Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1c3i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N ASP 155.A OD1 no hydrogen 3.125 N/A PHE 1.A N ASP 155.A OD2 no hydrogen 2.471 N/A ARG 2.A NH1 HIS 129.A O no hydrogen 3.077 N/A THR 3.A OG1 PHE 4.A O no hydrogen 3.431 N/A ILE 7.A N PHE 4.A O no hydrogen 2.908 N/A LYS 9.A NZ TRP 10.A O no hydrogen 3.110 N/A TRP 10.A N TYR 164.A OH no hydrogen 2.856 N/A TRP 10.A NE1 SER 124.A O no hydrogen 2.844 N/A LYS 12.A NZ ASP 59.A OD2 no hydrogen 2.881 N/A HIS 14.A ND1 THR 49.A OG1 no hydrogen 2.562 N/A HIS 14.A NE2 SER 51.A OG no hydrogen 2.989 N/A LEU 15.A N THR 49.A O no hydrogen 3.005 N/A THR 16.A N ASP 59.A OD1 no hydrogen 2.658 N/A THR 16.A OG1 ASP 59.A OD1 no hydrogen 2.888 N/A TYR 17.A N SER 51.A O no hydrogen 2.799 N/A ARG 18.A N ILE 60.A O no hydrogen 3.040 N/A ARG 18.A NH1 GLY 56.A O no hydrogen 2.972 N/A VAL 20.A N ILE 62.A O no hydrogen 2.839 N/A ASN 21.A ND2 PHE 64.A O no hydrogen 3.148 N/A TYR 22.A OH ASP 32.A OD1 no hydrogen 3.425 N/A TYR 22.A OH ASP 32.A OD2 no hydrogen 2.567 N/A THR 23.A OG1 ASP 100.A OD1 no hydrogen 2.641 N/A THR 23.A OG1 ASP 100.A OD2 no hydrogen 2.969 N/A ASP 25.A N THR 23.A OG1 no hydrogen 3.009 N/A ALA 30.A N PRO 27.A O no hydrogen 2.927 N/A VAL 31.A N PRO 27.A O no hydrogen 3.333 N/A VAL 31.A N LYS 28.A O no hydrogen 3.132 N/A ASP 32.A N LYS 28.A O no hydrogen 3.056 N/A SER 33.A N ASP 29.A O no hydrogen 2.976 N/A SER 33.A OG ASP 29.A O no hydrogen 3.181 N/A ALA 34.A N ALA 30.A O no hydrogen 3.162 N/A VAL 35.A N VAL 31.A O no hydrogen 2.941 N/A GLU 36.A N ASP 32.A O no hydrogen 2.797 N/A LYS 37.A N SER 33.A O no hydrogen 2.866 N/A ALA 38.A N ALA 34.A O no hydrogen 2.996 N/A LEU 39.A N VAL 35.A O no hydrogen 3.057 N/A LYS 40.A N GLU 36.A O no hydrogen 2.925 N/A VAL 41.A N LYS 37.A O no hydrogen 3.258 N/A TRP 42.A N LEU 39.A O no hydrogen 3.238 N/A TRP 42.A NE1 ALA 118.A O no hydrogen 2.987 N/A GLU 43.A N LEU 39.A O no hydrogen 3.091 N/A GLU 44.A N LYS 40.A O no hydrogen 2.924 N/A VAL 45.A N TRP 42.A O no hydrogen 3.440 N/A THR 46.A N GLU 43.A O no hydrogen 3.332 N/A THR 46.A OG1 TRP 42.A O no hydrogen 2.781 N/A LEU 48.A N THR 46.A OG1 no hydrogen 3.204 N/A THR 49.A N THR 13.A O no hydrogen 2.875 N/A THR 49.A OG1 THR 13.A O no hydrogen 3.551 N/A THR 49.A OG1 HIS 14.A ND1 no hydrogen 