A N PRO 21.A O no hydrogen 2.738 N/A ARG 26.A N GLY 118.A O no hydrogen 2.900 N/A ARG 26.A NH1 ASP 28.A OD1 no hydrogen 3.257 N/A LEU 27.A N GLN 60.A OE1 no hydrogen 2.952 N/A LEU 29.A N ARG 26.A O no hydrogen 2.681 N/A VAL 30.A N ARG 26.A O no hydrogen 2.994 N/A VAL 30.A N LEU 27.A O no hydrogen 3.283 N/A LEU 31.A N LEU 27.A O no hydrogen 3.009 N/A SER 33.A N VAL 30.A O no hydrogen 3.391 N/A SER 33.A OG VAL 30.A O no hydrogen 2.686 N/A ARG 38.A N SER 36.A OG no hydrogen 3.124 N/A ARG 38.A NH1 HIS 168.A O no hydrogen 3.353 N/A ARG 38.A NH2 HIS 168.A O no hydrogen 2.487 N/A TRP 39.A NE1 TYR 88.A OH no hydrogen 3.146 N/A ARG 40.A N SER 48.A O no hydrogen 3.028 N/A ARG 40.A NH1 PHE 37.A O no hydrogen 3.444 N/A ARG 40.A NH1 TRP 39.A O no hydrogen 3.425 N/A ALA 45.A N GLU 41.A OE1 no hydrogen 2.657 N/A HIS 46.A N SER 43.A O no hydrogen 2.833 N/A HIS 46.A ND1 PRO 44.A O no hydrogen 3.017 N/A TRP 47.A N LEU 58.A O no hydrogen 2.786 N/A SER 48.A N ARG 40.A O no hydrogen 2.825 N/A SER 48.A OG THR 57.A OG1 no hydrogen 3.050 N/A GLY 49.A N TRP 56.A O no hydrogen 3.058 N/A LEU 51.A N GLN 54.A O no hydrogen 2.901 N/A GLN 54.A N LEU 51.A O no hydrogen 3.257 N/A TRP 56.A N GLY 49.A O no hydrogen 2.882 N/A THR 57.A N THR 68.A O no hydrogen 2.927 N/A THR 57.A OG1 SER 48.A OG no hydrogen 3.050 N/A THR 57.A OG1 TYR 70.A OH no hydrogen 2.749 N/A LEU 58.A N TRP 47.A O no hydrogen 2.669 N/A THR 59.A N HIS 66.A O no hydrogen 3.060 N/A THR 59.A OG1 ALA 45.A O no hydrogen 2.633 N/A GLN 60.A NE2 LEU 25.A O no hydrogen 2.926 N/A THR 61.A N GLN 64.A O no hydrogen 3.118 N/A THR 61.A OG1 HIS 66.A NE2 no hydrogen 3.177 N/A LEU 65.A N ILE 18.A O no hydrogen 2.847 N/A HIS 66.A N THR 59.A O no hydrogen 2.672 N/A HIS 66.A NE2 THR 61.A OG1 no hydrogen 3.177 N/A CYS 67.A N ALA 16.A O no hydrogen 2.918 N/A CYS 67.A SG LEU 65.A O no hydrogen 3.859 N/A THR 68.A N THR 57.A O no hydrogen 3.163 N/A THR 68.A OG1 LEU 14.A O no hydrogen 3.117 N/A TYR 70.A N VAL 55.A O no hydrogen 2.811 N/A TYR 70.A OH THR 57.A OG1 no hydrogen 2.749 N/A ARG 71.A NE GLU 81.A OE2 no hydrogen 2.720 N/A ARG 71.A NH1 ARG 76.A O no hydrogen 3.430 N/A ARG 71.A NH1 GLU 81.A OE1 no hydrogen 2.547 N/A ARG 71.A NH1 GLU 81.A OE2 no hydrogen 3.337 N/A ARG 71.A NH2 SER 75.A O no hydrogen 3.374 N/A ARG 71.A NH2 SER 75.A OG no hydrogen 3.382 N/A ARG 76.A NE TRP 15.A O no hydrogen 2.977 N/A ARG 76.A NH1 TRP 15.A O no hydrogen 3.251 N/A THR 78.A N GLU 81.A OE1 no hydrogen 2.725 N/A GLU 81.A N THR 78.A OG1 no hydrogen 3.262 N/A LEU 82.A N THR 78.A O no hydrogen 