Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6btw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N GLN 3.A OE1 no hydrogen 2.772 N/A ALA 5.A N GLU 8.A OE2 no hydrogen 2.717 N/A GLY 7.A N VAL 20.A O no hydrogen 2.880 N/A GLU 8.A N ALA 5.A O no hydrogen 2.918 N/A ILE 10.A N TRP 18.A O no hydrogen 2.682 N/A ASP 12.A N ALA 16.A O no hydrogen 2.888 N/A MET 13.A N SER 92.A O no hydrogen 2.826 N/A ALA 14.A N ASP 12.A OD1 no hydrogen 2.943 N/A ALA 15.A N ASP 12.A O no hydrogen 2.912 N/A ALA 16.A N ASP 12.A OD1 no hydrogen 2.963 N/A TRP 18.A N ILE 10.A O no hydrogen 2.844 N/A TRP 18.A NE1 ASP 12.A OD2 no hydrogen 2.868 N/A LYS 19.A N ASP 31.A O no hydrogen 2.789 N/A LYS 19.A NZ SER 34.A O no hydrogen 2.657 N/A LYS 19.A NZ GLU 36.A O no hydrogen 2.843 N/A VAL 20.A N GLU 8.A O no hydrogen 3.204 N/A GLY 21.A N LEU 29.A O no hydrogen 2.769 N/A ILE 24.A N ILE 27.A O no hydrogen 3.131 N/A TYR 28.A N VAL 46.A O no hydrogen 2.859 N/A TYR 28.A OH GLN 3.A OE1 no hydrogen 2.530 N/A LEU 29.A N LEU 22.A O no hydrogen 2.808 N/A ALA 30.A N CYS 44.A O no hydrogen 2.962 N/A ASP 31.A N LYS 19.A O no hydrogen 3.190 N/A MET 32.A N ASP 31.A OD1 no hydrogen 2.715 N/A ASN 33.A N ALA 17.A O no hydrogen 3.156 N/A GLU 36.A N SER 34.A OG no hydrogen 3.033 N/A ALA 42.A N GLY 39.A O no hydrogen 3.097 N/A CYS 44.A N ALA 30.A O no hydrogen 3.216 N/A VAL 45.A N MET 107.A O no hydrogen 2.920 N/A VAL 46.A N TYR 28.A O no hydrogen 2.732 N/A LYS 47.A N MET 105.A O no hydrogen 2.947 N/A LYS 47.A NZ GLU 59.A OE1 no hydrogen 2.773 N/A LYS 47.A NZ GLU 59.A OE2 no hydrogen 3.452 N/A VAL 48.A N CYS 26.A O no hydrogen 3.128 N/A GLU 49.A N ARG 103.A O no hydrogen 3.119 N/A SER 51.A N SER 101.A O no hydrogen 2.873 N/A SER 51.A OG SER 101.A O no hydrogen 3.319 N/A ASN 53.A N PRO 50.A O no hydrogen 2.809 N/A LEU 56.A N ASN 53.A OD1 no hydrogen 2.928 N/A THR 58.A N GLY 54.A O no hydrogen 2.959 N/A THR 58.A OG1 GLY 54.A O no hydrogen 3.268 N/A GLU 59.A N PRO 55.A O no hydrogen 2.849 N/A LEU 60.A N LEU 56.A O no hydrogen 2.845 N/A LYS 61.A N PHE 57.A O no hydrogen 2.919 N/A LYS 61.A NZ GLN 64.A OE1 no hydrogen 3.282 N/A PHE 62.A N THR 58.A O no hydrogen 3.027 N/A TYR 63.A N GLU 59.A O no hydrogen 2.941 N/A GLN 64.A N LEU 60.A O no hydrogen 2.818 N/A GLN 64.A NE2 TYR 89.A OH no hydrogen 3.213 N/A ARG 65.A N LYS 61.A O no hydrogen 2.905 N/A ARG 65.A NH1 TYR 149.A OH no hydrogen 2.908 N/A ALA 66.A N PHE 62.A O no hydrogen 2.807 N/A ALA 67.A N TYR 63.A O no hydrogen 2.904 N/A LYS 68.A N GLN 71.A OE1 no