Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ans_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N ASN 2.A OD1 no hydrogen 3.354 N/A SER 4.A OG ASN 2.A OD1 no hydrogen 2.951 N/A ASP 5.A N ASN 2.A O no hydrogen 2.971 N/A MET 6.A N PRO 3.A O no hydrogen 2.838 N/A HIS 8.A ND1 HIS 20.A NE2 no hydrogen 2.773 N/A HIS 8.A NE2 PRO 3.A O no hydrogen 2.895 N/A GLY 9.A N PHE 21.A O no hydrogen 2.811 N/A TYR 10.A OH GLU 67.A OE2 no hydrogen 2.535 N/A VAL 11.A N LEU 19.A O no hydrogen 2.971 N/A VAL 13.A N VAL 17.A O no hydrogen 2.824 N/A LYS 14.A N VAL 17.A O no hydrogen 3.327 N/A LYS 14.A NZ GLU 85.A OE2 no hydrogen 2.725 N/A VAL 17.A N LYS 14.A O no hydrogen 2.775 N/A ARG 18.A N SER 69.A OG no hydrogen 2.852 N/A LEU 19.A N VAL 11.A O no hydrogen 2.811 N/A HIS 20.A N SER 68.A OG no hydrogen 2.846 N/A HIS 20.A ND1 ASP 61.A OD2 no hydrogen 2.760 N/A HIS 20.A NE2 HIS 8.A ND1 no hydrogen 2.773 N/A PHE 21.A N GLY 9.A O no hydrogen 2.986 N/A VAL 22.A N ALA 59.A O no hydrogen 2.825 N/A GLU 23.A N SER 7.A O no hydrogen 3.060 N/A LEU 24.A N VAL 57.A O no hydrogen 3.022 N/A VAL 30.A N ARG 56.A O no hydrogen 2.795 N/A CYS 31.A N VAL 99.A O no hydrogen 2.765 N/A LEU 32.A N LEU 58.A O no hydrogen 2.752 N/A CYS 33.A N ILE 101.A O no hydrogen 2.753 N/A HIS 34.A ND1 GLY 35.A O no hydrogen 2.833 N/A PHE 36.A N ASP 104.A OD1 no hydrogen 2.900 N/A GLU 38.A N GLY 35.A O no hydrogen 3.000 N/A TRP 40.A N ASP 61.A OD1 no hydrogen 3.210 N/A TYR 41.A N SER 39.A OG no hydrogen 3.001 N/A SER 42.A N SER 39.A O no hydrogen 2.952 N/A SER 42.A OG GLU 38.A OE2 no hydrogen 2.850 N/A SER 42.A OG TYR 219.A OH no hydrogen 2.680 N/A TRP 43.A N TRP 40.A O no hydrogen 3.034 N/A ARG 44.A N TYR 41.A O no hydrogen 2.951 N/A ARG 44.A NE GLU 215.A OE2 no hydrogen 3.080 N/A ARG 44.A NH1 TYR 41.A O no hydrogen 2.977 N/A GLN 46.A N TRP 43.A O no hydrogen 2.906 N/A GLN 46.A NE2 GLN 296.A O no hydrogen 3.538 N/A ILE 47.A N TRP 43.A O no hydrogen 2.943 N/A LEU 50.A N GLN 46.A O no hydrogen 2.832 N/A ALA 51.A N ILE 47.A O no hydrogen 3.088 N/A GLN 52.A N PRO 48.A O no hydrogen 2.890 N/A ALA 53.A N ALA 49.A O no hydrogen 2.914 N/A GLY 54.A N ALA 51.A O no hydrogen 3.085 N/A TYR 55.A N LEU 50.A O no hydrogen 3.118 N/A TYR 55.A OH ASP 312.A OD1 no hydrogen 2.514 N/A ARG 56.A N PRO 28.A O no hydrogen 3.044 N/A ARG 56.A NE GLU 23.A OE2 no hydrogen 