Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q0k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N VAL 8.A O no hydrogen 2.914 N/A HIS 1.A ND1 VAL 8.A O no hydrogen 2.641 N/A CYS 6.A SG VAL 8.A O no hydrogen 3.803 N/A ALA 12.A N ASP 10.A OD1 no hydrogen 2.698 N/A GLN 13.A N ASP 10.A O no hydrogen 3.019 N/A ARG 15.A N PRO 11.A O no hydrogen 3.029 N/A ARG 15.A NE GLU 19.A OE2 no hydrogen 3.322 N/A ILE 16.A N ALA 12.A O no hydrogen 2.929 N/A ALA 18.A N ALA 14.A O no hydrogen 2.964 N/A GLU 19.A N ARG 15.A O no hydrogen 2.762 N/A SER 20.A N ILE 16.A O no hydrogen 3.312 N/A VAL 21.A N GLU 17.A O no hydrogen 3.074 N/A LYS 22.A N ALA 18.A O no hydrogen 3.076 N/A LYS 22.A NZ GLN 98.A OE1 no hydrogen 2.658 N/A ALA 23.A N GLU 19.A O no hydrogen 2.997 N/A ILE 24.A N SER 20.A O no hydrogen 2.864 N/A GLN 25.A N VAL 21.A O no hydrogen 3.102 N/A GLN 25.A NE2 ALA 88.A O no hydrogen 3.260 N/A GLN 25.A NE2 SER 91.A O no hydrogen 3.156 N/A GLN 25.A NE2 THR 96.A OG1 no hydrogen 2.843 N/A GLU 26.A N LYS 22.A O no hydrogen 3.053 N/A LYS 27.A N ALA 23.A O no hydrogen 3.084 N/A MET 28.A N ILE 24.A O no hydrogen 2.911 N/A ALA 29.A N GLN 25.A O no hydrogen 3.333 N/A ALA 29.A N GLU 26.A O no hydrogen 3.233 N/A ALA 30.A N LYS 27.A O no hydrogen 3.049 N/A ASN 31.A N LYS 27.A O no hydrogen 3.175 N/A ASP 33.A N ASN 31.A OD1 no hydrogen 2.732 N/A PHE 36.A N ASP 33.A OD2 no hydrogen 3.223 N/A GLN 37.A N ASP 33.A O no hydrogen 2.897 N/A GLN 37.A NE2 MET 28.A O no hydrogen 2.917 N/A GLN 37.A NE2 ASN 31.A O no hydrogen 2.639 N/A ILE 38.A N LEU 34.A O no hydrogen 2.891 N/A ARG 39.A N HIS 35.A O no hydrogen 3.018 N/A ALA 40.A N PHE 36.A O no hydrogen 2.809 N/A THR 41.A N GLN 37.A O no hydrogen 2.984 N/A THR 41.A OG1 GLN 37.A O no hydrogen 2.813 N/A VAL 42.A N ILE 38.A O no hydrogen 3.053 N/A ILE 43.A N ARG 39.A O no hydrogen 2.921 N/A LYS 44.A N ALA 40.A O no hydrogen 2.928 N/A LYS 44.A NZ ALA 88.A O no hydrogen 3.220 N/A LYS 44.A NZ SER 91.A O no hydrogen 2.948 N/A GLU 45.A N THR 41.A O no hydrogen 3.014 N/A GLN 46.A N VAL 42.A O no hydrogen 3.326 N/A ARG 47.A N ILE 43.A O no hydrogen 3.005 N/A ARG 47.A NE GLU 17.A OE1 no hydrogen 2.982 N/A ARG 47.A NH2 GLU 17.A OE1 no hydrogen 3.144 N/A ARG 47.A NH2 GLU 17.A OE2 no hydrogen 2.880 N/A ALA 48.A N LYS 44.A O no hydrogen 2.996 N/A GLU 49.A N GLU 45.A O no hydrogen 3.090 N/A LEU 50.A N GLN 46.A O no hydrogen 3.055 N/A ALA 51.A N ARG 47.A O no hydrogen 2.974 N/A LYS 52.A N ALA 48.A O no hydrogen 3.023 N/A LYS 52.A NZ SER 86.A OG no hydrogen 2.841 N/A HIS 53.A N GLU 49.A O no hydrogen 2.999 N/A HIS 54.A N LEU 50.A O no hydrogen 3.000 N/A LEU 55.A N ALA 51.A O no hydrogen 3.085 N/A ASP 56.A N LYS 52.A O no hydrogen 2.819 N/A VAL 57.A N HIS 53.A O no hydrogen 2.974 N/A LEU 58.A N HIS 54.A O no hydrogen 3.194 N/A TRP 59.A N LEU 55.A O no hydrogen 3.078 N/A TRP 59.A NE1 HIS 75.A ND1 no hydrogen 2.896 N/A SER 60.A N ASP 56.A O no hydrogen 2.833 N/A SER 60.A OG