Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3l77_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N ASP 82.A OD2 no hydrogen 2.818 N/A ALA 5.A N ALA 28.A O no hydrogen 2.851 N/A VAL 6.A N VAL 83.A O no hydrogen 2.768 N/A ILE 7.A N ALA 30.A O no hydrogen 2.868 N/A THR 8.A N VAL 85.A O no hydrogen 2.915 N/A THR 8.A OG1 VAL 85.A O no hydrogen 3.465 N/A ALA 10.A N GLY 32.A O no hydrogen 3.231 N/A ARG 12.A NH2 SER 35.A OG no hydrogen 3.001 N/A GLU 16.A N ARG 12.A O no hydrogen 3.200 N/A ALA 17.A N GLY 13.A O no hydrogen 3.101 N/A ILE 18.A N ILE 14.A O no hydrogen 2.869 N/A ALA 19.A N GLY 15.A O no hydrogen 2.998 N/A ARG 20.A N GLU 16.A O no hydrogen 2.989 N/A ARG 20.A NE GLU 16.A OE2 no hydrogen 2.944 N/A ARG 20.A NH1 GLU 45.A OE1 no hydrogen 3.218 N/A ARG 20.A NH1 GLU 45.A OE2 no hydrogen 3.051 N/A ARG 20.A NH2 GLU 16.A OE2 no hydrogen 3.045 N/A ARG 20.A NH2 GLU 45.A OE1 no hydrogen 2.956 N/A ALA 21.A N ALA 17.A O no hydrogen 2.935 N/A LEU 22.A N ILE 18.A O no hydrogen 2.889 N/A ALA 23.A N ALA 19.A O no hydrogen 2.940 N/A ARG 24.A N ARG 20.A O no hydrogen 3.243 N/A ARG 24.A NH1 GLU 207.A OE1 no hydrogen 3.025 N/A ASP 25.A N LEU 22.A O no hydrogen 3.017 N/A GLY 26.A N ALA 23.A O no hydrogen 2.909 N/A TYR 27.A N LEU 22.A O no hydrogen 3.152 N/A ALA 28.A N LYS 3.A O no hydrogen 2.885 N/A LEU 29.A N GLU 53.A O no hydrogen 2.878 N/A ALA 30.A N ALA 5.A O no hydrogen 2.867 N/A LEU 31.A N PHE 55.A O no hydrogen 2.752 N/A GLY 32.A N ILE 7.A O no hydrogen 2.936 N/A ARG 38.A NE SER 11.A O no hydrogen 2.960 N/A ARG 38.A NH2 SER 11.A O no hydrogen 3.041 N/A LEU 39.A N SER 35.A O no hydrogen 3.167 N/A GLU 40.A N VAL 36.A O no hydrogen 2.894 N/A LYS 41.A N ASP 37.A O no hydrogen 3.170 N/A ILE 42.A N ARG 38.A O no hydrogen 2.979 N/A ALA 43.A N LEU 39.A O no hydrogen 2.828 N/A HIS 44.A N GLU 40.A O no hydrogen 2.942 N/A GLU 45.A N LYS 41.A O no hydrogen 3.302 N/A LEU 46.A N ILE 42.A O no hydrogen 2.951 N/A MET 47.A N ALA 43.A O no hydrogen 2.907 N/A GLN 48.A N HIS 44.A O no hydrogen 3.179 N/A GLU 49.A N GLU 45.A O no hydrogen 2.773 N/A GLN 50.A N LEU 46.A O no hydrogen 2.832 N/A PHE 55.A N LEU 29.A O no hydrogen 2.766 N/A HIS 57.A N LEU 31.A O no hydrogen 3.112 N/A HIS 57.A ND1 HIS 58.A O no hydrogen 2.803 N/A LEU 59.A N ALA 33.A O no hydrogen 2.921 N/A ASP 60.A N SER 66.A OG no hydrogen 2.843 N/A SER 62.A N ASP 