2.697 N/A ARG 56.A NH2 GLU 23.A OE2 no hydrogen 2.866 N/A VAL 57.A N LEU 24.A O no hydrogen 2.830 N/A LEU 58.A N VAL 30.A O no hydrogen 2.813 N/A ALA 59.A N VAL 22.A O no hydrogen 2.822 N/A MET 60.A N LEU 32.A O no hydrogen 3.138 N/A ASP 61.A N HIS 20.A O no hydrogen 2.846 N/A MET 62.A N HIS 34.A NE2 no hydrogen 3.020 N/A LYS 63.A NZ GLU 76.A O no hydrogen 2.778 N/A LYS 63.A NZ GLU 76.A OE1 no hydrogen 2.772 N/A LYS 63.A NZ GLU 85.A OE1 no hydrogen 3.550 N/A LYS 63.A NZ GLU 85.A OE2 no hydrogen 2.641 N/A GLY 64.A N SER 69.A O no hydrogen 2.928 N/A TYR 65.A N MET 62.A O no hydrogen 3.046 N/A GLU 67.A N ASP 61.A OD2 no hydrogen 2.975 N/A SER 68.A N TYR 65.A O no hydrogen 2.951 N/A SER 68.A OG ASP 61.A O no hydrogen 2.612 N/A SER 69.A N ARG 18.A O no hydrogen 2.925 N/A SER 69.A OG ARG 16.A O no hydrogen 3.432 N/A SER 69.A OG ARG 18.A O no hydrogen 3.394 N/A GLU 75.A N GLU 75.A OE1 no hydrogen 2.825 N/A GLU 76.A N GLU 73.A O no hydrogen 3.215 N/A TYR 77.A N ILE 74.A O no hydrogen 3.064 N/A TYR 77.A OH PRO 71.A O no hydrogen 2.681 N/A CYS 78.A SG GLU 75.A O no hydrogen 3.503 N/A MET 79.A N ASN 241.A OD1 no hydrogen 2.848 N/A LEU 82.A N CYS 78.A O no hydrogen 3.000 N/A CYS 83.A N MET 79.A O no hydrogen 2.838 N/A CYS 83.A SG MET 79.A O no hydrogen 3.487 N/A CYS 83.A SG LEU 109.A O no hydrogen 3.938 N/A LYS 84.A N GLU 80.A O no hydrogen 3.085 N/A LYS 84.A NZ GLU 80.A OE2 no hydrogen 2.832 N/A GLU 85.A N VAL 81.A O no hydrogen 3.077 N/A MET 86.A N LEU 82.A O no hydrogen 3.174 N/A VAL 87.A N CYS 83.A O no hydrogen 3.039 N/A THR 88.A N LYS 84.A O no hydrogen 2.972 N/A THR 88.A OG1 LYS 84.A O no hydrogen 3.184 N/A PHE 89.A N GLU 85.A O no hydrogen 2.866 N/A LEU 90.A N MET 86.A O no hydrogen 3.171 N/A ASP 91.A N VAL 87.A O no hydrogen 3.028 N/A LYS 92.A N THR 88.A O no hydrogen 2.907 N/A LYS 92.A NZ THR 12.A O no hydrogen 2.725 N/A LEU 93.A N PHE 89.A O no hydrogen 3.043 N/A GLY 94.A N ASP 91.A O no hydrogen 3.002 N/A LEU 95.A N LEU 90.A O no hydrogen 2.854 N/A GLN 97.A NE2 GLU 119.A O no hydrogen 3.169 N/A ALA 98.A N ARG 120.A O no hydrogen 3.067 N/A VAL 99.A N ALA 29.A O no hydrogen 2.914 N/A PHE 100.A N ALA 123.A O no hydrogen 3.004 N/A ILE 101.A N CYS 31.A O no hydrogen 2.943 N/A GLY 102.A N ALA 125.A O no hydrogen 2.959 N/A HIS 103.A N CYS 33.A O no hydrogen 2.989 N/A HIS 103.A NE2 HIS 293.A O no