Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n9i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N ASP 1.A OD1 no hydrogen 2.864 N/A GLU 5.A N ASP 1.A O no hydrogen 2.927 N/A TRP 6.A N PRO 2.A O no hydrogen 3.004 N/A PHE 7.A N THR 3.A O no hydrogen 2.908 N/A LEU 8.A N LEU 4.A O no hydrogen 2.733 N/A SER 9.A N GLU 5.A O no hydrogen 2.996 N/A SER 9.A OG GLU 5.A O no hydrogen 3.563 N/A SER 9.A OG TRP 6.A O no hydrogen 2.843 N/A HIS 10.A N PHE 7.A O no hydrogen 2.884 N/A HIS 10.A ND1 TRP 6.A O no hydrogen 2.796 N/A CYS 11.A N LEU 8.A O no hydrogen 2.776 N/A CYS 11.A SG PHE 7.A O no hydrogen 3.548 N/A HIS 12.A N GLU 89.A O no hydrogen 2.991 N/A HIS 14.A N VAL 87.A O no hydrogen 2.766 N/A TYR 16.A N CYS 85.A O no hydrogen 2.697 N/A TYR 16.A OH GLU 89.A OE2 no hydrogen 2.616 N/A SER 18.A OG LYS 82.A O no hydrogen 3.330 N/A LYS 19.A N ALA 81.A O no hydrogen 2.840 N/A LYS 19.A NZ LYS 82.A O no hydrogen 2.555 N/A SER 20.A N PRO 17.A O no hydrogen 3.177 N/A SER 20.A OG PRO 17.A O no hydrogen 2.590 N/A LEU 22.A N VAL 79.A O no hydrogen 2.678 N/A ILE 23.A N VAL 79.A O no hydrogen 3.235 N/A HIS 24.A N GLU 27.A OE2 no hydrogen 3.194 N/A GLN 25.A NE2 SER 76.A O no hydrogen 2.764 N/A GLY 26.A N ARG 75.A O no hydrogen 2.765 N/A GLU 27.A N HIS 24.A O no hydrogen 3.229 N/A ALA 29.A N GLN 73.A O no hydrogen 2.741 N/A LEU 32.A N ILE 90.A O no hydrogen 2.866 N/A TYR 33.A N ILE 63.A O no hydrogen 3.065 N/A TYR 34.A N ALA 88.A O no hydrogen 2.890 N/A ILE 35.A N ASP 61.A O no hydrogen 2.995 N/A VAL 36.A N GLU 86.A O no hydrogen 2.796 N/A LYS 37.A N GLU 86.A O no hydrogen 3.067 N/A GLY 38.A N GLN 59.A OE1 no hydrogen 3.528 N/A SER 39.A N THR 83.A OG1 no hydrogen 3.037 N/A VAL 40.A N LEU 57.A O no hydrogen 2.796 N/A ALA 41.A N ARG 80.A O no hydrogen 2.920 N/A VAL 42.A N SER 55.A O no hydrogen 2.718 N/A LEU 43.A N TRP 78.A O no hydrogen 2.873 N/A ILE 44.A N MET 52.A O no hydrogen 2.965 N/A ASP 46.A N LYS 50.A O no hydrogen 2.850 N/A GLU 48.A N ASP 46.A OD1 no hydrogen 3.022 N/A GLY 49.A N ASP 46.A O no hydrogen 3.049 N/A LYS 50.A N ASP 46.A OD1 no hydrogen 2.818 N/A MET 52.A N ILE 44.A O no hydrogen 2.819 N/A LEU 54.A N VAL 42.A O no hydrogen 2.845 N/A SER 55.A N VAL 42.A O no hydrogen 3.270 N/A SER 55.A OG TYR 56.A O no hydrogen 3.485 N/A LEU 57.A N VAL 40.A O no hydrogen 2.947 N/A ASN 58.A N ASP 61.A OD2 no hydrogen 2.883 N/A GLY 60.A N ILE 35.A O no hydrogen 3.092 N/A ASP 61.A N ASN 58.A O no hydrogen 3.001 N/A PHE 62.A N GLN 112.A OE1 no hydrogen 2.537 N/A ILE 63.A N TYR 33.A O no hydrogen 2.826 N/A GLU 65.A N GLU 65.A OE1 no hydrogen 2.602 N/A GLY 67.A N GLY 64.A O no hydrogen 3.175 N/A LEU 68.A N GLU 65.A O no hydrogen 2.919 N/A PHE 69.A N LEU 66.A O no hydrogen 3.032 N/A GLU 70.A N LEU 66.A O no hydrogen 3.348 N/A ARG 75.A N GLU 27.A O no hydrogen 2.585 N/A ARG 75.A NH1 TYR 92.A OH no hydrogen 2.990 N/A ARG 75.A NH2 THR 31.A O no hydrogen 2.912 N/A TRP 78.A N LEU 43.A O no hydrogen 3.101 N/A VAL 79.A N ILE 23.A O no hydrogen 2.775 N/A ARG 80.A N ALA 41.A