Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ppq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ASP 2.A OD1 no hydrogen 2.841 N/A THR 4.A N GLU 7.A OE1 no hydrogen 3.248 N/A GLU 5.A N GLU 5.A OE1 no hydrogen 2.766 N/A GLU 7.A N THR 4.A OG1 no hydrogen 3.362 N/A LEU 8.A N THR 4.A O no hydrogen 3.084 N/A ARG 9.A N GLU 5.A O no hydrogen 2.993 N/A ASN 10.A N ASP 6.A O no hydrogen 2.931 N/A PHE 11.A N GLU 7.A O no hydrogen 2.850 N/A LEU 12.A N LEU 8.A O no hydrogen 2.947 N/A THR 13.A N ASN 10.A O no hydrogen 3.134 N/A THR 13.A OG1 ASN 10.A O no hydrogen 2.529 N/A GLN 14.A N PHE 11.A O no hydrogen 3.169 N/A TYR 15.A N LEU 12.A O no hydrogen 3.154 N/A SER 19.A N THR 37.A OG1 no hydrogen 2.938 N/A SER 19.A OG THR 37.A OG1 no hydrogen 3.229 N/A THR 21.A N HIS 35.A O no hydrogen 2.837 N/A SER 22.A N HIS 35.A O no hydrogen 3.338 N/A TYR 23.A OH ILE 3.A O no hydrogen 2.912 N/A LYS 24.A N LEU 33.A O no hydrogen 3.092 N/A ILE 26.A N ASN 31.A O no hydrogen 3.017 N/A SER 30.A N LEU 45.A O no hydrogen 2.998 N/A SER 30.A OG GLU 47.A OE2 no hydrogen 2.770 N/A PHE 32.A N LEU 43.A O no hydrogen 2.818 N/A LEU 33.A N LYS 24.A O no hydrogen 2.921 N/A LEU 34.A N LEU 41.A O no hydrogen 2.879 N/A HIS 35.A N SER 22.A O no hydrogen 2.907 N/A THR 36.A OG1 ASP 39.A O no hydrogen 2.634 N/A THR 37.A N SER 19.A O no hydrogen 3.016 N/A THR 37.A OG1 SER 19.A OG no hydrogen 3.229 N/A LYS 38.A N THR 36.A OG1 no hydrogen 3.030 N/A LEU 41.A N LEU 34.A O no hydrogen 2.978 N/A ILE 42.A N ILE 91.A O no hydrogen 2.870 N/A LEU 43.A N PHE 32.A O no hydrogen 2.889 N/A THR 44.A N ALA 89.A O no hydrogen 3.023 N/A THR 44.A OG1 ASN 31.A OD1 no hydrogen 2.961 N/A LEU 45.A N SER 30.A O no hydrogen 2.781 N/A TYR 46.A N PRO 87.A O no hydrogen 2.852 N/A TYR 46.A OH TYR 200.A OH no hydrogen 2.864 N/A GLU 47.A N GLU 28.A O no hydrogen 2.853 N/A PHE 54.A N ASN 50.A O no hydrogen 3.408 N/A PHE 55.A N ASP 51.A O no hydrogen 2.831 N/A LEU 56.A N LEU 52.A O no hydrogen 2.825 N/A GLY 57.A N PRO 53.A O no hydrogen 2.861 N/A LEU 58.A N PHE 54.A O no hydrogen 2.764 N/A HIS 60.A N GLY 57.A O no hydrogen 3.019 N/A LEU 61.A N LEU 58.A O no hydrogen 2.929 N/A ALA 63.A N GLN 59.A O no hydrogen 2.801 N/A LYS 64.A N HIS 60.A O no hydrogen 3.181 N/A LYS 64.A N LEU 61.A O no hydrogen 2.977 N/A GLY 65.A N ALA 62.A O no hydrogen 2.794 N/A LEU 66.A N LEU 61.A O no hydrogen 3.117 N/A SER 67.A OG SER 194.A O no hydrogen 2.569 N/A CYS 68.A N LEU 66.A O no hydrogen 3.116 N/A LEU 70.A N SER 92.A OG no hydrogen 2.833 N/A LEU 72.A N LEU 90.A O no hydrogen 2.945 N/A ARG 74.A NE ASP 76.A OD1 no hydrogen 3.123 N/A ARG 74.A NH1 GLN 14.A OE1 no hydrogen 2.755 N/A ARG 74.A