Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3m0k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N PRO 80.A O no hydrogen 2.818 N/A SER 5.A OG GLU 2.A O no hydrogen 2.665 N/A LYS 9.A N SER 5.A O no hydrogen 2.947 N/A LYS 9.A NZ GLY 82.A O no hydrogen 2.872 N/A LEU 10.A N GLY 6.A O no hydrogen 2.854 N/A ARG 11.A N ALA 7.A O no hydrogen 2.909 N/A ARG 11.A NE ASP 151.A O no hydrogen 3.054 N/A ARG 11.A NH1 GLU 15.A OE2 no hydrogen 3.070 N/A ARG 11.A NH1 ASP 182.A OD1 no hydrogen 3.019 N/A ARG 11.A NH2 ASP 151.A O no hydrogen 2.887 N/A ARG 11.A NH2 PHE 152.A O no hydrogen 3.032 N/A ARG 11.A NH2 ASP 182.A OD1 no hydrogen 3.201 N/A ARG 11.A NH2 ASP 182.A OD2 no hydrogen 3.332 N/A HIS 12.A N LYS 8.A O no hydrogen 2.872 N/A LEU 13.A N LYS 9.A O no hydrogen 3.061 N/A LEU 14.A N LEU 10.A O no hydrogen 2.922 N/A GLU 15.A N ARG 11.A O no hydrogen 2.870 N/A ASN 16.A N HIS 12.A O no hydrogen 2.756 N/A THR 17.A OG1 LEU 13.A O no hydrogen 2.500 N/A GLU 19.A N THR 17.A OG1 no hydrogen 3.395 N/A ILE 21.A N ARG 231.A O no hydrogen 2.852 N/A CYS 23.A N MET 233.A O no hydrogen 2.893 N/A CYS 23.A SG ILE 21.A O no hydrogen 3.886 N/A CYS 23.A SG SER 42.A OG no hydrogen 3.332 N/A GLY 25.A N PHE 235.A O no hydrogen 2.808 N/A VAL 26.A N TYR 44.A O no hydrogen 2.660 N/A TYR 27.A N SER 31.A OG no hydrogen 2.882 N/A ASP 28.A N SER 31.A OG no hydrogen 3.031 N/A SER 31.A N ASP 28.A OD1 no hydrogen 2.757 N/A SER 31.A OG ASP 28.A O no hydrogen 3.229 N/A SER 31.A OG ASP 28.A OD1 no hydrogen 2.627 N/A ALA 32.A N ASP 28.A O no hydrogen 3.037 N/A ARG 33.A N GLY 29.A O no hydrogen 2.838 N/A THR 34.A N LEU 30.A O no hydrogen 3.029 N/A THR 34.A OG1 LEU 30.A O no hydrogen 2.814 N/A ALA 35.A N SER 31.A O no hydrogen 3.074 N/A MET 36.A N ALA 32.A O no hydrogen 2.998 N/A GLU 37.A N ARG 33.A O no hydrogen 2.868 N/A LEU 38.A N THR 34.A O no hydrogen 3.147 N/A LEU 38.A N ALA 35.A O no hydrogen 3.306 N/A GLY 39.A N MET 36.A O no hydrogen 3.111 N/A PHE 40.A N ALA 35.A O no hydrogen 3.335 N/A SER 42.A OG PRO 84.A O no hydrogen 3.230 N/A LEU 43.A N PRO 84.A O no hydrogen 2.951 N/A TYR 44.A N PRO 24.A O no hydrogen 2.997 N/A TYR 44.A OH HIS 115.A NE2 no hydrogen 2.635 N/A MET 45.A N ILE 86.A O no hydrogen 2.754 N/A THR 46.A N VAL 26.A O no hydrogen 3.205 N/A GLY 49.A N THR 46.A OG1 no hydrogen 2.874 N/A THR 50.A N THR 46.A O no hydrogen 2.967 N/A THR 50.A OG1 THR 46.A O no hydrogen 2.683 N/A THR 51.A N GLY 47.A O no hydrogen 2.906 N/A THR 51.A OG1 GLY 47.A O no hydrogen 2.797 N/A ALA 52.A N ALA 48.A O no hydrogen 2.956 N/A SER 53.A N GLY 49.A O no hydrogen 2.898 N/A ARG 54.A N