O no hydrogen 2.737 N/A ARG 80.A NH1 GLU 51.A OE2 no hydrogen 2.837 N/A ARG 80.A NH2 GLU 51.A OE1 no hydrogen 2.890 N/A ARG 80.A NH2 GLU 51.A OE2 no hydrogen 3.558 N/A ALA 81.A N SER 20.A O no hydrogen 2.865 N/A LYS 82.A N SER 39.A O no hydrogen 2.665 N/A THR 83.A N SER 39.A O no hydrogen 3.407 N/A THR 83.A OG1 ALA 84.A O no hydrogen 2.977 N/A CYS 85.A N TYR 16.A O no hydrogen 2.833 N/A CYS 85.A SG LYS 37.A O no hydrogen 3.854 N/A CYS 85.A SG SER 39.A O no hydrogen 3.307 N/A CYS 85.A SG THR 83.A O no hydrogen 3.424 N/A GLU 86.A N LYS 37.A O no hydrogen 2.860 N/A VAL 87.A N HIS 14.A O no hydrogen 2.819 N/A ALA 88.A N TYR 34.A O no hydrogen 2.802 N/A GLU 89.A N HIS 12.A O no hydrogen 2.724 N/A ILE 90.A N LEU 32.A O no hydrogen 3.064 N/A TYR 92.A N GLU 30.A O no hydrogen 2.746 N/A TYR 92.A OH GLY 64.A O no hydrogen 2.506 N/A LYS 94.A N SER 91.A OG no hydrogen 3.017 N/A PHE 95.A N SER 91.A O no hydrogen 2.909 N/A ARG 96.A N TYR 92.A O no hydrogen 2.920 N/A ARG 96.A NH1 LEU 68.A O no hydrogen 2.890 N/A GLN 97.A N LYS 93.A O no hydrogen 3.130 N/A LEU 98.A N LYS 94.A O no hydrogen 3.046 N/A ILE 99.A N PHE 95.A O no hydrogen 2.880 N/A GLN 100.A N GLN 97.A O no hydrogen 3.028 N/A VAL 101.A N GLN 97.A O no hydrogen 3.352 N/A ASN 102.A N LEU 98.A O no hydrogen 2.856 N/A ASN 102.A N ILE 99.A O no hydrogen 3.220 N/A ILE 105.A N ASN 102.A O no hydrogen 3.188 N/A MET 107.A N PRO 103.A O no hydrogen 3.230 N/A ARG 108.A N ASP 104.A O no hydrogen 3.085 N/A ARG 108.A NE ASP 1.A OD2 no hydrogen 2.531 N/A ARG 108.A NH2 ASP 1.A OD1 no hydrogen 3.031 N/A ARG 108.A NH2 ASP 1.A OD2 no hydrogen 2.912 N/A LEU 109.A N ILE 105.A O no hydrogen 3.119 N/A SER 110.A N LEU 106.A O no hydrogen 2.845 N/A SER 110.A OG LEU 106.A O no hydrogen 3.196 N/A ALA 111.A N MET 107.A O no hydrogen 2.805 N/A GLN 112.A N ARG 108.A O no hydrogen 3.229 N/A GLN 112.A NE2 GLU 65.A OE2 no hydrogen 3.214 N/A GLN 112.A NE2 LEU 109.A O no hydrogen 3.164 N/A MET 113.A N LEU 109.A O no hydrogen 3.231 N/A ALA 114.A N SER 110.A O no hydrogen 2.961 N/A ARG 115.A N ALA 111.A O no hydrogen 3.043 N/A ARG 116.A N GLN 112.A O no hydrogen 3.230 N/A ARG 116.A NH1 GLU 65.A OE2 no hydrogen 2.799 N/A ARG 116.A NH1 GLN 112.A OE1 no hydrogen 2.613 N/A LEU 117.A N MET 113.A O no hydrogen 3.080 N/A GLN 118.A N ALA 114.A O no hydrogen 2.798 N/A VAL 119.A N ARG 115.A O no hydrogen 2.873 N/A THR 120.A N ARG 116.A O no hydrogen 3.144 N/A SER 121.A N LEU 117.A O no hydrogen 3.010 N/A SER 121.A OG LEU 117.A O no hydrogen 3.494 N/A SER 121.A OG GLN 118.A O no hydrogen 3.201 N/A GLU 122.A N VAL 119.A O no hydrogen 3.360 N/A LYS 123.A N THR 120.A O no hydrogen 3.042 N/A VAL 124.A N SER 121.A O no hydrogen 3.253 N/A PHE 129.A N ASN 126.A OD1 no hydrogen 3.049 N/A LEU 130.A N ASN 126.A O no hydrogen 2.959 N/A ASP 131.A N LEU 127.A O no hydrogen 2.855 N/A VAL 132.A N ALA 128.A O no hydrogen 2.876 N/A THR 133.A N PHE 129.A O no hydrogen 2.816 N/A THR 133.A OG1 PHE 129.A O no hydrogen 2.911 N/A GLY 134.A N LEU 130.A O no hydrogen 2.901 