hydrogen 3.164 N/A LYS 68.A NZ GLN 64.A O no hydrogen 2.770 N/A LYS 68.A NZ GLN 71.A OE1 no hydrogen 2.921 N/A GLU 70.A N GLU 70.A OE1 no hydrogen 2.765 N/A GLN 71.A NE2 ARG 65.A O no hydrogen 2.872 N/A ILE 72.A N LYS 68.A O no hydrogen 3.076 N/A GLN 73.A N PRO 69.A O no hydrogen 3.053 N/A LYS 74.A N GLU 70.A O no hydrogen 2.851 N/A TRP 75.A N GLN 71.A O no hydrogen 3.296 N/A ILE 76.A N ILE 72.A O no hydrogen 2.954 N/A ARG 77.A N GLN 73.A O no hydrogen 3.047 N/A THR 78.A N LYS 74.A O no hydrogen 2.987 N/A THR 78.A OG1 LYS 74.A O no hydrogen 3.096 N/A THR 78.A OG1 TRP 75.A O no hydrogen 3.186 N/A ARG 79.A N TRP 75.A O no hydrogen 2.898 N/A ARG 79.A NH1.A THR 78.A OG1 no hydrogen 2.862 N/A ARG 79.A NH2.B GLU 142.A OE2 no hydrogen 2.819 N/A LYS 80.A N ARG 77.A O no hydrogen 3.132 N/A LEU 81.A N ILE 76.A O no hydrogen 3.004 N/A TYR 83.A OH VAL 169.A O no hydrogen 2.644 N/A VAL 86.A N LEU 84.A O no hydrogen 2.814 N/A LYS 88.A N ASP 108.A OD2 no hydrogen 2.909 N/A LYS 88.A NZ GLN 73.A OE1 no hydrogen 2.781 N/A TYR 89.A N ALA 67.A O no hydrogen 3.127 N/A TYR 89.A OH SER 92.A OG no hydrogen 2.642 N/A TRP 90.A N ILE 106.A O no hydrogen 2.972 N/A TRP 90.A NE1 ASP 108.A OD1 no hydrogen 2.895 N/A SER 92.A OG TYR 89.A OH no hydrogen 2.642 N/A GLY 93.A N PHE 104.A O no hydrogen 2.952 N/A HIS 95.A N TYR 102.A O no hydrogen 2.987 N/A HIS 95.A NE2 GLN 3.A O no hydrogen 2.857 N/A LYS 97.A N LYS 100.A O no hydrogen 2.928 N/A LYS 100.A N LYS 97.A O no hydrogen 2.997 N/A SER 101.A OG ASP 96.A OD1 no hydrogen 2.899 N/A TYR 102.A N HIS 95.A O no hydrogen 2.779 N/A ARG 103.A N GLU 49.A O no hydrogen 2.812 N/A ARG 103.A NH2 SER 51.A O no hydrogen 2.842 N/A PHE 104.A N GLY 93.A O no hydrogen 3.021 N/A MET 105.A N LYS 47.A O no hydrogen 2.946 N/A ILE 106.A N GLY 91.A O no hydrogen 2.794 N/A MET 107.A N VAL 45.A O no hydrogen 2.993 N/A ASP 108.A N LYS 88.A O no hydrogen 3.455 N/A ARG 109.A N PRO 43.A O no hydrogen 2.932 N/A ARG 109.A NE PHE 110.A O no hydrogen 3.306 N/A ARG 109.A NH1 SER 40.A O no hydrogen 2.958 N/A ARG 109.A NH1 ALA 42.A O no hydrogen 2.802 N/A ARG 109.A NH2 SER 40.A O no hydrogen 3.007 N/A GLY 111.A N LEU 161.A O no hydrogen 2.820 N/A SER 112.A OG ASP 113.A O no hydrogen 2.748 N/A LEU 114.A N LEU 159.A O no hydrogen 2.803 N/A GLN 115.A NE2 GLU 119.A OE1 no hydrogen 2.805 N/A LYS 116.A N ASP 113.A OD1 no hydrogen 2.978 N/A TYR 118.A N LEU 114.A O no hydrogen 2.858 N/A TYR 118.A OH GLN 229.A O no hydrogen 2.774 N/A GLU 119.A N GLN 115.A O no hydrogen 2.951 N/A