Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5kuy_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N ASP 109.A OD1 no hydrogen 3.127 N/A PHE 3.A N ASP 112.A OD2 no hydrogen 2.855 N/A GLY 4.A N ASP 112.A OD2 no hydrogen 3.058 N/A ALA 5.A N ASP 112.A OD1 no hydrogen 3.040 N/A ILE 6.A N ASP 112.A OD1 no hydrogen 2.873 N/A PHE 9.A N GLY 4.A O no hydrogen 2.838 N/A ILE 10.A N ALA 5.A O no hydrogen 3.227 N/A ASN 12.A ND2 GLY 13.A O no hydrogen 3.221 N/A MET 17.A N TRP 14.A O no hydrogen 3.361 N/A TRP 21.A N THR 41.A OG1 no hydrogen 2.914 N/A TYR 22.A N THR 41.A OG1 no hydrogen 3.275 N/A TYR 22.A OH THR 111.A O no hydrogen 2.851 N/A PHE 24.A N ALA 35.A O no hydrogen 2.678 N/A ARG 25.A NE GLN 34.A OE1 no hydrogen 2.612 N/A ARG 25.A NH2 GLN 34.A OE1 no hydrogen 2.680 N/A HIS 26.A N GLY 33.A O no hydrogen 3.183 N/A ASN 28.A N GLY 31.A O no hydrogen 2.936 N/A ASN 28.A ND2 CYS 144.A O no hydrogen 2.959 N/A ASN 28.A ND2 ASN 146.A OD1 no hydrogen 3.097 N/A GLU 30.A N ASN 28.A OD1 no hydrogen 3.054 N/A GLY 31.A N ASN 28.A O no hydrogen 3.296 N/A GLY 33.A N HIS 26.A O no hydrogen 3.269 N/A GLN 34.A NE2 GLY 16.A O no hydrogen 3.501 N/A ALA 35.A N PHE 24.A O no hydrogen 2.873 N/A ASP 37.A N TYR 22.A O no hydrogen 2.634 N/A SER 40.A N ASP 37.A OD2 no hydrogen 3.011 N/A SER 40.A OG ASP 37.A OD2 no hydrogen 2.690 N/A THR 41.A N ASP 37.A O no hydrogen 3.424 N/A THR 41.A OG1 ASP 37.A O no hydrogen 2.837 N/A GLN 42.A N LEU 38.A O no hydrogen 2.868 N/A GLN 42.A NE2 ASP 46.A OD1 no hydrogen 3.045 N/A ALA 43.A N LYS 39.A O no hydrogen 2.949 N/A ALA 44.A N SER 40.A O no hydrogen 3.234 N/A ILE 45.A N THR 41.A O no hydrogen 3.013 N/A ASP 46.A N GLN 42.A O no hydrogen 2.820 N/A GLN 47.A N ALA 43.A O no hydrogen 3.212 N/A GLN 47.A NE2 ALA 43.A O no hydrogen 3.214 N/A GLN 47.A NE2 GLU 114.A OE2 no hydrogen 3.239 N/A ILE 48.A N ALA 44.A O no hydrogen 3.134 N/A ASN 49.A N ILE 45.A O no hydrogen 2.897 N/A GLY 50.A N ASP 46.A O no hydrogen 2.937 N/A LYS 51.A N GLN 47.A O no hydrogen 2.968 N/A LYS 51.A NZ GLU 103.A O no hydrogen 3.017 N/A LYS 51.A NZ GLU 103.A OE1 no hydrogen 3.302 N/A LYS 51.A NZ HIS 106.A ND1 no hydrogen 2.955 N/A LYS 51.A NZ THR 107.A OG1 no hydrogen 2.814 N/A LEU 52.A N ILE 48.A O no hydrogen 2.722 N/A ASN 53.A N ASN 49.A O no hydrogen 2.840 N/A ARG 54.A N GLY 50.A O no hydrogen 3.190 N/A VAL 55.A N LYS 51.A O no hydrogen 3.174 N/A VAL 55.A N LEU 52.A O no hydrogen 3.122 N/A ILE 56.A N LEU 52.A O no hydrogen 3.062 N/A THR 59.A OG1 GLU 57.A O no hydrogen 3.427 N/A GLN 65.A NE2 PHE 63.A O no hydrogen 3.140 N/A