Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3neg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 10.A N GLU 13.A OE1 no hydrogen 3.292 N/A THR 10.A OG1 ASP 12.A OD2 no hydrogen 3.071 N/A GLU 13.A N THR 10.A OG1 no hydrogen 3.329 N/A PHE 14.A N THR 10.A O no hydrogen 2.800 N/A THR 15.A N GLN 11.A O no hydrogen 2.863 N/A THR 15.A OG1 ASP 12.A O no hydrogen 3.358 N/A GLN 16.A N ASP 12.A O no hydrogen 3.221 N/A LEU 17.A N GLU 13.A O no hydrogen 3.051 N/A SER 18.A N PHE 14.A O no hydrogen 2.864 N/A ILE 21.A N LEU 17.A O no hydrogen 2.922 N/A ALA 22.A N SER 18.A O no hydrogen 2.859 N/A GLU 23.A N GLN 19.A O no hydrogen 2.916 N/A PHE 24.A N SER 20.A O no hydrogen 2.926 N/A HIS 25.A N ILE 21.A O no hydrogen 3.131 N/A HIS 25.A ND1 SER 144.A OG no hydrogen 2.941 N/A HIS 25.A NE2 THR 129.A OG1 no hydrogen 2.689 N/A THR 26.A OG1 ILE 21.A O no hydrogen 3.297 N/A TYR 27.A OH SER 144.A OG no hydrogen 2.533 N/A CYS 34.A N VAL 147.A O no hydrogen 3.063 N/A SER 36.A N TYR 145.A O no hydrogen 3.169 N/A SER 36.A OG ASP 163.A OD1 no hydrogen 3.199 N/A SER 36.A OG ASP 163.A OD2 no hydrogen 3.456 N/A LEU 38.A N GLU 143.A O no hydrogen 2.692 N/A ALA 39.A N SER 7.A O no hydrogen 2.790 N/A GLN 40.A N VAL 141.A O no hydrogen 2.895 N/A GLN 40.A NE2 ARG 41.A O no hydrogen 2.999 N/A ARG 41.A NE GLU 13.A OE2 no hydrogen 2.652 N/A ARG 41.A NH1 PRO 6.A O no hydrogen 2.582 N/A ARG 41.A NH2 PRO 6.A O no hydrogen 3.274 N/A ARG 41.A NH2 ASP 8.A O no hydrogen 3.046 N/A ARG 41.A NH2 GLU 13.A OE1 no hydrogen 3.018 N/A ILE 42.A N THR 139.A O no hydrogen 2.867 N/A HIS 43.A N GLU 178.A OE2 no hydrogen 2.915 N/A ALA 44.A N ILE 42.A O no hydrogen 2.672 N/A VAL 49.A N PRO 45.A O no hydrogen 3.238 N/A TRP 50.A N PRO 46.A O no hydrogen 2.793 N/A TRP 50.A NE1 ASP 105.A OD2 no hydrogen 2.899 N/A SER 51.A N GLU 47.A O no hydrogen 3.116 N/A SER 51.A OG THR 48.A O no hydrogen 3.025 N/A VAL 53.A N VAL 49.A O no hydrogen 3.181 N/A ARG 54.A N TRP 50.A O no hydrogen 2.928 N/A ARG 54.A NE ASP 105.A OD2 no hydrogen 2.995 N/A ARG 54.A NH2 ASP 105.A OD1 no hydrogen 2.920 N/A ARG 54.A NH2 ASP 105.A OD2 no hydrogen 3.475 N/A ARG 55.A N VAL 52.A O no hydrogen 3.012 N/A ARG 55.A NE ASP 57.A OD1 no hydrogen 2.851 N/A ARG 55.A NH2 ASP 57.A OD1 no hydrogen 2.668 N/A ARG 55.A NH2 ASP 57.A OD2 no hydrogen 2.793 N/A ARG 58.A N ARG 55.A O no hydrogen 3.033 N/A ILE 61.A N ARG 58.A O no hydrogen 3.329 N/A TYR 62.A N PRO 59.A O no hydrogen 3.015 N/A LYS 63.A N PRO 59.A O no hydrogen 2.985 N/A HIS 64.A N ASN 169.A OD1 no hydrogen 2.911 N/A LYS 67.A N ASN 86.A O no hydrogen 2.614 N/A SER 68.A N ASN 86.A O no hydrogen 3.292 N/A SER 68.A OG ASN 70.A OD1 no hydrogen 3.510 N/A CYS 69.A