Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mg2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N SER 4.A OG no hydrogen 3.419 N/A SER 4.A OG THR 1.A O no hydrogen 2.704 N/A ALA 5.A N THR 1.A O no hydrogen 3.173 N/A ARG 6.A N ASP 3.A O no hydrogen 3.321 N/A ARG 6.A NE GLN 213.A OE1 no hydrogen 2.849 N/A GLY 7.A N SER 4.A O no hydrogen 2.967 N/A ILE 8.A N ALA 5.A O no hydrogen 3.133 N/A THR 12.A N PHE 9.A O no hydrogen 3.123 N/A THR 12.A OG1 PHE 9.A O no hydrogen 2.731 N/A LEU 13.A N GLU 300.A OE1 no hydrogen 2.696 N/A ALA 15.A N LEU 294.A O no hydrogen 2.898 N/A ASP 16.A N ALA 14.A O no hydrogen 2.860 N/A VAL 18.A N ALA 15.A O no hydrogen 3.031 N/A ALA 20.A N ASP 16.A O no hydrogen 3.030 N/A THR 21.A N VAL 17.A O no hydrogen 2.732 N/A THR 21.A OG1 VAL 17.A O no hydrogen 2.565 N/A ILE 22.A N VAL 18.A O no hydrogen 2.917 N/A ALA 23.A N PRO 19.A O no hydrogen 2.883 N/A ARG 24.A N ALA 20.A O no hydrogen 3.166 N/A ARG 24.A NH1 THR 138.A OG1 no hydrogen 2.929 N/A PHE 25.A N THR 21.A O no hydrogen 2.891 N/A SER 26.A N ILE 22.A O no hydrogen 3.000 N/A SER 26.A OG ILE 22.A O no hydrogen 3.146 N/A GLN 27.A N ARG 24.A O no hydrogen 3.070 N/A GLN 27.A NE2 ALA 23.A O no hydrogen 3.217 N/A LEU 28.A N PHE 25.A O no hydrogen 3.119 N/A GLN 33.A N ASN 29.A O no hydrogen 2.807 N/A GLN 33.A NE2 LEU 28.A O no hydrogen 2.809 N/A LEU 34.A N ALA 30.A O no hydrogen 3.073 N/A ALA 35.A N GLU 31.A O no hydrogen 2.944 N/A LEU 36.A N ASP 32.A O no hydrogen 2.854 N/A ILE 37.A N GLN 33.A O no hydrogen 3.032 N/A TRP 38.A N LEU 34.A O no hydrogen 3.064 N/A PHE 39.A N ALA 35.A O no hydrogen 2.860 N/A ALA 40.A N LEU 36.A O no hydrogen 2.821 N/A SER 41.A N ILE 37.A O no hydrogen 2.900 N/A SER 41.A OG ILE 37.A O no hydrogen 2.979 N/A SER 41.A OG TRP 38.A O no hydrogen 3.395 N/A LEU 42.A N TRP 38.A O no hydrogen 2.991 N/A GLU 43.A N PHE 39.A O no hydrogen 3.259 N/A GLU 43.A N ALA 40.A O no hydrogen 3.079 N/A MET 44.A N ALA 40.A O no hydrogen 2.802 N/A GLY 45.A N SER 41.A O no hydrogen 2.683 N/A THR 47.A N MET 44.A O no hydrogen 2.897 N/A THR 47.A OG1 MET 44.A O no hydrogen 3.468 N/A LEU 48.A N MET 44.A O no hydrogen 2.719 N/A ALA 51.A N TRP 266.A O no hydrogen 2.698 N/A MET 58.A N GLY 54.A O no hydrogen 2.921 N/A GLN 59.A N ALA 55.A O no hydrogen 2.936 N/A LEU 60.A N ALA 56.A O no hydrogen 3.129 N/A ALA 61.A N SER 57.A O no hydrogen 3.160 N/A ALA 61.A N MET 58.A O no hydrogen 3.108 N/A GLU 62.A N GLN 59.A O no hydrogen 3.436 N/A LEU 65.A N ALA 61.A O no hydrogen 3.090 N/A LYS 66.A N GLU 62.A O no