Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1umw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 5.A N HIS 1.A O no hydrogen 2.943 N/A LEU 6.A N LEU 2.A O no hydrogen 2.790 N/A GLN 7.A N SER 3.A O no hydrogen 3.111 N/A GLN 8.A N ASP 4.A O no hydrogen 2.996 N/A GLN 8.A NE2 PRO 173.A O no hydrogen 3.038 N/A LEU 9.A N MET 5.A O no hydrogen 2.914 N/A HIS 10.A N LEU 6.A O no hydrogen 2.784 N/A SER 11.A N GLN 7.A O no hydrogen 2.982 N/A SER 11.A OG GLU 196.A OE1 no hydrogen 2.743 N/A SER 11.A OG GLU 196.A OE2 no hydrogen 3.567 N/A VAL 12.A N GLN 8.A O no hydrogen 3.205 N/A ASN 13.A N LEU 9.A O no hydrogen 2.903 N/A ASN 13.A ND2 LEU 208.A O no hydrogen 3.173 N/A ALA 14.A N HIS 10.A O no hydrogen 2.892 N/A SER 15.A N VAL 12.A O no hydrogen 3.171 N/A SER 15.A OG VAL 12.A O no hydrogen 2.701 N/A LYS 16.A N ASN 13.A O no hydrogen 3.067 N/A GLU 19.A N LYS 16.A O no hydrogen 2.990 N/A ARG 20.A NE SER 15.A O no hydrogen 3.398 N/A ARG 20.A NH1 GLU 196.A O no hydrogen 2.873 N/A ARG 20.A NH2 SER 15.A O no hydrogen 2.852 N/A ARG 20.A NH2 GLU 196.A O no hydrogen 2.723 N/A ARG 24.A N TYR 198.A O no hydrogen 3.009 N/A GLN 25.A NE2 TYR 190.A OH no hydrogen 2.878 N/A GLU 26.A N GLU 26.A OE1 no hydrogen 2.674 N/A GLU 27.A N ARG 24.A O no hydrogen 2.956 N/A ALA 28.A N GLN 25.A O no hydrogen 2.949 N/A GLU 29.A N GLU 26.A O no hydrogen 3.272 N/A ASP 30.A N THR 189.A O no hydrogen 2.897 N/A CYS 33.A N ASP 30.A O no hydrogen 2.960 N/A ILE 34.A N PRO 31.A O no hydrogen 3.267 N/A TRP 38.A NE1 ALA 121.A O no hydrogen 2.994 N/A VAL 39.A N GLN 159.A OE1 no hydrogen 2.714 N/A SER 40.A N GLN 54.A O no hydrogen 2.796 N/A SER 40.A OG ALA 121.A O no hydrogen 2.743 N/A LYS 41.A NZ MET 114.A O no hydrogen 3.328 N/A LYS 41.A NZ LEU 118.A O no hydrogen 3.162 N/A VAL 43.A N GLY 52.A O no hydrogen 2.862 N/A TYR 45.A N GLY 50.A O no hydrogen 2.960 N/A SER 46.A N ASP 44.A OD1 no hydrogen 2.970 N/A SER 46.A OG ASP 44.A OD1 no hydrogen 2.838 N/A LYS 48.A N TYR 45.A O no hydrogen 3.148 N/A TYR 49.A N TYR 45.A O no hydrogen 2.865 N/A GLY 50.A N TYR 45.A O no hydrogen 2.980 N/A LEU 51.A N LEU 63.A O no hydrogen 2.938 N/A GLY 52.A N VAL 43.A O no hydrogen 3.073 N/A TYR 53.A N GLY 61.A O no hydrogen 2.839 N/A GLN 54.A N LYS 41.A O no hydrogen 2.890 N/A LEU 55.A N SER 59.A O no hydrogen 2.919 N/A CYS 56.A N TRP 38.A O no hydrogen 3.023 N/A CYS 56.A SG ILE 36.A O no hydrogen 3.419 N/A ASN 58.A N LEU 55.A O no hydrogen 3.000 N/A SER 59.A N ASP 57.A OD2 no hydrogen 2.904 N/A SER 59.A OG ASP 57.A OD2 no hydrogen 2.640 N/A