2.974 N/A GLU 83.A N PRO 79.A O no hydrogen 3.254 N/A ALA 84.A N ASP 80.A O no hydrogen 3.060 N/A ALA 84.A N GLU 81.A O no hydrogen 3.056 N/A VAL 85.A N GLU 81.A O no hydrogen 3.328 N/A ARG 86.A N LEU 82.A O no hydrogen 3.100 N/A ARG 86.A NH1 ASP 92.A OD2 no hydrogen 3.390 N/A ARG 86.A NH2 ASP 92.A OD2 no hydrogen 3.202 N/A LYS 87.A N GLU 83.A O no hydrogen 2.979 N/A TYR 88.A N ALA 84.A O no hydrogen 2.979 N/A PHE 89.A N VAL 85.A O no hydrogen 3.170 N/A PHE 89.A N ARG 86.A O no hydrogen 3.167 N/A GLN 90.A N LYS 87.A O no hydrogen 3.181 N/A GLN 90.A NE2 LEU 121.A O no hydrogen 2.936 N/A LEU 91.A N ARG 86.A O no hydrogen 3.315 N/A VAL 93.A N GLN 90.A O no hydrogen 2.947 N/A LEU 95.A N GLU 24.A OE1 no hydrogen 3.042 N/A ALA 96.A N GLU 24.A OE2 no hydrogen 3.044 N/A LEU 98.A N THR 94.A O no hydrogen 3.345 N/A TYR 99.A N LEU 95.A O no hydrogen 2.789 N/A TYR 99.A OH PHE 116.A O no hydrogen 2.850 N/A HIS 100.A N ALA 96.A O no hydrogen 3.214 N/A HIS 101.A N GLN 97.A O no hydrogen 3.064 N/A HIS 101.A NE2 TRP 296.A O no hydrogen 3.012 N/A TRP 102.A N LEU 98.A O no hydrogen 2.881 N/A GLY 103.A N TYR 99.A O no hydrogen 2.898 N/A SER 104.A N HIS 100.A O no hydrogen 2.915 N/A SER 104.A OG HIS 101.A O no hydrogen 2.993 N/A VAL 105.A N TRP 102.A O no hydrogen 3.224 N/A PHE 109.A N ASP 106.A O no hydrogen 2.975 N/A PHE 109.A N ASP 106.A OD1 no hydrogen 3.319 N/A GLN 110.A N ASP 106.A O no hydrogen 3.144 N/A GLU 111.A N SER 107.A O no hydrogen 3.241 N/A VAL 112.A N HIS 108.A O no hydrogen 3.133 N/A ALA 113.A N PHE 109.A O no hydrogen 2.851 N/A GLN 114.A N GLU 111.A O no hydrogen 2.840 N/A PHE 116.A N ALA 113.A O no hydrogen 3.028 N/A VAL 119.A N TYR 99.A OH no hydrogen 3.401 N/A ARG 120.A NE GLU 24.A O no hydrogen 2.885 N/A ARG 120.A NH1 PHE 89.A O no hydrogen 3.118 N/A ARG 120.A NH1 VAL 93.A O no hydrogen 3.163 N/A ARG 120.A NH2 GLU 24.A O no hydrogen 2.899 N/A ARG 120.A NH2 VAL 93.A O no hydrogen 3.107 N/A ARG 123.A N TYR 88.A O no hydrogen 2.970 N/A ARG 123.A NE ASP 249.A OD2 no hydrogen 3.012 N/A GLN 124.A N MET 246.A O no hydrogen 3.094 N/A GLN 124.A NE2 GLN 35.A O no hydrogen 3.066 N/A CYS 129.A N ASP 125.A O no hydrogen 2.957 N/A LEU 130.A N PRO 126.A O no hydrogen 2.754 N/A PHE 131.A N ILE 127.A O no hydrogen 3.013 N/A SER 132.A N GLU 128.A O no hydrogen 2.888 N/A SER 132.A OG GLU 128.A O no hydrogen 2.744 N/A PHE 133.A N CYS 129.A O no hydrogen 3.124 N/A ILE 134.A N LEU 130.A O no hydrogen 3.147 N/A CYS 135.A N SER 132.A O no hydrogen 3.021 N/A CYS 135.A SG PHE 131.A O no hydrogen 3.257 