THR 50.A O no hydrogen 2.797 N/A LEU 55.A N THR 51.A O no hydrogen 3.024 N/A GLY 56.A N ALA 52.A O no hydrogen 2.857 N/A GLN 57.A N THR 51.A O no hydrogen 3.268 N/A LEU 60.A N PRO 58.A O no hydrogen 2.781 N/A GLN 64.A N ASP 67.A OD2 no hydrogen 2.991 N/A MET 68.A N GLN 64.A O no hydrogen 3.070 N/A ARG 69.A N LEU 65.A O no hydrogen 2.734 N/A ARG 69.A NE SER 109.A OG no hydrogen 2.720 N/A ARG 69.A NH2 SER 109.A OG no hydrogen 3.056 N/A ASP 70.A N HIS 66.A O no hydrogen 2.930 N/A ASN 71.A N ASP 67.A O no hydrogen 3.032 N/A ASN 71.A ND2 TYR 27.A O no hydrogen 2.959 N/A ASN 71.A ND2 THR 50.A OG1 no hydrogen 2.942 N/A ALA 72.A N MET 68.A O no hydrogen 2.948 N/A ASP 73.A N ARG 69.A O no hydrogen 2.770 N/A MET 74.A N ASP 70.A O no hydrogen 3.046 N/A ILE 75.A N ASN 71.A O no hydrogen 2.928 N/A ALA 76.A N ALA 72.A O no hydrogen 2.790 N/A ASN 77.A N MET 74.A O no hydrogen 3.425 N/A ASN 77.A ND2 ASP 73.A O no hydrogen 2.838 N/A ASN 77.A ND2 SER 109.A O no hydrogen 2.767 N/A LEU 78.A N ILE 75.A O no hydrogen 3.415 N/A PHE 81.A N ASP 79.A OD1 no hydrogen 2.850 N/A GLY 82.A N ASP 79.A O no hydrogen 2.821 N/A ILE 86.A N LEU 43.A O no hydrogen 2.892 N/A ALA 87.A N GLY 113.A O no hydrogen 2.822 N/A ASP 88.A N MET 45.A O no hydrogen 3.090 N/A MET 89.A N HIS 115.A O no hydrogen 3.071 N/A ASP 90.A N ASP 88.A OD1 no hydrogen 2.742 N/A GLY 92.A N MET 89.A O no hydrogen 2.887 N/A TYR 93.A OH ASP 90.A OD2 no hydrogen 2.572 N/A VAL 99.A N GLY 95.A O no hydrogen 2.950 N/A ALA 100.A N PRO 96.A O no hydrogen 2.921 N/A ARG 101.A N ILE 97.A O no hydrogen 3.023 N/A THR 102.A N MET 98.A O no hydrogen 2.794 N/A THR 102.A OG1 GLY 92.A O no hydrogen 3.076 N/A THR 102.A OG1 MET 98.A O no hydrogen 2.792 N/A VAL 103.A N VAL 99.A O no hydrogen 2.944 N/A GLU 104.A N ALA 100.A O no hydrogen 2.835 N/A HIS 105.A N ARG 101.A O no hydrogen 2.765 N/A TYR 106.A N THR 102.A O no hydrogen 2.849 N/A TYR 106.A OH ASP 88.A O no hydrogen 2.718 N/A ILE 107.A N VAL 103.A O no hydrogen 2.836 N/A ARG 108.A N GLU 104.A O no hydrogen 2.973 N/A SER 109.A N HIS 105.A O no hydrogen 2.985 N/A SER 109.A OG ASP 73.A OD1 no hydrogen 3.077 N/A SER 109.A OG HIS 105.A O no hydrogen 3.122 N/A GLY 110.A N ILE 107.A O no hydrogen 3.056 N/A VAL 111.A N TYR 106.A O no hydrogen 2.966 N/A ALA 112.A N LEU 85.A O no hydrogen 2.848 N/A GLY 113.A N LEU 85.A O no hydrogen 3.278 N/A ALA 114.A N VAL 153.A O no hydrogen 3.097 N/A HIS 115.A N ALA 87.A O no hydrogen 3.341 N/A HIS 115.A NE2 TYR 44.A OH no hydrogen 2.635 N/A LEU 116.A N ILE 155.A O no hydrogen 2.890 N/A GLU 117.A N ASP 90.A O no hydrogen 2.912 N/A GLN 119.A