Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2z3k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH2 ARG 1.A O no hydrogen 2.658 N/A ARG 1.A NH2 GLY 17.A O no hydrogen 3.507 N/A GLN 4.A NE2 LEU 5.A O no hydrogen 3.303 N/A LEU 5.A N LEU 28.A O no hydrogen 3.026 N/A HIS 8.A N SER 6.A OG no hydrogen 3.415 N/A ALA 11.A N SER 9.A OG no hydrogen 3.396 N/A GLU 16.A N SER 14.A OG no hydrogen 3.251 N/A GLY 17.A N SER 14.A O no hydrogen 3.026 N/A ALA 18.A N PRO 15.A O no hydrogen 2.845 N/A LEU 19.A N LEU 25.A O no hydrogen 2.749 N/A ASN 23.A ND2 ASP 61.A O no hydrogen 2.837 N/A GLY 24.A N LEU 19.A O no hydrogen 3.048 N/A LEU 25.A N PRO 22.A O no hydrogen 3.063 N/A LEU 26.A N TRP 57.A O no hydrogen 3.127 N/A LEU 28.A N VAL 3.A O no hydrogen 3.435 N/A GLY 29.A N ILE 55.A O no hydrogen 2.800 N/A SER 33.A N ASP 31.A OD2 no hydrogen 3.044 N/A SER 33.A OG ASP 31.A OD2 no hydrogen 2.732 N/A ARG 36.A NH2 SER 6.A O no hydrogen 2.538 N/A LEU 37.A N SER 33.A O no hydrogen 2.867 N/A LEU 38.A N PRO 34.A O no hydrogen 2.744 N/A MET 39.A N ALA 35.A O no hydrogen 3.030 N/A ALA 40.A N ARG 36.A O no hydrogen 2.858 N/A TYR 41.A N LEU 37.A O no hydrogen 3.038 N/A TYR 41.A OH TYR 119.A OH no hydrogen 2.585 N/A TYR 41.A OH GLU 155.A OE2 no hydrogen 2.809 N/A GLN 42.A N LEU 38.A O no hydrogen 2.840 N/A ARG 43.A N MET 39.A O no hydrogen 3.036 N/A ARG 43.A N ALA 40.A O no hydrogen 2.967 N/A GLY 44.A N TYR 41.A O no hydrogen 3.253 N/A ILE 45.A N ALA 40.A O no hydrogen 2.830 N/A PHE 46.A N TRP 58.A O no hydrogen 2.772 N/A TRP 48.A N LEU 56.A O no hydrogen 2.761 N/A SER 50.A OG ASP 53.A OD2 no hydrogen 3.064 N/A ASP 53.A N SER 50.A O no hydrogen 3.065 N/A TRP 57.A N ALA 27.A O no hydrogen 2.671 N/A TRP 57.A NE1 GLY 29.A O no hydrogen 2.970 N/A TRP 58.A N PHE 46.A O no hydrogen 2.600 N/A TRP 58.A NE1 TRP 48.A O no hydrogen 2.904 N/A SER 59.A N GLY 24.A O no hydrogen 3.242 N/A SER 59.A OG GLY 44.A O no hydrogen 2.841 N/A ASP 61.A N ASN 23.A OD1 no hydrogen 2.868 N/A ARG 63.A N ILE 201.A O no hydrogen 3.114 N/A ARG 63.A NE ASP 185.A OD1 no hydrogen 2.807 N/A ARG 63.A NH1 GLY 44.A O no hydrogen 3.113 N/A ARG 63.A NH2 ASP 185.A OD2 no hydrogen 3.211 N/A ALA 64.A N GLN 187.A O no hydrogen 3.080 N/A VAL 65.A N CYS 199.A O no hydrogen 2.880 N/A LEU 66.A N ILE 184.A O no hydrogen 2.793 N/A SER 70.A N TRP 67.A O no hydrogen 2.642 N/A