ALA 120.A N LYS 116.A O no hydrogen 2.999 N/A ASN 121.A N ILE 117.A O no hydrogen 2.948 N/A ASN 121.A N TYR 118.A O no hydrogen 3.091 N/A ASN 121.A ND2 ARG 124.A O no hydrogen 2.602 N/A ALA 122.A N GLU 119.A O no hydrogen 3.266 N/A LYS 123.A N TYR 118.A O no hydrogen 2.809 N/A ARG 124.A NH1 LYS 123.A O no hydrogen 2.843 N/A PHE 125.A N TRP 230.A O no hydrogen 2.856 N/A SER 126.A OG THR 129.A OG1 no hydrogen 2.902 N/A ARG 127.A NE GLU 274.A OE2 no hydrogen 2.835 N/A ARG 127.A NH2 GLU 274.A OE1 no hydrogen 2.765 N/A ARG 127.A NH2 GLU 274.A OE2 no hydrogen 3.304 N/A LYS 128.A NZ GLN 132.A OE1 no hydrogen 2.847 N/A LYS 128.A NZ SER 309.A OG no hydrogen 2.883 N/A LYS 128.A NZ ASP 312.A OD1 no hydrogen 2.770 N/A THR 129.A N SER 126.A OG no hydrogen 3.018 N/A THR 129.A OG1 SER 126.A OG no hydrogen 2.902 N/A THR 129.A OG1 LEU 315.A O no hydrogen 2.705 N/A THR 129.A OG1 ASP 316.A O no hydrogen 3.132 N/A VAL 130.A N SER 126.A O no hydrogen 2.822 N/A LEU 131.A N ARG 127.A O no hydrogen 2.979 N/A GLN 132.A N LYS 128.A O no hydrogen 2.986 N/A GLN 132.A NE2 ASP 311.A OD1 no hydrogen 2.893 N/A LEU 133.A N THR 129.A O no hydrogen 2.790 N/A SER 134.A N VAL 130.A O no hydrogen 2.930 N/A SER 134.A OG VAL 130.A O no hydrogen 2.753 N/A LEU 135.A N LEU 131.A O no hydrogen 2.948 N/A ARG 136.A NE ASP 139.A OD2 no hydrogen 3.117 N/A ARG 136.A NH1 ASP 311.A OD1 no hydrogen 2.982 N/A ARG 136.A NH1 ASP 311.A OD2 no hydrogen 3.337 N/A ARG 136.A NH2 ASP 139.A OD2 no hydrogen 3.475 N/A ARG 136.A NH2 ASP 311.A OD2 no hydrogen 3.203 N/A ILE 137.A N LEU 133.A O no hydrogen 2.963 N/A LEU 138.A N SER 134.A O no hydrogen 2.878 N/A ASP 139.A N LEU 135.A O no hydrogen 3.145 N/A ILE 140.A N ARG 136.A O no hydrogen 3.060 N/A LEU 141.A N ILE 137.A O no hydrogen 2.758 N/A GLU 142.A N LEU 138.A O no hydrogen 3.007 N/A TYR 143.A N ASP 139.A O no hydrogen 3.079 N/A TYR 143.A OH ALA 66.A O no hydrogen 2.540 N/A ILE 144.A N ILE 140.A O no hydrogen 2.926 N/A HIS 145.A N LEU 141.A O no hydrogen 2.885 N/A HIS 145.A ND1 TYR 293.A OH no hydrogen 2.509 N/A HIS 145.A NE2 ASP 219.A OD2 no hydrogen 2.866 N/A GLU 146.A N GLU 142.A O no hydrogen 2.922 N/A HIS 147.A N TYR 143.A O no hydrogen 3.146 N/A HIS 147.A N ILE 144.A O no hydrogen 3.018 N/A HIS 147.A ND1 TYR 143.A O no hydrogen 2.853 N/A GLU 148.A N HIS 145.A O no hydrogen 3.090 N/A TYR 149.A N ILE 144.A O no hydrogen 3.021 N/A VAL 150.A N TYR 178.A O no hydrogen 2.880 N/A HIS 151.A N ASP 219.A OD2 no hydrogen 2.971 N/A HIS 151.A NE2 VAL 172.A O no hydrogen 