Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kcu_L.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N SER 26.A OG no hydrogen 2.527 N/A THR 5.A N LYS 24.A O no hydrogen 2.803 N/A GLN 6.A NE2 TYR 86.A O no hydrogen 2.954 N/A LYS 9.A NZ GLY 101.A O no hydrogen 3.074 N/A MET 11.A N LYS 103.A O no hydrogen 2.833 N/A SER 12.A OG TYR 140.A OH no hydrogen 2.979 N/A MET 13.A N GLU 105.A O no hydrogen 3.239 N/A SER 14.A N GLU 17.A OE2 no hydrogen 2.777 N/A GLY 16.A N VAL 78.A O no hydrogen 2.891 N/A LEU 21.A N LEU 73.A O no hydrogen 2.941 N/A CYS 23.A N PHE 71.A O no hydrogen 3.147 N/A LYS 24.A N THR 5.A O no hydrogen 2.837 N/A ALA 25.A N THR 69.A O no hydrogen 2.953 N/A SER 26.A OG VAL 3.A O no hydrogen 2.802 N/A ASP 30.A N ASN 28.A OD1 no hydrogen 3.021 N/A TYR 32.A N VAL 29.A O no hydrogen 3.127 N/A SER 34.A N GLY 89.A O no hydrogen 2.988 N/A TRP 35.A N ILE 48.A O no hydrogen 2.668 N/A TYR 36.A N HIS 87.A O no hydrogen 2.618 N/A GLN 37.A N ALA 45.A O no hydrogen 2.885 N/A GLN 37.A NE2 TYR 86.A OH no hydrogen 2.953 N/A GLN 38.A N ASP 85.A O no hydrogen 2.818 N/A GLN 38.A NE2 GLN 42.A O no hydrogen 3.071 N/A ARG 39.A NH1 GLN 37.A OE1 no hydrogen 3.150 N/A ARG 39.A NH2 GLN 37.A OE1 no hydrogen 3.350 N/A ALA 45.A N GLN 37.A O no hydrogen 2.756 N/A LEU 47.A N TRP 35.A O no hydrogen 2.681 N/A ILE 48.A N TRP 35.A O no hydrogen 3.293 N/A TYR 49.A N ASN 53.A O no hydrogen 2.650 N/A ALA 51.A N VAL 33.A O no hydrogen 2.892 N/A SER 52.A N GLY 50.A O no hydrogen 2.723 N/A ASN 53.A ND2 TYR 49.A O no hydrogen 3.262 N/A ARG 54.A NE PHE 62.A O no hydrogen 2.847 N/A ARG 54.A NH2 PHE 62.A O no hydrogen 3.281 N/A TYR 55.A N LEU 47.A O no hydrogen 2.870 N/A VAL 58.A N TYR 55.A O no hydrogen 3.196 N/A ARG 61.A NH1 ASP 82.A OD1 no hydrogen 2.540 N/A THR 63.A N THR 74.A O no hydrogen 2.855 N/A THR 63.A OG1 ASP 60.A O no hydrogen 3.541 N/A SER 65.A N THR 72.A O no hydrogen 3.085 N/A SER 65.A OG THR 72.A OG1 no hydrogen 2.976 N/A ALA 68.A N ASP 30.A O no hydrogen 2.623 N/A THR 69.A OG1 ASP 70.A OD1 no hydrogen 2.999 N/A PHE 71.A N CYS 23.A O no hydrogen 2.839 N/A THR 72.A N SER 65.A O no hydrogen 2.978 N/A LEU 73.A N LEU 21.A O no hydrogen 3.105 N/A THR 74.A N THR 63.A O no hydrogen 2.874 N/A ILE 75.A N VAL 19.A O no hydrogen 3.260 N/A SER 76.A N ARG 61.A O no hydrogen 2.578 N/A VAL 78.A N GLU 17.A O no hydrogen 2.784 N/A GLN 79.A N ASP 82.A OD2 no hydrogen 2.917 N/A GLN 79.A NE2 SER 77.A OG no hydrogen 3.276 N/A GLU 81.A N GLU 81.A OE2 no hydrogen 2.490 N/A ASP 82.A N GLN 79.A O no hydrogen 2.719 N/A LEU 83.A N ALA 80.A O no hydrogen 2.898 N/A ASP 85.A N GLN 38.A O no hydrogen 3.197 N/A TYR 86.A N THR 102.A O no hydrogen 2.883 N/A TYR 86.A OH ASP 82.A O no hydrogen 2.764 N/A HIS 87.A N TYR 36.A O no hydrogen 2.822 N/A GLY 