hydrogen 2.878 N/A GLU 67.A N ASN 63.A O no hydrogen 2.970 N/A ILE 68.A N ALA 64.A O no hydrogen 3.145 N/A GLN 69.A N LEU 65.A O no hydrogen 3.195 N/A GLN 69.A NE2 LEU 65.A O no hydrogen 3.013 N/A ALA 70.A N LYS 66.A O no hydrogen 2.950 N/A MET 71.A N GLU 67.A O no hydrogen 3.272 N/A MET 71.A N ILE 68.A O no hydrogen 3.264 N/A GLN 76.A N GLY 72.A O no hydrogen 2.926 N/A GLN 76.A NE2 ILE 68.A O no hydrogen 2.895 N/A GLN 76.A NE2 GLN 69.A O no hydrogen 3.362 N/A THR 77.A N PRO 73.A O no hydrogen 3.166 N/A THR 77.A OG1 PRO 73.A O no hydrogen 3.324 N/A THR 77.A OG1 LEU 74.A O no hydrogen 2.744 N/A GLN 78.A N LEU 74.A O no hydrogen 2.977 N/A GLN 78.A NE2 ASP 82.A OD1 no hydrogen 3.008 N/A ALA 79.A N GLN 75.A O no hydrogen 2.914 N/A MET 80.A N GLN 76.A O no hydrogen 3.172 N/A CYS 81.A N THR 77.A O no hydrogen 3.043 N/A CYS 81.A SG THR 77.A O no hydrogen 3.422 N/A ASP 82.A N GLN 78.A O no hydrogen 3.006 N/A LEU 83.A N ALA 79.A O no hydrogen 3.262 N/A ALA 84.A N MET 80.A O no hydrogen 3.013 N/A ASN 85.A N CYS 81.A O no hydrogen 2.738 N/A ASN 85.A ND2 CYS 81.A O no hydrogen 2.912 N/A ARG 86.A N LEU 83.A O no hydrogen 3.264 N/A ARG 86.A NH2 SER 26.A OG no hydrogen 3.399 N/A ALA 87.A N ASP 82.A O no hydrogen 2.903 N/A CYS 92.A SG ALA 87.A O no hydrogen 3.133 N/A ARG 93.A N THR 89.A O no hydrogen 2.712 N/A ARG 93.A NE ASP 88.A OD1 no hydrogen 2.738 N/A ARG 93.A NH2 ASP 88.A OD1 no hydrogen 2.986 N/A ARG 93.A NH2 ASP 88.A OD2 no hydrogen 2.765 N/A THR 94.A N PRO 90.A O no hydrogen 3.016 N/A THR 94.A OG1 PRO 90.A O no hydrogen 3.416 N/A TYR 95.A N LEU 91.A O no hydrogen 2.799 N/A TYR 95.A OH VAL 155.A O no hydrogen 2.735 N/A ALA 96.A N CYS 92.A O no hydrogen 2.858 N/A SER 97.A N ARG 93.A O no hydrogen 3.195 N/A SER 97.A N THR 94.A O no hydrogen 3.131 N/A SER 97.A OG THR 94.A O no hydrogen 2.698 N/A TRP 98.A N TYR 95.A O no hydrogen 3.074 N/A ASN 101.A ND2 GLU 163.A OE1 no hydrogen 3.029 N/A ILE 102.A N SER 99.A O no hydrogen 2.895 N/A LYS 103.A N SER 99.A O no hydrogen 3.078 N/A LYS 103.A NZ VAL 156.A O no hydrogen 2.985 N/A LEU 104.A N PRO 100.A O no hydrogen 2.914 N/A GLY 105.A N ASN 101.A O no hydrogen 2.966 N/A PHE 106.A N ILE 102.A O no hydrogen 2.857 N/A TRP 107.A N LYS 103.A O no hydrogen 3.075 N/A TRP 107.A NE1 TYR 95.A OH no hydrogen 2.980 N/A TYR 108.A N LEU 104.A O no hydrogen 2.856 N/A ARG 109.A N GLY 105.A O no hydrogen 3.161 N/A ARG 109.A NH1 GLU 112.A OE1 no hydrogen 2.832 N/A LEU 110.A N PHE 106.A O no hydrogen 3.198 N/A GLY 111.A N TRP 107.A O no hydrogen 3.005 N/A LEU 113.A