Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mzk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 8.A ND1 ASP 30.A OD2 no hydrogen 2.995 N/A HIS 8.A NE2 THR 26.A OG1 no hydrogen 2.998 N/A HIS 13.A N CYS 27.A O no hydrogen 2.858 N/A HIS 13.A NE2 SER 29.A OG no hydrogen 2.962 N/A VAL 16.A N ALA 25.A O no hydrogen 2.852 N/A ASP 18.A N ARG 23.A O no hydrogen 2.933 N/A GLY 21.A N ASP 18.A O no hydrogen 3.053 N/A LYS 22.A N ASP 18.A OD1 no hydrogen 3.045 N/A ARG 23.A N ASP 18.A OD1 no hydrogen 3.183 N/A ARG 23.A NE GLU 84.A OE1 no hydrogen 3.400 N/A ARG 23.A NE GLU 84.A OE2 no hydrogen 3.125 N/A ARG 23.A NH1 ASP 18.A OD2 no hydrogen 3.080 N/A ARG 23.A NH2 GLU 84.A OE1 no hydrogen 2.906 N/A LEU 24.A N PHE 36.A O no hydrogen 2.794 N/A ALA 25.A N VAL 16.A O no hydrogen 2.957 N/A THR 26.A N LYS 34.A O no hydrogen 2.897 N/A THR 26.A OG1 HIS 8.A NE2 no hydrogen 2.998 N/A CYS 27.A N ASP 14.A O no hydrogen 3.060 N/A CYS 27.A SG ASP 14.A O no hydrogen 3.762 N/A CYS 27.A SG VAL 56.A O no hydrogen 3.445 N/A SER 28.A N THR 32.A O no hydrogen 3.354 N/A SER 28.A OG LEU 11.A O no hydrogen 2.862 N/A SER 29.A N LEU 11.A O no hydrogen 3.107 N/A SER 29.A OG HIS 13.A NE2 no hydrogen 2.962 N/A ASP 30.A N SER 28.A OG no hydrogen 2.852 N/A LYS 31.A N SER 28.A O no hydrogen 3.089 N/A THR 32.A N ASP 30.A OD1 no hydrogen 2.904 N/A THR 32.A OG1 ASP 30.A OD1 no hydrogen 2.850 N/A ILE 33.A N LEU 49.A O no hydrogen 2.979 N/A LYS 34.A N THR 26.A O no hydrogen 2.740 N/A LYS 34.A NZ ALA 7.A O no hydrogen 2.882 N/A ILE 35.A N ASP 47.A O no hydrogen 3.012 N/A PHE 36.A N LEU 24.A O no hydrogen 2.801 N/A GLU 37.A N LYS 44.A O no hydrogen 2.852 N/A VAL 38.A N LYS 22.A O no hydrogen 2.834 N/A GLU 39.A N THR 42.A O no hydrogen 3.296 N/A THR 42.A N GLU 39.A O no hydrogen 3.410 N/A THR 42.A OG1 GLU 39.A O no hydrogen 2.538 N/A LYS 44.A N GLU 37.A O no hydrogen 3.122 N/A ILE 46.A N ILE 35.A O no hydrogen 2.798 N/A LEU 49.A N ILE 33.A O no hydrogen 2.637 N/A GLU 53.A N ASP 76.A OD2 no hydrogen 2.985 N/A VAL 56.A N SER 28.A O no hydrogen 3.140 N/A TRP 57.A N CYS 73.A O no hydrogen 3.004 N/A TRP 57.A NE1 SER 101.A OG no hydrogen 2.957 N/A ARG 58.A NH1 ASP 209.A OD2 no hydrogen 3.373 N/A ARG 58.A NH2 ASP 209.A OD2 no hydrogen 2.970 N/A VAL 59.A N ASP 14.A OD2 no hydrogen 3.073 N/A ASP 60.A N ALA 71.A O no hydrogen 2.907 N/A TRP 61.A NE1 VAL 16.A O no hydrogen 2.733 N/A ALA 62.A N ILE 69.A O no hydrogen 