Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bxy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A NE2 GLN 6.A O no hydrogen 3.200 N/A LEU 8.A N GLY 4.A O no hydrogen 2.856 N/A GLN 9.A N SER 5.A O no hydrogen 2.949 N/A GLN 9.A NE2 GLU 13.A OE2 no hydrogen 2.947 N/A ASN 10.A N GLN 6.A O no hydrogen 3.015 N/A ASN 10.A ND2 GLN 6.A O no hydrogen 3.138 N/A ILE 11.A N GLN 7.A O no hydrogen 2.934 N/A ILE 12.A N LEU 8.A O no hydrogen 2.922 N/A GLU 13.A N GLN 9.A O no hydrogen 2.809 N/A THR 14.A N ASN 10.A O no hydrogen 2.860 N/A THR 14.A OG1 ASN 10.A O no hydrogen 2.932 N/A ALA 15.A N ILE 11.A O no hydrogen 2.986 N/A PHE 16.A N ILE 12.A O no hydrogen 2.810 N/A GLU 17.A N GLU 13.A O no hydrogen 3.203 N/A ARG 18.A N ALA 15.A O no hydrogen 3.095 N/A ARG 19.A N PHE 16.A O no hydrogen 3.194 N/A ARG 19.A NH2 PHE 16.A O no hydrogen 2.872 N/A GLU 21.A N ARG 18.A O no hydrogen 3.107 N/A ILE 22.A N ARG 19.A O no hydrogen 3.139 N/A THR 23.A N ASN 26.A OD1 no hydrogen 2.910 N/A ASN 26.A N THR 23.A O no hydrogen 3.255 N/A ASN 26.A N THR 23.A OG1 no hydrogen 3.103 N/A ASN 26.A ND2 GLU 21.A O no hydrogen 2.882 N/A ALA 27.A N THR 23.A O no hydrogen 3.027 N/A THR 31.A N ASP 28.A OD2 no hydrogen 2.830 N/A THR 31.A OG1 ASP 28.A OD1 no hydrogen 2.541 N/A THR 31.A OG1 ASP 28.A OD2 no hydrogen 3.268 N/A ARG 32.A N ASP 28.A O no hydrogen 3.015 N/A ARG 32.A NH1 ILE 73.A O no hydrogen 3.065 N/A ARG 32.A NH2 ILE 73.A O no hydrogen 3.563 N/A ARG 32.A NH2 ASN 74.A OD1 no hydrogen 3.203 N/A GLU 33.A N THR 29.A O no hydrogen 2.933 N/A ALA 34.A N VAL 30.A O no hydrogen 2.925 N/A VAL 35.A N THR 31.A O no hydrogen 2.903 N/A ASN 36.A N ARG 32.A O no hydrogen 2.845 N/A GLN 37.A N GLU 33.A O no hydrogen 2.946 N/A VAL 38.A N ALA 34.A O no hydrogen 3.026 N/A ILE 39.A N VAL 35.A O no hydrogen 3.058 N/A ALA 40.A N ASN 36.A O no hydrogen 3.039 N/A LEU 41.A N GLN 37.A O no hydrogen 2.933 N/A LEU 42.A N VAL 38.A O no hydrogen 2.912 N/A ASP 43.A N ILE 39.A O no hydrogen 2.840 N/A SER 44.A N ALA 40.A O no hydrogen 3.042 N/A SER 44.A OG ALA 40.A O no hydrogen 3.381 N/A SER 44.A OG LEU 41.A O no hydrogen 3.275 N/A GLY 45.A N LEU 42.A O no hydrogen 3.192 N/A LEU 47.A N LEU 41.A O no hydrogen 3.028 N/A ARG 48.A NE ALA 50.A O no hydrogen 2.931 N/A ARG 48.A NE GLN 155.A OE1 no hydrogen 3.110 N/A ARG 48.A NH2 GLN 155.A OE1 no hydrogen 2.830 N/A GLU 51.A N VAL 