Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2r2i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 7.A N ASP 4.A OD2 no hydrogen 2.838 N/A VAL 8.A N ASP 4.A O no hydrogen 3.069 N/A GLU 9.A N SER 5.A O no hydrogen 2.972 N/A GLU 10.A N LYS 6.A O no hydrogen 3.172 N/A LEU 11.A N ALA 7.A O no hydrogen 3.045 N/A SER 12.A N VAL 8.A O no hydrogen 2.952 N/A ALA 13.A N GLU 10.A O no hydrogen 3.168 N/A THR 14.A N LEU 11.A O no hydrogen 2.949 N/A THR 14.A OG1 GLU 10.A O no hydrogen 2.849 N/A THR 14.A OG1 LEU 11.A O no hydrogen 3.417 N/A GLN 18.A N GLU 15.A O no hydrogen 3.080 N/A TYR 20.A N CYS 16.A O no hydrogen 2.870 N/A LYS 21.A N HIS 17.A O no hydrogen 2.815 N/A LYS 22.A N GLN 18.A O no hydrogen 3.209 N/A LYS 22.A NZ GLU 26.A OE2 no hydrogen 2.670 N/A PHE 23.A N TRP 19.A O no hydrogen 3.126 N/A MET 24.A N TYR 20.A O no hydrogen 2.875 N/A THR 25.A N LYS 21.A O no hydrogen 3.004 N/A THR 25.A OG1 LYS 21.A O no hydrogen 2.835 N/A GLU 26.A N LYS 22.A O no hydrogen 2.976 N/A CYS 27.A N PHE 23.A O no hydrogen 2.633 N/A GLY 30.A N CYS 27.A O no hydrogen 2.791 N/A GLN 31.A N SER 29.A OG no hydrogen 3.302 N/A LEU 32.A N ILE 69.A O no hydrogen 3.116 N/A THR 33.A N GLU 36.A OE2 no hydrogen 3.065 N/A GLU 36.A N THR 33.A OG1 no hydrogen 3.258 N/A PHE 37.A N THR 33.A O no hydrogen 2.905 N/A LYS 38.A N LEU 34.A O no hydrogen 3.027 N/A LYS 38.A NZ ASN 51.A OD1 no hydrogen 3.067 N/A GLN 39.A N TYR 35.A O no hydrogen 3.102 N/A PHE 40.A N GLU 36.A O no hydrogen 2.807 N/A PHE 41.A N PHE 37.A O no hydrogen 3.034 N/A GLY 42.A N GLN 39.A O no hydrogen 3.293 N/A LEU 43.A N LYS 38.A O no hydrogen 2.653 N/A LYS 44.A NZ TYR 35.A OH no hydrogen 2.767 N/A SER 47.A OG ASP 183.A O no hydrogen 3.115 N/A ALA 50.A N SER 47.A OG no hydrogen 3.246 N/A ASN 51.A N SER 47.A O no hydrogen 2.750 N/A LYS 52.A N PRO 48.A O no hydrogen 2.933 N/A TYR 53.A N SER 49.A O no hydrogen 2.985 N/A VAL 54.A N ALA 50.A O no hydrogen 2.910 N/A GLU 55.A N ASN 51.A O no hydrogen 3.017 N/A GLN 56.A N LYS 52.A O no hydrogen 3.096 N/A MET 57.A N TYR 53.A O no hydrogen 2.943 N/A PHE 58.A N VAL 54.A O no hydrogen 2.962 N/A GLU 59.A N GLU 55.A O no hydrogen 2.945 N/A THR 60.A N GLN 56.A O no hydrogen 2.911 N/A THR 60.A OG1 GLN 56.A O no hydrogen 2.693 N/A PHE 61.A N MET 57.A O no hydrogen 3.039 N/A ASP 62.A N PHE 58.A O no hydrogen 2.885 N/A ASP 62.A N GLU 59.A O no hydrogen 3.158 N/A ASN 64.A N GLU 73.A OE2 no hydrogen 3.143 N/A ASN 64.A ND2 ASP 66.A OD1 no hydrogen 3.457 N/A LYS 65.A N ASP 62.A O no hydrogen 2.949 N/A LYS 65.A NZ GLU 59.A O no hydrogen 2.937 N/A LYS 65.A NZ ASP 62.A O no hydrogen 3.164 N/A ASP 66.A N ASP 62.A OD2 no hydrogen 