Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3t6e_M.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N ASP 2.A O no hydrogen 3.056 N/A THR 5.A OG1 ASP 2.A O no hydrogen 2.745 N/A ILE 6.A N TYR 3.A O no hydrogen 2.919 N/A TYR 7.A N TYR 3.A O no hydrogen 3.059 N/A THR 8.A N LYS 40.A O no hydrogen 2.788 N/A GLN 9.A N GLN 4.A OE1 no hydrogen 3.401 N/A GLN 9.A NE2 GLN 4.A OE1 no hydrogen 2.950 N/A GLN 11.A NE2 TYR 36.A O no hydrogen 2.895 N/A ARG 13.A NH1 GLN 11.A OE1 no hydrogen 3.049 N/A ARG 13.A NH1 ALA 12.A O no hydrogen 3.125 N/A ARG 13.A NH2 GLN 11.A OE1 no hydrogen 2.932 N/A SER 20.A OG GLY 21.A O no hydrogen 3.396 N/A SER 20.A OG ASP 25.A OD2 no hydrogen 2.466 N/A GLY 21.A N ASP 25.A OD1 no hydrogen 2.908 N/A GLU 22.A N ALA 137.A O no hydrogen 2.938 N/A ASP 27.A N GLY 24.A O no hydrogen 2.789 N/A ARG 28.A NH2 VAL 19.A O no hydrogen 3.128 N/A VAL 29.A N ILE 49.A O no hydrogen 2.868 N/A PHE 33.A N ILE 46.A O no hydrogen 2.938 N/A SER 35.A N ALA 44.A O no hydrogen 2.928 N/A LEU 38.A N SER 35.A OG no hydrogen 3.159 N/A GLY 39.A N SER 35.A O no hydrogen 2.955 N/A LYS 40.A N TRP 37.A O no hydrogen 3.165 N/A LYS 40.A NZ TYR 36.A OH no hydrogen 2.952 N/A ILE 41.A N LEU 38.A O no hydrogen 2.981 N/A GLY 42.A N LEU 38.A O no hydrogen 2.767 N/A GLN 45.A N ASP 43.A OD1 no hydrogen 2.977 N/A GLN 45.A NE2 GLY 47.A O no hydrogen 2.923 N/A ILE 46.A N PHE 33.A O no hydrogen 2.762 N/A ILE 49.A N VAL 29.A O no hydrogen 2.896 N/A LEU 51.A N ASP 27.A O no hydrogen 2.872 N/A ILE 56.A N GLY 52.A O no hydrogen 3.139 N/A ALA 57.A N ALA 53.A O no hydrogen 2.815 N/A ALA 58.A N SER 54.A O no hydrogen 2.804 N/A PHE 59.A N GLY 55.A O no hydrogen 3.029 N/A ALA 60.A N ILE 56.A O no hydrogen 2.938 N/A PHE 61.A N ALA 57.A O no hydrogen 2.952 N/A GLY 62.A N ALA 58.A O no hydrogen 2.820 N/A SER 63.A N PHE 59.A O no hydrogen 2.902 N/A SER 63.A OG PHE 59.A O no hydrogen 2.832 N/A THR 64.A N ALA 60.A O no hydrogen 3.067 N/A THR 64.A OG1 ALA 60.A O no hydrogen 2.855 N/A ALA 65.A N PHE 61.A O no hydrogen 3.075 N/A ILE 66.A N GLY 62.A O no hydrogen 2.921 N/A LEU 67.A N SER 63.A O no hydrogen 2.806 N/A ILE 68.A N THR 64.A O no hydrogen 3.029 N/A ILE 69.A N ALA 65.A O no hydrogen 3.015 N/A LEU 70.A N ILE 66.A O no hydrogen 2.950 N/A PHE 71.A N.A LEU 67.A O no hydrogen 2.942 N/A PHE 71.A N.B LEU 67.A O no hydrogen 2.950 N/A ASN 72.A N ILE 68.A O no hydrogen 3.205 N/A ASN 72.A ND2 ILE 68.A O no hydrogen 2.749 N/A MET 73.A N ILE 69.A O no hydrogen 2.839 N/A ALA 74.A N LEU 70.A O no hydrogen 2.828 N/A ALA 75.A N PHE 71.A O.A no hydrogen 3.052 N/A ALA 75.A N PHE 71.A O.B no hydrogen 2.901 N/A GLU 76.A N ASN 72.A O no hydrogen 3.153 N/A GLU 76.A N MET 73.A O no hydrogen 2.958 N/A VAL 77.A N ALA 74.A O no hydrogen 3.145 N/A HIS 78.A N ALA 75.A O no hydrogen 2.983 