hydrogen 2.798 N/A ASP 104.A N LEU 127.A O no hydrogen 3.392 N/A GLY 106.A N HIS 103.A O no hydrogen 2.873 N/A GLY 107.A N ASP 104.A O no hydrogen 2.816 N/A MET 108.A N ASP 104.A O no hydrogen 3.158 N/A LEU 109.A N TRP 105.A O no hydrogen 3.100 N/A VAL 110.A N GLY 106.A O no hydrogen 2.979 N/A TRP 111.A N GLY 107.A O no hydrogen 3.174 N/A TRP 111.A NE1 THR 129.A O no hydrogen 2.790 N/A TYR 112.A N MET 108.A O no hydrogen 3.133 N/A MET 113.A N LEU 109.A O no hydrogen 2.860 N/A ALA 114.A N VAL 110.A O no hydrogen 3.005 N/A LEU 115.A N TRP 111.A O no hydrogen 3.025 N/A PHE 116.A N TYR 112.A O no hydrogen 2.891 N/A TYR 117.A N MET 113.A O no hydrogen 2.726 N/A GLU 119.A N GLU 119.A OE1 no hydrogen 2.892 N/A ARG 120.A N TYR 117.A O no hydrogen 2.917 N/A ARG 120.A NE SER 96.A O no hydrogen 2.809 N/A ARG 120.A NH1 ASP 91.A OD1 no hydrogen 2.710 N/A ARG 120.A NH1 LEU 95.A O no hydrogen 2.909 N/A ARG 120.A NH2 ASP 91.A OD1 no hydrogen 2.720 N/A VAL 121.A N PRO 118.A O no hydrogen 3.336 N/A ARG 122.A N ALA 98.A O no hydrogen 2.982 N/A ARG 122.A NH1 ARG 122.A O no hydrogen 3.504 N/A VAL 124.A N PRO 256.A O no hydrogen 2.972 N/A ALA 125.A N PHE 100.A O no hydrogen 2.883 N/A SER 126.A N LEU 258.A O no hydrogen 2.927 N/A SER 126.A OG THR 129.A O no hydrogen 2.617 N/A LEU 127.A N GLY 102.A O no hydrogen 2.810 N/A ASN 128.A N VAL 260.A O no hydrogen 2.795 N/A ASN 128.A ND2 ASP 265.A OD2 no hydrogen 2.626 N/A THR 129.A OG1 ASP 104.A O no hydrogen 2.675 N/A ASN 137.A N ASN 135.A OD1 no hydrogen 3.114 N/A MET 138.A N ASN 135.A OD1 no hydrogen 3.420 N/A GLU 142.A N SER 139.A O no hydrogen 3.246 N/A GLU 142.A N SER 139.A OG no hydrogen 3.263 N/A SER 143.A N SER 139.A O no hydrogen 3.320 N/A SER 143.A OG SER 139.A O no hydrogen 3.356 N/A ILE 144.A N LEU 141.A O no hydrogen 3.418 N/A ALA 146.A N GLU 142.A O no hydrogen 3.248 N/A ASN 147.A N SER 143.A O no hydrogen 2.922 N/A LEU 154.A N ASP 151.A O no hydrogen 3.127 N/A TYR 155.A OH GLU 165.A OE1 no hydrogen 2.581 N/A PHE 156.A N TYR 152.A O no hydrogen 2.988 N/A GLN 157.A N LEU 154.A O no hydrogen 3.145 N/A GLN 157.A NE2 GLN 153.A O no hydrogen 2.915 N/A GLN 157.A NE2 TYR 235.A O no hydrogen 2.996 N/A GLY 160.A N GLU 163.A OE1 no hydrogen 2.908 N/A VAL 161.A N GLU 158.A O no hydrogen 3.281 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.887 N/A ALA 164.A N