Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6g9r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N LEU 103.A O no hydrogen 3.071 N/A HIS 3.A ND1 ASP 29.A OD2 no hydrogen 2.856 N/A SER 4.A N ASP 29.A OD1 no hydrogen 3.062 N/A MET 5.A N CYS 101.A O no hydrogen 2.921 N/A ARG 6.A N TYR 27.A O no hydrogen 2.877 N/A ARG 6.A NH1 MET 5.A O no hydrogen 2.744 N/A ARG 6.A NH1 CYS 101.A O no hydrogen 3.048 N/A ARG 6.A NH1 ASP 102.A OD1 no hydrogen 2.924 N/A ARG 6.A NH2 ASP 102.A OD1 no hydrogen 2.683 N/A ARG 6.A NH2 ASP 102.A OD2 no hydrogen 3.562 N/A TYR 7.A N SER 99.A O no hydrogen 2.682 N/A PHE 8.A N VAL 25.A O no hydrogen 2.915 N/A GLU 9.A N GLN 97.A O no hydrogen 2.855 N/A THR 10.A N ILE 23.A O no hydrogen 2.820 N/A ALA 11.A N LEU 95.A O no hydrogen 2.837 N/A VAL 12.A N ARG 21.A O no hydrogen 2.987 N/A SER 13.A N HIS 93.A O no hydrogen 2.902 N/A SER 13.A OG HIS 93.A O no hydrogen 3.505 N/A ARG 21.A N VAL 12.A O no hydrogen 2.972 N/A ARG 21.A NE ASP 37.A OD1 no hydrogen 3.168 N/A ARG 21.A NH2 ASP 37.A OD2 no hydrogen 2.902 N/A TYR 22.A N SER 38.A OG no hydrogen 3.057 N/A TYR 22.A OH GLU 9.A OE1 no hydrogen 2.601 N/A ILE 23.A N THR 10.A O no hydrogen 2.915 N/A SER 24.A N PHE 36.A O no hydrogen 3.081 N/A SER 24.A OG TYR 45.A OH no hydrogen 2.628 N/A VAL 25.A N PHE 8.A O no hydrogen 3.156 N/A GLY 26.A N VAL 34.A O no hydrogen 3.155 N/A TYR 27.A N ARG 6.A O no hydrogen 2.778 N/A VAL 28.A N LYS 31.A O no hydrogen 3.021 N/A ASP 29.A N SER 4.A O no hydrogen 2.964 N/A LYS 31.A N VAL 28.A O no hydrogen 2.799 N/A PHE 33.A N GLY 26.A O no hydrogen 2.941 N/A ARG 35.A N GLU 46.A O no hydrogen 3.194 N/A ARG 35.A NH1 GLU 32.A OE2 no hydrogen 3.092 N/A PHE 36.A N SER 24.A O no hydrogen 2.881 N/A SER 38.A N TYR 22.A O no hydrogen 3.032 N/A SER 38.A OG TYR 22.A O no hydrogen 3.538 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 3.106 N/A ALA 40.A N ASP 37.A O no hydrogen 3.134 N/A TYR 45.A N THR 64.A OG1 no hydrogen 3.124 N/A TYR 45.A OH SER 24.A OG no hydrogen 2.628 N/A GLU 46.A N ARG 35.A O no hydrogen 2.897 N/A ARG 48.A N PHE 33.A O no hydrogen 3.227 N/A MET 52.A N ALA 49.A O no hydrogen 3.148 N/A GLU 53.A N PRO 50.A O no hydrogen 2.931 N/A TYR 59.A N GLY 56.A O no hydrogen 2.839 N/A TYR 59.A OH TYR 171.A OH no hydrogen 2.678 N/A TRP 60.A NE1 GLU 55.A O no hydrogen 3.096 N/A GLU 61.A N PRO 57.A O no hydrogen 2.903 N/A ARG 62.A N GLU 58.A O no hydrogen 3.027 N/A GLU 63.A N TYR 59.A O no hydrogen 3.013 N/A THR 64.A N TRP 60.A O no hydrogen 3.004 N/A THR 64.A OG1 TRP 60.A O no hydrogen 2.691 N/A GLN 65.A N GLU 61.A O no hydrogen 2.851 N/A LYS 66.A N ARG 62.A O no hydrogen 