Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ef2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 57.A OD1 no hydrogen 2.531 N/A ARG 4.A NE GLU 50.A OE1 no hydrogen 2.902 N/A ARG 4.A NH1 GLY 236.A O no hydrogen 3.119 N/A ARG 4.A NH2 GLU 50.A OE2 no hydrogen 2.819 N/A ARG 4.A NH2 GLY 236.A O no hydrogen 2.788 N/A GLY 5.A N ALA 49.A O no hydrogen 3.345 N/A ILE 6.A N SER 156.A OG no hydrogen 2.885 N/A TYR 7.A N TRP 47.A O no hydrogen 2.799 N/A TYR 7.A OH ARG 3.A O no hydrogen 2.677 N/A HIS 8.A N ASN 153.A O no hydrogen 2.915 N/A HIS 8.A ND1 GLU 10.A OE2.A no hydrogen 2.572 N/A HIS 8.A NE2 GLN 45.A OE1 no hydrogen 2.747 N/A GLU 10.A N TYR 151.A O no hydrogen 2.923 N/A ASN 11.A N SER 16.A O no hydrogen 2.819 N/A ASN 11.A ND2 PRO 146.A O no hydrogen 2.915 N/A ALA 12.A N LYS 149.A O no hydrogen 2.905 N/A GLY 13.A N ASN 11.A OD1 no hydrogen 2.821 N/A VAL 14.A N ASN 11.A OD1 no hydrogen 3.108 N/A SER 16.A N VAL 14.A O no hydrogen 2.755 N/A SER 16.A OG SER 128.A O no hydrogen 3.395 N/A ALA 17.A N TRP 34.A O no hydrogen 2.768 N/A ILE 18.A N ILE 9.A O no hydrogen 2.829 N/A ASP 19.A N VAL 32.A O no hydrogen 2.858 N/A LEU 20.A N HIS 44.A O no hydrogen 3.022 N/A LYS 21.A N PRO 30.A O no hydrogen 3.021 N/A GLY 23.A N LEU 20.A O no hydrogen 2.814 N/A SER 24.A N LYS 21.A O no hydrogen 3.246 N/A SER 25.A OG.B SER 66.A O no hydrogen 3.027 N/A SER 26.A N SER 24.A OG no hydrogen 3.249 N/A SER 26.A OG SER 24.A OG no hydrogen 3.250 N/A GLY 28.A N GLY 85.A O no hydrogen 2.850 N/A THR 29.A N SER 26.A O no hydrogen 3.281 N/A THR 29.A OG1 SER 24.A O no hydrogen 3.365 N/A THR 29.A OG1 SER 26.A O no hydrogen 2.766 N/A ILE 31.A N VAL 83.A O no hydrogen 3.016 N/A VAL 32.A N ASP 19.A O no hydrogen 2.808 N/A GLY 33.A N ALA 132.A O no hydrogen 2.898 N/A TRP 34.A N ALA 17.A O no hydrogen 3.045 N/A GLN 35.A N ASP 130.A OD1 no hydrogen 2.958 N/A THR 40.A OG1 THR 37.A O no hydrogen 2.813 N/A GLN 45.A N ASN 42.A O no hydrogen 2.971 N/A GLN 45.A NE2 ASP 19.A OD2 no hydrogen 2.886 N/A GLN 45.A NE2 GLN 35.A O no hydrogen 3.233 N/A TRP 47.A N TYR 7.A O no hydrogen 2.936 N/A TRP 47.A NE1 ILE 18.A O no hydrogen 2.992 N/A LEU 48.A N CYS 62.A O no hydrogen 2.767 N/A ALA 49.A N GLY 5.A O no hydrogen 2.813 N/A GLU 50.A N THR 60.A O no hydrogen 3.126 N/A ILE 52.A N THR 58.A O no hydrogen 2.901 N/A VAL 55.A N ILE 52.A O no hydrogen 3.285 N/A THR 58.A OG1 ALA 56.A O no hydrogen 2.920 N/A THR 58.A OG1 THR 100.A OG1 no hydrogen 2.809 N/A PHE 59.A N TRP 99.A O no hydrogen 2.802 N/A THR 60.A N GLU 50.A O no hydrogen 3.080 N/A THR 60.A OG1 ALA 90.A O no hydrogen 2.759 N/A CYS 62.A N LEU 48.A O no hydrogen 2.930 N/A CYS 62.A SG ASN 63.A O no hydrogen 