2.966 N/A LYS 65.A N HIS 63.A ND1 no hydrogen 3.149 N/A PHE 66.A N HIS 63.A O no hydrogen 2.917 N/A GLY 67.A N PRO 64.A O no hydrogen 2.773 N/A LEU 70.A N TRP 82.A O no hydrogen 2.783 N/A ALA 71.A N ASP 60.A O no hydrogen 2.888 N/A SER 72.A N LEU 80.A O no hydrogen 2.777 N/A SER 72.A OG LEU 80.A O no hydrogen 3.308 N/A CYS 73.A N ARG 58.A O no hydrogen 3.157 N/A CYS 73.A SG ARG 58.A O no hydrogen 3.930 N/A CYS 73.A SG VAL 102.A O no hydrogen 3.391 N/A SER 74.A OG GLY 54.A O no hydrogen 3.555 N/A SER 74.A OG PRO 55.A O no hydrogen 3.262 N/A TYR 75.A N PRO 55.A O no hydrogen 3.012 N/A ASP 76.A N SER 74.A OG no hydrogen 2.774 N/A GLY 77.A N SER 74.A O no hydrogen 2.866 N/A LYS 78.A N ASP 76.A OD1 no hydrogen 2.676 N/A LYS 78.A NZ GLU 53.A OE1 no hydrogen 3.148 N/A VAL 79.A N HIS 95.A O no hydrogen 2.900 N/A LEU 80.A N SER 72.A O no hydrogen 2.813 N/A ILE 81.A N ALA 93.A O no hydrogen 3.174 N/A TRP 82.A N LEU 70.A O no hydrogen 2.788 N/A TRP 82.A NE1 SER 72.A OG no hydrogen 2.842 N/A LYS 83.A N SER 90.A O no hydrogen 3.043 N/A LYS 83.A NZ GLU 85.A OE1 no hydrogen 3.315 N/A LYS 83.A NZ GLU 132.A OE1 no hydrogen 3.439 N/A LYS 83.A NZ GLU 132.A OE2 no hydrogen 3.318 N/A GLU 84.A N THR 68.A O no hydrogen 3.026 N/A GLU 85.A N ARG 88.A O no hydrogen 2.995 N/A ARG 88.A N GLU 85.A O no hydrogen 3.110 N/A SER 90.A N LYS 83.A O no hydrogen 3.195 N/A ILE 92.A N ILE 81.A O no hydrogen 2.923 N/A HIS 95.A N VAL 79.A O no hydrogen 2.849 N/A HIS 95.A NE2 SER 126.A OG no hydrogen 2.801 N/A SER 99.A N ASP 122.A OD2 no hydrogen 3.113 N/A SER 101.A OG ASN 103.A OD1 no hydrogen 2.808 N/A VAL 102.A N SER 74.A O no hydrogen 3.215 N/A ASN 103.A N ALA 119.A O no hydrogen 2.768 N/A ASN 103.A ND2 SER 121.A OG no hydrogen 2.851 N/A ASN 103.A ND2 VAL 148.A O no hydrogen 2.847 N/A GLN 106.A N LEU 117.A O no hydrogen 3.031 N/A TRP 107.A N ASP 60.A OD2 no hydrogen 2.746 N/A TRP 107.A NE1 ASP 60.A O no hydrogen 2.823 N/A ALA 108.A N LEU 115.A O no hydrogen 2.909 N/A GLU 111.A N GLU 111.A OE2 no hydrogen 2.729 N/A TYR 112.A N PRO 109.A O no hydrogen 3.025 N/A GLY 113.A N HIS 110.A O no hydrogen 3.129 N/A LEU 116.A N VAL 128.A O no hydrogen 2.790 N/A LEU 117.A N GLN 106.A O no hydrogen 3.043 N/A VAL 118.A N SER 126.A O no hydrogen 2.729 N/A ALA 119.A N SER 104.A O no hydrogen 3.117 N/A SER 120.A N LYS 124.A O no hydrogen 3.172 N/A SER 120.A OG ALA 100.A O no hydrogen 3.231 N/A SER 120.A OG SER 101.A O no