Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1u02_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ASP 38.A O no hydrogen 3.180 N/A PHE 4.A N ILE 169.A O no hydrogen 2.784 N/A LEU 5.A N TYR 40.A O no hydrogen 2.806 N/A ASP 6.A N ALA 171.A O no hydrogen 3.030 N/A TYR 7.A OH SER 20.A O no hydrogen 2.748 N/A GLY 9.A N VAL 12.A O no hydrogen 2.685 N/A THR 10.A N TYR 7.A O no hydrogen 3.063 N/A THR 10.A OG1 ASP 6.A OD2 no hydrogen 2.692 N/A THR 10.A OG1 ASP 173.A OD1 no hydrogen 3.236 N/A LEU 11.A N TYR 7.A O no hydrogen 2.828 N/A VAL 12.A N TYR 7.A O no hydrogen 3.308 N/A ASN 16.A ND2 GLU 19.A OE2 no hydrogen 2.920 N/A GLU 18.A N GLU 18.A OE1 no hydrogen 2.629 N/A GLU 19.A N ASN 16.A O no hydrogen 2.978 N/A SER 20.A N PRO 17.A O no hydrogen 3.413 N/A SER 20.A OG PRO 17.A O no hydrogen 3.464 N/A TYR 21.A N GLU 19.A O no hydrogen 2.694 N/A ALA 22.A N PHE 53.A O no hydrogen 2.976 N/A LEU 26.A N ASP 23.A OD1 no hydrogen 2.886 N/A LEU 27.A N ASP 23.A O no hydrogen 3.011 N/A SER 28.A N ALA 24.A O no hydrogen 2.969 N/A LEU 29.A N GLY 25.A O no hydrogen 3.103 N/A ILE 30.A N LEU 26.A O no hydrogen 2.965 N/A SER 31.A N LEU 27.A O no hydrogen 2.926 N/A ASP 32.A N SER 28.A O no hydrogen 2.945 N/A LEU 33.A N LEU 29.A O no hydrogen 2.936 N/A LYS 34.A N ILE 30.A O no hydrogen 2.897 N/A LYS 34.A NZ SER 31.A O no hydrogen 3.032 N/A LYS 34.A NZ GLU 35.A OE2 no hydrogen 2.703 N/A GLU 35.A N ASP 32.A O no hydrogen 3.036 N/A ARG 36.A N LEU 33.A O no hydrogen 3.014 N/A ARG 36.A NE GLU 216.A OE2 no hydrogen 3.012 N/A PHE 37.A N LEU 33.A O no hydrogen 2.924 N/A ASP 38.A N SER 1.A O no hydrogen 2.949 N/A THR 39.A OG1 PHE 37.A O no hydrogen 2.973 N/A TYR 40.A N ILE 3.A O no hydrogen 2.859 N/A ILE 41.A N ASN 59.A O no hydrogen 3.022 N/A VAL 42.A N LEU 5.A O no hydrogen 2.786 N/A THR 43.A N ILE 60.A O no hydrogen 2.931 N/A ARG 45.A N THR 43.A OG1 no hydrogen 2.835 N/A ARG 45.A NE ASP 8.A OD2 no hydrogen 2.742 N/A ARG 45.A NH1 PRO 17.A O no hydrogen 3.032 N/A ARG 45.A NH1 GLU 49.A OE2 no hydrogen 3.066 N/A ARG 45.A NH2 ASP 8.A OD1 no hydrogen 2.855 N/A ARG 45.A NH2 ASP 8.A OD2 no hydrogen 3.458 N/A ARG 45.A NH2 PRO 17.A O no hydrogen 2.939 N/A SER 46.A N GLU 49.A OE1 no hydrogen 2.946 N/A SER 46.A OG GLU 49.A OE1 no hydrogen 3.144 N/A GLU 49.A N SER 46.A OG no hydrogen 3.180 N/A ILE 50.A N SER 46.A O no hydrogen 3.132 N/A SER 51.A N PRO 47.A O no hydrogen 2.884 N/A SER 51.A OG PRO 47.A O no hydrogen 2.653 N/A ARG 52.A N GLU 48.A O no hydrogen 3.315 N/A ARG 52.A N GLU 49.A O no hydrogen 3.191 N/A PHE 53.A N GLU 49.A O no hydrogen 2.810 N/A LEU 54.A N ILE 50.A O no hydrogen 2.701 N/A LEU 56.A N