3.261 N/A ASP 66.A N ASN 64.A OD1 no hydrogen 3.172 N/A GLY 67.A N ASP 62.A OD1 no hydrogen 2.753 N/A TYR 68.A N ASP 66.A OD2 no hydrogen 3.030 N/A ILE 69.A N LEU 32.A O no hydrogen 2.983 N/A ASP 70.A N GLU 73.A OE1 no hydrogen 2.887 N/A MET 72.A N ASP 70.A OD2 no hydrogen 3.142 N/A GLU 73.A N ASP 70.A OD2 no hydrogen 3.039 N/A TYR 74.A N ASP 70.A O no hydrogen 2.797 N/A TYR 74.A OH TRP 19.A O no hydrogen 2.854 N/A VAL 75.A N PHE 71.A O no hydrogen 3.374 N/A ALA 76.A N MET 72.A O no hydrogen 3.130 N/A ALA 77.A N GLU 73.A O no hydrogen 2.860 N/A LEU 78.A N TYR 74.A O no hydrogen 2.981 N/A SER 79.A N VAL 75.A O no hydrogen 2.992 N/A SER 79.A N ALA 76.A O no hydrogen 3.182 N/A SER 79.A OG VAL 75.A O no hydrogen 2.843 N/A LEU 80.A N ALA 77.A O no hydrogen 3.031 N/A VAL 81.A N ALA 77.A O no hydrogen 3.071 N/A LEU 82.A N LEU 78.A O no hydrogen 2.902 N/A LYS 83.A N SER 12.A O no hydrogen 3.038 N/A LYS 83.A NZ GLU 9.A OE2 no hydrogen 3.421 N/A LYS 89.A N LYS 85.A O no hydrogen 2.867 N/A LYS 89.A NZ SER 79.A O no hydrogen 3.495 N/A LYS 89.A NZ LEU 82.A O no hydrogen 3.059 N/A LEU 90.A N VAL 86.A O no hydrogen 3.280 N/A TYR 93.A N LYS 89.A O no hydrogen 2.864 N/A PHE 94.A N LEU 90.A O no hydrogen 3.079 N/A LYS 95.A N ARG 91.A O no hydrogen 3.050 N/A LEU 96.A N TRP 92.A O no hydrogen 3.142 N/A TYR 97.A N TYR 93.A O no hydrogen 2.960 N/A TYR 97.A OH LEU 167.A O no hydrogen 2.601 N/A ASP 98.A N PHE 94.A O no hydrogen 2.913 N/A VAL 99.A N TYR 97.A O no hydrogen 2.815 N/A ASP 100.A N GLU 109.A OE2 no hydrogen 2.981 N/A GLY 101.A N ASP 98.A O no hydrogen 3.088 N/A ASN 102.A N ASP 98.A OD1 no hydrogen 3.309 N/A ASN 102.A N ASP 100.A OD1 no hydrogen 3.142 N/A GLY 103.A N ASP 98.A OD2 no hydrogen 2.707 N/A CYS 104.A N ASN 102.A OD1 no hydrogen 2.989 N/A CYS 104.A SG ASN 102.A O no hydrogen 3.946 N/A CYS 104.A SG GLU 147.A OE2 no hydrogen 3.795 N/A ILE 105.A N LEU 148.A O no hydrogen 2.971 N/A ASP 106.A N GLU 109.A OE1 no hydrogen 3.016 N/A ARG 107.A NE ASN 134.A OD1 no hydrogen 3.263 N/A ARG 107.A NH2 ASN 134.A OD1 no hydrogen 3.416 N/A GLU 109.A N ASP 106.A OD1 no hydrogen 2.698 N/A LEU 110.A N ASP 106.A O no hydrogen 3.010 N/A LEU 111.A N ARG 107.A O no hydrogen 3.036 N/A ASN 112.A N GLY 108.A O no hydrogen 3.062 N/A ILE 113.A N GLU 109.A O no hydrogen 3.128 N/A ILE 114.A N LEU 110.A O no hydrogen 2.955 N/A LYS 115.A N LEU 111.A O no hydrogen 3.062 N/A LYS 115.A NZ GLU 130.A OE2 no hydrogen 2.773 N/A ALA 116.A N ASN 112.A O no hydrogen 2.945 N/A ILE 117.A N ILE 113.A O no hydrogen 2.952 N/A ARG 118.A N LYS 115.A O no hydrogen 3.112 N/A ARG 118.A NH1 SER 49.A OG no hydrogen 3.030 N/A ARG 118.A NH2 SER 49.A