Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2x1u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLN 210.A O no hydrogen 2.811 N/A LYS 2.A NZ VAL 213.A O no hydrogen 2.959 N/A GLN 4.A NE2 ASP 28.A OD1 no hydrogen 2.991 N/A ILE 6.A N ASN 214.A O no hydrogen 3.079 N/A ALA 7.A N GLN 30.A O no hydrogen 2.948 N/A ALA 8.A N PHE 216.A O no hydrogen 2.872 N/A ALA 9.A N VAL 32.A O no hydrogen 2.928 N/A ASN 10.A N ALA 218.A O no hydrogen 2.718 N/A GLU 15.A N SER 12.A OG no hydrogen 3.367 N/A LEU 16.A N SER 12.A O no hydrogen 3.095 N/A ILE 17.A N LEU 13.A O no hydrogen 2.894 N/A ASP 18.A N SER 14.A O no hydrogen 3.099 N/A LEU 19.A N GLU 15.A O no hydrogen 2.975 N/A PHE 20.A N LEU 16.A O no hydrogen 3.094 N/A ASN 21.A N ILE 17.A O no hydrogen 2.867 N/A ASN 21.A ND2 ARG 46.A O no hydrogen 2.879 N/A SER 22.A N ASP 18.A O no hydrogen 3.156 N/A SER 22.A N LEU 19.A O no hydrogen 3.180 N/A SER 22.A OG ASP 18.A O no hydrogen 3.414 N/A SER 22.A OG LEU 19.A O no hydrogen 2.670 N/A THR 23.A N PHE 20.A O no hydrogen 3.005 N/A THR 23.A OG1 LEU 19.A O no hydrogen 2.726 N/A HIS 27.A NE2 THR 231.A OG1 no hydrogen 2.782 N/A GLN 30.A N PRO 5.A O no hydrogen 2.998 N/A CYS 31.A N LYS 51.A O no hydrogen 2.809 N/A VAL 32.A N ALA 7.A O no hydrogen 2.895 N/A VAL 33.A N VAL 53.A O no hydrogen 2.951 N/A ALA 34.A N ALA 9.A O no hydrogen 2.828 N/A SER 35.A N ALA 55.A O no hydrogen 3.083 N/A SER 35.A OG THR 36.A O no hydrogen 3.021 N/A HIS 39.A N THR 36.A O no hydrogen 3.177 N/A LEU 40.A N PHE 37.A O no hydrogen 3.189 N/A THR 43.A N HIS 39.A O no hydrogen 2.992 N/A THR 43.A OG1 HIS 39.A O no hydrogen 2.728 N/A LYS 44.A N LEU 40.A O no hydrogen 2.929 N/A GLU 45.A N ALA 41.A O no hydrogen 3.154 N/A ARG 46.A N MET 42.A O no hydrogen 2.882 N/A ARG 46.A N THR 43.A O no hydrogen 3.262 N/A ARG 46.A NH2 SER 14.A OG no hydrogen 3.119 N/A ARG 46.A NH2 ASP 18.A OD1 no hydrogen 2.581 N/A LEU 47.A N THR 43.A O no hydrogen 2.745 N/A SER 48.A N ASN 21.A OD1 no hydrogen 2.898 N/A HIS 49.A N ASN 21.A OD1 no hydrogen 3.158 N/A HIS 49.A NE2 THR 23.A O no hydrogen 2.817 N/A LYS 51.A N HIS 49.A ND1 no hydrogen 3.141 N/A LYS 51.A NZ ILE 25.A O no hydrogen 2.752 N/A LYS 51.A NZ HIS 27.A O no hydrogen 2.780 N/A PHE 52.A N HIS 49.A O no hydrogen 3.021 N/A VAL 53.A N CYS 31.A O no hydrogen 2.902 N/A ALA 55.A N VAL 33.A O no hydrogen 2.932 N/A ALA 56.A N TRP 75.A O no hydrogen 2.957 N/A ASN 58.A N VAL 77.A O no hydrogen 3.015 N/A ALA 64.A N ASN 61.A OD1 no hydrogen 2.963 N/A LEU 65.A N ASN 61.A O no hydrogen 2.944 N/A ALA 66.A N ALA 62.A O no hydrogen 2.985 N/A SER 67.A N ASP 63.A O no hydrogen 2.873 N/A LEU 68.A N ALA 64.A O