Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1gxy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N ARG 128.A O no hydrogen 2.929 N/A LEU 4.A N HIS 130.A O no hydrogen 3.005 N/A ALA 7.A N ASP 5.A OD1 no hydrogen 2.787 N/A ALA 10.A N ALA 7.A O no hydrogen 3.299 N/A PHE 11.A N VAL 87.A O no hydrogen 3.022 N/A GLN 14.A NE2 LYS 214.A O no hydrogen 3.012 N/A GLN 14.A NE2 SER 216.A OG no hydrogen 2.887 N/A TYR 15.A N ASP 13.A OD1 no hydrogen 2.873 N/A TYR 15.A OH HIS 103.A ND1 no hydrogen 2.705 N/A GLU 16.A N ASN 219.A OD1 no hydrogen 2.840 N/A MET 22.A N CYS 18.A O no hydrogen 2.811 N/A GLU 23.A N VAL 19.A O no hydrogen 2.812 N/A GLU 24.A N ASN 20.A O no hydrogen 3.347 N/A LYS 25.A N LYS 21.A O no hydrogen 3.290 N/A LYS 25.A N MET 22.A O no hydrogen 3.184 N/A LYS 25.A NZ TYR 222.A O no hydrogen 2.849 N/A ALA 26.A N MET 22.A O no hydrogen 2.733 N/A LEU 29.A N LYS 25.A O no hydrogen 3.070 N/A LEU 30.A N ALA 26.A O no hydrogen 2.695 N/A GLN 31.A N PRO 27.A O no hydrogen 3.175 N/A GLU 32.A N LEU 28.A O no hydrogen 3.070 N/A ASP 33.A N LEU 29.A O no hydrogen 2.837 N/A PHE 34.A N LEU 30.A O no hydrogen 2.922 N/A ASN 35.A N GLN 31.A O no hydrogen 3.086 N/A MET 36.A N GLU 32.A O no hydrogen 3.120 N/A MET 36.A N ASP 33.A O no hydrogen 3.003 N/A ASN 37.A N PHE 34.A O no hydrogen 3.204 N/A ASN 37.A ND2 HIS 98.A O no hydrogen 3.264 N/A LEU 40.A N ASN 37.A OD1 no hydrogen 3.117 N/A LYS 41.A N ASN 37.A O no hydrogen 3.124 N/A VAL 42.A N ALA 38.A O no hydrogen 3.076 N/A ALA 43.A N LYS 39.A O no hydrogen 2.923 N/A TRP 44.A N LEU 40.A O no hydrogen 2.787 N/A GLU 45.A N LYS 41.A O no hydrogen 3.135 N/A GLU 46.A N VAL 42.A O no hydrogen 3.057 N/A ALA 47.A N ALA 43.A O no hydrogen 3.006 N/A LYS 48.A N TRP 44.A O no hydrogen 2.786 N/A LYS 49.A N GLU 45.A O no hydrogen 3.235 N/A ARG 50.A N GLU 46.A O no hydrogen 3.189 N/A TRP 51.A N ALA 47.A O no hydrogen 2.817 N/A TRP 51.A NE1 ASP 66.A OD1 no hydrogen 2.942 N/A ASN 52.A N LYS 48.A O no hydrogen 2.988 N/A ASN 53.A N LYS 49.A O no hydrogen 3.264 N/A ASN 53.A N ARG 50.A O no hydrogen 3.039 N/A ILE 54.A N ARG 50.A O no hydrogen 3.146 N/A ILE 54.A N TRP 51.A O no hydrogen 3.234 N/A LYS 55.A N TRP 51.A O no hydrogen 2.927 N/A LYS 55.A NZ ASN 52.A OD1 no hydrogen 3.094 N/A LYS 55.A NZ ASP 66.A OD1 no hydrogen 3.041 N/A SER 57.A N ILE 54.A O no hydrogen 3.225 N/A SER 57.A OG ILE 54.A O no hydrogen 2.633 N/A TYR 60.A OH LYS 55.A O no hydrogen 3.205 N/A PHE 64.A N PRO 61.A O no hydrogen 3.049 N/A ASN 65.A N HIS 68.A ND1 no hydrogen 2.886 N/A PHE 67.A N ASN 65.A OD1 no hydrogen 