LEU 54.A O no hydrogen 2.678 N/A ILE 58.A N LEU 56.A O no hydrogen 3.018 N/A ASN 59.A N THR 39.A O no hydrogen 3.294 N/A ASN 59.A ND2 ASP 38.A OD1 no hydrogen 3.533 N/A ILE 60.A N ILE 41.A O no hydrogen 2.832 N/A CYS 61.A N CYS 66.A O no hydrogen 2.722 N/A TYR 62.A N ARG 45.A O no hydrogen 2.983 N/A HIS 63.A N THR 43.A O no hydrogen 2.874 N/A GLY 64.A N CYS 61.A O no hydrogen 2.759 N/A ALA 65.A N TYR 62.A O no hydrogen 3.256 N/A CYS 66.A N CYS 61.A O no hydrogen 3.417 N/A CYS 66.A SG SER 67.A O no hydrogen 3.829 N/A CYS 66.A SG VAL 74.A O no hydrogen 3.537 N/A SER 67.A N VAL 74.A O no hydrogen 2.785 N/A SER 67.A OG ASN 76.A OD1 no hydrogen 2.902 N/A LYS 68.A NZ SER 51.A OG no hydrogen 2.998 N/A ILE 69.A N GLN 72.A O no hydrogen 2.973 N/A ASN 70.A N ASN 59.A OD1 no hydrogen 3.172 N/A GLN 72.A N ILE 69.A O no hydrogen 2.837 N/A VAL 74.A N SER 67.A O no hydrogen 2.690 N/A ASN 76.A N ALA 65.A O no hydrogen 2.850 N/A SER 79.A N ASN 76.A O no hydrogen 3.015 N/A SER 79.A OG ALA 65.A O no hydrogen 2.679 N/A SER 79.A OG ASN 76.A O no hydrogen 3.319 N/A ARG 81.A N GLY 78.A O no hydrogen 3.128 N/A ARG 81.A NE GLY 78.A O no hydrogen 2.729 N/A PHE 82.A N SER 79.A O no hydrogen 2.902 N/A LEU 83.A N ASP 80.A O no hydrogen 3.213 N/A PHE 86.A N PHE 82.A O no hydrogen 3.178 N/A ASP 87.A N LEU 83.A O no hydrogen 3.436 N/A ARG 88.A N GLY 84.A O no hydrogen 3.141 N/A ILE 89.A N VAL 85.A O no hydrogen 2.859 N/A TYR 90.A N PHE 86.A O no hydrogen 3.103 N/A GLU 91.A N ASP 87.A O no hydrogen 3.054 N/A ASP 92.A N ARG 88.A O no hydrogen 2.882 N/A THR 93.A N ILE 89.A O no hydrogen 3.003 N/A THR 93.A N TYR 90.A O no hydrogen 3.215 N/A THR 93.A OG1 ILE 89.A O no hydrogen 2.710 N/A THR 93.A OG1 TYR 114.A OH no hydrogen 2.807 N/A ARG 94.A N TYR 90.A O no hydrogen 2.760 N/A TRP 96.A N THR 93.A O no hydrogen 2.935 N/A VAL 97.A N ARG 94.A O no hydrogen 3.450 N/A SER 98.A N SER 95.A O no hydrogen 3.064 N/A SER 98.A OG SER 95.A O no hydrogen 2.809 N/A PHE 100.A N TRP 96.A O no hydrogen 2.849 N/A LEU 103.A N PHE 100.A O no hydrogen 2.887 N/A ARG 104.A N HIS 115.A O no hydrogen 3.157 N/A ARG 104.A NH1 ASN 16.A OD1 no hydrogen 2.945 N/A TYR 106.A N LEU 113.A O no hydrogen 2.859 N/A TYR 106.A OH GLU 18.A OE1 no hydrogen 2.777 N/A ARG 107.A NH2 ASP 87.A OD1 no hydrogen 2.953 N/A LYS 108.A N ALA 111.A O no hydrogen 2.906 N/A LYS 108.A NZ GLU 49.A OE1 no hydrogen 2.801 N/A LYS 108.A NZ GLU 49.A OE2 no hydrogen 3.114 N/A LEU 110.A N TYR 62.A OH no hydrogen 3.194 N/A ALA 111.A N LYS 108.A O no hydrogen 3.461 N/A VAL 112.A N LEU 148.A O no hydrogen 3.175 N/A LEU 113.A N TYR 106.A O no hydrogen 2.994 N/A TYR 114.A N ILE 