Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3u0t_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N SER 25.A O no hydrogen 2.913 N/A VAL 5.A N LYS 23.A O no hydrogen 3.022 N/A GLN 6.A N GLN 108.A OE1 no hydrogen 3.101 N/A GLN 6.A NE2 TYR 94.A O no hydrogen 2.906 N/A GLN 6.A NE2 THR 110.A OG1 no hydrogen 2.794 N/A SER 7.A N SER 21.A O no hydrogen 3.104 N/A GLU 10.A N THR 111.A O no hydrogen 2.959 N/A LYS 12.A N THR 113.A O no hydrogen 2.981 N/A GLY 15.A N LEU 86C.A O no hydrogen 2.735 N/A ALA 16.A N LYS 13.A O no hydrogen 3.094 N/A SER 17.A OG GLU 82.A OE2 no hydrogen 2.834 N/A VAL 18.A N LEU 83.A O no hydrogen 2.993 N/A VAL 20.A N MET 81.A O no hydrogen 2.857 N/A SER 21.A N SER 7.A OG no hydrogen 2.891 N/A CYS 22.A N VAL 79.A O no hydrogen 2.873 N/A LYS 23.A N VAL 5.A O no hydrogen 2.739 N/A LYS 23.A NZ THR 76.A O no hydrogen 2.744 N/A ALA 24.A N SER 77.A O no hydrogen 2.837 N/A SER 25.A N GLN 3.A O no hydrogen 3.036 N/A THR 29.A OG1 SER 77.A OG no hydrogen 3.211 N/A ALA 31.A N TYR 28.A O no hydrogen 3.327 N/A TYR 32.A N THR 29.A O no hydrogen 3.306 N/A ILE 34.A N ILE 51.A O no hydrogen 3.217 N/A HIS 35.A N ALA 97.A O no hydrogen 2.933 N/A TRP 36.A N GLY 49.A O no hydrogen 3.067 N/A VAL 37.A N TYR 95.A O no hydrogen 2.914 N/A ARG 38.A N GLU 46.A O no hydrogen 3.051 N/A ARG 38.A NE GLU 46.A OE1 no hydrogen 2.973 N/A ARG 38.A NH1 ASP 90.A OD1 no hydrogen 2.846 N/A ARG 38.A NH1 TYR 94.A OH no hydrogen 2.914 N/A ARG 38.A NH2 GLU 46.A OE1 no hydrogen 3.148 N/A GLN 39.A N VAL 93.A O no hydrogen 2.973 N/A GLN 43.A N ALA 40.A O no hydrogen 2.736 N/A GLU 46.A N ARG 38.A O no hydrogen 2.939 N/A TRP 47.A NE1 HIS 35.A ND1 no hydrogen 3.142 N/A MET 48.A N TRP 36.A O no hydrogen 2.993 N/A ARG 50.A N LYS 59.A O no hydrogen 3.063 N/A ILE 51.A N ILE 34.A O no hydrogen 2.890 N/A ASP 52.A N ASN 57.A O no hydrogen 2.964 N/A ALA 54.A N ASP 52.A OD1 no hydrogen 2.852 N/A THR 55.A OG1 ASP 52.A OD2 no hydrogen 3.238 N/A GLY 56.A N ASP 52.A O no hydrogen 2.670 N/A ASN 57.A N THR 55.A OG1 no hydrogen 3.202 N/A THR 58.A OG1 TYR 60.A OH no hydrogen 3.246 N/A LYS 59.A N ARG 50.A O no hydrogen 3.147 N/A ALA 61.A N MET 48.A O no hydrogen 2.929 N/A LEU 64.A N ALA 61.A O no hydrogen 3.073 N/A GLN 65.A N PRO 62.A O no hydrogen 3.371 N/A ARG 67.A N LEU 64.A O no hydrogen 2.781 N/A ARG 67.A NH1 ASP 90.A OD1 no hydrogen 3.533 N/A ARG 67.A NH1 ASP 90.A OD2 no hydrogen 2.919 N/A ARG 67.A NH1 SER 84A.A O no hydrogen 3.232 N/A ARG 67.A NH1 SER 85B.A O no hydrogen 3.287 N/A ARG 67.A NH2 ASP 90.A OD1 no hydrogen 3.142 N/A VAL 68.A N LEU 64.A O no hydrogen 3.132 N/A THR 69.A N GLU 82.A O no hydrogen 2.961 N/A MET 70.A N TYR 60.A OH no hydrogen 2.723 N/A THR 71.A N TYR 80.A O no hydrogen 3.035 N/A ARG 72.A NH1 PRO 53A.A O no hydrogen 3.259 N/A ASP 73.A N THR 78.A O no hydrogen 2.783 N/A SER 75.A OG ASP 