Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kpx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ LYS 4.A O no hydrogen 3.222 N/A LYS 2.A NZ THR 175.A O no hydrogen 3.428 N/A ASP 9.A N ASN 6.A O no hydrogen 3.166 N/A LYS 11.A N ASP 9.A OD1 no hydrogen 2.980 N/A LYS 11.A NZ ASP 181.A OD1 no hydrogen 3.427 N/A LYS 11.A NZ ASP 181.A OD2 no hydrogen 2.458 N/A TRP 12.A N ASP 9.A O no hydrogen 2.757 N/A TRP 12.A NE1 TRP 173.A O no hydrogen 2.903 N/A VAL 13.A N ASP 9.A O no hydrogen 3.170 N/A ASN 14.A N PRO 10.A O no hydrogen 2.721 N/A ARG 15.A N LYS 11.A O no hydrogen 2.995 N/A ARG 15.A NH1 PHE 172.A O no hydrogen 2.966 N/A ARG 15.A NH2 ASP 181.A OD1 no hydrogen 3.035 N/A ARG 15.A NH2 PRO 189.A O no hydrogen 2.812 N/A HIS 16.A N TRP 12.A O no hydrogen 3.266 N/A LYS 17.A N VAL 13.A O no hydrogen 2.885 N/A PHE 18.A N ASN 14.A O no hydrogen 2.836 N/A MET 19.A N ARG 15.A O no hydrogen 3.127 N/A PHE 20.A N HIS 16.A O no hydrogen 2.758 N/A ASN 21.A N LYS 17.A O no hydrogen 2.855 N/A PHE 22.A N PHE 18.A O no hydrogen 3.085 N/A LEU 23.A N MET 19.A O no hydrogen 2.944 N/A ASP 24.A N PHE 20.A O no hydrogen 2.795 N/A ILE 25.A N LEU 23.A O no hydrogen 2.775 N/A GLY 27.A N ASP 24.A O no hydrogen 2.918 N/A ASN 28.A N ASP 24.A OD1 no hydrogen 3.128 N/A ASN 28.A N ASN 26.A OD1 no hydrogen 3.374 N/A GLY 29.A N ASP 24.A OD2 no hydrogen 2.718 N/A LYS 30.A N ASN 28.A OD1 no hydrogen 2.982 N/A LYS 30.A NZ ASN 28.A O no hydrogen 3.200 N/A ILE 31.A N VAL 77.A O no hydrogen 2.901 N/A THR 32.A N GLU 35.A OE1 no hydrogen 2.947 N/A GLU 35.A N THR 32.A OG1 no hydrogen 3.127 N/A ILE 36.A N THR 32.A O no hydrogen 3.107 N/A VAL 37.A N LEU 33.A O no hydrogen 2.838 N/A SER 38.A N ASP 34.A O no hydrogen 2.925 N/A SER 38.A OG ASP 42.A OD2 no hydrogen 2.809 N/A LYS 39.A N GLU 35.A O no hydrogen 2.997 N/A LYS 39.A NZ SER 136.A O no hydrogen 2.846 N/A ALA 40.A N ILE 36.A O no hydrogen 3.027 N/A SER 41.A N VAL 37.A O no hydrogen 2.889 N/A SER 41.A OG VAL 37.A O no hydrogen 3.498 N/A SER 41.A OG GLN 59.A OE1 no hydrogen 2.545 N/A ASP 42.A N SER 38.A O no hydrogen 2.841 N/A ASP 43.A N SER 38.A O no hydrogen 3.240 N/A ILE 44.A N LYS 39.A O no hydrogen 2.957 N/A CYS 45.A N ALA 40.A O no hydrogen 3.088 N/A CYS 45.A SG ALA 40.A O no hydrogen 3.417 N/A LYS 47.A N ASP 43.A O no hydrogen 3.063 N/A LYS 47.A NZ ASP 43.A OD1 no hydrogen 2.764 N/A LEU 48.A N ILE 44.A O no hydrogen 2.870 N/A GLY 49.A N ALA 46.A O no hydrogen 3.187 N/A ALA 50.A N CYS 45.A O no hydrogen 2.950 N/A THR 51.A N GLN 54.A OE1 no hydrogen 2.854 N/A GLN 54.A N THR 51.A OG1 no hydrogen 3.160 N/A THR 55.A N THR 51.A O no hydrogen 2.810 N/A THR 55.A OG1 THR 51.A O no hydrogen 2.849 N/A GLN 56.A N PRO 52.A O no hydrogen 2.947 N/A ARG 57.A N ALA 53.A O no hydrogen 2.943 N/A HIS 58.A N GLN 54.A O no hydrogen 2.889 N/A GLN 59.A N THR 55.A O no hydrogen 2.890 N/A GLU 60.A N GLN 56.A O no hydrogen 2.921 N/A ALA 61.A N ARG 57.A O no hydrogen 3.031 N/A VAL 62.A N HIS 58.A O no hydrogen 2.980 N/A GLU 63.A