58.A O no hydrogen 2.998 N/A LYS 52.A NZ GLU 183.A OE2 no hydrogen 2.844 N/A ILE 53.A N GLN 56.A O no hydrogen 2.509 N/A GLN 56.A N ILE 53.A O no hydrogen 2.548 N/A TRP 57.A NE1 GLU 183.A OE2 no hydrogen 2.755 N/A VAL 58.A N GLU 51.A O no hydrogen 2.758 N/A HIS 60.A N VAL 49.A O no hydrogen 2.727 N/A HIS 60.A NE2 GLU 51.A OE2 no hydrogen 2.628 N/A LEU 63.A N HIS 60.A O no hydrogen 3.027 N/A LYS 64.A NZ LEU 172.A O no hydrogen 3.512 N/A LYS 64.A NZ PRO 174.A O no hydrogen 2.994 N/A LYS 64.A NZ LEU 175.A O no hydrogen 2.842 N/A LYS 64.A NZ ALA 177.A O no hydrogen 2.637 N/A LYS 65.A N GLN 61.A O no hydrogen 2.937 N/A ALA 66.A N TRP 62.A O no hydrogen 2.978 N/A VAL 67.A N LEU 63.A O no hydrogen 3.093 N/A LEU 68.A N LYS 64.A O no hydrogen 2.903 N/A LEU 69.A N LYS 65.A O no hydrogen 2.828 N/A SER 70.A N ALA 66.A O no hydrogen 2.951 N/A SER 70.A OG VAL 67.A O no hydrogen 2.579 N/A PHE 71.A N VAL 67.A O no hydrogen 3.317 N/A ARG 72.A N LEU 68.A O no hydrogen 3.202 N/A ILE 73.A N LEU 69.A O no hydrogen 2.926 N/A ASN 74.A ND2 SER 70.A O no hydrogen 2.804 N/A GLN 77.A N ASP 88.A O no hydrogen 2.970 N/A ILE 79.A N TYR 86.A O no hydrogen 2.884 N/A GLU 83.A N GLU 83.A OE1 no hydrogen 2.640 N/A ARG 85.A NE GLU 80.A OE1 no hydrogen 3.343 N/A TYR 86.A N ILE 79.A O no hydrogen 2.925 N/A ASP 88.A N GLN 77.A O no hydrogen 3.169 N/A LYS 89.A NZ PHE 71.A O no hydrogen 2.866 N/A LYS 89.A NZ ASN 74.A O no hydrogen 2.915 N/A LYS 93.A N VAL 115.A O no hydrogen 2.806 N/A LYS 93.A NZ ASP 43.A OD2 no hydrogen 2.906 N/A LYS 93.A NZ ALA 119.A O no hydrogen 2.798 N/A TYR 97.A N PHE 94.A O no hydrogen 3.033 N/A TYR 97.A OH GLU 105.A OE1 no hydrogen 2.641 N/A ARG 101.A N ASP 98.A OD1 no hydrogen 2.975 N/A ARG 101.A NE GLU 105.A OE2 no hydrogen 2.961 N/A PHE 102.A N ASP 98.A O no hydrogen 3.078 N/A GLN 103.A N GLU 99.A O no hydrogen 2.862 N/A LYS 104.A N ALA 100.A O no hydrogen 2.894 N/A GLU 105.A N ARG 101.A O no hydrogen 2.902 N/A GLY 106.A N PHE 102.A O no hydrogen 3.009 N/A ARG 108.A N THR 125.A O no hydrogen 2.922 N/A VAL 110.A N LEU 127.A O no hydrogen 2.822 N/A ALA 113.A N VAL 110.A O no hydrogen 2.898 N/A ALA 114.A N SER 130.A O no hydrogen 3.018 N/A ARG 116.A N VAL 132.A O no hydrogen 3.152 N/A ARG 116.A NH1 ASN 133.A OD1 no hydrogen 3.042 N/A ARG 116.A NH2 ASP 88.A OD2 no hydrogen 2.901 N/A GLN 117.A N PRO 91.A O no hydrogen 2.944 N/A