Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pvq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 GLU 4.A OE1 no hydrogen 2.439 N/A GLU 4.A N THR 1.A OG1 no hydrogen 3.234 N/A VAL 5.A N THR 1.A O no hydrogen 2.584 N/A ARG 6.A N SER 2.A O no hydrogen 3.177 N/A LYS 7.A N ASP 3.A O no hydrogen 3.003 N/A LYS 7.A NZ ASP 11.A OD1 no hydrogen 2.856 N/A ASN 8.A N GLU 4.A O no hydrogen 3.025 N/A ASN 8.A ND2 SER 84.A O no hydrogen 2.957 N/A LEU 9.A N VAL 5.A O no hydrogen 2.905 N/A MET 10.A N ARG 6.A O no hydrogen 3.104 N/A ASP 11.A N LYS 7.A O no hydrogen 3.010 N/A MET 12.A N ASN 8.A O no hydrogen 3.213 N/A PHE 13.A N LEU 9.A O no hydrogen 3.065 N/A ARG 14.A N MET 10.A O no hydrogen 2.921 N/A ASP 15.A N ASP 11.A O no hydrogen 3.036 N/A ARG 16.A NH1 PHE 13.A O no hydrogen 2.465 N/A PHE 19.A N ARG 16.A O no hydrogen 3.264 N/A SER 20.A OG THR 23.A OG1 no hydrogen 2.556 N/A THR 23.A N SER 20.A OG no hydrogen 2.863 N/A THR 23.A OG1 SER 20.A O no hydrogen 3.558 N/A THR 23.A OG1 SER 20.A OG no hydrogen 2.556 N/A TRP 24.A N SER 20.A O no hydrogen 3.115 N/A TRP 24.A NE1 ARG 16.A O no hydrogen 2.740 N/A LYS 25.A N GLU 21.A O no hydrogen 2.967 N/A MET 26.A N HIS 22.A O no hydrogen 2.961 N/A LEU 27.A N THR 23.A O no hydrogen 2.828 N/A LEU 28.A N TRP 24.A O no hydrogen 2.792 N/A SER 29.A N LYS 25.A O no hydrogen 2.839 N/A VAL 30.A N MET 26.A O no hydrogen 2.887 N/A CYS 31.A N LEU 27.A O no hydrogen 3.124 N/A CYS 31.A SG LEU 27.A O no hydrogen 3.416 N/A ARG 32.A N LEU 28.A O no hydrogen 3.029 N/A SER 33.A N SER 29.A O no hydrogen 3.205 N/A SER 33.A N VAL 30.A O no hydrogen 3.213 N/A SER 33.A OG TYR 56.A OH no hydrogen 2.334 N/A TRP 34.A N VAL 30.A O no hydrogen 2.862 N/A TRP 34.A NE1 TRP 45.A O no hydrogen 2.573 N/A ALA 35.A N CYS 31.A O no hydrogen 2.760 N/A ALA 36.A N ARG 32.A O no hydrogen 3.134 N/A TRP 37.A N SER 33.A O no hydrogen 3.292 N/A CYS 38.A N TRP 34.A O no hydrogen 2.970 N/A CYS 38.A SG TRP 34.A O no hydrogen 3.448 N/A CYS 38.A SG LYS 44.A O no hydrogen 3.843 N/A LYS 39.A N ALA 35.A O no hydrogen 3.104 N/A LYS 39.A N ALA 36.A O no hydrogen 3.236 N/A LEU 40.A N ALA 36.A O no hydrogen 3.014 N/A ASN 41.A N TRP 37.A O no hydrogen 2.939 N/A ASN 41.A ND2 TRP 37.A O no hydrogen 2.629 N/A ASN 42.A N LYS 39.A O no hydrogen 2.988 N/A ARG 43.A N CYS 38.A O no hydrogen 2.636 N/A ARG 43.A NE ASN 41.A O no hydrogen 2.647 N/A ARG 43.A NH1 ASP 52.A OD1 no hydrogen 3.330 N/A ARG 43.A NH1 