N/A SER 136.A N PHE 133.A O no hydrogen 3.378 N/A SER 136.A OG PHE 133.A O no hydrogen 2.689 N/A SER 137.A OG TYR 192.A OH no hydrogen 2.497 N/A ASN 139.A N SER 136.A O no hydrogen 3.299 N/A ASN 139.A ND2 CYS 138.A O no hydrogen 2.738 N/A ARG 143.A N ASN 140.A OD1 no hydrogen 2.735 N/A ILE 144.A N ASN 140.A O no hydrogen 2.915 N/A THR 145.A N ILE 141.A O no hydrogen 2.910 N/A THR 145.A OG1 ILE 141.A O no hydrogen 2.460 N/A GLY 146.A N ALA 142.A O no hydrogen 3.204 N/A MET 147.A N ARG 143.A O no hydrogen 3.055 N/A VAL 148.A N ILE 144.A O no hydrogen 2.949 N/A GLU 149.A N THR 145.A O no hydrogen 3.064 N/A ARG 150.A N GLY 146.A O no hydrogen 3.030 N/A ARG 150.A NE LEU 188.A O no hydrogen 3.090 N/A ARG 150.A NH2 LEU 188.A O no hydrogen 3.497 N/A LEU 151.A N MET 147.A O no hydrogen 2.903 N/A CYS 152.A N VAL 148.A O no hydrogen 3.196 N/A CYS 152.A SG VAL 148.A O no hydrogen 3.186 N/A GLN 153.A N GLU 149.A O no hydrogen 3.112 N/A ALA 154.A N ARG 150.A O no hydrogen 2.855 N/A PHE 155.A N LEU 151.A O no hydrogen 3.060 N/A GLY 156.A N CYS 152.A O no hydrogen 2.622 N/A LEU 159.A N TYR 167.A O no hydrogen 2.652 N/A GLN 161.A NE2 ASP 163.A O no hydrogen 3.137 N/A LEU 162.A N VAL 165.A O no hydrogen 2.926 N/A VAL 165.A N LEU 162.A O no hydrogen 2.922 N/A TYR 167.A N ILE 160.A O no hydrogen 2.915 N/A TYR 167.A OH HIS 5.A NE2 no hydrogen 2.568 N/A GLY 169.A N PRO 157.A O no hydrogen 2.966 N/A ALA 175.A N SER 172.A OG no hydrogen 3.234 N/A LEU 176.A N SER 172.A O no hydrogen 3.150 N/A ALA 177.A N LEU 173.A O no hydrogen 2.880 N/A GLY 178.A N ALA 175.A O no hydrogen 3.176 N/A HIS 184.A N GLU 180.A O no hydrogen 3.048 N/A LEU 185.A N VAL 181.A O no hydrogen 2.753 N/A ARG 186.A N GLU 182.A O no hydrogen 2.997 N/A ARG 186.A NE GLU 182.A OE1 no hydrogen 3.135 N/A ARG 186.A NH1 GLU 182.A OE1 no hydrogen 2.887 N/A LYS 187.A N ALA 183.A O no hydrogen 3.388 N/A LYS 187.A N HIS 184.A O no hydrogen 2.974 N/A LEU 188.A N HIS 184.A O no hydrogen 3.336 N/A LEU 188.A N LEU 185.A O no hydrogen 3.013 N/A GLY 189.A N ARG 186.A O no hydrogen 3.003 N/A LEU 190.A N LEU 185.A O no hydrogen 3.228 N/A TYR 192.A OH SER 137.A OG no hydrogen 2.497 N/A ARG 193.A N LEU 190.A O no hydrogen 3.313 N/A ARG 193.A NE SER 137.A O no hydrogen 3.054 N/A ARG 193.A NH1 LEU 190.A O no hydrogen 2.789 N/A ARG 193.A NH2 SER 137.A O no hydrogen 2.884 N/A ALA 194.A N GLY 191.A O no hydrogen 3.067 N/A ARG 195.A N TYR 192.A O no hydrogen 3.318 N/A VAL 197.A N ARG 193.A O no hydrogen 3.043 N/A SER 198.A N ALA 194.A O no hydrogen 3.259 N/A ALA 