2.716 N/A GLY 152.A N ASP 219.A OD1 no hydrogen 2.740 N/A LYS 155.A NZ THR 200.A OG1 no hydrogen 2.803 N/A ASN 158.A N LYS 155.A O no hydrogen 2.930 N/A ASN 158.A ND2 ASP 153.A O no hydrogen 3.126 N/A LEU 159.A N ALA 156.A O no hydrogen 3.183 N/A LEU 160.A N TYR 170.A O no hydrogen 2.872 N/A LEU 161.A N SER 112.A O no hydrogen 2.929 N/A ASN 162.A N GLN 168.A O no hydrogen 2.929 N/A ASN 162.A ND2 GLN 168.A OE1 no hydrogen 2.956 N/A LYS 164.A N ASN 162.A OD1 no hydrogen 2.774 N/A ASN 165.A N ASN 162.A O no hydrogen 3.156 N/A ASP 167.A N ASN 165.A OD1 no hydrogen 3.033 N/A GLN 168.A N ASN 165.A O no hydrogen 3.210 N/A VAL 169.A N TYR 83.A OH no hydrogen 2.793 N/A TYR 170.A N LEU 160.A O no hydrogen 2.739 N/A LEU 171.A N GLY 85.A O no hydrogen 2.936 N/A VAL 172.A N ASN 158.A O no hydrogen 2.906 N/A TYR 174.A N GLU 59.A OE2 no hydrogen 2.817 N/A TYR 174.A OH LEU 171.A O no hydrogen 2.800 N/A GLY 175.A N ASP 173.A OD1 no hydrogen 3.167 N/A ALA 177.A N TYR 174.A O no hydrogen 3.128 N/A TYR 178.A N VAL 150.A O no hydrogen 3.049 N/A TYR 178.A OH ASP 192.A OD2 no hydrogen 2.679 N/A ARG 179.A NE GLU 148.A OE1 no hydrogen 3.372 N/A ARG 179.A NH2 GLU 148.A OE1 no hydrogen 3.256 N/A TYR 180.A OH HIS 145.A O no hydrogen 2.679 N/A CYS 181.A N GLU 148.A O no hydrogen 3.452 N/A GLU 183.A N GLU 148.A OE1 no hydrogen 3.326 N/A GLY 184.A N CYS 181.A O no hydrogen 2.939 N/A VAL 185.A N PRO 182.A O no hydrogen 3.171 N/A HIS 186.A ND1 LYS 187.A O no hydrogen 2.733 N/A LYS 187.A N TYR 180.A O no hydrogen 2.888 N/A LYS 187.A NZ ASP 192.A OD2 no hydrogen 3.313 N/A LYS 194.A N ASP 192.A OD1 no hydrogen 2.996 N/A ARG 195.A N ASP 192.A O no hydrogen 3.208 N/A ARG 195.A NE HIS 197.A O no hydrogen 3.136 N/A ARG 195.A NH1 LEU 176.A O no hydrogen 2.804 N/A HIS 197.A NE2 ASP 153.A OD2 no hydrogen 3.374 N/A THR 200.A OG1 ASP 153.A OD1 no hydrogen 2.609 N/A THR 200.A OG1 ASP 153.A OD2 no hydrogen 3.405 N/A GLU 202.A N GLU 202.A OE1 no hydrogen 2.811 N/A PHE 203.A N THR 200.A O no hydrogen 2.942 N/A THR 204.A N THR 200.A O no hydrogen 2.792 N/A THR 204.A OG1 ASP 198.A O no hydrogen 2.698 N/A ILE 206.A N GLU 221.A OE2 no hydrogen 2.923 N/A ALA 208.A N SER 205.A OG no hydrogen 2.942 N/A HIS 209.A N SER 205.A O no hydrogen 2.904 N/A ASN 210.A N ILE 206.A O no hydrogen 2.811 N/A GLY 211.A N ALA 208.A O no hydrogen 2.972 N/A VAL 212.A N ASP 207.A O no hydrogen 3.170 N/A ALA 213.A N ALA 190.A O no hydrogen 3.067 N/A SER 215.A OG TYR 287.A O no hydrogen 2.852 N/A ARG 216.A NH2 THR 288.A O no