Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5i3r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N VAL 10.A O no hydrogen 2.941 N/A VAL 5.A N HIS 8.A O no hydrogen 2.799 N/A ARG 7.A N ASP 72.A OD2 no hydrogen 2.839 N/A HIS 8.A N VAL 5.A O no hydrogen 3.026 N/A HIS 8.A ND1 ASP 72.A OD2 no hydrogen 2.797 N/A VAL 10.A N PHE 3.A O no hydrogen 2.869 N/A THR 11.A N ARG 28.A O no hydrogen 2.982 N/A GLU 13.A N LEU 26.A O no hydrogen 2.807 N/A SER 15.A OG GLU 18.A OE2 no hydrogen 3.445 N/A LEU 16.A N VAL 24.A O no hydrogen 2.771 N/A ALA 17.A N VAL 24.A O no hydrogen 3.415 N/A THR 23.A N ARG 39.A O no hydrogen 3.125 N/A VAL 24.A N ALA 17.A O no hydrogen 2.842 N/A PHE 25.A N LEU 37.A O no hydrogen 2.840 N/A LEU 26.A N GLU 14.A O no hydrogen 2.717 N/A VAL 27.A N CYS 35.A O no hydrogen 2.866 N/A ARG 28.A N THR 11.A O no hydrogen 3.038 N/A ARG 28.A NE GLY 32.A O no hydrogen 3.172 N/A ARG 28.A NH1 GLU 13.A OE2 no hydrogen 2.840 N/A THR 29.A N ILE 33.A O no hydrogen 3.118 N/A GLY 32.A N THR 29.A O no hydrogen 2.946 N/A ILE 33.A N THR 29.A OG1 no hydrogen 3.040 N/A CYS 35.A N VAL 27.A O no hydrogen 2.925 N/A CYS 35.A SG ILE 33.A O no hydrogen 3.916 N/A ALA 36.A N MET 89.A O no hydrogen 2.795 N/A LEU 37.A N PHE 25.A O no hydrogen 2.760 N/A LYS 38.A N ILE 87.A O no hydrogen 2.766 N/A LYS 38.A NZ GLU 54.A OE2 no hydrogen 2.792 N/A LYS 38.A NZ ASP 157.A OD2 no hydrogen 2.789 N/A ARG 39.A N THR 23.A O no hydrogen 2.806 N/A MET 40.A N VAL 85.A O no hydrogen 2.954 N/A VAL 42.A N TRP 83.A O no hydrogen 2.930 N/A ASN 44.A ND2 ASN 43.A OD1 no hydrogen 3.090 N/A ASN 44.A ND2 ASP 47.A OD2 no hydrogen 2.776 N/A ASP 47.A N ASN 44.A OD1 no hydrogen 2.835 N/A LEU 48.A N ASN 44.A O no hydrogen 3.018 N/A ASN 49.A N MET 45.A O no hydrogen 2.799 N/A VAL 50.A N PRO 46.A O no hydrogen 3.159 N/A CYS 51.A N ASP 47.A O no hydrogen 3.214 N/A CYS 51.A SG ASP 47.A O no hydrogen 3.488 N/A LYS 52.A N LEU 48.A O no hydrogen 2.888 N/A ARG 53.A N ASN 49.A O no hydrogen 2.887 N/A GLU 54.A N VAL 50.A O no hydrogen 2.894 N/A ILE 55.A N CYS 51.A O no hydrogen 3.064 N/A THR 56.A N LYS 52.A O no hydrogen 3.036 N/A THR 56.A OG1 LYS 52.A O no hydrogen 3.248 N/A ILE 57.A N ARG 53.A O no hydrogen 2.974 N/A MET 58.A N GLU 54.A O no hydrogen 2.973 N/A LYS 59.A N ILE 55.A O no hydrogen 2.861 N/A GLU 60.A N THR 56.A O no hydrogen 2.828 N/A LEU 61.A N ILE 57.A O no hydrogen 2.882 N/A SER 62.A N MET 58.A O no hydrogen 3.049 N/A HIS 64.A N LEU 