146.A O no hydrogen 2.791 N/A TYR 114.A OH THR 93.A OG1 no hydrogen 2.807 N/A HIS 115.A N ARG 104.A O no hydrogen 2.830 N/A GLY 117.A N HIS 115.A ND1 no hydrogen 2.899 N/A LYS 122.A NZ LEU 116.A O no hydrogen 3.198 N/A ARG 126.A N LYS 122.A O no hydrogen 2.847 N/A ARG 126.A NE GLU 130.A OE2 no hydrogen 3.383 N/A SER 127.A N PRO 123.A O no hydrogen 3.088 N/A SER 127.A OG LYS 124.A O no hydrogen 2.664 N/A ARG 128.A N LYS 124.A O no hydrogen 3.099 N/A ARG 128.A NH1 ASP 99.A OD2 no hydrogen 3.453 N/A ILE 129.A N LEU 125.A O no hydrogen 2.934 N/A GLU 130.A N ARG 126.A O no hydrogen 3.017 N/A GLU 131.A N SER 127.A O no hydrogen 3.028 N/A ILE 132.A N ARG 128.A O no hydrogen 3.032 N/A ALA 133.A N ILE 129.A O no hydrogen 2.930 N/A ARG 134.A N GLU 130.A O no hydrogen 3.017 N/A ILE 135.A N GLU 131.A O no hydrogen 2.929 N/A PHE 136.A N ILE 132.A O no hydrogen 2.964 N/A GLY 137.A N ARG 134.A O no hydrogen 3.388 N/A VAL 138.A N ALA 133.A O no hydrogen 2.954 N/A GLU 139.A N ARG 149.A O no hydrogen 2.958 N/A TYR 141.A N GLU 147.A O no hydrogen 2.780 N/A TYR 142.A OH GLU 130.A OE2 no hydrogen 2.528 N/A GLY 143.A N ILE 145.A O no hydrogen 2.684 N/A ILE 146.A N TYR 114.A O no hydrogen 3.028 N/A GLU 147.A N TYR 141.A O no hydrogen 2.853 N/A LEU 148.A N VAL 112.A O no hydrogen 2.992 N/A ARG 149.A N GLU 139.A O no hydrogen 2.813 N/A ARG 149.A NE GLU 139.A OE2 no hydrogen 2.825 N/A ARG 149.A NH2 GLU 139.A OE2 no hydrogen 2.963 N/A GLY 152.A N GLU 139.A OE1 no hydrogen 2.762 N/A VAL 153.A N VAL 150.A O no hydrogen 3.490 N/A LYS 155.A NZ ASP 6.A OD1 no hydrogen 2.942 N/A LYS 155.A NZ THR 176.A OG1 no hydrogen 3.334 N/A LYS 155.A NZ ASP 177.A OD1 no hydrogen 2.653 N/A SER 157.A N ASN 154.A OD1 no hydrogen 2.993 N/A ALA 158.A N ASN 154.A O no hydrogen 3.120 N/A ILE 159.A N LYS 155.A O no hydrogen 2.903 N/A ARG 160.A N GLY 156.A O no hydrogen 2.803 N/A ARG 160.A NE GLY 164.A O no hydrogen 3.240 N/A ARG 160.A NH1 ALA 183.A O no hydrogen 3.029 N/A ARG 160.A NH1 ASP 186.A OD1 no hydrogen 3.433 N/A ARG 160.A NH2 GLY 164.A O no hydrogen 2.704 N/A ARG 160.A NH2 ASP 186.A OD1 no hydrogen 3.235 N/A SER 161.A N SER 157.A O no hydrogen 2.817 N/A VAL 162.A N ALA 158.A O no hydrogen 3.236 N/A VAL 162.A N ILE 159.A O no hydrogen 2.950 N/A ARG 163.A N ILE 159.A O no hydrogen 2.996 N/A ARG 163.A NE ARG 166.A O no hydrogen 3.101 N/A ARG 163.A NH1 ASN 184.A OD1 no hydrogen 2.946 N/A ARG 163.A NH1 ASP 186.A OD1 no hydrogen 3.092 N/A ARG 163.A NH2 ARG 166.A O no hydrogen 2.895 N/A ARG 163.A NH2 ASP 186.A OD1 no hydrogen 3.455 N/A ARG 163.A NH2 ASP 186.A OD2 no hydrogen 2.698 N/A GLY 164.A N ARG 160.A O no hydrogen 2.728 N/A