2.954 N/A LYS 66.A NZ GLU 63.A OE2 no hydrogen 3.114 N/A ALA 67.A N GLU 63.A O no hydrogen 2.917 N/A LYS 68.A N THR 64.A O no hydrogen 3.152 N/A GLY 69.A N GLN 65.A O no hydrogen 3.077 N/A GLN 70.A N LYS 66.A O no hydrogen 2.713 N/A GLN 70.A NE2 GLU 9.A OE1 no hydrogen 2.820 N/A GLU 71.A N ALA 67.A O no hydrogen 2.703 N/A GLN 72.A N LYS 68.A O no hydrogen 3.182 N/A TRP 73.A N GLY 69.A O no hydrogen 2.893 N/A PHE 74.A N GLN 70.A O no hydrogen 2.846 N/A ARG 75.A N GLU 71.A O no hydrogen 3.030 N/A ARG 75.A NE GLN 72.A OE1 no hydrogen 2.503 N/A ARG 75.A NH2 GLN 72.A OE1 no hydrogen 3.290 N/A VAL 76.A N GLN 72.A O no hydrogen 3.037 N/A SER 77.A N TRP 73.A O no hydrogen 2.988 N/A SER 77.A OG TRP 73.A O no hydrogen 2.956 N/A LEU 78.A N PHE 74.A O no hydrogen 2.827 N/A ARG 79.A N ARG 75.A O no hydrogen 3.087 N/A ASN 80.A N VAL 76.A O no hydrogen 3.015 N/A LEU 81.A N SER 77.A O no hydrogen 2.853 N/A LEU 82.A N LEU 78.A O no hydrogen 3.220 N/A TYR 84.A N ASN 80.A O no hydrogen 2.832 N/A TYR 85.A N LEU 81.A O no hydrogen 2.820 N/A TYR 85.A OH ASP 137.A OD2 no hydrogen 2.676 N/A ASN 86.A N GLY 83.A O no hydrogen 3.129 N/A GLN 87.A N LEU 82.A O no hydrogen 2.915 N/A GLN 87.A NE2 GLU 119.A OE2 no hydrogen 2.784 N/A HIS 93.A N SER 13.A O no hydrogen 2.844 N/A HIS 93.A ND1 GLU 119.A OE2 no hydrogen 2.692 N/A THR 94.A N GLU 119.A OE1 no hydrogen 3.125 N/A LEU 95.A N ALA 11.A O no hydrogen 2.955 N/A GLN 96.A N ALA 117.A O no hydrogen 2.836 N/A GLN 97.A N GLU 9.A O no hydrogen 2.862 N/A MET 98.A N GLN 115.A O no hydrogen 2.926 N/A SER 99.A N TYR 7.A O no hydrogen 3.035 N/A SER 99.A OG GLN 97.A OE1 no hydrogen 3.067 N/A GLY 100.A N TYR 113.A O no hydrogen 2.977 N/A CYS 101.A N MET 5.A O no hydrogen 3.017 N/A ASP 102.A N ARG 111.A O no hydrogen 2.982 N/A LEU 103.A N HIS 3.A O no hydrogen 2.690 N/A GLY 104.A N ARG 108.A O no hydrogen 2.955 N/A TRP 107.A N GLY 104.A O no hydrogen 2.875 N/A ARG 108.A N ASP 106.A OD1 no hydrogen 2.970 N/A LEU 110.A N ASP 102.A O no hydrogen 2.739 N/A ARG 111.A N ASP 102.A O no hydrogen 3.481 N/A ARG 111.A NH1 TYR 113.A OH no hydrogen 3.181 N/A TYR 113.A N GLY 100.A O no hydrogen 2.801 N/A TYR 113.A OH ASP 102.A OD2 no hydrogen 3.216 N/A GLN 115.A N MET 98.A O no hydrogen 2.890 N/A PHE 116.A N ILE 124.A O no hydrogen 2.752 N/A ALA 117.A N GLN 96.A O no hydrogen 2.932 N/A TYR 118.A N ARG 121.A O no hydrogen 2.783 N/A TYR 118.A OH GLN 87.A OE1 no hydrogen 2.471 N/A GLU 119.A N THR 94.A O no hydrogen 2.921 N/A ARG 121.A N TYR 118.A O no hydrogen 2.825 N/A TYR 123.A N PHE 116.A O no hydrogen 3.020 N/A TYR 123.A OH THR 143.A OG1 no hydrogen 2.753 N/A ALA 125.A