Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ex4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N TYR 252.A OH no hydrogen 2.946 N/A GLY 6.A N GLN 26.A OE1 no hydrogen 3.069 N/A ALA 7.A N SER 4.A OG no hydrogen 3.082 N/A ARG 8.A N SER 4.A O no hydrogen 2.877 N/A ARG 8.A NE PRO 188.A O no hydrogen 2.874 N/A ARG 8.A NH1 ASP 223.A OD1 no hydrogen 2.827 N/A ARG 8.A NH2 PRO 188.A O no hydrogen 3.179 N/A ARG 8.A NH2 ASP 223.A OD2 no hydrogen 3.024 N/A ALA 9.A N PHE 5.A O no hydrogen 2.988 N/A GLU 10.A N ALA 7.A O no hydrogen 2.995 N/A LEU 11.A N ARG 8.A O no hydrogen 3.096 N/A ILE 14.A N LEU 11.A O no hydrogen 3.039 N/A VAL 17.A N HIS 15.A ND1 no hydrogen 3.009 N/A SER 19.A N HIS 15.A O no hydrogen 2.883 N/A SER 19.A OG ALA 9.A O no hydrogen 2.712 N/A LYS 20.A N PRO 16.A O no hydrogen 3.047 N/A LEU 21.A N VAL 17.A O no hydrogen 3.062 N/A LEU 22.A N ALA 18.A O no hydrogen 2.844 N/A ARG 23.A N SER 19.A O no hydrogen 2.932 N/A LEU 24.A N LYS 20.A O no hydrogen 3.134 N/A MET 25.A N LEU 21.A O no hydrogen 2.904 N/A GLN 26.A N LEU 22.A O no hydrogen 3.101 N/A LYS 27.A N ARG 23.A O no hydrogen 2.944 N/A LYS 27.A NZ GLU 84.A OE1 no hydrogen 2.664 N/A LYS 28.A N LEU 24.A O no hydrogen 2.956 N/A LYS 28.A NZ GLY 52.A O no hydrogen 2.818 N/A LYS 28.A NZ ILE 55.A O no hydrogen 2.737 N/A LYS 28.A NZ HIS 83.A O no hydrogen 2.783 N/A LYS 28.A NZ GLU 84.A O no hydrogen 2.804 N/A THR 30.A N MET 25.A O no hydrogen 3.116 N/A THR 30.A OG1 SER 54.A O no hydrogen 2.723 N/A ASN 31.A ND2 ASP 223.A O no hydrogen 2.894 N/A ASN 31.A ND2 ALA 248.A O no hydrogen 3.163 N/A LEU 32.A N THR 30.A OG1 no hydrogen 3.153 N/A CYS 33.A N ILE 225.A O no hydrogen 2.782 N/A CYS 33.A SG LEU 34.A O no hydrogen 3.966 N/A CYS 33.A SG MET 57.A O no hydrogen 3.891 N/A LEU 34.A N MET 57.A O no hydrogen 3.044 N/A SER 35.A N VAL 227.A O no hydrogen 2.861 N/A SER 35.A OG ASP 37.A OD1 no hydrogen 3.295 N/A SER 35.A OG ASP 37.A OD2 no hydrogen 2.809 N/A ALA 36.A N LYS 59.A O no hydrogen 2.969 N/A ASP 37.A N SER 35.A O no hydrogen 2.899 N/A VAL 38.A N ALA 36.A O no hydrogen 2.938 N/A ALA 41.A N ASP 67.A OD1 no hydrogen 2.855 N/A ARG 42.A NH1.B GLN 46.A OE1 no hydrogen 3.289 N/A LEU 44.A N LEU 40.A O no hydrogen 2.993 N/A LEU 45.A N ALA 41.A O no hydrogen 2.926 N/A GLN 46.A N ARG 42.A O no hydrogen 2.915 N/A LEU 47.A N GLU 43.A O no hydrogen 2.888 N/A ALA 48.A N LEU 44.A O no hydrogen 2.892 N/A ASP 49.A N LEU 45.A O no hydrogen 2.957 N/A ALA 50.A N GLN 46.A O no hydrogen 3.075 N/A LEU 51.A N LEU 