2.845 N/A HIS 68.A N ASN 65.A OD1 no hydrogen 3.378 N/A HIS 68.A NE2 GLU 23.A OE2 no hydrogen 3.171 N/A GLY 69.A N ASN 65.A O no hydrogen 3.118 N/A THR 70.A N ASP 66.A O no hydrogen 2.930 N/A THR 70.A OG1 ASP 66.A O no hydrogen 2.727 N/A ALA 71.A N PHE 67.A O no hydrogen 2.972 N/A LEU 72.A N HIS 68.A O no hydrogen 3.151 N/A VAL 73.A N GLY 69.A O no hydrogen 3.155 N/A ALA 74.A N THR 70.A O no hydrogen 2.914 N/A TYR 75.A N ALA 71.A O no hydrogen 3.005 N/A THR 76.A N LEU 72.A O no hydrogen 3.379 N/A THR 76.A N VAL 73.A O no hydrogen 2.903 N/A THR 76.A OG1 VAL 73.A O no hydrogen 2.550 N/A THR 76.A OG1 SER 179.A OG no hydrogen 3.379 N/A GLY 77.A N ALA 74.A O no hydrogen 2.929 N/A ALA 80.A N GLY 77.A O no hydrogen 3.368 N/A PHE 83.A N ILE 79.A O no hydrogen 2.962 N/A ASN 84.A N ALA 80.A O no hydrogen 2.767 N/A ASN 84.A ND2 TYR 75.A OH no hydrogen 2.866 N/A ARG 85.A N VAL 81.A O no hydrogen 3.058 N/A ARG 85.A NE ASP 82.A OD2 no hydrogen 3.228 N/A ARG 85.A NH1 GLU 89.A OE1 no hydrogen 3.112 N/A ARG 85.A NH2 ASP 82.A OD2 no hydrogen 3.021 N/A ALA 86.A N ASP 82.A O no hydrogen 2.863 N/A VAL 87.A N PHE 83.A O no hydrogen 2.974 N/A ARG 88.A N ASN 84.A O no hydrogen 2.941 N/A ARG 88.A NE GLN 141.A OE1 no hydrogen 3.145 N/A ARG 88.A NH2 GLN 141.A OE1 no hydrogen 2.744 N/A GLU 89.A N ARG 85.A O no hydrogen 2.930 N/A PHE 90.A N VAL 87.A O no hydrogen 3.204 N/A LYS 91.A N ASN 9.A O no hydrogen 2.911 N/A LYS 91.A NZ TYR 218.A OH no hydrogen 3.050 N/A ASN 93.A N GLU 89.A O no hydrogen 3.384 N/A ASN 93.A N PHE 90.A O no hydrogen 3.037 N/A GLN 96.A N ASN 93.A O no hydrogen 3.145 N/A PHE 97.A N PRO 94.A O no hydrogen 3.335 N/A TYR 99.A OH ASP 82.A OD1 no hydrogen 2.414 N/A LYS 100.A N ASP 33.A OD1 no hydrogen 2.929 N/A LYS 100.A NZ PHE 97.A O no hydrogen 3.042 N/A ALA 101.A N ASP 33.A OD2 no hydrogen 2.726 N/A PHE 102.A N ASP 33.A OD2 no hydrogen 3.428 N/A HIS 103.A N TYR 99.A O no hydrogen 2.869 N/A HIS 103.A ND1 TYR 15.A OH no hydrogen 2.705 N/A TYR 104.A OH GLU 23.A OE2 no hydrogen 2.636 N/A TYR 105.A N ALA 101.A O no hydrogen 2.874 N/A LEU 106.A N PHE 102.A O no hydrogen 2.990 N/A THR 107.A N HIS 103.A O no hydrogen 2.971 N/A THR 107.A OG1 HIS 103.A O no hydrogen 2.785 N/A ARG 108.A N TYR 104.A O no hydrogen 2.778 N/A ARG 108.A NH1 GLN 111.A OE1 no hydrogen 3.099 N/A ALA 109.A N TYR 105.A O no hydrogen 2.830 N/A LEU 110.A N LEU 106.A O no hydrogen 3.068 N/A GLN 111.A N THR 107.A O no hydrogen 2.963 N/A GLN 111.A NE2 GLN 14.A O no hydrogen 3.062 N/A GLN 111.A NE2 TYR 192.A OH no hydrogen 3.519 N/A LEU 112.A N ARG 108.A