3.776 N/A CYS 62.A SG THR 68.A O no hydrogen 3.871 N/A ASN 63.A N THR 68.A O no hydrogen 2.873 N/A ASN 63.A ND2 HIS 44.A O no hydrogen 3.142 N/A LEU 64.A N LEU 46.A O no hydrogen 2.903 N/A PHE 65.A N ASN 63.A OD1 no hydrogen 3.116 N/A SER 66.A N ASN 63.A OD1 no hydrogen 3.204 N/A SER 66.A OG THR 68.A OG1 no hydrogen 2.828 N/A GLY 67.A N ASN 63.A O no hydrogen 2.866 N/A THR 68.A N SER 66.A OG no hydrogen 3.051 N/A THR 68.A OG1 SER 66.A OG no hydrogen 2.828 N/A TYR 69.A N TRP 86.A O no hydrogen 2.730 N/A MET 70.A N LEU 61.A O no hydrogen 2.921 N/A ASP 71.A N ASN 84.A O no hydrogen 2.831 N/A LEU 72.A N HIS 96.A O no hydrogen 2.838 N/A TYR 73.A N ALA 82.A O no hydrogen 2.851 N/A GLY 75.A N LEU 72.A O no hydrogen 2.870 N/A SER 76.A N TYR 73.A O no hydrogen 3.314 N/A SER 76.A OG GLU 78.A OE1.A no hydrogen 3.211 N/A SER 76.A OG THR 81.A OG1 no hydrogen 3.355 N/A GLU 78.A N SER 76.A OG no hydrogen 3.098 N/A GLY 80.A N GLY 136.A O no hydrogen 2.810 N/A THR 81.A N GLU 78.A O no hydrogen 3.298 N/A THR 81.A OG1 SER 76.A O no hydrogen 3.422 N/A THR 81.A OG1 SER 76.A OG no hydrogen 3.355 N/A THR 81.A OG1 GLU 78.A O no hydrogen 2.621 N/A ASN 84.A N ASP 71.A O no hydrogen 2.955 N/A GLY 85.A N THR 29.A O no hydrogen 2.789 N/A TRP 86.A N TYR 69.A O no hydrogen 2.887 N/A GLN 87.A N ASP 27.A OD1 no hydrogen 2.839 N/A GLN 87.A NE2 ASP 27.A OD2 no hydrogen 2.786 N/A THR 92.A N THR 89.A O no hydrogen 3.405 N/A ASN 94.A N THR 92.A OG1 no hydrogen 3.044 N/A HIS 96.A N ASN 94.A OD1 no hydrogen 2.954 N/A GLN 97.A N ASN 94.A O no hydrogen 2.990 N/A LEU 98.A N PRO 95.A O no hydrogen 3.132 N/A TRP 99.A N PHE 59.A O no hydrogen 2.872 N/A TRP 99.A NE1 MET 70.A O no hydrogen 2.924 N/A THR 100.A N GLN 113.A O no hydrogen 2.693 N/A THR 100.A OG1 THR 58.A OG1 no hydrogen 2.809 N/A ILE 101.A N ASP 57.A O no hydrogen 2.878 N/A LYS 102.A N LYS 111.A O no hydrogen 3.265 N/A LYS 103.A NZ GLY 107.A O no hydrogen 2.852 N/A SER 104.A N SER 109.A O no hydrogen 2.743 N/A SER 104.A OG SER 109.A O no hydrogen 3.243 N/A SER 104.A OG SER 109.A OG no hydrogen 2.880 N/A SER 105.A OG ASP 142.A O no hydrogen 2.848 N/A ASP 106.A N SER 104.A OG no hydrogen 3.126 N/A GLY 107.A N SER 104.A O no hydrogen 3.001 N/A THR 108.A N ASP 106.A OD1 no hydrogen 2.728 N/A THR 108.A OG1.B ASP 106.A OD1 no hydrogen 2.710 N/A SER 109.A N ASP 106.A OD1 no hydrogen 2.792 N/A SER 109.A OG SER 104.A OG no hydrogen 2.880 N/A SER 109.A OG ASP 106.A OD1 no hydrogen 3.158 N/A SER 109.A OG ASP 106.A OD2 no hydrogen 2.689 N/A TYR 110.A N TRP 150.A O no hydrogen 2.749 N/A LYS 111.A N LYS 102.A O no hydrogen 2.880 N/A LYS 111.A NZ THR 140.A O no hydrogen 2.886 N/A LYS 111.A NZ GLN 