SG ASP 57.A O no hydrogen 3.728 N/A ASN 70.A N ASP 84.A O no hydrogen 2.861 N/A SER 72.A OG ASP 74.A OD1 no hydrogen 3.287 N/A GLY 80.A N LEU 100.A O no hydrogen 2.865 N/A CYS 81.A N ARG 78.A O no hydrogen 3.017 N/A CYS 81.A SG GLU 76.A O no hydrogen 3.855 N/A CYS 81.A SG ARG 78.A O no hydrogen 3.257 N/A ARG 83.A N GLU 98.A O no hydrogen 2.893 N/A ARG 83.A NE GLU 98.A OE1 no hydrogen 2.564 N/A ARG 83.A NH1 PHE 56.A O no hydrogen 2.665 N/A ASP 84.A N ASN 70.A O no hydrogen 2.978 N/A VAL 85.A N SER 96.A O no hydrogen 2.704 N/A ASN 86.A N SER 68.A O no hydrogen 2.702 N/A VAL 87.A N ASN 94.A O no hydrogen 2.759 N/A ILE 88.A N PHE 65.A O no hydrogen 3.005 N/A ASN 94.A N GLU 118.A O no hydrogen 2.971 N/A ASN 94.A ND2 GLU 118.A OE1 no hydrogen 3.081 N/A SER 96.A N VAL 85.A O no hydrogen 2.807 N/A SER 96.A OG GLU 98.A OE2 no hydrogen 2.840 N/A ARG 97.A N GLY 116.A O no hydrogen 2.612 N/A GLU 98.A N ARG 83.A O no hydrogen 2.950 N/A ARG 99.A N SER 113.A O no hydrogen 2.814 N/A ARG 99.A NE ASP 101.A OD1 no hydrogen 3.068 N/A ARG 99.A NH2 ASP 101.A OD1 no hydrogen 3.362 N/A ARG 99.A NH2 SER 113.A OG no hydrogen 3.323 N/A LEU 100.A N CYS 81.A O no hydrogen 2.879 N/A ASP 101.A N GLY 111.A O no hydrogen 2.680 N/A ASP 104.A N VAL 109.A O no hydrogen 3.042 N/A ASP 106.A N ASP 104.A OD2 no hydrogen 2.818 N/A ARG 107.A N ASP 104.A OD2 no hydrogen 3.202 N/A ARG 107.A NH1 GLU 23.A OE2 no hydrogen 2.782 N/A ARG 107.A NH2 GLU 23.A OE1 no hydrogen 2.724 N/A ARG 107.A NH2 GLU 23.A OE2 no hydrogen 3.254 N/A ARG 108.A NE GLU 47.A OE2 no hydrogen 3.231 N/A ARG 108.A NH2 GLU 47.A OE2 no hydrogen 3.422 N/A VAL 109.A N ASP 104.A O no hydrogen 3.297 N/A THR 110.A N THR 128.A O no hydrogen 2.933 N/A THR 110.A OG1 LEU 102.A O no hydrogen 3.032 N/A GLY 111.A N LEU 102.A O no hydrogen 3.271 N/A SER 113.A N ARG 99.A O no hydrogen 2.846 N/A SER 113.A OG ASP 101.A OD1 no hydrogen 3.332 N/A SER 113.A OG ASP 101.A OD2 no hydrogen 2.624 N/A ILE 114.A N TYR 124.A O no hydrogen 2.981 N/A THR 115.A N ARG 97.A O no hydrogen 2.782 N/A THR 115.A OG1 ARG 97.A O no hydrogen 3.526 N/A GLU 118.A N THR 95.A O no hydrogen 2.864 N/A GLU 118.A N THR 95.A OG1 no hydrogen 3.301 N/A LEU 121.A N HIS 119.A ND1 no hydrogen 3.165 N/A ARG 122.A NH2 GLY 117.A O no hydrogen 2.619 N/A ARG 122.A NH2 HIS 119.A O no hydrogen 2.882 N/A ASN 123.A ND2 ASP 148.A OD2 no hydrogen 2.985 N/A LYS 125.A N VAL 146.A O no hydrogen 2.863 N/A SER 126.A N PHE 112.A O no hydrogen 2.895 N/A SER 126.A OG SER 144.A O no hydrogen 3.310 N/A VAL 127.A N SER 144.A O no hydrogen 3.065 N/A THR 128.A N THR 110.A O no hydrogen 2.665 N/A THR 129.A N LEU 142.A O no hydrogen 2.903 N/A THR 129.A OG1 HIS 25.A NE2 no