2.562 N/A SER 51.A N LEU 15.A O no hydrogen 3.228 N/A SER 51.A OG HIS 14.A NE2 no hydrogen 2.989 N/A ARG 52.A NH2 ASP 32.A OD1 no hydrogen 3.272 N/A ARG 52.A NH2 ASP 32.A OD2 no hydrogen 3.302 N/A LEU 53.A N TYR 17.A O no hydrogen 2.944 N/A ASP 59.A N THR 16.A OG1 no hydrogen 2.998 N/A ILE 60.A N THR 16.A O no hydrogen 3.050 N/A MET 61.A N ASP 95.A OD1 no hydrogen 3.196 N/A ILE 62.A N ARG 18.A O no hydrogen 2.724 N/A SER 63.A N ALA 96.A O no hydrogen 3.184 N/A PHE 64.A N ASN 21.A OD1 no hydrogen 2.789 N/A ALA 65.A N PHE 98.A O no hydrogen 2.771 N/A HIS 69.A ND1 ARG 67.A O no hydrogen 2.949 N/A HIS 69.A NE2 HIS 97.A ND1 no hydrogen 3.041 N/A GLY 70.A N GLU 68.A OE1 no hydrogen 3.278 N/A TYR 73.A N ASP 71.A OD1 no hydrogen 3.196 N/A PHE 75.A N ARG 67.A O no hydrogen 2.769 N/A GLY 79.A N GLU 102.A OE1 no hydrogen 2.659 N/A VAL 81.A N ASP 76.A OD1 no hydrogen 3.003 N/A HIS 84.A N HIS 97.A O no hydrogen 2.878 N/A TYR 86.A N ASP 95.A O no hydrogen 2.925 N/A TYR 86.A OH ASP 71.A OD2 no hydrogen 2.696 N/A ASN 93.A N PRO 90.A O no hydrogen 3.206 N/A ASN 93.A ND2 PRO 90.A O no hydrogen 3.066 N/A GLY 94.A N TYR 86.A O no hydrogen 3.156 N/A ASP 95.A N ILE 92.A O no hydrogen 2.943 N/A ALA 96.A N MET 61.A O no hydrogen 3.169 N/A HIS 97.A N HIS 84.A O no hydrogen 2.713 N/A HIS 97.A ND1 HIS 69.A NE2 no hydrogen 3.041 N/A PHE 98.A N SER 63.A O no hydrogen 2.902 N/A ASP 99.A N LEU 82.A O no hydrogen 2.883 N/A ASP 100.A N ALA 65.A O no hydrogen 2.877 N/A ASP 101.A N ASP 99.A OD1 no hydrogen 2.990 N/A GLU 102.A N ASP 99.A O no hydrogen 3.066 N/A TRP 104.A N ASP 25.A OD1 no hydrogen 2.929 N/A TRP 104.A NE1 ASP 99.A O no hydrogen 2.918 N/A THR 105.A N THR 111.A O no hydrogen 2.857 N/A THR 105.A OG1 ASP 107.A O no hydrogen 2.712 N/A THR 105.A OG1 ASP 107.A OD1 no hydrogen 3.497 N/A THR 109.A N ASP 107.A OD1 no hydrogen 2.715 N/A THR 109.A OG1 ASP 107.A OD1 no hydrogen 2.631 N/A GLY 110.A N THR 105.A OG1 no hydrogen 3.138 N/A THR 111.A N GLN 103.A O no hydrogen 2.838 N/A ASN 112.A ND2 LYS 106.A O no hydrogen 2.636 N/A ASN 112.A ND2 ASP 107.A O no hydrogen 2.769 N/A LEU 113.A N THR 105.A O no hydrogen 3.293 N/A LEU 115.A N ASN 112.A OD1 no hydrogen 3.084 N/A VAL 116.A N ASN 112.A O no hydrogen 3.169 N/A ALA 117.A N LEU 113.A O no hydrogen 2.702 N/A ALA 118.A N PHE 114.A O no hydrogen 