Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1krq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N SER 3.A OG no hydrogen 3.384 N/A VAL 7.A N SER 3.A O no hydrogen 3.109 N/A LYS 8.A N LYS 4.A O no hydrogen 3.169 N/A LEU 9.A N GLU 5.A O no hydrogen 2.883 N/A LEU 10.A N VAL 6.A O no hydrogen 2.769 N/A ASN 11.A N VAL 7.A O no hydrogen 2.966 N/A ASN 11.A ND2 VAL 7.A O no hydrogen 2.784 N/A ASN 11.A ND2 HIS 67.A O no hydrogen 3.315 N/A GLU 12.A N LYS 8.A O no hydrogen 3.067 N/A GLN 13.A N LEU 9.A O no hydrogen 3.033 N/A GLN 13.A NE2 GLU 17.A OE2 no hydrogen 3.529 N/A ILE 14.A N LEU 10.A O no hydrogen 2.805 N/A ASN 15.A N ASN 11.A O no hydrogen 3.228 N/A ASN 15.A ND2 GLU 72.A O no hydrogen 3.116 N/A LYS 16.A N GLU 12.A O no hydrogen 3.150 N/A GLU 17.A N GLN 13.A O no hydrogen 3.032 N/A MET 18.A N ILE 14.A O no hydrogen 3.013 N/A TYR 19.A N ASN 15.A O no hydrogen 2.942 N/A ALA 20.A N LYS 16.A O no hydrogen 2.911 N/A ALA 21.A N GLU 17.A O no hydrogen 3.046 N/A ASN 22.A N MET 18.A O no hydrogen 3.441 N/A LEU 23.A N TYR 19.A O no hydrogen 2.887 N/A TYR 24.A N ALA 20.A O no hydrogen 2.832 N/A TYR 24.A OH GLU 94.A OE2 no hydrogen 2.490 N/A LEU 25.A N ALA 21.A O no hydrogen 2.768 N/A SER 26.A N ASN 22.A O no hydrogen 2.770 N/A SER 26.A OG GLU 77.A O no hydrogen 2.876 N/A MET 27.A N LEU 23.A O no hydrogen 2.958 N/A SER 28.A N TYR 24.A O no hydrogen 2.911 N/A SER 28.A OG GLY 40.A O no hydrogen 2.692 N/A SER 29.A N LEU 25.A O no hydrogen 3.348 N/A TRP 30.A N SER 26.A O no hydrogen 3.243 N/A CYS 31.A N MET 27.A O no hydrogen 3.071 N/A CYS 31.A SG MET 27.A O no hydrogen 3.367 N/A TYR 32.A N SER 28.A O no hydrogen 3.112 N/A GLU 33.A N SER 29.A O no hydrogen 2.953 N/A ASN 34.A N TRP 30.A O no hydrogen 3.096 N/A ASN 34.A N CYS 31.A O no hydrogen 3.050 N/A ASN 34.A ND2 TRP 30.A O no hydrogen 2.714 N/A SER 35.A N TYR 32.A O no hydrogen 3.277 N/A LEU 36.A N CYS 31.A O no hydrogen 2.716 N/A GLY 38.A N ASP 155.A OD2 no hydrogen 2.874 N/A ALA 39.A N ASP 155.A OD1 no hydrogen 2.768 N/A GLY 40.A N LEU 36.A O no hydrogen 2.752 N/A ALA 41.A N ASP 37.A O no hydrogen 3.021 N/A PHE 42.A N GLY 38.A O no hydrogen 3.084 N/A LEU 43.A N ALA 39.A O no hydrogen 3.010 N/A PHE 44.A N GLY 40.A O no hydrogen 3.094 N/A ALA 45.A N ALA 41.A O no hydrogen 3.053 N/A HIS 46.A N PHE 42.A O no hydrogen 3.015 N/A HIS 46.A NE2 GLU 94.A OE2 no hydrogen 3.259 N/A ALA 47.A N LEU 43.A O no hydrogen 2.884 N/A SER 48.A N ALA 45.A O no hydrogen 2.916 N/A SER 48.A OG PHE 44.A O no hydrogen 3.497 N/A GLU 49.A N ALA 45.A O no hydrogen 3.205 N/A GLU 50.A N HIS 46.A O no hydrogen 3.088 N/A SER 51.A N ALA 47.A O no hydrogen 3.084 N/A ASP 52.A N SER 48.A