Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3oa2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLY 25.A O no hydrogen 3.314 N/A LYS 2.A N ASN 26.A OD1 no hydrogen 2.772 N/A ASN 3.A N ASP 73.A OD2 no hydrogen 2.842 N/A ASN 3.A ND2 ALA 69.A O no hydrogen 3.001 N/A ASN 3.A ND2 ALA 71.A O no hydrogen 3.000 N/A PHE 4.A N CYS 27.A O no hydrogen 2.814 N/A ALA 5.A N TYR 74.A O no hydrogen 3.020 N/A LEU 6.A N SER 30.A O no hydrogen 2.991 N/A ILE 7.A N SER 76.A O no hydrogen 2.849 N/A GLY 8.A N TYR 32.A O no hydrogen 2.844 N/A ALA 9.A N TYR 32.A O no hydrogen 3.412 N/A ALA 10.A N ASP 33.A OD2 no hydrogen 2.852 N/A GLY 11.A N GLY 8.A O no hydrogen 3.265 N/A ARG 16.A N ILE 13.A O no hydrogen 2.923 N/A HIS 17.A N ALA 14.A O no hydrogen 2.883 N/A HIS 17.A ND1 TYR 264.A OH no hydrogen 2.604 N/A HIS 17.A NE2 GLU 101.A OE2 no hydrogen 2.700 N/A MET 18.A N ALA 14.A O no hydrogen 3.034 N/A ARG 19.A N PRO 15.A O no hydrogen 2.943 N/A ALA 20.A N ARG 16.A O no hydrogen 3.023 N/A ILE 21.A N HIS 17.A O no hydrogen 2.984 N/A LYS 22.A N MET 18.A O no hydrogen 3.094 N/A ASP 23.A N ARG 19.A O no hydrogen 2.702 N/A THR 24.A N ALA 20.A O no hydrogen 3.160 N/A THR 24.A OG1 ALA 20.A O no hydrogen 2.827 N/A THR 24.A OG1 ILE 21.A O no hydrogen 3.233 N/A GLY 25.A N LYS 22.A O no hydrogen 3.032 N/A ASN 26.A N ILE 21.A O no hydrogen 2.922 N/A ASN 26.A ND2 THR 24.A OG1 no hydrogen 2.900 N/A CYS 27.A N LYS 2.A O no hydrogen 3.009 N/A VAL 29.A N PHE 4.A O no hydrogen 2.866 N/A TYR 32.A N LEU 6.A O no hydrogen 2.884 N/A ASP 33.A N PHE 51.A O no hydrogen 3.024 N/A ASN 35.A N ASP 33.A OD1 no hydrogen 2.898 N/A ILE 41.A N VAL 38.A O no hydrogen 2.952 N/A ASP 42.A N GLY 39.A O no hydrogen 3.066 N/A SER 43.A N ILE 40.A O no hydrogen 3.165 N/A SER 43.A OG ILE 40.A O no hydrogen 2.795 N/A ILE 44.A N ILE 41.A O no hydrogen 3.076 N/A SER 45.A N ILE 41.A O no hydrogen 2.646 N/A SER 48.A N SER 45.A O no hydrogen 3.103 N/A SER 48.A OG GLU 49.A O no hydrogen 2.833 N/A GLU 49.A N VAL 29.A O no hydrogen 2.909 N/A PHE 51.A N ALA 31.A O no hydrogen 2.934 N/A GLU 55.A N GLU 55.A OE2 no hydrogen 2.725 N/A PHE 56.A N GLU 53.A O no hydrogen 3.057 N/A PHE 57.A N GLU 53.A O no hydrogen 3.194 N/A LEU 58.A N PHE 54.A O no hydrogen 2.842 N/A ASP 59.A N GLU 55.A O no hydrogen 3.190 N/A HIS 60.A N PHE 56.A O no hydrogen 3.085 N/A ALA 61.A N PHE 57.A O no hydrogen 2.951 N/A SER 62.A N LEU 58.A O no hydrogen 2.954 N/A SER 62.A