2.662 N/A HIS 119.A N LEU 115.A O no hydrogen 3.046 N/A HIS 119.A ND1 LEU 136.A O no hydrogen 2.731 N/A GLU 120.A N VAL 116.A O no hydrogen 2.868 N/A ILE 121.A N ALA 117.A O no hydrogen 2.920 N/A GLY 122.A N ALA 118.A O no hydrogen 3.103 N/A HIS 123.A N HIS 119.A O no hydrogen 3.204 N/A HIS 123.A ND1 LEU 127.A O no hydrogen 2.725 N/A HIS 123.A NE2 HIS 119.A NE2 no hydrogen 3.091 N/A SER 124.A N GLU 120.A O no hydrogen 2.897 N/A SER 124.A OG GLY 94.A O no hydrogen 2.739 N/A SER 124.A OG GLU 120.A O no hydrogen 3.452 N/A LEU 125.A N ILE 121.A O no hydrogen 2.851 N/A LEU 125.A N GLY 122.A O no hydrogen 3.347 N/A GLY 126.A N HIS 123.A O no hydrogen 3.042 N/A LEU 127.A N GLY 122.A O no hydrogen 2.979 N/A PHE 128.A N ARG 2.A O no hydrogen 2.773 N/A SER 130.A N MET 137.A O no hydrogen 3.051 N/A SER 130.A OG ASP 155.A OD1 no hydrogen 2.742 N/A ASN 132.A N SER 130.A OG no hydrogen 3.007 N/A THR 133.A OG1 GLU 134.A OE1 no hydrogen 2.395 N/A GLU 134.A N ASN 132.A OD1 no hydrogen 2.965 N/A ALA 135.A N ASN 132.A O no hydrogen 2.952 N/A LEU 136.A N ASP 156.A OD1 no hydrogen 2.551 N/A MET 137.A N ASP 156.A OD2 no hydrogen 2.970 N/A TYR 138.A N ALA 135.A O no hydrogen 2.885 N/A TYR 141.A N TYR 138.A O no hydrogen 2.951 N/A SER 143.A N LEU 140.A O no hydrogen 2.966 N/A SER 143.A OG LEU 140.A O no hydrogen 3.238 N/A LEU 144.A N LEU 140.A O no hydrogen 2.978 N/A LEU 144.A N TYR 141.A O no hydrogen 3.139 N/A THR 145.A OG1 TYR 141.A O no hydrogen 2.555 N/A THR 148.A OG1 ASP 146.A OD1 no hydrogen 2.447 N/A ARG 149.A N ASP 146.A OD1 no hydrogen 3.263 N/A SER 153.A N ASP 156.A OD1 no hydrogen 3.236 N/A SER 153.A OG ASP 156.A OD1 no hydrogen 2.537 N/A ASP 156.A N SER 153.A OG no hydrogen 3.279 N/A ILE 157.A N SER 153.A O no hydrogen 3.065 N/A ASN 158.A N GLN 154.A O no hydrogen 2.719 N/A ASN 158.A ND2 GLN 154.A OE1 no hydrogen 2.511 N/A GLY 159.A N ASP 155.A O no hydrogen 3.113 N/A ILE 160.A N ASP 156.A O no hydrogen 2.972 N/A GLN 161.A N ILE 157.A O no hydrogen 2.965 N/A GLN 161.A NE2 VAL 45.A O no hydrogen 2.805 N/A SER 162.A N ASN 158.A O no hydrogen 2.898 N/A SER 162.A OG GLY 159.A O no hydrogen 2.828 N/A TYR 164.A N ILE 160.A O no hydrogen 3.041 N/A TYR 164.A OH LEU 125.A O no hydrogen 2.628 N/A GLY 165.A N GLN 161.A O no hydrogen 2.742 N/A SER 170.A OG PRO 167.A O no hydrogen 2.854 N/A