Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1mss_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLN 217.A O no hydrogen 2.886 N/A LYS 2.A NZ VAL 220.A O no hydrogen 2.869 N/A GLN 4.A NE2 ASP 35.A OD1 no hydrogen 2.914 N/A ILE 6.A N ASN 221.A O no hydrogen 3.217 N/A ALA 7.A N GLN 37.A O no hydrogen 3.000 N/A ALA 8.A N PHE 223.A O no hydrogen 2.986 N/A ALA 9.A N VAL 39.A O no hydrogen 2.728 N/A ASN 10.A N VAL 225.A O no hydrogen 2.669 N/A TRP 11.A N ALA 41.A O no hydrogen 3.041 N/A LYS 12.A NZ GLU 89.A OE2 no hydrogen 2.299 N/A GLY 15.A N CYS 13.A O no hydrogen 2.331 N/A SER 16.A OG SER 19.A OG no hydrogen 2.309 N/A GLN 18.A N GLN 18.A OE1 no hydrogen 2.566 N/A SER 19.A N SER 16.A OG no hydrogen 3.070 N/A SER 19.A OG SER 16.A OG no hydrogen 2.309 N/A LEU 20.A N SER 16.A O no hydrogen 2.891 N/A SER 21.A N GLN 17.A O no hydrogen 2.762 N/A GLU 22.A N GLN 18.A O no hydrogen 2.752 N/A LEU 23.A N SER 19.A O no hydrogen 3.235 N/A ILE 24.A N LEU 20.A O no hydrogen 3.152 N/A ASP 25.A N SER 21.A O no hydrogen 3.227 N/A LEU 26.A N GLU 22.A O no hydrogen 3.079 N/A PHE 27.A N LEU 23.A O no hydrogen 2.927 N/A ASN 28.A N ILE 24.A O no hydrogen 2.915 N/A ASN 28.A ND2 ARG 53.A O no hydrogen 2.929 N/A SER 29.A N ASP 25.A O no hydrogen 2.999 N/A SER 29.A OG LEU 26.A O no hydrogen 3.113 N/A THR 30.A N PHE 27.A O no hydrogen 3.115 N/A THR 30.A OG1 LEU 26.A O no hydrogen 2.739 N/A HIS 34.A NE2 THR 241.A OG1 no hydrogen 3.069 N/A GLN 37.A N PRO 5.A O no hydrogen 3.175 N/A GLN 37.A NE2 CYS 38.A O no hydrogen 2.673 N/A CYS 38.A N LYS 58.A O no hydrogen 2.875 N/A VAL 39.A N ALA 7.A O no hydrogen 2.923 N/A VAL 40.A N VAL 60.A O no hydrogen 2.975 N/A ALA 41.A N ALA 9.A O no hydrogen 2.746 N/A SER 42.A N ALA 62.A O no hydrogen 3.149 N/A SER 42.A OG THR 43.A O no hydrogen 3.075 N/A THR 43.A OG1 SER 45.A OG no hydrogen 3.420 N/A SER 45.A OG THR 43.A OG1 no hydrogen 3.420 N/A SER 45.A OG HIS 46.A ND1 no hydrogen 3.086 N/A HIS 46.A N THR 43.A O no hydrogen 3.321 N/A HIS 46.A ND1 SER 45.A OG no hydrogen 3.086 N/A LEU 47.A N THR 43.A O no hydrogen 3.289 N/A LEU 47.A N SER 44.A O no hydrogen 3.256 N/A THR 50.A N HIS 46.A O no hydrogen 3.103 N/A LYS 51.A N LEU 47.A O no hydrogen 3.091 N/A LYS 51.A NZ PHE 78.A O no hydrogen 2.440 N/A GLU 52.A N ALA 48.A O no hydrogen 3.132 N/A GLU 52.A N MET 49.A O no hydrogen 2.762 N/A ARG 53.A N MET 49.A O no hydrogen 3.047 N/A LEU 54.A N THR 50.A O no hydrogen 2.996 N/A SER 55.A N ASN 28.A OD1 no hydrogen 2.909 N/A SER 55.A OG ASN 28.A OD1 no hydrogen 3.470 N/A HIS 56.A N ASN 28.A OD1 no hydrogen 3.040 N/A LYS 58.A N HIS 56.A ND1 no hydrogen 2.918 N/A LYS 58.A NZ ILE 32.A O no hydrogen 3.260 N/A LYS 58.A NZ HIS 34.A O no hydrogen 2.857 N/A