no hydrogen 2.895 N/A LYS 69.A N LEU 65.A O no hydrogen 2.885 N/A LYS 69.A NZ GLY 105.A O no hydrogen 2.872 N/A ASP 70.A N ALA 66.A O no hydrogen 2.999 N/A PHE 71.A N SER 67.A O no hydrogen 2.972 N/A GLY 72.A N LYS 69.A O no hydrogen 2.985 N/A VAL 73.A N LEU 68.A O no hydrogen 3.008 N/A ILE 76.A N MET 107.A O no hydrogen 3.041 N/A VAL 77.A N ALA 56.A O no hydrogen 2.891 N/A LEU 78.A N ILE 109.A O no hydrogen 2.878 N/A HIS 80.A ND1 GLU 82.A OE1 no hydrogen 2.487 N/A SER 81.A OG GLU 82.A OE1 no hydrogen 3.492 N/A ARG 83.A N HIS 80.A O no hydrogen 2.723 N/A ARG 83.A NE GLU 82.A OE2 no hydrogen 2.989 N/A ARG 84.A N SER 81.A O no hydrogen 2.823 N/A ARG 84.A NE GLY 79.A O no hydrogen 3.140 N/A ARG 84.A NH1 ASN 91.A OD1 no hydrogen 2.833 N/A ARG 84.A NH2 CYS 111.A O no hydrogen 2.993 N/A TRP 85.A N SER 81.A O no hydrogen 3.019 N/A TYR 86.A N GLU 82.A O no hydrogen 2.972 N/A TYR 87.A N GLU 82.A O no hydrogen 3.005 N/A GLY 88.A N ARG 84.A O no hydrogen 3.258 N/A GLU 89.A N ARG 83.A O no hydrogen 2.846 N/A ILE 93.A N THR 90.A OG1 no hydrogen 3.128 N/A VAL 94.A N THR 90.A O no hydrogen 3.015 N/A ALA 95.A N ASN 91.A O no hydrogen 2.984 N/A ASP 96.A N GLU 92.A O no hydrogen 2.867 N/A LYS 97.A N ILE 93.A O no hydrogen 3.016 N/A LYS 97.A NZ ASN 58.A O no hydrogen 2.779 N/A LYS 97.A NZ GLU 89.A OE2 no hydrogen 2.978 N/A VAL 98.A N VAL 94.A O no hydrogen 2.936 N/A ALA 99.A N ALA 95.A O no hydrogen 2.960 N/A ALA 100.A N ASP 96.A O no hydrogen 2.851 N/A ALA 101.A N LYS 97.A O no hydrogen 3.011 N/A VAL 102.A N VAL 98.A O no hydrogen 3.008 N/A ALA 103.A N ALA 99.A O no hydrogen 2.952 N/A SER 104.A N ALA 100.A O no hydrogen 2.968 N/A SER 104.A OG ALA 100.A O no hydrogen 2.934 N/A GLY 105.A N VAL 102.A O no hydrogen 2.981 N/A PHE 106.A N ALA 101.A O no hydrogen 3.023 N/A MET 107.A N ASN 74.A O no hydrogen 2.867 N/A VAL 108.A N LYS 146.A O no hydrogen 2.826 N/A ILE 109.A N ILE 76.A O no hydrogen 2.922 N/A ALA 110.A N VAL 148.A O no hydrogen 2.799 N/A CYS 111.A N LEU 78.A O no hydrogen 2.872 N/A CYS 111.A SG LEU 78.A O no hydrogen 3.625 N/A ILE 112.A N ALA 150.A O no hydrogen 2.960 N/A GLY 113.A N GLN 131.A OE1 no hydrogen 2.858 N/A GLU 114.A N GLU 114.A OE1 no hydrogen 2.694 N/A THR 115.A N GLU 118.A OE1 no hydrogen 2.747 N/A GLN 117.A N GLN 117.A OE1 no hydrogen 2.692 N/A GLU 118.A N THR 115.A OG1 no hydrogen 3.160 N/A ARG 119.A N THR 115.A O no hydrogen 2.972 N/A ARG 119.A NE GLU 114.A OE2 no hydrogen 2.760 N/A ARG 119.A NH2 GLU 114.A OE2 no hydrogen 2.972 N/A GLU 120.A N LEU 116.A O no hydrogen 2.990 N/A SER 121.A N GLN 117.A O no hydrogen 3.019 N/A SER 121.A OG GLN 117.A O no hydrogen 2.746 