47.A O no hydrogen 2.848 N/A SER 54.A N LEU 51.A O no hydrogen 2.842 N/A SER 54.A OG GLU 242.A OE2 no hydrogen 2.642 N/A ILE 55.A N GLY 52.A O no hydrogen 3.344 N/A CYS 56.A N LEU 32.A O no hydrogen 2.837 N/A CYS 56.A SG LEU 32.A O no hydrogen 3.526 N/A LEU 58.A N LEU 86.A O no hydrogen 2.863 N/A LYS 59.A N LEU 34.A O no hydrogen 2.777 N/A LYS 59.A NZ SER 35.A OG no hydrogen 3.015 N/A LYS 59.A NZ ASP 90.A OD2 no hydrogen 2.703 N/A THR 60.A N PHE 88.A O no hydrogen 2.821 N/A THR 60.A OG1 PHE 88.A O no hydrogen 3.448 N/A THR 60.A OG1 GLU 89.A OE1 no hydrogen 2.720 N/A VAL 62.A N GLU 89.A OE1 no hydrogen 2.894 N/A ILE 64.A N HIS 61.A O no hydrogen 3.046 N/A LEU 65.A N VAL 62.A O no hydrogen 3.201 N/A ASN 66.A N SER 39.A O no hydrogen 2.802 N/A PHE 68.A N LEU 65.A O no hydrogen 3.422 N/A VAL 72.A N THR 69.A OG1 no hydrogen 3.115 N/A LYS 74.A N LEU 70.A O no hydrogen 3.002 N/A GLU 75.A N ASP 71.A O no hydrogen 3.041 N/A LEU 76.A N VAL 72.A O no hydrogen 2.924 N/A ILE 77.A N MET 73.A O no hydrogen 2.873 N/A THR 78.A N LYS 74.A O no hydrogen 3.067 N/A THR 78.A OG1 LYS 74.A O no hydrogen 3.195 N/A LEU 79.A N GLU 75.A O no hydrogen 3.178 N/A ALA 80.A N LEU 76.A O no hydrogen 2.867 N/A LYS 81.A N ILE 77.A O no hydrogen 2.886 N/A CYS 82.A N THR 78.A O no hydrogen 2.970 N/A HIS 83.A N LEU 79.A O no hydrogen 2.858 N/A HIS 83.A NE2 ASP 49.A OD1 no hydrogen 2.794 N/A PHE 85.A N ALA 80.A O no hydrogen 3.052 N/A LEU 86.A N CYS 56.A O no hydrogen 3.064 N/A ILE 87.A N ASP 116.A OD2 no hydrogen 2.851 N/A PHE 88.A N LEU 58.A O no hydrogen 2.928 N/A GLU 89.A N LEU 117.A O no hydrogen 2.975 N/A ASP 90.A N THR 60.A O no hydrogen 2.893 N/A ARG 91.A NH1 ARG 91.A O no hydrogen 2.841 N/A LYS 92.A N ASN 119.A OD1 no hydrogen 2.854 N/A LYS 92.A NZ ASP 90.A OD1 no hydrogen 2.693 N/A PHE 93.A N ASN 119.A O no hydrogen 3.128 N/A ILE 96.A N ASP 95.A OD1 no hydrogen 2.822 N/A THR 99.A N ILE 96.A O no hydrogen 3.065 N/A VAL 100.A N ILE 96.A O no hydrogen 3.068 N/A LYS 101.A N GLY 97.A O no hydrogen 3.206 N/A LYS 101.A NZ ASN 98.A O no hydrogen 2.992 N/A LYS 102.A N THR 99.A O no hydrogen 3.077 N/A LYS 102.A NZ.A ASN 98.A OD1 no hydrogen 2.955 N/A GLN 103.A N THR 99.A O no hydrogen 3.100 N/A TYR 104.A N VAL 100.A O no hydrogen 2.903 N/A GLU 105.A N LYS 101.A O no hydrogen 3.137 N/A GLY 106.A N LYS 102.A O no hydrogen 2.904 N/A LYS 110.A N GLY 106.A O no hydrogen 3.176 N/A ALA 112.A N TYR 104.A O no hydrogen 2.959 N/A SER 113.A N LYS 110.A O no hydrogen 2.924 N/A SER 113.A OG.A LYS 110.A