LYS 68.A NZ GLU 85.A OE1 no hydrogen 3.554 N/A LYS 68.A NZ GLU 85.A OE2 no hydrogen 2.912 N/A SER 71.A OG GLU 72.A OE1 no hydrogen 2.557 N/A GLN 78.A NE2 GLU 72.A O no hydrogen 2.747 N/A GLN 78.A NE2 GLU 74.A OE1 no hydrogen 2.917 N/A ASP 79.A N GLY 75.A O no hydrogen 2.760 N/A LEU 80.A N ARG 76.A O no hydrogen 3.086 N/A GLU 81.A N ILE 77.A O no hydrogen 2.994 N/A LYS 82.A N GLN 78.A O no hydrogen 2.960 N/A LYS 82.A NZ GLN 78.A OE1 no hydrogen 3.270 N/A TYR 83.A N ASP 79.A O no hydrogen 2.969 N/A VAL 84.A N LEU 80.A O no hydrogen 2.847 N/A GLU 85.A N GLU 81.A O no hydrogen 3.317 N/A ASP 86.A N LYS 82.A O no hydrogen 2.890 N/A THR 87.A N TYR 83.A O no hydrogen 2.897 N/A THR 87.A OG1 TYR 83.A O no hydrogen 2.872 N/A LYS 88.A N VAL 84.A O no hydrogen 3.084 N/A ILE 89.A N GLU 85.A O no hydrogen 3.006 N/A ASP 90.A N ASP 86.A O no hydrogen 3.137 N/A LEU 91.A N THR 87.A O no hydrogen 3.178 N/A TRP 92.A N LYS 88.A O no hydrogen 2.974 N/A SER 93.A N ILE 89.A O no hydrogen 2.759 N/A SER 93.A OG ILE 89.A O no hydrogen 2.758 N/A TYR 94.A N ASP 90.A O no hydrogen 2.922 N/A ASN 95.A N LEU 91.A O no hydrogen 2.981 N/A ALA 96.A N TRP 92.A O no hydrogen 2.916 N/A GLU 97.A N SER 93.A O no hydrogen 3.083 N/A LEU 98.A N TYR 94.A O no hydrogen 2.918 N/A LEU 99.A N ASN 95.A O no hydrogen 2.888 N/A VAL 100.A N ALA 96.A O no hydrogen 3.314 N/A ALA 101.A N GLU 97.A O no hydrogen 3.264 N/A LEU 102.A N LEU 98.A O no hydrogen 2.984 N/A GLU 103.A N LEU 99.A O no hydrogen 2.883 N/A ASN 104.A N VAL 100.A O no hydrogen 2.893 N/A GLN 105.A N ALA 101.A O no hydrogen 3.104 N/A HIS 106.A N LEU 102.A O no hydrogen 3.030 N/A THR 107.A N GLU 103.A O no hydrogen 2.783 N/A THR 107.A OG1 GLU 103.A O no hydrogen 2.987 N/A ILE 108.A N ASN 104.A O no hydrogen 3.047 N/A ASP 109.A N GLN 105.A O no hydrogen 3.173 N/A LEU 110.A N HIS 106.A O no hydrogen 2.798 N/A THR 111.A N THR 107.A O no hydrogen 3.111 N/A THR 111.A OG1 THR 107.A O no hydrogen 2.865 N/A THR 111.A OG1 ILE 108.A O no hydrogen 3.043 N/A ASP 112.A N ILE 108.A O no hydrogen 3.095 N/A SER 113.A N ASP 109.A O no hydrogen 2.845 N/A GLU 114.A N LEU 110.A O no hydrogen 2.992 N/A MET 115.A N THR 111.A O no hydrogen 3.275 N/A ASN 116.A N ASP 112.A O no hydrogen 3.072 N/A ASN 116.A ND2 GLU 120.A OE2 no hydrogen 3.051 N/A LYS 117.A N SER 113.A O no hydrogen 2.796 N/A LYS 117.A NZ GLU 114.A OE2 no hydrogen 2.952 N/A LEU 118.A N GLU 114.A O no hydrogen 3.077 N/A PHE 119.A N MET 115.A O no hydrogen 3.096 N/A GLU 120.A N ASN 116.A O no hydrogen 2.961 N/A LYS 121.A N LYS 117.A O no hydrogen 2.924 