N/A SER 121.A OG GLU 118.A O no hydrogen 3.210 N/A GLY 122.A N ARG 119.A O no hydrogen 2.976 N/A ARG 123.A N GLU 118.A O no hydrogen 2.815 N/A VAL 127.A N ARG 123.A O no hydrogen 2.995 N/A VAL 128.A N THR 124.A O no hydrogen 2.940 N/A LEU 129.A N ALA 125.A O no hydrogen 2.984 N/A THR 130.A N VAL 126.A O no hydrogen 3.092 N/A THR 130.A OG1 VAL 126.A O no hydrogen 2.608 N/A GLN 131.A N VAL 127.A O no hydrogen 3.045 N/A GLN 131.A NE2 GLY 113.A O no hydrogen 3.182 N/A ILE 132.A N VAL 128.A O no hydrogen 3.105 N/A ALA 133.A N LEU 129.A O no hydrogen 2.832 N/A ALA 134.A N THR 130.A O no hydrogen 3.099 N/A ILE 135.A N GLN 131.A O no hydrogen 3.323 N/A ALA 136.A N ILE 132.A O no hydrogen 2.810 N/A LYS 137.A N ALA 133.A O no hydrogen 2.950 N/A LYS 138.A N ILE 135.A O no hydrogen 3.164 N/A LYS 138.A NZ ASP 96.A OD1 no hydrogen 2.839 N/A LEU 139.A N ALA 136.A O no hydrogen 3.231 N/A LYS 140.A N ASP 143.A OD2 no hydrogen 2.727 N/A LYS 141.A NZ ASP 186.A OD1 no hydrogen 3.429 N/A LYS 141.A NZ ASP 186.A OD2 no hydrogen 2.742 N/A ASP 143.A N LYS 140.A O no hydrogen 2.803 N/A TRP 144.A N LYS 141.A O no hydrogen 3.152 N/A ALA 145.A N ALA 142.A O no hydrogen 3.437 N/A LYS 146.A N ASP 143.A O no hydrogen 2.892 N/A VAL 147.A N TRP 144.A O no hydrogen 3.145 N/A VAL 148.A N VAL 108.A O no hydrogen 2.704 N/A ILE 149.A N ARG 192.A O no hydrogen 3.032 N/A ALA 150.A N ALA 110.A O no hydrogen 2.880 N/A TYR 151.A N LEU 194.A O no hydrogen 2.756 N/A TYR 151.A OH GLU 114.A OE1 no hydrogen 2.679 N/A TYR 151.A OH GLU 114.A OE2 no hydrogen 3.098 N/A GLU 152.A N ILE 112.A O no hydrogen 2.932 N/A VAL 154.A N GLU 114.A O no hydrogen 2.957 N/A TRP 155.A NE1 GLU 114.A OE2 no hydrogen 2.969 N/A ALA 156.A N PRO 153.A O no hydrogen 2.832 N/A ILE 157.A N VAL 154.A O no hydrogen 3.020 N/A THR 159.A OG1 TRP 155.A O no hydrogen 2.631 N/A LYS 161.A N THR 159.A OG1 no hydrogen 3.356 N/A ALA 163.A N TYR 195.A OH no hydrogen 2.887 N/A THR 164.A N GLN 167.A OE1 no hydrogen 3.033 N/A GLN 167.A N THR 164.A OG1 no hydrogen 3.097 N/A ALA 168.A N THR 164.A O no hydrogen 2.930 N/A GLN 169.A N PRO 165.A O no hydrogen 2.895 N/A GLN 169.A NE2 ASP 212.A OD1 no hydrogen 2.772 N/A GLU 170.A N GLN 166.A O no hydrogen 2.922 N/A ALA 171.A N GLN 167.A O no hydrogen 3.131 N/A HIS 172.A N ALA 168.A O no hydrogen 2.945 N/A HIS 172.A ND1 ASP 212.A O no hydrogen 3.091 N/A ALA 173.A N GLN 169.A O no hydrogen 2.826 N/A LEU 174.A N GLU 170.A O no hydrogen 3.048 N/A ILE 175.A N ALA 171.A O no hydrogen 3.059 N/A ARG 176.A N HIS 172.A O no hydrogen 2.896 N/A ARG 176.A NE ASP 212.A OD2 no hydrogen 2.703 N/A ARG 176.A NH1 ALA 188.A O no hydrogen 