199.A N ARG 195.A O no hydrogen 2.696 N/A SER 200.A N TYR 196.A O no hydrogen 2.694 N/A ALA 201.A N VAL 197.A O no hydrogen 2.867 N/A ARG 202.A N SER 198.A O no hydrogen 3.085 N/A ARG 202.A NE ALA 177.A O no hydrogen 2.865 N/A ARG 202.A NH1 ALA 177.A O no hydrogen 3.210 N/A ARG 202.A NH1 GLY 178.A O no hydrogen 2.839 N/A ALA 203.A N ALA 199.A O no hydrogen 3.031 N/A ILE 204.A N SER 200.A O no hydrogen 3.236 N/A GLU 206.A N ARG 202.A O no hydrogen 2.640 N/A GLY 210.A N ILE 204.A O no hydrogen 2.717 N/A GLN 215.A N LEU 211.A O no hydrogen 2.993 N/A GLN 216.A N ALA 212.A O no hydrogen 2.737 N/A LEU 217.A N LEU 214.A O no hydrogen 2.898 N/A ARG 218.A N GLN 215.A O no hydrogen 2.800 N/A ARG 218.A NE ALA 247.A O no hydrogen 2.809 N/A ARG 218.A NH2 GLN 124.A O no hydrogen 2.951 N/A ARG 218.A NH2 ALA 247.A O no hydrogen 3.253 N/A GLU 219.A N GLN 216.A O no hydrogen 3.208 N/A SER 220.A OG GLN 216.A O no hydrogen 3.191 N/A SER 221.A OG GLU 223.A OE2 no hydrogen 3.221 N/A TYR 222.A OH ASP 241.A OD1 no hydrogen 2.364 N/A GLU 224.A N SER 221.A OG no hydrogen 3.130 N/A ALA 225.A N SER 221.A O no hydrogen 2.704 N/A HIS 226.A N TYR 222.A O no hydrogen 2.820 N/A LYS 227.A N GLU 223.A O no hydrogen 3.140 N/A ALA 228.A N GLU 224.A O no hydrogen 2.907 N/A LEU 229.A N ALA 225.A O no hydrogen 3.186 N/A CYS 230.A N HIS 226.A O no hydrogen 3.334 N/A CYS 230.A SG HIS 226.A NE2 no hydrogen 3.638 N/A CYS 230.A SG HIS 226.A O no hydrogen 3.514 N/A ILE 231.A N ALA 228.A O no hydrogen 2.989 N/A LEU 232.A N LEU 229.A O no hydrogen 2.856 N/A VAL 235.A N LEU 232.A O no hydrogen 3.130 N/A LYS 238.A NZ ASP 257.A OD1 no hydrogen 3.375 N/A ALA 240.A N GLY 236.A O no hydrogen 2.783 N/A ASP 241.A N THR 237.A O no hydrogen 2.786 N/A CYS 242.A N LYS 238.A O no hydrogen 2.993 N/A CYS 242.A SG LYS 238.A O no hydrogen 3.436 N/A ILE 243.A N VAL 239.A O no hydrogen 2.906 N/A CYS 244.A N ALA 240.A O no hydrogen 2.880 N/A CYS 244.A SG ALA 240.A O no hydrogen 3.182 N/A LEU 245.A N ASP 241.A O no hydrogen 2.770 N/A MET 246.A N CYS 242.A O no hydrogen 2.693 N/A ALA 247.A N ILE 243.A O no hydrogen 2.774 N/A LEU 248.A N ILE 243.A O no hydrogen 3.250 N/A LYS 250.A N CYS 244.A O no hydrogen 3.059 N/A LYS 250.A NZ LEU 217.A O no hydrogen 2.919 N/A LYS 250.A NZ ARG 218.A O no hydrogen 2.858 N/A LYS 250.A NZ SER 220.A O no hydrogen 3.028 N/A LYS 250.A NZ LEU 248.A O no hydrogen 2.633 N/A GLN 252.A N GLN 252.A OE1 no hydrogen 2.657 N/A ALA 253.A N LYS 250.A O no hydrogen 3.105 N/A MET 260.A N ASP 257.A OD2 no hydrogen 2.961 N/A TRP 261.A