Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q3t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NH1 TYR 111.A OH no hydrogen 2.718 N/A ALA 7.A N LEU 3.A O no hydrogen 2.966 N/A GLU 8.A N LEU 4.A O no hydrogen 2.798 N/A MET 9.A N ARG 5.A O no hydrogen 2.898 N/A TYR 10.A N ARG 6.A O no hydrogen 3.058 N/A GLN 11.A N ALA 7.A O no hydrogen 2.909 N/A GLN 11.A NE2 HIS 92.A O no hydrogen 2.970 N/A ASP 12.A N GLU 8.A O no hydrogen 2.902 N/A TYR 13.A N MET 9.A O no hydrogen 2.863 N/A MET 14.A N TYR 10.A O no hydrogen 3.005 N/A LYS 15.A N GLN 11.A O no hydrogen 3.292 N/A LYS 15.A NZ ASP 12.A OD1 no hydrogen 2.749 N/A GLN 16.A N TYR 13.A O no hydrogen 2.719 N/A GLN 16.A NE2 ASP 12.A O no hydrogen 3.232 N/A VAL 17.A N MET 14.A O no hydrogen 2.947 N/A ARG 23.A NE PRO 20.A O no hydrogen 2.764 N/A ARG 23.A NH2 PRO 20.A O no hydrogen 3.063 N/A GLY 24.A N TYR 43.A OH no hydrogen 3.173 N/A TRP 32.A N ASP 59.A OD1 no hydrogen 2.819 N/A VAL 33.A N ASP 59.A OD2 no hydrogen 3.068 N/A GLY 34.A N SER 31.A OG no hydrogen 2.711 N/A LEU 35.A N SER 31.A O no hydrogen 2.745 N/A SER 36.A N TRP 32.A O no hydrogen 3.171 N/A SER 36.A OG TRP 32.A O no hydrogen 3.090 N/A SER 36.A OG VAL 33.A O no hydrogen 2.648 N/A ILE 37.A N VAL 33.A O no hydrogen 3.260 N/A SER 38.A N GLY 34.A O no hydrogen 3.309 N/A SER 38.A OG GLY 34.A O no hydrogen 3.294 N/A MET 39.A N LEU 35.A O no hydrogen 2.957 N/A LYS 40.A N SER 36.A O no hydrogen 2.958 N/A LYS 40.A NZ ASN 52.A OD1 no hydrogen 2.984 N/A LYS 40.A NZ ASP 116.A OD1 no hydrogen 2.683 N/A GLN 41.A N ILE 37.A O no hydrogen 2.584 N/A LEU 42.A N SER 38.A O no hydrogen 3.169 N/A TYR 43.A N MET 39.A O no hydrogen 2.876 N/A TYR 43.A OH GLU 82.A OE2 no hydrogen 2.349 N/A GLY 44.A N LYS 40.A O no hydrogen 2.776 N/A GLN 45.A NE2 PRO 18.A O no hydrogen 2.765 N/A LEU 47.A N ASP 116.A OD2 no hydrogen 3.165 N/A HIS 48.A N GLU 89.A OE1 no hydrogen 2.797 N/A HIS 48.A N GLU 89.A OE2 no hydrogen 3.223 N/A HIS 48.A NE2 GLN 11.A OE1 no hydrogen 2.486 N/A TYR 49.A N TYR 10.A OH no hydrogen 2.596 N/A TYR 49.A OH ASP 108.A OD2 no hydrogen 2.474 N/A LEU 50.A N HIS 48.A ND1 no hydrogen 2.807 N/A THR 51.A OG1 GLU 89.A OE1 no hydrogen 2.650 N/A THR 51.A OG1 HIS 92.A ND1 no hydrogen 2.831 N/A ASN 52.A N HIS 48.A O no hydrogen 2.820 N/A ASN 52.A ND2 LEU 47.A O no hydrogen 3.096 N/A ASN 52.A ND2 PHE 114.A O no hydrogen 2.681 N/A ASN 52.A ND2 ASP 116.A OD1 no hydrogen 2.974 N/A VAL 53.A N TYR 49.A O no hydrogen 2.596 N/A LEU 54.A N LEU 50.A O no hydrogen 2.922 N/A LEU 55.A N THR 51.A O no hydrogen 2.907 N/A GLN 56.A N ASN 52.A O no hydrogen 2.877 N/A ARG 57.A N VAL 53.A O no hydrogen 3.096 N/A TRP 58.A N LEU 54.A O no hydrogen 2.983 N/A ASP 59.A N LEU 55.A O no hydrogen 3.199 N/A GLN 