Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2i81_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH TYR 113.A O no hydrogen 2.817 N/A VAL 4.A N THR 2.A OG1 no hydrogen 3.240 N/A GLY 5.A N VAL 135.A O no hydrogen 2.733 N/A LYS 6.A N TYR 3.A O no hydrogen 2.898 N/A ALA 8.A N GLY 133.A O no hydrogen 2.934 N/A ALA 13.A N VAL 25.A O no hydrogen 2.898 N/A ALA 15.A N GLY 23.A O no hydrogen 3.103 N/A VAL 16.A N LEU 101.A O no hydrogen 3.022 N/A PHE 17.A N SER 21.A O no hydrogen 2.996 N/A ASN 20.A N PHE 17.A O no hydrogen 2.899 N/A SER 21.A N ASP 19.A OD1 no hydrogen 3.386 N/A SER 21.A OG ASP 19.A OD1 no hydrogen 2.719 N/A SER 21.A OG ASP 19.A OD2 no hydrogen 3.355 N/A GLY 23.A N ALA 15.A O no hydrogen 2.885 N/A VAL 25.A N ALA 13.A O no hydrogen 2.863 N/A LEU 27.A N PHE 11.A O no hydrogen 3.130 N/A GLN 29.A N ASN 26.A O no hydrogen 3.265 N/A GLN 29.A NE2 ASN 26.A OD1 no hydrogen 2.909 N/A PHE 30.A N LEU 27.A O no hydrogen 3.042 N/A ILE 31.A N THR 28.A O no hydrogen 3.099 N/A GLY 32.A N MET 131.A O no hydrogen 2.714 N/A LYS 33.A N PHE 30.A O no hydrogen 2.841 N/A LYS 34.A N PHE 30.A O no hydrogen 3.087 N/A TYR 35.A N ASN 67.A O no hydrogen 3.103 N/A TYR 35.A OH GLU 163.A OE1 no hydrogen 2.583 N/A VAL 36.A N ILE 129.A O no hydrogen 2.839 N/A LEU 37.A N GLU 69.A O no hydrogen 2.817 N/A LEU 38.A N VAL 127.A O no hydrogen 2.917 N/A TYR 39.A N LEU 71.A O no hydrogen 2.832 N/A TYR 39.A OH HIS 99.A NE2 no hydrogen 2.752 N/A PHE 40.A N ALA 125.A O no hydrogen 2.901 N/A TYR 41.A N CYS 73.A O no hydrogen 3.018 N/A TYR 41.A OH ASP 44.A OD1 no hydrogen 3.099 N/A ASP 44.A N ASP 76.A OD2 no hydrogen 2.702 N/A THR 46.A OG1 LEU 43.A O no hydrogen 2.644 N/A CYS 49.A SG LEU 43.A O no hydrogen 3.428 N/A CYS 49.A SG THR 46.A OG1 no hydrogen 3.099 N/A SER 51.A OG VAL 48.A O no hydrogen 2.559 N/A GLU 52.A N VAL 48.A O no hydrogen 3.138 N/A ILE 53.A N CYS 49.A O no hydrogen 2.954 N/A ILE 54.A N PRO 50.A O no hydrogen 2.910 N/A ALA 55.A N SER 51.A O no hydrogen 3.104 N/A LEU 56.A N GLU 52.A O no hydrogen 2.903 N/A ASP 57.A N ILE 53.A O no hydrogen 3.059 N/A LYS 58.A N ILE 54.A O no hydrogen 3.006 N/A ALA 59.A N LEU 56.A O no hydrogen 3.275 N/A LEU 60.A N ASP 57.A O no hydrogen 3.191 N/A PHE 63.A N ALA 59.A O no hydrogen 3.325 N/A HIS 64.A N LEU 60.A O no hydrogen 2.953 N/A GLU 65.A N ASP 61.A O no hydrogen 3.048 N/A ARG 66.A N PHE 63.A O no hydrogen 3.226 N/A ARG 66.A NE ALA 62.A O no hydrogen 2.608 N/A ARG 66.A NH1 ASP 157.A OD1 no hydrogen 2.881 N/A ARG 66.A NH2 ALA 62.A O no hydrogen 3.385 N/A ASN 67.A N HIS 64.A O no hydrogen 3.120 N/A VAL 68.A N PHE 63.A O no hydrogen 2.975 N/A GLU 69.A N TYR 35.A O no hydrogen 2.618 N/A LEU 71.A