GLY 160.A O no hydrogen 3.146 N/A GLU 165.A N VAL 161.A O no hydrogen 3.308 N/A LEU 166.A N ALA 162.A O no hydrogen 2.862 N/A GLU 167.A N GLU 163.A O no hydrogen 2.877 N/A ARG 172.A N ASN 169.A OD1 no hydrogen 3.144 N/A ARG 172.A NE PRO 202.A O no hydrogen 2.724 N/A ARG 172.A NH2 PHE 198.A O no hydrogen 3.180 N/A ARG 172.A NH2 SER 201.A O no hydrogen 2.601 N/A ARG 172.A NH2 PRO 202.A O no hydrogen 3.223 N/A THR 173.A N ASN 169.A O no hydrogen 2.877 N/A THR 173.A OG1 LEU 166.A O no hydrogen 2.704 N/A THR 173.A OG1 ASN 169.A O no hydrogen 3.090 N/A PHE 174.A N LEU 170.A O no hydrogen 3.016 N/A LYS 175.A N SER 171.A O no hydrogen 3.040 N/A LYS 175.A NZ GLU 213.A OE1 no hydrogen 2.809 N/A SER 176.A N ARG 172.A O no hydrogen 2.897 N/A SER 176.A OG ARG 172.A O no hydrogen 2.614 N/A LEU 177.A N THR 173.A O no hydrogen 3.024 N/A PHE 178.A N PHE 174.A O no hydrogen 2.930 N/A ARG 179.A NE GLU 183.A O no hydrogen 2.701 N/A ARG 179.A NH1 LYS 175.A O no hydrogen 2.943 N/A ARG 179.A NH1 SER 206.A O no hydrogen 2.770 N/A ARG 179.A NH2 SER 206.A OG no hydrogen 3.315 N/A ALA 180.A N GLU 183.A OE2 no hydrogen 2.929 N/A GLU 183.A N ALA 180.A O no hydrogen 2.808 N/A SER 184.A N SER 181.A O no hydrogen 3.379 N/A SER 184.A OG LEU 186.A O no hydrogen 3.362 N/A LEU 186.A N SER 184.A OG no hydrogen 3.352 N/A LYS 190.A NZ ASP 151.A OD1 no hydrogen 3.524 N/A CYS 192.A SG ASP 151.A OD2 no hydrogen 3.754 N/A GLY 195.A N CYS 192.A O no hydrogen 3.392 N/A LEU 197.A N GLU 165.A OE1 no hydrogen 2.956 N/A PHE 198.A N GLU 165.A OE2 no hydrogen 2.666 N/A SER 201.A N PHE 198.A O no hydrogen 3.053 N/A SER 201.A OG PHE 198.A O no hydrogen 2.654 N/A SER 208.A OG GLU 183.A OE2 no hydrogen 2.711 N/A ARG 209.A N GLU 183.A OE1 no hydrogen 2.931 N/A ARG 209.A NH2 ASP 182.A OD1 no hydrogen 2.385 N/A MET 210.A N SER 208.A OG no hydrogen 2.954 N/A VAL 211.A N SER 208.A O no hydrogen 3.276 N/A THR 212.A N GLU 215.A OE1 no hydrogen 3.111 N/A GLU 215.A N THR 212.A OG1 no hydrogen 3.094 N/A ILE 216.A N THR 212.A O no hydrogen 3.139 N/A GLN 217.A N GLU 213.A O no hydrogen 2.907 N/A GLN 217.A NE2 SER 171.A OG no hydrogen 3.389 N/A GLN 217.A NE2 GLU 213.A OE2 no hydrogen 2.935 N/A PHE 218.A N GLU 214.A O no hydrogen 3.113 N/A TYR 219.A N GLU 215.A O no hydrogen 3.373 N/A TYR 219.A OH SER 42.A OG no hydrogen 2.680 N/A VAL 220.A N ILE 216.A O no