hydrogen 2.882 N/A SER 121.A N SER 101.A O no hydrogen 2.770 N/A ASP 122.A N SER 120.A OG no hydrogen 2.927 N/A GLY 123.A N SER 120.A O no hydrogen 3.170 N/A LYS 124.A N ASP 122.A OD1 no hydrogen 2.678 N/A VAL 125.A N ILE 141.A O no hydrogen 2.950 N/A SER 126.A N VAL 118.A O no hydrogen 2.837 N/A SER 126.A OG HIS 95.A NE2 no hydrogen 2.801 N/A VAL 127.A N ILE 139.A O no hydrogen 3.025 N/A VAL 128.A N LEU 116.A O no hydrogen 3.091 N/A PHE 130.A N PRO 114.A O no hydrogen 2.921 N/A LYS 131.A NZ THR 135.A O no hydrogen 3.046 N/A ILE 139.A N VAL 127.A O no hydrogen 2.992 N/A ILE 141.A N VAL 125.A O no hydrogen 2.962 N/A ALA 143.A N GLY 123.A O no hydrogen 2.950 N/A HIS 144.A N GLY 123.A O no hydrogen 3.167 N/A HIS 144.A ND1 ASP 179.A OD1 no hydrogen 2.879 N/A HIS 144.A ND1 ASP 179.A OD2 no hydrogen 3.166 N/A HIS 144.A NE2 THR 175.A OG1 no hydrogen 2.618 N/A ALA 145.A N ASP 179.A OD2 no hydrogen 3.314 N/A VAL 148.A N SER 120.A O no hydrogen 2.891 N/A ASN 149.A N GLY 176.A O no hydrogen 2.772 N/A ASN 149.A ND2 VAL 207.A O no hydrogen 3.010 N/A SER 150.A OG ASP 209.A OD2 no hydrogen 2.697 N/A ALA 151.A N SER 104.A OG no hydrogen 3.257 N/A SER 152.A N VAL 174.A O no hydrogen 2.783 N/A SER 152.A OG TRP 153.A O no hydrogen 3.540 N/A TRP 153.A N GLN 106.A OE1 no hydrogen 2.779 N/A TRP 153.A NE1 GLN 106.A O no hydrogen 2.963 N/A ALA 154.A N LYS 172.A O no hydrogen 2.973 N/A THR 157.A OG1 SER 170.A OG no hydrogen 3.359 N/A GLU 159.A N LYS 168.A O no hydrogen 2.842 N/A ASP 161.A N GLY 166.A O no hydrogen 2.686 N/A HIS 164.A ND1 ASP 161.A OD1 no hydrogen 3.340 N/A HIS 164.A ND1 ASP 161.A OD2 no hydrogen 2.990 N/A ASN 165.A N GLY 162.A O no hydrogen 3.001 N/A GLY 166.A N ASP 161.A O no hydrogen 2.969 N/A LYS 168.A N GLU 159.A O no hydrogen 3.155 N/A SER 170.A N THR 157.A O no hydrogen 3.148 N/A SER 170.A OG THR 157.A OG1 no hydrogen 3.359 N/A ARG 171.A NE GLU 169.A OE1 no hydrogen 2.956 N/A ARG 171.A NH2 GLU 169.A OE1 no hydrogen 3.150 N/A LYS 172.A NZ GLU 197.A OE1 no hydrogen 2.646 N/A LYS 172.A NZ GLU 197.A OE2 no hydrogen 3.198 N/A PHE 173.A N TRP 185.A O no hydrogen 3.056 N/A VAL 174.A N SER 152.A O no hydrogen 2.828 N/A THR 175.A N LYS 183.A O no hydrogen 2.936 N/A THR 175.A OG1 HIS 144.A NE2 no hydrogen 2.618 N/A GLY 176.A N SER 150.A O no hydrogen 2.887 N/A GLY 177.A N LEU 181.A O no hydrogen 3.269 N/A ALA 178.A N GLY 147.A O no hydrogen 2.786 N/A ASN 180.A N GLY 177.A O