Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3i8r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASN 175.A OD1 no hydrogen 2.923 N/A GLU 5.A N GLY 1.A O no hydrogen 2.997 N/A LEU 6.A N LEU 2.A O no hydrogen 2.808 N/A LYS 7.A N ALA 3.A O no hydrogen 3.115 N/A GLN 8.A N VAL 4.A O no hydrogen 2.911 N/A SER 9.A N GLU 5.A O no hydrogen 2.838 N/A THR 10.A N LEU 6.A O no hydrogen 3.126 N/A THR 10.A N LYS 7.A O no hydrogen 3.358 N/A THR 10.A OG1 LEU 6.A O no hydrogen 2.786 N/A THR 10.A OG1 LYS 7.A O no hydrogen 3.564 N/A ALA 11.A N GLN 8.A O no hydrogen 3.448 N/A HIS 14.A N THR 10.A O no hydrogen 2.903 N/A GLU 15.A N ALA 11.A O no hydrogen 3.000 N/A LYS 16.A N GLN 12.A O no hydrogen 2.977 N/A LYS 16.A NZ GLN 12.A OE1 no hydrogen 3.411 N/A ALA 17.A N ALA 13.A O no hydrogen 2.950 N/A GLU 18.A N HIS 14.A O no hydrogen 2.985 N/A HIS 19.A N LYS 16.A O no hydrogen 3.118 N/A SER 20.A N ALA 17.A O no hydrogen 3.162 N/A MET 23.A N SER 20.A OG no hydrogen 3.180 N/A SER 24.A N SER 20.A O no hydrogen 2.868 N/A ASP 25.A N THR 21.A O no hydrogen 2.874 N/A LEU 26.A N PHE 22.A O no hydrogen 2.879 N/A LEU 27.A N MET 23.A O no hydrogen 2.886 N/A LYS 28.A N SER 24.A O no hydrogen 2.995 N/A GLY 29.A N LEU 26.A O no hydrogen 3.263 N/A ARG 30.A N ASP 25.A O no hydrogen 2.961 N/A ARG 30.A NH1 ASP 25.A OD1 no hydrogen 3.146 N/A LEU 31.A N TYR 145.A OH no hydrogen 3.075 N/A GLU 35.A N GLU 35.A OE1 no hydrogen 2.795 N/A PHE 36.A N GLY 32.A O no hydrogen 3.160 N/A THR 37.A N VAL 33.A O no hydrogen 2.852 N/A THR 37.A OG1 VAL 33.A O no hydrogen 2.643 N/A ARG 38.A N ALA 34.A O no hydrogen 2.928 N/A ARG 38.A NE GLU 41.A OE1 no hydrogen 2.839 N/A ARG 38.A NH2 GLU 41.A OE2 no hydrogen 2.965 N/A LEU 39.A N GLU 35.A O no hydrogen 3.016 N/A GLN 40.A N PHE 36.A O no hydrogen 2.995 N/A GLU 41.A N THR 37.A O no hydrogen 2.838 N/A GLN 42.A N ARG 38.A O no hydrogen 3.088 N/A GLN 42.A NE2 THR 95.A O no hydrogen 3.013 N/A ALA 43.A N LEU 39.A O no hydrogen 2.869 N/A TRP 44.A N GLN 40.A O no hydrogen 2.841 N/A LEU 45.A N GLU 41.A O no hydrogen 3.197 N/A PHE 46.A N GLN 42.A O no hydrogen 3.076 N/A TYR 47.A N ALA 43.A O no hydrogen 2.763 N/A TYR 47.A OH ASP 130.A OD1 no hydrogen 2.430 N/A THR 48.A N TRP 44.A O no hydrogen 2.939 N/A THR 48.A OG1 TRP 44.A O no hydrogen 2.750 N/A ALA 49.A N LEU 45.A O no hydrogen 3.304 N/A LEU 50.A N PHE 46.A O no hydrogen 2.775 N/A GLU 51.A N TYR 47.A O no hydrogen 2.885 N/A GLN 52.A N THR 48.A O no hydrogen 3.162 N/A ALA 53.A N ALA 49.A O no hydrogen 3.150 N/A VAL 54.A N LEU 50.A O no hydrogen 2.772 N/A ASP 55.A N GLU 51.A O no hydrogen 2.909 N/A ALA 56.A N GLN 52.A O no hydrogen 