N ASP 257.A O no hydrogen 3.302 N/A TRP 261.A NE1 ASN 285.A OD1 no hydrogen 3.122 N/A HIS 262.A N VAL 258.A O no hydrogen 3.359 N/A ILE 263.A N HIS 259.A O no hydrogen 3.194 N/A ALA 264.A N MET 260.A O no hydrogen 3.045 N/A ALA 264.A N TRP 261.A O no hydrogen 2.962 N/A GLN 265.A N TRP 261.A O no hydrogen 2.846 N/A ARG 266.A N HIS 262.A O no hydrogen 3.100 N/A ARG 266.A NE ASP 267.A OD1 no hydrogen 2.917 N/A ARG 266.A NH1 ASP 267.A OD1 no hydrogen 3.437 N/A ARG 266.A NH1 ASP 311.A OD2 no hydrogen 3.421 N/A ARG 266.A NH2 HIS 262.A NE2 no hydrogen 3.184 N/A ARG 266.A NH2 ASP 311.A OD2 no hydrogen 3.430 N/A ASP 267.A N ILE 263.A O no hydrogen 3.213 N/A TYR 268.A OH ASP 106.A OD2 no hydrogen 2.431 N/A TRP 270.A N ALA 264.A O no hydrogen 3.083 N/A THR 273.A N GLU 287.A OE1 no hydrogen 2.528 N/A THR 274.A N GLU 287.A OE1 no hydrogen 3.249 N/A SER 281.A N ASN 285.A OD1 no hydrogen 3.003 N/A SER 281.A OG THR 284.A OG1 no hydrogen 2.834 N/A THR 284.A N SER 281.A OG no hydrogen 3.166 N/A THR 284.A OG1 GLY 279.A O no hydrogen 3.167 N/A THR 284.A OG1 SER 281.A O no hydrogen 3.055 N/A THR 284.A OG1 SER 281.A OG no hydrogen 2.834 N/A ASN 285.A N SER 281.A O no hydrogen 2.721 N/A LYS 286.A N PRO 282.A O no hydrogen 3.214 N/A GLU 287.A N GLN 283.A O no hydrogen 2.982 N/A LEU 288.A N THR 284.A O no hydrogen 2.827 N/A GLY 289.A N ASN 285.A O no hydrogen 2.834 N/A ASN 290.A N LYS 286.A O no hydrogen 2.997 N/A PHE 291.A N GLU 287.A O no hydrogen 2.978 N/A PHE 292.A N LEU 288.A O no hydrogen 3.329 N/A ARG 293.A N GLY 289.A O no hydrogen 3.271 N/A ARG 293.A NE GLN 252.A O no hydrogen 2.694 N/A SER 294.A N ASN 290.A O no hydrogen 2.961 N/A LEU 295.A N PHE 291.A O no hydrogen 2.885 N/A TRP 296.A N PHE 292.A O no hydrogen 2.767 N/A TRP 296.A NE1 ASP 106.A OD2 no hydrogen 2.976 N/A GLY 297.A N ARG 293.A O no hydrogen 2.932 N/A ALA 300.A N GLY 297.A O no hydrogen 3.136 N/A GLY 301.A N PRO 251.A O no hydrogen 2.872 N/A TRP 302.A N TYR 299.A O no hydrogen 2.928 N/A ALA 303.A N TYR 299.A O no hydrogen 3.229 N/A GLN 304.A N ALA 300.A O no hydrogen 3.083 N/A GLN 304.A NE2 PRO 255.A O no hydrogen 2.784 N/A ALA 305.A N GLY 301.A O no hydrogen 3.405 N/A VAL 306.A N TRP 302.A O no hydrogen 3.320 N/A LEU 307.A N ALA 303.A O no hydrogen 3.125 N/A PHE 308.A N GLN 304.A O no hydrogen 2.923 N/A SER 309.A N ALA 305.A O no hydrogen 3.067 N/A SER 309.A N VAL 306.A O no hydrogen 3.250 N/A ALA 310.A N VAL 306.A O no hydrogen 3.191 N/A ASP 311.A N LEU 307.A O no hydrogen 2.878 N/A LEU 312.A N SER 309.A O no hydrogen 2.921 N/A