60.A OD1 no hydrogen 2.950 N/A SER 62.A OG ASP 60.A OD1 no hydrogen 2.656 N/A SER 62.A OG ASP 60.A OD2 no hydrogen 3.516 N/A LYS 63.A N ASP 60.A O no hydrogen 3.048 N/A GLU 65.A N GLU 65.A OE1 no hydrogen 2.765 N/A VAL 67.A N LYS 63.A O no hydrogen 3.182 N/A GLU 68.A N ALA 64.A O no hydrogen 3.055 N/A GLU 69.A N GLU 65.A O no hydrogen 3.007 N/A PHE 70.A N SER 66.A O no hydrogen 2.896 N/A SER 71.A N VAL 67.A O no hydrogen 2.948 N/A SER 71.A OG VAL 67.A O no hydrogen 3.357 N/A SER 71.A OG GLU 68.A O no hydrogen 2.900 N/A LYS 72.A N GLU 68.A O no hydrogen 3.044 N/A LYS 72.A NZ.C GLU 69.A OE1 no hydrogen 2.878 N/A LYS 73.A N GLU 69.A O no hydrogen 2.953 N/A VAL 74.A N PHE 70.A O no hydrogen 2.893 N/A LEU 75.A N SER 71.A O no hydrogen 2.919 N/A GLU 76.A N LYS 72.A O no hydrogen 2.966 N/A ARG 77.A N LYS 73.A O no hydrogen 2.938 N/A ARG 77.A NH1 ARG 77.A O no hydrogen 3.098 N/A ARG 77.A NH2 GLU 53.A OE1 no hydrogen 3.008 N/A PHE 78.A N VAL 74.A O no hydrogen 2.973 N/A GLY 79.A N LEU 75.A O no hydrogen 2.781 N/A VAL 81.A N SER 125.A OG no hydrogen 2.849 N/A ASP 82.A N VAL 4.A O no hydrogen 2.925 N/A VAL 83.A N VAL 4.A O no hydrogen 3.032 N/A VAL 84.A N LEU 132.A O no hydrogen 2.820 N/A VAL 85.A N VAL 6.A O no hydrogen 2.673 N/A ALA 86.A N LEU 134.A O no hydrogen 2.740 N/A ASN 87.A N THR 8.A OG1 no hydrogen 2.911 N/A ASN 87.A ND2 THR 8.A O no hydrogen 3.237 N/A ASN 87.A ND2 GLY 9.A O no hydrogen 3.236 N/A ALA 88.A N THR 8.A OG1 no hydrogen 3.158 N/A LEU 90.A N ASN 111.A OD1 no hydrogen 2.995 N/A TYR 92.A OH GLU 106.A OE1 no hydrogen 2.506 N/A LYS 94.A NZ GLU 103.A OE2 no hydrogen 2.598 N/A ARG 95.A NE GLU 97.A OE2 no hydrogen 2.720 N/A ARG 95.A NH2 GLU 97.A OE2 no hydrogen 3.467 N/A GLU 97.A N GLU 97.A OE1 no hydrogen 2.760 N/A GLU 98.A N ARG 95.A O no hydrogen 2.874 N/A LEU 99.A N ARG 95.A O no hydrogen 3.019 N/A SER 100.A N GLU 103.A OE1 no hydrogen 2.884 N/A SER 100.A OG GLU 102.A OE1.A no hydrogen 3.528 N/A GLU 102.A N GLU 102.A OE1.A no hydrogen 2.743 N/A GLU 103.A N SER 100.A OG no hydrogen 2.946 N/A PHE 104.A N SER 100.A O no hydrogen 3.017 N/A HIS 105.A N GLU 101.A O no hydrogen 2.884 N/A HIS 105.A ND1 GLU 101.A O no hydrogen 2.801 N/A GLU 106.A N GLU 102.A O no hydrogen 2.983 N/A MET 107.A N GLU 103.A O no hydrogen 3.113 N/A ILE 108.A N PHE 104.A O no hydrogen 2.969 N/A GLU 109.A N HIS 105.A O no hydrogen 