N/A PHE 79.A N ALA 74.A O no hydrogen 2.825 N/A ASP 80.A N VAL 77.A O no hydrogen 3.054 N/A GLN 83.A N ASP 80.A OD1 no hydrogen 2.932 N/A PHE 84.A N ASP 80.A O no hydrogen 2.864 N/A PHE 85.A N PRO 81.A O no hydrogen 3.055 N/A ARG 86.A N LEU 82.A O no hydrogen 2.947 N/A ARG 86.A NH1 GLN 83.A OE1 no hydrogen 2.961 N/A GLN 87.A N GLN 83.A O no hydrogen 2.885 N/A GLN 87.A NE2 GLN 83.A OE1 no hydrogen 2.861 N/A TRP 90.A N GLN 87.A O no hydrogen 2.774 N/A LEU 91.A N PHE 88.A O no hydrogen 3.118 N/A GLY 92.A N GLU 76.A OE1 no hydrogen 2.911 N/A LEU 93.A N PHE 174.A O no hydrogen 2.891 N/A LYS 97.A N ASP 109.A OD1 no hydrogen 2.825 N/A ALA 98.A N ASP 109.A OD2 no hydrogen 3.186 N/A TYR 100.A OH ASP 109.A OD2 no hydrogen 2.668 N/A GLY 101.A N GLN 99.A OE1 no hydrogen 2.852 N/A GLY 103.A N TYR 100.A O no hydrogen 3.041 N/A ASP 109.A N PRO 106.A O no hydrogen 2.849 N/A GLY 111.A N PRO 106.A O no hydrogen 2.938 N/A TRP 113.A NE1 VAL 172.A O no hydrogen 2.776 N/A LEU 114.A N GLY 110.A O no hydrogen 3.045 N/A MET 115.A N.A GLY 111.A O no hydrogen 3.134 N/A MET 115.A N.B GLY 111.A O no hydrogen 3.133 N/A ALA 116.A N TRP 112.A O no hydrogen 2.907 N/A GLY 117.A N TRP 113.A O no hydrogen 2.883 N/A LEU 118.A N LEU 114.A O no hydrogen 3.019 N/A PHE 119.A N MET 115.A O.A no hydrogen 3.127 N/A PHE 119.A N MET 115.A O.B no hydrogen 3.142 N/A MET 120.A N ALA 116.A O no hydrogen 2.832 N/A THR 121.A N GLY 117.A O no hydrogen 2.892 N/A THR 121.A OG1 GLY 117.A O no hydrogen 2.870 N/A LEU 122.A N LEU 118.A O no hydrogen 2.955 N/A SER 123.A N.A PHE 119.A O no hydrogen 2.969 N/A SER 123.A N.B PHE 119.A O no hydrogen 2.991 N/A SER 123.A N.B MET 120.A O no hydrogen 3.067 N/A SER 123.A OG.A ALA 58.A O no hydrogen 2.643 N/A SER 123.A OG.B MET 120.A O no hydrogen 2.803 N/A LEU 124.A N MET 120.A O no hydrogen 2.934 N/A GLY 125.A N THR 121.A O no hydrogen 2.987 N/A SER 126.A N LEU 122.A O no hydrogen 3.011 N/A SER 126.A OG LEU 122.A O no hydrogen 2.817 N/A TRP 127.A N SER 123.A O.A no hydrogen 2.838 N/A TRP 127.A N SER 123.A O.B no hydrogen 3.002 N/A TRP 128.A N LEU 124.A O no hydrogen 2.912 N/A TRP 128.A NE1 ALA 145.A O no hydrogen 2.823 N/A ILE 129.A N GLY 125.A O no hydrogen 3.117 N/A ARG 130.A N SER 126.A O no hydrogen 3.294 N/A ARG 130.A NH1 TYR 50.A O no hydrogen 3.103 N/A ARG 130.A NH1 LEU 51.A O no hydrogen 2.841 N/A ARG 130.A NH2 TYR 50.A O no hydrogen 2.805 N/A VAL 131.A N TRP 127.A O no hydrogen 2.957 N/A TYR 132.A N TRP 128.A O no hydrogen 2.901 N/A SER 133.A N ILE 129.A O no hydrogen 2.693 N/A SER 133.A OG ILE 129.A O no hydrogen 2.724 N/A ARG 134.A N ARG 130.A O no hydrogen 2.915 N/A ARG 134.A NH2 TRP 23.A O no hydrogen 3.073 N/A ARG 136.A N TYR 132.A O no hydrogen 3.229 N/A ALA 137.A N SER 133.A O no hydrogen 2.823 N/A LEU 138.A N ARG 134.A O no