60.A N GLN 56.A O no hydrogen 2.765 N/A SER 61.A N ARG 57.A O no hydrogen 2.780 N/A SER 61.A OG TRP 58.A O no hydrogen 2.741 N/A ARG 62.A N ASP 59.A O no hydrogen 2.954 N/A ARG 62.A NH2 GLN 70.A O no hydrogen 2.903 N/A PHE 63.A N GLN 60.A O no hydrogen 3.045 N/A THR 65.A OG1 SER 67.A OG no hydrogen 3.257 N/A SER 67.A N THR 65.A OG1 no hydrogen 3.037 N/A SER 67.A OG THR 65.A OG1 no hydrogen 3.257 N/A SER 67.A OG GLU 68.A O no hydrogen 3.314 N/A ARG 71.A NE ASP 73.A OD2 no hydrogen 2.216 N/A ARG 71.A NH2 ASP 73.A OD2 no hydrogen 2.768 N/A ASP 73.A N ASP 73.A OD1 no hydrogen 2.351 N/A SER 74.A N ARG 71.A O no hydrogen 2.451 N/A SER 74.A OG ARG 71.A O no hydrogen 3.247 N/A ILE 75.A N LEU 72.A O no hydrogen 2.393 N/A ILE 76.A N LEU 72.A O no hydrogen 2.768 N/A THR 79.A N HIS 77.A ND1 no hydrogen 2.262 N/A ALA 81.A N HIS 77.A O no hydrogen 2.685 N/A GLU 82.A N PRO 78.A O no hydrogen 2.669 N/A ALA 83.A N THR 79.A O no hydrogen 3.047 N/A THR 84.A N LYS 80.A O no hydrogen 2.577 N/A THR 84.A OG1 LYS 80.A O no hydrogen 2.951 N/A ILE 85.A N ALA 81.A O no hydrogen 3.231 N/A TRP 86.A N GLU 82.A O no hydrogen 2.854 N/A TRP 86.A NE1 GLU 82.A OE2 no hydrogen 2.738 N/A LEU 87.A N ALA 83.A O no hydrogen 2.855 N/A VAL 88.A N THR 84.A O no hydrogen 2.591 N/A GLU 89.A N ILE 85.A O no hydrogen 2.830 N/A ILE 91.A N LEU 87.A O no hydrogen 3.186 N/A HIS 92.A N VAL 88.A O no hydrogen 3.012 N/A HIS 92.A ND1 THR 51.A OG1 no hydrogen 2.831 N/A ARG 93.A N GLU 89.A O no hydrogen 2.753 N/A ARG 93.A N GLU 90.A O no hydrogen 3.156 N/A ARG 93.A NH1 VAL 17.A O no hydrogen 3.164 N/A ARG 93.A NH1 GLN 45.A OE1 no hydrogen 2.610 N/A ARG 93.A NH2 GLN 45.A OE1 no hydrogen 2.598 N/A ARG 93.A NH2 PRO 46.A O no hydrogen 3.127 N/A ARG 93.A NH2 GLU 89.A OE2 no hydrogen 3.261 N/A LEU 94.A N ILE 91.A O no hydrogen 3.391 N/A THR 95.A N ILE 91.A O no hydrogen 3.061 N/A THR 95.A OG1 ILE 91.A O no hydrogen 2.785 N/A HIS 100.A N SER 97.A OG no hydrogen 3.061 N/A MET 101.A N SER 97.A O no hydrogen 3.200 N/A ALA 102.A N HIS 98.A O no hydrogen 2.943 N/A LEU 103.A N LEU 99.A O no hydrogen 2.827 N/A LEU 104.A N HIS 100.A O no hydrogen 2.913 N/A TRP 105.A N MET 101.A O no hydrogen 2.586 N/A ARG 106.A N ALA 102.A O no hydrogen 2.576 N/A ARG 106.A NE SER 2.A O no hydrogen 3.002 N/A ARG 106.A NH2 SER 2.A O no hydrogen 2.689 N/A SER 107.A N LEU 103.A O no hydrogen 3.358 N/A SER 107.A N LEU 104.A O no hydrogen 3.071 N/A ASP 108.A N TRP 105.A O no hydrogen 3.038 N/A MET 110.A N ASP 108.A OD1 no hydrogen 3.153 N/A TYR 111.A N ASP 108.A O no hydrogen 2.897 N/A SER 113.A N MET 110.A O no hydrogen 3.155 N/A SER 113.A OG MET 110.A O no hydrogen 2.527 N/A PHE 114.A N TYR 111.A O no hydrogen 3.099 N/A ILE 115.A N HIS 112.A O no hydrogen 3.253 N/A