Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jsq_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 TYR 18.A OH no hydrogen 3.506 N/A THR 6.A OG1 GLY 3.A O no hydrogen 2.800 N/A SER 8.A N ARG 12.A O no hydrogen 2.649 N/A SER 8.A OG ARG 12.A O no hydrogen 2.917 N/A GLY 11.A N SER 8.A O no hydrogen 2.837 N/A ARG 12.A N SER 8.A OG no hydrogen 2.966 N/A PHE 14.A N THR 6.A O no hydrogen 3.366 N/A GLU 17.A N LEU 13.A O no hydrogen 3.040 N/A TYR 18.A N PHE 14.A O no hydrogen 2.916 N/A SER 19.A N GLN 15.A O no hydrogen 3.034 N/A SER 19.A OG PHE 130.A O no hydrogen 2.557 N/A LEU 20.A N VAL 16.A O no hydrogen 3.187 N/A GLU 21.A N TYR 18.A O no hydrogen 3.286 N/A ALA 22.A N SER 19.A O no hydrogen 3.219 N/A ILE 23.A N SER 19.A O no hydrogen 3.340 N/A LYS 24.A N LEU 20.A O no hydrogen 3.313 N/A LYS 24.A NZ GLU 21.A OE1 no hydrogen 3.325 N/A LEU 25.A N ALA 22.A O no hydrogen 3.320 N/A GLY 26.A N ILE 23.A O no hydrogen 3.060 N/A THR 28.A N GLU 43.A OE2 no hydrogen 3.322 N/A THR 28.A OG1 GLU 43.A OE2 no hydrogen 3.408 N/A THR 28.A OG1 SER 166.A OG no hydrogen 3.319 N/A ALA 29.A N ILE 164.A O no hydrogen 2.751 N/A ILE 30.A N GLY 41.A O no hydrogen 2.772 N/A GLY 31.A N LYS 162.A O no hydrogen 2.864 N/A ILE 32.A N VAL 39.A O no hydrogen 2.967 N/A ALA 33.A N ASN 160.A O no hydrogen 2.788 N/A THR 34.A N GLY 37.A O no hydrogen 2.796 N/A THR 34.A OG1 GLY 37.A O no hydrogen 2.579 N/A GLU 36.A N THR 34.A OG1 no hydrogen 3.289 N/A GLY 37.A N THR 34.A OG1 no hydrogen 3.054 N/A VAL 38.A N ILE 214.A O no hydrogen 3.217 N/A VAL 39.A N ILE 32.A O no hydrogen 2.859 N/A LEU 40.A N SER 212.A O no hydrogen 2.762 N/A GLY 41.A N ILE 30.A O no hydrogen 2.868 N/A VAL 42.A N GLN 210.A O no hydrogen 3.030 N/A GLU 43.A N THR 28.A O no hydrogen 2.903 N/A LYS 44.A N ASN 208.A O no hydrogen 2.840 N/A LYS 44.A NZ SER 53.A O no hydrogen 2.929 N/A LYS 44.A NZ ASN 207.A O no hydrogen 3.468 N/A ARG 45.A NE GLU 43.A OE1 no hydrogen 3.239 N/A ARG 45.A NH1 LEU 25.A O no hydrogen 3.064 N/A ARG 45.A NH2 GLY 26.A O no hydrogen 3.503 N/A LEU 51.A N SER 48.A O no hydrogen 3.129 N/A SER 55.A N GLU 52.A O no hydrogen 3.156 N/A SER 55.A OG GLU 52.A O no hydrogen 2.641 N/A ILE 56.A N SER 53.A O no hydrogen 3.268 N/A LYS 58.A NZ GLU 43.A O no hydrogen 3.570 N/A LYS 58.A NZ LYS 44.A O no hydrogen 3.084 N/A VAL 60.A N CYS 68.A O no hydrogen 3.030 N/A ILE 62.A N ILE 66.A O no hydrogen 2.948 N/A ASP 63.A N ILE 