Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cg3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N LYS 36.A O no hydrogen 2.907 N/A LEU 6.A N THR 38.A O no hydrogen 2.960 N/A ILE 7.A N ASP 61.A OD2 no hydrogen 2.830 N/A ILE 8.A N GLN 40.A O no hydrogen 3.113 N/A PHE 9.A N ILE 62.A O no hydrogen 2.984 N/A HIS 10.A N GLU 42.A O no hydrogen 2.986 N/A ALA 11.A N ALA 64.A O no hydrogen 2.962 N/A SER 13.A OG TYR 257.A OH no hydrogen 2.751 N/A LEU 14.A N ALA 11.A O no hydrogen 3.148 N/A SER 15.A N GLY 12.A O no hydrogen 3.035 N/A SER 15.A OG HIS 10.A NE2 no hydrogen 3.401 N/A SER 15.A OG GLY 12.A O no hydrogen 3.034 N/A LEU 18.A N LEU 14.A O no hydrogen 2.875 N/A SER 19.A N SER 15.A O no hydrogen 2.928 N/A SER 19.A OG SER 15.A O no hydrogen 3.413 N/A SER 19.A OG ILE 16.A O no hydrogen 2.738 N/A GLN 20.A N ILE 16.A O no hydrogen 3.333 N/A VAL 21.A N PRO 17.A O no hydrogen 2.930 N/A GLU 22.A N LEU 18.A O no hydrogen 2.838 N/A GLU 23.A N SER 19.A O no hydrogen 3.150 N/A LYS 24.A N GLN 20.A O no hydrogen 3.163 N/A PHE 25.A N VAL 21.A O no hydrogen 2.826 N/A THR 26.A N GLU 22.A O no hydrogen 3.017 N/A THR 26.A N GLU 23.A O no hydrogen 3.261 N/A THR 26.A OG1 GLU 22.A O no hydrogen 2.996 N/A TYR 28.A N LYS 24.A O no hydrogen 3.088 N/A TYR 28.A OH GLU 273.A OE1 no hydrogen 3.381 N/A ALA 29.A N PHE 25.A O no hydrogen 2.679 N/A GLN 30.A N THR 26.A O no hydrogen 3.221 N/A GLN 30.A NE2 GLN 30.A O no hydrogen 3.363 N/A GLU 31.A N LYS 27.A O no hydrogen 3.082 N/A LYS 32.A N TYR 28.A O no hydrogen 2.820 N/A LYS 32.A NZ TYR 28.A OH no hydrogen 3.225 N/A LEU 33.A N ALA 29.A O no hydrogen 2.839 N/A GLY 34.A N GLN 30.A O no hydrogen 2.888 N/A VAL 35.A N ALA 29.A O no hydrogen 3.091 N/A LYS 36.A N ARG 2.A O no hydrogen 2.547 N/A THR 38.A N ALA 4.A O no hydrogen 3.129 N/A GLN 40.A N LEU 6.A O no hydrogen 2.749 N/A GLU 42.A N ILE 8.A O no hydrogen 2.826 N/A SER 44.A N HIS 10.A O no hydrogen 3.011 N/A SER 44.A OG GLY 45.A O no hydrogen 3.073 N/A VAL 47.A N GLN 130.A O no hydrogen 3.011 N/A LYS 48.A N GLN 130.A O no hydrogen 3.279 N/A ALA 49.A N GLY 45.A O no hydrogen 3.007 N/A VAL 50.A N SER 46.A O no hydrogen 3.042 N/A ARG 51.A N VAL 47.A O no hydrogen 2.936 N/A ARG 51.A NE ASP 55.A OD2 no hydrogen 3.213 N/A LYS 52.A N LYS 48.A O no hydrogen 2.930 N/A LYS 52.A NZ GLU 42.A OE1 no hydrogen 2.802 N/A VAL 53.A N VAL 50.A O no hydrogen 3.002 N/A THR 54.A N VAL 50.A O no hydrogen 2.971 N/A THR 54.A