hydrogen 3.134 N/A LEU 138.A N ALA 135.A O no hydrogen 3.176 N/A GLY 139.A N ARG 136.A O no hydrogen 3.070 N/A LEU 140.A N ALA 135.A O no hydrogen 2.830 N/A TRP 146.A N THR 142.A O no hydrogen 3.240 N/A ASN 147.A N HIS 143.A O no hydrogen 3.259 N/A ASN 147.A ND2 SER 270.A OG no hydrogen 3.295 N/A PHE 148.A N ILE 144.A O no hydrogen 2.917 N/A ALA 149.A N ALA 145.A O no hydrogen 2.869 N/A ALA 150.A N TRP 146.A O no hydrogen 3.310 N/A ALA 151.A N ASN 147.A O no hydrogen 3.381 N/A ILE 152.A N PHE 148.A O no hydrogen 2.926 N/A PHE 153.A N ALA 149.A O no hydrogen 2.884 N/A PHE 154.A N ALA 150.A O no hydrogen 3.072 N/A VAL 155.A N ALA 151.A O no hydrogen 3.174 N/A LEU 156.A N ILE 152.A O no hydrogen 2.932 N/A CYS 157.A N PHE 153.A O no hydrogen 2.812 N/A CYS 157.A SG PHE 153.A O no hydrogen 3.384 N/A ILE 158.A N PHE 154.A O no hydrogen 3.056 N/A GLY 159.A N VAL 155.A O no hydrogen 2.922 N/A HIS 161.A N.A CYS 157.A O no hydrogen 2.920 N/A HIS 161.A N.B CYS 157.A O no hydrogen 2.935 N/A HIS 161.A NE2.A GLU 170.A OE1 no hydrogen 2.787 N/A LEU 164.A N ILE 160.A O no hydrogen 2.838 N/A VAL 165.A N HIS 161.A O.A no hydrogen 3.033 N/A VAL 165.A N HIS 161.A O.B no hydrogen 3.125 N/A SER 167.A N PRO 162.A O no hydrogen 2.777 N/A SER 167.A OG GLN 99.A OE1 no hydrogen 2.630 N/A SER 167.A OG SER 169.A OG no hydrogen 2.702 N/A TRP 168.A N GLY 101.A O no hydrogen 3.279 N/A SER 169.A N SER 167.A OG no hydrogen 3.155 N/A SER 169.A OG SER 167.A OG no hydrogen 2.702 N/A GLU 170.A N SER 167.A O no hydrogen 3.372 N/A GLY 171.A N TRP 168.A O no hydrogen 3.238 N/A PHE 174.A N LEU 93.A O no hydrogen 3.011 N/A TRP 177.A N PHE 89.A O no hydrogen 2.810 N/A HIS 179.A N GLY 175.A O no hydrogen 3.038 N/A HIS 179.A ND1 GLY 175.A O no hydrogen 3.023 N/A HIS 179.A ND1 ILE 176.A O no hydrogen 2.815 N/A ASP 181.A N TRP 177.A O no hydrogen 2.884 N/A TRP 182.A N PRO 178.A O no hydrogen 3.213 N/A TRP 182.A NE1 GLU 170.A O no hydrogen 3.072 N/A LEU 183.A N ILE 180.A O no hydrogen 3.056 N/A ALA 185.A N ASP 181.A O no hydrogen 3.114 N/A PHE 186.A N TRP 182.A O no hydrogen 2.913 N/A SER 187.A N LEU 183.A O no hydrogen 3.014 N/A ILE 188.A N THR 184.A O no hydrogen 2.924 N/A ARG 189.A N ALA 185.A O no hydrogen 2.933 N/A ARG 189.A NH1 ARG 189.A O no hydrogen 2.819 N/A ARG 189.A NH1 ASP 289.A OD1 no hydrogen 3.019 N/A ARG 189.A NH2 ASP 289.A OD1 no hydrogen 3.238 N/A TYR 190.A N PHE 186.A O no hydrogen 3.075 N/A TYR 190.A OH HIS 161.A NE2.A no hydrogen 3.319 N/A TYR 190.A OH HIS 161.A NE2.B no hydrogen 3.312 N/A TYR 190.A OH GLU 170.A OE1 no hydrogen 2.700 N/A GLY 191.A N ILE 188.A O no hydrogen 3.180 N/A ASN 192.A N SER 187.A O no hydrogen 2.860 N/A PHE 193.A N SER 187.A OG no hydrogen 2.966 N/A TYR 194.A N ASN 192.A OD1 no hydrogen 3.084 N/A TYR 195.A N ASN 192.A O no hydrogen 