OG LEU 58.A O no hydrogen 2.773 N/A ASN 63.A N ASP 59.A O no hydrogen 2.896 N/A LEU 64.A N HIS 60.A O no hydrogen 3.028 N/A LYS 65.A N SER 62.A O no hydrogen 3.212 N/A LYS 65.A NZ LEU 94.A O no hydrogen 2.963 N/A ARG 66.A N ASN 63.A O no hydrogen 3.190 N/A ASP 67.A N LEU 64.A O no hydrogen 3.511 N/A ALA 69.A N ASP 67.A OD2 no hydrogen 3.071 N/A THR 70.A N ASP 67.A O no hydrogen 3.020 N/A THR 70.A OG1 LEU 64.A O no hydrogen 2.727 N/A THR 70.A OG1 ASP 67.A O no hydrogen 3.196 N/A ALA 71.A N ASP 67.A O no hydrogen 3.011 N/A ASP 73.A N ASN 3.A O no hydrogen 2.802 N/A TYR 74.A N ASN 3.A O no hydrogen 3.138 N/A VAL 75.A N ASP 97.A O no hydrogen 2.941 N/A SER 76.A N ALA 5.A O no hydrogen 2.781 N/A SER 76.A OG TYR 264.A OH no hydrogen 2.712 N/A ILE 77.A N ILE 99.A O no hydrogen 2.821 N/A CYS 78.A N ILE 7.A O no hydrogen 2.835 N/A CYS 78.A SG.A ILE 7.A O no hydrogen 3.540 N/A CYS 78.A SG.A GLY 8.A O no hydrogen 3.492 N/A SER 79.A OG HIS 87.A ND1 no hydrogen 2.871 N/A ASN 81.A ND2 SER 177.A O no hydrogen 2.938 N/A ASN 81.A ND2 ASN 183.A OD1 no hydrogen 2.955 N/A TYR 82.A N LYS 176.A O no hydrogen 3.006 N/A LEU 83.A N PRO 80.A O no hydrogen 2.839 N/A HIS 84.A N ASN 81.A O no hydrogen 3.100 N/A HIS 84.A ND1 PRO 103.A O no hydrogen 2.765 N/A HIS 84.A ND1 LEU 104.A O no hydrogen 2.995 N/A HIS 84.A NE2 SER 79.A O no hydrogen 2.873 N/A HIS 87.A N LEU 83.A O no hydrogen 3.073 N/A HIS 87.A ND1 SER 79.A OG no hydrogen 2.871 N/A ILE 88.A N HIS 84.A O no hydrogen 2.839 N/A ALA 89.A N TYR 85.A O no hydrogen 2.962 N/A ALA 90.A N PRO 86.A O no hydrogen 3.034 N/A GLY 91.A N HIS 87.A O no hydrogen 2.984 N/A LEU 92.A N ILE 88.A O no hydrogen 2.938 N/A ARG 93.A N ALA 89.A O no hydrogen 2.936 N/A LEU 94.A N ALA 90.A O no hydrogen 2.944 N/A LEU 94.A N GLY 91.A O no hydrogen 3.181 N/A GLY 95.A N LEU 92.A O no hydrogen 2.959 N/A CYS 96.A N GLY 91.A O no hydrogen 3.237 N/A CYS 96.A SG LEU 72.A O no hydrogen 3.657 N/A ASP 97.A N ASP 73.A O no hydrogen 3.124 N/A VAL 98.A N ARG 124.A O no hydrogen 2.868 N/A ILE 99.A N VAL 75.A O no hydrogen 2.877 N/A CYS 100.A N TYR 126.A O no hydrogen 2.856 N/A CYS 100.A SG GLU 101.A O no hydrogen 3.490 N/A GLU 101.A N ILE 77.A O no hydrogen 3.067 N/A LYS 102.A N GLU 101.A OE1 no hydrogen 3.195 N/A LYS 102.A NZ ASN 183.A O no hydrogen 3.000 N/A MET 110.A N THR 107.A OG1 no hydrogen 3.051 N/A LEU 111.A N THR 107.A O no hydrogen 3.308 N/A ASP 112.A N PRO 108.A O no hydrogen 