VAL 60.A N LEU 72.A O no hydrogen 3.003 N/A GLY 61.A N TYR 53.A O no hydrogen 2.814 N/A VAL 62.A N LEU 70.A O no hydrogen 3.008 N/A LEU 63.A N LEU 51.A O no hydrogen 2.868 N/A PHE 64.A N THR 68.A O no hydrogen 2.962 N/A ASN 65.A N TYR 49.A O no hydrogen 2.863 N/A ASN 65.A ND2 SER 46.A O no hydrogen 3.103 N/A SER 67.A N PHE 64.A O no hydrogen 2.882 N/A THR 68.A N ASP 66.A OD1 no hydrogen 2.987 N/A THR 68.A OG1 ASP 66.A OD1 no hydrogen 2.737 N/A THR 68.A OG1 ASP 66.A OD2 no hydrogen 3.403 N/A ARG 69.A N ILE 82.A O no hydrogen 2.908 N/A LEU 70.A N VAL 62.A O no hydrogen 3.226 N/A ILE 71.A N GLN 80.A O no hydrogen 2.867 N/A LEU 72.A N VAL 60.A O no hydrogen 2.914 N/A TYR 73.A N SER 78.A O no hydrogen 2.948 N/A ASN 74.A ND2 ASP 57.A O no hydrogen 2.875 N/A GLY 76.A N TYR 73.A O no hydrogen 2.945 N/A SER 78.A OG ASP 75.A OD1 no hydrogen 2.860 N/A LEU 79.A N LEU 91.A O no hydrogen 2.608 N/A GLN 80.A N ILE 71.A O no hydrogen 3.039 N/A TYR 81.A N SER 89.A O no hydrogen 2.764 N/A ILE 82.A N ARG 69.A O no hydrogen 2.804 N/A GLU 83.A N THR 87.A O no hydrogen 2.875 N/A GLY 86.A N GLU 83.A O no hydrogen 2.753 N/A THR 87.A N ASP 85.A OD2 no hydrogen 3.121 N/A THR 87.A OG1 ASP 85.A OD2 no hydrogen 2.420 N/A SER 89.A N TYR 81.A O no hydrogen 2.757 N/A TYR 90.A OH GLU 88.A OE1 no hydrogen 2.667 N/A LEU 91.A N LEU 79.A O no hydrogen 2.926 N/A VAL 93.A N ASP 77.A O no hydrogen 2.822 N/A SER 94.A N ASP 77.A OD1 no hydrogen 2.783 N/A SER 94.A OG ASP 77.A OD1 no hydrogen 3.408 N/A SER 94.A OG ASP 77.A OD2 no hydrogen 2.783 N/A SER 95.A OG THR 92.A O no hydrogen 2.709 N/A HIS 96.A N VAL 93.A O no hydrogen 2.822 N/A LEU 100.A N PRO 97.A O no hydrogen 2.928 N/A LYS 103.A NZ ASP 66.A OD2 no hydrogen 2.929 N/A LYS 103.A NZ THR 68.A OG1 no hydrogen 2.762 N/A ILE 104.A N LEU 100.A O no hydrogen 2.842 N/A THR 105.A N MET 101.A O no hydrogen 3.031 N/A THR 105.A OG1 MET 101.A O no hydrogen 3.153 N/A LEU 106.A N LYS 102.A O no hydrogen 3.122 N/A LEU 107.A N LYS 103.A O no hydrogen 2.968 N/A LYS 108.A N ILE 104.A O no hydrogen 2.950 N/A TYR 109.A N THR 105.A O no hydrogen 3.027 N/A PHE 110.A N LEU 106.A O no hydrogen 3.075 N/A ARG 111.A N LEU 107.A O no hydrogen 2.844 N/A ARG 111.A NE ASN 112.A OD1 no hydrogen 3.150 N/A ARG 111.A NH2 ASN 112.A OD1 no hydrogen 3.556 N/A ASN 112.A N LYS 108.A O no hydrogen 2.899 N/A TYR 113.A N TYR 109.A O no hydrogen 2.859 N/A MET 114.A N PHE 110.A O no hydrogen 2.921 N/A SER 115.A N ARG 111.A O no hydrogen 3.037 N/A GLU 116.A N ASN 112.A O no hydrogen 3.059 N/A HIS 117.A N TYR 