2.935 N/A ARG 176.A NH1 LEU 191.A O no hydrogen 2.755 N/A ARG 176.A NH2 ASP 212.A O no hydrogen 3.103 N/A ARG 176.A NH2 ASN 214.A OD1 no hydrogen 2.690 N/A SER 177.A N ALA 173.A O no hydrogen 2.863 N/A TRP 178.A N LEU 174.A O no hydrogen 3.069 N/A VAL 179.A N ILE 175.A O no hydrogen 2.920 N/A SER 180.A N ARG 176.A O no hydrogen 2.843 N/A SER 181.A N SER 177.A O no hydrogen 3.035 N/A LYS 182.A N TRP 178.A O no hydrogen 2.852 N/A ILE 183.A N VAL 179.A O no hydrogen 2.796 N/A GLY 184.A N VAL 179.A O no hydrogen 2.946 N/A VAL 187.A N ASP 186.A OD1 no hydrogen 2.904 N/A ALA 188.A N GLY 184.A O no hydrogen 2.891 N/A GLY 189.A N ALA 185.A O no hydrogen 3.027 N/A GLU 190.A N ASP 186.A O no hydrogen 3.379 N/A GLU 190.A N VAL 187.A O no hydrogen 3.190 N/A LEU 191.A N VAL 187.A O no hydrogen 2.977 N/A ARG 192.A NH2 GLN 4.A O no hydrogen 2.848 N/A ARG 192.A NH2 GLN 4.A OE1 no hydrogen 3.111 N/A ILE 193.A N ASN 214.A OD1 no hydrogen 2.896 N/A LEU 194.A N ILE 149.A O no hydrogen 2.718 N/A TYR 195.A N GLY 215.A O no hydrogen 2.961 N/A TYR 195.A OH GLY 197.A O no hydrogen 2.906 N/A GLY 196.A N TYR 151.A O no hydrogen 2.874 N/A SER 198.A OG ALA 156.A O no hydrogen 2.664 N/A ASN 200.A N ASN 203.A OD1 no hydrogen 2.867 N/A LYS 202.A NZ ASN 200.A OD1 no hydrogen 3.452 N/A ASN 203.A ND2 SER 198.A O no hydrogen 3.041 N/A ALA 204.A N ASN 200.A O no hydrogen 2.761 N/A ARG 205.A N GLY 201.A O no hydrogen 3.108 N/A LEU 207.A N ASN 203.A O no hydrogen 3.061 N/A TYR 208.A N ALA 204.A O no hydrogen 2.933 N/A GLN 209.A N THR 206.A O no hydrogen 3.131 N/A GLN 210.A N LEU 207.A O no hydrogen 3.053 N/A ARG 211.A NE ASP 212.A OD1 no hydrogen 2.678 N/A ARG 211.A NH2 ASP 212.A OD1 no hydrogen 3.077 N/A ASP 212.A N GLN 169.A OE1 no hydrogen 2.898 N/A VAL 213.A N GLN 210.A O no hydrogen 3.406 N/A ASN 214.A N ILE 193.A O no hydrogen 2.907 N/A PHE 216.A N ILE 6.A O no hydrogen 2.980 N/A LEU 217.A N TYR 195.A O no hydrogen 3.041 N/A ALA 218.A N ALA 8.A O no hydrogen 2.842 N/A LEU 220.A N ASN 10.A O no hydrogen 3.319 N/A LYS 221.A NZ VAL 199.A O no hydrogen 3.389 N/A LYS 221.A NZ GLU 223.A OE2 no hydrogen 2.993 N/A PHE 224.A N LYS 221.A O no hydrogen 3.166 N/A VAL 225.A N PRO 222.A O no hydrogen 3.368 N/A ASP 226.A N GLU 223.A O no hydrogen 2.849 N/A ILE 227.A N GLU 223.A O no hydrogen 3.201 N/A ILE 228.A N PHE 224.A O no hydrogen 2.895 N/A LYS 229.A N VAL 225.A O no hydrogen 3.162 N/A ALA 230.A N ASP 226.A O no hydrogen 2.957 N/A ALA 230.A N ILE 227.A O no hydrogen 3.079 N/A THR 231.A N ILE 228.A O no hydrogen 3.198 N/A THR 231.A OG1 HIS 27.A NE2 no hydrogen 2.782 N/A THR 231.A OG1 ILE 228.A O no hydrogen 2.695 N/A