66.A O no hydrogen 2.836 N/A ARG 64.A N ASP 63.A OD2 no hydrogen 2.827 N/A ARG 64.A NH1 GLN 217.A O no hydrogen 3.145 N/A HIS 65.A NE2 ILE 99.A O no hydrogen 2.736 N/A ILE 66.A N ASP 63.A O no hydrogen 3.200 N/A GLY 67.A N ALA 137.A O no hydrogen 2.871 N/A CYS 68.A N VAL 60.A O no hydrogen 3.053 N/A ALA 69.A N LEU 135.A O no hydrogen 3.103 N/A MET 70.A N LYS 58.A O no hydrogen 3.037 N/A SER 71.A N ALA 133.A O no hydrogen 3.092 N/A SER 71.A OG SER 27.A O no hydrogen 2.643 N/A SER 71.A OG ILE 164.A O no hydrogen 3.500 N/A LEU 73.A N GLY 131.A O no hydrogen 2.748 N/A ASP 76.A N LEU 73.A O no hydrogen 3.166 N/A ALA 77.A N THR 74.A O no hydrogen 3.282 N/A ARG 78.A NH2 GLU 57.A O no hydrogen 2.964 N/A SER 79.A OG ASP 76.A O no hydrogen 3.529 N/A ILE 81.A N ALA 77.A O no hydrogen 2.846 N/A GLU 82.A N ARG 78.A O no hydrogen 3.068 N/A HIS 83.A N SER 79.A O no hydrogen 3.112 N/A HIS 83.A NE2 SER 107.A OG no hydrogen 2.872 N/A ALA 84.A N MET 80.A O no hydrogen 3.026 N/A ARG 85.A N ILE 81.A O no hydrogen 2.793 N/A ARG 85.A NE GLU 61.A O no hydrogen 2.753 N/A ARG 85.A NH2 GLU 61.A O no hydrogen 3.109 N/A THR 86.A N GLU 82.A O no hydrogen 3.072 N/A THR 86.A OG1 GLU 82.A O no hydrogen 2.686 N/A ALA 87.A N HIS 83.A O no hydrogen 2.880 N/A ALA 88.A N ALA 84.A O no hydrogen 3.038 N/A VAL 89.A N ARG 85.A O no hydrogen 3.218 N/A THR 90.A N THR 86.A O no hydrogen 2.743 N/A THR 90.A OG1 THR 86.A O no hydrogen 2.561 N/A HIS 91.A N ALA 87.A O no hydrogen 3.173 N/A HIS 91.A NE2 GLU 97.A OE1 no hydrogen 2.912 N/A ASN 92.A N ALA 88.A O no hydrogen 3.159 N/A ASN 92.A ND2 GLU 97.A O no hydrogen 2.808 N/A LEU 93.A N VAL 89.A O no hydrogen 2.904 N/A TYR 94.A N THR 90.A O no hydrogen 2.963 N/A TYR 95.A N HIS 91.A O no hydrogen 2.930 N/A ASP 96.A N ASN 92.A O no hydrogen 2.999 N/A VAL 101.A N ASP 140.A OD1 no hydrogen 3.119 N/A LEU 104.A N ASN 100.A O no hydrogen 2.864 N/A THR 105.A N VAL 101.A O no hydrogen 3.074 N/A THR 105.A OG1 VAL 101.A O no hydrogen 2.735 N/A GLN 106.A N GLU 102.A O no hydrogen 3.013 N/A SER 107.A N SER 103.A O no hydrogen 3.168 N/A SER 107.A OG HIS 83.A NE2 no hydrogen 2.872 N/A VAL 108.A N LEU 104.A O no hydrogen 3.166 N/A CYS 109.A N THR 105.A O no hydrogen 2.931 N/A CYS 109.A SG THR 105.A O no hydrogen 3.346 N/A ASP 110.A N GLN 106.A O no hydrogen 3.137 N/A LEU 111.A N VAL 108.A O no hydrogen 3.335 N/A ALA 112.A N CYS 109.A O no hydrogen 3.322 N/A ARG 114.A N