hydrogen 3.113 N/A GLN 221.A N GLN 217.A O no hydrogen 3.011 N/A GLN 222.A N PHE 218.A O no hydrogen 3.044 N/A PHE 223.A N TYR 219.A O no hydrogen 3.002 N/A LYS 224.A N VAL 220.A O no hydrogen 3.171 N/A LYS 224.A N GLN 221.A O no hydrogen 3.287 N/A LYS 225.A NZ GLY 66.A O no hydrogen 3.457 N/A LYS 225.A NZ SER 68.A O no hydrogen 3.260 N/A GLY 227.A N PHE 223.A O no hydrogen 2.930 N/A PHE 228.A N GLU 167.A OE2 no hydrogen 2.920 N/A ARG 229.A NE PRO 72.A O no hydrogen 2.755 N/A ARG 229.A NH2 PRO 72.A O no hydrogen 3.242 N/A LEU 232.A N PHE 228.A O no hydrogen 2.805 N/A ASN 233.A N ARG 229.A O no hydrogen 2.919 N/A ASN 233.A ND2 PRO 72.A O no hydrogen 2.834 N/A TRP 234.A N PRO 231.A O no hydrogen 3.255 N/A TRP 234.A NE1 LYS 63.A O no hydrogen 2.926 N/A TYR 235.A N LEU 232.A O no hydrogen 2.915 N/A ARG 236.A N ASN 233.A O no hydrogen 3.089 N/A ARG 236.A NE PHE 156.A O no hydrogen 2.642 N/A ARG 236.A NH1 GLU 163.A OE2 no hydrogen 2.712 N/A ARG 236.A NH1 ASN 233.A OD1 no hydrogen 3.211 N/A ARG 236.A NH2 PHE 156.A O no hydrogen 2.974 N/A ARG 236.A NH2 GLU 163.A OE1 no hydrogen 2.848 N/A ARG 236.A NH2 GLU 163.A OE2 no hydrogen 3.349 N/A ASN 237.A ND2 ILE 74.A O no hydrogen 3.080 N/A ASN 237.A ND2 ASN 233.A O no hydrogen 2.941 N/A ARG 240.A NE ASN 237.A OD1 no hydrogen 2.904 N/A ARG 240.A NH2 ARG 236.A O no hydrogen 3.387 N/A ARG 240.A NH2 ASN 237.A OD1 no hydrogen 2.800 N/A ASN 241.A N ASN 237.A O no hydrogen 2.831 N/A TRP 242.A N MET 238.A O no hydrogen 2.915 N/A TRP 242.A NE1 ASN 135.A O no hydrogen 3.046 N/A LYS 243.A N GLU 239.A O no hydrogen 2.953 N/A TRP 244.A N ARG 240.A O no hydrogen 2.988 N/A ALA 245.A N ASN 241.A O no hydrogen 2.888 N/A CYS 246.A N TRP 242.A O no hydrogen 3.039 N/A CYS 246.A SG TRP 242.A O no hydrogen 3.410 N/A LYS 247.A N TRP 244.A O no hydrogen 2.978 N/A SER 248.A N ALA 245.A O no hydrogen 3.086 N/A SER 248.A OG ALA 245.A O no hydrogen 2.575 N/A LEU 249.A N ALA 245.A O no hydrogen 3.249 N/A ARG 251.A N SER 248.A O no hydrogen 2.808 N/A LEU 258.A N VAL 124.A O no hydrogen 2.838 N/A MET 259.A N LYS 284.A O no hydrogen 2.896 N/A VAL 260.A N SER 126.A O no hydrogen 2.909 N/A THR 261.A N GLY 286.A O no hydrogen 2.901 N/A THR 261.A OG1 GLY 286.A O no hydrogen 3.165 N/A THR 261.A OG1 HIS 287.A ND1 no hydrogen 2.665 N/A GLU 263.A N ILE 288.A O no hydrogen 2.952 N/A LYS 264.A N CYS 