hydrogen 3.019 N/A ARG 217.A NE ASP 207.A OD2 no hydrogen 2.782 N/A ARG 217.A NH1 LEU 285.A O no hydrogen 2.829 N/A ARG 217.A NH2 ASP 207.A OD1 no hydrogen 2.850 N/A ARG 217.A NH2 ASP 207.A OD2 no hydrogen 3.541 N/A ASP 219.A N SER 215.A O no hydrogen 3.411 N/A LEU 220.A N ARG 216.A O no hydrogen 3.323 N/A GLU 221.A N ARG 217.A O no hydrogen 2.863 N/A ILE 222.A N GLY 218.A O no hydrogen 2.878 N/A LEU 223.A N ASP 219.A O no hydrogen 3.097 N/A GLY 224.A N LEU 220.A O no hydrogen 3.082 N/A TYR 225.A N GLU 221.A O no hydrogen 3.070 N/A TYR 225.A OH GLU 221.A OE2 no hydrogen 2.756 N/A CYS 226.A N ILE 222.A O no hydrogen 2.922 N/A CYS 226.A SG ILE 154.A O no hydrogen 3.397 N/A CYS 226.A SG ILE 222.A O no hydrogen 3.573 N/A MET 227.A N LEU 223.A O no hydrogen 2.877 N/A ILE 228.A N GLY 224.A O no hydrogen 3.282 N/A GLN 229.A N TYR 225.A O no hydrogen 2.983 N/A GLN 229.A NE2 TYR 118.A OH no hydrogen 2.845 N/A TRP 230.A N CYS 226.A O no hydrogen 2.841 N/A LEU 231.A N MET 227.A O no hydrogen 2.908 N/A THR 232.A N ILE 228.A O no hydrogen 2.985 N/A THR 232.A OG1 ILE 228.A O no hydrogen 2.754 N/A GLY 233.A N GLN 229.A O no hydrogen 2.846 N/A HIS 234.A N THR 232.A OG1 no hydrogen 3.061 N/A HIS 234.A ND1 GLU 238.A OE1 no hydrogen 2.707 N/A LEU 235.A N GLU 238.A OE2 no hydrogen 3.242 N/A TRP 237.A NE1 GLU 202.A O no hydrogen 2.795 N/A GLU 238.A N LEU 235.A O no hydrogen 3.169 N/A ASN 240.A N TRP 237.A O no hydrogen 3.000 N/A ASP 243.A N ASN 240.A O no hydrogen 3.000 N/A LYS 245.A N ASP 243.A OD1 no hydrogen 3.173 N/A LYS 245.A NZ ASP 243.A OD1 no hydrogen 2.862 N/A VAL 247.A N ASP 243.A O no hydrogen 3.191 N/A ARG 248.A N PRO 244.A O no hydrogen 2.953 N/A ARG 248.A NH1 ASN 210.A OD1 no hydrogen 2.871 N/A ASP 249.A N LYS 245.A O no hydrogen 2.948 N/A SER 250.A N TYR 246.A O no hydrogen 2.929 N/A SER 250.A OG TYR 246.A O no hydrogen 3.193 N/A LYS 251.A N VAL 247.A O no hydrogen 3.084 N/A LYS 251.A NZ ILE 201.A O no hydrogen 2.847 N/A LYS 251.A NZ THR 204.A O no hydrogen 2.706 N/A LYS 251.A NZ HIS 209.A NE2 no hydrogen 2.969 N/A ILE 252.A N ARG 248.A O no hydrogen 2.888 N/A ARG 253.A N ASP 249.A O no hydrogen 3.030 N/A ARG 253.A NE ASP 249.A OD1 no hydrogen 3.341 N/A ARG 253.A NE ASP 249.A OD2 no hydrogen 3.078 N/A TYR 254.A N SER 250.A O no hydrogen 2.886 N/A ARG 255.A N LYS 251.A O no hydrogen 2.924 N/A GLU 256.A N ILE 252.A O no hydrogen 2.982 N/A ASN 257.A N ARG 253.A O no hydrogen 3.011 N/A SER 260.A N ASN 257.A O no hydrogen 3.075 N/A SER 260.A N ASN 257.A OD1 no hydrogen 