LEU 111.A O no hydrogen 3.120 N/A GLY 116.A N MET 126.A O no hydrogen 2.834 N/A ARG 128.A NH1 ASP 76.A OD1 no hydrogen 2.651 N/A ARG 128.A NH1 PRO 129.A O no hydrogen 3.243 N/A ARG 128.A NH2 ASP 76.A OD1 no hydrogen 3.501 N/A ARG 128.A NH2 ASP 76.A OD2 no hydrogen 3.122 N/A GLY 131.A N ASP 76.A OD1 no hydrogen 2.844 N/A ALA 133.A N SER 71.A O no hydrogen 3.013 N/A LEU 134.A N ALA 150.A O no hydrogen 3.012 N/A LEU 135.A N ALA 69.A O no hydrogen 2.770 N/A ILE 136.A N PHE 148.A O no hydrogen 2.913 N/A ALA 137.A N GLY 67.A O no hydrogen 2.756 N/A GLY 138.A N GLN 146.A O no hydrogen 3.085 N/A HIS 139.A N HIS 65.A O no hydrogen 3.115 N/A ASP 140.A N GLY 144.A O no hydrogen 3.276 N/A ASP 142.A N ASP 140.A OD2 no hydrogen 3.169 N/A ASP 143.A N ASP 140.A OD2 no hydrogen 2.842 N/A GLY 144.A N ASP 140.A O no hydrogen 2.926 N/A GLN 146.A N GLY 138.A O no hydrogen 2.923 N/A PHE 148.A N ILE 136.A O no hydrogen 2.712 N/A HIS 149.A N TYR 157.A O no hydrogen 2.875 N/A ALA 150.A N LEU 134.A O no hydrogen 2.820 N/A GLU 151.A N THR 155.A O no hydrogen 3.312 N/A SER 153.A OG THR 155.A OG1 no hydrogen 2.725 N/A GLY 154.A N GLU 151.A O no hydrogen 3.103 N/A THR 155.A OG1 SER 153.A OG no hydrogen 2.725 N/A TYR 157.A N HIS 149.A O no hydrogen 3.421 N/A ARG 158.A NH2 TYR 145.A O no hydrogen 3.359 N/A TYR 159.A N LEU 147.A O no hydrogen 2.793 N/A LYS 162.A N GLY 31.A O no hydrogen 2.947 N/A LYS 162.A NZ TYR 159.A OH no hydrogen 3.336 N/A ALA 163.A N GLN 172.A OE1 no hydrogen 2.989 N/A ILE 164.A N ALA 29.A O no hydrogen 2.831 N/A SER 166.A OG THR 28.A OG1 no hydrogen 3.319 N/A SER 168.A OG GLY 165.A O no hydrogen 3.129 N/A GLU 169.A N GLU 169.A OE1 no hydrogen 2.690 N/A ALA 171.A N GLY 167.A O no hydrogen 3.058 N/A GLN 172.A N SER 168.A O no hydrogen 2.884 N/A GLN 172.A NE2 ALA 161.A O no hydrogen 3.257 N/A GLU 174.A N GLY 170.A O no hydrogen 3.279 N/A LEU 175.A N ALA 171.A O no hydrogen 2.860 N/A LEU 176.A N GLN 172.A O no hydrogen 2.977 N/A ASN 177.A N GLU 174.A O no hydrogen 3.327 N/A GLU 178.A N GLU 174.A O no hydrogen 3.163 N/A TRP 179.A N LEU 175.A O no hydrogen 3.219 N/A TRP 179.A NE1 ALA 33.A O no hydrogen 3.191 N/A HIS 180.A ND1 SER 182.A OG no hydrogen 2.842 N/A SER 182.A N HIS 180.A ND1 no hydrogen 3.314 N/A SER 182.A OG HIS 180.A ND1 no hydrogen 2.842 N/A LEU 183.A N HIS 180.A O no hydrogen 3.381 N/A THR 184.A N GLU 187.A OE1 no hydrogen 3.050 N/A THR 184.A OG1 GLU 187.A