3.016 N/A VAL 57.A N ALA 53.A O no hydrogen 2.938 N/A ARG 58.A N VAL 54.A O no hydrogen 2.853 N/A ARG 58.A NE LEU 67.A O no hydrogen 2.926 N/A ARG 58.A NH1 ASP 55.A OD1 no hydrogen 2.842 N/A ARG 58.A NH2 LEU 67.A O no hydrogen 2.951 N/A ALA 59.A N ASP 55.A O no hydrogen 2.948 N/A SER 60.A N ALA 56.A O no hydrogen 3.067 N/A SER 60.A OG VAL 57.A O no hydrogen 2.584 N/A GLY 61.A N ARG 58.A O no hydrogen 3.129 N/A PHE 62.A N VAL 57.A O no hydrogen 3.464 N/A LEU 67.A N ALA 63.A O no hydrogen 3.144 N/A ASP 68.A N LEU 66.A O no hydrogen 2.873 N/A ALA 70.A N ASP 68.A OD1 no hydrogen 2.923 N/A LEU 71.A N ASP 68.A O no hydrogen 2.982 N/A ASN 72.A N PRO 69.A O no hydrogen 3.007 N/A ARG 73.A N GLU 51.A OE1 no hydrogen 3.265 N/A ARG 73.A N GLU 51.A OE2 no hydrogen 2.722 N/A ARG 73.A NE LEU 71.A O no hydrogen 2.913 N/A ARG 73.A NE ASN 72.A O no hydrogen 3.213 N/A ARG 73.A NH1 PHE 154.A O no hydrogen 2.760 N/A ARG 73.A NH2 ALA 70.A O no hydrogen 3.321 N/A ARG 73.A NH2 ASN 72.A O no hydrogen 2.924 N/A ALA 74.A N GLU 51.A OE1 no hydrogen 2.969 N/A LEU 77.A N ARG 73.A O no hydrogen 2.860 N/A ALA 78.A N ALA 74.A O no hydrogen 2.937 N/A ARG 79.A N GLU 75.A O no hydrogen 3.059 N/A ASP 80.A N VAL 76.A O no hydrogen 2.885 N/A LEU 81.A N LEU 77.A O no hydrogen 2.848 N/A ASP 82.A N ALA 78.A O no hydrogen 2.847 N/A LYS 83.A N ARG 79.A O no hydrogen 3.285 N/A LEU 84.A N ASP 80.A O no hydrogen 2.860 N/A ASN 85.A N LEU 81.A O no hydrogen 2.992 N/A ASN 85.A ND2 GLU 41.A OE2 no hydrogen 2.977 N/A ASN 85.A ND2 LEU 81.A O no hydrogen 3.378 N/A GLY 86.A N ASP 82.A O no hydrogen 2.980 N/A SER 88.A OG ASP 82.A OD1 no hydrogen 3.483 N/A GLU 89.A N SER 87.A OG no hydrogen 3.123 N/A TRP 90.A NE1 ASP 82.A OD1 no hydrogen 2.907 N/A ARG 91.A N SER 88.A O no hydrogen 3.208 N/A SER 92.A OG GLU 89.A O no hydrogen 3.431 N/A ARG 93.A N TRP 90.A O no hydrogen 3.089 N/A ARG 93.A NH1 GLU 41.A OE2 no hydrogen 2.986 N/A ARG 93.A NH1 GLU 89.A OE2 no hydrogen 3.219 N/A ARG 93.A NH2 GLU 41.A OE1 no hydrogen 2.618 N/A ARG 93.A NH2 GLU 41.A OE2 no hydrogen 3.441 N/A ILE 94.A N TRP 90.A O no hydrogen 2.787 N/A SER 97.A N GLN 42.A OE1 no hydrogen 2.958 N/A SER 97.A OG GLN 42.A OE1 no hydrogen 3.275 N/A ALA 99.A N ASP 204.A OD2 no hydrogen 2.919 N/A VAL 100.A N SER 97.A OG no hydrogen 3.229 N/A ILE 101.A N SER 97.A O no hydrogen 2.930 N/A ASP 102.A N PRO 98.A O no hydrogen 3.173 N/A TYR 103.A N ALA 99.A O no hydrogen 3.007 N/A VAL 104.A N VAL 100.A O no hydrogen 2.756 N/A ASN 105.A N ILE 101.A O no hydrogen 2.867 N/A ARG 106.A N ASP 102.A O no hydrogen 3.045 N/A ARG 106.A NE.A GLU 190.A OE1 no hydrogen 2.826 N/A ARG 106.A NE.A GLU 