PHE 59.A N HIS 56.A O no hydrogen 3.342 N/A VAL 60.A N CYS 38.A O no hydrogen 3.052 N/A ALA 62.A N VAL 40.A O no hydrogen 3.014 N/A ALA 63.A N TRP 82.A O no hydrogen 2.749 N/A GLN 64.A NE2 TRP 11.A O no hydrogen 3.019 N/A ASN 65.A N VAL 84.A O no hydrogen 3.133 N/A ALA 71.A N ASN 68.A OD1 no hydrogen 2.824 N/A LEU 72.A N ASN 68.A O no hydrogen 2.960 N/A ALA 73.A N ALA 69.A O no hydrogen 3.084 N/A SER 74.A N ASP 70.A O no hydrogen 3.116 N/A SER 74.A OG ASP 70.A O no hydrogen 2.768 N/A SER 74.A OG ALA 71.A O no hydrogen 3.532 N/A LEU 75.A N ALA 71.A O no hydrogen 3.185 N/A LYS 76.A N LEU 72.A O no hydrogen 2.949 N/A ASP 77.A N ALA 73.A O no hydrogen 2.953 N/A PHE 78.A N SER 74.A O no hydrogen 2.591 N/A GLY 79.A N LYS 76.A O no hydrogen 3.137 N/A VAL 80.A N LEU 75.A O no hydrogen 2.850 N/A ILE 83.A N MET 114.A O no hydrogen 2.846 N/A VAL 84.A N ALA 63.A O no hydrogen 2.957 N/A LEU 85.A N ILE 116.A O no hydrogen 2.886 N/A SER 88.A N GLU 159.A OE1 no hydrogen 2.880 N/A SER 88.A OG GLU 159.A OE1 no hydrogen 3.219 N/A SER 88.A OG GLU 159.A OE2 no hydrogen 2.445 N/A GLU 89.A N HIS 87.A ND1 no hydrogen 3.348 N/A ARG 90.A N HIS 87.A O no hydrogen 2.961 N/A ARG 90.A NH1 GLU 96.A OE2 no hydrogen 2.769 N/A ARG 91.A N HIS 87.A O no hydrogen 3.254 N/A ARG 91.A NH1 GLY 86.A O no hydrogen 3.155 N/A ARG 91.A NH2 ASN 98.A OD1 no hydrogen 2.793 N/A ALA 92.A N SER 88.A O no hydrogen 3.037 N/A TYR 93.A N GLU 89.A O no hydrogen 3.070 N/A TYR 94.A N ARG 90.A O no hydrogen 2.982 N/A GLU 96.A N ARG 90.A O no hydrogen 3.391 N/A THR 97.A OG1 GLU 99.A OE1 no hydrogen 3.519 N/A GLU 99.A N THR 97.A OG1 no hydrogen 3.208 N/A ILE 100.A N THR 97.A OG1 no hydrogen 3.100 N/A VAL 101.A N THR 97.A O no hydrogen 2.761 N/A ALA 102.A N ASN 98.A O no hydrogen 2.961 N/A ASP 103.A N GLU 99.A O no hydrogen 2.849 N/A LYS 104.A N ILE 100.A O no hydrogen 3.084 N/A LYS 104.A NZ ASN 65.A O no hydrogen 2.828 N/A LYS 104.A NZ GLU 96.A OE1 no hydrogen 3.321 N/A LYS 104.A NZ GLU 96.A OE2 no hydrogen 3.143 N/A VAL 105.A N VAL 101.A O no hydrogen 3.181 N/A ALA 106.A N ALA 102.A O no hydrogen 3.180 N/A ALA 107.A N ASP 103.A O no hydrogen 3.078 N/A ALA 108.A N LYS 104.A O no hydrogen 2.887 N/A VAL 109.A N VAL 105.A O no hydrogen 2.999 N/A ALA 110.A N ALA 106.A O no hydrogen 3.058 N/A SER 111.A N ALA 107.A O no hydrogen 2.922 N/A SER 111.A OG ALA 107.A O no hydrogen 3.158 N/A GLY 112.A N VAL 109.A O no hydrogen 3.326 N/A PHE 113.A N ALA 108.A O no hydrogen 3.070 N/A MET 114.A N ASN 81.A O no hydrogen 2.815 N/A VAL 115.A N LYS 153.A O no hydrogen 2.936 N/A ILE 116.A N ILE 83.A O no hydrogen 2.924 N/A ALA 117.A N VAL 155.A O no hydrogen 2.755 N/A CYS 118.A N LEU 85.A O no hydrogen 2.904 N/A CYS 118.A SG LEU 85.A