N THR 134.A O no hydrogen 2.847 N/A LEU 126.A N LEU 114.A O no hydrogen 2.791 N/A ASN 127.A N THR 132.A O no hydrogen 2.983 N/A ASN 127.A ND2 THR 132.A OG1 no hydrogen 2.815 N/A LEU 130.A N ASN 127.A O no hydrogen 2.819 N/A LYS 131.A N ASP 129.A OD1 no hydrogen 2.831 N/A THR 132.A N ASP 129.A OD1 no hydrogen 3.069 N/A THR 132.A OG1 ASP 129.A OD1 no hydrogen 3.067 N/A THR 132.A OG1 ASP 129.A OD2 no hydrogen 2.572 N/A THR 134.A N ALA 125.A O no hydrogen 2.870 N/A THR 134.A OG1 ASN 127.A OD1 no hydrogen 2.575 N/A ALA 140.A N ASP 137.A O no hydrogen 3.041 N/A GLN 141.A N MET 138.A O no hydrogen 3.023 N/A GLN 141.A NE2 ALA 135.A O no hydrogen 2.663 N/A GLN 141.A NE2 ASP 137.A O no hydrogen 2.756 N/A THR 143.A OG1 TYR 123.A OH no hydrogen 2.753 N/A ARG 144.A N ALA 140.A O no hydrogen 3.065 N/A ARG 144.A NE TRP 133.A O no hydrogen 3.638 N/A ARG 145.A N GLN 141.A O no hydrogen 2.979 N/A LYS 146.A N ILE 142.A O no hydrogen 3.002 N/A LYS 146.A NZ TYR 84.A OH no hydrogen 3.274 N/A TRP 147.A N THR 143.A O no hydrogen 2.942 N/A GLU 148.A N ARG 144.A O no hydrogen 2.848 N/A GLN 149.A N ARG 145.A O no hydrogen 2.842 N/A SER 150.A OG LYS 146.A O no hydrogen 3.061 N/A ALA 152.A N TRP 147.A O no hydrogen 3.334 N/A GLU 154.A N GLY 151.A O no hydrogen 3.082 N/A GLU 154.A N GLU 154.A OE2 no hydrogen 2.904 N/A HIS 155.A N GLY 151.A O no hydrogen 3.494 N/A TYR 156.A N ALA 152.A O no hydrogen 3.123 N/A LYS 157.A N ALA 153.A O no hydrogen 2.752 N/A LYS 157.A NZ GLU 161.A OE1 no hydrogen 3.066 N/A ALA 158.A N GLU 154.A O no hydrogen 2.835 N/A TYR 159.A N HIS 155.A O no hydrogen 3.199 N/A LEU 160.A N TYR 156.A O no hydrogen 2.915 N/A GLU 161.A N LYS 157.A O no hydrogen 2.965 N/A GLU 161.A N ALA 158.A O no hydrogen 3.214 N/A GLY 162.A N ALA 158.A O no hydrogen 2.756 N/A CYS 164.A N TYR 159.A O no hydrogen 2.844 N/A GLU 166.A N GLY 162.A O no hydrogen 2.869 N/A TRP 167.A N GLU 163.A O no hydrogen 2.930 N/A LEU 168.A N CYS 164.A O no hydrogen 3.230 N/A HIS 169.A N VAL 165.A O no hydrogen 2.958 N/A HIS 169.A NE2 TRP 107.A O no hydrogen 2.824 N/A ARG 170.A N GLU 166.A O no hydrogen 3.194 N/A TYR 171.A N TRP 167.A O no hydrogen 2.848 N/A TYR 171.A OH TYR 59.A OH no hydrogen 2.678 N/A LEU 172.A N LEU 168.A O no hydrogen 2.852 N/A LYS 173.A N HIS 169.A O no hydrogen 3.117 N/A ASN 174.A N ARG 170.A O no hydrogen 3.189 N/A ASN 176.A N LYS 173.A O no hydrogen 2.914 N/A ASN 176.A ND2 LEU 172.A O no hydrogen 3.652 N/A ARG 181.A NH1 ARG 181.A O no hydrogen 2.602 N/A LYS 186.A N LEU 206.A O no hydrogen 3.010 N/A HIS 188.A N TRP 204.A O no hydrogen 3.458 N/A THR 190.A N ARG 202.A O no hydrogen 2.960 N/A THR 