Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kr8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 ILE 89.A O no hydrogen 2.642 N/A ILE 3.A N CYS 50.A O no hydrogen 2.872 N/A ILE 5.A N LYS 48.A O no hydrogen 3.024 N/A LEU 7.A N ILE 46.A O no hydrogen 3.019 N/A ASP 10.A N SER 8.A OG no hydrogen 2.965 N/A ASP 11.A N SER 8.A O no hydrogen 2.888 N/A GLU 13.A N ASP 11.A OD1 no hydrogen 3.109 N/A GLN 15.A N ASP 11.A O no hydrogen 3.108 N/A GLN 15.A NE2 PRO 9.A O no hydrogen 2.788 N/A SER 16.A N LYS 12.A O no hydrogen 3.049 N/A SER 16.A OG LYS 12.A O no hydrogen 3.483 N/A SER 16.A OG GLU 13.A O no hydrogen 3.509 N/A VAL 17.A N GLU 13.A O no hydrogen 3.349 N/A GLU 18.A N PHE 14.A O no hydrogen 2.850 N/A GLU 19.A N GLN 15.A O no hydrogen 2.843 N/A GLU 20.A N SER 16.A O no hydrogen 3.130 N/A MET 21.A N VAL 17.A O no hydrogen 2.962 N/A GLN 22.A N GLU 18.A O no hydrogen 2.829 N/A GLN 22.A NE2 GLU 18.A OE2 no hydrogen 3.066 N/A GLN 22.A NE2 TYR 41.A O no hydrogen 2.664 N/A SER 23.A N GLU 19.A O no hydrogen 2.790 N/A SER 23.A OG GLU 19.A O no hydrogen 2.747 N/A THR 24.A OG1 GLU 20.A O no hydrogen 2.744 N/A THR 24.A OG1 MET 21.A O no hydrogen 3.467 N/A THR 24.A OG1 GLU 112.A O no hydrogen 3.503 N/A ARG 26.A N SER 115.A OG no hydrogen 3.029 N/A ARG 26.A NE ASN 113.A OD1 no hydrogen 2.841 N/A ARG 26.A NH1 GLU 27.A O no hydrogen 3.131 N/A HIS 28.A NE2 SER 115.A OG no hydrogen 2.805 N/A GLY 31.A N HIS 28.A O no hydrogen 3.064 N/A GLY 32.A N ASP 30.A OD1 no hydrogen 2.649 N/A HIS 33.A N ASP 30.A O no hydrogen 3.126 N/A ALA 34.A N ASP 30.A OD2 no hydrogen 2.858 N/A GLY 36.A N GLY 32.A O no hydrogen 2.825 N/A ILE 37.A N SER 137.A OG no hydrogen 3.176 N/A TYR 41.A N GLN 22.A OE1 no hydrogen 2.957 N/A TYR 41.A OH SER 114.A OG no hydrogen 2.760 N/A ASN 42.A N GLN 201.A O no hydrogen 2.868 N/A ASN 42.A ND2 GLN 201.A OE1 no hydrogen 2.968 N/A LEU 44.A N THR 199.A O no hydrogen 2.802 N/A LYS 45.A N THR 199.A O no hydrogen 3.196 N/A LYS 45.A NZ ASP 6.A OD1 no hydrogen 2.629 N/A GLN 47.A N LEU 197.A O no hydrogen 2.864 N/A GLN 47.A NE2 ASP 6.A OD2 no hydrogen 3.248 N/A LYS 48.A N ILE 5.A O no hydrogen 2.856 N/A LYS 48.A NZ GLU 195.A OE1 no hydrogen 3.131 N/A VAL 49.A N GLU 195.A O no hydrogen 2.785 N/A CYS 50.A N ILE 3.A O no hydrogen 2.852 N/A ASN 51.A ND2 THR 2.A OG1 no hydrogen 2.744 N/A LYS 52.A NZ GLU 56.A OE2 no hydrogen 2.763 N/A LEU 