73.A OD1 no hydrogen 2.543 N/A THR 76.A N ASP 73.A OD1 no hydrogen 3.401 N/A THR 76.A OG1 ASP 73.A O no hydrogen 3.255 N/A THR 76.A OG1 THR 78.A OG1 no hydrogen 3.080 N/A SER 77.A N THR 74.A O no hydrogen 3.282 N/A SER 77.A OG THR 29.A OG1 no hydrogen 3.211 N/A THR 78.A N ASP 73.A O no hydrogen 3.224 N/A THR 78.A OG1 THR 76.A O no hydrogen 2.725 N/A THR 78.A OG1 THR 76.A OG1 no hydrogen 3.080 N/A VAL 79.A N CYS 22.A O no hydrogen 3.060 N/A TYR 80.A N THR 71.A O no hydrogen 2.719 N/A MET 81.A N VAL 20.A O no hydrogen 2.945 N/A GLU 82.A N THR 69.A O no hydrogen 2.945 N/A LEU 83.A N VAL 18.A O no hydrogen 2.906 N/A ARG 87.A N ASP 90.A OD2 no hydrogen 2.886 N/A SER 88.A OG GLU 89.A OE2 no hydrogen 3.095 N/A GLU 89.A N GLU 89.A OE2 no hydrogen 2.611 N/A ASP 90.A N ARG 87.A O no hydrogen 2.998 N/A THR 91.A N SER 88.A O no hydrogen 3.006 N/A THR 91.A OG1 SER 88.A O no hydrogen 3.067 N/A ALA 92.A N VAL 112.A O no hydrogen 2.926 N/A VAL 93.A N GLN 39.A O no hydrogen 3.010 N/A TYR 94.A N THR 110.A O no hydrogen 2.778 N/A TYR 94.A OH ASP 90.A O no hydrogen 2.618 N/A TYR 95.A N VAL 37.A O no hydrogen 2.713 N/A CYS 96.A N GLN 6.A OE1 no hydrogen 3.172 N/A ALA 97.A N HIS 35.A O no hydrogen 2.949 N/A SER 98.A N TYR 105.A O no hydrogen 2.980 N/A SER 98.A OG SER 101.A OG no hydrogen 2.705 N/A SER 98.A OG TYR 105.A O no hydrogen 3.569 N/A SER 101.A N SER 98.A O no hydrogen 3.249 N/A SER 101.A OG SER 98.A O no hydrogen 3.080 N/A SER 101.A OG SER 98.A OG no hydrogen 2.705 N/A SER 101.A OG PRO 103.A O no hydrogen 2.725 N/A TYR 105.A N SER 98.A OG no hydrogen 3.128 N/A GLY 107.A N CYS 96.A O no hydrogen 2.832 N/A GLN 108.A N GLN 108.A OE1 no hydrogen 2.772 N/A GLN 108.A NE2 GLN 6.A O no hydrogen 2.927 N/A GLY 109.A N GLN 6.A OE1 no hydrogen 3.082 N/A THR 110.A N TYR 94.A O no hydrogen 2.928 N/A THR 110.A OG1 SER 7.A O no hydrogen 2.661 N/A VAL 112.A N ALA 92.A O no hydrogen 2.909 N/A THR 113.A N GLU 10.A O no hydrogen 3.139 N/A VAL 114.A N THR 91.A OG1 no hydrogen 2.879 N/A SER 115.A N LYS 12.A O no hydrogen 2.840 N/A ALA 117.A N SER 115.A OG no hydrogen 3.126 N/A LYS 120.A N PHE 146.A O no hydrogen 2.882 N/A LYS 120.A NZ GLY 121.A O no hydrogen 3.347 N/A LYS 120.A NZ ASP 144.A O no hydrogen 2.925 N/A SER 123.A N LYS 143.A O no hydrogen 3.042 N/A PHE 125.A N LEU 141.A O no hydrogen 2.732 N/A LEU 127.A N GLY 139.A O no hydrogen 2.678 N/A SER 131.A OG CYS 130.A O no hydrogen 2.975 N/A SER 132.A OG GLU 133.A OE1 no hydrogen 2.677 N/A SER 132.A OG GLU 133.A OE2 no hydrogen 2.684 N/A ALA 136.A N VAL 184.A O no hydrogen 2.951 N/A LEU 138.A N VAL 182.A O no hydrogen 3.094 N/A GLY 139.A N LEU 127.A O no hydrogen 2.927 N/A CYS 140.A N SER 180.A O no hydrogen 2.758 N/A LEU 141.A N PHE 125.A O no hydrogen 2.712 N/A VAL 142.A N LEU 178.A O no hydrogen 2.887 N/A LYS 143.A N SER 123.A O no hydrogen 2.810 N/A