89.A N SER 34.A O no hydrogen 3.061 N/A GLN 90.A N THR 97.A O no hydrogen 3.149 N/A GLN 90.A NE2 SER 93.A O no hydrogen 3.549 N/A GLN 90.A NE2 THR 97.A OG1 no hydrogen 2.851 N/A SER 91.A N TYR 32.A O no hydrogen 3.048 N/A SER 91.A OG TYR 32.A O no hydrogen 3.451 N/A TYR 92.A N GLN 90.A OE1 no hydrogen 2.728 N/A SER 93.A N GLN 90.A OE1 no hydrogen 3.047 N/A THR 97.A OG1 ASP 1.A OD2 no hydrogen 3.523 N/A THR 97.A OG1 ILE 2.A O no hydrogen 2.973 N/A GLY 99.A N CYS 88.A O no hydrogen 3.036 N/A GLY 101.A N GLN 6.A OE1 no hydrogen 2.624 N/A THR 102.A N TYR 86.A O no hydrogen 2.948 N/A THR 102.A OG1 PRO 8.A O no hydrogen 2.424 N/A LYS 103.A N LYS 9.A O no hydrogen 2.883 N/A LYS 103.A NZ ASP 85.A OD2 no hydrogen 3.204 N/A LEU 104.A N ALA 84.A O no hydrogen 3.056 N/A GLU 105.A N MET 11.A O no hydrogen 2.949 N/A LEU 106.A N GLN 166.A OE1 no hydrogen 2.987 N/A LYS 107.A N MET 13.A O no hydrogen 3.055 N/A LYS 107.A NZ GLU 17.A OE2 no hydrogen 3.561 N/A ARG 108.A NE ALA 109.A O no hydrogen 2.723 N/A ARG 108.A NH1 ASP 170.A O no hydrogen 2.552 N/A ARG 108.A NH2 ALA 109.A O no hydrogen 3.158 N/A ALA 111.A N TYR 140.A O no hydrogen 3.049 N/A THR 114.A N ASN 137.A O no hydrogen 3.047 N/A SER 116.A N PHE 135.A O no hydrogen 2.910 N/A PHE 118.A N VAL 133.A O no hydrogen 2.762 N/A GLN 124.A N SER 121.A O no hydrogen 2.817 N/A LEU 125.A N SER 121.A O no hydrogen 3.101 N/A THR 126.A N SER 122.A O no hydrogen 2.982 N/A THR 126.A OG1 SER 122.A O no hydrogen 2.674 N/A SER 127.A N GLN 124.A O no hydrogen 2.945 N/A SER 127.A OG GLN 124.A O no hydrogen 3.158 N/A GLY 128.A N LEU 125.A O no hydrogen 2.591 N/A GLY 129.A N GLN 124.A O no hydrogen 3.188 N/A SER 131.A OG GLN 124.A OE1 no hydrogen 3.236 N/A VAL 132.A N LEU 179.A O no hydrogen 2.752 N/A VAL 133.A N PHE 118.A O no hydrogen 3.266 N/A CYS 134.A N SER 177.A O no hydrogen 2.866 N/A CYS 134.A SG SER 116.A O no hydrogen 3.563 N/A PHE 135.A N SER 116.A O no hydrogen 2.699 N/A LEU 136.A N MET 175.A O no hydrogen 2.727 N/A ASN 137.A N THR 114.A O no hydrogen 3.468 N/A ASN 137.A ND2 SER 174.A OG no hydrogen 3.340 N/A ASN 138.A N SER 174.A OG no hydrogen 2.996 N/A ASN 138.A ND2 ASP 170.A OD2 no hydrogen 3.437 N/A PHE 139.A N TYR 173.A O no hydrogen 3.264 N/A TYR 140.A N ALA 111.A O no hydrogen 3.033 N/A TYR 140.A OH SER 12.A OG no hydrogen 2.979 N/A TYR 140.A OH GLU 105.A OE2 no hydrogen 3.298 N/A TYR 140.A OH LEU 106.A O no hydrogen 3.338 N/A LYS 142.A NZ TYR 173.A OH no hydrogen 2.439 N/A ASN 145.A N THR 197.A O no hydrogen 3.451 N/A LYS 147.A NZ GLU 154.A OE1 no hydrogen 3.008 N/A TRP 148.A NE1 SER 177.A OG no hydrogen 2.715 N/A LYS 149.A N THR 193.A O no hydrogen 2.987 N/A LYS 149.A NZ GLU 195.A OE1 no hydrogen 2.455 N/A ILE 150.A N SER 153.A O no hydrogen 2.649 N/A ASP 151.A N SER 