190.A OG1 ARG 202.A O no hydrogen 3.371 N/A HIS 192.A N THR 200.A O no hydrogen 3.038 N/A ARG 194.A N GLU 198.A O no hydrogen 3.226 N/A ARG 194.A NE SER 195.A OG no hydrogen 3.167 N/A ARG 194.A NH2 SER 195.A OG no hydrogen 3.062 N/A SER 195.A OG GLU 198.A OE1 no hydrogen 3.153 N/A GLU 198.A N SER 195.A O no hydrogen 3.399 N/A VAL 199.A N VAL 249.A O no hydrogen 2.747 N/A THR 200.A N HIS 192.A O no hydrogen 2.855 N/A LEU 201.A N VAL 247.A O no hydrogen 3.132 N/A ARG 202.A N THR 190.A O no hydrogen 2.989 N/A CYS 203.A N ALA 245.A O no hydrogen 2.692 N/A CYS 203.A SG TRP 204.A O no hydrogen 3.808 N/A TRP 204.A N HIS 188.A O no hydrogen 2.784 N/A ALA 205.A N LYS 243.A O no hydrogen 2.924 N/A LEU 206.A N LYS 186.A O no hydrogen 2.910 N/A PHE 208.A N PHE 241.A O no hydrogen 3.372 N/A TYR 209.A N ASP 183.A O no hydrogen 2.991 N/A TYR 209.A OH ASP 29.A O no hydrogen 3.346 N/A THR 214.A N TYR 262.A O no hydrogen 3.127 N/A THR 216.A N ARG 260.A O no hydrogen 3.014 N/A TRP 217.A NE1 ALA 245.A O no hydrogen 3.043 N/A GLN 218.A N THR 258.A O no hydrogen 2.771 N/A LEU 219.A N GLU 222.A O no hydrogen 2.836 N/A GLU 222.A N LEU 219.A O no hydrogen 3.233 N/A GLU 229.A N SER 246.A O no hydrogen 2.775 N/A ARG 234.A N GLN 242.A O no hydrogen 3.016 N/A ARG 234.A NH1 GLN 242.A OE1 no hydrogen 2.775 N/A ALA 236.A N THR 240.A O no hydrogen 2.938 N/A THR 240.A N ASP 238.A OD1 no hydrogen 2.835 N/A THR 240.A OG1 ASP 238.A OD1 no hydrogen 2.773 N/A PHE 241.A N PHE 208.A O no hydrogen 2.814 N/A GLN 242.A N ARG 234.A O no hydrogen 2.776 N/A LYS 243.A N ALA 205.A O no hydrogen 3.141 N/A LYS 243.A NZ VAL 231.A O no hydrogen 2.830 N/A ALA 245.A N CYS 203.A O no hydrogen 2.980 N/A SER 246.A N GLU 229.A O no hydrogen 2.641 N/A VAL 247.A N LEU 201.A O no hydrogen 3.000 N/A VAL 249.A N VAL 199.A O no hydrogen 2.832 N/A LEU 251.A N GLY 197.A O no hydrogen 2.924 N/A GLY 252.A N GLU 254.A OE1 no hydrogen 3.310 N/A GLU 254.A N GLY 252.A O no hydrogen 2.933 N/A GLN 255.A NE2 TRP 274.A O no hydrogen 3.083 N/A THR 258.A N GLN 218.A O no hydrogen 3.039 N/A CYS 259.A N LEU 272.A O no hydrogen 2.785 N/A CYS 259.A SG ARG 260.A O no hydrogen 3.911 N/A ARG 260.A N THR 216.A O no hydrogen 2.714 N/A ARG 260.A NE GLN 218.A OE1 no hydrogen 3.140 N/A ARG 260.A NH2 GLN 218.A OE1 no hydrogen 3.481 N/A VAL 261.A N LEU 270.A O no hydrogen 2.951 N/A TYR 262.A N THR 214.A O no hydrogen 3.041 N/A HIS 263.A NE2 PRO 210.A O no hydrogen 2.757 N/A GLY 265.A N HIS 263.A ND1 no hydrogen 3.301 N/A LEU 266.A N HIS 263.A O no hydrogen 3.236 N/A LEU 270.A N VAL 261.A O no hydrogen 3.011 N/A LEU 272.A N CYS 259.A O no hydrogen 2.852 N/A