N ARG 109.A O no hydrogen 3.192 N/A MET 114.A N LEU 110.A O no hydrogen 2.897 N/A GLU 115.A N GLY 111.A O no hydrogen 3.193 N/A GLN 116.A N GLU 112.A O no hydrogen 2.865 N/A GLY 117.A N LEU 113.A O no hydrogen 2.770 N/A PHE 118.A N LEU 113.A O no hydrogen 2.787 N/A VAL 119.A N LEU 113.A O no hydrogen 3.237 N/A ALA 120.A N GLN 76.A OE1 no hydrogen 2.812 N/A TYR 126.A N PRO 123.A O no hydrogen 3.457 N/A TYR 126.A OH ASP 32.A OD2 no hydrogen 2.811 N/A GLN 127.A NE2 GLY 125.A O no hydrogen 3.059 N/A SER 129.A N ASP 32.A OD1 no hydrogen 2.781 N/A SER 129.A OG ASP 32.A OD1 no hydrogen 3.361 N/A ALA 132.A N SER 129.A OG no hydrogen 3.169 N/A ASN 133.A N SER 129.A O no hydrogen 2.770 N/A ASN 133.A ND2 LEU 128.A O no hydrogen 3.696 N/A ALA 134.A N ALA 130.A O no hydrogen 3.293 N/A VAL 135.A N ASN 131.A O no hydrogen 3.069 N/A LEU 136.A N ALA 132.A O no hydrogen 2.986 N/A ALA 137.A N ASN 133.A O no hydrogen 3.007 N/A THR 138.A N ALA 134.A O no hydrogen 2.984 N/A THR 138.A OG1 ALA 134.A O no hydrogen 3.197 N/A ILE 139.A N VAL 135.A O no hydrogen 3.066 N/A GLN 140.A N LEU 136.A O no hydrogen 2.956 N/A GLY 141.A N ALA 137.A O no hydrogen 3.153 N/A GLY 141.A N THR 138.A O no hydrogen 3.125 N/A LEU 142.A N ILE 139.A O no hydrogen 2.878 N/A GLN 146.A NE2 LEU 295.A O no hydrogen 3.478 N/A GLN 146.A NE2 ALA 296.A O no hydrogen 3.099 N/A GLN 147.A N GLU 143.A O no hydrogen 2.790 N/A GLN 147.A NE2 ILE 139.A O no hydrogen 3.102 N/A ILE 148.A N SER 144.A O no hydrogen 3.000 N/A THR 149.A OG1 GLY 145.A O no hydrogen 2.872 N/A VAL 150.A N GLN 146.A O no hydrogen 3.008 N/A LEU 151.A N GLN 147.A O no hydrogen 3.059 N/A ARG 152.A N ILE 148.A O no hydrogen 2.819 N/A ARG 152.A NH2 GLU 233.A OE1 no hydrogen 3.024 N/A ASN 153.A N THR 149.A O no hydrogen 2.999 N/A ALA 154.A N VAL 150.A O no hydrogen 3.130 N/A VAL 155.A N LEU 151.A O no hydrogen 3.123 N/A VAL 156.A N ARG 152.A O no hydrogen 2.992 N/A ASP 157.A N ASN 153.A O no hydrogen 2.944 N/A MET 158.A N VAL 155.A O no hydrogen 3.104 N/A GLY 159.A N LEU 83.A O no hydrogen 3.032 N/A PHE 160.A N CYS 92.A O no hydrogen 3.061 N/A VAL 166.A N GLN 235.A OE1 no hydrogen 2.950 N/A GLN 169.A N ALA 196.A O no hydrogen 2.697 N/A SER 173.A N ASP 170.A O no hydrogen 3.090 N/A ARG 174.A N THR 171.A O no hydrogen 3.298 N/A ARG 174.A NE GLN 169.A O no hydrogen 2.957 N/A ARG 174.A NH1 ASN 193.A OD1 no hydrogen 3.042 N/A ARG 174.A NH1 ASP 198.A OD2 no hydrogen 3.237 N/A ARG 174.A NH2 GLN 169.A O no hydrogen 3.311 N/A ARG 174.A NH2 ASP 198.A OD2 no hydrogen 2.939 N/A VAL 