GLY 118.A N ASP 43.A OD1 no hydrogen 2.834 N/A PHE 120.A N ALA 136.A O no hydrogen 2.941 N/A ALA 122.A N VAL 138.A O no hydrogen 2.856 N/A ARG 123.A NH1 LYS 104.A O no hydrogen 3.177 N/A ASN 124.A N GLY 106.A O no hydrogen 2.715 N/A VAL 126.A N THR 142.A O no hydrogen 2.959 N/A LEU 127.A N ARG 108.A O no hydrogen 2.913 N/A MET 128.A N VAL 144.A O no hydrogen 2.847 N/A SER 130.A OG MET 128.A O no hydrogen 2.714 N/A TYR 131.A N ALA 148.A O no hydrogen 3.120 N/A VAL 132.A N ALA 114.A O no hydrogen 3.094 N/A ASN 133.A N VAL 150.A O no hydrogen 2.865 N/A ILE 134.A N ASN 133.A OD1 no hydrogen 2.754 N/A GLY 135.A N GLY 118.A O no hydrogen 2.809 N/A ALA 136.A N ASN 133.A O no hydrogen 3.315 N/A TYR 137.A N ALA 154.A O no hydrogen 2.854 N/A VAL 138.A N PHE 120.A O no hydrogen 2.857 N/A ASP 139.A N ILE 156.A O no hydrogen 2.907 N/A GLU 140.A N ASP 139.A OD1 no hydrogen 2.696 N/A GLY 141.A N ARG 123.A O no hydrogen 3.214 N/A THR 142.A OG1 ASP 139.A O no hydrogen 3.558 N/A THR 142.A OG1 GLY 157.A O no hydrogen 2.760 N/A MET 143.A N VAL 160.A O no hydrogen 2.894 N/A VAL 144.A N VAL 126.A O no hydrogen 2.981 N/A ASP 145.A N LEU 162.A O no hydrogen 2.878 N/A THR 146.A N ASP 145.A OD1 no hydrogen 3.013 N/A TRP 147.A N PRO 129.A O no hydrogen 2.595 N/A ALA 148.A N ASP 145.A O no hydrogen 3.070 N/A THR 149.A N VAL 166.A O no hydrogen 2.851 N/A VAL 150.A N TYR 131.A O no hydrogen 2.874 N/A GLY 151.A N ILE 168.A O no hydrogen 2.771 N/A SER 152.A OG ILE 134.A O no hydrogen 2.808 N/A CYS 153.A N ILE 134.A O no hydrogen 3.261 N/A CYS 153.A SG SER 152.A OG no hydrogen 3.663 N/A CYS 153.A SG VAL 171.A O no hydrogen 3.690 N/A ALA 154.A N GLY 151.A O no hydrogen 3.185 N/A GLN 155.A N THR 180.A O no hydrogen 3.067 N/A GLN 155.A NE2 CYS 153.A O no hydrogen 2.922 N/A ILE 156.A N TYR 137.A O no hydrogen 2.764 N/A GLY 157.A N ILE 182.A O no hydrogen 2.745 N/A LYS 158.A N ASP 184.A OD1 no hydrogen 2.808 N/A LYS 158.A NZ ASP 139.A OD1 no hydrogen 3.551 N/A LYS 158.A NZ ASP 139.A OD2 no hydrogen 2.835 N/A ASN 159.A N GLU 140.A O no hydrogen 2.884 N/A VAL 160.A N THR 142.A OG1 no hydrogen 2.988 N/A HIS 161.A N CYS 186.A O no hydrogen 2.977 N/A HIS 161.A NE2 ASP 145.A OD2 no hydrogen 3.294 N/A LEU 162.A N MET 143.A O no hydrogen 2.812 N/A SER 163.A N ILE 188.A O no hydrogen 2.998 N/A SER 163.A OG ILE 188.A O no hydrogen 2.702 N/A GLY 165.A N THR 