O no hydrogen 2.706 N/A TRP 114.A N ILE 111.A O no hydrogen 3.138 N/A TRP 114.A NE1 PHE 109.A O no hydrogen 2.821 N/A ALA 115.A N ILE 111.A O no hydrogen 2.976 N/A LEU 117.A N ILE 87.A O no hydrogen 3.124 N/A VAL 118.A N GLY 142.A O no hydrogen 3.202 N/A ASN 119.A ND2 ASP 90.A OD1 no hydrogen 2.740 N/A ALA 120.A N LEU 144.A O no hydrogen 2.950 N/A HIS 121.A N PHE 93.A O no hydrogen 2.849 N/A GLY 125.A N VAL 122.A O no hydrogen 2.957 N/A VAL 128.A N GLY 125.A O no hydrogen 3.131 N/A LYS 130.A N SER 126.A O no hydrogen 3.029 N/A LYS 130.A NZ HIS 171.A NE2 no hydrogen 2.778 N/A GLY 131.A N GLY 127.A O no hydrogen 2.850 N/A LEU 132.A N VAL 128.A O no hydrogen 3.168 N/A GLN 133.A N VAL 129.A O no hydrogen 2.824 N/A GLU 134.A N LYS 130.A O no hydrogen 3.282 N/A GLU 134.A N GLY 131.A O no hydrogen 3.286 N/A VAL 135.A N LEU 132.A O no hydrogen 3.068 N/A GLY 136.A N LEU 132.A O no hydrogen 2.819 N/A LEU 137.A N GLN 133.A O no hydrogen 2.915 N/A HIS 140.A N LEU 137.A O no hydrogen 3.008 N/A HIS 140.A ND1.A PRO 138.A O no hydrogen 3.280 N/A ARG 141.A N GLY 136.A O no hydrogen 2.902 N/A ARG 141.A NE ALA 112.A O no hydrogen 2.954 N/A ARG 141.A NH2 ALA 112.A O no hydrogen 2.956 N/A GLY 142.A N ASP 116.A O no hydrogen 3.079 N/A CYS 143.A N PHE 174.A O no hydrogen 2.937 N/A CYS 143.A SG VAL 118.A O no hydrogen 3.894 N/A CYS 143.A SG LEU 144.A O no hydrogen 3.813 N/A LEU 144.A N VAL 118.A O no hydrogen 2.862 N/A LEU 145.A N GLY 177.A O no hydrogen 2.940 N/A ILE 146.A N ALA 120.A O no hydrogen 2.940 N/A ALA 147.A N ILE 179.A O no hydrogen 2.916 N/A GLU 148.A N ILE 179.A O no hydrogen 3.388 N/A SER 150.A OG GLN 208.A OE1 no hydrogen 2.647 N/A THR 152.A N GLY 207.A O no hydrogen 2.831 N/A THR 152.A OG1.A GLY 207.A O no hydrogen 3.294 N/A SER 154.A N SER 151.A O no hydrogen 3.153 N/A ALA 156.A N SER 154.A OG no hydrogen 3.105 N/A THR 157.A N LEU 155.A O no hydrogen 2.946 N/A TYR 160.A N THR 157.A O no hydrogen 2.991 N/A THR 161.A N THR 157.A O no hydrogen 3.502 N/A THR 161.A OG1 ALA 147.A O no hydrogen 2.852 N/A ARG 162.A N GLY 158.A O no hydrogen 3.085 N/A ARG 162.A NE ASP 159.A OD1 no hydrogen 3.206 N/A ARG 162.A NH2 ASP 159.A OD1 no hydrogen 2.716 N/A ALA 163.A N ASP 159.A O no hydrogen 2.950 N/A ALA 164.A N TYR 160.A O no hydrogen 3.038 N/A VAL 165.A N THR 161.A O no hydrogen 3.091 N/A ARG 166.A N ARG 162.A O no hydrogen 3.002 N/A MET 167.A N ALA 163.A O no hydrogen 2.935 N/A ALA 168.A N ALA 164.A O no hydrogen 2.982 N/A GLU 169.A N VAL 165.A O no hydrogen 3.005 N/A