177.A N ASP 192.A OD1 no hydrogen 3.081 N/A GLU 180.A N GLU 242.A O no hydrogen 2.799 N/A VAL 182.A N ILE 179.A O no hydrogen 2.925 N/A THR 186.A OG1 GLY 285.A O no hydrogen 2.616 N/A VAL 187.A N ASN 184.A OD1 no hydrogen 3.335 N/A LEU 188.A N ASN 184.A O no hydrogen 3.079 N/A ASN 189.A N ALA 185.A O no hydrogen 2.780 N/A TYR 190.A N THR 186.A O no hydrogen 2.797 N/A MET 191.A N VAL 187.A O no hydrogen 3.097 N/A ASP 192.A N LEU 188.A O no hydrogen 2.967 N/A ASN 193.A N ASN 189.A O no hydrogen 2.839 N/A ASN 193.A ND2 ASN 189.A O no hydrogen 3.063 N/A LEU 194.A N TYR 190.A O no hydrogen 3.140 N/A ASN 195.A N MET 191.A O no hydrogen 3.072 N/A ASN 195.A ND2 LEU 239.A O no hydrogen 3.161 N/A ALA 196.A N ASN 193.A O no hydrogen 3.281 N/A ASN 197.A N LEU 194.A O no hydrogen 3.042 N/A ASN 197.A ND2 ASN 236.A OD1 no hydrogen 2.924 N/A ASP 198.A N ASN 193.A O no hydrogen 2.834 N/A THR 201.A N ASP 198.A OD1 no hydrogen 3.201 N/A THR 201.A OG1 ASP 198.A OD1 no hydrogen 2.960 N/A THR 201.A OG1 ASP 198.A OD2 no hydrogen 2.709 N/A LEU 202.A N ASP 198.A O no hydrogen 2.981 N/A ILE 203.A N PHE 199.A O no hydrogen 2.848 N/A GLU 204.A N THR 201.A O no hydrogen 3.198 N/A LEU 205.A N LEU 202.A O no hydrogen 2.940 N/A PHE 206.A N ILE 203.A O no hydrogen 3.052 N/A THR 207.A N ILE 287.A O no hydrogen 2.858 N/A THR 207.A OG1 ASP 209.A OD1 no hydrogen 3.010 N/A THR 207.A OG1 ILE 287.A O no hydrogen 3.315 N/A GLY 210.A N THR 207.A O no hydrogen 2.780 N/A ALA 211.A N PHE 288.A O no hydrogen 3.087 N/A LEU 212.A N ILE 220.A O no hydrogen 3.018 N/A GLN 213.A N VAL 290.A O no hydrogen 2.816 N/A GLN 217.A N PRO 214.A O no hydrogen 3.117 N/A ILE 220.A N LEU 212.A O no hydrogen 2.755 N/A GLY 222.A N GLY 210.A O no hydrogen 2.934 N/A ASN 225.A ND2 VAL 221.A O no hydrogen 2.904 N/A VAL 226.A N GLY 222.A O no hydrogen 2.958 N/A LEU 227.A N LYS 223.A O no hydrogen 2.918 N/A ARG 228.A N GLU 224.A O no hydrogen 3.188 N/A ARG 228.A NH1 ASN 225.A OD1 no hydrogen 3.419 N/A ARG 228.A NH2 ASN 225.A OD1 no hydrogen 3.216 N/A PHE 229.A N ASN 225.A O no hydrogen 3.049 N/A PHE 230.A N VAL 226.A O no hydrogen 2.961 N/A ARG 231.A N LEU 227.A O no hydrogen 2.999 N/A ARG 231.A NH2 ASP 200.A OD1 no hydrogen 3.001 N/A GLU 232.A N ARG 228.A O no hydrogen 2.971 N/A GLU 233.A N PHE 229.A O no hydrogen 3.101 N/A CYS 234.A N PHE 230.A O no hydrogen 3.037 N/A CYS 234.A SG PHE 229.A O no hydrogen 3.406 N/A GLN 235.A NE2 PRO 164.A O no hydrogen 3.262 N/A ASN 236.A N ASN 197.A OD1 no hydrogen 2.929 N/A LYS 238.A N GLN 263.A O no hydrogen 