2.859 N/A VAL 110.A N GLU 106.A O no hydrogen 3.076 N/A ASN 111.A N MET 107.A O no hydrogen 2.819 N/A ASN 111.A ND2 LEU 90.A O no hydrogen 2.888 N/A ASN 111.A ND2 THR 154.A OG1 no hydrogen 3.041 N/A LEU 112.A N ILE 108.A O no hydrogen 3.160 N/A LEU 113.A N ILE 108.A O no hydrogen 2.890 N/A TRP 116.A N LEU 112.A O no hydrogen 3.013 N/A ARG 117.A N LEU 113.A O no hydrogen 2.795 N/A ARG 117.A NH1 GLU 109.A OE1 no hydrogen 2.797 N/A ARG 117.A NH2 VAL 61.A O no hydrogen 2.915 N/A ARG 117.A NH2 GLU 109.A OE1 no hydrogen 3.007 N/A THR 118.A N GLY 114.A O no hydrogen 2.980 N/A THR 118.A OG1 GLY 114.A O no hydrogen 2.751 N/A LEU 119.A N VAL 115.A O no hydrogen 2.909 N/A LYS 120.A N TRP 116.A O no hydrogen 2.936 N/A ALA 121.A N ARG 117.A O no hydrogen 3.052 N/A PHE 122.A N THR 118.A O no hydrogen 3.401 N/A PHE 122.A N LEU 119.A O no hydrogen 3.278 N/A LEU 123.A N LYS 120.A O no hydrogen 3.359 N/A SER 125.A OG ASP 80.A OD1 no hydrogen 2.766 N/A LEU 126.A N PHE 122.A O no hydrogen 2.964 N/A LYS 127.A N LEU 123.A O no hydrogen 2.889 N/A LYS 127.A NZ ASN 169.A OD1 no hydrogen 2.793 N/A LYS 127.A NZ ASP 171.A OD1 no hydrogen 3.265 N/A LYS 127.A NZ ASP 171.A OD2 no hydrogen 2.921 N/A ARG 128.A N ASP 124.A O no hydrogen 3.162 N/A ARG 128.A NE ASP 80.A OD1 no hydrogen 3.469 N/A ARG 128.A NE ASP 80.A OD2 no hydrogen 2.724 N/A ARG 128.A NH1 ASP 80.A OD1 no hydrogen 2.862 N/A THR 129.A N SER 125.A O no hydrogen 3.094 N/A THR 129.A OG1 VAL 81.A O no hydrogen 2.812 N/A THR 129.A OG1 SER 125.A O no hydrogen 3.367 N/A THR 129.A OG1 LEU 126.A O no hydrogen 3.382 N/A GLY 130.A N LYS 127.A O no hydrogen 3.439 N/A GLY 131.A N LEU 126.A O no hydrogen 2.904 N/A LEU 132.A N ASP 82.A O no hydrogen 2.874 N/A ALA 133.A N ARG 173.A O no hydrogen 2.716 N/A LEU 134.A N VAL 84.A O no hydrogen 2.742 N/A VAL 135.A N PHE 175.A O no hydrogen 2.860 N/A THR 136.A N ALA 86.A O no hydrogen 3.017 N/A THR 136.A OG1 ASN 87.A OD1 no hydrogen 2.913 N/A THR 137.A N LEU 177.A O no hydrogen 2.883 N/A THR 137.A OG1 GLU 176.A OE2 no hydrogen 2.655 N/A THR 137.A OG1 LEU 177.A O no hydrogen 3.474 N/A SER 138.A OG ASP 139.A OD2 no hydrogen 3.334 N/A SER 138.A OG TYR 151.A OH.B no hydrogen 2.942 N/A ASP 139.A N PRO 179.A O no hydrogen 2.979 N/A VAL 140.A N SER 138.A OG no hydrogen 3.012 N/A SER 141.A N SER 138.A O no hydrogen 2.989 N/A SER 141.A OG SER 138.A O no