GLU 170.A N ARG 166.A O no hydrogen 3.055 N/A HIS 171.A N ALA 168.A O no hydrogen 3.068 N/A HIS 171.A ND1 MET 167.A O no hydrogen 2.881 N/A PHE 174.A N HIS 171.A O no hydrogen 3.037 N/A VAL 175.A N HIS 171.A O no hydrogen 2.859 N/A VAL 176.A N CYS 143.A O no hydrogen 2.829 N/A PHE 178.A N LEU 191.A O.A no hydrogen 2.770 N/A PHE 178.A N LEU 191.A O.B no hydrogen 2.938 N/A ILE 179.A N LEU 145.A O no hydrogen 2.909 N/A SER 180.A N LEU 193.A O no hydrogen 2.980 N/A SER 180.A OG SER 182.A O no hydrogen 2.744 N/A GLY 181.A N GLU 148.A OE1 no hydrogen 2.857 N/A SER 182.A OG.A GLU 148.A OE1 no hydrogen 3.175 N/A SER 182.A OG.A ARG 183.A O no hydrogen 3.454 N/A ARG 183.A N ARG 220.A O no hydrogen 2.912 N/A ARG 183.A NE GLY 221.A O no hydrogen 3.089 N/A ARG 183.A NH1 GLU 2.A OE2.B no hydrogen 2.978 N/A ARG 183.A NH2 GLU 2.A OE1.A no hydrogen 3.418 N/A ARG 183.A NH2 GLU 2.A OE1.B no hydrogen 2.970 N/A ARG 183.A NH2 GLU 2.A OE2.A no hydrogen 2.888 N/A ARG 183.A NH2 GLY 221.A O no hydrogen 3.346 N/A VAL 184.A N HIS 192.A NE2 no hydrogen 3.081 N/A SER 185.A N HIS 192.A NE2 no hydrogen 3.262 N/A SER 185.A OG GLU 169.A OE2.A no hydrogen 2.833 N/A LYS 187.A N SER 185.A OG no hydrogen 3.045 N/A PHE 190.A N.A LYS 187.A O no hydrogen 3.229 N/A PHE 190.A N.B LYS 187.A O no hydrogen 3.207 N/A LEU 191.A N.A VAL 176.A O no hydrogen 2.947 N/A LEU 191.A N.B VAL 176.A O no hydrogen 2.932 N/A HIS 192.A N ASP 223.A OD2 no hydrogen 2.894 N/A LEU 193.A N PHE 178.A O no hydrogen 2.916 N/A THR 194.A N ILE 224.A O no hydrogen 2.837 N/A THR 194.A OG1 SER 180.A O no hydrogen 2.696 N/A THR 194.A OG1 SER 222.A OG.A no hydrogen 2.715 N/A THR 194.A OG1 SER 222.A OG.B no hydrogen 2.666 N/A GLN 198.A N ASN 211.A O no hydrogen 3.105 N/A LEU 199.A N TYR 244.A OH no hydrogen 2.980 N/A ASP 204.A N GLN 208.A O no hydrogen 3.159 N/A LEU 206.A N ASP 204.A OD1 no hydrogen 2.806 N/A GLN 208.A N ASP 204.A OD1 no hydrogen 2.888 N/A GLN 209.A N GLN 208.A OE1 no hydrogen 3.051 N/A GLN 209.A NE2 SER 150.A O no hydrogen 2.995 N/A TYR 210.A N GLY 202.A O no hydrogen 3.003 N/A ASN 211.A N GLY 196.A O no hydrogen 2.914 N/A GLU 215.A N SER 212.A OG no hydrogen 3.111 N/A VAL 216.A N SER 212.A O no hydrogen 2.984 N/A ILE 217.A N PRO 213.A O no hydrogen 2.926 N/A GLY 218.A N GLN 214.A O no hydrogen 2.880 N/A LYS 219.A N GLN 214.A O no hydrogen 3.261 N/A LYS 219.A N GLU 215.A O no hydrogen 3.137 N/A ARG 220.A N GLU 215.A O no hydrogen 2.911 N/A ARG 220.A NE GLU 215.A OE2 no hydrogen 2.736 N/A ARG 220.A NH2 GLU 