113.A O no hydrogen 3.022 N/A LEU 118.A N MET 114.A O no hydrogen 3.042 N/A LYS 120.A NZ CYS 56.A O no hydrogen 2.713 N/A LYS 120.A NZ ASN 58.A OD1 no hydrogen 2.642 N/A ALA 121.A N SER 40.A O no hydrogen 2.932 N/A ASN 124.A ND2 ARG 185.A O no hydrogen 3.005 N/A ILE 125.A N GLY 122.A O no hydrogen 2.927 N/A ARG 128.A NH1 ILE 34.A O no hydrogen 2.915 N/A TYR 138.A N SER 154.A OG no hydrogen 2.754 N/A LEU 139.A N TYR 53.A OH no hydrogen 3.115 N/A ARG 140.A N HIS 152.A O no hydrogen 2.764 N/A THR 141.A N HIS 152.A O no hydrogen 3.421 N/A PHE 143.A N ILE 150.A O no hydrogen 3.153 N/A ARG 144.A NE ASP 44.A OD2 no hydrogen 3.123 N/A ARG 144.A NH2 ASP 44.A OD2 no hydrogen 3.004 N/A THR 145.A N ALA 148.A O no hydrogen 2.793 N/A THR 145.A OG1 ALA 148.A O no hydrogen 3.377 N/A THR 145.A OG1 TYR 210.A OH no hydrogen 2.680 N/A SER 147.A N THR 145.A OG1 no hydrogen 3.173 N/A ALA 148.A N THR 145.A OG1 no hydrogen 3.053 N/A ILE 149.A N ASN 161.A O no hydrogen 3.078 N/A ILE 150.A N PHE 143.A O no hydrogen 2.908 N/A LEU 151.A N GLN 159.A O no hydrogen 2.805 N/A HIS 152.A N THR 141.A O no hydrogen 2.940 N/A HIS 152.A ND1 SER 157.A O no hydrogen 3.312 N/A LEU 153.A N SER 157.A O no hydrogen 2.903 N/A SER 154.A N TYR 138.A O no hydrogen 2.756 N/A SER 154.A OG TYR 138.A O no hydrogen 3.365 N/A GLY 156.A N LEU 153.A O no hydrogen 2.972 N/A SER 157.A N ASN 155.A OD1 no hydrogen 3.058 N/A SER 157.A OG ASN 155.A OD1 no hydrogen 3.245 N/A VAL 158.A N LEU 171.A O no hydrogen 2.866 N/A GLN 159.A N LEU 151.A O no hydrogen 2.779 N/A GLN 159.A NE2 VAL 39.A O no hydrogen 2.917 N/A GLN 159.A NE2 ASN 161.A OD1 no hydrogen 2.989 N/A ILE 160.A N LEU 169.A O no hydrogen 2.923 N/A ASN 161.A N ILE 149.A O no hydrogen 3.065 N/A PHE 162.A N THR 167.A O no hydrogen 2.913 N/A PHE 163.A N SER 147.A O no hydrogen 2.983 N/A THR 167.A N ASP 165.A OD1 no hydrogen 3.049 N/A THR 167.A OG1 ASP 165.A OD1 no hydrogen 2.681 N/A THR 167.A OG1 ASP 165.A OD2 no hydrogen 3.418 N/A LYS 168.A N ILE 181.A O no hydrogen 2.976 N/A LYS 168.A NZ HIS 166.A O no hydrogen 2.917 N/A LEU 169.A N ILE 160.A O no hydrogen 2.906 N/A ILE 170.A N THR 179.A O no hydrogen 2.828 N/A LEU 171.A N VAL 158.A O no hydrogen 2.764 N/A CYS 172.A N ALA 177.A O no hydrogen 2.996 N/A ALA 177.A N CYS 172.A O no hydrogen 3.034 N/A VAL 178.A N TYR 190.A O no hydrogen 2.917 N/A THR 179.A N ILE 170.A O no hydrogen 2.806 N/A THR 179.A OG1 THR 189.A OG1 no hydrogen 2.768 N/A TYR 180.A N ARG 188.A O no hydrogen 2.937 N/A ILE 181.A N LYS 168.A O no hydrogen 2.845 N/A ASP 182.A