HIS 72.A N LEU 196.A O no hydrogen 2.694 N/A SER 74.A OG SER 76.A OG no hydrogen 3.202 N/A SER 76.A OG SER 74.A OG no hydrogen 3.202 N/A MET 77.A N SER 74.A OG no hydrogen 3.170 N/A LYS 78.A N SER 74.A O no hydrogen 3.273 N/A LYS 78.A NZ ILE 73.A O no hydrogen 2.898 N/A ARG 79.A N ARG 75.A O no hydrogen 3.004 N/A PHE 80.A N SER 76.A O no hydrogen 2.822 N/A HIS 81.A N MET 77.A O no hydrogen 2.767 N/A LYS 82.A N LYS 78.A O no hydrogen 2.871 N/A SER 84.A N HIS 81.A O no hydrogen 3.183 N/A TYR 86.A N SER 84.A OG no hydrogen 3.256 N/A TYR 86.A OH GLU 162.A O no hydrogen 2.621 N/A ARG 87.A N TRP 134.A O no hydrogen 2.774 N/A VAL 88.A N PHE 229.A O no hydrogen 3.094 N/A THR 89.A N GLU 132.A O no hydrogen 2.925 N/A THR 89.A OG1 GLU 132.A OE2 no hydrogen 2.633 N/A MET 90.A N ARG 226.A O no hydrogen 2.685 N/A ASN 91.A N SER 130.A O no hydrogen 2.641 N/A ASN 91.A ND2 HIS 129.A ND1 no hydrogen 3.286 N/A ASN 91.A ND2 TRP 223.A O no hydrogen 2.855 N/A TYR 92.A N GLU 132.A OE1 no hydrogen 3.104 N/A TYR 92.A N GLU 132.A OE2 no hydrogen 3.144 N/A ALA 93.A N GLU 132.A OE1 no hydrogen 2.915 N/A VAL 97.A N ALA 93.A O no hydrogen 3.189 N/A ILE 98.A N PHE 94.A O no hydrogen 3.057 N/A GLU 99.A N GLY 95.A O no hydrogen 3.182 N/A GLY 100.A N GLN 96.A O no hydrogen 2.869 N/A CYS 101.A N VAL 97.A O no hydrogen 2.951 N/A CYS 101.A SG VAL 97.A O no hydrogen 3.527 N/A CYS 101.A SG SER 156.A OG no hydrogen 3.147 N/A ALA 102.A N ILE 98.A O no hydrogen 2.887 N/A SER 103.A N GLY 100.A O no hydrogen 3.296 N/A SER 103.A OG GLU 99.A O no hydrogen 2.399 N/A SER 103.A OG GLY 100.A O no hydrogen 3.250 N/A ASP 104.A N CYS 101.A O no hydrogen 2.995 N/A GLU 106.A N ASP 104.A O no hydrogen 2.447 N/A GLU 107.A N GLU 107.A OE1 no hydrogen 2.613 N/A THR 109.A OG1 ARG 105.A O no hydrogen 3.299 N/A THR 109.A OG1 GLU 106.A O no hydrogen 2.941 N/A ILE 111.A N GLY 108.A O no hydrogen 3.051 N/A VAL 116.A N THR 112.A O no hydrogen 2.833 N/A GLU 117.A N ARG 113.A O no hydrogen 3.020 N/A ALA 118.A N GLY 114.A O no hydrogen 2.974 N/A TYR 119.A N VAL 115.A O no hydrogen 2.972 N/A TYR 119.A OH TYR 41.A OH no hydrogen 2.585 N/A HIS 120.A N VAL 116.A O no hydrogen 2.865 N/A ARG 121.A N GLU 117.A O no hydrogen 3.007 N/A ARG 121.A N ALA 118.A O no hydrogen 3.233 N/A ARG 121.A NH2 LEU 32.A O no hydrogen 3.162 N/A LEU 122.A N ALA 118.A O no hydrogen 3.449 N/A HIS 