190.A OE2 no hydrogen 3.358 N/A ARG 106.A NH1.A GLU 190.A OE2 no hydrogen 2.604 N/A ARG 106.A NH2.A GLU 109.A OE2 no hydrogen 3.173 N/A ARG 106.A NH2.B GLU 190.A OE1 no hydrogen 2.896 N/A ARG 106.A NH2.B GLU 190.A OE2 no hydrogen 3.539 N/A ARG 106.A NH2.B ASP 193.A OD2 no hydrogen 2.769 N/A LEU 107.A N TYR 103.A O no hydrogen 2.989 N/A GLU 108.A N VAL 104.A O no hydrogen 2.861 N/A GLU 109.A N ASN 105.A O no hydrogen 2.990 N/A ILE 110.A N ARG 106.A O no hydrogen 2.935 N/A ARG 111.A N LEU 107.A O no hydrogen 2.857 N/A ARG 111.A NE ASP 112.A OD1 no hydrogen 2.807 N/A ARG 111.A NH1 GLN 52.A OE1 no hydrogen 2.820 N/A ARG 111.A NH2 ASP 112.A OD1 no hydrogen 3.338 N/A ARG 111.A NH2 ASP 112.A OD2 no hydrogen 3.096 N/A ASP 112.A N GLU 108.A O no hydrogen 2.912 N/A ASN 113.A N GLU 109.A O no hydrogen 2.854 N/A VAL 114.A N ARG 111.A O no hydrogen 3.044 N/A ASP 115.A N ILE 110.A O no hydrogen 3.025 N/A ALA 118.A N ASP 115.A OD1 no hydrogen 3.111 N/A LEU 119.A N ASP 115.A O no hydrogen 3.019 N/A VAL 120.A N GLY 116.A O no hydrogen 2.937 N/A ALA 121.A N PRO 117.A O no hydrogen 3.193 N/A HIS 122.A N ALA 118.A O no hydrogen 3.171 N/A HIS 122.A NE2 GLU 190.A OE1 no hydrogen 2.806 N/A HIS 123.A N LEU 119.A O no hydrogen 2.917 N/A HIS 123.A ND1 TYR 170.A OH no hydrogen 2.812 N/A TYR 124.A N VAL 120.A O no hydrogen 2.874 N/A VAL 125.A N ALA 121.A O no hydrogen 2.996 N/A ARG 126.A N HIS 122.A O no hydrogen 3.129 N/A ARG 126.A NE TYR 47.A OH no hydrogen 2.729 N/A ARG 126.A NH1 ASN 198.A OD1 no hydrogen 2.854 N/A ARG 126.A NH2 TYR 47.A OH no hydrogen 3.076 N/A ARG 126.A NH2 ASP 130.A OD2 no hydrogen 2.992 N/A TYR 127.A N HIS 123.A O no hydrogen 2.772 N/A TYR 127.A OH GLU 51.A OE2 no hydrogen 2.579 N/A LEU 128.A N TYR 124.A O no hydrogen 3.072 N/A ASP 130.A N ARG 126.A O no hydrogen 2.934 N/A LEU 131.A N TYR 127.A O no hydrogen 2.908 N/A SER 132.A N LEU 128.A O no hydrogen 2.925 N/A SER 132.A N GLY 129.A O no hydrogen 3.045 N/A SER 132.A OG LEU 128.A O no hydrogen 2.684 N/A GLY 133.A N GLY 129.A O no hydrogen 2.870 N/A GLN 135.A NE2 TYR 155.A O no hydrogen 3.186 N/A ILE 137.A N GLY 133.A O no hydrogen 3.212 N/A ALA 138.A N GLY 134.A O no hydrogen 2.842 N/A ARG 139.A N GLN 135.A O no hydrogen 2.772 N/A MET 140.A N VAL 136.A O no hydrogen 2.973 N/A MET 141.A N ILE 137.A O no hydrogen 2.982 N/A GLN 142.A N ALA 138.A O no hydrogen 3.041 N/A ARG 143.A N ARG 139.A O no hydrogen 2.829 N/A HIS 144.A N MET 140.A O no hydrogen 2.860 N/A TYR 145.A N MET 141.A O no hydrogen 3.191 N/A TYR 145.A OH LEU 26.A O no hydrogen 2.604 N/A GLY 146.A N GLN 142.A O no hydrogen 3.058 N/A VAL 147.A N MET 141.A O no hydrogen 