291.A O no hydrogen 2.749 N/A ASP 265.A N ALA 262.A O no hydrogen 3.121 N/A VAL 267.A N ASP 265.A OD1 no hydrogen 3.055 N/A LEU 268.A N ASP 265.A OD1 no hydrogen 3.000 N/A MET 272.A N VAL 269.A O no hydrogen 2.892 N/A SER 273.A N PRO 270.A O no hydrogen 3.011 N/A SER 273.A OG PRO 270.A O no hydrogen 2.710 N/A GLN 274.A N GLN 271.A O no hydrogen 3.046 N/A MET 276.A N SER 273.A O no hydrogen 3.071 N/A ASP 278.A N HIS 275.A O no hydrogen 3.136 N/A TRP 279.A N MET 276.A O no hydrogen 3.099 N/A TRP 279.A NE1 PHE 131.A O no hydrogen 2.758 N/A ILE 280.A N MET 276.A O no hydrogen 2.942 N/A HIS 282.A NE2 ILE 255.A O no hydrogen 2.810 N/A LEU 283.A N ILE 280.A O no hydrogen 3.111 N/A LYS 284.A N ALA 257.A O no hydrogen 2.934 N/A LYS 284.A NZ HIS 282.A O no hydrogen 3.211 N/A ARG 285.A NE GLU 277.A OE1 no hydrogen 3.209 N/A ARG 285.A NH1 SER 273.A OG no hydrogen 2.911 N/A ARG 285.A NH2 SER 273.A O no hydrogen 2.701 N/A ARG 285.A NH2 GLU 277.A OE2 no hydrogen 2.597 N/A GLY 286.A N MET 259.A O no hydrogen 3.061 N/A HIS 287.A ND1 THR 261.A OG1 no hydrogen 2.665 N/A ILE 288.A N THR 261.A O no hydrogen 2.890 N/A ASP 290.A N GLU 263.A OE1 no hydrogen 2.763 N/A CYS 291.A SG GLY 292.A O no hydrogen 3.683 N/A GLY 292.A N ASP 298.A OD2 no hydrogen 2.723 N/A HIS 293.A ND1 ASP 265.A OD2 no hydrogen 2.957 N/A THR 295.A OG1 ASN 128.A OD1 no hydrogen 2.557 N/A THR 295.A OG1 HIS 293.A O no hydrogen 3.097 N/A GLN 296.A N GLN 296.A OE1 no hydrogen 2.892 N/A MET 297.A N TRP 294.A O no hydrogen 3.104 N/A ASP 298.A N TRP 294.A O no hydrogen 2.832 N/A LYS 299.A N THR 295.A O no hydrogen 2.897 N/A LYS 299.A NZ ASP 290.A O no hydrogen 3.268 N/A LYS 299.A NZ ASP 298.A OD1 no hydrogen 3.149 N/A GLU 302.A N GLU 302.A OE1 no hydrogen 2.712 N/A VAL 303.A N LYS 299.A O no hydrogen 2.910 N/A ASN 304.A N PRO 300.A O no hydrogen 2.779 N/A GLN 305.A N THR 301.A O no hydrogen 2.994 N/A ILE 306.A N GLU 302.A O no hydrogen 3.062 N/A LEU 307.A N VAL 303.A O no hydrogen 2.932 N/A ILE 308.A N ASN 304.A O no hydrogen 2.962 N/A LYS 309.A N GLN 305.A O no hydrogen 3.062 N/A TRP 310.A N ILE 306.A O no hydrogen 3.168 N/A LEU 311.A N LEU 307.A O no hydrogen 2.832 N/A ASP 312.A N ILE 308.A O no hydrogen 2.853 N/A SER 313.A N LYS 309.A O no hydrogen 3.030 N/A SER 313.A N TRP 310.A O no hydrogen 3.187 N/A SER 313.A OG LYS 309.A O no hydrogen 2.745 N/A