N/A THR 122.A N LEU 118.A O no hydrogen 3.095 N/A THR 122.A OG1 LEU 118.A O no hydrogen 2.841 N/A GLY 123.A N PHE 119.A O no hydrogen 3.061 N/A ARG 124.A N GLU 120.A O no hydrogen 3.030 N/A GLN 125.A N LYS 121.A O no hydrogen 3.163 N/A GLN 125.A NE2 ILE 152.A O no hydrogen 2.962 N/A LEU 126.A N THR 122.A O no hydrogen 3.162 N/A ARG 127.A N GLY 123.A O no hydrogen 3.243 N/A ARG 127.A NE HIS 159.A NE2 no hydrogen 2.943 N/A ARG 127.A NH2 HIS 159.A NE2 no hydrogen 3.179 N/A ASN 129.A N LEU 126.A O no hydrogen 2.844 N/A ASN 129.A ND2 TYR 157.A OH no hydrogen 2.812 N/A ASN 129.A ND2 HIS 159.A O no hydrogen 2.845 N/A GLU 131.A N LYS 139.A O no hydrogen 3.025 N/A MET 133.A N CYS 137.A O no hydrogen 2.952 N/A GLY 134.A N ASP 132.A OD1 no hydrogen 2.830 N/A CYS 137.A N ASN 135.A OD1 no hydrogen 3.337 N/A LYS 139.A N GLU 131.A O no hydrogen 2.970 N/A TYR 141.A N ASN 129.A O no hydrogen 3.112 N/A TYR 141.A OH GLU 131.A OE1 no hydrogen 3.359 N/A HIS 142.A ND1 LYS 143.A O no hydrogen 2.856 N/A HIS 142.A NE2 TYR 157.A OH no hydrogen 2.813 N/A LYS 143.A N GLU 165.A OE2 no hydrogen 3.103 N/A ASN 146.A N GLU 30.A OE1 no hydrogen 2.767 N/A CYS 148.A N ASP 145.A OD1 no hydrogen 2.955 N/A ILE 149.A N ASP 145.A O no hydrogen 2.933 N/A GLU 150.A N ASN 146.A O no hydrogen 2.803 N/A SER 151.A N ALA 147.A O no hydrogen 3.091 N/A SER 151.A OG CYS 148.A O no hydrogen 2.655 N/A ILE 152.A N CYS 148.A O no hydrogen 3.316 N/A ILE 152.A N ILE 149.A O no hydrogen 3.094 N/A ARG 153.A N ILE 149.A O no hydrogen 3.106 N/A ASN 154.A N GLU 150.A O no hydrogen 3.001 N/A GLY 155.A N ILE 152.A O no hydrogen 3.311 N/A THR 156.A N SER 151.A O no hydrogen 2.821 N/A THR 156.A OG1 SER 151.A O no hydrogen 3.523 N/A THR 156.A OG1 ASN 154.A OD1 no hydrogen 2.822 N/A TYR 157.A N SER 151.A O no hydrogen 3.012 N/A TYR 157.A OH HIS 142.A NE2 no hydrogen 2.813 N/A ASP 160.A N ASP 158.A OD1 no hydrogen 3.344 N/A VAL 161.A N ASP 158.A O no hydrogen 3.228 N/A TYR 162.A N HIS 159.A O no hydrogen 3.181 N/A ALA 166.A N TYR 162.A O no hydrogen 2.765 N/A LEU 167.A N ARG 163.A O no hydrogen 2.807 N/A ASN 168.A N ASP 164.A O no hydrogen 3.176 N/A ASN 169.A N GLU 165.A O no hydrogen 3.260 N/A ASN 169.A ND2 TYR 141.A O no hydrogen 2.788 N/A ARG 170.A N ALA 166.A O no hydrogen 2.928 N/A ARG 170.A NE GLU 131.A OE2 no hydrogen 2.699 N/A ARG 170.A NH1 GLU 128.A O no hydrogen 2.872 N/A ARG 170.A NH1 GLU 128.A OE2 no hydrogen 3.001 N/A ARG 170.A NH2 GLU 131.A OE2 no hydrogen 2.928 N/A PHE 171.A N LEU 167.A O no hydrogen 3.202 N/A GLN 172.A NE2 ASN 168.A O no hydrogen 3.432 N/A