N GLN 59.A O no hydrogen 2.862 N/A ALA 64.A N GLU 60.A O no hydrogen 2.918 N/A PHE 65.A N ALA 61.A O no hydrogen 2.939 N/A PHE 66.A N VAL 62.A O no hydrogen 2.997 N/A LYS 67.A N GLU 63.A O no hydrogen 2.819 N/A LYS 67.A NZ GLU 63.A OE2 no hydrogen 2.881 N/A LYS 68.A N ALA 64.A O no hydrogen 3.125 N/A LYS 68.A NZ GLU 88.A OE2 no hydrogen 3.067 N/A ILE 69.A N PHE 66.A O no hydrogen 3.092 N/A GLY 70.A N LYS 67.A O no hydrogen 2.954 N/A LEU 71.A N PHE 66.A O no hydrogen 3.046 N/A TYR 73.A N ASP 72.A OD1 no hydrogen 2.657 N/A TYR 73.A OH GLU 63.A OE1 no hydrogen 2.747 N/A GLY 74.A N ASP 34.A OD2 no hydrogen 2.897 N/A LYS 75.A N ASP 72.A O no hydrogen 3.163 N/A LYS 75.A NZ GLY 70.A O no hydrogen 2.771 N/A VAL 77.A N ILE 31.A O no hydrogen 2.862 N/A PHE 82.A N GLU 78.A O no hydrogen 2.961 N/A VAL 83.A N PHE 79.A O no hydrogen 2.931 N/A ASN 84.A N PRO 80.A O no hydrogen 3.158 N/A GLY 85.A N ALA 81.A O no hydrogen 2.964 N/A TRP 86.A N PHE 82.A O no hydrogen 3.092 N/A LYS 87.A N ASN 84.A O no hydrogen 3.242 N/A LEU 89.A N GLY 85.A O no hydrogen 3.157 N/A ALA 90.A N TRP 86.A O no hydrogen 2.781 N/A LYS 91.A N LYS 87.A O no hydrogen 3.129 N/A HIS 92.A N GLU 88.A O no hydrogen 2.982 N/A HIS 92.A ND1 ASP 93.A OD1 no hydrogen 3.259 N/A ASP 93.A N LEU 89.A O no hydrogen 2.809 N/A LEU 94.A N ALA 90.A O no hydrogen 2.885 N/A LYS 95.A N LYS 91.A O no hydrogen 3.174 N/A LEU 96.A N HIS 92.A O no hydrogen 3.273 N/A TRP 97.A N ASP 93.A O no hydrogen 2.870 N/A SER 98.A N LEU 94.A O no hydrogen 2.992 N/A SER 98.A OG LEU 94.A O no hydrogen 3.286 N/A SER 98.A OG LYS 95.A O no hydrogen 2.818 N/A GLN 99.A N LEU 96.A O no hydrogen 3.002 N/A ASN 100.A N TRP 97.A O no hydrogen 3.011 N/A LYS 101.A N LEU 96.A O no hydrogen 2.887 N/A LYS 101.A NZ GLN 99.A OE1 no hydrogen 3.117 N/A LEU 104.A N ASP 93.A OD1 no hydrogen 2.877 N/A ILE 105.A N ASP 93.A OD2 no hydrogen 2.873 N/A ARG 106.A N SER 103.A OG no hydrogen 3.278 N/A ASN 107.A N SER 103.A O no hydrogen 2.946 N/A TRP 108.A N LEU 104.A O no hydrogen 3.001 N/A GLY 109.A N ILE 105.A O no hydrogen 3.059 N/A GLU 110.A N ARG 106.A O no hydrogen 2.782 N/A ALA 111.A N ASN 107.A O no hydrogen 3.095 N/A VAL 112.A N TRP 108.A O no hydrogen 2.936 N/A PHE 113.A N GLY 109.A O no hydrogen 2.916 N/A ASP 114.A N GLU 110.A O no hydrogen 2.876 N/A ILE 115.A N VAL 112.A O no hydrogen 3.134 N/A PHE 116.A N PHE 113.A O no hydrogen 2.946 N/A ASP 117.A N PHE 113.A O no hydrogen 2.925 N/A LYS 118.A NZ ILE 115.A O no hydrogen 3.430 N/A ASP 119.A N ASP 117.A OD1 no hydrogen 3.136 N/A GLY 120.A N ASP 117.A OD1 no hydrogen 3.055 N/A SER 121.A N ASP 117.A OD1 no hydrogen 3.123 N/A SER 121.A N ASP 119.A OD1 no hydrogen 3.080 N/A SER 121.A OG ASP 117.A OD1 no hydrogen 3.514 N/A SER 121.A OG ASP 119.A OD1 no hydrogen 3.060 N/A SER 121.A OG SER 123.A OG no hydrogen 2.578 N/A GLY 122.A N ASP 117.A OD2 no hydrogen 2.720 N/A SER 123.A OG SER 121.A OG no hydrogen 2.578 N/A ILE 124.A N LEU 160.A O no hydrogen 2.912 N/A SER 125.A N GLU 128.A