O no hydrogen 3.082 N/A ASP 52.A N GLU 49.A O no hydrogen 2.841 N/A HIS 53.A N GLU 49.A O no hydrogen 3.096 N/A HIS 53.A ND1 GLU 50.A OE2 no hydrogen 2.976 N/A ALA 54.A N GLU 50.A O no hydrogen 3.347 N/A LYS 55.A N SER 51.A O no hydrogen 3.305 N/A LYS 56.A N ASP 52.A O no hydrogen 2.955 N/A LEU 57.A N HIS 53.A O no hydrogen 3.292 N/A ILE 58.A N ALA 54.A O no hydrogen 2.935 N/A THR 59.A N LYS 55.A O no hydrogen 2.917 N/A THR 59.A OG1 LYS 55.A O no hydrogen 3.086 N/A TYR 60.A N LYS 56.A O no hydrogen 3.201 N/A TYR 60.A OH THR 116.A OG1 no hydrogen 2.739 N/A LEU 61.A N LEU 57.A O no hydrogen 3.076 N/A ASN 62.A N ILE 58.A O no hydrogen 2.845 N/A GLU 63.A N THR 59.A O no hydrogen 2.965 N/A THR 64.A N LEU 61.A O no hydrogen 3.156 N/A THR 64.A OG1 TYR 60.A O no hydrogen 3.039 N/A THR 64.A OG1 LEU 61.A O no hydrogen 2.978 N/A THR 64.A OG1 SER 66.A OG no hydrogen 2.813 N/A SER 66.A N LEU 61.A O no hydrogen 3.052 N/A SER 66.A OG THR 64.A OG1 no hydrogen 2.813 N/A GLU 69.A N ASN 11.A OD1 no hydrogen 2.626 N/A LYS 81.A N ASP 85.A OD2 no hydrogen 2.726 N/A ASP 85.A N SER 82.A OG no hydrogen 3.381 N/A VAL 86.A N SER 82.A O no hydrogen 2.924 N/A PHE 87.A N LEU 83.A O no hydrogen 3.142 N/A GLU 88.A N LEU 84.A O no hydrogen 2.937 N/A GLU 88.A N ASP 85.A O no hydrogen 3.184 N/A LYS 89.A N ASP 85.A O no hydrogen 3.047 N/A THR 90.A N VAL 86.A O no hydrogen 2.965 N/A THR 90.A OG1 VAL 86.A O no hydrogen 2.908 N/A TYR 91.A N PHE 87.A O no hydrogen 3.183 N/A GLU 92.A N GLU 88.A O no hydrogen 2.863 N/A HIS 93.A N LYS 89.A O no hydrogen 2.761 N/A HIS 93.A ND1 TYR 24.A OH no hydrogen 3.093 N/A GLU 94.A N THR 90.A O no hydrogen 2.909 N/A GLN 95.A N TYR 91.A O no hydrogen 2.990 N/A PHE 96.A N GLU 92.A O no hydrogen 3.120 N/A ILE 97.A N HIS 93.A O no hydrogen 3.019 N/A THR 98.A N GLU 94.A O no hydrogen 2.874 N/A THR 98.A OG1 GLU 94.A O no hydrogen 3.214 N/A THR 98.A OG1 GLU 131.A OE1 no hydrogen 2.687 N/A LYS 99.A N GLN 95.A O no hydrogen 2.933 N/A SER 100.A N PHE 96.A O no hydrogen 2.931 N/A SER 100.A OG PHE 96.A O no hydrogen 3.259 N/A ILE 101.A N ILE 97.A O no hydrogen 2.970 N/A ASN 102.A N THR 98.A O no hydrogen 2.922 N/A THR 103.A N LYS 99.A O no hydrogen 3.013 N/A THR 103.A OG1 LYS 99.A O no hydrogen 3.244 N/A LEU 104.A N SER 100.A O no hydrogen 3.087 N/A VAL 105.A N ILE 101.A O no hydrogen 2.895 N/A GLU 106.A N ASN 102.A O no hydrogen 2.860 N/A HIS 107.A N THR 103.A O no hydrogen 3.040 N/A MET 108.A N LEU 104.A O no hydrogen 3.103 N/A MET 108.A N VAL 105.A O no hydrogen 3.048 N/A LEU 109.A N VAL 105.A O no hydrogen 3.194 N/A THR 110.A N GLU 106.A O no hydrogen 3.037 N/A THR 110.A OG1 HIS 107.A O no hydrogen 3.348 N/A THR 