hydrogen 2.689 N/A THR 129.A OG1 HIS 131.A NE2 no hydrogen 2.781 N/A VAL 130.A N ARG 108.A O no hydrogen 3.113 N/A HIS 131.A N VAL 140.A O no hydrogen 2.928 N/A HIS 131.A NE2 THR 129.A OG1 no hydrogen 2.781 N/A ARG 132.A NH1 GLU 134.A OE2 no hydrogen 2.710 N/A ARG 132.A NH2 GLU 134.A OE2 no hydrogen 2.842 N/A PHE 133.A N TRP 138.A O no hydrogen 2.925 N/A TRP 138.A N PHE 133.A O no hydrogen 3.100 N/A THR 139.A N ILE 42.A O no hydrogen 2.973 N/A THR 139.A OG1 ALA 44.A O no hydrogen 2.442 N/A VAL 140.A N HIS 131.A O no hydrogen 3.167 N/A VAL 141.A N GLN 40.A O no hydrogen 2.926 N/A LEU 142.A N THR 129.A O no hydrogen 2.974 N/A GLU 143.A N LEU 38.A O no hydrogen 2.785 N/A SER 144.A N VAL 127.A O no hydrogen 2.883 N/A SER 144.A OG HIS 25.A ND1 no hydrogen 2.941 N/A SER 144.A OG TYR 27.A OH no hydrogen 2.533 N/A TYR 145.A N SER 36.A O no hydrogen 3.174 N/A TYR 145.A OH ASP 163.A OD1 no hydrogen 2.800 N/A VAL 146.A N LYS 125.A O no hydrogen 2.891 N/A VAL 147.A N CYS 34.A O no hydrogen 2.984 N/A ASP 148.A N ARG 122.A O no hydrogen 3.062 N/A VAL 149.A N GLY 32.A O no hydrogen 2.868 N/A ASN 153.A N PRO 150.A O no hydrogen 3.194 N/A ASP 157.A N SER 154.A OG no hydrogen 3.044 N/A THR 158.A N SER 154.A O no hydrogen 3.188 N/A THR 158.A OG1 SER 154.A O no hydrogen 3.200 N/A ARG 159.A N GLU 155.A O no hydrogen 2.955 N/A ARG 159.A NE SER 35.A O no hydrogen 3.217 N/A ARG 159.A NH2 GLU 155.A OE1 no hydrogen 3.195 N/A LEU 160.A N GLU 156.A O no hydrogen 2.978 N/A PHE 161.A N ASP 157.A O no hydrogen 3.101 N/A ALA 162.A N THR 158.A O no hydrogen 3.208 N/A ASP 163.A N ARG 159.A O no hydrogen 2.761 N/A THR 164.A N LEU 160.A O no hydrogen 2.999 N/A THR 164.A N PHE 161.A O no hydrogen 2.855 N/A THR 164.A OG1 LEU 160.A O no hydrogen 2.798 N/A VAL 165.A N PHE 161.A O no hydrogen 3.389 N/A ILE 166.A N ALA 162.A O no hydrogen 3.028 N/A ARG 167.A N ASP 163.A O no hydrogen 2.697 N/A ARG 167.A NE SER 7.A OG no hydrogen 3.140 N/A LEU 168.A N THR 164.A O no hydrogen 2.951 N/A ASN 169.A N VAL 165.A O no hydrogen 2.931 N/A LEU 170.A N ILE 166.A O no hydrogen 2.939 N/A GLN 171.A N ARG 167.A O no hydrogen 3.156 N/A LYS 172.A N LEU 168.A O no hydrogen 2.977 N/A LYS 172.A NZ GLN 60.A O no hydrogen 3.565 N/A LEU 173.A N ASN 169.A O no hydrogen 2.869 N/A ALA 174.A N LEU 170.A O no hydrogen 2.743 N/A SER 175.A N GLN 171.A O no hydrogen 2.936 N/A ILE 176.A N LYS 172.A O no hydrogen 2.957 N/A THR 177.A N LEU 173.A O no hydrogen 3.110 N/A THR 177.A OG1 LEU 173.A O no hydrogen 2.582 N/A THR 177.A OG1 ALA 174.A O no hydrogen 3.161 N/A GLU 178.A N ALA 174.A O no hydrogen 2.885 N/A ALA 179.A N ILE 176.A O no hydrogen 3.063 N/A ASN 181.A ND2 HIS 43.A O no hydrogen 3.328 N/A