OG1 VAL 50.A O no hydrogen 3.247 N/A THR 54.A OG1 ASP 55.A OD1 no hydrogen 3.406 N/A ASP 55.A N ARG 51.A O no hydrogen 2.748 N/A LEU 56.A N ARG 51.A O no hydrogen 3.055 N/A LYS 57.A NZ THR 54.A O no hydrogen 2.837 N/A LYS 57.A NZ TYR 79.A OH no hydrogen 2.598 N/A LYS 58.A N LYS 52.A O no hydrogen 2.812 N/A ASP 61.A N ILE 7.A O no hydrogen 2.880 N/A ILE 62.A N ILE 7.A O no hydrogen 3.156 N/A VAL 63.A N THR 260.A O no hydrogen 3.106 N/A ALA 64.A N PHE 9.A O no hydrogen 3.079 N/A VAL 65.A N GLY 258.A O no hydrogen 2.804 N/A ALA 66.A N SER 46.A OG no hydrogen 2.901 N/A TYR 68.A N VAL 256.A O no hydrogen 2.962 N/A THR 69.A N ASP 67.A OD1 no hydrogen 3.283 N/A THR 69.A OG1 ASP 67.A OD1 no hydrogen 2.654 N/A LEU 70.A N ASP 67.A O no hydrogen 3.144 N/A ILE 71.A N TYR 68.A O no hydrogen 2.966 N/A GLN 73.A N THR 69.A O no hydrogen 3.078 N/A GLN 73.A NE2 THR 249.A O no hydrogen 3.041 N/A LEU 74.A N LEU 70.A O no hydrogen 2.954 N/A MET 75.A N ILE 71.A O no hydrogen 2.803 N/A TYR 79.A N MET 75.A O no hydrogen 2.787 N/A THR 80.A N MET 75.A O no hydrogen 3.260 N/A THR 80.A OG1 PHE 82.A O no hydrogen 3.325 N/A THR 80.A OG1 THR 260.A OG1 no hydrogen 2.648 N/A THR 80.A OG1 VAL 261.A O no hydrogen 3.093 N/A TYR 83.A N PHE 301.A O no hydrogen 3.115 N/A VAL 84.A N ILE 259.A O no hydrogen 2.905 N/A LEU 85.A N VAL 299.A O no hydrogen 2.725 N/A PHE 86.A N TYR 257.A O no hydrogen 3.011 N/A THR 88.A OG1 ASN 89.A O no hydrogen 3.524 N/A THR 88.A OG1 ILE 255.A O no hydrogen 2.616 N/A ASN 89.A N THR 88.A OG1 no hydrogen 2.660 N/A ASN 89.A ND2 SER 209.A OG no hydrogen 2.679 N/A ASN 89.A ND2 TYR 257.A OH no hydrogen 3.115 N/A ASN 89.A ND2 GLN 292.A OE1 no hydrogen 3.674 N/A GLU 90.A N ASN 89.A OD1 no hydrogen 3.118 N/A ILE 91.A N ASN 226.A O no hydrogen 2.964 N/A VAL 92.A N ILE 206.A O no hydrogen 2.902 N/A ILE 93.A N ILE 219.A O no hydrogen 3.219 N/A ALA 94.A N ILE 204.A O no hydrogen 2.915 N/A PHE 95.A N SER 217.A O no hydrogen 2.812 N/A THR 96.A N SER 99.A OG no hydrogen 3.231 N/A LYS 98.A N THR 96.A OG1 no hydrogen 3.098 N/A SER 99.A N THR 96.A O no hydrogen 3.050 N/A SER 99.A OG THR 96.A O no hydrogen 3.412 N/A SER 99.A OG ASP 202.A O no hydrogen 2.591 N/A LYS 100.A N ASP 202.A OD1 no hydrogen 3.032 N/A LYS 100.A NZ ASP 120.A OD2 no hydrogen 2.794 N/A TYR 101.A OH ASP 120.A OD2 no hydrogen 2.429 N/A ALA 102.A N SER 99.A O no hydrogen 3.008 N/A MET 105.A N TYR 101.A O no hydrogen 2.865 N/A LEU 106.A