LYS 143.A NZ ASP 144.A OD1 no hydrogen 3.088 N/A LYS 143.A NZ ASP 144.A OD2 no hydrogen 3.115 N/A TYR 145.A N TYR 176.A O no hydrogen 3.302 N/A TYR 145.A OH GLU 148.A OE2 no hydrogen 2.953 N/A PHE 146.A N LYS 120.A O no hydrogen 2.977 N/A THR 151.A N ASP 195.A O no hydrogen 3.192 N/A SER 153.A N ASN 193.A O no hydrogen 2.924 N/A SER 153.A OG ASN 193.A OD1 no hydrogen 3.483 N/A TRP 154.A NE1 SER 180.A OG no hydrogen 2.871 N/A ASN 155.A N THR 191.A O no hydrogen 2.716 N/A ASN 155.A ND2 THR 189.A O no hydrogen 3.498 N/A SER 156.A N ASN 193.A OD1 no hydrogen 2.917 N/A GLY 157.A N TRP 154.A O no hydrogen 2.849 N/A ALA 158.A N ASN 155.A O no hydrogen 2.945 N/A HIS 164.A N VAL 181.A O no hydrogen 2.927 N/A THR 165.A OG1 SER 180.A OG no hydrogen 2.900 N/A PHE 166.A N SER 179.A O no hydrogen 3.038 N/A VAL 169.A N SER 177.A O no hydrogen 2.808 N/A GLN 171.A N LEU 175.A O no hydrogen 2.912 N/A GLN 171.A NE2 ASP 144.A OD1 no hydrogen 2.891 N/A GLN 171.A NE2 LEU 175.A O no hydrogen 3.129 N/A GLY 174.A N GLN 171.A O no hydrogen 3.141 N/A LEU 175.A N SER 173.A OG no hydrogen 3.412 N/A TYR 176.A N TYR 145.A O no hydrogen 2.927 N/A SER 177.A N VAL 169.A O no hydrogen 2.882 N/A SER 177.A OG VAL 142.A O no hydrogen 3.406 N/A LEU 178.A N VAL 142.A O no hydrogen 2.967 N/A SER 180.A N CYS 140.A O no hydrogen 3.023 N/A SER 180.A OG THR 165.A OG1 no hydrogen 2.900 N/A VAL 181.A N HIS 164.A O no hydrogen 2.773 N/A VAL 182.A N LEU 138.A O no hydrogen 2.837 N/A THR 183.A N GLY 162.A O no hydrogen 3.016 N/A VAL 184.A N ALA 136.A O no hydrogen 3.029 N/A SER 186.A OG GLU 133.A O no hydrogen 3.072 N/A SER 186.A OG SER 134.A O no hydrogen 3.385 N/A THR 191.A N ASN 155.A OD1 no hydrogen 2.890 N/A THR 191.A OG1 THR 206.A OG1 no hydrogen 2.891 N/A CYS 192.A N LYS 205.A O no hydrogen 2.838 N/A ASN 193.A N SER 153.A O no hydrogen 2.621 N/A ASN 193.A ND2 ASP 204.A OD1 no hydrogen 3.191 N/A VAL 194.A N VAL 203.A O no hydrogen 2.808 N/A ASP 195.A N THR 151.A O no hydrogen 3.134 N/A HIS 196.A N THR 201.A O no hydrogen 2.674 N/A HIS 196.A ND1 SER 199.A OG no hydrogen 2.790 N/A HIS 196.A NE2 PRO 147.A O no hydrogen 2.704 N/A LYS 197.A NZ ASP 195.A OD2 no hydrogen 2.685 N/A SER 199.A N HIS 196.A O no hydrogen 3.151 N/A SER 199.A OG HIS 196.A ND1 no hydrogen 2.790 N/A SER 199.A OG THR 201.A OG1 no hydrogen 3.004 N/A ASN 200.A N LYS 197.A O no hydrogen 2.893 N/A THR 201.A N HIS 196.A O no hydrogen 3.191 N/A THR 201.A OG1 SER 199.A O no hydrogen 3.145 N/A THR 201.A OG1 SER 199.A OG no hydrogen 3.004 N/A VAL 203.A N VAL 194.A O no hydrogen 2.812 N/A LYS 205.A N CYS 192.A O no hydrogen 2.945 N/A THR 206.A OG1 THR 191.A OG1 no hydrogen 2.891 N/A VAL 207.A N TYR 190.A O no hydrogen 3.043 N/A SER 84A.A N ARG 67.A O no hydrogen 2.905 N/A SER 84A.A OG ARG 67.A O no hydrogen 3.239 N/A LEU 86C.A N ALA 16.A O no hydrogen 3.045 N/A