NH1 TYR 15.A OH no hydrogen 3.174 N/A ARG 74.A NH2 GLN 14.A OE1 no hydrogen 2.959 N/A ARG 74.A NH2 ASP 76.A OD2 no hydrogen 3.045 N/A LYS 75.A N GLN 14.A O no hydrogen 2.775 N/A LYS 75.A NZ THR 13.A O no hydrogen 3.243 N/A GLY 77.A N ARG 74.A O no hydrogen 3.063 N/A GLU 78.A N ASP 76.A OD1 no hydrogen 2.898 N/A GLY 81.A N ALA 88.A O no hydrogen 2.907 N/A LEU 83.A N ARG 86.A O no hydrogen 2.951 N/A ARG 86.A N LEU 83.A O no hydrogen 2.981 N/A ARG 86.A NH1 SER 84.A O no hydrogen 3.371 N/A ALA 88.A N GLY 81.A O no hydrogen 2.922 N/A ALA 89.A N THR 44.A O no hydrogen 3.132 N/A ILE 91.A N ILE 42.A O no hydrogen 2.813 N/A SER 92.A N LEU 70.A O no hydrogen 2.826 N/A ARG 99.A NH1 TRP 97.A O no hydrogen 2.821 N/A LYS 104.A NZ ASP 191.A OD2 no hydrogen 3.560 N/A HIS 105.A N GLU 102.A O no hydrogen 2.903 N/A CYS 106.A N GLU 102.A O no hydrogen 3.262 N/A CYS 106.A SG GLU 102.A O no hydrogen 3.837 N/A CYS 106.A SG TRP 218.A O no hydrogen 3.915 N/A ARG 107.A N ALA 103.A O no hydrogen 3.182 N/A ARG 107.A NH1 GLU 236.A OE1 no hydrogen 3.478 N/A ARG 107.A NH2 GLU 236.A OE1 no hydrogen 2.933 N/A GLU 108.A N LYS 104.A O no hydrogen 3.482 N/A VAL 109.A N HIS 105.A O no hydrogen 2.995 N/A GLY 110.A N CYS 106.A O no hydrogen 2.978 N/A LYS 111.A N ARG 107.A O no hydrogen 2.999 N/A LYS 111.A NZ GLU 108.A OE2 no hydrogen 3.118 N/A ALA 112.A N GLU 108.A O no hydrogen 2.925 N/A LEU 113.A N VAL 109.A O no hydrogen 2.906 N/A ALA 114.A N GLY 110.A O no hydrogen 3.138 N/A ALA 115.A N LYS 111.A O no hydrogen 2.998 N/A HIS 116.A ND1 TYR 238.A OH no hydrogen 2.655 N/A HIS 116.A NE2 ASP 210.A OD2 no hydrogen 2.769 N/A LEU 117.A N ALA 114.A O no hydrogen 2.948 N/A ALA 118.A N ALA 115.A O no hydrogen 2.865 N/A SER 119.A OG HIS 116.A O no hydrogen 2.866 N/A SER 119.A OG VAL 176.A O no hydrogen 3.560 N/A GLU 120.A N LEU 117.A O no hydrogen 3.354 N/A PHE 122.A N SER 119.A O no hydrogen 3.289 N/A LYS 125.A NZ GLU 123.A OE1 no hydrogen 3.536 N/A ARG 126.A NE ASP 51.A OD1 no hydrogen 3.260 N/A ARG 126.A NH1 ALA 202.A O no hydrogen 2.910 N/A ASN 128.A ND2 ASP 205.A OD2 no hydrogen 2.808 N/A LEU 130.A N ASN 128.A OD1 no hydrogen 2.914 N/A TRP 135.A N SER 131.A O no hydrogen 2.933 N/A TRP 135.A NE1 LEU 130.A O no hydrogen 2.848 N/A LYS 136.A N VAL 132.A O no hydrogen 3.037 N/A VAL 137.A N ASP 133.A O no hydrogen 3.198 N/A LEU 138.A N GLY 134.A O no hydrogen 2.938 N/A TRP 139.A N TRP 135.A O no hydrogen 2.852 N/A ASP 140.A N LYS 136.A O no hydrogen 2.878 N/A LYS 141.A N VAL 137.A O no hydrogen 3.149 N/A SER 142.A N TRP 139.A O no hydrogen 2.839 N/A SER 142.A OG LEU 138.A O no hydrogen 2.999 N/A GLU 143.A N TRP 139.A O no hydrogen 2.729 N/A ARG 