N ALA 102.A O no hydrogen 2.958 N/A LYS 107.A N ASP 103.A O no hydrogen 3.020 N/A ASN 108.A N GLU 104.A O no hydrogen 2.895 N/A ASN 108.A ND2 GLU 104.A O no hydrogen 3.205 N/A LYS 111.A N ASN 108.A O no hydrogen 2.930 N/A TRP 112.A N PRO 109.A O no hydrogen 3.229 N/A TRP 112.A NE1 TYR 148.A OH no hydrogen 2.940 N/A GLU 114.A N LYS 111.A O no hydrogen 2.947 N/A ILE 115.A N LYS 111.A O no hydrogen 3.352 N/A LEU 116.A N TRP 112.A O no hydrogen 3.045 N/A SER 117.A N GLU 114.A O no hydrogen 3.219 N/A SER 117.A OG TYR 113.A O no hydrogen 2.672 N/A ARG 118.A N ILE 115.A O no hydrogen 3.138 N/A ARG 118.A NH1 GLU 104.A OE1 no hydrogen 2.902 N/A ARG 118.A NH1 GLU 104.A OE2 no hydrogen 3.555 N/A ARG 118.A NH2 GLU 104.A OE2 no hydrogen 2.810 N/A ASP 120.A N ASP 120.A OD1 no hydrogen 2.603 N/A VAL 121.A N ARG 118.A O no hydrogen 3.169 N/A SER 122.A N ASP 202.A OD2 no hydrogen 3.024 N/A SER 122.A OG ASP 202.A OD2 no hydrogen 3.250 N/A PHE 123.A N ARG 182.A O no hydrogen 3.120 N/A GLY 124.A N TYR 203.A O no hydrogen 2.903 N/A PHE 125.A N ILE 184.A O no hydrogen 3.213 N/A SER 126.A OG ASP 131.A OD2 no hydrogen 2.670 N/A ASP 127.A N ARG 186.A O no hydrogen 2.948 N/A ASN 129.A N ASP 127.A OD1 no hydrogen 2.916 N/A ASN 129.A ND2 PRO 173.A O no hydrogen 2.803 N/A GLN 130.A N ASP 127.A O no hydrogen 2.934 N/A GLN 130.A NE2 ASP 127.A OD2 no hydrogen 2.984 N/A ASP 131.A N ASP 127.A O no hydrogen 2.884 N/A CYS 133.A N ASP 131.A OD1 no hydrogen 3.485 N/A TYR 135.A N ASP 131.A O no hydrogen 3.082 N/A TYR 135.A OH ASP 67.A OD2 no hydrogen 2.459 N/A ARG 136.A N PRO 132.A O no hydrogen 2.719 N/A ARG 136.A NH1 ALA 66.A O no hydrogen 2.897 N/A ARG 136.A NH1 TYR 207.A OH no hydrogen 2.772 N/A ARG 136.A NH2 ALA 66.A O no hydrogen 2.844 N/A SER 137.A N CYS 133.A O no hydrogen 2.899 N/A SER 137.A OG CYS 133.A O no hydrogen 2.731 N/A VAL 138.A N GLY 134.A O no hydrogen 3.267 N/A MET 139.A N TYR 135.A O no hydrogen 3.001 N/A VAL 140.A N ARG 136.A O no hydrogen 2.671 N/A MET 141.A N SER 137.A O no hydrogen 3.107 N/A LYS 142.A N VAL 138.A O no hydrogen 3.115 N/A LYS 142.A NZ SER 165.A OG no hydrogen 2.986 N/A LYS 142.A NZ GLY 167.A O no hydrogen 3.019 N/A LEU 143.A N MET 139.A O no hydrogen 2.867 N/A ALA 144.A N VAL 140.A O no hydrogen 2.825 N/A GLU 145.A N MET 141.A O no hydrogen 3.066 N/A LEU 146.A N LYS 142.A O no hydrogen 3.092 N/A TYR 147.A N LEU 143.A O no hydrogen 2.732 N/A TYR 148.A N ALA 144.A O no hydrogen 