3.014 N/A CYS 196.A N PHE 193.A O no hydrogen 3.052 N/A GLY 200.A N CYS 196.A O no hydrogen 3.186 N/A PHE 201.A N PRO 197.A O no hydrogen 2.771 N/A SER 202.A N TRP 198.A O no hydrogen 2.939 N/A SER 202.A OG VAL 273.A O no hydrogen 2.873 N/A ILE 203.A N HIS 199.A O no hydrogen 2.934 N/A GLY 204.A N GLY 200.A O no hydrogen 2.867 N/A PHE 205.A N PHE 201.A O no hydrogen 2.938 N/A ALA 206.A N SER 202.A O no hydrogen 2.916 N/A TYR 207.A N ILE 203.A O no hydrogen 2.761 N/A GLY 208.A N GLY 204.A O no hydrogen 2.887 N/A CYS 209.A N PHE 205.A O no hydrogen 2.760 N/A CYS 209.A SG PHE 205.A O no hydrogen 3.308 N/A GLY 210.A N ALA 206.A O no hydrogen 3.177 N/A LEU 211.A N TYR 207.A O no hydrogen 2.898 N/A LEU 212.A N GLY 208.A O no hydrogen 2.839 N/A PHE 213.A N CYS 209.A O no hydrogen 2.930 N/A ALA 214.A N GLY 210.A O no hydrogen 3.000 N/A ALA 215.A N LEU 211.A O no hydrogen 2.824 N/A HIS 216.A N LEU 212.A O no hydrogen 2.751 N/A GLY 217.A N PHE 213.A O no hydrogen 2.792 N/A ALA 218.A N ALA 214.A O no hydrogen 2.941 N/A THR 219.A N ALA 215.A O no hydrogen 2.827 N/A THR 219.A OG1 ALA 215.A O no hydrogen 2.675 N/A ILE 220.A N HIS 216.A O no hydrogen 3.032 N/A LEU 221.A N GLY 217.A O no hydrogen 3.071 N/A ALA 222.A N ALA 218.A O no hydrogen 2.829 N/A VAL 223.A N THR 219.A O no hydrogen 3.029 N/A VAL 223.A N ILE 220.A O no hydrogen 3.161 N/A ALA 224.A N LEU 221.A O no hydrogen 3.156 N/A PHE 226.A N VAL 223.A O no hydrogen 3.035 N/A GLY 227.A N ALA 224.A O no hydrogen 3.005 N/A GLY 228.A N VAL 223.A O no hydrogen 3.099 N/A ARG 230.A N GLY 227.A O no hydrogen 3.037 N/A GLN 234.A N ARG 230.A O no hydrogen 3.206 N/A ILE 235.A N GLU 231.A O no hydrogen 2.935 N/A THR 236.A N ILE 232.A O no hydrogen 3.094 N/A THR 236.A OG1 ILE 232.A O no hydrogen 3.520 N/A ASP 237.A N GLU 233.A O no hydrogen 2.672 N/A ARG 238.A NE GLU 243.A OE2 no hydrogen 2.850 N/A ARG 238.A NH2 GLU 243.A OE2 no hydrogen 3.191 N/A GLY 239.A N GLN 234.A OE1 no hydrogen 2.874 N/A VAL 242.A N GLY 239.A O no hydrogen 3.130 N/A GLU 243.A N GLY 239.A O no hydrogen 3.115 N/A ARG 244.A N THR 240.A O no hydrogen 2.906 N/A ARG 244.A NE THR 240.A OG1 no hydrogen 2.819 N/A ARG 244.A NH2 THR 240.A OG1 no hydrogen 3.422 N/A ALA 245.A N ALA 241.A O no hydrogen 3.013 N/A ALA 246.A N VAL 242.A O no hydrogen 3.011 N/A LEU 247.A N GLU 243.A O no hydrogen 3.058 N/A PHE 248.A N ARG 244.A O no hydrogen 2.949 N/A TRP 249.A N ALA 245.A O no hydrogen 3.341 N/A TRP 249.A NE1 THR 219.A OG1 no hydrogen 2.932 N/A ARG 250.A N ALA 246.A O no hydrogen 2.894 N/A ARG 250.A NH1 ASN 256.A OD1 no hydrogen 2.815 N/A TRP 251.A N LEU 247.A O no hydrogen 2.900 N/A THR 252.A N PHE 248.A O no hydrogen 3.003 N/A THR 252.A OG1 PHE 248.A O no hydrogen 2.688 N/A ILE 253.A N TRP 249.A O no hydrogen 2.750 N/A GLY 254.A N ARG 250.A O