Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xgr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N SER 27.A OG no hydrogen 2.860 N/A THR 6.A N ARG 25.A O no hydrogen 2.696 N/A GLN 7.A NE2 TYR 87.A O no hydrogen 2.966 N/A SER 8.A N SER 23.A O no hydrogen 3.017 N/A THR 11.A OG1 LYS 104.A O no hydrogen 3.526 N/A LEU 12.A N LYS 104.A O no hydrogen 2.738 N/A SER 13.A OG TYR 141.A OH no hydrogen 3.218 N/A VAL 14.A N GLU 106.A O no hydrogen 2.879 N/A GLY 17.A N VAL 79.A O no hydrogen 2.751 N/A ASP 18.A N THR 15.A O no hydrogen 2.907 N/A VAL 20.A N ILE 76.A O no hydrogen 3.216 N/A LEU 22.A N LEU 74.A O no hydrogen 2.750 N/A SER 23.A N SER 8.A O no hydrogen 3.185 N/A CYS 24.A N PHE 72.A O no hydrogen 3.130 N/A ARG 25.A N THR 6.A O no hydrogen 2.804 N/A ALA 26.A N THR 70.A O no hydrogen 3.085 N/A SER 27.A N VAL 4.A O no hydrogen 2.854 N/A GLN 28.A NE2 MET 1.A O no hydrogen 3.264 N/A ILE 30.A N GLY 69.A O no hydrogen 2.766 N/A ASN 33.A N ILE 30.A O no hydrogen 2.916 N/A HIS 35.A N GLN 90.A O no hydrogen 2.739 N/A HIS 35.A NE2 SER 92.A OG no hydrogen 2.729 N/A TRP 36.A N ILE 49.A O no hydrogen 2.957 N/A TYR 37.A N PHE 88.A O no hydrogen 2.731 N/A GLN 38.A N ARG 46.A O no hydrogen 2.855 N/A GLN 38.A NE2 TYR 87.A OH no hydrogen 2.789 N/A GLN 39.A N MET 86.A O no hydrogen 2.719 N/A GLN 39.A NE2 GLU 43.A O no hydrogen 2.682 N/A LYS 40.A NZ GLU 82.A O no hydrogen 3.381 N/A GLU 43.A N LYS 40.A O no hydrogen 3.086 N/A ARG 46.A N GLN 38.A O no hydrogen 2.720 N/A ARG 46.A NH2 GLN 38.A OE1 no hydrogen 2.748 N/A LEU 48.A N TRP 36.A O no hydrogen 2.823 N/A ILE 49.A N TRP 36.A O no hydrogen 3.496 N/A LYS 50.A N GLN 54.A O no hydrogen 3.125 N/A TYR 51.A N HIS 35.A ND1 no hydrogen 2.945 N/A ALA 52.A N LEU 34.A O no hydrogen 2.716 N/A SER 53.A N TYR 51.A O no hydrogen 2.778 N/A GLN 54.A N LYS 50.A O no hydrogen 2.976 N/A ILE 59.A N ILE 56.A O no hydrogen 3.073 N/A ARG 62.A NE ASP 83.A OD2 no hydrogen 2.644 N/A ARG 62.A NH2 ASP 83.A OD1 no hydrogen 2.756 N/A PHE 63.A N PRO 60.A O no hydrogen 3.276 N/A SER 64.A N SER 75.A O no hydrogen 2.982 N/A SER 66.A N THR 73.A O no hydrogen 2.939 N/A SER 68.A N ASP 71.A O no hydrogen 3.147 N/A GLY 69.A N SER 31.A O no hydrogen 2.912 N/A ASP 71.A N SER 68.A O no hydrogen 3.450 N/A PHE 72.A N CYS 24.A O no hydrogen 3.032 N/A THR 73.A N SER 66.A O no hydrogen 2.988 N/A LEU 74.A N LEU 22.A O no hydrogen 2.841 N/A SER 75.A N SER 64.A O no hydrogen 2.690 N/A ILE 76.A N VAL 20.A O no hydrogen 3.129 N/A ASN 77.A N ARG 62.A O no hydrogen 2.915 N/A SER 78.A N SER 19.A OG no hydrogen 3.114 N/A SER 78.A OG GLU 80.A OE1 no hydrogen 3.320 N/A VAL 79.A N ASP 18.A O no hydrogen 2.450 N/A GLU 80.A N ASP 83.A OD2 no hydrogen 2.764 N/A GLU 82.A N GLU 82.A OE2 no hydrogen 2.460 N/A ASP 83.A N GLU 80.A O no hydrogen 2.905 N/A GLY 85.A N LEU 105.A O no hydrogen 3.005 N/A MET 86.A N GLN 39.A O no hydrogen 2.951 N/A TYR 87.A N THR 103.A O no hydrogen 2.847 N/A TYR 87.A OH ASP 83.A O no hydrogen 2.562 N/A PHE 88.A N TYR 37.A O no hydrogen 2.860 N/A CYS 89.A N GLN 7.A