ASP 55.A OD2 no hydrogen 2.617 N/A ALA 48.A N HIS 81.A NE2 no hydrogen 2.941 N/A GLU 51.A N GLU 49.A OE2 no hydrogen 3.213 N/A VAL 53.A N GLU 49.A O no hydrogen 2.964 N/A ARG 54.A N PRO 50.A O no hydrogen 2.890 N/A ASP 55.A N GLU 51.A O no hydrogen 2.865 N/A TYR 56.A N ASP 52.A O no hydrogen 2.918 N/A TYR 56.A OH SER 33.A OG no hydrogen 2.334 N/A TYR 56.A OH HIS 73.A ND1 no hydrogen 2.526 N/A LEU 57.A N VAL 53.A O no hydrogen 3.042 N/A LEU 58.A N ARG 54.A O no hydrogen 3.241 N/A TYR 59.A N ASP 55.A O no hydrogen 3.071 N/A LEU 60.A N TYR 56.A O no hydrogen 2.868 N/A GLN 61.A N LEU 57.A O no hydrogen 2.993 N/A GLN 61.A NE2 GLU 105.A OE1 no hydrogen 3.485 N/A GLN 61.A NE2 ASN 106.A OD1 no hydrogen 2.979 N/A ALA 62.A N LEU 58.A O no hydrogen 2.845 N/A ARG 63.A N LEU 60.A O no hydrogen 3.014 N/A GLY 64.A N GLN 61.A O no hydrogen 2.570 N/A LEU 65.A N LEU 60.A O no hydrogen 3.134 N/A VAL 67.A N GLU 111.A OE2 no hydrogen 2.377 N/A THR 69.A N ALA 66.A O no hydrogen 3.028 N/A ILE 70.A N ALA 66.A O no hydrogen 3.024 N/A GLN 71.A N VAL 67.A O no hydrogen 3.041 N/A GLN 72.A N LYS 68.A O no hydrogen 3.324 N/A HIS 73.A N THR 69.A O no hydrogen 3.166 N/A LEU 74.A N ILE 70.A O no hydrogen 3.186 N/A GLY 75.A N GLN 71.A O no hydrogen 2.623 N/A GLN 76.A N GLN 72.A O no hydrogen 2.811 N/A LEU 77.A N HIS 73.A O no hydrogen 3.289 N/A ASN 78.A N LEU 74.A O no hydrogen 2.708 N/A ASN 78.A ND2 SER 90.A OG no hydrogen 2.429 N/A MET 79.A N GLY 75.A O no hydrogen 2.991 N/A LEU 80.A N GLN 76.A O no hydrogen 2.883 N/A HIS 81.A N LEU 77.A O no hydrogen 3.085 N/A HIS 81.A ND1 LEU 77.A O no hydrogen 2.609 N/A ARG 82.A N ASN 78.A O no hydrogen 2.990 N/A ARG 83.A N MET 79.A O no hydrogen 2.763 N/A SER 84.A N HIS 81.A O no hydrogen 3.240 N/A SER 84.A OG LEU 80.A O no hydrogen 2.361 N/A SER 84.A OG HIS 81.A O no hydrogen 3.242 N/A GLY 85.A N ARG 82.A O no hydrogen 3.293 N/A LEU 86.A N HIS 81.A O no hydrogen 2.696 N/A SER 90.A N ASN 78.A OD1 no hydrogen 2.950 N/A ASP 91.A N ARG 88.A O no hydrogen 2.816 N/A SER 92.A N PRO 89.A O no hydrogen 3.158 N/A SER 92.A OG PRO 89.A O no hydrogen 2.289 N/A SER 96.A N SER 92.A O no hydrogen 2.721 N/A SER 96.A OG SER 90.A O no hydrogen 2.768 N/A SER 96.A OG SER 92.A O no hydrogen 3.290 N/A LEU 97.A N ASN 93.A O no hydrogen 2.718 N/A VAL 98.A N ALA 94.A O no hydrogen 3.044 N/A MET 99.A N VAL 95.A O no hydrogen 3.126 N/A ARG 100.A N SER 96.A O no hydrogen 3.265 N/A ARG 101.A N LEU 