146.A O no hydrogen 2.861 N/A VAL 166.A N SER 163.A O no hydrogen 3.247 N/A GLY 167.A N SER 192.A O no hydrogen 3.075 N/A ILE 168.A N THR 149.A O no hydrogen 2.822 N/A GLY 169.A N VAL 194.A O no hydrogen 2.725 N/A VAL 171.A N SER 152.A O no hydrogen 3.046 N/A GLN 176.A N GLN 176.A OE1 no hydrogen 2.758 N/A ALA 177.A N PRO 174.A O no hydrogen 3.305 N/A THR 180.A OG1 GLY 169.A O no hydrogen 2.765 N/A ILE 181.A N VAL 198.A O no hydrogen 3.129 N/A ILE 182.A N GLN 155.A O no hydrogen 2.973 N/A GLU 183.A N VAL 200.A O no hydrogen 2.888 N/A ASN 185.A N LYS 158.A O no hydrogen 2.896 N/A CYS 186.A SG GLU 183.A O no hydrogen 3.401 N/A CYS 186.A SG ASP 184.A O no hydrogen 3.903 N/A CYS 186.A SG VAL 200.A O no hydrogen 3.902 N/A CYS 186.A SG GLU 201.A O no hydrogen 3.190 N/A PHE 187.A N SER 204.A O no hydrogen 2.987 N/A ILE 188.A N HIS 161.A O no hydrogen 2.903 N/A GLY 189.A N ILE 206.A O no hydrogen 2.677 N/A ARG 191.A N GLY 164.A O no hydrogen 2.943 N/A SER 192.A N GLY 189.A O no hydrogen 3.311 N/A SER 192.A OG GLY 189.A O no hydrogen 3.163 N/A SER 192.A OG SER 207.A O no hydrogen 2.789 N/A GLU 193.A N VAL 210.A O no hydrogen 2.963 N/A VAL 194.A N GLY 167.A O no hydrogen 2.986 N/A VAL 195.A N ILE 212.A O no hydrogen 2.969 N/A GLY 197.A N THR 180.A OG1 no hydrogen 3.119 N/A VAL 198.A N VAL 195.A O no hydrogen 3.173 N/A ILE 199.A N GLY 229.A O no hydrogen 3.016 N/A VAL 200.A N ILE 181.A O no hydrogen 2.877 N/A GLU 201.A N VAL 231.A O no hydrogen 2.912 N/A GLU 202.A N GLU 183.A OE1 no hydrogen 2.962 N/A GLY 203.A N ASP 184.A O no hydrogen 3.052 N/A SER 204.A OG GLU 201.A O no hydrogen 2.711 N/A SER 204.A OG PRO 232.A O no hydrogen 3.355 N/A VAL 205.A N SER 235.A O no hydrogen 2.860 N/A ILE 206.A N PHE 187.A O no hydrogen 2.840 N/A SER 207.A N VAL 237.A O no hydrogen 2.912 N/A SER 207.A OG MET 208.A O no hydrogen 3.532 N/A SER 207.A OG VAL 237.A O no hydrogen 3.420 N/A GLY 209.A N ALA 190.A O no hydrogen 2.987 N/A VAL 210.A N SER 192.A OG no hydrogen 2.919 N/A TYR 211.A N TYR 252.A OH no hydrogen 2.905 N/A ILE 212.A N GLU 193.A O no hydrogen 2.901 N/A GLY 213.A N THR 216.A OG1 no hydrogen 2.967 N/A GLN 214.A N GLU 196.A OE1 no hydrogen 2.945 N/A THR 216.A N GLY 213.A O no hydrogen 3.164 N/A THR 216.A OG1 TYR 211.A O no hydrogen 3.427 N/A THR 216.A OG1 GLY 213.A O no hydrogen 3.475 N/A ILE 218.A N HIS 227.A O no hydrogen 2.911 