O no hydrogen 3.844 N/A ILE 119.A N ALA 157.A O no hydrogen 3.097 N/A GLY 120.A N GLN 138.A OE1 no hydrogen 2.778 N/A GLU 121.A N GLU 121.A OE1 no hydrogen 2.808 N/A THR 122.A OG1 GLU 125.A OE2 no hydrogen 3.146 N/A ARG 126.A N THR 122.A O no hydrogen 2.902 N/A ARG 126.A NE GLU 121.A OE2 no hydrogen 3.184 N/A GLU 127.A N LEU 123.A O no hydrogen 2.678 N/A SER 128.A N GLN 124.A O no hydrogen 3.176 N/A SER 128.A OG GLN 124.A O no hydrogen 2.476 N/A GLY 129.A N ARG 126.A O no hydrogen 2.633 N/A ARG 130.A N GLU 125.A O no hydrogen 2.638 N/A THR 131.A OG1 GLU 121.A OE2 no hydrogen 2.917 N/A VAL 134.A N ARG 130.A O no hydrogen 2.857 N/A VAL 135.A N THR 131.A O no hydrogen 3.095 N/A LEU 136.A N ALA 132.A O no hydrogen 2.985 N/A THR 137.A N VAL 133.A O no hydrogen 2.889 N/A THR 137.A OG1 VAL 133.A O no hydrogen 2.501 N/A GLN 138.A N VAL 134.A O no hydrogen 3.106 N/A GLN 138.A NE2 GLY 120.A O no hydrogen 3.358 N/A ILE 139.A N VAL 135.A O no hydrogen 3.102 N/A ALA 140.A N LEU 136.A O no hydrogen 2.943 N/A ALA 141.A N THR 137.A O no hydrogen 3.125 N/A ILE 142.A N GLN 138.A O no hydrogen 3.214 N/A ALA 143.A N ILE 139.A O no hydrogen 2.917 N/A LYS 144.A N ALA 141.A O no hydrogen 3.136 N/A LYS 145.A N ILE 142.A O no hydrogen 3.028 N/A LYS 147.A N ASP 150.A OD2 no hydrogen 3.055 N/A LYS 148.A NZ ILE 190.A O no hydrogen 3.035 N/A LYS 148.A NZ ASP 193.A OD1 no hydrogen 3.053 N/A ASP 150.A N LYS 147.A O no hydrogen 3.071 N/A ALA 152.A N ALA 149.A O no hydrogen 3.362 N/A LYS 153.A N ASP 150.A O no hydrogen 2.859 N/A LYS 153.A NZ GLY 112.A O no hydrogen 2.892 N/A VAL 154.A N TRP 151.A O no hydrogen 2.877 N/A VAL 155.A N VAL 115.A O no hydrogen 2.729 N/A ILE 156.A N ARG 199.A O no hydrogen 2.932 N/A ALA 157.A N ALA 117.A O no hydrogen 2.850 N/A TYR 158.A N LEU 201.A O no hydrogen 2.851 N/A TYR 158.A OH GLU 121.A OE1 no hydrogen 2.759 N/A GLU 159.A N ILE 119.A O no hydrogen 2.733 N/A VAL 161.A N GLU 159.A O no hydrogen 2.638 N/A TRP 162.A NE1 TYR 158.A OH no hydrogen 3.221 N/A ALA 163.A N PRO 160.A O no hydrogen 2.714 N/A ILE 164.A N VAL 161.A O no hydrogen 3.177 N/A THR 166.A OG1 TRP 162.A O no hydrogen 2.342 N/A THR 171.A OG1 GLN 173.A OE1 no hydrogen 3.122 N/A GLN 174.A N THR 171.A O no hydrogen 2.875 N/A GLN 174.A N THR 171.A OG1 no hydrogen 3.414 N/A GLN 174.A NE2 THR 171.A OG1 no hydrogen 2.713 N/A ALA 175.A N THR 171.A O no hydrogen 3.225 N/A GLN 176.A N PRO 172.A O no hydrogen 3.254 N/A GLN 176.A NE2 ASP 219.A OD2 no hydrogen 2.521 N/A GLU 177.A N GLN 173.A O no hydrogen 3.356 N/A ALA 178.A N GLN 174.A O no hydrogen 3.265 N/A HIS 179.A N ALA 175.A O no hydrogen 2.934 N/A HIS 179.A ND1 ASP 219.A O no hydrogen 3.185 N/A ALA 180.A N GLN 176.A O no hydrogen 2.788 N/A LEU 