3.294 N/A GLU 150.A N ASP 148.A OD1 no hydrogen 2.799 N/A ALA 151.A N ASP 148.A O no hydrogen 2.908 N/A LEU 152.A N PRO 149.A O no hydrogen 3.070 N/A GLY 153.A N ASP 80.A OD2 no hydrogen 2.865 N/A PHE 154.A N ASP 80.A OD1 no hydrogen 2.783 N/A TYR 155.A N LEU 152.A O no hydrogen 2.885 N/A HIS 156.A N GLY 153.A O no hydrogen 2.873 N/A ILE 160.A N PHE 157.A O no hydrogen 2.957 N/A TYR 166.A N LYS 162.A O no hydrogen 3.122 N/A TYR 166.A OH ASP 68.A OD2 no hydrogen 2.654 N/A LYS 167.A N LEU 163.A O no hydrogen 3.067 N/A ASP 168.A N LYS 164.A O no hydrogen 3.037 N/A GLU 169.A N VAL 165.A O no hydrogen 2.869 N/A TYR 170.A N TYR 166.A O no hydrogen 2.853 N/A TYR 170.A OH HIS 123.A ND1 no hydrogen 2.812 N/A ARG 171.A N LYS 167.A O no hydrogen 2.977 N/A GLU 172.A N ASP 168.A O no hydrogen 3.038 N/A LYS 173.A N GLU 169.A O no hydrogen 2.897 N/A LYS 173.A NZ SER 65.A O no hydrogen 2.787 N/A LEU 174.A N TYR 170.A O no hydrogen 3.027 N/A ASN 175.A N ARG 171.A O no hydrogen 3.054 N/A ASN 176.A N GLU 172.A O no hydrogen 3.007 N/A ASN 176.A N LYS 173.A O no hydrogen 3.266 N/A LEU 177.A N LEU 174.A O no hydrogen 3.304 N/A SER 180.A N GLN 183.A OE1 no hydrogen 2.859 N/A GLN 183.A N SER 180.A OG no hydrogen 3.078 N/A ARG 184.A N SER 180.A O no hydrogen 2.817 N/A ARG 184.A NH2 GLU 5.A OE2 no hydrogen 2.267 N/A GLU 185.A N ASP 181.A O no hydrogen 2.953 N/A HIS 186.A N GLU 182.A O no hydrogen 3.097 N/A HIS 186.A NE2 ASP 115.A OD2 no hydrogen 2.749 N/A LEU 187.A N GLN 183.A O no hydrogen 2.921 N/A LEU 188.A N ARG 184.A O no hydrogen 2.887 N/A LYS 189.A N GLU 185.A O no hydrogen 2.946 N/A GLU 190.A N HIS 186.A O no hydrogen 2.909 N/A ALA 191.A N LEU 187.A O no hydrogen 2.941 N/A THR 192.A N LEU 188.A O no hydrogen 3.265 N/A ASP 193.A N LYS 189.A O no hydrogen 3.060 N/A ALA 194.A N GLU 190.A O no hydrogen 2.734 N/A PHE 195.A N ALA 191.A O no hydrogen 3.088 N/A VAL 196.A N THR 192.A O no hydrogen 3.103 N/A PHE 197.A N ASP 193.A O no hydrogen 2.924 N/A ASN 198.A N ALA 194.A O no hydrogen 3.037 N/A ASN 198.A ND2 TYR 103.A OH no hydrogen 2.932 N/A ASN 198.A ND2 ALA 194.A O no hydrogen 2.910 N/A HIS 199.A N PHE 195.A O no hydrogen 2.824 N/A GLN 200.A N VAL 196.A O no hydrogen 3.063 N/A GLN 200.A NE2 ASP 204.A OD1 no hydrogen 2.941 N/A VAL 201.A N PHE 197.A O no hydrogen 3.024 N/A PHE 202.A N ASN 198.A O no hydrogen 3.348 N/A ALA 203.A N HIS 199.A O no hydrogen 2.983 N/A ASP 204.A N GLN 200.A O no hydrogen 2.854 N/A LEU 205.A N VAL 201.A O no hydrogen 3.018 N/A GLY 206.A N PHE 202.A O no hydrogen 2.979 N/A LYS 207.A N ALA 203.A O no hydrogen 3.134 N/A LYS 207.A NZ ASP 204.A OD1 no hydrogen 2.878 N/A