ASP 56.A O no hydrogen 3.178 N/A SER 60.A OG VAL 57.A O no hydrogen 3.488 N/A SER 60.A OG ASP 61.A OD1 no hydrogen 2.601 N/A ASP 61.A N VAL 57.A O no hydrogen 2.682 N/A TYR 62.A N VAL 57.A O no hydrogen 3.431 N/A TYR 62.A N LEU 58.A O no hydrogen 3.019 N/A TYR 62.A OH THR 114.A OG1 no hydrogen 2.772 N/A PHE 63.A N LEU 58.A O no hydrogen 2.856 N/A LYS 64.A N HIS 67.A ND1 no hydrogen 3.016 N/A LYS 64.A NZ ASP 61.A O no hydrogen 3.086 N/A LYS 64.A NZ TYR 62.A O no hydrogen 3.074 N/A PHE 68.A N LYS 64.A O no hydrogen 3.228 N/A GLU 69.A N PRO 65.A O no hydrogen 2.964 N/A SER 70.A N PRO 66.A O no hydrogen 2.817 N/A SER 70.A OG PRO 66.A O no hydrogen 2.937 N/A TYR 71.A N HIS 67.A O no hydrogen 2.868 N/A TYR 71.A OH GLU 113.A OE1 no hydrogen 2.701 N/A GLU 73.A N GLU 73.A OE1 no hydrogen 2.774 N/A LEU 74.A N TYR 71.A O no hydrogen 2.895 N/A LEU 77.A N GLU 73.A O no hydrogen 2.894 N/A VAL 78.A N LEU 74.A O no hydrogen 2.999 N/A ASN 79.A N HIS 75.A O no hydrogen 3.032 N/A GLU 80.A N THR 76.A O no hydrogen 2.857 N/A ALA 81.A N LEU 77.A O no hydrogen 2.999 N/A VAL 82.A N VAL 78.A O no hydrogen 3.049 N/A LYS 83.A N ASN 79.A O no hydrogen 3.111 N/A LYS 83.A NZ ASN 79.A OD1 no hydrogen 2.711 N/A ALA 84.A N GLU 80.A O no hydrogen 2.840 N/A LEU 85.A N ALA 81.A O no hydrogen 3.041 N/A SER 86.A N VAL 82.A O no hydrogen 2.950 N/A SER 86.A OG VAL 82.A O no hydrogen 3.427 N/A ALA 87.A N LYS 83.A O no hydrogen 2.921 N/A ALA 88.A N ALA 84.A O no hydrogen 3.038 N/A LYS 89.A N LEU 85.A O no hydrogen 3.041 N/A LYS 89.A NZ GLU 49.A OE1 no hydrogen 2.702 N/A ALA 90.A N SER 86.A O no hydrogen 3.308 N/A SER 91.A N ALA 88.A O no hydrogen 3.162 N/A ASP 93.A N SER 91.A OG no hydrogen 2.878 N/A ALA 95.A N ASP 93.A OD1 no hydrogen 2.856 N/A THR 96.A N ASP 93.A O no hydrogen 2.939 N/A THR 96.A OG1 ASP 93.A O no hydrogen 2.769 N/A GLN 98.A N PRO 94.A O no hydrogen 2.923 N/A GLN 98.A NE2 ASP 102.A OD1 no hydrogen 3.154 N/A LYS 99.A N ALA 95.A O no hydrogen 2.937 N/A ALA 100.A N THR 96.A O no hydrogen 3.195 N/A LEU 101.A N GLY 97.A O no hydrogen 3.044 N/A ASP 102.A N GLN 98.A O no hydrogen 2.964 N/A TYR 103.A N LYS 99.A O no hydrogen 3.237 N/A ILE 104.A N ALA 100.A O no hydrogen 3.019 N/A ALA 105.A N LEU 101.A O no hydrogen 3.085 N/A GLN 106.A N ASP 102.A O no hydrogen 3.237 N/A ILE 107.A N TYR 103.A O no hydrogen 2.922 N/A ASP 108.A N ILE 104.A O no hydrogen 2.719 N/A LYS 109.A N ALA 105.A O no hydrogen 3.095 N/A ILE 110.A N GLN 106.A O no hydrogen 3.190 N/A PHE 111.A N ILE 107.A O no hydrogen 2.814 N/A TRP 112.A N ASP 108.A O no hydrogen 3.023 N/A GLU 113.A N LYS 109.A O no hydrogen 3.130 N/A THR 114.A N ILE 110.A O no hydrogen 3.053 N/A THR 114.A OG1 TYR 62.A OH no hydrogen 2.772 N/A THR 114.A OG1 PHE 111.A O no hydrogen 2.427 N/A LYS 115.A N PHE 111.A O no hydrogen 3.235 N/A LYS 115.A N TRP 112.A O no hydrogen 3.102 N/A LYS 116.A N TRP 112.A O no hydrogen 3.168 N/A LYS 116.A N GLU 113.A O no hydrogen 3.119 N/A