145.A N SER 142.A O no hydrogen 3.147 N/A ARG 145.A NE GLU 148.A OE1 no hydrogen 3.476 N/A ARG 145.A NE GLU 148.A OE2 no hydrogen 3.141 N/A ARG 145.A NH1 LEU 272.A O no hydrogen 3.043 N/A ARG 145.A NH2 GLU 148.A OE1 no hydrogen 3.136 N/A ARG 145.A NH2 LEU 272.A O no hydrogen 3.261 N/A ALA 146.A N GLU 143.A O no hydrogen 3.424 N/A GLU 148.A N ARG 145.A O no hydrogen 3.131 N/A VAL 149.A N ALA 146.A O no hydrogen 2.911 N/A LEU 153.A N GLU 150.A O no hydrogen 3.057 N/A ARG 154.A N ASP 147.A OD1 no hydrogen 3.122 N/A ARG 154.A NE GLU 144.A OE2 no hydrogen 3.508 N/A GLU 156.A N GLY 152.A O no hydrogen 3.067 N/A ILE 157.A N LEU 153.A O no hydrogen 3.053 N/A ARG 158.A N ARG 154.A O no hydrogen 3.178 N/A ARG 158.A NH1 GLU 143.A OE2 no hydrogen 2.894 N/A ILE 161.A N ILE 157.A O no hydrogen 2.832 N/A ASP 162.A N ARG 158.A O no hydrogen 3.075 N/A TYR 163.A N PRO 159.A O no hydrogen 3.007 N/A LEU 164.A N GLU 160.A O no hydrogen 2.889 N/A ALA 165.A N ILE 161.A O no hydrogen 3.015 N/A ALA 166.A N ASP 162.A O no hydrogen 2.967 N/A HIS 167.A N TYR 163.A O no hydrogen 2.914 N/A HIS 167.A N LEU 164.A O no hydrogen 3.217 N/A GLY 175.A N ASP 205.A O no hydrogen 3.015 N/A ILE 177.A N CYS 203.A O no hydrogen 2.860 N/A HIS 178.A N ASP 210.A OD2 no hydrogen 2.945 N/A HIS 178.A NE2 ILE 197.A O no hydrogen 2.836 N/A ALA 179.A N ASP 210.A OD1 no hydrogen 2.782 N/A ASP 180.A N HIS 178.A ND1 no hydrogen 3.190 N/A PHE 182.A N ASP 180.A O no hydrogen 2.847 N/A ASN 185.A N PHE 182.A O no hydrogen 2.993 N/A ASN 185.A ND2 ASP 180.A O no hydrogen 2.763 N/A PHE 187.A N GLY 195.A O no hydrogen 2.874 N/A LEU 189.A N GLU 192.A O no hydrogen 2.865 N/A GLU 192.A N LEU 189.A O no hydrogen 3.283 N/A SER 194.A N PHE 187.A O no hydrogen 2.696 N/A SER 194.A OG GLU 95.A O no hydrogen 2.842 N/A GLY 195.A N PHE 187.A O no hydrogen 3.270 N/A LEU 196.A N SER 67.A O no hydrogen 2.968 N/A ILE 197.A N ASN 185.A O no hydrogen 3.014 N/A TYR 200.A OH TYR 46.A OH no hydrogen 2.864 N/A ALA 202.A N PHE 199.A O no hydrogen 2.983 N/A CYS 203.A N ILE 177.A O no hydrogen 3.270 N/A CYS 203.A SG PHE 201.A O no hydrogen 3.657 N/A ASN 204.A N ARG 126.A O no hydrogen 2.831 N/A ASN 204.A ND2 ARG 126.A O no hydrogen 3.434 N/A ASP 205.A N GLY 175.A O no hydrogen 3.008 N/A LEU 206.A N ASP 205.A OD1 no hydrogen 2.768 N/A LEU 207.A N PRO 173.A O no hydrogen 2.966 N/A TYR 209.A N LEU 206.A O no hydrogen 3.078 N/A ASP 210.A N LEU 206.A O no hydrogen 3.393 N/A VAL 211.A N LEU 207.A O no hydrogen 3.132 N/A SER 212.A N ALA 208.A O no hydrogen 3.007 N/A SER 212.A OG TYR 209.A O no hydrogen 2.754 N/A SER 212.A OG LEU 255.A O no hydrogen 3.172 N/A SER 212.A OG SER 259.A OG no hydrogen 