61.A O no hydrogen 3.277 N/A LYS 65.A NZ ASN 66.A OD1 no hydrogen 2.843 N/A LYS 65.A NZ GLU 123.A OE2 no hydrogen 2.715 N/A ASN 66.A N HIS 64.A ND1 no hydrogen 2.940 N/A ASN 66.A ND2 TYR 153.A O no hydrogen 2.926 N/A ILE 67.A N HIS 64.A O no hydrogen 3.121 N/A VAL 68.A N LEU 155.A O no hydrogen 3.031 N/A GLY 69.A N GLU 90.A OE1 no hydrogen 3.013 N/A TYR 70.A N SER 62.A OG no hydrogen 3.075 N/A LEU 71.A N LEU 88.A O no hydrogen 2.818 N/A ASP 72.A N LEU 88.A O no hydrogen 3.220 N/A CYS 73.A N ASP 72.A OD1 no hydrogen 3.291 N/A CYS 73.A SG TYR 70.A OH no hydrogen 3.140 N/A ALA 74.A N LEU 86.A O no hydrogen 2.904 N/A ASN 76.A N GLU 84.A O no hydrogen 2.936 N/A ASN 76.A ND2 GLU 84.A OE1 no hydrogen 2.915 N/A ILE 78.A N VAL 82.A O no hydrogen 2.876 N/A SER 79.A N VAL 82.A O no hydrogen 3.418 N/A TRP 83.A N VAL 42.A O no hydrogen 2.796 N/A GLU 84.A N ASN 76.A O no hydrogen 2.791 N/A VAL 85.A N MET 40.A O no hydrogen 2.771 N/A LEU 86.A N ALA 74.A O no hydrogen 2.803 N/A ILE 87.A N LYS 38.A O no hydrogen 2.894 N/A LEU 88.A N ASP 72.A O no hydrogen 2.685 N/A MET 89.A N ALA 36.A O no hydrogen 2.860 N/A GLU 90.A N GLY 69.A O no hydrogen 2.889 N/A ARG 93.A N ASP 149.A OD1 no hydrogen 2.981 N/A GLY 95.A N CYS 92.A O no hydrogen 3.010 N/A GLN 96.A NE2 GLU 143.A O no hydrogen 3.104 N/A VAL 97.A N ILE 145.A O no hydrogen 2.808 N/A ASN 99.A N GLN 96.A O no hydrogen 3.154 N/A ASN 99.A ND2 ALA 94.A O no hydrogen 3.362 N/A GLN 100.A N GLN 96.A O no hydrogen 3.138 N/A MET 101.A N VAL 97.A O no hydrogen 2.873 N/A ASN 102.A N VAL 98.A O no hydrogen 3.034 N/A LYS 104.A N MET 101.A O no hydrogen 2.904 N/A GLY 108.A N LYS 104.A O no hydrogen 2.806 N/A THR 110.A N GLU 113.A OE1 no hydrogen 3.047 N/A GLU 113.A N THR 110.A OG1 no hydrogen 3.227 N/A VAL 114.A N THR 110.A O no hydrogen 2.957 N/A LEU 115.A N GLU 111.A O no hydrogen 2.988 N/A GLN 116.A N PRO 112.A O no hydrogen 3.002 N/A ILE 117.A N GLU 113.A O no hydrogen 3.027 N/A PHE 118.A N VAL 114.A O no hydrogen 2.929 N/A CYS 119.A N LEU 115.A O no hydrogen 2.907 N/A CYS 119.A SG LEU 115.A O no hydrogen 3.287 N/A ASP 120.A N GLN 116.A O no hydrogen 3.249 N/A THR 121.A N ILE 117.A O no hydrogen 3.092 N/A THR 121.A OG1 ILE 117.A O no hydrogen 2.790 N/A CYS 122.A N PHE 118.A O no hydrogen 2.924 N/A CYS 122.A SG PHE 118.A O no hydrogen 3.472 N/A GLU 123.A N CYS 119.A O no hydrogen 3.132 N/A ALA 124.A N ASP 120.A O no hydrogen 3.177 N/A VAL 125.A N THR 121.A O no hydrogen 