Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1k3z_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ASP 8.A O no hydrogen 2.911 N/A GLY 7.A N THR 4.A O no hydrogen 2.905 N/A THR 9.A N HIS 12.A ND1 no hydrogen 2.927 N/A THR 9.A OG1 HIS 12.A ND1 no hydrogen 3.046 N/A THR 9.A OG1 TYR 35.A OH no hydrogen 3.389 N/A HIS 12.A ND1 THR 9.A OG1 no hydrogen 3.046 N/A HIS 12.A NE2 GLN 44.A O no hydrogen 3.268 N/A LEU 13.A N THR 9.A O no hydrogen 2.916 N/A ALA 14.A N ALA 10.A O no hydrogen 2.712 N/A VAL 15.A N LEU 11.A O no hydrogen 3.301 N/A ILE 16.A N HIS 12.A O no hydrogen 3.055 N/A HIS 17.A N LEU 13.A O no hydrogen 2.961 N/A HIS 17.A ND1 LEU 13.A O no hydrogen 2.956 N/A GLN 18.A NE2 HIS 17.A O no hydrogen 3.344 N/A HIS 19.A N ALA 14.A O no hydrogen 2.775 N/A LEU 23.A N HIS 19.A O no hydrogen 2.671 N/A ASP 24.A N GLU 20.A O no hydrogen 2.817 N/A PHE 25.A N PRO 21.A O no hydrogen 2.883 N/A LEU 26.A N PHE 22.A O no hydrogen 2.701 N/A LEU 27.A N LEU 23.A O no hydrogen 2.958 N/A GLY 28.A N PHE 25.A O no hydrogen 2.579 N/A PHE 29.A N LEU 26.A O no hydrogen 3.342 N/A SER 30.A N LEU 26.A O no hydrogen 3.399 N/A SER 30.A OG LEU 26.A O no hydrogen 3.249 N/A GLY 32.A N ALA 65.A O no hydrogen 3.299 N/A HIS 33.A N SER 30.A O no hydrogen 3.237 N/A ASP 37.A N GLU 34.A O no hydrogen 3.317 N/A LEU 38.A N TYR 35.A O no hydrogen 3.235 N/A GLN 39.A NE2 GLY 43.A O no hydrogen 2.687 N/A ASN 40.A N GLN 44.A O no hydrogen 2.868 N/A ASN 40.A ND2 ASP 8.A OD1 no hydrogen 2.704 N/A ASP 41.A N ASP 6.A O no hydrogen 3.000 N/A LEU 42.A N ASN 40.A OD1 no hydrogen 2.796 N/A GLY 43.A N ASN 40.A O no hydrogen 3.033 N/A GLN 44.A N ASN 40.A OD1 no hydrogen 3.124 N/A THR 45.A N HIS 48.A ND1 no hydrogen 2.796 N/A THR 45.A OG1 HIS 48.A ND1 no hydrogen 3.043 N/A HIS 48.A N THR 45.A OG1 no hydrogen 3.247 N/A HIS 48.A NE2 HIS 77.A O no hydrogen 3.052 N/A LEU 49.A N THR 45.A O no hydrogen 3.083 N/A ALA 50.A N ALA 46.A O no hydrogen 2.779 N/A ALA 51.A N LEU 47.A O no hydrogen 2.807 N/A ILE 52.A N HIS 48.A O no hydrogen 3.054 N/A LEU 53.A N LEU 49.A O no hydrogen 3.069 N/A GLY 54.A N ALA 51.A O no hydrogen 2.800 N/A GLU 55.A N ALA 50.A O no hydrogen 3.431 N/A VAL 59.A N GLU 55.A O no hydrogen 2.937 N/A GLU 60.A N ALA 56.A O no hydrogen 2.935 N/A LYS 61.A N SER 57.A O no hydrogen 2.962 N/A LYS 61.A NZ GLU 20.A OE1 no hydrogen 3.461 N/A LYS 61.A NZ ASP 24.A OD2 no hydrogen 2.642 N/A LEU 62.A N THR 58.A O no hydrogen 3.069 N/A TYR 63.A N VAL 59.A O no hydrogen 3.015 N/A TYR 63.A OH GLN 97.A O no hydrogen 2.872 N/A ALA 64.A N GLU 60.A O no hydrogen 2.641 N/A ALA 65.A N LYS 61.A O no hydrogen 2.926 N/A GLY 66.A N TYR 63.A O no hydrogen 3.094 N/A ALA 67.A N LEU 62.A O no hydrogen 2.929 N/A GLY 68.A N ASP 37.A OD1 no hydrogen 2.779 N/A GLU 73.A N HIS 77.A O no hydrogen 3.026 N/A ARG 74.A N LEU 42.A O no hydrogen 2.952 N/A ARG 74.A NH1 GLN 44.A OE1 no hydrogen 3.005 