NE2 ARG 124.A O no hydrogen 3.196 N/A ILE 120.A N LYS 127.A O no hydrogen 3.166 N/A LYS 123.A N LEU 121.A O no hydrogen 2.752 N/A CYS 125.A N ASP 59.A O no hydrogen 3.146 N/A LYS 126.A NZ ASP 159.A OD1 no hydrogen 2.778 N/A VAL 129.A N ASP 118.A O no hydrogen 2.829 N/A ARG 131.A NE GLU 168.A OE2 no hydrogen 3.336 N/A ARG 131.A NH2 GLU 168.A OE1 no hydrogen 2.740 N/A ARG 131.A NH2 GLU 168.A OE2 no hydrogen 3.293 N/A ARG 131.A NH2 GLU 171.A OE1 no hydrogen 3.436 N/A GLU 133.A N SER 130.A OG no hydrogen 2.975 N/A TYR 134.A N SER 130.A O no hydrogen 2.914 N/A LEU 135.A N ARG 131.A O no hydrogen 2.913 N/A VAL 136.A N ASP 132.A O no hydrogen 3.065 N/A ARG 137.A N GLU 133.A O no hydrogen 3.375 N/A ARG 137.A NH1 GLU 117.A O no hydrogen 2.796 N/A ARG 137.A NH1 GLN 119.A O no hydrogen 2.766 N/A ARG 137.A NH2 GLN 119.A O no hydrogen 2.968 N/A ILE 138.A N TYR 134.A O no hydrogen 3.042 N/A ARG 139.A N LEU 135.A O no hydrogen 2.763 N/A ARG 139.A NH1 GLU 179.A OE2 no hydrogen 3.115 N/A ALA 140.A N VAL 136.A O no hydrogen 3.032 N/A ALA 141.A N ARG 137.A O no hydrogen 2.968 N/A VAL 142.A N ILE 138.A O no hydrogen 2.831 N/A ALA 143.A N ARG 139.A O no hydrogen 2.951 N/A THR 144.A N ALA 140.A O no hydrogen 3.207 N/A THR 144.A OG1 ALA 140.A O no hydrogen 2.824 N/A LYS 145.A N ALA 141.A O no hydrogen 3.134 N/A LYS 145.A NZ GLY 180.A O no hydrogen 3.411 N/A LYS 145.A NZ ASP 182.A OD2 no hydrogen 2.463 N/A ARG 146.A N VAL 142.A O no hydrogen 2.996 N/A ARG 147.A N ALA 143.A O no hydrogen 2.850 N/A LEU 148.A N THR 144.A O no hydrogen 2.968 N/A ARG 149.A N ARG 146.A O no hydrogen 2.815 N/A SER 150.A N LYS 145.A O no hydrogen 2.961 N/A PHE 152.A N SER 150.A OG no hydrogen 2.915 N/A VAL 153.A N ALA 112.A O no hydrogen 2.936 N/A LEU 154.A N ASP 182.A OD2 no hydrogen 2.796 N/A ILE 155.A N ALA 114.A O no hydrogen 2.824 N/A ALA 156.A N VAL 183.A O no hydrogen 2.825 N/A ARG 157.A N LEU 116.A O no hydrogen 2.737 N/A ARG 157.A NE ASP 159.A OD1 no hydrogen 3.293 N/A ARG 157.A NE ASP 159.A OD2 no hydrogen 2.890 N/A ARG 157.A NH2 ASP 159.A OD1 no hydrogen 2.871 N/A ARG 157.A NH2 ASP 159.A OD2 no hydrogen 3.395 N/A THR 158.A N LEU 185.A O no hydrogen 2.836 N/A THR 158.A OG1 ASP 118.A OD2 no hydrogen 2.816 N/A ASP 159.A N ASP 118.A OD1 no hydrogen 2.788 N/A ALA 160.A N THR 158.A OG1 no hydrogen 3.138 N/A LEU 164.A N ALA 160.A O no hydrogen 2.693 N/A GLY 165.A N ALA 160.A O no hydrogen 3.209 N/A GLY 165.A N LEU 161.A O no hydrogen 2.892 N/A CYS 169.A N GLY 165.A O no hydrogen 3.278 N/A CYS 169.A SG GLY 165.A O no hydrogen 3.410 N/A ILE 170.A N TYR 166.A O no hydrogen 2.924 N/A