no hydrogen 3.090 N/A LEU 181.A N ASP 179.A OD1 no hydrogen 3.122 N/A VAL 182.A N LEU 200.A O no hydrogen 3.191 N/A LYS 183.A N THR 175.A O no hydrogen 3.085 N/A LYS 183.A NZ ALA 143.A O no hydrogen 2.958 N/A ILE 184.A N SER 198.A O no hydrogen 3.031 N/A TRP 185.A N PHE 173.A O no hydrogen 2.809 N/A TRP 185.A NE1 THR 175.A OG1 no hydrogen 3.016 N/A LYS 186.A N VAL 195.A O no hydrogen 3.001 N/A LYS 186.A NZ GLU 159.A OE1 no hydrogen 2.865 N/A LYS 186.A NZ GLU 159.A OE2 no hydrogen 2.875 N/A TYR 187.A N ARG 171.A O no hydrogen 3.046 N/A ASN 188.A N THR 193.A O no hydrogen 2.888 N/A ALA 191.A N ASN 188.A OD1 no hydrogen 3.181 N/A GLN 192.A N ASN 188.A O no hydrogen 2.683 N/A VAL 195.A N LYS 186.A O no hydrogen 2.961 N/A GLU 197.A N ILE 184.A O no hydrogen 2.893 N/A LEU 200.A N VAL 182.A O no hydrogen 2.642 N/A HIS 203.A ND1 ASP 228.A OD2 no hydrogen 2.838 N/A HIS 203.A NE2 SER 224.A OG no hydrogen 2.614 N/A SER 204.A N ASP 228.A OD2 no hydrogen 3.153 N/A TRP 206.A N ASP 205.A OD1 no hydrogen 2.623 N/A VAL 207.A N GLY 177.A O no hydrogen 3.283 N/A ARG 208.A N VAL 225.A O no hydrogen 2.728 N/A ARG 208.A NE GLN 227.A OE1 no hydrogen 2.712 N/A ARG 208.A NH2 GLN 227.A OE1 no hydrogen 2.659 N/A ASP 209.A N VAL 225.A O no hydrogen 3.379 N/A VAL 210.A N SER 150.A OG no hydrogen 3.147 N/A ALA 211.A N ALA 223.A O no hydrogen 2.951 N/A TRP 212.A N SER 152.A OG no hydrogen 3.403 N/A SER 213.A N TYR 221.A O no hydrogen 2.788 N/A SER 213.A OG GLY 266.A O no hydrogen 3.195 N/A THR 215.A N SER 213.A OG no hydrogen 3.032 N/A LEU 217.A N THR 215.A OG1 no hydrogen 3.107 N/A ARG 219.A NE ASP 237.A OD1 no hydrogen 2.869 N/A ARG 219.A NH2 ASP 237.A OD1 no hydrogen 3.544 N/A SER 220.A N GLN 236.A O no hydrogen 2.954 N/A TYR 221.A OH GLU 283.A OE2 no hydrogen 2.862 N/A LEU 222.A N TRP 234.A O no hydrogen 2.749 N/A ALA 223.A N ALA 211.A O no hydrogen 2.929 N/A SER 224.A N ILE 232.A O no hydrogen 2.839 N/A SER 224.A OG HIS 203.A NE2 no hydrogen 2.614 N/A SER 224.A OG ILE 232.A O no hydrogen 3.456 N/A VAL 225.A N ASP 209.A O no hydrogen 2.992 N/A SER 226.A N THR 230.A O no hydrogen 3.285 N/A SER 226.A OG ASP 205.A O no hydrogen 2.930 N/A SER 226.A OG TRP 206.A O no hydrogen 2.596 N/A GLN 227.A N TRP 206.A O no hydrogen 3.030 N/A ASP 228.A N SER 226.A OG no hydrogen 2.928 N/A ARG 229.A N SER 226.A O no hydrogen 3.265 N/A ARG 229.A NH1 PHE 253.A O no hydrogen 2.602 N/A ARG 229.A NH1 PRO 254.A O