N/A TYR 219.A N ALA 254.A O no hydrogen 2.814 N/A ASP 220.A N ASP 225.A O no hydrogen 2.830 N/A ARG 221.A NH2 VAL 257.A O no hydrogen 3.051 N/A GLU 222.A N ASP 220.A OD1 no hydrogen 3.171 N/A THR 223.A N ASP 220.A O no hydrogen 3.264 N/A GLY 224.A N ASP 220.A O no hydrogen 2.732 N/A ASP 225.A N THR 223.A OG1 no hydrogen 3.029 N/A HIS 227.A N ILE 218.A O no hydrogen 2.812 N/A ARG 230.A NH1 GLU 201.A OE1 no hydrogen 3.051 N/A ARG 230.A NH1 GLU 201.A OE2 no hydrogen 3.200 N/A VAL 231.A N ILE 199.A O no hydrogen 2.897 N/A ALA 233.A N GLU 201.A OE1 no hydrogen 2.978 N/A GLY 234.A N GLU 202.A O no hydrogen 2.998 N/A SER 235.A N PRO 232.A O no hydrogen 3.199 N/A SER 235.A OG PRO 232.A O no hydrogen 2.648 N/A VAL 236.A N LYS 258.A O no hydrogen 2.788 N/A VAL 237.A N VAL 205.A O no hydrogen 2.801 N/A VAL 238.A N VAL 255.A O no hydrogen 2.944 N/A SER 239.A OG GLY 209.A O no hydrogen 2.655 N/A SER 239.A OG TYR 252.A OH no hydrogen 2.676 N/A GLY 240.A N CYS 253.A O no hydrogen 3.028 N/A ASN 241.A ND2 GLY 240.A O no hydrogen 2.707 N/A LEU 242.A N LEU 251.A O no hydrogen 2.932 N/A SER 244.A N TYR 249.A O no hydrogen 2.924 N/A SER 244.A OG ASP 246.A OD1 no hydrogen 2.444 N/A SER 244.A OG TYR 249.A O no hydrogen 3.130 N/A GLY 247.A N SER 244.A O no hydrogen 3.168 N/A GLY 247.A N SER 244.A OG no hydrogen 3.136 N/A LYS 248.A N ASP 246.A OD1 no hydrogen 2.852 N/A SER 250.A OG ASN 241.A OD1 no hydrogen 2.673 N/A LEU 251.A N LEU 242.A O no hydrogen 3.028 N/A TYR 252.A OH GLY 209.A O no hydrogen 3.401 N/A TYR 252.A OH SER 239.A OG no hydrogen 2.676 N/A CYS 253.A N GLY 240.A O no hydrogen 3.110 N/A CYS 253.A SG ALA 254.A O no hydrogen 3.658 N/A ALA 254.A N ARG 217.A O no hydrogen 2.926 N/A VAL 255.A N VAL 238.A O no hydrogen 2.833 N/A ILE 256.A N TYR 219.A O no hydrogen 2.797 N/A VAL 257.A N VAL 236.A O no hydrogen 2.870 N/A LYS 259.A NZ ASP 220.A OD1 no hydrogen 3.430 N/A LYS 259.A NZ ASP 220.A OD2 no hydrogen 2.692 N/A LYS 259.A NZ GLU 222.A OE2 no hydrogen 2.800 N/A VAL 260.A N GLY 234.A O no hydrogen 2.748 N/A THR 264.A N ASP 261.A O no hydrogen 3.050 N/A ARG 265.A NH1 VAL 260.A O no hydrogen 2.898 N/A LEU 270.A N GLY 266.A O no hydrogen 2.884 N/A LEU 271.A N ILE 267.A O no hydrogen 3.241 N/A ARG 272.A N ASN 268.A O no hydrogen 2.980 N/A THR 273.A N LEU 270.A O no hydrogen 3.236 N/A THR 273.A OG1 GLU 269.A O no hydrogen 2.865 N/A