123.A N TYR 119.A O no hydrogen 2.952 N/A HIS 123.A ND1 ALA 128.A O no hydrogen 2.933 N/A GLU 124.A N HIS 120.A O no hydrogen 2.825 N/A LEU 125.A N ARG 121.A O no hydrogen 2.604 N/A GLY 126.A N HIS 123.A O no hydrogen 2.718 N/A HIS 127.A N LEU 122.A O no hydrogen 2.561 N/A ALA 128.A N LEU 122.A O no hydrogen 3.025 N/A HIS 129.A N GLY 145.A O no hydrogen 3.061 N/A SER 130.A N ASN 91.A OD1 no hydrogen 2.742 N/A SER 130.A OG GLU 132.A OE1 no hydrogen 2.677 N/A ILE 131.A N MET 143.A O no hydrogen 2.647 N/A GLU 132.A N THR 89.A O no hydrogen 2.797 N/A VAL 133.A N GLY 141.A O no hydrogen 3.017 N/A TRP 134.A N ARG 87.A O no hydrogen 2.599 N/A TRP 134.A NE1 THR 89.A OG1 no hydrogen 2.923 N/A ARG 135.A N GLU 138.A O no hydrogen 2.869 N/A ARG 135.A NH1 PRO 85.A O no hydrogen 2.779 N/A GLU 138.A N ARG 135.A O no hydrogen 2.997 N/A VAL 140.A N VAL 133.A O no hydrogen 3.009 N/A GLY 142.A N PHE 158.A O no hydrogen 3.248 N/A MET 143.A N ILE 131.A O no hydrogen 2.986 N/A TYR 144.A N SER 156.A O no hydrogen 3.284 N/A GLY 145.A N HIS 129.A O no hydrogen 3.118 N/A VAL 146.A N CYS 153.A O no hydrogen 2.810 N/A ALA 147.A N HIS 127.A O no hydrogen 2.821 N/A GLN 148.A N LEU 151.A O no hydrogen 2.983 N/A GLN 148.A NE2 ALA 147.A O no hydrogen 3.030 N/A THR 150.A N MET 213.A O no hydrogen 2.942 N/A THR 150.A OG1 MET 213.A O no hydrogen 3.340 N/A LEU 151.A N GLN 148.A O no hydrogen 3.323 N/A PHE 152.A N LEU 183.A O no hydrogen 2.968 N/A CYS 153.A N VAL 146.A O no hydrogen 2.877 N/A CYS 153.A SG ASP 185.A OD2 no hydrogen 3.650 N/A GLY 154.A N ASP 185.A O no hydrogen 2.916 N/A GLU 155.A N TYR 144.A O no hydrogen 3.035 N/A SER 156.A OG MET 157.A O no hydrogen 3.209 N/A PHE 158.A N GLY 142.A O no hydrogen 3.395 N/A ARG 160.A N VAL 140.A O no hydrogen 2.885 N/A ALA 164.A N MET 161.A O no hydrogen 2.905 N/A LYS 166.A NZ ASN 163.A OD1 no hydrogen 2.942 N/A THR 167.A N ASN 163.A O no hydrogen 2.984 N/A THR 167.A OG1 ASN 163.A O no hydrogen 2.788 N/A ALA 168.A N ALA 164.A O no hydrogen 3.075 N/A LEU 169.A N SER 165.A O no hydrogen 3.138 N/A LEU 170.A N LYS 166.A O no hydrogen 2.805 N/A VAL 171.A N THR 167.A O no hydrogen 2.726 N/A PHE 172.A N ALA 168.A O no hydrogen 2.844 N/A CYS 173.A N LEU 169.A O no hydrogen 2.772 N/A CYS 173.A SG PRO 68.A O no hydrogen 3.985 N/A CYS 173.A SG LEU 169.A O no hydrogen 3.390 N/A GLU 174.A N LEU 170.A