215.A OE2 no hydrogen 3.350 N/A SER 222.A N VAL 216.A O no hydrogen 3.051 N/A SER 222.A OG.A HIS 192.A O no hydrogen 2.992 N/A SER 222.A OG.A THR 194.A OG1 no hydrogen 2.715 N/A SER 222.A OG.B THR 194.A OG1 no hydrogen 2.666 N/A ASP 223.A N HIS 192.A O no hydrogen 2.970 N/A ILE 224.A N HIS 192.A O no hydrogen 3.068 N/A ILE 225.A N ASN 31.A O no hydrogen 3.072 N/A ILE 226.A N THR 194.A O no hydrogen 2.842 N/A VAL 227.A N CYS 33.A O no hydrogen 3.044 N/A ARG 229.A NH1 ASP 204.A OD2 no hydrogen 2.918 N/A ARG 229.A NH2 ASP 204.A OD2 no hydrogen 3.036 N/A ILE 231.A N GLY 228.A O no hydrogen 2.896 N/A ILE 232.A N GLY 228.A O no hydrogen 2.871 N/A SER 233.A N ARG 229.A O no hydrogen 3.044 N/A ALA 234.A N ILE 231.A O no hydrogen 3.011 N/A ARG 237.A NH1 GLU 43.A OE2 no hydrogen 3.033 N/A ARG 237.A NH1 ILE 232.A O no hydrogen 2.879 N/A ARG 237.A NH2 GLU 43.A OE2 no hydrogen 2.818 N/A GLU 239.A N ASP 236.A OD1 no hydrogen 3.107 N/A ALA 240.A N ASP 236.A O no hydrogen 3.039 N/A ALA 241.A N ARG 237.A O no hydrogen 2.927 N/A GLU 242.A N LEU 238.A O no hydrogen 2.934 N/A MET 243.A N GLU 239.A O no hydrogen 2.927 N/A TYR 244.A N ALA 240.A O no hydrogen 3.036 N/A ARG 245.A N ALA 241.A O no hydrogen 2.807 N/A ARG 245.A NE GLU 242.A OE1 no hydrogen 3.466 N/A ARG 245.A NE GLU 242.A OE2 no hydrogen 2.963 N/A ARG 245.A NH1 GLU 29.A O no hydrogen 2.892 N/A ARG 245.A NH2 GLU 242.A OE1 no hydrogen 2.930 N/A LYS 246.A N GLU 242.A O no hydrogen 2.932 N/A ALA 247.A N MET 243.A O no hydrogen 3.011 N/A ALA 248.A N TYR 244.A O no hydrogen 2.968 N/A TRP 249.A N ARG 245.A O no hydrogen 2.895 N/A GLU 250.A N LYS 246.A O no hydrogen 3.027 N/A ALA 251.A N ALA 247.A O no hydrogen 3.109 N/A TYR 252.A N ALA 248.A O no hydrogen 3.040 N/A LEU 253.A N TRP 249.A O no hydrogen 2.924 N/A SER 254.A N GLU 250.A O no hydrogen 2.886 N/A SER 254.A OG.A GLU 250.A O no hydrogen 3.185 N/A SER 254.A OG.A GLU 250.A OE2 no hydrogen 2.787 N/A SER 254.A OG.B ALA 251.A O no hydrogen 2.591 N/A ARG 255.A N ALA 251.A O no hydrogen 3.169 N/A ARG 255.A NE GLU 2.A OE1.A no hydrogen 3.149 N/A ARG 255.A NE GLU 2.A OE2.A no hydrogen 3.352 N/A ARG 255.A NH1 ILE 217.A O no hydrogen 2.884 N/A ARG 255.A NH1 SER 222.A O no hydrogen 2.715 N/A ARG 255.A NH2 GLU 2.A OE1.B no hydrogen 3.549 N/A ARG 255.A NH2 GLU 2.A OE2.A no hydrogen 3.027 N/A ARG 255.A NH2 ASP 223.A OD1 no hydrogen 3.552 N/A LEU 256.A N TYR 252.A O no hydrogen 3.048 N/A GLY 257.A N LEU 253.A O no hydrogen 2.961 N/A GLY 257.A N SER 254.A O no hydrogen 3.244 N/A