O no hydrogen 2.943 N/A LEU 113.A N ALA 109.A O no hydrogen 3.137 N/A SER 114.A N GLN 111.A O no hydrogen 3.032 N/A SER 114.A OG LEU 110.A O no hydrogen 2.860 N/A SER 114.A OG GLN 111.A O no hydrogen 3.144 N/A HIS 119.A N THR 169.A O no hydrogen 2.727 N/A VAL 121.A N ILE 167.A O no hydrogen 2.859 N/A TYR 122.A N SER 146.A O no hydrogen 2.890 N/A ARG 123.A N PHE 165.A O no hydrogen 3.012 N/A ARG 123.A NH1 SER 144.A O no hydrogen 2.918 N/A THR 125.A N THR 163.A O no hydrogen 2.825 N/A THR 125.A OG1 THR 127.A O no hydrogen 2.643 N/A THR 125.A OG1 THR 163.A O no hydrogen 3.319 N/A LYS 126.A NZ GLN 155.A O no hydrogen 2.582 N/A LYS 126.A NZ PHE 158.A O no hydrogen 2.703 N/A ARG 128.A NE GLY 162.A O no hydrogen 2.740 N/A ARG 128.A NH2 ASP 160.A O no hydrogen 2.946 N/A ARG 128.A NH2 GLY 162.A O no hydrogen 3.320 N/A PHE 129.A N THR 163.A OG1 no hydrogen 2.880 N/A HIS 130.A N LEU 2.A O no hydrogen 2.808 N/A TYR 131.A OH GLY 135.A O no hydrogen 2.772 N/A THR 132.A OG1 ALA 134.A O no hydrogen 3.219 N/A VAL 137.A N TYR 195.A O no hydrogen 3.006 N/A ARG 138.A N ASP 5.A O no hydrogen 2.806 N/A ARG 138.A NE THR 6.A O no hydrogen 2.813 N/A ARG 138.A NH1 ASP 12.A OD2 no hydrogen 2.777 N/A ARG 138.A NH2 THR 6.A O no hydrogen 3.534 N/A ARG 138.A NH2 ALA 7.A O no hydrogen 2.774 N/A ARG 138.A NH2 ASP 12.A OD2 no hydrogen 3.169 N/A GLY 140.A N GLY 191.A O no hydrogen 3.099 N/A GLN 141.A NE2 PHE 142.A O no hydrogen 2.957 N/A THR 143.A N ILE 189.A O no hydrogen 2.989 N/A SER 145.A OG VAL 187.A O no hydrogen 2.798 N/A SER 146.A N TYR 122.A O no hydrogen 2.830 N/A SER 146.A OG SER 148.A O no hydrogen 3.430 N/A SER 146.A OG GLN 184.A O no hydrogen 2.675 N/A SER 146.A OG GLU 185.A O no hydrogen 3.507 N/A LEU 147.A N GLU 185.A O no hydrogen 2.965 N/A SER 148.A N SER 146.A OG no hydrogen 2.935 N/A VAL 151.A N SER 148.A OG no hydrogen 3.127 N/A ALA 152.A N SER 148.A O no hydrogen 3.152 N/A GLN 153.A N LYS 149.A O no hydrogen 3.019 N/A SER 154.A N VAL 151.A O no hydrogen 3.096 N/A SER 154.A OG VAL 151.A O no hydrogen 2.592 N/A PHE 157.A N SER 154.A O no hydrogen 2.987 N/A PHE 158.A N SER 154.A O no hydrogen 2.946 N/A HIS 161.A N SER 159.A OG no hydrogen 3.104 N/A GLY 162.A N SER 159.A O no hydrogen 2.727 N/A THR 163.A N THR 125.A O no hydrogen 3.202 N/A THR 163.A N THR 125.A OG1 no hydrogen 3.331 N/A LEU 164.A N ASN 204.A O no hydrogen 2.824 N/A PHE 165.A N ARG 123.A O no hydrogen 2.747 N/A ILE 166.A N ILE 206.A O no hydrogen 2.908 N/A ILE 167.A N VAL 121.A O no hydrogen 2.881 N/A LYS 168.A N LEU 208.A O no hydrogen 2.964 N/A THR 