3.055 N/A GLN 113.A N GLU 109.A O no hydrogen 2.988 N/A LEU 114.A N MET 110.A O no hydrogen 2.933 N/A ALA 115.A N LEU 111.A O no hydrogen 2.953 N/A VAL 116.A N ASP 112.A O no hydrogen 3.169 N/A ILE 117.A N GLN 113.A O no hydrogen 3.239 N/A GLU 118.A N LEU 114.A O no hydrogen 2.897 N/A ARG 119.A N ALA 115.A O no hydrogen 3.106 N/A GLU 120.A N VAL 116.A O no hydrogen 2.975 N/A GLU 120.A N ILE 117.A O no hydrogen 3.113 N/A THR 121.A N ILE 117.A O no hydrogen 2.961 N/A THR 121.A OG1 ILE 117.A O no hydrogen 2.845 N/A THR 121.A OG1 GLU 118.A O no hydrogen 3.449 N/A LYS 123.A N THR 121.A OG1 no hydrogen 3.303 N/A ARG 124.A N ASP 97.A OD1 no hydrogen 2.852 N/A ARG 124.A NE GLU 118.A OE2 no hydrogen 3.100 N/A LEU 125.A N GLU 118.A OE2 no hydrogen 2.903 N/A TYR 126.A N VAL 98.A O no hydrogen 2.681 N/A ASN 127.A N TYR 273.A O no hydrogen 2.883 N/A ASN 127.A ND2 CYS 100.A O no hydrogen 3.026 N/A ILE 128.A N CYS 100.A O no hydrogen 3.112 N/A GLN 130.A N GLN 130.A OE1 no hydrogen 3.128 N/A ARG 132.A N LEU 129.A O no hydrogen 3.218 N/A ARG 132.A NE ASP 190.A OD2 no hydrogen 2.758 N/A ARG 132.A NH2 ASP 190.A OD1 no hydrogen 2.601 N/A ARG 132.A NH2 ASP 190.A OD2 no hydrogen 3.521 N/A HIS 133.A N GLN 130.A O no hydrogen 3.053 N/A HIS 134.A N LEU 131.A O no hydrogen 3.132 N/A ILE 137.A N HIS 134.A O no hydrogen 2.844 N/A ILE 138.A N HIS 134.A O no hydrogen 3.126 N/A ALA 139.A N GLN 135.A O no hydrogen 3.061 N/A LEU 140.A N ALA 136.A O no hydrogen 3.194 N/A LYS 141.A N ILE 137.A O no hydrogen 2.894 N/A LYS 141.A NZ PHE 194.A O no hydrogen 2.761 N/A ASP 142.A N ILE 138.A O no hydrogen 3.286 N/A LYS 143.A N ALA 139.A O no hydrogen 2.973 N/A VAL 144.A N LEU 140.A O no hydrogen 2.831 N/A ALA 145.A N LYS 141.A O no hydrogen 3.105 N/A ALA 145.A N ASP 142.A O no hydrogen 3.161 N/A ARG 146.A N ASP 142.A O no hydrogen 3.170 N/A ARG 146.A N LYS 143.A O no hydrogen 3.391 N/A ARG 146.A NE ASP 142.A OD1 no hydrogen 3.042 N/A ARG 146.A NH2 ASP 142.A OD1 no hydrogen 3.094 N/A GLU 147.A N LYS 143.A O no hydrogen 3.479 N/A SER 148.A OG HIS 150.A O no hydrogen 3.248 N/A HIS 150.A N SER 148.A OG no hydrogen 3.265 N/A LYS 151.A NZ GLN 200.A OE1 no hydrogen 2.762 N/A LYS 151.A NZ GLU 217.A OE2 no hydrogen 2.751 N/A LYS 151.A NZ TYR 218.A O no hydrogen 2.833 N/A TYR 152.A N GLN 220.A O no hydrogen 2.890 N/A GLU 153.A N ASN 251.A OD1 no hydrogen 2.904 N/A VAL 154.A N ARG 222.A O no hydrogen 2.823 N/A ASP 155.A