N ASP 186.A O no hydrogen 2.869 N/A LYS 184.A N ASP 182.A OD1 no hydrogen 2.875 N/A ARG 185.A N ASP 182.A O no hydrogen 2.764 N/A ASP 186.A N ASP 182.A OD1 no hydrogen 2.927 N/A ARG 188.A N TYR 180.A O no hydrogen 3.179 N/A ARG 188.A NE GLU 29.A OE2 no hydrogen 3.190 N/A ARG 188.A NH1 PHE 187.A O no hydrogen 3.119 N/A THR 189.A OG1 THR 179.A OG1 no hydrogen 2.768 N/A TYR 190.A N VAL 178.A O no hydrogen 2.779 N/A ARG 191.A N ALA 28.A O no hydrogen 2.895 N/A ARG 191.A NE ASP 30.A OD2 no hydrogen 2.508 N/A ARG 191.A NH2 ASP 30.A OD2 no hydrogen 3.160 N/A LEU 192.A N ALA 176.A O no hydrogen 3.031 N/A LEU 194.A N ARG 191.A O no hydrogen 3.059 N/A LEU 195.A N ARG 191.A O no hydrogen 3.149 N/A GLU 196.A N LEU 192.A O no hydrogen 3.135 N/A GLU 197.A N SER 193.A O no hydrogen 3.240 N/A TYR 198.A N LEU 194.A O no hydrogen 2.747 N/A GLY 199.A N LEU 195.A O no hydrogen 2.749 N/A CYS 200.A N PRO 17.A O no hydrogen 3.118 N/A CYS 200.A SG CYS 201.A O no hydrogen 3.712 N/A CYS 201.A N GLN 25.A OE1 no hydrogen 2.621 N/A CYS 201.A SG GLN 25.A OE1 no hydrogen 3.357 N/A CYS 201.A SG LYS 202.A O no hydrogen 2.844 N/A CYS 201.A SG GLU 203.A OE1 no hydrogen 3.597 N/A ALA 205.A N CYS 201.A O no hydrogen 3.051 N/A SER 206.A OG GLU 203.A O no hydrogen 2.932 N/A ARG 207.A N GLU 203.A O no hydrogen 3.081 N/A ARG 207.A NE THR 167.A OG1 no hydrogen 2.991 N/A ARG 207.A NH1 GLU 203.A O no hydrogen 2.892 N/A ARG 207.A NH2 ASP 165.A OD2 no hydrogen 2.556 N/A LEU 208.A N LEU 204.A O no hydrogen 2.863 N/A ARG 209.A N ALA 205.A O no hydrogen 3.058 N/A TYR 210.A N SER 206.A O no hydrogen 3.076 N/A ALA 211.A N ARG 207.A O no hydrogen 2.826 N/A ARG 212.A N LEU 208.A O no hydrogen 3.087 N/A ARG 212.A NE ASP 216.A OD2 no hydrogen 2.990 N/A ARG 212.A NH1 HIS 10.A ND1 no hydrogen 3.116 N/A ARG 212.A NH2 HIS 10.A ND1 no hydrogen 3.428 N/A THR 213.A N ARG 209.A O no hydrogen 3.268 N/A THR 213.A OG1 ARG 209.A O no hydrogen 3.386 N/A MET 214.A N TYR 210.A O no hydrogen 2.984 N/A VAL 215.A N ALA 211.A O no hydrogen 2.827 N/A ASP 216.A N ARG 212.A O no hydrogen 2.954 N/A LYS 217.A N THR 213.A O no hydrogen 3.044 N/A LEU 218.A N MET 214.A O no hydrogen 2.952 N/A LEU 219.A N VAL 215.A O no hydrogen 2.943 N/A SER 220.A N ASP 216.A O no hydrogen 2.861 N/A SER 220.A OG LYS 217.A O no hydrogen 2.729 N/A SER 221.A N LYS 217.A O no hydrogen 2.998 N/A SER 221.A OG LYS 217.A O no hydrogen 3.041 N/A SER 221.A OG LEU 218.A O no hydrogen 3.458 N/A ARG 222.A N LEU 219.A O no hydrogen 3.373 N/A SER 223.A N SER 221.A O no hydrogen 2.672 N/A