169.A N HIS 119.A O no hydrogen 2.994 N/A THR 169.A OG1 GLU 193.A OE1 no hydrogen 2.655 N/A THR 169.A OG1 GLU 193.A OE2 no hydrogen 3.184 N/A CYS 170.A N GLU 193.A OE2 no hydrogen 2.835 N/A LEU 171.A N GLU 193.A OE2 no hydrogen 2.875 N/A GLY 172.A N THR 169.A OG1 no hydrogen 2.970 N/A VAL 173.A N LEU 188.A O no hydrogen 2.839 N/A TYR 174.A OH GLU 185.A OE1 no hydrogen 2.533 N/A ILE 175.A N GLU 186.A O no hydrogen 2.854 N/A LYS 176.A NZ GLU 185.A OE2 no hydrogen 3.372 N/A PHE 178.A N ILE 175.A O no hydrogen 2.869 N/A SER 179.A OG GLU 186.A OE1 no hydrogen 2.607 N/A PHE 180.A N THR 76.A OG1 no hydrogen 2.940 N/A ARG 181.A N SER 179.A OG no hydrogen 2.855 N/A ARG 181.A NH1 GLU 156.A OE1 no hydrogen 2.951 N/A ARG 181.A NH1 GLU 156.A OE2 no hydrogen 3.484 N/A ARG 181.A NH2 GLU 156.A OE2 no hydrogen 2.948 N/A GLN 184.A N ARG 181.A O no hydrogen 2.983 N/A GLU 185.A N PRO 182.A O no hydrogen 2.980 N/A VAL 187.A N SER 145.A O no hydrogen 2.899 N/A LEU 188.A N VAL 173.A O no hydrogen 2.831 N/A ILE 189.A N THR 143.A O no hydrogen 2.890 N/A GLU 193.A N PRO 190.A O no hydrogen 3.369 N/A VAL 194.A N LYS 212.A O no hydrogen 2.874 N/A TYR 195.A N VAL 137.A O no hydrogen 2.869 N/A TYR 195.A OH GLU 193.A OE1 no hydrogen 2.674 N/A GLN 196.A N SER 210.A O no hydrogen 3.056 N/A GLN 196.A NE2 SER 210.A O no hydrogen 3.021 N/A LYS 197.A N ASP 209.A O no hydrogen 3.073 N/A ARG 199.A N PHE 207.A O no hydrogen 2.941 N/A ARG 199.A NH1 GLN 201.A OE1 no hydrogen 2.959 N/A ARG 199.A NH2 GLN 201.A OE1 no hydrogen 3.446 N/A GLN 201.A N GLU 205.A O no hydrogen 2.926 N/A GLN 201.A NE2 GLU 205.A OE1 no hydrogen 3.102 N/A ASN 204.A ND2 ASP 160.A O no hydrogen 3.111 N/A GLU 205.A N GLN 201.A O no hydrogen 3.199 N/A ILE 206.A N LEU 164.A O no hydrogen 3.002 N/A PHE 207.A N ARG 199.A O no hydrogen 2.792 N/A LEU 208.A N ILE 166.A O no hydrogen 2.851 N/A ASP 209.A N LYS 197.A O no hydrogen 2.731 N/A SER 210.A N ASP 209.A OD1 no hydrogen 2.693 N/A LYS 212.A N VAL 194.A O no hydrogen 2.896 N/A ARG 213.A NE GLN 14.A OE1 no hydrogen 3.280 N/A ARG 213.A NH2 GLN 14.A OE1 no hydrogen 3.480 N/A LYS 214.A N TYR 192.A O no hydrogen 3.397 N/A SER 216.A OG ASP 12.A O no hydrogen 2.599 N/A ASN 217.A N ASP 12.A OD2 no hydrogen 2.828 N/A TYR 218.A N ASP 12.A OD1 no hydrogen 2.949 N/A ASN 219.A ND2 GLU 16.A O no hydrogen 3.036 N/A CYS 220.A N ASP 13.A OD1 no hydrogen 2.701 N/A CYS 220.A SG GLU 16.A O no hydrogen 3.454 N/A LEU 221.A N ASP 13.A OD2 no hydrogen 2.981 N/A SER 223.A N CYS 220.A O no hydrogen 3.263 N/A SER 223.A OG CYS 220.A O no hydrogen 2.809 N/A