2.853 N/A ILE 213.A N TYR 209.A O no hydrogen 3.054 N/A CYS 214.A N ASP 210.A O no hydrogen 3.193 N/A CYS 214.A SG LEU 181.A O no hydrogen 3.767 N/A CYS 214.A SG ASP 210.A O no hydrogen 3.896 N/A LEU 215.A N VAL 211.A O no hydrogen 2.951 N/A ASN 216.A N SER 212.A O no hydrogen 3.073 N/A ASN 216.A ND2 HIS 295.A NE2 no hydrogen 2.794 N/A ALA 217.A N ILE 213.A O no hydrogen 2.808 N/A TRP 218.A N CYS 214.A O no hydrogen 2.854 N/A TRP 218.A NE1 LEU 181.A O no hydrogen 2.875 N/A CYS 219.A N LEU 215.A O no hydrogen 3.120 N/A GLU 221.A N ALA 225.A O no hydrogen 2.715 N/A GLY 224.A N GLU 221.A O no hydrogen 2.816 N/A ALA 225.A N ASP 223.A OD1 no hydrogen 3.062 N/A TYR 226.A OH TYR 304.A O no hydrogen 2.573 N/A ASN 227.A N CYS 219.A O no hydrogen 2.756 N/A ASN 227.A ND2 GLU 221.A OE2 no hydrogen 2.928 N/A LYS 230.A N ASN 227.A OD1 no hydrogen 3.097 N/A LYS 230.A NZ PRO 101.A O no hydrogen 3.277 N/A LYS 230.A NZ GLU 221.A OE2 no hydrogen 3.117 N/A GLY 231.A N ASN 227.A O no hydrogen 3.018 N/A LYS 232.A N VAL 228.A O no hydrogen 2.853 N/A LYS 232.A NZ GLU 236.A OE1 no hydrogen 3.460 N/A LYS 232.A NZ GLU 236.A OE2 no hydrogen 3.387 N/A ALA 233.A N THR 229.A O no hydrogen 3.154 N/A LEU 234.A N LYS 230.A O no hydrogen 2.930 N/A LEU 235.A N GLY 231.A O no hydrogen 2.993 N/A GLU 236.A N LYS 232.A O no hydrogen 2.893 N/A GLY 237.A N ALA 233.A O no hydrogen 2.802 N/A TYR 238.A N LEU 234.A O no hydrogen 2.946 N/A TYR 238.A OH HIS 116.A ND1 no hydrogen 2.655 N/A GLN 239.A N LEU 235.A O no hydrogen 2.848 N/A SER 240.A N GLU 236.A O no hydrogen 2.932 N/A SER 240.A OG GLY 237.A O no hydrogen 2.552 N/A VAL 241.A N TYR 238.A O no hydrogen 3.115 N/A ARG 242.A N TYR 238.A O no hydrogen 2.941 N/A ARG 242.A NH1 TYR 238.A OH no hydrogen 2.933 N/A ARG 242.A NH1 GLU 248.A OE2 no hydrogen 3.070 N/A ARG 242.A NH2 GLU 248.A OE1 no hydrogen 3.566 N/A ARG 242.A NH2 GLU 248.A OE2 no hydrogen 3.095 N/A LEU 244.A N GLN 239.A OE1 no hydrogen 2.522 N/A SER 245.A N GLU 248.A OE1 no hydrogen 2.807 N/A SER 245.A OG GLU 248.A OE1 no hydrogen 3.336 N/A GLU 248.A N SER 245.A OG no hydrogen 3.023 N/A LEU 249.A N SER 245.A O no hydrogen 2.998 N/A GLU 250.A N GLU 246.A O no hydrogen 2.962 N/A ALA 251.A N ALA 247.A O no hydrogen 3.111 N/A LEU 252.A N LEU 249.A O no hydrogen 3.249 N/A LEU 255.A N ALA 251.A O no hydrogen 2.901 N/A SER 256.A N LEU 252.A O no hydrogen 2.798 N/A SER 256.A OG LEU 252.A O no hydrogen 2.715 N/A ARG 257.A N PRO 253.A O no hydrogen 3.014 N/A ARG 257.A NE GLU 160.A OE2 no hydrogen 2.794 N/A ARG 257.A NH1 GLU 160.A OE1 no hydrogen 2.781 N/A ARG 257.A NH1 GLU 160.A OE2 no hydrogen 3.290 N/A GLY 258.A N LEU 254.A O no hydrogen 