N LEU 37.A O no hydrogen 2.988 N/A GLY 72.A N THR 100.A O no hydrogen 3.155 N/A CYS 73.A N TYR 39.A O no hydrogen 2.755 N/A SER 74.A OG ASP 44.A OD1 no hydrogen 3.483 N/A SER 74.A OG ASP 76.A OD2 no hydrogen 2.916 N/A ASP 76.A N SER 74.A OG no hydrogen 3.342 N/A SER 77.A OG THR 80.A OG1 no hydrogen 3.002 N/A LYS 78.A NZ GLU 14.A OE2 no hydrogen 2.873 N/A THR 80.A N SER 77.A OG no hydrogen 3.362 N/A THR 80.A OG1 SER 77.A OG no hydrogen 3.002 N/A HIS 81.A N SER 77.A O no hydrogen 3.164 N/A HIS 81.A ND1 ASP 44.A OD2 no hydrogen 2.578 N/A HIS 81.A NE2 LEU 102.A O no hydrogen 2.887 N/A LEU 82.A N LYS 78.A O no hydrogen 3.124 N/A ALA 83.A N TYR 79.A O no hydrogen 3.195 N/A TRP 84.A N THR 80.A O no hydrogen 3.090 N/A TRP 84.A NE1 GLY 92.A O no hydrogen 2.945 N/A LYS 85.A N HIS 81.A O no hydrogen 2.955 N/A LYS 85.A NZ PHE 17.A O no hydrogen 2.797 N/A LYS 85.A NZ ASN 20.A OD1 no hydrogen 2.788 N/A LYS 86.A N LEU 82.A O no hydrogen 2.987 N/A THR 87.A N TRP 84.A O no hydrogen 3.391 N/A THR 87.A OG1 ALA 83.A O no hydrogen 2.619 N/A LYS 91.A N PRO 88.A O no hydrogen 2.987 N/A GLY 92.A N LEU 89.A O no hydrogen 3.033 N/A GLY 93.A N PRO 88.A O no hydrogen 3.018 N/A ILE 94.A N TRP 84.A O no hydrogen 3.177 N/A ASN 96.A ND2 ASN 20.A OD1 no hydrogen 2.948 N/A ILE 97.A N GLY 95.A O no hydrogen 2.976 N/A LYS 98.A N ASP 57.A OD1 no hydrogen 2.970 N/A LYS 98.A N ASP 57.A OD2 no hydrogen 2.905 N/A HIS 99.A N ASP 57.A OD2 no hydrogen 3.220 N/A HIS 99.A ND1 ASP 57.A OD2 no hydrogen 2.937 N/A HIS 99.A NE2 TYR 39.A OH no hydrogen 2.752 N/A LEU 101.A N VAL 16.A O no hydrogen 3.105 N/A LEU 102.A N GLY 72.A O no hydrogen 2.632 N/A SER 103.A N GLU 14.A O no hydrogen 2.878 N/A SER 103.A OG ASP 76.A O no hydrogen 2.858 N/A ASP 104.A N SER 74.A O no hydrogen 2.783 N/A THR 106.A OG1 SER 108.A OG no hydrogen 2.704 N/A LYS 107.A N ASP 104.A O no hydrogen 2.947 N/A LYS 107.A NZ SER 120.A O no hydrogen 2.595 N/A SER 108.A N THR 106.A OG1 no hydrogen 3.245 N/A SER 108.A OG THR 106.A OG1 no hydrogen 2.704 N/A ILE 109.A N ASP 104.A OD2 no hydrogen 3.019 N/A SER 110.A N ASP 104.A OD1 no hydrogen 2.828 N/A SER 110.A OG ASP 104.A OD1 no hydrogen 2.713 N/A LYS 111.A N LYS 107.A O no hydrogen 3.001 N/A ASP 112.A N SER 108.A O no hydrogen 2.841 N/A TYR 113.A N ILE 109.A O no hydrogen 3.022 N/A TYR 113.A OH PRO 9.A O no hydrogen 2.832 N/A ASN 114.A N LYS 111.A O no hydrogen 3.341 N/A VAL 115.A N SER 110.A O no hydrogen 2.922 N/A PHE 117.A N VAL 121.A O no hydrogen 2.695 N/A SER 120.A N PHE 117.A O no hydrogen 3.008 N/A SER 120.A OG ASP 118.A O no hydrogen 2.799 N/A VAL 121.A N PHE 117.A O no hydrogen 3.283 N/A SER 122.A OG TYR 41.A O no hydrogen 3.281 N/A LEU 123.A