97.A O no hydrogen 2.942 N/A ILE 102.A N VAL 98.A O no hydrogen 2.778 N/A ARG 103.A N MET 99.A O no hydrogen 3.030 N/A ARG 103.A NH2 GLN 71.A OE1 no hydrogen 3.363 N/A LYS 104.A N ARG 100.A O no hydrogen 3.197 N/A GLU 105.A N ARG 101.A O no hydrogen 2.750 N/A ASN 106.A N ILE 102.A O no hydrogen 2.881 N/A ASN 106.A ND2 LEU 65.A O no hydrogen 3.510 N/A ASN 106.A ND2 GLU 111.A OE1 no hydrogen 3.148 N/A VAL 107.A N ARG 103.A O no hydrogen 3.059 N/A ASP 108.A N LYS 104.A O no hydrogen 3.154 N/A ALA 109.A N ASN 106.A O no hydrogen 2.932 N/A GLY 110.A N VAL 107.A O no hydrogen 3.201 N/A GLU 111.A N ASN 106.A O no hydrogen 3.104 N/A LYS 114.A NZ ARG 264.A O no hydrogen 3.429 N/A PHE 119.A N SER 272.A O no hydrogen 2.707 N/A GLU 120.A N ASP 123.A OD2 no hydrogen 2.784 N/A ARG 121.A N ASP 280.A OD2 no hydrogen 3.075 N/A THR 122.A OG1 ASP 123.A OD1 no hydrogen 3.483 N/A PHE 124.A N GLU 120.A O no hydrogen 3.001 N/A ASP 125.A N ARG 121.A O no hydrogen 2.758 N/A GLN 126.A N THR 122.A O no hydrogen 3.089 N/A VAL 127.A N ASP 123.A O no hydrogen 3.023 N/A ARG 128.A N PHE 124.A O no hydrogen 2.744 N/A SER 129.A N ASP 125.A O no hydrogen 2.620 N/A SER 129.A OG GLN 126.A O no hydrogen 3.136 N/A LEU 130.A N GLN 126.A O no hydrogen 3.194 N/A MET 131.A N VAL 127.A O no hydrogen 3.004 N/A SER 134.A N MET 131.A O no hydrogen 3.153 N/A SER 134.A OG ASP 139.A OD2 no hydrogen 3.368 N/A ARG 136.A N SER 134.A OG no hydrogen 3.013 N/A ARG 136.A NE ASP 139.A OD2 no hydrogen 3.432 N/A ARG 136.A NH2 ASP 139.A OD1 no hydrogen 3.335 N/A ASP 139.A N ARG 136.A O no hydrogen 2.383 N/A ILE 140.A N ARG 136.A O no hydrogen 2.885 N/A ARG 141.A N CYS 137.A O no hydrogen 2.870 N/A ARG 141.A NE ASN 142.A OD1 no hydrogen 2.647 N/A ARG 141.A NH1 CYS 222.A O no hydrogen 3.022 N/A ARG 141.A NH2 ASN 142.A OD1 no hydrogen 2.921 N/A ASN 142.A N GLN 138.A O no hydrogen 3.125 N/A LEU 143.A N ASP 139.A O no hydrogen 3.285 N/A LEU 143.A N ILE 140.A O no hydrogen 3.136 N/A ALA 144.A N ILE 140.A O no hydrogen 3.312 N/A PHE 145.A N ARG 141.A O no hydrogen 3.194 N/A LEU 146.A N ASN 142.A O no hydrogen 3.190 N/A GLY 147.A N LEU 143.A O no hydrogen 2.946 N/A GLY 147.A N ALA 144.A O no hydrogen 2.474 N/A ILE 148.A N ALA 144.A O no hydrogen 2.789 N/A ALA 149.A N PHE 145.A O no hydrogen 2.948 N/A TYR 150.A N LEU 146.A O no hydrogen 3.355 N/A TYR 150.A OH ASP 280.A OD2 no hydrogen 2.632 N/A ASN 151.A N GLY 147.A O no hydrogen 2.889 N/A ASN 