148.A OE1 no hydrogen 2.731 N/A GLN 113.A N THR 100.A O no hydrogen 2.861 N/A ASN 114.A N THR 119.A O no hydrogen 2.834 N/A ASN 114.A ND2 PRO 95.A O no hydrogen 2.880 N/A ASN 114.A ND2 HIS 96.A O no hydrogen 3.317 N/A TYR 115.A N LEU 98.A O no hydrogen 2.855 N/A GLY 116.A N ASN 114.A OD1 no hydrogen 2.950 N/A SER 117.A N ASN 114.A OD1 no hydrogen 2.940 N/A SER 117.A OG THR 119.A OG1 no hydrogen 2.649 N/A LYS 118.A N ASN 114.A O no hydrogen 2.896 N/A LYS 118.A NZ TYR 115.A O no hydrogen 2.837 N/A THR 119.A N SER 117.A OG no hydrogen 3.059 N/A THR 119.A OG1 SER 117.A OG no hydrogen 2.649 N/A PHE 120.A N TRP 137.A O no hydrogen 2.734 N/A VAL 121.A N ILE 112.A O no hydrogen 2.868 N/A ASP 122.A N ALA 135.A O no hydrogen 2.829 N/A LEU 123.A N HIS 147.A O no hydrogen 2.872 N/A VAL 124.A N LYS 133.A O no hydrogen 3.062 N/A GLY 126.A N LEU 123.A O no hydrogen 2.885 N/A ASP 127.A N VAL 124.A O no hydrogen 3.282 N/A SER 129.A N ASP 127.A OD1 no hydrogen 2.938 N/A SER 129.A OG.A ASP 127.A OD1 no hydrogen 2.893 N/A SER 129.A OG.A ASP 127.A OD2 no hydrogen 3.208 N/A SER 129.A OG.B ASP 127.A OD1 no hydrogen 2.704 N/A GLY 131.A N GLY 33.A O no hydrogen 2.811 N/A ALA 132.A N SER 129.A O no hydrogen 3.217 N/A ALA 135.A N ASP 122.A O no hydrogen 2.968 N/A GLY 136.A N THR 81.A O no hydrogen 2.811 N/A TRP 137.A N PHE 120.A O no hydrogen 2.829 N/A THR 140.A N GLU 143.A OE2 no hydrogen 2.942 N/A THR 140.A OG1 ASP 142.A OD1 no hydrogen 3.334 N/A GLU 143.A N THR 140.A OG1 no hydrogen 3.242 N/A HIS 147.A N ASN 145.A OD1 no hydrogen 2.980 N/A GLN 148.A N ASN 145.A O no hydrogen 3.181 N/A GLN 148.A NE2 ASP 122.A OD2 no hydrogen 2.919 N/A GLN 148.A NE2 THR 138.A O no hydrogen 2.922 N/A LYS 149.A N PRO 146.A O no hydrogen 3.294 N/A LYS 149.A NZ ASP 106.A OD2 no hydrogen 3.532 N/A LYS 149.A NZ GLY 144.A O no hydrogen 3.119 N/A TRP 150.A N TYR 110.A O no hydrogen 2.838 N/A TRP 150.A NE1 VAL 121.A O no hydrogen 3.023 N/A TYR 151.A N GLU 10.A O no hydrogen 2.748 N/A ASN 153.A N HIS 8.A O no hydrogen 2.911 N/A ASN 153.A ND2.A GLU 10.A OE2.A no hydrogen 3.055 N/A ARG 154.A NH1 ARG 4.A O no hydrogen 2.994 N/A ARG 154.A NH1 TYR 7.A OH no hydrogen 3.249 N/A ARG 154.A NH2 GLU 161.A OE1 no hydrogen 2.967 N/A MET 155.A N ILE 6.A O no hydrogen 2.806 N/A SER 156.A OG GLU 184.A OE2 no hydrogen 2.573 N/A VAL 157.A N TYR 185.A O no hydrogen 2.869 N/A SER 158.A N GLU 161.A OE1 no hydrogen 2.868 N/A SER 159.A N GLY 183.A O no hydrogen 3.022 N/A GLU 161.A N SER 158.A OG no hydrogen 3.021 N/A ALA 162.A N SER 158.A O no hydrogen 3.070 N/A GLN 163.A N SER 159.A O no hydrogen 2.832 N/A ALA 164.A N ALA 160.A O no hydrogen 2.976 N/A ALA 165.A N GLU 161.A O