OE1 no hydrogen 2.833 N/A GLU 128.A N SER 125.A OG no hydrogen 3.227 N/A TRP 129.A N SER 125.A O no hydrogen 2.975 N/A TRP 129.A NE1 THR 148.A OG1 no hydrogen 3.193 N/A LYS 130.A N LEU 126.A O no hydrogen 2.888 N/A LYS 130.A NZ GLU 146.A OE2 no hydrogen 2.924 N/A THR 131.A N ASP 127.A O no hydrogen 2.972 N/A THR 131.A OG1 ASP 127.A O no hydrogen 3.021 N/A TYR 132.A N GLU 128.A O no hydrogen 2.911 N/A GLY 133.A N TRP 129.A O no hydrogen 2.689 N/A GLY 134.A N LYS 130.A O no hydrogen 2.922 N/A ILE 135.A N THR 131.A O no hydrogen 3.020 N/A SER 136.A N TYR 132.A O no hydrogen 2.881 N/A SER 136.A OG TYR 132.A O no hydrogen 3.002 N/A GLY 137.A N GLY 133.A O no hydrogen 2.887 N/A ILE 138.A N SER 136.A OG no hydrogen 3.308 N/A CYS 139.A N GLY 133.A O no hydrogen 3.325 N/A SER 141.A OG ASP 144.A OD2 no hydrogen 2.881 N/A ASP 144.A N SER 141.A OG no hydrogen 3.283 N/A ALA 145.A N SER 141.A O no hydrogen 3.104 N/A GLU 146.A N ASP 142.A O no hydrogen 2.847 N/A LYS 147.A N GLU 143.A O no hydrogen 2.925 N/A THR 148.A N ASP 144.A O no hydrogen 2.991 N/A THR 148.A OG1 ASP 144.A O no hydrogen 3.315 N/A THR 148.A OG1 LEU 183.A O no hydrogen 2.694 N/A PHE 149.A N ALA 145.A O no hydrogen 3.245 N/A LYS 150.A N GLU 146.A O no hydrogen 2.882 N/A HIS 151.A N LYS 147.A O no hydrogen 2.758 N/A HIS 151.A NE2 ASN 179.A O no hydrogen 2.839 N/A CYS 152.A N THR 148.A O no hydrogen 2.882 N/A CYS 152.A SG THR 148.A O no hydrogen 3.309 N/A ASP 153.A N GLU 164.A OE2 no hydrogen 2.815 N/A ASP 155.A N LYS 159.A O no hydrogen 2.885 N/A SER 157.A N ASP 155.A OD1 no hydrogen 2.790 N/A GLY 158.A N ASP 155.A O no hydrogen 2.855 N/A LYS 159.A N ASP 155.A OD1 no hydrogen 3.076 N/A LEU 160.A N ILE 124.A O no hydrogen 2.901 N/A VAL 162.A N GLY 122.A O no hydrogen 2.881 N/A GLU 164.A N ASP 161.A OD1 no hydrogen 3.161 N/A MET 165.A N ASP 161.A O no hydrogen 3.008 N/A THR 166.A N VAL 162.A O no hydrogen 2.858 N/A THR 166.A OG1 VAL 162.A O no hydrogen 2.826 N/A ARG 167.A N ASP 163.A O no hydrogen 2.997 N/A ARG 167.A NH2 GLU 164.A OE1 no hydrogen 2.881 N/A GLN 168.A N GLU 164.A O no hydrogen 3.058 N/A GLN 168.A NE2 GLU 164.A OE2 no hydrogen 2.952 N/A HIS 169.A N MET 165.A O no hydrogen 2.874 N/A HIS 169.A NE2 TYR 184.A OH no hydrogen 2.633 N/A LEU 170.A N THR 166.A O no hydrogen 2.966 N/A GLY 171.A N ARG 167.A O no hydrogen 3.352 N/A PHE 172.A N GLN 168.A O no hydrogen 2.805 N/A TRP 173.A N HIS 169.A O no hydrogen 2.742 N/A TYR 174.A N LEU 170.A O no hydrogen 2.948 N/A TYR 174.A OH ASP 93.A OD2 no hydrogen 2.651 N/A THR 175.A N LEU 170.A O no hydrogen 3.102 N/A ASP 177.A N GLY 171.A O no hydrogen 2.916 N/A ASN 179.A N ASP 177.A OD1 no hydrogen 3.076 N/A ALA 180.A N ASP 177.A O no hydrogen 2.688 N/A ASP 181.A N PRO 178.A O no hydrogen 3.140 N/A LEU 183.A N ALA 180.A O no hydrogen 3.097 N/A TYR 184.A OH HIS 169.A NE2 no hydrogen 2.633 N/A GLY 185.A N GLY 182.A O no hydrogen 3.041 N/A ASN 186.A N ASP 144.A OD1 no hydrogen 2.742 N/A PHE 187.A N TYR 184.A O no hydrogen 3.213 N/A