2.858 N/A ALA 126.A N CYS 122.A O no hydrogen 2.825 N/A ARG 127.A N GLU 123.A O no hydrogen 3.074 N/A ARG 127.A NH1 ARG 127.A O no hydrogen 3.140 N/A LEU 128.A N VAL 125.A O no hydrogen 2.974 N/A HIS 129.A N VAL 125.A O no hydrogen 2.837 N/A HIS 129.A NE2 ASP 207.A OD2 no hydrogen 2.890 N/A GLN 130.A N ALA 126.A O no hydrogen 2.973 N/A GLN 130.A NE2 SER 285.A O no hydrogen 2.835 N/A CYS 131.A N LEU 128.A O no hydrogen 3.415 N/A CYS 131.A SG ARG 127.A O no hydrogen 3.339 N/A CYS 131.A SG LEU 128.A O no hydrogen 3.593 N/A ILE 135.A N LEU 128.A O no hydrogen 3.286 N/A ILE 136.A N THR 162.A O no hydrogen 2.784 N/A HIS 137.A N ASP 207.A OD2 no hydrogen 2.763 N/A HIS 137.A NE2 ASP 157.A O no hydrogen 2.770 N/A ARG 138.A N ASP 207.A OD1 no hydrogen 3.048 N/A ARG 138.A NE SER 160.A O no hydrogen 2.789 N/A ARG 138.A NH2 SER 160.A O no hydrogen 2.906 N/A ASP 139.A N HIS 137.A ND1 no hydrogen 3.017 N/A LYS 141.A NZ ASP 139.A OD2 no hydrogen 3.350 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.776 N/A ASN 144.A N LYS 141.A O no hydrogen 3.162 N/A ASN 144.A ND2 ASP 139.A O no hydrogen 2.733 N/A LEU 146.A N VAL 154.A O no hydrogen 2.801 N/A LEU 147.A N GLY 95.A O no hydrogen 2.991 N/A ASN 148.A N ASN 152.A O no hydrogen 2.899 N/A GLY 151.A N ASN 148.A O no hydrogen 3.037 N/A ASN 152.A N ASN 148.A OD1 no hydrogen 2.891 N/A TYR 153.A N ASP 120.A OD2 no hydrogen 2.791 N/A VAL 154.A N LEU 146.A O no hydrogen 2.768 N/A LEU 155.A N ASN 66.A O no hydrogen 3.030 N/A CYS 156.A N ASN 144.A O no hydrogen 3.017 N/A CYS 156.A SG ASN 144.A O no hydrogen 3.636 N/A GLY 159.A N ASP 157.A OD1 no hydrogen 3.143 N/A SER 160.A OG TYR 183.A O no hydrogen 2.789 N/A ALA 161.A N PHE 158.A O no hydrogen 3.223 N/A THR 162.A N ILE 136.A O no hydrogen 2.848 N/A LYS 164.A N THR 162.A OG1 no hydrogen 3.161 N/A ASN 167.A N ASP 171.A OD2 no hydrogen 3.094 N/A GLN 169.A N ASN 167.A OD1 no hydrogen 3.409 N/A LYS 170.A N ASN 167.A O no hydrogen 3.087 N/A ASP 171.A N ASN 167.A O no hydrogen 2.728 N/A GLY 172.A N PRO 168.A O no hydrogen 2.911 N/A VAL 176.A N GLY 172.A O no hydrogen 3.132 N/A GLU 177.A N VAL 173.A O no hydrogen 2.806 N/A GLU 178.A N ASN 174.A O no hydrogen 3.117 N/A GLU 179.A N VAL 175.A O no hydrogen 3.214 N/A ILE 180.A N VAL 176.A O no hydrogen 3.032 N/A LYS 181.A N GLU 177.A O no hydrogen 3.003 N/A LYS 181.A NZ GLU 178.A OE2 no hydrogen 3.271 N/A LYS 182.A N GLU 178.A O no hydrogen 3.153 N/A LYS 182.A NZ ASP 47.A