OE1 no hydrogen 3.397 N/A LEU 185.A N GLU 36.A OE1 no hydrogen 3.215 N/A GLU 187.A N THR 184.A OG1 no hydrogen 3.258 N/A ALA 188.A N THR 184.A O no hydrogen 3.034 N/A GLU 189.A N LEU 185.A O no hydrogen 2.946 N/A LEU 190.A N LYS 186.A O no hydrogen 3.125 N/A LEU 191.A N GLU 187.A O no hydrogen 3.077 N/A VAL 192.A N ALA 188.A O no hydrogen 3.025 N/A LEU 193.A N GLU 189.A O no hydrogen 3.281 N/A LYS 194.A N LEU 190.A O no hydrogen 2.763 N/A LYS 194.A NZ GLU 178.A OE1 no hydrogen 2.914 N/A ILE 195.A N LEU 191.A O no hydrogen 3.126 N/A LEU 196.A N VAL 192.A O no hydrogen 2.926 N/A LYS 197.A N LEU 193.A O no hydrogen 3.442 N/A GLN 198.A N LYS 194.A O no hydrogen 3.252 N/A GLN 198.A NE2 GLU 174.A OE2 no hydrogen 2.684 N/A VAL 199.A N ILE 195.A O no hydrogen 3.276 N/A VAL 199.A N LEU 196.A O no hydrogen 3.216 N/A MET 200.A N LEU 196.A O no hydrogen 2.925 N/A ASP 205.A N ASN 208.A OD1 no hydrogen 2.947 N/A GLU 206.A N GLU 206.A OE2 no hydrogen 2.810 N/A ASN 207.A N ASP 205.A OD1 no hydrogen 3.332 N/A ASN 208.A N ASP 205.A OD1 no hydrogen 3.171 N/A ASN 208.A ND2 LYS 203.A O no hydrogen 2.747 N/A GLN 210.A N VAL 42.A O no hydrogen 3.200 N/A SER 212.A N LEU 40.A O no hydrogen 2.735 N/A SER 212.A OG LEU 40.A O no hydrogen 3.030 N/A CYS 213.A N LYS 221.A O no hydrogen 2.996 N/A CYS 213.A SG TYR 223.A OH no hydrogen 3.076 N/A ILE 214.A N VAL 38.A O no hydrogen 2.962 N/A THR 215.A N GLY 219.A O no hydrogen 3.322 N/A LYS 216.A N TYR 145.A OH no hydrogen 2.765 N/A GLY 219.A N THR 215.A O no hydrogen 2.841 N/A PHE 220.A N ARG 64.A O no hydrogen 2.819 N/A LYS 221.A N CYS 213.A O no hydrogen 2.919 N/A TYR 223.A N LEU 211.A O no hydrogen 2.948 N/A TYR 223.A OH GLU 189.A OE1 no hydrogen 2.704 N/A GLU 226.A N GLU 226.A OE2 no hydrogen 2.860 N/A LYS 227.A N ASP 224.A O no hydrogen 3.073 N/A THR 228.A N ASP 224.A O no hydrogen 3.264 N/A THR 228.A OG1 ASP 224.A O no hydrogen 3.327 N/A ALA 229.A N ASN 225.A O no hydrogen 3.024 N/A ILE 232.A N THR 228.A O no hydrogen 2.926 N/A LYS 233.A N ALA 229.A O no hydrogen 3.033 N/A LYS 233.A NZ GLU 237.A OE2 no hydrogen 2.962 N/A GLU 234.A N GLU 230.A O no hydrogen 2.886 N/A LEU 235.A N LEU 231.A O no hydrogen 2.943 N/A LYS 236.A N ILE 232.A O no hydrogen 3.084 N/A GLU 237.A N LYS 233.A O no hydrogen 3.354 N/A LYS 238.A N GLU 234.A O no hydrogen 3.278 N/A GLU 239.A N LEU 235.A O no hydrogen 2.950 N/A ALA 240.A N LYS 236.A O no hydrogen 3.009 N/A