191.A O no hydrogen 2.758 N/A SER 153.A N ILE 150.A O no hydrogen 2.874 N/A ARG 155.A N TRP 148.A O no hydrogen 2.968 N/A ARG 155.A NE ASN 157.A O no hydrogen 2.603 N/A ARG 155.A NH1 GLU 185.A OE1 no hydrogen 3.345 N/A ALA 160.A N THR 178.A O no hydrogen 2.672 N/A SER 162.A N SER 176.A O no hydrogen 2.985 N/A THR 164.A N SER 174.A O no hydrogen 2.842 N/A THR 164.A OG1 SER 174.A O no hydrogen 3.272 N/A GLN 166.A NE2 LEU 106.A O no hydrogen 2.848 N/A GLN 166.A NE2 SER 171.A O no hydrogen 2.957 N/A ASP 167.A N THR 172.A O no hydrogen 2.840 N/A LYS 169.A N ASP 167.A OD2 no hydrogen 2.882 N/A ASP 170.A N ASP 167.A OD2 no hydrogen 2.526 N/A THR 172.A N ASP 170.A OD1 no hydrogen 2.956 N/A THR 172.A OG1 ASP 170.A OD1 no hydrogen 2.867 N/A THR 172.A OG1 TYR 173.A O no hydrogen 3.458 N/A TYR 173.A N PHE 139.A O no hydrogen 2.831 N/A TYR 173.A OH GLU 105.A OE2 no hydrogen 2.772 N/A SER 174.A OG TYR 173.A O no hydrogen 2.682 N/A MET 175.A N LEU 136.A O no hydrogen 3.015 N/A SER 176.A N SER 162.A O no hydrogen 2.947 N/A SER 177.A N CYS 134.A O no hydrogen 2.764 N/A SER 177.A OG ASN 161.A OD1 no hydrogen 2.740 N/A THR 178.A N ALA 160.A O no hydrogen 2.916 N/A LEU 179.A N VAL 132.A O no hydrogen 2.859 N/A THR 180.A N GLY 158.A O no hydrogen 2.627 N/A LEU 181.A N ALA 130.A O no hydrogen 2.627 N/A LYS 183.A N GLY 128.A O no hydrogen 2.905 N/A GLU 185.A N THR 182.A OG1 no hydrogen 3.024 N/A TYR 186.A N THR 182.A O no hydrogen 2.978 N/A GLU 187.A N LYS 183.A O no hydrogen 3.090 N/A ARG 188.A N GLU 185.A O no hydrogen 3.209 N/A HIS 189.A N TYR 186.A O no hydrogen 3.350 N/A HIS 189.A ND1 ASP 151.A OD2 no hydrogen 3.091 N/A ASN 190.A N ASP 151.A OD1 no hydrogen 3.227 N/A ASN 190.A N ASP 151.A OD2 no hydrogen 3.393 N/A SER 191.A N ASP 151.A OD1 no hydrogen 2.803 N/A TYR 192.A N PHE 209.A O no hydrogen 3.103 N/A TYR 192.A OH TYR 186.A O no hydrogen 2.679 N/A THR 193.A N LYS 149.A O no hydrogen 2.829 N/A THR 193.A OG1 SER 208.A OG no hydrogen 2.729 N/A CYS 194.A N LYS 207.A O no hydrogen 2.872 N/A GLU 195.A N LYS 147.A O no hydrogen 2.853 N/A ALA 196.A N VAL 205.A O no hydrogen 2.712 N/A HIS 198.A NE2 TYR 140.A O no hydrogen 2.989 N/A LYS 199.A NZ ASP 110.A OD2 no hydrogen 2.919 N/A SER 201.A N HIS 198.A O no hydrogen 3.174 N/A SER 201.A OG SER 203.A O no hydrogen 2.858 N/A SER 203.A N SER 201.A OG no hydrogen 3.260 N/A VAL 205.A N ALA 196.A O no hydrogen 2.627 N/A LYS 207.A N CYS 194.A O no hydrogen 3.075 N/A SER 208.A OG TYR 192.A O no hydrogen 2.814 N/A SER 208.A OG THR 193.A OG1 no hydrogen 2.729 N/A PHE 209.A N TYR 192.A O no hydrogen 3.223 N/A ARG 211.A N ASN 190.A O no hydrogen 2.629 N/A ARG 211.A NE HIS 189.A O no hydrogen 3.033 N/A ARG 211.A NH2 HIS 189.A O no hydrogen 3.013 N/A GLU 213.A N ASN 210.A O no hydrogen 3.189 N/A