3.025 N/A LEU 239.A N ASN 195.A OD1 no hydrogen 2.733 N/A ILE 240.A N LYS 261.A O no hydrogen 2.855 N/A GLU 242.A N THR 259.A O no hydrogen 2.880 N/A ARG 243.A N THR 259.A O no hydrogen 3.437 N/A ARG 243.A NH1 GLU 180.A OE1 no hydrogen 3.365 N/A GLY 244.A N GLU 180.A O no hydrogen 2.996 N/A VAL 245.A N LYS 257.A O no hydrogen 2.845 N/A GLU 247.A N GLN 255.A O no hydrogen 2.908 N/A ALA 249.A N PHE 253.A O no hydrogen 2.792 N/A PHE 253.A N GLU 250.A O no hydrogen 3.138 N/A THR 254.A N LEU 281.A O no hydrogen 2.937 N/A GLN 255.A N GLU 247.A O no hydrogen 2.752 N/A ILE 256.A N PHE 279.A O no hydrogen 3.063 N/A LYS 257.A N VAL 245.A O no hydrogen 3.051 N/A LYS 257.A NZ THR 12.A OG1 no hydrogen 2.840 N/A VAL 258.A N TRP 277.A O no hydrogen 2.883 N/A THR 259.A N ARG 243.A O no hydrogen 2.948 N/A GLY 260.A N ILE 275.A O no hydrogen 2.977 N/A LYS 261.A N ILE 240.A O no hydrogen 3.015 N/A LYS 261.A NZ ASN 274.A OD1 no hydrogen 2.712 N/A VAL 262.A N MET 273.A O no hydrogen 2.881 N/A GLN 263.A N LYS 238.A O no hydrogen 3.005 N/A TRP 266.A N THR 264.A OG1 no hydrogen 3.269 N/A TRP 266.A NE1 ASN 101.A OD1 no hydrogen 2.953 N/A PHE 267.A N THR 264.A O no hydrogen 3.046 N/A GLY 268.A N THR 264.A O no hydrogen 2.771 N/A ASN 270.A N PHE 267.A O no hydrogen 3.156 N/A MET 273.A N VAL 262.A O no hydrogen 3.044 N/A ILE 275.A N GLY 260.A O no hydrogen 2.893 N/A ALA 276.A N ASP 293.A O no hydrogen 2.901 N/A TRP 277.A N VAL 258.A O no hydrogen 2.710 N/A ARG 278.A N ALA 291.A O no hydrogen 2.829 N/A ARG 278.A NE ASP 293.A OD2 no hydrogen 2.635 N/A ARG 278.A NH1 ARG 6.A O no hydrogen 3.236 N/A ARG 278.A NH1 ILE 8.A O no hydrogen 2.788 N/A ARG 278.A NH2 ASP 293.A OD1 no hydrogen 3.107 N/A PHE 279.A N ILE 256.A O no hydrogen 2.739 N/A LEU 280.A N PHE 289.A O no hydrogen 2.731 N/A LEU 281.A N THR 254.A O no hydrogen 2.859 N/A ASN 282.A N LYS 286.A O no hydrogen 2.837 N/A GLY 285.A N ASN 282.A O no hydrogen 2.718 N/A LYS 286.A N ASN 282.A OD1 no hydrogen 2.631 N/A LYS 286.A NZ GLU 204.A O no hydrogen 2.756 N/A ILE 287.A N LEU 205.A O no hydrogen 2.843 N/A PHE 288.A N LEU 280.A O no hydrogen 2.892 N/A PHE 289.A N LEU 280.A O no hydrogen 3.353 N/A VAL 290.A N ALA 211.A O no hydrogen 2.943 N/A ALA 291.A N ARG 278.A O no hydrogen 2.920 N/A ILE 292.A N GLN 213.A O no hydrogen 2.773 N/A ASP 293.A N ALA 276.A O no hydrogen 2.786 N/A LEU 295.A N ASN 274.A O no hydrogen 2.841 N/A ALA 296.A N LEU 13.A O no hydrogen 2.992 N/A GLU 300.A N SER 297.A O no hydrogen 2.876 N/A LEU 301.A N PRO 298.A O no hydrogen 2.875 N/A