O no hydrogen 3.147 N/A GLU 175.A N VAL 171.A O no hydrogen 3.134 N/A PHE 176.A N PHE 172.A O no hydrogen 2.629 N/A ILE 177.A N CYS 173.A O no hydrogen 2.733 N/A GLY 178.A N GLU 174.A O no hydrogen 2.804 N/A HIS 179.A N GLU 175.A O no hydrogen 3.272 N/A HIS 179.A N PHE 176.A O no hydrogen 3.318 N/A GLY 180.A N ILE 177.A O no hydrogen 2.941 N/A GLY 181.A N PHE 176.A O no hydrogen 2.725 N/A LYS 182.A N THR 150.A O no hydrogen 2.768 N/A ILE 184.A N LEU 66.A O no hydrogen 3.133 N/A ASP 185.A N PHE 152.A O no hydrogen 2.512 N/A CYS 186.A N ALA 64.A O no hydrogen 2.908 N/A CYS 186.A SG ILE 184.A O no hydrogen 4.014 N/A CYS 186.A SG THR 193.A OG1 no hydrogen 3.708 N/A GLN 187.A N ASP 185.A OD1 no hydrogen 3.108 N/A THR 193.A N ASN 190.A OD1 no hydrogen 2.787 N/A ALA 194.A N ASN 190.A O no hydrogen 2.768 N/A SER 195.A N ASP 191.A O no hydrogen 2.902 N/A SER 195.A OG HIS 192.A O no hydrogen 2.659 N/A LEU 196.A N HIS 192.A O no hydrogen 3.166 N/A LEU 196.A N THR 193.A O no hydrogen 3.111 N/A GLY 197.A N ALA 194.A O no hydrogen 3.000 N/A ALA 198.A N THR 193.A O no hydrogen 3.222 N/A CYS 199.A N VAL 65.A O no hydrogen 2.807 N/A CYS 199.A SG VAL 65.A O no hydrogen 4.044 N/A ILE 201.A N ARG 63.A O no hydrogen 3.232 N/A ARG 203.A N ASP 61.A OD1 no hydrogen 3.001 N/A ARG 203.A NE SER 59.A O no hydrogen 3.375 N/A ARG 203.A NH1 GLU 16.A OE2 no hydrogen 3.135 N/A TYR 206.A N PRO 202.A O no hydrogen 2.889 N/A LEU 207.A N ARG 203.A O no hydrogen 2.863 N/A ASN 208.A N ARG 204.A O no hydrogen 3.218 N/A TYR 209.A N ASP 205.A O no hydrogen 3.148 N/A LEU 210.A N TYR 206.A O no hydrogen 2.861 N/A ASN 211.A N LEU 207.A O no hydrogen 3.196 N/A GLN 212.A N ASN 208.A O no hydrogen 3.101 N/A MET 213.A N TYR 209.A O no hydrogen 2.900 N/A ARG 214.A N LEU 210.A O no hydrogen 2.881 N/A GLY 216.A N GLN 212.A O no hydrogen 3.372 N/A PHE 222.A N PRO 219.A O no hydrogen 2.883 N/A VAL 224.A N ASN 221.A O no hydrogen 3.465 N/A ARG 226.A N MET 90.A O no hydrogen 3.166 N/A ARG 226.A NE PHE 222.A O no hydrogen 3.199 N/A ARG 226.A NH1 GLU 175.A OE1 no hydrogen 3.371 N/A ARG 226.A NH2 GLU 175.A OE1 no hydrogen 3.221 N/A ARG 226.A NH2 PHE 222.A O no hydrogen 2.879 N/A CYS 227.A SG VAL 88.A O no hydrogen 3.544 N/A CYS 227.A SG PHE 229.A O no hydrogen 3.618 N/A LEU 228.A N VAL 88.A O no hydrogen 2.612 N/A PHE 229.A N VAL 88.A O no hydrogen 3.126 N/A