OE1 no hydrogen 3.215 N/A GLN 90.A N HIS 35.A O no hydrogen 2.852 N/A GLN 90.A NE2 GLN 91.A O no hydrogen 3.177 N/A GLN 91.A N THR 98.A O no hydrogen 2.954 N/A GLN 91.A NE2 SER 94.A O no hydrogen 3.108 N/A GLN 91.A NE2 PRO 96.A O no hydrogen 3.084 N/A GLN 91.A NE2 THR 98.A OG1 no hydrogen 3.035 N/A SER 92.A N ASN 33.A O no hydrogen 3.171 N/A SER 92.A OG HIS 35.A NE2 no hydrogen 2.729 N/A ASN 93.A N GLN 91.A OE1 no hydrogen 2.848 N/A ASN 93.A ND2 ASN 33.A OD1 no hydrogen 3.122 N/A SER 94.A N GLN 91.A OE1 no hydrogen 3.023 N/A SER 94.A OG ASN 93.A OD1 no hydrogen 3.098 N/A THR 98.A OG1 ILE 3.A O no hydrogen 2.876 N/A GLY 100.A N CYS 89.A O no hydrogen 2.802 N/A GLY 102.A N GLN 7.A OE1 no hydrogen 2.745 N/A THR 103.A N TYR 87.A O no hydrogen 2.729 N/A THR 103.A OG1 PRO 9.A O no hydrogen 2.687 N/A LYS 104.A N ALA 10.A O no hydrogen 2.767 N/A LEU 105.A N GLY 85.A O no hydrogen 2.648 N/A GLU 106.A N LEU 12.A O no hydrogen 2.767 N/A ILE 107.A N GLN 167.A OE1 no hydrogen 2.877 N/A LYS 108.A N VAL 14.A O no hydrogen 2.826 N/A ARG 109.A NE ALA 110.A O no hydrogen 2.667 N/A ARG 109.A NH1 ASP 171.A O no hydrogen 2.945 N/A ARG 109.A NH2 ALA 110.A O no hydrogen 3.011 N/A ALA 112.A N TYR 141.A O no hydrogen 2.682 N/A THR 115.A N ASN 138.A O no hydrogen 2.997 N/A SER 117.A N PHE 136.A O no hydrogen 2.931 N/A PHE 119.A N VAL 134.A O no hydrogen 2.576 N/A SER 122.A OG GLU 124.A OE1 no hydrogen 3.552 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 2.585 N/A GLN 125.A N SER 122.A OG no hydrogen 3.244 N/A GLN 125.A NE2 SER 132.A OG no hydrogen 2.912 N/A LEU 126.A N SER 122.A O no hydrogen 3.278 N/A THR 127.A N SER 123.A O no hydrogen 3.089 N/A THR 127.A OG1 SER 123.A O no hydrogen 3.164 N/A SER 128.A N GLU 124.A O no hydrogen 3.249 N/A SER 128.A OG GLN 125.A O no hydrogen 2.634 N/A GLY 129.A N LEU 126.A O no hydrogen 2.836 N/A GLY 130.A N GLN 125.A O no hydrogen 2.959 N/A ALA 131.A N LEU 182.A O no hydrogen 2.983 N/A SER 132.A N GLN 125.A OE1 no hydrogen 2.936 N/A SER 132.A OG THR 181.A OG1 no hydrogen 3.080 N/A VAL 133.A N LEU 180.A O no hydrogen 2.706 N/A VAL 134.A N PHE 119.A O no hydrogen 2.923 N/A CYS 135.A N SER 178.A O no hydrogen 2.916 N/A CYS 135.A SG SER 117.A O no hydrogen 3.727 N/A PHE 136.A N SER 117.A O no hydrogen 2.835 N/A LEU 137.A N MET 176.A O no hydrogen 2.855 N/A ASN 138.A N THR 115.A O no hydrogen 2.995 N/A ASN 139.A N SER 175.A OG no hydrogen 2.985 N/A ASN 139.A ND2 ASP 171.A OD2 no hydrogen 2.849 N/A PHE 140.A N TYR 174.A O no hydrogen 2.863 N/A TYR 141.A N ALA 112.A O no hydrogen 2.850 N/A TYR 141.A OH SER 13.A OG no hydrogen 3.218 N/A ASN 146.A N THR 198.A O no hydrogen 2.938 N/A LYS 148.A N GLU 196.A O no hydrogen 2.781 N/A LYS 148.A NZ GLU 155.A OE2 no hydrogen 2.796 N/A TRP 149.A NE1 SER 178.A OG no hydrogen 2.825 N/A LYS 150.A N THR 194.A O no hydrogen 2.997 N/A LYS 150.A NZ GLU 196.A OE1 no hydrogen 3.246 N/A ILE 151.A N SER 154.A O no hydrogen 2.807 N/A ASP 152.A N SER 192.A O no hydrogen 2.917 N/A SER 154.A N ILE 151.A O no hydrogen 2.941 N/A ARG 