54.A N ASN 51.A OD1 no hydrogen 3.106 N/A TRP 55.A N ASN 51.A O no hydrogen 2.958 N/A GLU 56.A N LYS 52.A O no hydrogen 2.999 N/A ARG 57.A N LYS 53.A O no hydrogen 2.958 N/A ARG 57.A NH1 PHE 93.A O no hydrogen 3.312 N/A ARG 57.A NH2 PHE 93.A O no hydrogen 2.810 N/A TYR 58.A N LEU 54.A O no hydrogen 2.999 N/A TYR 58.A OH GLU 75.A OE1 no hydrogen 2.589 N/A TYR 58.A OH THR 151.A OG1 no hydrogen 2.831 N/A THR 59.A N TRP 55.A O no hydrogen 2.843 N/A THR 59.A OG1 TRP 55.A O no hydrogen 3.510 N/A THR 59.A OG1 GLU 56.A O no hydrogen 3.455 N/A HIS 60.A N GLU 56.A O no hydrogen 3.007 N/A ARG 61.A N ARG 57.A O no hydrogen 3.385 N/A ARG 61.A NE GLN 191.A OE1 no hydrogen 3.108 N/A ARG 61.A NH1 GLU 64.A OE1 no hydrogen 2.807 N/A ARG 61.A NH2 GLN 191.A OE1 no hydrogen 3.209 N/A ARG 62.A N TYR 58.A O no hydrogen 2.941 N/A ARG 62.A NH1 GLU 75.A OE1 no hydrogen 2.823 N/A LYS 63.A N THR 59.A O no hydrogen 3.075 N/A LYS 63.A NZ GLU 67.A OE1 no hydrogen 2.787 N/A LYS 63.A NZ GLU 67.A OE2 no hydrogen 3.291 N/A GLU 64.A N HIS 60.A O no hydrogen 3.227 N/A VAL 65.A N ARG 61.A O no hydrogen 2.919 N/A SER 66.A N ARG 62.A O no hydrogen 2.866 N/A GLU 67.A N LYS 63.A O no hydrogen 2.933 N/A GLU 68.A N GLU 64.A O no hydrogen 3.206 N/A ASN 69.A N SER 66.A O no hydrogen 3.020 N/A ASN 69.A ND2 HIS 72.A O no hydrogen 2.827 N/A HIS 72.A N ASN 69.A O no hydrogen 2.951 N/A ASN 74.A ND2 GLY 153.A O no hydrogen 2.760 N/A ARG 76.A N VAL 150.A O no hydrogen 2.716 N/A ARG 76.A NE ASN 74.A OD1 no hydrogen 3.273 N/A ARG 76.A NH1 ASN 74.A OD1 no hydrogen 2.915 N/A LEU 78.A N CYS 148.A O no hydrogen 2.815 N/A PHE 79.A N ALA 111.A O no hydrogen 2.861 N/A HIS 80.A N LEU 146.A O no hydrogen 2.766 N/A HIS 80.A ND1 TYR 109.A O no hydrogen 2.702 N/A PHE 84.A N SER 82.A OG no hydrogen 2.782 N/A ILE 88.A N PHE 84.A O no hydrogen 2.902 N/A ILE 89.A N VAL 85.A O no hydrogen 3.012 N/A HIS 90.A N ASN 86.A O no hydrogen 3.208 N/A LYS 91.A N ALA 87.A O no hydrogen 2.802 N/A GLY 92.A N ILE 88.A O no hydrogen 2.912 N/A ASP 94.A N HIS 97.A ND1 no hydrogen 2.888 N/A ARG 96.A N ASP 94.A OD1 no hydrogen 2.774 N/A HIS 97.A N ASP 94.A O no hydrogen 2.966 N/A ALA 98.A N GLU 95.A O no hydrogen 3.330 N/A TYR 99.A N GLY 107.A O no hydrogen 2.707 N/A GLY 102.A N TYR 99.A O no hydrogen 3.020 N/A PHE 104.A N TYR 109.A OH no hydrogen 2.809 N/A GLY 105.A N GLY 102.A O no hydrogen 3.065 N/A ILE 