hydrogen 3.059 N/A SER 141.A OG GLU 176.A OE2 no hydrogen 2.684 N/A ALA 142.A N ASP 139.A O no hydrogen 3.496 N/A ARG 143.A NE ASP 139.A OD1 no hydrogen 2.885 N/A ARG 143.A NH2 ASP 139.A OD1 no hydrogen 2.918 N/A GLY 148.A N ILE 145.A O no hydrogen 3.046 N/A VAL 152.A N GLY 148.A O no hydrogen 2.611 N/A SER 153.A N GLY 149.A O no hydrogen 3.005 N/A SER 153.A OG GLY 149.A O no hydrogen 3.206 N/A SER 153.A OG GLY 150.A O no hydrogen 2.901 N/A THR 154.A N GLY 150.A O no hydrogen 3.264 N/A THR 154.A OG1 TYR 151.A O no hydrogen 2.723 N/A LYS 155.A N TYR 151.A O no hydrogen 3.133 N/A LYS 155.A NZ THR 136.A O no hydrogen 3.150 N/A LYS 155.A NZ THR 137.A O no hydrogen 2.930 N/A TRP 156.A N VAL 152.A O no hydrogen 2.842 N/A TRP 156.A NE1 ARG 143.A O no hydrogen 3.122 N/A ALA 157.A N SER 153.A O no hydrogen 2.977 N/A ALA 158.A N THR 154.A O no hydrogen 2.864 N/A ARG 159.A N LYS 155.A O no hydrogen 2.953 N/A ARG 159.A NH1 GLU 176.A OE1 no hydrogen 2.769 N/A ARG 159.A NH1 GLU 223.A OE2 no hydrogen 2.792 N/A ALA 160.A N TRP 156.A O no hydrogen 3.136 N/A LEU 161.A N ALA 157.A O no hydrogen 2.873 N/A VAL 162.A N ALA 158.A O no hydrogen 2.866 N/A ARG 163.A N ARG 159.A O no hydrogen 3.045 N/A THR 164.A N ALA 160.A O no hydrogen 2.899 N/A THR 164.A OG1 ALA 160.A O no hydrogen 2.772 N/A PHE 165.A N LEU 161.A O no hydrogen 2.882 N/A GLN 166.A N VAL 162.A O no hydrogen 2.939 N/A GLN 166.A NE2 GLN 166.A O no hydrogen 3.001 N/A GLN 166.A NE2 VAL 172.A O no hydrogen 2.823 N/A ILE 167.A N.A ARG 163.A O no hydrogen 2.965 N/A ILE 167.A N.B ARG 163.A O no hydrogen 2.988 N/A GLU 168.A N THR 164.A O no hydrogen 2.917 N/A ASN 169.A N GLN 166.A O no hydrogen 3.153 N/A ASN 169.A ND2 PHE 165.A O no hydrogen 2.878 N/A ASP 171.A N ASP 171.A OD2 no hydrogen 2.585 N/A VAL 172.A N ASN 169.A O no hydrogen 3.048 N/A ARG 173.A N GLY 131.A O no hydrogen 2.979 N/A ARG 173.A NE GLY 130.A O no hydrogen 3.312 N/A ARG 173.A NH1 VAL 219.A O no hydrogen 3.338 N/A ARG 173.A NH2 GLY 130.A O no hydrogen 3.167 N/A PHE 174.A N GLN 166.A OE1 no hydrogen 2.969 N/A PHE 175.A N ALA 133.A O no hydrogen 2.803 N/A GLU 176.A N GLU 222.A O no hydrogen 2.807 N/A LEU 177.A N VAL 135.A O no hydrogen 2.847 N/A ARG 178.A N LEU 224.A O no hydrogen 2.786 N/A ARG 178.A NE SER 138.A O no hydrogen 3.322 N/A ARG 178.A NH1 GLU 223.A OE2 no hydrogen 2.744 N/A ARG 178.A NH2 ASP 139.A O