GLU 171.A N GLU 167.A O no hydrogen 2.942 N/A ARG 172.A N GLU 168.A O no hydrogen 2.931 N/A ARG 172.A NE GLU 168.A OE2 no hydrogen 2.769 N/A ARG 172.A NH1 ASP 118.A OD2 no hydrogen 2.862 N/A ARG 172.A NH1 VAL 129.A O no hydrogen 2.869 N/A ARG 172.A NH2 VAL 129.A O no hydrogen 2.936 N/A ARG 172.A NH2 GLU 168.A OE2 no hydrogen 3.471 N/A LEU 173.A N CYS 169.A O no hydrogen 2.984 N/A ARG 174.A N ILE 170.A O no hydrogen 2.942 N/A ARG 174.A NH2 ALA 201.A O no hydrogen 3.200 N/A ALA 175.A N GLU 171.A O no hydrogen 2.906 N/A ALA 176.A N ARG 172.A O no hydrogen 2.816 N/A ARG 177.A N LEU 173.A O no hydrogen 2.775 N/A ARG 177.A NE ASP 178.A OD1 no hydrogen 3.143 N/A ARG 177.A NH1 ASP 178.A OD1 no hydrogen 3.054 N/A ASP 178.A N ARG 174.A O no hydrogen 3.128 N/A GLU 179.A N ALA 175.A O no hydrogen 3.068 N/A GLY 180.A N ALA 176.A O no hydrogen 3.109 N/A GLY 180.A N ARG 177.A O no hydrogen 3.009 N/A ALA 181.A N ALA 176.A O no hydrogen 3.046 N/A ASP 182.A N LEU 154.A O no hydrogen 2.836 N/A VAL 183.A N LEU 154.A O no hydrogen 3.280 N/A GLY 184.A N PRO 206.A O no hydrogen 2.979 N/A LEU 185.A N ALA 156.A O no hydrogen 2.797 N/A GLU 187.A N THR 158.A O no hydrogen 3.025 N/A ARG 190.A N GLN 194.A OE1 no hydrogen 2.819 N/A LYS 192.A NZ LEU 219.A O no hydrogen 3.112 N/A GLN 194.A N SER 191.A OG no hydrogen 3.030 N/A ALA 195.A N SER 191.A O no hydrogen 3.153 N/A ALA 196.A N LYS 192.A O no hydrogen 3.046 N/A ALA 197.A N GLU 193.A O no hydrogen 2.951 N/A ALA 198.A N GLN 194.A O no hydrogen 3.018 N/A VAL 199.A N ALA 195.A O no hydrogen 3.213 N/A ALA 200.A N ALA 196.A O no hydrogen 3.015 N/A ALA 201.A N ALA 197.A O no hydrogen 2.849 N/A LEU 202.A N ALA 198.A O no hydrogen 3.171 N/A LEU 202.A N VAL 199.A O no hydrogen 3.202 N/A ALA 203.A N VAL 199.A O no hydrogen 2.853 N/A TRP 205.A N LEU 202.A O no hydrogen 2.856 N/A TRP 205.A NE1 ALA 181.A O no hydrogen 3.038 N/A LEU 208.A N GLY 184.A O no hydrogen 2.786 N/A LEU 209.A N ILE 232.A O no hydrogen 2.818 N/A ASN 210.A ND2 GLU 187.A OE1 no hydrogen 2.788 N/A ASN 210.A ND2 GLU 187.A OE2 no hydrogen 3.021 N/A SER 211.A N ILE 234.A O no hydrogen 2.855 N/A GLY 215.A N VAL 212.A O no hydrogen 2.994 N/A SER 217.A OG PHE 189.A O no hydrogen 3.525 N/A THR 221.A N GLU 224.A OE1 no hydrogen 3.084 N/A GLU 224.A N THR 221.A OG1 no hydrogen 3.047 N/A ALA 225.A N THR 221.A O no hydrogen 2.898 N/A LYS 226.A N VAL 222.A O no hydrogen 2.974 N/A ALA 227.A N GLU 223.A O no hydrogen 3.068 N/A MET 228.A N GLU 224.A O no hydrogen 3.017 N/A GLY 229.A N LYS 226.A O no hydrogen 2.916 N/A PHE 230.A N ALA 225.A O no hydrogen 3.245 N/A ARG 231.A