no hydrogen 3.355 N/A THR 230.A N ASP 228.A OD1 no hydrogen 2.697 N/A THR 230.A OG1 ASP 228.A OD1 no hydrogen 2.848 N/A THR 230.A OG1 ASP 228.A OD2 no hydrogen 3.292 N/A CYS 231.A SG SER 224.A O no hydrogen 3.714 N/A ILE 232.A N SER 224.A O no hydrogen 2.995 N/A ILE 233.A N THR 246.A O no hydrogen 2.731 N/A TRP 234.A N LEU 222.A O no hydrogen 2.712 N/A TRP 234.A NE1 SER 224.A OG no hydrogen 2.783 N/A THR 235.A N LYS 244.A O no hydrogen 2.921 N/A GLN 236.A N SER 220.A O no hydrogen 2.983 N/A GLN 236.A NE2 GLU 239.A O no hydrogen 3.536 N/A GLN 236.A NE2 GLY 241.A O no hydrogen 2.917 N/A GLN 240.A N ASN 238.A OD1 no hydrogen 3.338 N/A GLY 241.A N ASN 238.A O no hydrogen 2.750 N/A LYS 244.A N THR 235.A O no hydrogen 2.724 N/A THR 246.A N ILE 233.A O no hydrogen 3.049 N/A LEU 248.A N CYS 231.A O no hydrogen 2.869 N/A LYS 252.A NZ ASP 228.A O no hydrogen 3.456 N/A PHE 253.A N ARG 229.A O no hydrogen 2.773 N/A VAL 256.A N ASP 255.A OD1 no hydrogen 2.670 N/A LEU 257.A N SER 226.A O no hydrogen 3.275 N/A TRP 258.A N SER 272.A O no hydrogen 2.873 N/A ARG 259.A N SER 272.A O no hydrogen 3.393 N/A ARG 259.A NE ASP 209.A OD1 no hydrogen 3.442 N/A ALA 260.A N ASP 209.A OD1 no hydrogen 3.024 N/A SER 261.A N ALA 270.A O no hydrogen 3.196 N/A TRP 262.A NE1 ALA 211.A O no hydrogen 2.933 N/A SER 263.A N VAL 268.A O no hydrogen 2.936 N/A SER 263.A OG ASN 267.A OD1 no hydrogen 3.462 N/A SER 263.A OG VAL 268.A O no hydrogen 3.238 N/A GLY 266.A N SER 263.A O no hydrogen 3.082 N/A VAL 268.A N SER 263.A OG no hydrogen 3.012 N/A LEU 269.A N TRP 281.A O no hydrogen 2.929 N/A ALA 270.A N SER 261.A O no hydrogen 3.033 N/A LEU 271.A N THR 279.A O no hydrogen 2.796 N/A SER 272.A N ARG 259.A O no hydrogen 3.007 N/A GLY 273.A N LYS 277.A O no hydrogen 3.217 N/A GLY 274.A N VAL 256.A O no hydrogen 2.690 N/A ASN 276.A N GLY 273.A O no hydrogen 3.244 N/A VAL 278.A N VAL 295.A O no hydrogen 2.955 N/A THR 279.A N LEU 271.A O no hydrogen 2.912 N/A LEU 280.A N GLY 293.A O no hydrogen 3.057 N/A TRP 281.A N LEU 269.A O no hydrogen 2.841 N/A TRP 281.A NE1 THR 279.A OG1 no hydrogen 2.749 N/A LYS 282.A N GLU 290.A O no hydrogen 3.093 N/A ASN 284.A N LYS 288.A O no hydrogen 2.913 N/A GLY 287.A N ASN 284.A O no hydrogen 2.823 N/A LYS 288.A N ASN 284.A OD1 no hydrogen 2.972 N/A GLU 290.A N LYS 282.A O no hydrogen 2.908 N/A ALA 292.A N LEU 280.A O no hydrogen 2.881 N/A VAL 295.A N VAL 278.A O no hydrogen 3.083 N/A