156.A N TRP 149.A O no hydrogen 2.822 N/A ARG 156.A NE ASN 158.A O no hydrogen 2.789 N/A ARG 156.A NH2 ASN 158.A O no hydrogen 3.497 N/A ARG 156.A NH2 GLU 186.A OE2 no hydrogen 3.417 N/A VAL 160.A N GLN 157.A O no hydrogen 3.433 N/A LEU 161.A N THR 179.A O no hydrogen 2.857 N/A SER 163.A N SER 177.A O no hydrogen 2.930 N/A THR 165.A N SER 175.A O no hydrogen 3.085 N/A THR 165.A OG1 ASP 166.A O no hydrogen 3.527 N/A THR 165.A OG1 SER 175.A O no hydrogen 3.143 N/A GLN 167.A NE2 ILE 107.A O no hydrogen 2.676 N/A GLN 167.A NE2 SER 172.A O no hydrogen 2.977 N/A ASP 168.A N THR 173.A O no hydrogen 2.708 N/A LYS 170.A N ASP 168.A OD2 no hydrogen 2.716 N/A SER 172.A N ASP 168.A O no hydrogen 2.713 N/A THR 173.A N ASP 171.A OD1 no hydrogen 2.958 N/A THR 173.A OG1 ASP 171.A OD1 no hydrogen 2.579 N/A THR 173.A OG1 ASP 171.A OD2 no hydrogen 3.364 N/A TYR 174.A N PHE 140.A O no hydrogen 2.826 N/A TYR 174.A OH GLU 106.A OE1 no hydrogen 2.425 N/A SER 175.A N THR 165.A OG1 no hydrogen 3.192 N/A MET 176.A N LEU 137.A O no hydrogen 2.815 N/A SER 177.A N SER 163.A O no hydrogen 2.861 N/A SER 178.A N CYS 135.A O no hydrogen 2.826 N/A SER 178.A OG ASN 162.A OD1 no hydrogen 2.656 N/A THR 179.A N LEU 161.A O no hydrogen 2.862 N/A LEU 180.A N VAL 133.A O no hydrogen 2.905 N/A THR 181.A N GLY 159.A O no hydrogen 2.830 N/A THR 181.A OG1 SER 132.A OG no hydrogen 3.080 N/A LEU 182.A N ALA 131.A O no hydrogen 2.671 N/A THR 183.A N GLU 186.A OE1 no hydrogen 3.121 N/A THR 183.A OG1 GLU 186.A OE1 no hydrogen 3.460 N/A LYS 184.A N GLY 129.A O no hydrogen 3.189 N/A LYS 184.A NZ LEU 126.A O no hydrogen 3.540 N/A GLU 186.A N THR 183.A OG1 no hydrogen 2.971 N/A TYR 187.A N THR 183.A O no hydrogen 3.016 N/A GLU 188.A N LYS 184.A O no hydrogen 3.011 N/A ARG 189.A N GLU 186.A O no hydrogen 3.068 N/A HIS 190.A N TYR 187.A O no hydrogen 3.258 N/A HIS 190.A ND1 GLU 186.A O no hydrogen 3.011 N/A ASN 191.A N ASP 152.A OD1 no hydrogen 3.005 N/A SER 192.A N ASP 152.A OD1 no hydrogen 3.128 N/A TYR 193.A N PHE 210.A O no hydrogen 3.051 N/A TYR 193.A OH TYR 187.A O no hydrogen 2.533 N/A THR 194.A N LYS 150.A O no hydrogen 2.920 N/A THR 194.A OG1 SER 209.A OG no hydrogen 2.830 N/A CYS 195.A N LYS 208.A O no hydrogen 2.777 N/A GLU 196.A N LYS 148.A O no hydrogen 2.746 N/A ALA 197.A N ILE 206.A O no hydrogen 2.868 N/A THR 198.A N ASN 146.A O no hydrogen 2.757 N/A HIS 199.A ND1 THR 201.A OG1 no hydrogen 2.677 N/A HIS 199.A NE2 PRO 142.A O no hydrogen 2.929 N/A THR 201.A N HIS 199.A ND1 no hydrogen 3.046 N/A THR 201.A OG1 HIS 199.A ND1 no hydrogen 2.677 N/A SER 202.A N HIS 199.A O no hydrogen 3.012 N/A SER 202.A OG SER 204.A O no hydrogen 2.927 N/A ILE 206.A N ALA 197.A O no hydrogen 2.737 N/A LYS 208.A N CYS 195.A O no hydrogen 3.092 N/A SER 209.A OG TYR 193.A O no hydrogen 2.733 N/A SER 209.A OG THR 194.A OG1 no hydrogen 2.830 N/A PHE 210.A N TYR 193.A O no hydrogen 3.148 N/A ARG 212.A N ASN 191.A O no hydrogen 2.946 N/A ARG 212.A NH1 HIS 190.A O no hydrogen 2.964 N/A ASN 213.A N ASN 191.A OD1 no hydrogen 2.886 N/A