181.A N GLU 177.A O no hydrogen 2.790 N/A ILE 182.A N ALA 178.A O no hydrogen 2.919 N/A ARG 183.A N HIS 179.A O no hydrogen 2.911 N/A ARG 183.A NE ASP 219.A OD1 no hydrogen 2.898 N/A ARG 183.A NH1 ALA 195.A O no hydrogen 2.788 N/A ARG 183.A NH1 LEU 198.A O no hydrogen 2.733 N/A ARG 183.A NH2 ASP 219.A O no hydrogen 3.197 N/A ARG 183.A NH2 ASN 221.A OD1 no hydrogen 2.684 N/A SER 184.A N ALA 180.A O no hydrogen 3.057 N/A SER 184.A OG LEU 181.A O no hydrogen 2.884 N/A TRP 185.A N LEU 181.A O no hydrogen 3.481 N/A VAL 186.A N ILE 182.A O no hydrogen 3.403 N/A SER 187.A N ARG 183.A O no hydrogen 3.045 N/A SER 188.A N SER 184.A O no hydrogen 2.763 N/A LYS 189.A N TRP 185.A O no hydrogen 2.525 N/A ILE 190.A N VAL 186.A O no hydrogen 2.626 N/A GLY 191.A N VAL 186.A O no hydrogen 2.867 N/A VAL 194.A N GLY 191.A O no hydrogen 3.237 N/A ALA 195.A N GLY 191.A O no hydrogen 2.942 N/A GLY 196.A N ALA 192.A O no hydrogen 2.790 N/A ARG 199.A NH1 GLN 4.A O no hydrogen 2.351 N/A ARG 199.A NH1 GLN 4.A OE1 no hydrogen 3.165 N/A ILE 200.A N ASN 221.A OD1 no hydrogen 2.956 N/A LEU 201.A N ILE 156.A O no hydrogen 2.693 N/A TYR 202.A N GLY 222.A O no hydrogen 2.985 N/A GLY 203.A N TYR 158.A O no hydrogen 2.706 N/A SER 205.A OG SER 229.A OG no hydrogen 3.337 N/A ASN 210.A N ASN 207.A OD1 no hydrogen 2.872 N/A ASN 210.A ND2 SER 205.A O no hydrogen 3.278 N/A ALA 211.A N ASN 207.A O no hydrogen 2.924 N/A ARG 212.A NH1 GLN 242.A O no hydrogen 2.660 N/A ARG 212.A NH2 GLN 242.A O no hydrogen 2.730 N/A THR 213.A OG1 ASN 210.A O no hydrogen 3.274 N/A LEU 214.A N ASN 210.A O no hydrogen 2.969 N/A TYR 215.A N ALA 211.A O no hydrogen 3.057 N/A GLN 216.A N ARG 212.A O no hydrogen 3.032 N/A GLN 216.A N THR 213.A O no hydrogen 3.182 N/A GLN 217.A N LEU 214.A O no hydrogen 3.196 N/A GLN 217.A NE2 THR 213.A O no hydrogen 3.378 N/A ASP 219.A N GLN 176.A OE1 no hydrogen 2.943 N/A VAL 220.A N GLN 217.A O no hydrogen 3.307 N/A ASN 221.A N ILE 200.A O no hydrogen 2.994 N/A PHE 223.A N ILE 6.A O no hydrogen 2.929 N/A LEU 224.A N TYR 202.A O no hydrogen 3.166 N/A VAL 225.A N ALA 8.A O no hydrogen 2.954 N/A SER 229.A N GLY 226.A O no hydrogen 3.057 N/A SER 229.A OG VAL 206.A O no hydrogen 3.341 N/A LEU 230.A N GLY 227.A O no hydrogen 3.202 N/A PHE 234.A N LYS 231.A O no hydrogen 2.725 N/A VAL 235.A N PRO 232.A O no hydrogen 3.216 N/A ILE 237.A N GLU 233.A O no hydrogen 3.239 N/A ILE 238.A N PHE 234.A O no hydrogen 3.044 N/A LYS 239.A N VAL 235.A O no hydrogen 3.283 N/A ALA 240.A N ASP 236.A O no hydrogen 3.194 N/A ALA 240.A N ILE 237.A O no hydrogen 3.043 N/A THR 241.A N ILE 238.A O no hydrogen 3.094 N/A THR 241.A OG1 HIS 34.A NE2 no hydrogen 3.069 N/A THR 241.A OG1 ILE 238.A O no hydrogen 2.642 N/A