N/A GLY 75.A N GLU 73.A OE1 no hydrogen 2.485 N/A GLY 75.A N GLU 73.A OE2 no hydrogen 3.174 N/A GLY 76.A N GLU 73.A O no hydrogen 2.701 N/A HIS 77.A N GLU 73.A OE1 no hydrogen 2.701 N/A THR 78.A N HIS 81.A ND1 no hydrogen 2.910 N/A THR 78.A OG1 HIS 81.A ND1 no hydrogen 2.787 N/A HIS 81.A N THR 78.A OG1 no hydrogen 3.084 N/A HIS 81.A NE2 HIS 120.A O no hydrogen 3.121 N/A LEU 82.A N THR 78.A O no hydrogen 3.105 N/A ALA 83.A N ALA 79.A O no hydrogen 3.052 N/A CYS 84.A N LEU 80.A O no hydrogen 3.157 N/A CYS 84.A N HIS 81.A O no hydrogen 3.222 N/A CYS 84.A SG LEU 80.A O no hydrogen 3.476 N/A CYS 84.A SG PRO 122.A O no hydrogen 3.688 N/A ALA 88.A N ALA 83.A O no hydrogen 2.904 N/A CYS 91.A N ALA 88.A O no hydrogen 2.976 N/A ALA 92.A N ALA 88.A O no hydrogen 3.032 N/A CYS 93.A N HIS 89.A O no hydrogen 2.891 N/A CYS 93.A SG HIS 89.A O no hydrogen 3.522 N/A VAL 94.A N THR 90.A O no hydrogen 3.161 N/A LEU 95.A N CYS 91.A O no hydrogen 3.100 N/A LEU 96.A N ALA 92.A O no hydrogen 2.694 N/A GLN 97.A N LEU 95.A O no hydrogen 2.761 N/A ARG 99.A NE TYR 63.A O no hydrogen 2.921 N/A ARG 99.A NH2 ALA 67.A O no hydrogen 2.840 N/A ARG 104.A N HIS 102.A O no hydrogen 2.424 N/A ASP 107.A N ASP 105.A OD2 no hydrogen 2.653 N/A ARG 109.A NH1 ALA 141.A O no hydrogen 3.201 N/A LEU 110.A N GLU 106.A O no hydrogen 3.278 N/A LEU 110.A N ASP 107.A O no hydrogen 3.033 N/A GLN 111.A NE2 LEU 95.A O no hydrogen 2.952 N/A GLN 111.A NE2 TRP 108.A O no hydrogen 2.924 N/A LEU 112.A N ARG 109.A O no hydrogen 2.701 N/A ALA 114.A N GLN 111.A O no hydrogen 3.276 N/A ASN 116.A N HIS 120.A O no hydrogen 2.651 N/A TYR 117.A N GLY 75.A O no hydrogen 3.058 N/A ASP 118.A N ASN 116.A OD1 no hydrogen 2.714 N/A GLY 119.A N ASN 116.A O no hydrogen 3.046 N/A HIS 120.A N ASN 116.A OD1 no hydrogen 2.942 N/A THR 121.A N HIS 124.A ND1 no hydrogen 2.953 N/A THR 121.A OG1 HIS 124.A ND1 no hydrogen 3.118 N/A HIS 124.A NE2 LYS 147.A O no hydrogen 2.913 N/A VAL 125.A N THR 121.A O no hydrogen 3.303 N/A ALA 126.A N PRO 122.A O no hydrogen 2.864 N/A VAL 127.A N LEU 123.A O no hydrogen 2.831 N/A ILE 128.A N HIS 124.A O no hydrogen 2.954 N/A HIS 129.A N VAL 125.A O no hydrogen 2.882 N/A HIS 129.A ND1 VAL 125.A O no hydrogen 3.188 N/A LYS 130.A N VAL 127.A O no hydrogen 3.076 N/A ASP 131.A N ALA 126.A O no hydrogen 2.912 N/A ALA 132.A N LYS 130.A O no hydrogen 3.132 N/A MET 134.A N ASP 131.A OD2 no hydrogen 3.300 N/A VAL 135.A N ASP 131.A O no hydrogen 3.116 N/A ARG 136.A N ALA 132.A O no hydrogen 3.070 N/A LEU 137.A N GLU 133.A O no hydrogen 3.150 N/A LEU 138.A N MET 134.A O no hydrogen 2.936 N/A ARG 139.A N VAL 135.A O no hydrogen 2.741 N/A ARG 139.A NE ASP 140.A OD2 no hydrogen 2.959 N/A ARG 139.A NH2 ASP 140.A OD2 no hydrogen 3.176 N/A ASP 140.A N ARG 136.A O no hydrogen 2.902 N/A ALA 141.A N LEU 137.A O no hydrogen 2.806 N/A GLY 142.A N ARG 139.A O no hydrogen 3.030 N/A ALA 