no hydrogen 3.039 N/A ILE 166.A N ALA 162.A O no hydrogen 3.061 N/A ALA 167.A N GLN 163.A O no hydrogen 2.907 N/A ARG 168.A N ALA 164.A O no hydrogen 3.066 N/A ARG 168.A NH1 ALA 266.A O no hydrogen 2.750 N/A ASN 169.A N ILE 166.A O no hydrogen 3.011 N/A HIS 171.A N ASN 169.A OD1 no hydrogen 2.857 N/A HIS 173.A N SER 286.A O no hydrogen 2.826 N/A HIS 173.A ND1 THR 175.A OG1 no hydrogen 2.765 N/A THR 175.A N HIS 173.A ND1 no hydrogen 3.142 N/A THR 175.A OG1 HIS 173.A ND1 no hydrogen 2.765 N/A TYR 176.A N HIS 173.A O no hydrogen 3.038 N/A ARG 177.A N TYR 287.A O no hydrogen 3.138 N/A TYR 179.A N ALA 289.A O no hydrogen 2.783 N/A LEU 181.A N TYR 291.A OXT no hydrogen 2.730 N/A ASP 182.A N TYR 185.A OH no hydrogen 2.957 N/A TYR 185.A N VAL 157.A O no hydrogen 2.753 N/A TYR 185.A OH TYR 291.A O no hydrogen 2.736 N/A LEU 186.A N ALA 238.A O no hydrogen 2.807 N/A VAL 187.A N MET 155.A O no hydrogen 3.083 N/A THR 192.A N PRO 189.A O no hydrogen 2.971 N/A PHE 193.A N PRO 189.A O no hydrogen 3.086 N/A THR 194.A N ASN 190.A O no hydrogen 2.818 N/A THR 194.A OG1 ASN 190.A O no hydrogen 3.028 N/A THR 194.A OG1 TYR 278.A OH no hydrogen 2.733 N/A GLN 195.A N ALA 191.A O no hydrogen 3.110 N/A GLN 195.A NE2 ASP 199.A OD2 no hydrogen 2.880 N/A ILE 196.A N THR 192.A O no hydrogen 3.018 N/A TRP 197.A N PHE 193.A O no hydrogen 3.075 N/A TRP 197.A NE1 PRO 273.A O no hydrogen 2.835 N/A LYS 198.A N THR 194.A O no hydrogen 2.751 N/A ASP 199.A N GLN 195.A O no hydrogen 3.020 N/A ASP 199.A N ILE 196.A O no hydrogen 3.217 N/A SER 200.A N TRP 197.A O no hydrogen 3.116 N/A SER 200.A OG TRP 197.A O no hydrogen 2.666 N/A LEU 202.A N SER 200.A OG no hydrogen 3.063 N/A SER 205.A N LEU 202.A O no hydrogen 2.912 N/A SER 205.A OG GLY 201.A O no hydrogen 2.859 N/A ARG 208.A N TYR 212.A O no hydrogen 2.915 N/A ILE 211.A N GLU 209.A O no hydrogen 2.747 N/A TYR 212.A N ARG 208.A O no hydrogen 3.089 N/A ASP 213.A N ASP 215.A OD2 no hydrogen 2.921 N/A PHE 216.A N ASP 213.A O no hydrogen 3.164 N/A ILE 218.A N ASP 214.A O no hydrogen 2.954 N/A ALA 219.A N ASP 215.A O no hydrogen 2.890 N/A MET 220.A N PHE 216.A O no hydrogen 2.979 N/A LYS 221.A N ALA 217.A O no hydrogen 3.142 N/A LYS 221.A NZ CYS 241.A O no hydrogen 2.893 N/A ALA 222.A N ILE 218.A O no hydrogen 2.886 N/A ALA 223.A N ALA 219.A O no hydrogen 2.832 N/A VAL 224.A N MET 220.A O no hydrogen 2.985 N/A GLY 225.A N LYS 221.A O no hydrogen 3.007 N/A LYS 226.A N ALA 222.A O no hydrogen 2.913 N/A LYS 226.A NZ ASP 230.A OD2 no hydrogen 2.817 N/A TRP 227.A N ALA 223.A O no hydrogen 2.996 N/A GLY 228.A N VAL 224.A O no hydrogen 2.975 N/A ALA 229.A N GLY 225.A O no hydrogen 3.331 N/A ASP 230.A N