151.A ND2 ASN 151.A O no hydrogen 2.525 N/A THR 152.A OG1 ILE 148.A O no hydrogen 2.315 N/A LEU 154.A N THR 152.A OG1 no hydrogen 3.137 N/A ILE 159.A N LEU 156.A O no hydrogen 2.630 N/A ALA 160.A N LEU 156.A O no hydrogen 3.022 N/A ARG 161.A N ALA 157.A O no hydrogen 2.636 N/A ARG 163.A N ASP 166.A OD2 no hydrogen 3.040 N/A ARG 163.A NE ASN 217.A O no hydrogen 3.397 N/A ARG 163.A NH2 ALA 234.A O no hydrogen 3.407 N/A SER 168.A N LEU 176.A O no hydrogen 2.653 N/A SER 168.A OG LEU 176.A O no hydrogen 3.111 N/A SER 168.A OG GLU 192.A OE2 no hydrogen 3.315 N/A ARG 169.A NH2 GLU 204.A OE2 no hydrogen 3.073 N/A THR 170.A OG1 MET 175.A O no hydrogen 3.324 N/A ASP 171.A N ASP 171.A OD1 no hydrogen 2.350 N/A GLY 172.A N THR 170.A O no hydrogen 2.525 N/A ARG 174.A NH1 ASP 171.A O no hydrogen 3.231 N/A ILE 177.A N LYS 193.A O no hydrogen 2.470 N/A HIS 178.A N ASP 166.A O no hydrogen 2.760 N/A ILE 179.A N VAL 191.A O no hydrogen 2.864 N/A THR 182.A OG1 THR 188.A O no hydrogen 2.648 N/A THR 184.A N SER 187.A OG no hydrogen 3.198 N/A VAL 186.A N THR 184.A O no hydrogen 2.287 N/A SER 187.A OG THR 188.A O no hydrogen 3.467 N/A LYS 193.A N ILE 177.A O no hydrogen 2.823 N/A LYS 193.A NZ THR 152.A O no hydrogen 2.719 N/A LYS 193.A NZ ALA 294.A O no hydrogen 2.307 N/A LEU 195.A N MET 175.A O no hydrogen 3.175 N/A SER 196.A N ASN 151.A OD1 no hydrogen 3.228 N/A GLY 198.A N SER 196.A OG no hydrogen 2.662 N/A LEU 202.A N GLY 198.A O no hydrogen 3.503 N/A GLU 204.A N THR 200.A O no hydrogen 2.999 N/A GLU 204.A N LYS 201.A O no hydrogen 2.280 N/A ARG 205.A N LYS 201.A O no hydrogen 3.336 N/A TRP 206.A N LEU 202.A O no hydrogen 3.280 N/A TRP 206.A NE1 LEU 220.A O no hydrogen 2.663 N/A ILE 207.A N GLU 204.A O no hydrogen 2.353 N/A SER 208.A N GLU 204.A O no hydrogen 2.844 N/A VAL 209.A N ARG 205.A O no hydrogen 2.587 N/A SER 210.A N TRP 206.A O no hydrogen 3.081 N/A SER 210.A OG TRP 206.A O no hydrogen 2.492 N/A GLY 211.A N SER 208.A O no hydrogen 3.131 N/A VAL 212.A N SER 210.A OG no hydrogen 3.107 N/A ASP 214.A N VAL 212.A O no hydrogen 2.696 N/A ASN 217.A ND2 ASP 215.A OD1 no hydrogen 3.412 N/A ASN 218.A ND2 VAL 212.A O no hydrogen 2.562 N/A TYR 219.A N SER 233.A O no hydrogen 3.431 N/A ARG 225.A N VAL 229.A O no hydrogen 3.202 N/A GLY 228.A N ARG 225.A O no hydrogen 2.899 N/A ALA 231.A N ARG 223.A O no hydrogen 3.166 N/A SER 236.A OG THR 235.A O no hydrogen 3.250 N/A ALA 242.A N SER 239.A O no hydrogen 