2.852 N/A GLY 149.A N GLU 145.A O no hydrogen 3.014 N/A ILE 152.A N ARG 150.A O no hydrogen 2.737 N/A PHE 153.A N GLU 145.A OE1 no hydrogen 3.031 N/A LYS 154.A N GLU 145.A OE1 no hydrogen 3.282 N/A GLU 155.A N PRO 151.A O no hydrogen 2.980 N/A LEU 156.A N ILE 152.A O no hydrogen 2.866 N/A VAL 157.A N PHE 153.A O no hydrogen 2.921 N/A GLU 158.A N PHE 153.A O no hydrogen 3.188 N/A LYS 159.A N LYS 154.A O no hydrogen 3.052 N/A LYS 159.A NZ GLU 155.A OE1 no hydrogen 3.031 N/A LYS 159.A NZ GLU 155.A OE2 no hydrogen 2.639 N/A THR 160.A OG1 LEU 156.A O no hydrogen 2.618 N/A THR 160.A OG1 VAL 157.A O no hydrogen 3.278 N/A THR 161.A N VAL 157.A O no hydrogen 2.982 N/A THR 161.A OG1 VAL 157.A O no hydrogen 2.750 N/A ASN 162.A N ILE 177.A O no hydrogen 3.121 N/A ASN 162.A ND2 GLU 175.A O no hydrogen 3.064 N/A ILE 163.A N THR 161.A OG1 no hydrogen 2.952 N/A TYR 164.A N TYR 171.A O no hydrogen 3.249 N/A SER 165.A N GLU 158.A OE2 no hydrogen 3.100 N/A SER 165.A OG GLU 158.A OE2 no hydrogen 3.135 N/A ASN 166.A N ARG 169.A O no hydrogen 2.946 N/A THR 168.A OG1 ARG 238.A O no hydrogen 2.747 N/A ARG 169.A N ASN 166.A O no hydrogen 3.166 N/A ILE 170.A N SER 240.A O no hydrogen 2.869 N/A TYR 171.A N TYR 164.A O no hydrogen 2.767 N/A ALA 172.A N THR 242.A O no hydrogen 3.012 N/A LYS 174.A NZ GLY 244.A O no hydrogen 2.942 N/A ILE 177.A N ASN 162.A OD1 no hydrogen 2.843 N/A LYS 179.A N THR 160.A O no hydrogen 2.705 N/A LYS 179.A NZ GLU 158.A O no hydrogen 2.859 N/A LYS 179.A NZ THR 161.A O no hydrogen 3.140 N/A ASP 180.A N THR 160.A O no hydrogen 3.189 N/A LYS 181.A NZ ILE 178.A O no hydrogen 2.845 N/A ARG 182.A N ASP 180.A OD1 no hydrogen 3.125 N/A ARG 182.A NE ASP 180.A OD2 no hydrogen 3.058 N/A ARG 182.A NH1 LEU 116.A O no hydrogen 2.859 N/A ARG 182.A NH1 VAL 121.A O no hydrogen 2.780 N/A ARG 182.A NH2 LEU 116.A O no hydrogen 2.978 N/A VAL 183.A N ASP 180.A O no hydrogen 2.929 N/A ILE 184.A N PHE 123.A O no hydrogen 2.948 N/A ARG 186.A NH1 MET 185.A O no hydrogen 2.957 N/A LYS 188.A N ASP 191.A OD2 no hydrogen 3.364 N/A LYS 188.A NZ ASP 191.A OD1 no hydrogen 2.909 N/A GLU 189.A N ASP 131.A OD2 no hydrogen 2.810 N/A THR 190.A N GLU 189.A OE2 no hydrogen 3.067 N/A ASP 191.A N LYS 188.A O no hydrogen 2.961 N/A LEU 192.A N GLU 189.A O no hydrogen 2.894 N/A VAL 193.A N THR 190.A O no hydrogen 3.388 N/A VAL 196.A N LEU 192.A O no hydrogen 3.164 N/A GLU 197.A N VAL 193.A O no hydrogen 2.903 N/A SER 