3.414 N/A SER 260.A OG ASN 257.A O no hydrogen 2.858 N/A LEU 261.A N ASN 257.A O no hydrogen 3.378 N/A MET 262.A N ILE 258.A O no hydrogen 2.926 N/A ASP 263.A N ALA 259.A O no hydrogen 2.967 N/A LYS 264.A N SER 260.A O no hydrogen 2.899 N/A CYS 265.A N LEU 261.A O no hydrogen 2.911 N/A CYS 265.A SG LEU 261.A O no hydrogen 3.351 N/A PHE 266.A N MET 262.A O no hydrogen 3.068 N/A ASN 270.A N PRO 267.A O no hydrogen 3.041 N/A GLU 274.A N GLU 274.A OE1 no hydrogen 2.650 N/A ILE 275.A N PRO 272.A O no hydrogen 3.076 N/A LYS 277.A N GLY 273.A O no hydrogen 3.030 N/A TYR 278.A N GLU 274.A O no hydrogen 2.948 N/A TYR 278.A OH LEU 220.A O no hydrogen 2.690 N/A MET 279.A N.A ILE 275.A O no hydrogen 3.008 N/A MET 279.A N.B ILE 275.A O no hydrogen 3.032 N/A GLU 280.A N ALA 276.A O no hydrogen 2.924 N/A THR 281.A N LYS 277.A O no hydrogen 2.941 N/A THR 281.A OG1 LYS 277.A O no hydrogen 2.893 N/A VAL 282.A N TYR 278.A O no hydrogen 3.028 N/A LYS 283.A N MET 279.A O.A no hydrogen 2.912 N/A LYS 283.A N MET 279.A O.B no hydrogen 2.926 N/A LYS 283.A NZ ARG 255.A O no hydrogen 2.766 N/A LYS 283.A NZ GLU 256.A O no hydrogen 3.242 N/A LEU 284.A N THR 281.A O no hydrogen 3.155 N/A LEU 285.A N VAL 282.A O no hydrogen 3.064 N/A ASP 286.A N GLU 289.A OE1 no hydrogen 2.904 N/A TYR 287.A OH ALA 213.A O no hydrogen 2.559 N/A GLU 289.A N ASP 286.A O no hydrogen 3.094 N/A LYS 290.A NZ GLU 146.A OE2 no hydrogen 3.343 N/A TYR 293.A OH HIS 145.A ND1 no hydrogen 2.509 N/A LEU 296.A N LEU 292.A O no hydrogen 3.192 N/A ARG 297.A N TYR 293.A O no hydrogen 2.897 N/A ARG 297.A NE GLU 294.A OE1 no hydrogen 3.238 N/A ARG 297.A NH1 GLU 142.A OE1 no hydrogen 3.029 N/A ARG 297.A NH2 GLU 142.A OE1 no hydrogen 2.871 N/A ARG 297.A NH2 GLU 294.A OE1 no hydrogen 2.723 N/A ASP 298.A N GLU 294.A O no hydrogen 2.849 N/A ILE 299.A N ASN 295.A O no hydrogen 2.987 N/A LEU 300.A N LEU 296.A O no hydrogen 3.238 N/A LEU 301.A N ARG 297.A O no hydrogen 2.733 N/A GLN 302.A N ASP 298.A O no hydrogen 2.796 N/A GLY 303.A N ILE 299.A O no hydrogen 3.303 N/A LEU 304.A N LEU 300.A O no hydrogen 3.091 N/A LYS 305.A N LEU 301.A O no hydrogen 3.136 N/A ALA 306.A N GLN 302.A O no hydrogen 3.003 N/A ILE 307.A N GLY 303.A O no hydrogen 3.240 N/A ILE 307.A N LEU 304.A O no hydrogen 3.211 N/A GLY 308.A N LYS 305.A O no hydrogen 2.817 N/A SER 309.A N LEU 304.A O no hydrogen 2.828 N/A GLY 313.A N ASP 311.A OD1 no hydrogen 3.215 N/A LYS 314.A N ASP 312.A OD1 no hydrogen 3.239 N/A LEU 315.A N ASP 167.A OD1 no hydrogen 3.061 N/A