O no hydrogen 2.959 N/A ALA 119.A N ILE 114.A O no hydrogen 3.155 N/A ASN 121.A N ARG 118.A O no hydrogen 3.135 N/A ARG 122.A N ALA 119.A O no hydrogen 3.239 N/A ARG 122.A NH1 ASP 165.A O no hydrogen 3.253 N/A ARG 122.A NH2 ASP 165.A OD1 no hydrogen 2.751 N/A CYS 123.A N ILE 120.A O no hydrogen 3.275 N/A THR 128.A N GLU 131.A OE1 no hydrogen 3.444 N/A THR 128.A OG1 GLU 131.A OE2 no hydrogen 3.238 N/A GLU 130.A N GLU 130.A OE1 no hydrogen 2.581 N/A PHE 132.A N THR 128.A O no hydrogen 2.798 N/A THR 133.A N ALA 129.A O no hydrogen 3.010 N/A THR 133.A OG1 ALA 129.A O no hydrogen 2.819 N/A ASN 134.A N GLU 130.A O no hydrogen 2.988 N/A MET 135.A N GLU 131.A O no hydrogen 2.956 N/A VAL 136.A N PHE 132.A O no hydrogen 2.966 N/A PHE 137.A N THR 133.A O no hydrogen 3.272 N/A ASP 138.A N ASN 134.A O no hydrogen 2.921 N/A LYS 139.A N MET 135.A O no hydrogen 2.862 N/A LYS 139.A N VAL 136.A O no hydrogen 3.195 N/A ILE 140.A N VAL 136.A O no hydrogen 2.677 N/A ASP 141.A N PHE 137.A O no hydrogen 3.033 N/A GLY 144.A N ASP 141.A O no hydrogen 2.835 N/A GLY 146.A N ASP 141.A OD2 no hydrogen 2.978 N/A GLU 147.A N ASP 145.A OD1 no hydrogen 3.067 N/A LEU 148.A N ILE 105.A O no hydrogen 2.762 N/A SER 149.A N GLU 152.A OE1 no hydrogen 2.941 N/A GLU 152.A N SER 149.A OG no hydrogen 3.013 N/A PHE 153.A N SER 149.A O no hydrogen 2.965 N/A MET 154.A N LEU 150.A O no hydrogen 2.914 N/A GLU 155.A N GLU 151.A O no hydrogen 2.916 N/A GLY 156.A N GLU 152.A O no hydrogen 2.788 N/A VAL 157.A N PHE 153.A O no hydrogen 2.876 N/A GLN 158.A N MET 154.A O no hydrogen 3.181 N/A LYS 159.A N GLY 156.A O no hydrogen 3.213 N/A VAL 162.A N ASP 160.A OD1 no hydrogen 2.968 N/A LEU 163.A N ASP 160.A OD1 no hydrogen 3.180 N/A LEU 164.A N ASP 160.A O no hydrogen 3.017 N/A ASP 165.A N GLU 161.A O no hydrogen 3.178 N/A ILE 166.A N VAL 162.A O no hydrogen 3.056 N/A LEU 167.A N LEU 163.A O no hydrogen 2.820 N/A THR 168.A N LEU 164.A O no hydrogen 2.909 N/A THR 168.A OG1 LEU 164.A O no hydrogen 2.508 N/A ARG 169.A NH1 ASP 165.A OD1 no hydrogen 3.115 N/A LEU 171.A N TYR 93.A OH no hydrogen 2.977 N/A ASP 172.A N ARG 169.A O no hydrogen 3.085 N/A LEU 173.A N VAL 81.A O no hydrogen 2.896 N/A HIS 175.A ND1 ARG 169.A O no hydrogen 2.513 N/A ILE 176.A N ASP 172.A O no hydrogen 2.994 N/A VAL 177.A N LEU 173.A O no hydrogen 3.124 N/A LYS 178.A N THR 174.A O no hydrogen 3.042 N/A LYS 178.A NZ GLN 181.A O no hydrogen 3.547 N/A LEU 179.A N HIS 175.A O no hydrogen 2.952 N/A ILE 180.A N ILE 176.A O no hydrogen 2.793 N/A GLN 181.A N VAL 177.A O no hydrogen 3.121 N/A ASN 182.A N ILE 180.A O no hydrogen 2.582 N/A ASP 183.A N ILE 180.A O no hydrogen 3.090 N/A