N THR 249.A O no hydrogen 3.076 N/A LEU 156.A N ARG 224.A O no hydrogen 2.841 N/A THR 157.A N SER 247.A O no hydrogen 2.760 N/A THR 157.A OG1 HIS 302.A NE2 no hydrogen 2.819 N/A TYR 158.A N PHE 226.A O no hydrogen 2.978 N/A ILE 159.A N TYR 245.A O no hydrogen 2.851 N/A THR 160.A N SER 228.A O no hydrogen 2.802 N/A THR 160.A OG1 THR 244.A OG1 no hydrogen 2.782 N/A SER 161.A N PRO 243.A O no hydrogen 2.858 N/A SER 161.A OG PRO 243.A O no hydrogen 2.603 N/A ARG 162.A N VAL 229.A O no hydrogen 3.070 N/A ARG 162.A NH1 THR 160.A OG1 no hydrogen 2.928 N/A ARG 162.A NH1 SER 161.A O no hydrogen 2.971 N/A TYR 166.A N GLY 163.A O no hydrogen 3.140 N/A LYS 168.A NZ ASN 164.A OD1 no hydrogen 3.363 N/A SER 169.A N TRP 165.A O no hydrogen 2.987 N/A SER 169.A N TYR 166.A O no hydrogen 3.142 N/A SER 169.A OG TYR 166.A O no hydrogen 2.675 N/A LYS 171.A N SER 169.A OG no hydrogen 2.895 N/A GLY 172.A N SER 169.A O no hydrogen 2.970 N/A ASP 173.A N TRP 170.A O no hydrogen 3.095 N/A ARG 175.A N ASP 173.A OD2 no hydrogen 2.979 N/A LYS 176.A N ASP 173.A O no hydrogen 2.860 N/A SER 177.A N ASP 173.A O no hydrogen 2.857 N/A SER 177.A OG LYS 171.A O no hydrogen 3.249 N/A SER 177.A OG ASP 173.A O no hydrogen 3.264 N/A PHE 178.A N PRO 174.A O no hydrogen 2.968 N/A GLY 179.A N SER 177.A OG no hydrogen 2.991 N/A THR 182.A OG1 PHE 178.A O no hydrogen 3.358 N/A ASN 183.A N GLY 179.A O no hydrogen 2.911 N/A ASN 183.A ND2 TYR 166.A OH no hydrogen 2.969 N/A ILE 184.A N VAL 180.A O no hydrogen 2.851 N/A GLY 185.A N ALA 181.A O no hydrogen 2.959 N/A PHE 188.A N GLY 185.A O no hydrogen 2.845 N/A TYR 189.A N GLY 185.A O no hydrogen 3.131 N/A ASP 190.A N VAL 186.A O no hydrogen 3.023 N/A MET 191.A N HIS 187.A O no hydrogen 3.042 N/A LEU 192.A N PHE 188.A O no hydrogen 2.982 N/A HIS 193.A N TYR 189.A O no hydrogen 3.080 N/A HIS 193.A ND1 GLY 197.A O no hydrogen 3.027 N/A PHE 194.A N ASP 190.A O no hydrogen 2.899 N/A ILE 195.A N MET 191.A O no hydrogen 3.011 N/A PHE 196.A N LEU 192.A O no hydrogen 2.746 N/A GLY 197.A N HIS 193.A O no hydrogen 3.076 N/A LYS 198.A N GLU 219.A OE1 no hydrogen 3.139 N/A GLN 200.A N GLU 217.A O no hydrogen 2.659 N/A ARG 201.A N GLU 217.A O no hydrogen 3.275 N/A ARG 201.A NH1 GLU 300.A OE1 no hydrogen 3.301 N/A ARG 201.A NH2 GLU 300.A OE2 no hydrogen 2.536 N/A ASN 202.A ND2 THR 284.A O no hydrogen 3.330 N/A VAL 203.A N TYR 215.A O no hydrogen 2.866 N/A HIS 205.A N ALA 213.A O no