N VAL 115.A O no hydrogen 2.725 N/A ARG 124.A NE LEU 143.A O no hydrogen 2.730 N/A ARG 124.A NH1 GLU 52.A OE2 no hydrogen 2.928 N/A ARG 124.A NH2 LEU 143.A O no hydrogen 2.631 N/A ALA 125.A N PHE 40.A O no hydrogen 3.300 N/A PHE 126.A N LEU 139.A O no hydrogen 2.756 N/A VAL 127.A N LEU 38.A O no hydrogen 2.838 N/A LEU 128.A N HIS 137.A O no hydrogen 3.113 N/A ILE 129.A N VAL 36.A O no hydrogen 2.775 N/A ASP 130.A N ILE 134.A O no hydrogen 2.954 N/A ASN 132.A N ASP 130.A OD1 no hydrogen 2.995 N/A GLY 133.A N ASP 130.A O no hydrogen 2.950 N/A ILE 134.A N ASP 130.A OD1 no hydrogen 2.805 N/A VAL 135.A N LYS 6.A O no hydrogen 2.943 N/A GLN 136.A N LEU 128.A O no hydrogen 2.932 N/A GLN 136.A NE2 ASP 130.A OD2 no hydrogen 2.961 N/A LEU 139.A N PHE 126.A O no hydrogen 3.007 N/A ASN 141.A N ARG 124.A O no hydrogen 2.814 N/A ASN 141.A ND2 ILE 145.A O no hydrogen 3.215 N/A ASN 141.A ND2 GLY 146.A O no hydrogen 3.672 N/A LEU 143.A N ASN 142.A OD1 no hydrogen 2.919 N/A ILE 145.A N ASN 142.A O no hydrogen 3.081 N/A ARG 147.A N GLU 52.A OE1 no hydrogen 2.998 N/A ARG 147.A NH1 PHE 40.A O no hydrogen 2.757 N/A ARG 147.A NH1 ALA 125.A O no hydrogen 2.831 N/A ARG 147.A NH2 GLU 52.A OE1 no hydrogen 3.085 N/A LEU 153.A N VAL 149.A O no hydrogen 3.202 N/A ARG 154.A N ASP 150.A O no hydrogen 3.046 N/A ARG 154.A NE GLU 151.A OE1 no hydrogen 3.254 N/A ARG 154.A NE GLU 151.A OE2 no hydrogen 3.296 N/A ARG 154.A NH1 TRP 173.A O no hydrogen 3.094 N/A ARG 154.A NH2 GLU 151.A OE1 no hydrogen 2.946 N/A ILE 155.A N GLU 151.A O no hydrogen 2.924 N/A ILE 156.A N ILE 152.A O no hydrogen 2.827 N/A ASP 157.A N LEU 153.A O no hydrogen 2.888 N/A ALA 158.A N ARG 154.A O no hydrogen 2.853 N/A ILE 159.A N ILE 155.A O no hydrogen 2.970 N/A GLN 160.A N ILE 156.A O no hydrogen 2.997 N/A GLN 160.A NE2 ARG 66.A O no hydrogen 2.636 N/A HIS 161.A N ASP 157.A O no hydrogen 2.942 N/A HIS 162.A N ALA 158.A O no hydrogen 3.064 N/A HIS 162.A ND1 ASP 167.A O no hydrogen 2.819 N/A GLU 163.A N ILE 159.A O no hydrogen 2.988 N/A LYS 164.A N GLN 160.A O no hydrogen 3.200 N/A TYR 165.A N HIS 161.A O no hydrogen 3.023 N/A GLY 166.A N HIS 162.A O no hydrogen 2.785 N/A VAL 168.A N MET 180.A O no hydrogen 2.516 N/A CYS 169.A SG ALA 158.A O no hydrogen 3.333 N/A TRP 173.A NE1 LYS 177.A O no hydrogen 2.897 N/A GLN 174.A NE2 ASN 172.A O no hydrogen 3.212 N/A LYS 177.A N GLN 174.A O no hydrogen 2.772 N/A SER 179.A OG ASP 167.A OD2 no hydrogen 2.628 N/A SER 183.A N LYS 181.A O no hydrogen 2.735 N/A VAL 187.A N SER 183.A O no hydrogen 2.836 N/A LEU 191.A N VAL 187.A O no hydrogen 2.953 N/A SER 192.A OG ALA 188.A O no hydrogen 2.781 N/A THR 193.A OG1 GLN 189.A O no hydrogen 3.326 N/A