108.A N ILE 186.A O no hydrogen 2.865 N/A TYR 109.A OH GLY 105.A O no hydrogen 2.680 N/A PHE 110.A N TYR 184.A O no hydrogen 2.765 N/A ALA 111.A N PHE 79.A O no hydrogen 2.968 N/A GLU 112.A N ALA 182.A O no hydrogen 3.110 N/A ASN 113.A ND2 THR 24.A O no hydrogen 2.648 N/A SER 114.A N THR 24.A OG1 no hydrogen 3.067 N/A SER 114.A OG MET 21.A O no hydrogen 2.832 N/A SER 114.A OG THR 24.A OG1 no hydrogen 3.336 N/A SER 114.A OG TYR 41.A OH no hydrogen 2.760 N/A SER 115.A OG ARG 26.A O no hydrogen 3.496 N/A SER 115.A OG HIS 28.A NE2 no hydrogen 2.805 N/A LYS 116.A N ASN 113.A O no hydrogen 3.003 N/A LYS 116.A NZ GLN 119.A OE1 no hydrogen 2.869 N/A SER 117.A N ASN 113.A O no hydrogen 3.399 N/A ASN 118.A N SER 114.A O no hydrogen 2.876 N/A ASN 118.A ND2 GLY 35.A O no hydrogen 2.754 N/A GLN 119.A N LYS 116.A O no hydrogen 3.106 N/A TYR 120.A N SER 117.A O no hydrogen 2.877 N/A VAL 121.A N ASN 118.A O no hydrogen 3.194 N/A GLY 123.A N TYR 120.A O no hydrogen 3.179 N/A GLY 126.A N GLY 123.A O no hydrogen 2.883 N/A GLY 127.A N ILE 124.A O no hydrogen 3.024 N/A GLY 129.A N GLY 126.A O no hydrogen 2.917 N/A CYS 130.A N ASP 135.A O no hydrogen 3.174 N/A CYS 130.A SG HIS 133.A ND1 no hydrogen 3.619 N/A CYS 130.A SG ASP 135.A O no hydrogen 3.729 N/A LYS 134.A N CYS 130.A O no hydrogen 2.921 N/A ARG 136.A NE HIS 33.A O no hydrogen 3.007 N/A ARG 136.A NH1 GLY 127.A O no hydrogen 3.080 N/A SER 137.A N ASP 135.A OD1 no hydrogen 3.024 N/A SER 137.A OG TYR 139.A OH no hydrogen 3.299 N/A CYS 138.A N ASP 135.A O no hydrogen 3.250 N/A CYS 138.A SG HIS 133.A ND1 no hydrogen 3.379 N/A TYR 139.A OH ILE 37.A O no hydrogen 2.578 N/A CYS 141.A SG HIS 133.A ND1 no hydrogen 3.637 N/A ARG 143.A N TYR 200.A O no hydrogen 2.583 N/A ARG 143.A NH1 GLY 35.A O no hydrogen 3.054 N/A ARG 143.A NH1 ASN 118.A OD1 no hydrogen 2.974 N/A ARG 143.A NH2 ARG 136.A O no hydrogen 2.906 N/A ARG 143.A NH2 CYS 138.A O no hydrogen 3.325 N/A GLN 144.A NE2 THR 199.A OG1 no hydrogen 3.004 N/A LEU 145.A N ILE 198.A O no hydrogen 2.935 N/A LEU 146.A N HIS 80.A O no hydrogen 2.718 N/A PHE 147.A N TYR 196.A O no hydrogen 2.923 N/A CYS 148.A N LEU 78.A O no hydrogen 2.698 N/A ARG 149.A N TYR 193.A O no hydrogen 2.993 N/A ARG 149.A NE GLU 195.A OE2 no hydrogen 2.504 N/A ARG 149.A NH1 GLU 75.A OE2 no hydrogen 2.759 N/A ARG 149.A NH2 GLU 195.A OE2 no hydrogen 3.228 N/A VAL 150.A N ARG 76.A