143.A N LEU 138.A O no hydrogen 2.921 N/A ASP 144.A N GLU 113.A OE1 no hydrogen 2.495 N/A ASN 146.A N ASP 144.A OD1 no hydrogen 2.930 N/A LYS 147.A N ASP 144.A O no hydrogen 3.357 N/A LYS 147.A N ASP 144.A OD1 no hydrogen 3.045 N/A LYS 147.A NZ GLU 113.A OE2 no hydrogen 3.046 N/A GLU 149.A N ARG 154.A O no hydrogen 2.661 N/A THR 151.A N GLU 149.A OE2 no hydrogen 2.819 N/A THR 151.A OG1 GLU 149.A OE1 no hydrogen 3.313 N/A THR 151.A OG1 GLU 149.A OE2 no hydrogen 2.719 N/A CYS 152.A SG GLU 149.A OE1 no hydrogen 3.346 N/A ARG 154.A N GLU 149.A OE1 no hydrogen 3.052 N/A ARG 154.A NE GLU 149.A OE1 no hydrogen 2.451 N/A ARG 154.A NH1 GLU 162.A OE1 no hydrogen 3.350 N/A ARG 154.A NH1 GLU 162.A OE2 no hydrogen 2.845 N/A ARG 154.A NH2 THR 151.A OG1 no hydrogen 3.008 N/A THR 155.A N HIS 158.A ND1 no hydrogen 3.136 N/A THR 155.A OG1 HIS 158.A ND1 no hydrogen 2.653 N/A HIS 158.A N THR 155.A OG1 no hydrogen 3.383 N/A HIS 158.A ND1 THR 155.A OG1 no hydrogen 2.653 N/A HIS 158.A NE2 ARG 187.A O no hydrogen 3.107 N/A LEU 159.A N THR 155.A O no hydrogen 2.831 N/A ALA 160.A N PRO 156.A O no hydrogen 2.641 N/A VAL 161.A N LEU 157.A O no hydrogen 3.225 N/A GLU 162.A N HIS 158.A O no hydrogen 3.086 N/A ALA 163.A N LEU 159.A O no hydrogen 3.012 N/A GLN 164.A N VAL 161.A O no hydrogen 3.113 N/A GLN 164.A NE2 VAL 161.A O no hydrogen 2.512 N/A ALA 165.A N ALA 160.A O no hydrogen 2.958 N/A LEU 169.A N ALA 165.A O no hydrogen 2.783 N/A GLU 170.A N ALA 166.A O no hydrogen 2.789 N/A LEU 171.A N SER 167.A O no hydrogen 2.808 N/A LEU 172.A N VAL 168.A O no hydrogen 2.849 N/A LEU 173.A N LEU 169.A O no hydrogen 2.734 N/A LYS 174.A N GLU 170.A O no hydrogen 2.763 N/A ALA 175.A N LEU 171.A O no hydrogen 2.925 N/A GLY 176.A N LEU 173.A O no hydrogen 3.098 N/A ALA 177.A N LEU 172.A O no hydrogen 3.064 N/A ASP 178.A N ASN 146.A OD1 no hydrogen 2.819 N/A THR 180.A N ASP 178.A OD2 no hydrogen 2.614 N/A MET 183.A N ARG 187.A O no hydrogen 2.765 N/A TYR 184.A N CYS 152.A O no hydrogen 2.853 N/A TYR 184.A OH PRO 150.A O no hydrogen 3.363 N/A GLY 186.A N MET 183.A O no hydrogen 2.456 N/A SER 192.A N THR 188.A O no hydrogen 3.025 N/A SER 192.A OG THR 188.A O no hydrogen 3.460 N/A ALA 193.A N PRO 189.A O no hydrogen 3.145 N/A LEU 194.A N LEU 190.A O no hydrogen 3.169 N/A LEU 195.A N SER 192.A O no hydrogen 2.957 N/A ARG 196.A N ALA 193.A O no hydrogen 2.834 N/A ARG 196.A NE SER 192.A O no hydrogen 3.440 N/A ARG 203.A N PRO 199.A O no hydrogen 3.265 N/A LEU 204.A N ILE 200.A O no hydrogen 2.865 N/A LEU 205.A N LEU 201.A O no hydrogen 3.074 N/A ARG 206.A N ALA 202.A O no hydrogen 2.744 N/A ALA 207.A N ARG 203.A O no hydrogen 2.828 N/A HIS 208.A N LEU 205.A O no hydrogen 2.978 N/A HIS 208.A ND1 LEU 204.A O no hydrogen 2.937 N/A ALA 210.A N LEU 205.A O no hydrogen 2.904 N/A LYS 219.A N GLY 216.A O no hydrogen 2.776 N/A SER 221.A OG SER 221.A O no hydrogen 2.525 N/A