no hydrogen 2.825 N/A GLY 180.A N LEU 226.A O no hydrogen 2.869 N/A ALA 181.A N GLN 231.A OE1 no hydrogen 2.963 N/A ASP 183.A N LEU 200.A O no hydrogen 2.826 N/A PHE 186.A N THR 184.A OG1 no hydrogen 3.052 N/A SER 189.A N TYR 185.A O no hydrogen 3.138 N/A SER 189.A OG LYS 190.A O no hydrogen 3.487 N/A GLY 192.A N ASP 183.A OD2 no hydrogen 2.794 N/A LYS 193.A N ASP 183.A OD1 no hydrogen 2.964 N/A LYS 193.A NZ ASP 183.A OD1 no hydrogen 2.797 N/A LYS 193.A NZ SER 189.A OG no hydrogen 2.965 N/A LYS 193.A NZ LYS 190.A O no hydrogen 3.014 N/A LYS 195.A NZ GLU 204.A OE2 no hydrogen 2.673 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.768 N/A LYS 197.A N PRO 194.A O no hydrogen 3.041 N/A GLY 198.A N LYS 195.A O no hydrogen 2.752 N/A TYR 199.A N LYS 195.A O no hydrogen 3.098 N/A LEU 200.A N ALA 181.A O no hydrogen 2.994 N/A LYS 201.A N GLU 204.A OE1 no hydrogen 2.830 N/A LYS 201.A NZ ASP 183.A OD2 no hydrogen 2.806 N/A LYS 201.A NZ LYS 193.A O no hydrogen 2.910 N/A GLU 204.A N LYS 201.A O no hydrogen 2.966 N/A ILE 205.A N LYS 201.A O no hydrogen 3.394 N/A ALA 206.A N PRO 202.A O no hydrogen 2.946 N/A GLU 207.A N ASP 203.A O no hydrogen 2.922 N/A ALA 208.A N GLU 204.A O no hydrogen 3.051 N/A VAL 209.A N ILE 205.A O no hydrogen 2.967 N/A ARG 210.A N ALA 206.A O no hydrogen 2.832 N/A ARG 210.A NE GLU 207.A OE1 no hydrogen 3.038 N/A ARG 210.A NH1 ASP 25.A OD1 no hydrogen 3.409 N/A ARG 210.A NH1 ASP 25.A OD2 no hydrogen 2.745 N/A ARG 210.A NH2 GLU 207.A OE2 no hydrogen 2.898 N/A CYS 211.A N GLU 207.A O no hydrogen 3.066 N/A CYS 211.A SG.A GLU 207.A O no hydrogen 3.657 N/A CYS 211.A SG.A ALA 208.A O no hydrogen 3.534 N/A LEU 212.A N ALA 208.A O no hydrogen 3.182 N/A LEU 213.A N VAL 209.A O no hydrogen 2.852 N/A LYS 214.A N CYS 211.A O no hydrogen 3.244 N/A LEU 215.A N LEU 212.A O no hydrogen 3.129 N/A LYS 217.A NZ THR 129.A O no hydrogen 2.927 N/A VAL 219.A N PRO 216.A O no hydrogen 2.926 N/A ARG 220.A NE GLU 222.A OE2 no hydrogen 2.854 N/A ARG 220.A NH2 GLU 222.A OE2 no hydrogen 3.090 N/A LEU 224.A N GLU 176.A O no hydrogen 3.072 N/A LEU 226.A N ARG 178.A O no hydrogen 3.217 N/A ARG 227.A NH1 ASP 139.A OD1 no hydrogen 3.037 N/A ARG 227.A NH1 GLU 234.A O no hydrogen 2.897 N/A ARG 227.A NH2 GLU 234.A O no hydrogen 2.987 N/A TYR 230.A N SER 228.A OG no hydrogen 2.874 N/A GLN 231.A N SER 228.A O no hydrogen 2.922 N/A