OD1 no hydrogen 2.807 N/A LYS 182.A NZ TYR 183.A OH no hydrogen 3.312 N/A TYR 183.A N GLU 179.A O no hydrogen 3.056 N/A THR 184.A N ILE 180.A O no hydrogen 2.901 N/A THR 184.A OG1 ILE 180.A O no hydrogen 2.444 N/A THR 185.A OG1 ASP 139.A OD1 no hydrogen 2.909 N/A SER 187.A OG GLY 226.A O no hydrogen 3.025 N/A TYR 188.A N THR 185.A O no hydrogen 2.921 N/A ARG 189.A N LEU 186.A O no hydrogen 3.131 N/A ARG 189.A NE THR 184.A OG1 no hydrogen 2.927 N/A ARG 189.A NH2 THR 184.A O no hydrogen 2.943 N/A GLU 192.A N GLU 192.A OE2 no hydrogen 2.805 N/A MET 193.A N ALA 190.A O no hydrogen 2.808 N/A ILE 194.A N PRO 191.A O no hydrogen 3.091 N/A ASN 195.A N PRO 191.A O no hydrogen 2.869 N/A ILE 202.A N LEU 166.A O no hydrogen 2.767 N/A LYS 205.A N THR 203.A OG1 no hydrogen 3.330 N/A LYS 205.A NZ PRO 261.A O no hydrogen 3.292 N/A LYS 205.A NZ ARG 264.A O no hydrogen 2.774 N/A ALA 206.A N THR 203.A O no hydrogen 3.081 N/A ASP 207.A N THR 204.A O no hydrogen 3.079 N/A TRP 209.A N LYS 205.A O no hydrogen 3.326 N/A ALA 210.A N ALA 206.A O no hydrogen 3.273 N/A LEU 211.A N ASP 207.A O no hydrogen 2.802 N/A GLY 212.A N ILE 208.A O no hydrogen 3.042 N/A CYS 213.A N TRP 209.A O no hydrogen 3.039 N/A CYS 213.A SG SER 187.A O no hydrogen 3.687 N/A CYS 213.A SG TRP 209.A O no hydrogen 3.549 N/A LEU 214.A N ALA 210.A O no hydrogen 2.864 N/A LEU 215.A N LEU 211.A O no hydrogen 2.923 N/A TYR 216.A N GLY 212.A O no hydrogen 3.221 N/A TYR 216.A OH THR 238.A O no hydrogen 2.869 N/A LYS 217.A N CYS 213.A O no hydrogen 2.947 N/A LEU 218.A N LEU 214.A O no hydrogen 2.818 N/A CYS 219.A N LEU 215.A O no hydrogen 3.058 N/A CYS 219.A SG LEU 215.A O no hydrogen 3.373 N/A PHE 220.A N TYR 216.A O no hydrogen 2.809 N/A PHE 221.A N LYS 217.A O no hydrogen 2.804 N/A SER 228.A N PHE 225.A O no hydrogen 3.159 N/A GLN 229.A N GLN 229.A OE1 no hydrogen 3.080 N/A ALA 231.A N SER 228.A OG no hydrogen 3.246 N/A ILE 232.A N SER 228.A O no hydrogen 3.118 N/A CYS 233.A N GLN 229.A O no hydrogen 2.988 N/A CYS 233.A SG GLN 229.A O no hydrogen 3.270 N/A ASP 234.A N VAL 230.A O no hydrogen 3.062 N/A GLY 235.A N ILE 232.A O no hydrogen 2.889 N/A ASN 236.A N ALA 231.A O no hydrogen 2.950 N/A ILE 239.A N MET 300.A O no hydrogen 2.874 N/A SER 243.A OG HIS 250.A NE2 no hydrogen 2.728 N/A ARG 244.A NH2 THR 107.A O no hydrogen 2.922 N/A ARG 244.A NH2 THR 107.A OG1 no hydrogen 3.191 N/A TYR 245.A N SER 243.A OG no hydrogen 3.196 N/A TYR 245.A OH PHE 109.A