hydrogen 2.852 N/A PHE 206.A N ALA 213.A O no hydrogen 3.187 N/A THR 207.A OG1 THR 212.A OG1 no hydrogen 3.100 N/A SER 208.A N LYS 211.A O no hydrogen 2.935 N/A TYR 210.A N SER 208.A OG no hydrogen 2.954 N/A LYS 211.A N SER 208.A OG no hydrogen 3.228 N/A LYS 211.A NZ ASP 230.A OD2 no hydrogen 2.811 N/A LYS 211.A NZ ASP 233.A OD1 no hydrogen 3.156 N/A LYS 211.A NZ ASP 233.A OD2 no hydrogen 2.666 N/A THR 212.A N LEU 227.A O no hydrogen 2.807 N/A THR 212.A OG1 PHE 206.A O no hydrogen 3.469 N/A THR 212.A OG1 THR 207.A OG1 no hydrogen 3.100 N/A THR 212.A OG1 LYS 211.A O no hydrogen 2.844 N/A ALA 213.A N PHE 206.A O no hydrogen 2.996 N/A GLY 214.A N TRP 225.A O no hydrogen 3.079 N/A TYR 215.A N VAL 203.A O no hydrogen 2.903 N/A TYR 215.A OH GLU 217.A OE1 no hydrogen 2.802 N/A LEU 216.A N VAL 223.A O no hydrogen 2.904 N/A GLU 217.A N ARG 201.A O no hydrogen 2.958 N/A TYR 218.A N ALA 221.A O no hydrogen 2.752 N/A GLU 219.A N LYS 198.A O no hydrogen 3.034 N/A GLN 220.A N PHE 196.A O no hydrogen 3.079 N/A ALA 221.A N TYR 218.A O no hydrogen 3.315 N/A ARG 222.A N TYR 152.A O no hydrogen 2.901 N/A ARG 222.A NH1 GLU 153.A OE1 no hydrogen 3.271 N/A VAL 223.A N LEU 216.A O no hydrogen 2.803 N/A ARG 224.A N VAL 154.A O no hydrogen 2.907 N/A ARG 224.A NE ASP 155.A OD1 no hydrogen 2.717 N/A ARG 224.A NH1 ASP 155.A OD1 no hydrogen 3.293 N/A ARG 224.A NH1 ASP 155.A OD2 no hydrogen 2.803 N/A ARG 224.A NH2 ASN 299.A O no hydrogen 3.294 N/A TRP 225.A N GLY 214.A O no hydrogen 2.988 N/A PHE 226.A N LEU 156.A O no hydrogen 2.978 N/A LEU 227.A N THR 212.A O no hydrogen 2.902 N/A SER 228.A N TYR 158.A O no hydrogen 2.960 N/A SER 228.A OG ASP 233.A OD2 no hydrogen 2.595 N/A VAL 229.A N TYR 210.A O no hydrogen 2.937 N/A ASP 230.A N SER 228.A OG no hydrogen 2.893 N/A ASN 232.A N ASP 230.A OD1 no hydrogen 2.903 N/A ASP 233.A N ASP 230.A O no hydrogen 2.918 N/A LEU 234.A N ALA 231.A O no hydrogen 3.097 N/A VAL 238.A N PRO 235.A O no hydrogen 3.000 N/A LYS 239.A N PRO 235.A O no hydrogen 3.151 N/A LYS 239.A NZ ASN 232.A O no hydrogen 3.103 N/A LYS 241.A N VAL 238.A O no hydrogen 2.845 N/A LYS 242.A N VAL 238.A O no hydrogen 3.182 N/A THR 244.A OG1 THR 160.A OG1 no hydrogen 2.782 N/A TYR 245.A N ILE 159.A O no hydrogen 2.760 N/A SER 247.A N THR 157.A O no hydrogen 2.813 N/A SER 247.A OG GLU 254.A OE1 no hydrogen 3.487 N/A SER 247.A OG GLU 254.A OE2 no hydrogen 2.600 N/A THR 249.A N ASP 155.A O no hydrogen 