N LEU 207.A O no hydrogen 2.982 N/A ARG 231.A NE GLU 19.A O no hydrogen 3.156 N/A ARG 231.A NH1 LEU 14.A O no hydrogen 2.801 N/A ARG 231.A NH2 LEU 13.A O no hydrogen 3.141 N/A ARG 231.A NH2 LEU 14.A O no hydrogen 3.563 N/A ARG 231.A NH2 GLU 19.A O no hydrogen 2.963 N/A ILE 232.A N LEU 207.A O no hydrogen 3.267 N/A MET 233.A N ILE 21.A O no hydrogen 2.874 N/A ILE 234.A N LEU 209.A O no hydrogen 2.892 N/A PHE 235.A N CYS 23.A O no hydrogen 2.960 N/A SER 236.A N SER 211.A O no hydrogen 3.064 N/A SER 236.A OG ASN 210.A OD1 no hydrogen 2.649 N/A ALA 238.A N PHE 235.A O no hydrogen 3.210 N/A THR 239.A OG1 GLY 25.A O no hydrogen 2.698 N/A ALA 241.A N PHE 237.A O no hydrogen 3.264 N/A ALA 243.A N THR 239.A O no hydrogen 3.032 N/A TYR 244.A N LEU 240.A O no hydrogen 2.973 N/A ALA 245.A N ALA 241.A O no hydrogen 3.055 N/A ALA 246.A N PRO 242.A O no hydrogen 3.010 N/A ILE 247.A N ALA 243.A O no hydrogen 2.892 N/A ARG 248.A N TYR 244.A O no hydrogen 2.830 N/A GLU 249.A N ALA 245.A O no hydrogen 2.974 N/A THR 250.A N ALA 246.A O no hydrogen 2.951 N/A THR 250.A OG1 ALA 246.A O no hydrogen 2.884 N/A LEU 251.A N ILE 247.A O no hydrogen 2.912 N/A VAL 252.A N ARG 248.A O no hydrogen 2.887 N/A ARG 253.A N GLU 249.A O no hydrogen 3.080 N/A ARG 253.A NH1 VAL 260.A O no hydrogen 2.801 N/A LEU 254.A N THR 250.A O no hydrogen 2.857 N/A ARG 255.A N LEU 251.A O no hydrogen 2.785 N/A ARG 255.A NE ASP 256.A OD1 no hydrogen 3.158 N/A ASP 256.A N VAL 252.A O no hydrogen 2.909 N/A HIS 257.A N ARG 253.A O no hydrogen 2.780 N/A GLY 258.A N LEU 254.A O no hydrogen 2.910 N/A ILE 266.A N PRO 263.A O no hydrogen 3.132 N/A THR 267.A N GLY 265.A O no hydrogen 3.026 N/A ARG 270.A N THR 267.A OG1 no hydrogen 3.036 N/A LEU 271.A N THR 267.A O no hydrogen 3.027 N/A PHE 272.A N PRO 268.A O no hydrogen 2.814 N/A GLU 273.A N VAL 269.A O no hydrogen 2.783 N/A VAL 274.A N ARG 270.A O no hydrogen 2.829 N/A CYS 275.A N LEU 271.A O no hydrogen 2.970 N/A CYS 275.A SG LEU 271.A O no hydrogen 3.480 N/A GLY 276.A N GLU 273.A O no hydrogen 3.314 N/A LEU 277.A N PHE 272.A O no hydrogen 2.871 N/A ALA 280.A N GLY 276.A O no hydrogen 3.148 N/A MET 281.A N LEU 277.A O no hydrogen 2.860 N/A GLU 282.A N GLN 278.A O no hydrogen 2.886 N/A VAL 283.A N ASP 279.A O no hydrogen 2.957 N/A ASP 284.A N ALA 280.A O no hydrogen 3.034 N/A ASN 285.A N MET 281.A O no hydrogen 2.796 N/A GLY 286.A N GLU 282.A O no hydrogen 2.819 N/A ALA 287.A N VAL 283.A O no hydrogen 2.993 N/A ALA 287.A N ASP 284.A O no hydrogen 3.264 N/A GLY 288.A N ASN 285.A O no hydrogen 3.088 N/A GLY 289.A N ASP 284.A O no hydrogen 3.078 N/A