no hydrogen 2.805 N/A ASN 256.A ND2 ALA 257.A O no hydrogen 3.014 N/A THR 258.A N SER 261.A OG no hydrogen 2.862 N/A THR 258.A OG1 SER 261.A OG no hydrogen 3.113 N/A SER 261.A N THR 258.A OG1 no hydrogen 2.974 N/A SER 261.A OG THR 258.A O no hydrogen 3.451 N/A SER 261.A OG THR 258.A OG1 no hydrogen 3.113 N/A VAL 262.A N THR 258.A O no hydrogen 2.980 N/A HIS 263.A N GLU 260.A O no hydrogen 3.024 N/A HIS 263.A ND1 ILE 259.A O no hydrogen 2.673 N/A ARG 264.A NH2 GLU 260.A OE2 no hydrogen 2.798 N/A TRP 265.A N SER 261.A O no hydrogen 2.925 N/A GLY 266.A N VAL 262.A O no hydrogen 3.069 N/A TRP 267.A N HIS 263.A O no hydrogen 2.892 N/A TRP 267.A NE1 HIS 143.A O no hydrogen 2.842 N/A PHE 268.A N ARG 264.A O no hydrogen 2.925 N/A PHE 269.A N TRP 265.A O no hydrogen 2.843 N/A SER 270.A N GLY 266.A O no hydrogen 3.049 N/A SER 270.A OG ASN 147.A OD1 no hydrogen 3.484 N/A LEU 271.A N TRP 267.A O no hydrogen 2.882 N/A MET 272.A N PHE 268.A O no hydrogen 2.913 N/A VAL 273.A N PHE 269.A O no hydrogen 3.190 N/A VAL 273.A N SER 270.A O no hydrogen 3.213 N/A VAL 275.A N LEU 271.A O no hydrogen 2.961 N/A SER 276.A N MET 272.A O no hydrogen 2.916 N/A SER 276.A OG MET 272.A O no hydrogen 2.889 N/A ALA 277.A N VAL 273.A O no hydrogen 3.076 N/A SER 278.A N MET 274.A O no hydrogen 2.911 N/A SER 278.A OG MET 274.A O no hydrogen 2.744 N/A VAL 279.A N VAL 275.A O no hydrogen 2.991 N/A GLY 280.A N SER 276.A O no hydrogen 3.030 N/A ILE 281.A N ALA 277.A O no hydrogen 2.973 N/A LEU 282.A N SER 278.A O no hydrogen 2.878 N/A LEU 283.A N VAL 279.A O no hydrogen 2.981 N/A THR 284.A N GLY 280.A O no hydrogen 3.031 N/A THR 284.A N ILE 281.A O no hydrogen 3.213 N/A THR 284.A OG1 GLY 280.A O no hydrogen 2.824 N/A GLY 285.A N VAL 288.A O no hydrogen 2.796 N/A THR 286.A OG1 LEU 282.A O no hydrogen 2.846 N/A PHE 287.A N LEU 283.A O no hydrogen 2.961 N/A VAL 288.A N LEU 283.A O no hydrogen 3.139 N/A TRP 291.A N TYR 190.A O no hydrogen 2.944 N/A TRP 291.A NE1 THR 284.A OG1 no hydrogen 2.986 N/A TYR 292.A N GLY 191.A O no hydrogen 2.984 N/A LEU 293.A N ASN 290.A OD1 no hydrogen 2.951 N/A TRP 294.A N ASN 290.A O no hydrogen 2.903 N/A CYS 295.A N TRP 291.A O no hydrogen 2.937 N/A CYS 295.A SG TYR 195.A O no hydrogen 3.133 N/A CYS 295.A SG TRP 291.A O no hydrogen 3.635 N/A VAL 296.A N TYR 292.A O no hydrogen 2.885 N/A LYS 297.A N LEU 293.A O no hydrogen 2.851 N/A HIS 298.A N TRP 294.A O no hydrogen 3.061 N/A GLY 299.A N VAL 296.A O no hydrogen 2.996 N/A ALA 300.A N CYS 295.A O no hydrogen 2.978 N/A THR 311.A OG1 PRO 309.A O no hydrogen 2.944 N/A ALA 315.A N ASP 313.A OD1 no hydrogen 2.971 N/A SER 316.A N ASP 313.A O no hydrogen 3.043 N/A SER 316.A OG ASP 313.A O no hydrogen 2.716 N/A LEU 317.A N PRO 314.A O no hydrogen 3.039 N/A ALA 320.A N LEU 317.A O no hydrogen 3.068 N/A