O no hydrogen 2.844 N/A THR 151.A N GLN 191.A O no hydrogen 2.825 N/A THR 151.A OG1 TYR 58.A OH no hydrogen 2.831 N/A LEU 152.A N ASN 74.A O no hydrogen 2.927 N/A GLY 153.A N ALA 73.A O no hydrogen 2.840 N/A LYS 154.A N HIS 168.A ND1 no hydrogen 3.165 N/A SER 155.A OG SER 169.A OG no hydrogen 2.695 N/A SER 155.A OG THR 171.A OG1 no hydrogen 2.671 N/A PHE 156.A N SER 169.A O no hydrogen 2.842 N/A GLN 158.A N THR 171.A O no hydrogen 2.965 N/A SER 160.A N ARG 173.A O no hydrogen 3.014 N/A SER 163.A OG HIS 167.A O no hydrogen 3.057 N/A HIS 167.A N PRO 164.A O no hydrogen 2.895 N/A HIS 167.A ND1 PRO 165.A O no hydrogen 2.702 N/A HIS 168.A N LYS 154.A O no hydrogen 2.795 N/A HIS 168.A NE2 GLU 68.A OE1 no hydrogen 2.749 N/A SER 169.A OG LEU 152.A O no hydrogen 2.826 N/A SER 169.A OG SER 155.A OG no hydrogen 2.695 N/A VAL 170.A N VAL 185.A O no hydrogen 2.961 N/A THR 171.A N PHE 156.A O no hydrogen 2.853 N/A THR 171.A OG1 SER 155.A OG no hydrogen 2.671 N/A GLY 172.A N GLU 183.A O no hydrogen 2.659 N/A ARG 173.A N GLN 158.A O no hydrogen 2.857 N/A SER 175.A N SER 160.A O no hydrogen 2.417 N/A SER 175.A OG SER 160.A O no hydrogen 2.850 N/A LEU 179.A N ASN 177.A OD1 no hydrogen 2.953 N/A ALA 180.A N ASN 177.A O no hydrogen 3.280 N/A LEU 181.A N ASN 113.A OD1 no hydrogen 2.972 N/A GLU 183.A N GLY 172.A O no hydrogen 3.140 N/A TYR 184.A N PHE 110.A O no hydrogen 2.818 N/A TYR 184.A OH GLU 112.A OE1 no hydrogen 2.535 N/A VAL 185.A N VAL 170.A O no hydrogen 2.900 N/A ILE 186.A N ILE 108.A O no hydrogen 3.036 N/A TYR 187.A OH PHE 104.A O no hydrogen 2.668 N/A ARG 188.A NH1 GLU 190.A OE2 no hydrogen 3.029 N/A GLN 191.A N ARG 188.A O no hydrogen 3.060 N/A GLN 191.A NE2 THR 151.A O no hydrogen 2.953 N/A GLN 191.A NE2 HIS 168.A O no hydrogen 3.057 N/A ALA 192.A N GLY 189.A O no hydrogen 3.240 N/A TYR 193.A N ARG 149.A O no hydrogen 2.864 N/A TYR 193.A OH VAL 49.A O no hydrogen 2.691 N/A TYR 196.A N PHE 147.A O no hydrogen 3.028 N/A TYR 196.A OH GLU 13.A OE2 no hydrogen 2.584 N/A LEU 197.A N GLN 47.A O no hydrogen 2.957 N/A ILE 198.A N LEU 145.A O no hydrogen 2.993 N/A THR 199.A N LYS 45.A O no hydrogen 2.793 N/A TYR 200.A N ARG 143.A O no hydrogen 2.775 N/A TYR 200.A OH ASN 118.A OD1 no hydrogen 2.740 N/A GLN 201.A N ASN 42.A O no hydrogen 2.974 N/A GLN 201.A NE2 ILE 140.A O no hydrogen 2.886 N/A MET 203.A N ARG 40.A O no hydrogen 3.199 N/A