O no hydrogen 2.728 N/A TYR 245.A OH CYS 219.A O no hydrogen 3.165 N/A SER 246.A N GLU 111.A OE1 no hydrogen 2.940 N/A SER 246.A OG GLU 111.A OE1 no hydrogen 3.034 N/A ARG 247.A NH2 GLU 298.A OE1 no hydrogen 3.185 N/A ILE 249.A N SER 246.A O no hydrogen 3.251 N/A ILE 249.A N SER 246.A OG no hydrogen 3.417 N/A HIS 250.A N SER 246.A O no hydrogen 3.404 N/A HIS 250.A NE2 SER 243.A OG no hydrogen 2.728 N/A CYS 251.A N ARG 247.A O no hydrogen 2.946 N/A CYS 251.A SG ARG 247.A O no hydrogen 3.328 N/A LEU 252.A N ASN 248.A O no hydrogen 3.049 N/A ILE 253.A N ILE 249.A O no hydrogen 3.007 N/A ARG 254.A N HIS 250.A O no hydrogen 3.162 N/A ARG 254.A NH1 ARG 254.A O no hydrogen 2.806 N/A ARG 254.A NH1 GLU 258.A OE1 no hydrogen 2.886 N/A PHE 255.A N CYS 251.A O no hydrogen 2.820 N/A MET 256.A N LEU 252.A O no hydrogen 3.340 N/A LEU 257.A N ILE 253.A O no hydrogen 3.045 N/A GLU 262.A N ASP 260.A OD1 no hydrogen 3.266 N/A HIS 263.A N ASP 260.A O no hydrogen 3.067 N/A ARG 264.A N ASP 260.A O no hydrogen 3.065 N/A ARG 264.A N PRO 261.A O no hydrogen 3.211 N/A ARG 264.A NE GLU 258.A O no hydrogen 2.781 N/A ARG 264.A NH1 GLU 192.A OE1 no hydrogen 2.811 N/A ARG 264.A NH1 GLU 192.A OE2 no hydrogen 3.503 N/A ARG 264.A NH1 LYS 205.A O no hydrogen 2.841 N/A ARG 264.A NH2 GLU 192.A OE2 no hydrogen 2.889 N/A ARG 264.A NH2 GLU 258.A O no hydrogen 3.062 N/A ARG 264.A NH2 PRO 259.A O no hydrogen 3.011 N/A ASP 266.A N GLN 269.A OE1 no hydrogen 2.955 N/A GLN 269.A N ASP 266.A OD1 no hydrogen 3.104 N/A GLN 269.A NE2 SER 291.A O no hydrogen 2.767 N/A VAL 270.A N ASP 266.A O no hydrogen 3.074 N/A SER 271.A N ILE 267.A O no hydrogen 3.009 N/A SER 271.A OG ILE 267.A O no hydrogen 2.659 N/A TYR 272.A N PHE 268.A O no hydrogen 2.823 N/A ALA 274.A N VAL 270.A O no hydrogen 3.043 N/A PHE 275.A N SER 271.A O no hydrogen 2.901 N/A LYS 276.A N TYR 272.A O no hydrogen 3.071 N/A PHE 277.A N PHE 273.A O no hydrogen 2.930 N/A ALA 278.A N ALA 274.A O no hydrogen 3.278 N/A ALA 278.A N PHE 275.A O no hydrogen 3.063 N/A ALA 279.A N LYS 276.A O no hydrogen 2.994 N/A ALA 280.A N PHE 275.A O no hydrogen 3.058 N/A CYS 282.A SG VAL 284.A O no hydrogen 3.722 N/A ASN 286.A ND2 SER 290.A O no hydrogen 2.828 N/A ASN 288.A ND2 ASP 266.A OD2 no hydrogen 3.371 N/A ASN 289.A N ASN 286.A O no hydrogen 2.978 N/A SER 290.A N ASN 286.A OD1 no hydrogen 2.741 N/A SER 290.A OG ASP 266.A OD2 no hydrogen 2.846 N/A ALA 302.A N ILE 239.A O no hydrogen 2.727 N/A