3.029 N/A SER 259.A N LEU 255.A O no hydrogen 2.873 N/A SER 259.A OG SER 212.A OG no hydrogen 2.853 N/A SER 259.A OG ASN 216.A OD1 no hydrogen 2.917 N/A SER 259.A OG LEU 255.A O no hydrogen 3.373 N/A SER 259.A OG SER 256.A O no hydrogen 3.487 N/A ALA 260.A N SER 256.A O no hydrogen 2.941 N/A LEU 261.A N ARG 257.A O no hydrogen 2.887 N/A ARG 262.A N GLY 258.A O no hydrogen 2.997 N/A ARG 262.A NH1 ARG 262.A O no hydrogen 3.244 N/A PHE 263.A N SER 259.A O no hydrogen 3.293 N/A PHE 264.A N ALA 260.A O no hydrogen 2.984 N/A LEU 265.A N LEU 261.A O no hydrogen 2.814 N/A THR 266.A N ARG 262.A O no hydrogen 3.236 N/A THR 266.A OG1 ARG 262.A O no hydrogen 3.319 N/A THR 266.A OG1 PHE 263.A O no hydrogen 3.402 N/A ARG 267.A N PHE 263.A O no hydrogen 3.089 N/A ARG 267.A NE ASP 284.A O no hydrogen 3.279 N/A ARG 267.A NH2 ASP 284.A O no hydrogen 2.908 N/A ARG 267.A NH2 GLU 287.A OE1 no hydrogen 2.827 N/A LEU 268.A N PHE 264.A O no hydrogen 2.737 N/A TYR 269.A N LEU 265.A O no hydrogen 2.954 N/A ASP 270.A N THR 266.A O no hydrogen 2.829 N/A TRP 271.A N ARG 267.A O no hydrogen 2.866 N/A LEU 272.A N LEU 268.A O no hydrogen 3.031 N/A THR 273.A N ASP 270.A O no hydrogen 3.371 N/A THR 274.A OG1 ASP 270.A O no hydrogen 3.489 N/A THR 274.A OG1 TRP 271.A O no hydrogen 3.141 N/A LYS 282.A NZ TRP 271.A O no hydrogen 3.375 N/A LEU 286.A N ASP 284.A OD1 no hydrogen 2.803 N/A GLU 287.A N ASP 284.A O no hydrogen 3.342 N/A TYR 288.A N PRO 285.A O no hydrogen 3.131 N/A LEU 289.A N PRO 285.A O no hydrogen 3.264 N/A ARG 290.A N LEU 286.A O no hydrogen 2.879 N/A LYS 291.A N GLU 287.A O no hydrogen 3.179 N/A LYS 291.A NZ ASN 216.A O no hydrogen 2.775 N/A LYS 291.A NZ GLU 287.A OE2 no hydrogen 3.183 N/A LYS 291.A NZ TYR 288.A OH no hydrogen 3.254 N/A LEU 292.A N TYR 288.A O no hydrogen 2.933 N/A ARG 293.A N LEU 289.A O no hydrogen 3.004 N/A ARG 293.A NE GLU 156.A OE2 no hydrogen 2.958 N/A ARG 293.A NH2 GLU 156.A OE1 no hydrogen 2.709 N/A PHE 294.A N ARG 290.A O no hydrogen 3.066 N/A HIS 295.A N LYS 291.A O no hydrogen 3.058 N/A HIS 295.A ND1 TYR 304.A OH no hydrogen 2.769 N/A ARG 296.A N LEU 292.A O no hydrogen 3.314 N/A ARG 296.A NE GLU 160.A OE1 no hydrogen 3.168 N/A ARG 296.A NH1 GLU 160.A OE1 no hydrogen 2.782 N/A THR 297.A N PHE 294.A O no hydrogen 2.972 N/A THR 297.A OG1 PHE 294.A O no hydrogen 2.518 N/A ILE 298.A N HIS 295.A O no hydrogen 3.174 N/A ALA 299.A N GLU 303.A OE2 no hydrogen 2.770 N/A ALA 302.A N ASN 300.A OD1 no hydrogen 2.939 N/A GLU 303.A N ASN 300.A O no hydrogen 2.782 N/A TYR 304.A N VAL 301.A O no hydrogen 3.047 N/A TYR 304.A OH HIS 295.A ND1 no hydrogen 2.769 N/A GLY 305.A N ALA 302.A O no hydrogen 2.983 N/A