N/A ARG 135.A N ASP 131.A O no hydrogen 2.889 N/A ARG 135.A NE ASP 131.A OD1 no hydrogen 2.938 N/A ARG 135.A NH1 VAL 169.A O no hydrogen 2.823 N/A ARG 135.A NH2 ASP 131.A OD2 no hydrogen 2.694 N/A ILE 136.A N VAL 132.A O no hydrogen 2.990 N/A ALA 137.A N THR 133.A O no hydrogen 2.947 N/A GLN 138.A N GLY 134.A O no hydrogen 2.912 N/A THR 139.A N ARG 135.A O no hydrogen 3.049 N/A THR 139.A OG1 ARG 135.A O no hydrogen 2.843 N/A LEU 140.A N ILE 136.A O no hydrogen 2.902 N/A LEU 141.A N ALA 137.A O no hydrogen 3.028 N/A ASN 142.A N GLN 138.A O no hydrogen 2.867 N/A LEU 143.A N THR 139.A O no hydrogen 2.874 N/A ALA 144.A N LEU 140.A O no hydrogen 3.042 N/A LYS 145.A N ASN 142.A O no hydrogen 3.077 N/A LYS 145.A NZ ASN 142.A OD1 no hydrogen 3.389 N/A GLN 146.A N LEU 143.A O no hydrogen 3.073 N/A ALA 149.A N GLN 146.A O no hydrogen 3.032 N/A MET 150.A N GLN 157.A O no hydrogen 2.796 N/A HIS 152.A N GLY 155.A O no hydrogen 3.023 N/A ASP 154.A N HIS 152.A ND1 no hydrogen 2.917 N/A GLY 155.A N HIS 152.A O no hydrogen 3.423 N/A MET 156.A N VAL 198.A O no hydrogen 3.223 N/A GLN 157.A N MET 150.A O no hydrogen 2.939 N/A ILE 158.A N ILE 196.A O no hydrogen 2.849 N/A LYS 159.A NZ THR 195.A OG1 no hydrogen 3.197 N/A ILE 160.A N LYS 194.A O no hydrogen 2.960 N/A THR 161.A N GLU 164.A OE1 no hydrogen 3.248 N/A GLU 164.A N THR 161.A OG1 no hydrogen 2.985 N/A ILE 165.A N THR 161.A O no hydrogen 3.121 N/A GLY 166.A N ARG 162.A O no hydrogen 2.909 N/A GLN 167.A N GLN 163.A O no hydrogen 3.013 N/A ILE 168.A N GLU 164.A O no hydrogen 2.869 N/A VAL 169.A N ILE 165.A O no hydrogen 2.968 N/A GLY 170.A N GLY 166.A O no hydrogen 2.586 N/A CYS 171.A N GLY 166.A O no hydrogen 2.900 N/A CYS 171.A SG SER 172.A O no hydrogen 3.644 N/A SER 172.A OG THR 175.A OG1 no hydrogen 3.404 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 2.721 N/A THR 175.A N SER 172.A OG no hydrogen 2.943 N/A THR 175.A OG1 SER 172.A OG no hydrogen 3.404 N/A VAL 176.A N SER 172.A O no hydrogen 3.187 N/A GLY 177.A N ARG 173.A O no hydrogen 3.017 N/A ARG 178.A N GLU 174.A O no hydrogen 2.966 N/A ILE 179.A N THR 175.A O no hydrogen 3.002 N/A LEU 180.A N VAL 176.A O no hydrogen 2.967 N/A LYS 181.A N GLY 177.A O no hydrogen 3.145 N/A MET 182.A N ARG 178.A O no hydrogen 3.112 N/A LEU 183.A N ILE 179.A O no hydrogen 2.801 N/A GLU 184.A N LEU 180.A O no hydrogen 2.875 N/A ASP 185.A N LYS 181.A O no hydrogen 3.048 N/A GLN 186.A N MET 182.A O no hydrogen 2.957 N/A ASN 187.A N GLU 184.A O no hydrogen 2.721 N/A LEU 188.A N LEU 183.A O no hydrogen 2.963 N/A SER 190.A N VAL 197.A O no hydrogen 3.179 N/A ALA 191.A N GLU 184.A OE2 no hydrogen 3.352 N/A HIS 192.A N THR 195.A O no hydrogen 2.920 N/A THR 195.A N HIS 192.A O no hydrogen 2.888 N/A ILE 196.A N ILE 158.A O no hydrogen 2.987 N/A VAL 197.A N SER 190.A O no hydrogen 2.940 N/A VAL 198.A N MET 156.A O no hydrogen 2.773 N/A TYR 199.A N LEU 188.A O no hydrogen 3.079 N/A GLY 200.A N ASP 154.A O no hydrogen 3.251 N/A THR 201.A OG1 VAL 198.A O no hydrogen 2.781 N/A