198.A N GLY 194.A O no hydrogen 3.108 N/A SER 198.A OG LEU 195.A O no hydrogen 3.050 N/A GLY 199.A N VAL 196.A O no hydrogen 3.000 N/A SER 200.A N SER 198.A OG no hydrogen 3.321 N/A SER 200.A OG LEU 195.A O no hydrogen 3.204 N/A SER 200.A OG SER 198.A OG no hydrogen 3.242 N/A LEU 201.A N LEU 195.A O no hydrogen 3.176 N/A ASP 202.A N SER 122.A OG no hydrogen 2.972 N/A TYR 203.A N SER 122.A O no hydrogen 3.190 N/A TYR 203.A OH LYS 100.A O no hydrogen 2.667 N/A ILE 204.A N ALA 94.A O no hydrogen 3.003 N/A PHE 205.A N GLY 124.A O no hydrogen 3.124 N/A ILE 206.A N VAL 92.A O no hydrogen 3.121 N/A LYS 208.A N GLU 90.A O no hydrogen 2.949 N/A SER 209.A N ASN 89.A OD1 no hydrogen 3.276 N/A ALA 211.A N TYR 207.A O no hydrogen 3.090 N/A LYS 212.A N LYS 208.A O no hydrogen 2.978 N/A GLN 213.A N SER 209.A O no hydrogen 2.944 N/A GLN 213.A NE2 ASN 290.A O no hydrogen 2.870 N/A HIS 214.A N VAL 210.A O no hydrogen 3.042 N/A HIS 214.A ND1 VAL 210.A O no hydrogen 3.114 N/A HIS 215.A N LYS 212.A O no hydrogen 3.172 N/A LEU 216.A N ALA 211.A O no hydrogen 2.864 N/A SER 217.A N PHE 95.A O no hydrogen 2.763 N/A ILE 219.A N ILE 93.A O no hydrogen 2.948 N/A ILE 225.A N PRO 222.A O no hydrogen 3.049 N/A ASN 226.A N PRO 222.A O no hydrogen 2.977 N/A ASN 226.A ND2 LEU 221.A O no hydrogen 3.032 N/A ASN 226.A ND2 ASP 223.A OD1 no hydrogen 3.292 N/A GLY 228.A N ASN 226.A OD1 no hydrogen 2.841 N/A ASP 229.A N TYR 236.A OH no hydrogen 2.995 N/A ASN 231.A N ASP 229.A OD1 no hydrogen 2.672 N/A LYS 232.A N ASP 229.A O no hydrogen 3.045 N/A LYS 232.A NZ ASP 224.A OD1 no hydrogen 3.350 N/A TYR 236.A N LYS 232.A O no hydrogen 2.870 N/A TYR 236.A OH ASP 223.A O no hydrogen 2.646 N/A GLY 237.A N ALA 233.A O no hydrogen 2.841 N/A ARG 238.A N PHE 235.A O no hydrogen 3.272 N/A VAL 239.A N TYR 236.A O no hydrogen 2.995 N/A SER 240.A N THR 168.A O no hydrogen 3.269 N/A ILE 241.A N ILE 250.A O no hydrogen 2.962 N/A THR 242.A N ILE 170.A O no hydrogen 2.915 N/A THR 242.A OG1 THR 249.A OG1 no hydrogen 2.768 N/A LEU 243.A N LYS 248.A O no hydrogen 3.046 N/A SER 245.A N ASN 129.A OD1 no hydrogen 3.004 N/A SER 245.A OG ASN 129.A O no hydrogen 2.741 N/A GLY 247.A N LEU 243.A O no hydrogen 2.749 N/A LYS 248.A N THR 246.A OG1 no hydrogen 2.994 N/A LYS 248.A NZ GLN 73.A O no hydrogen 2.966 N/A THR 249.A OG1 THR 242.A OG1 no hydrogen 2.768 N/A ILE 250.A N ILE 241.A O no hydrogen 2.874 N/A ALA 252.A N VAL 239.A O no hydrogen 