ARG 166.A N ARG 163.A O no hydrogen 2.908 N/A ARG 166.A NE ARG 163.A O no hydrogen 3.439 N/A ARG 166.A NH2 VAL 162.A O no hydrogen 2.949 N/A ILE 169.A N LEU 2.A O no hydrogen 2.982 N/A ILE 170.A N LEU 188.A O no hydrogen 2.969 N/A ALA 171.A N PHE 4.A O no hydrogen 3.019 N/A GLY 172.A N ILE 190.A O no hydrogen 3.076 N/A ASP 173.A N ASP 177.A OD2 no hydrogen 3.039 N/A ASP 174.A N ASP 177.A OD2 no hydrogen 3.010 N/A THR 176.A N ASP 174.A OD1 no hydrogen 2.984 N/A THR 176.A OG1 ASP 174.A OD1 no hydrogen 2.637 N/A ASP 177.A N ASP 174.A O no hydrogen 2.868 N/A GLU 178.A N ASP 174.A O no hydrogen 2.887 N/A ALA 179.A N ALA 175.A O no hydrogen 2.813 N/A ALA 180.A N THR 176.A O no hydrogen 3.231 N/A PHE 181.A N ASP 177.A O no hydrogen 2.839 N/A GLU 182.A N GLU 178.A O no hydrogen 3.191 N/A ALA 183.A N ALA 179.A O no hydrogen 3.028 N/A ASN 184.A N PHE 181.A O no hydrogen 2.965 N/A ASN 184.A ND2 GLY 156.A O no hydrogen 3.363 N/A ASN 184.A ND2 ALA 180.A O no hydrogen 2.941 N/A ALA 187.A N ASN 184.A O no hydrogen 2.902 N/A LEU 188.A N ALA 168.A O no hydrogen 2.882 N/A ILE 190.A N ILE 170.A O no hydrogen 2.713 N/A LYS 191.A N PHE 201.A O no hydrogen 2.886 N/A LYS 191.A NZ ASP 173.A O no hydrogen 3.244 N/A LYS 191.A NZ VAL 192.A O no hydrogen 3.100 N/A LYS 191.A NZ GLY 193.A O no hydrogen 3.395 N/A LYS 191.A NZ GLU 194.A O no hydrogen 3.218 N/A VAL 192.A N GLY 172.A O no hydrogen 2.888 N/A GLY 193.A N VAL 203.A O no hydrogen 2.908 N/A THR 197.A OG1 GLU 178.A OE1 no hydrogen 2.721 N/A THR 197.A OG1 GLU 178.A OE2 no hydrogen 2.958 N/A HIS 198.A N GLU 178.A OE2 no hydrogen 2.928 N/A ALA 199.A N THR 197.A OG1 no hydrogen 2.977 N/A LYS 200.A N THR 189.A OG1 no hydrogen 2.767 N/A LYS 200.A NZ ASP 185.A O no hydrogen 3.367 N/A LYS 200.A NZ ALA 187.A O no hydrogen 3.062 N/A PHE 201.A N THR 189.A O no hydrogen 2.889 N/A VAL 203.A N LYS 191.A O no hydrogen 2.808 N/A ALA 204.A N GLU 208.A OE1 no hydrogen 2.784 N/A GLU 208.A N ASP 205.A OD1 no hydrogen 2.928 N/A ARG 209.A NE LEU 11.A O no hydrogen 2.851 N/A ARG 209.A NH1 ASP 23.A OD1 no hydrogen 3.169 N/A ARG 209.A NH1 ASP 23.A OD2 no hydrogen 3.313 N/A ARG 209.A NH2 LEU 11.A O no hydrogen 2.902 N/A LYS 210.A N ILE 207.A O no hydrogen 3.116 N/A ILE 211.A N GLU 208.A O no hydrogen 2.984 N/A LYS 213.A N ARG 209.A O no hydrogen 2.802 N/A PHE 214.A N LYS 210.A O no hydrogen 2.941 N/A ILE 215.A N ILE 211.A O no hydrogen 2.944 N/A GLU 216.A N LEU 212.A O no hydrogen 3.127 N/A GLY 218.A N ILE 215.A O no hydrogen 3.239 N/A VAL 219.A N GLU 216.A O no hydrogen 3.134 N/A LYS 221.A N LEU 217.A O no hydrogen 2.886 N/A LYS 222.A N GLY 218.A O no hydrogen 3.292 N/A