LYS 226.A O no hydrogen 2.954 N/A SER 231.A OG TRP 227.A O no hydrogen 2.693 N/A TRP 232.A N GLY 228.A O no hydrogen 3.222 N/A LYS 233.A N LEU 64.A O no hydrogen 3.177 N/A LYS 233.A N PHE 65.A O no hydrogen 3.307 N/A LYS 233.A NZ PHE 65.A O no hydrogen 3.255 N/A ALA 234.A N LEU 64.A O no hydrogen 3.182 N/A ALA 238.A N GLU 184.A O no hydrogen 2.802 N/A PHE 240.A N LEU 186.A O no hydrogen 2.895 N/A CYS 241.A SG GLY 242.A O no hydrogen 4.037 N/A GLY 242.A N PHE 259.A O no hydrogen 3.004 N/A VAL 243.A N PHE 290.A O no hydrogen 2.843 N/A MET 244.A N TYR 257.A O no hydrogen 2.917 N/A LEU 245.A N MET 288.A O no hydrogen 2.903 N/A GLY 246.A N HIS 255.A O no hydrogen 2.832 N/A VAL 247.A N ASP 285.A O no hydrogen 2.956 N/A ASN 248.A N ALA 253.A O no hydrogen 2.900 N/A ASN 248.A ND2 ASP 252.A OD1 no hydrogen 2.947 N/A LYS 249.A NZ ASP 285.A OD2 no hydrogen 2.870 N/A GLY 251.A N ASN 248.A O no hydrogen 3.068 N/A ASP 252.A N ASN 248.A OD1 no hydrogen 2.928 N/A ALA 253.A N ASN 248.A OD1 no hydrogen 3.128 N/A HIS 255.A N GLY 246.A O no hydrogen 2.909 N/A HIS 255.A NE2 GLU 272.A OE1 no hydrogen 2.642 N/A TYR 257.A N MET 244.A O no hydrogen 3.017 N/A ASN 258.A N PHE 271.A O no hydrogen 2.965 N/A ASN 258.A ND2 ALA 217.A O no hydrogen 2.965 N/A ASN 258.A ND2 GLY 242.A O no hydrogen 3.099 N/A PHE 259.A N GLY 242.A O no hydrogen 3.245 N/A THR 260.A N VAL 269.A O no hydrogen 2.883 N/A LEU 261.A N THR 260.A OG1 no hydrogen 2.747 N/A THR 262.A N ASP 267.A O no hydrogen 2.925 N/A THR 262.A OG1 ASP 264.A OD1 no hydrogen 2.662 N/A THR 262.A OG1 ASP 267.A O no hydrogen 3.291 N/A LYS 263.A NZ ASP 39.A OD2 no hydrogen 2.961 N/A HIS 265.A N THR 262.A O no hydrogen 2.876 N/A ALA 266.A N ASP 264.A OD1 no hydrogen 2.896 N/A ASP 267.A N THR 262.A OG1 no hydrogen 3.236 N/A VAL 269.A N THR 260.A O no hydrogen 2.949 N/A PHE 270.A N LEU 279.A O no hydrogen 2.838 N/A PHE 271.A N ASN 258.A O no hydrogen 2.823 N/A GLU 272.A N GLY 277.A O no hydrogen 2.873 N/A GLN 274.A N GLU 272.A OE2 no hydrogen 3.022 N/A ASN 275.A N GLU 272.A O no hydrogen 3.071 N/A GLY 276.A N GLU 272.A O no hydrogen 2.790 N/A GLY 277.A N ASN 275.A OD1 no hydrogen 2.879 N/A TYR 278.A OH THR 194.A OG1 no hydrogen 2.733 N/A LEU 279.A N PHE 270.A O no hydrogen 2.844 N/A GLY 283.A N ASP 281.A OD2 no hydrogen 2.891 N/A ASP 285.A N VAL 247.A O no hydrogen 2.834 N/A SER 286.A N HIS 171.A O no hydrogen 2.971 N/A SER 286.A OG MET 288.A O no hydrogen 3.147 N/A TYR 287.A N LEU 245.A O no hydrogen 2.783 N/A MET 288.A N LEU 245.A O no hydrogen 3.308 N/A ALA 289.A N ARG 177.A O no hydrogen 3.157 N/A PHE 290.A N VAL 243.A O no hydrogen 2.951 N/A TYR 291.A N TYR 179.A O no hydrogen 3.248 N/A