2.921 N/A LYS 253.A NZ THR 69.A OG1 no hydrogen 2.874 N/A ILE 255.A N LEU 227.A O no hydrogen 2.864 N/A TYR 257.A N ALA 87.A O no hydrogen 2.807 N/A TYR 257.A OH SER 13.A OG no hydrogen 2.751 N/A GLY 258.A N VAL 65.A O no hydrogen 2.900 N/A ILE 259.A N VAL 84.A O no hydrogen 2.956 N/A THR 260.A N VAL 63.A O no hydrogen 3.058 N/A THR 260.A OG1 THR 80.A OG1 no hydrogen 2.648 N/A THR 260.A OG1 PHE 82.A O no hydrogen 2.635 N/A THR 260.A OG1 VAL 261.A O no hydrogen 3.359 N/A LEU 262.A N ASP 61.A O no hydrogen 2.894 N/A LYS 263.A N TYR 79.A O no hydrogen 2.799 N/A LYS 263.A NZ PRO 77.A O no hydrogen 2.834 N/A ALA 265.A N LEU 262.A O no hydrogen 3.227 N/A ASN 267.A N ASP 61.A OD1 no hydrogen 2.999 N/A ARG 268.A NE LEU 262.A O no hydrogen 3.174 N/A ALA 271.A N ASN 267.A O no hydrogen 2.781 N/A ILE 272.A N ARG 268.A O no hydrogen 2.897 N/A GLU 273.A N GLU 269.A O no hydrogen 3.132 N/A PHE 274.A N LEU 270.A O no hydrogen 2.983 N/A LEU 275.A N ALA 271.A O no hydrogen 2.978 N/A ARG 276.A N ILE 272.A O no hydrogen 2.942 N/A ARG 276.A NE GLU 273.A OE2 no hydrogen 3.433 N/A ARG 276.A NH2 GLU 273.A OE1 no hydrogen 2.841 N/A ARG 276.A NH2 GLU 273.A OE2 no hydrogen 3.417 N/A PHE 277.A N GLU 273.A O no hydrogen 2.963 N/A LEU 278.A N PHE 274.A O no hydrogen 2.844 N/A LEU 279.A N LEU 275.A O no hydrogen 2.977 N/A GLY 280.A N PHE 277.A O no hydrogen 3.158 N/A ARG 284.A N GLY 280.A O no hydrogen 3.014 N/A ARG 284.A NH2 LEU 295.A O no hydrogen 3.165 N/A LYS 285.A N ASN 281.A O no hydrogen 3.062 N/A ILE 286.A N GLU 282.A O no hydrogen 3.108 N/A PHE 287.A N GLY 283.A O no hydrogen 2.945 N/A GLU 288.A N ARG 284.A O no hydrogen 2.965 N/A ASP 289.A N LYS 285.A O no hydrogen 2.996 N/A ASN 290.A N PHE 287.A O no hydrogen 3.021 N/A TYR 291.A N GLU 288.A O no hydrogen 3.065 N/A GLN 292.A N PHE 287.A O no hydrogen 2.888 N/A LEU 295.A N PHE 86.A O no hydrogen 2.904 N/A VAL 299.A N LEU 85.A O no hydrogen 2.952 N/A ALA 300.A N GLU 313.A O no hydrogen 2.765 N/A PHE 301.A N TYR 83.A O no hydrogen 2.930 N/A ASN 303.A N ASP 81.A O no hydrogen 2.937 N/A ASN 303.A ND2 ASP 81.A OD2 no hydrogen 2.960 N/A VAL 304.A N GLY 302.A O no hydrogen 3.005 N/A GLU 307.A N GLU 307.A OE1 no hydrogen 2.710 N/A ILE 308.A N PRO 305.A O no hydrogen 3.133 N/A ARG 309.A N PRO 306.A O no hydrogen 3.127 N/A LEU 311.A N ILE 308.A O no hydrogen 2.992 N/A GLU 313.A N PRO 298.A O no hydrogen 2.938 N/A LYS 315.A N ALA 300.A O no hydrogen 2.764 N/A