3.033 N/A ALA 242.A N SER 239.A OG no hydrogen 3.067 N/A LEU 243.A N SER 239.A O no hydrogen 3.503 N/A GLY 244.A N ASN 240.A O no hydrogen 3.326 N/A GLY 245.A N SER 241.A O no hydrogen 3.194 N/A ILE 246.A N ALA 242.A O no hydrogen 2.948 N/A PHE 247.A N GLY 244.A O no hydrogen 3.171 N/A GLY 248.A N GLY 244.A O no hydrogen 3.099 N/A ALA 249.A N GLY 245.A O no hydrogen 2.620 N/A THR 250.A N ILE 246.A O no hydrogen 3.109 N/A HIS 251.A N PHE 247.A O no hydrogen 3.127 N/A HIS 251.A N GLY 248.A O no hydrogen 2.674 N/A ARG 252.A N GLY 248.A O no hydrogen 2.951 N/A ARG 252.A N ALA 249.A O no hydrogen 3.243 N/A LEU 253.A N ALA 249.A O no hydrogen 3.256 N/A TYR 255.A N HIS 251.A O no hydrogen 2.767 N/A GLY 256.A N ARG 252.A O no hydrogen 2.441 N/A GLN 263.A N SER 261.A O no hydrogen 2.256 N/A TRP 268.A NE1 ALA 118.A O no hydrogen 3.134 N/A SER 269.A N SER 272.A OG no hydrogen 2.707 N/A SER 272.A N SER 269.A O no hydrogen 2.999 N/A SER 272.A OG LEU 117.A O no hydrogen 2.888 N/A SER 272.A OG SER 269.A O no hydrogen 3.039 N/A ARG 274.A NH1 LEU 153.A O no hydrogen 2.611 N/A VAL 275.A N HIS 271.A O no hydrogen 3.156 N/A GLY 276.A N SER 272.A O no hydrogen 3.081 N/A ALA 277.A N ALA 273.A O no hydrogen 2.896 N/A ALA 278.A N ARG 274.A O no hydrogen 2.984 N/A ARG 279.A N VAL 275.A O no hydrogen 3.351 N/A ASP 280.A N GLY 276.A O no hydrogen 2.968 N/A MET 281.A N ALA 277.A O no hydrogen 2.842 N/A ALA 282.A N ALA 278.A O no hydrogen 2.527 N/A ALA 282.A N ARG 279.A O no hydrogen 2.950 N/A ARG 283.A N ARG 279.A O no hydrogen 2.488 N/A ARG 283.A NH2 GLU 120.A OE2 no hydrogen 2.329 N/A ALA 284.A N ASP 280.A O no hydrogen 3.279 N/A GLY 285.A N ALA 282.A O no hydrogen 2.524 N/A GLU 290.A N SER 287.A OG no hydrogen 3.144 N/A ILE 291.A N SER 287.A O no hydrogen 2.845 N/A MET 292.A N ILE 288.A O no hydrogen 2.587 N/A GLN 293.A N GLU 290.A O no hydrogen 3.077 N/A GLY 295.A N ILE 291.A O no hydrogen 3.459 N/A GLY 296.A N MET 292.A O no hydrogen 2.978 N/A ILE 307.A N MET 304.A O no hydrogen 3.083 N/A ARG 308.A N MET 304.A O no hydrogen 2.884 N/A LEU 310.A N ILE 307.A O no hydrogen 3.381 N/A THR 314.A N ASP 311.A O no hydrogen 3.467 N/A THR 314.A OG1 ASP 311.A O no hydrogen 2.920 N/A ARG 319.A N GLY 315.A O no hydrogen 3.421 N/A LEU 320.A N ALA 316.A O no hydrogen 2.882 N/A LEU 320.A N MET 317.A O no hydrogen 3.167 N/A LEU 321.A N MET 317.A O no hydrogen 2.846 N/A GLU 322.A N VAL 318.A O no hydrogen 2.977 N/A