2.941 N/A VAL 250.A N GLU 253.A O no hydrogen 2.932 N/A ASN 251.A N GLU 153.A O no hydrogen 2.751 N/A GLU 253.A N VAL 250.A O no hydrogen 3.094 N/A MET 255.A N ILE 248.A O no hydrogen 2.789 N/A HIS 260.A NE2 GLU 101.A OE2 no hydrogen 2.769 N/A THR 261.A N ASP 258.A O no hydrogen 3.137 N/A THR 262.A N ASP 258.A O no hydrogen 3.280 N/A THR 262.A OG1 ASP 258.A O no hydrogen 3.529 N/A SER 263.A N LEU 259.A O no hydrogen 2.913 N/A SER 263.A OG LEU 259.A O no hydrogen 2.789 N/A TYR 264.A N HIS 260.A O no hydrogen 2.993 N/A TYR 264.A OH HIS 17.A ND1 no hydrogen 2.604 N/A TYR 264.A OH SER 76.A OG no hydrogen 2.712 N/A GLU 265.A N THR 261.A O no hydrogen 2.879 N/A GLU 266.A N THR 262.A O no hydrogen 2.986 N/A ILE 267.A N SER 263.A O no hydrogen 3.046 N/A LEU 268.A N TYR 264.A O no hydrogen 2.924 N/A ALA 269.A N GLU 265.A O no hydrogen 2.848 N/A GLY 270.A N ILE 267.A O no hydrogen 3.034 N/A ARG 271.A N GLU 266.A O no hydrogen 2.845 N/A ARG 271.A NE GLU 266.A OE1 no hydrogen 2.861 N/A ARG 271.A NH2 GLU 266.A OE2 no hydrogen 2.881 N/A GLY 274.A N ASP 277.A OD2 no hydrogen 3.062 N/A ALA 278.A N GLY 274.A O no hydrogen 3.045 N/A ARG 279.A NH1 ASP 112.A OD1 no hydrogen 3.096 N/A ARG 279.A NH2 ASP 112.A OD1 no hydrogen 2.770 N/A CYS 281.A SG ALA 278.A O no hydrogen 3.464 N/A VAL 282.A N ALA 278.A O no hydrogen 3.138 N/A GLU 283.A N ARG 279.A O no hydrogen 2.920 N/A THR 284.A N HIS 280.A O no hydrogen 3.037 N/A THR 284.A OG1 HIS 280.A NE2 no hydrogen 3.207 N/A THR 284.A OG1 HIS 280.A O no hydrogen 3.006 N/A VAL 285.A N CYS 281.A O no hydrogen 3.010 N/A ASN 286.A N VAL 282.A O no hydrogen 2.953 N/A THR 287.A N GLU 283.A O no hydrogen 3.048 N/A THR 287.A OG1 GLU 283.A O no hydrogen 3.148 N/A ILE 288.A N THR 284.A O no hydrogen 3.135 N/A ARG 289.A N VAL 285.A O no hydrogen 2.784 N/A ARG 289.A NE PHE 178.A O no hydrogen 2.971 N/A ARG 289.A NE THR 182.A OG1 no hydrogen 3.322 N/A ARG 289.A NH1 PRO 106.A O no hydrogen 3.323 N/A ARG 289.A NH1 ASN 286.A OD1 no hydrogen 3.152 N/A ARG 289.A NH2 PRO 106.A O no hydrogen 3.041 N/A ARG 289.A NH2 THR 182.A OG1 no hydrogen 2.773 N/A SER 290.A N THR 287.A O no hydrogen 3.246 N/A ALA 291.A N ILE 288.A O no hydrogen 3.236 N/A VAL 294.A N VAL 204.A O no hydrogen 2.996 N/A GLU 300.A N SER 297.A O no hydrogen 2.573 N/A HIS 302.A NE2 THR 157.A OG1 no hydrogen 2.819 N/A PHE 304.A N HIS 302.A ND1 no hydrogen 2.996 N/A VAL 305.A N HIS 302.A O no hydrogen 3.071 N/A