110.A OG1 HIS 111.A ND1 no hydrogen 2.695 N/A HIS 111.A N HIS 107.A O no hydrogen 3.077 N/A HIS 111.A ND1 THR 110.A OG1 no hydrogen 2.695 N/A LYS 112.A N LEU 109.A O no hydrogen 3.231 N/A ASP 113.A N MET 108.A O no hydrogen 2.693 N/A THR 116.A N ASP 113.A OD1 no hydrogen 3.177 N/A THR 116.A OG1 TYR 60.A OH no hydrogen 2.739 N/A THR 116.A OG1 ASP 113.A OD2 no hydrogen 2.648 N/A PHE 117.A N ASP 113.A O no hydrogen 3.093 N/A ASN 118.A N TYR 114.A O no hydrogen 2.927 N/A PHE 119.A N SER 115.A O no hydrogen 2.842 N/A LEU 120.A N THR 116.A O no hydrogen 2.987 N/A GLN 121.A N ASN 118.A O no hydrogen 2.986 N/A GLN 121.A NE2 PHE 117.A O no hydrogen 3.123 N/A TYR 123.A OH HIS 53.A O no hydrogen 2.672 N/A VAL 124.A N LEU 120.A O no hydrogen 3.219 N/A SER 125.A N GLN 121.A O no hydrogen 3.052 N/A GLU 126.A N TRP 122.A O no hydrogen 2.826 N/A GLN 127.A N TYR 123.A O no hydrogen 2.930 N/A GLN 127.A NE2 GLU 94.A OE1 no hydrogen 3.161 N/A GLN 127.A NE2 THR 98.A OG1 no hydrogen 3.206 N/A HIS 128.A N VAL 124.A O no hydrogen 3.192 N/A HIS 128.A N SER 125.A O no hydrogen 3.171 N/A GLU 129.A N SER 125.A O no hydrogen 3.352 N/A GLU 130.A N GLU 126.A O no hydrogen 2.993 N/A GLU 131.A N GLN 127.A O no hydrogen 2.899 N/A ALA 132.A N HIS 128.A O no hydrogen 3.145 N/A LEU 133.A N GLU 129.A O no hydrogen 3.014 N/A PHE 134.A N GLU 130.A O no hydrogen 3.146 N/A ARG 135.A N GLU 131.A O no hydrogen 3.039 N/A ARG 135.A NE TYR 91.A OH no hydrogen 3.358 N/A GLY 136.A N ALA 132.A O no hydrogen 3.034 N/A ILE 137.A N LEU 133.A O no hydrogen 3.152 N/A VAL 138.A N PHE 134.A O no hydrogen 3.137 N/A ASP 139.A N ARG 135.A O no hydrogen 3.079 N/A LYS 140.A N GLY 136.A O no hydrogen 2.881 N/A ILE 141.A N ILE 137.A O no hydrogen 2.815 N/A LYS 142.A N VAL 138.A O no hydrogen 2.983 N/A LEU 143.A N ASP 139.A O no hydrogen 2.750 N/A ILE 144.A N LYS 140.A O no hydrogen 3.097 N/A GLY 145.A N ILE 141.A O no hydrogen 3.061 N/A GLY 150.A N HIS 147.A O no hydrogen 3.056 N/A LEU 153.A N ASN 149.A O no hydrogen 2.966 N/A ALA 154.A N GLY 150.A O no hydrogen 2.716 N/A ASP 155.A N LEU 151.A O no hydrogen 2.858 N/A GLN 156.A N TYR 152.A O no hydrogen 2.944 N/A TYR 157.A N LEU 153.A O no hydrogen 2.988 N/A TYR 157.A N ALA 154.A O no hydrogen 3.081 N/A ILE 158.A N ALA 154.A O no hydrogen 3.135 N/A LYS 159.A N ASP 155.A O no hydrogen 2.993 N/A ASN 160.A N GLN 156.A O no hydrogen 3.115 N/A ILE 161.A N TYR 157.A O no hydrogen 3.239 N/A ALA 162.A N ILE 158.A O no hydrogen 3.099 N/A LEU 163.A N LYS 159.A O no hydrogen 3.211 N/A SER 164.A N ASN 160.A O no hydrogen 2.959 N/A SER 164.A OG ASN 160.A O no hydrogen 3.327 N/A SER 164.A OG ILE 161.A O no hydrogen 3.016 N/A