Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4y8d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N VAL 16.A O no hydrogen 2.858 N/A GLN 5.A N PHE 2.A O no hydrogen 3.462 N/A GLN 5.A NE2 ASP 1.A O no hydrogen 3.445 N/A VAL 7.A N LEU 14.A O no hydrogen 2.816 N/A LEU 9.A N LEU 12.A O no hydrogen 2.907 N/A LEU 12.A N LEU 9.A O no hydrogen 3.377 N/A ARG 13.A NH1 GLU 8.A OE1 no hydrogen 2.595 N/A LEU 14.A N VAL 7.A O no hydrogen 2.741 N/A ARG 15.A N GLN 32.A O no hydrogen 2.774 N/A VAL 16.A N GLN 5.A O no hydrogen 2.955 N/A ARG 17.A N GLU 30.A O no hydrogen 2.904 N/A ARG 17.A NH1 GLU 30.A OE2 no hydrogen 3.524 N/A ARG 18.A NE GLU 30.A OE2 no hydrogen 2.922 N/A ARG 18.A NH2 GLU 30.A OE1 no hydrogen 3.450 N/A LEU 20.A N VAL 28.A O no hydrogen 2.778 N/A ALA 21.A N VAL 28.A O no hydrogen 3.352 N/A PHE 27.A N ARG 44.A O no hydrogen 3.025 N/A VAL 28.A N ALA 21.A O no hydrogen 2.841 N/A TYR 29.A N LEU 42.A O no hydrogen 2.910 N/A GLU 30.A N ARG 18.A O no hydrogen 3.024 N/A ALA 31.A N TYR 40.A O no hydrogen 2.905 N/A GLN 32.A N ARG 15.A O no hydrogen 2.931 N/A GLN 32.A NE2 GLY 37.A O no hydrogen 3.257 N/A ASP 33.A N ARG 38.A O no hydrogen 2.853 N/A VAL 34.A N ARG 13.A O no hydrogen 3.012 N/A GLY 35.A N ASP 33.A OD1 no hydrogen 2.886 N/A SER 36.A N ASP 33.A OD1 no hydrogen 3.193 N/A GLY 37.A N ASP 33.A O no hydrogen 2.797 N/A ARG 38.A NE TYR 40.A OH no hydrogen 3.241 N/A ARG 38.A NH1 TYR 40.A OH no hydrogen 2.575 N/A TYR 40.A N ALA 31.A O no hydrogen 2.728 N/A ALA 41.A N THR 97.A O no hydrogen 2.950 N/A LEU 42.A N TYR 29.A O no hydrogen 2.971 N/A LYS 43.A N LEU 95.A O no hydrogen 2.877 N/A LYS 43.A NZ GLU 59.A OE2 no hydrogen 2.822 N/A ARG 44.A N PHE 27.A O no hydrogen 2.860 N/A ARG 44.A NH2 GLU 92.A OE1 no hydrogen 2.898 N/A LEU 45.A N PHE 93.A O no hydrogen 2.934 N/A LEU 46.A N PHE 25.A O no hydrogen 3.218 N/A SER 47.A N ALA 91.A O no hydrogen 2.878 N/A SER 47.A OG ASN 53.A OD1 no hydrogen 2.686 N/A GLU 49.A N SER 47.A OG no hydrogen 3.310 N/A ASN 53.A N GLU 49.A O no hydrogen 3.004 N/A ARG 54.A N GLU 50.A O no hydrogen 3.053 N/A ARG 54.A NH2.A GLU 51.A OE1 no hydrogen 2.601 N/A ALA 55.A N GLU 51.A O no hydrogen 3.198 N/A ILE 56.A N LYS 52.A O no hydrogen 2.867 N/A ILE 57.A N ASN 53.A O no hydrogen 2.921 N/A GLN 58.A N ARG 54.A O no hydrogen 2.952 N/A GLN 58.A NE2 GLN 58.A O no hydrogen 2.964 N/A GLU 59.A N ALA 55.A O no hydrogen 3.056 N/A VAL 60.A N ILE 56.A O no hydrogen 3.027 N/A CYS 61.A N ILE 57.A O no hydrogen 2.827 N/A CYS 61.A SG ILE 57.A O no hydrogen 3.262 N/A PHE 62.A N GLN 58.A O no hydrogen 2.922 N/A MET 63.A N GLU 59.A O no hydrogen 2.946 N/A LYS 64.A N VAL 60.A O no hydrogen 2.991 N/A LYS 65.A N CYS 61.A O no hydrogen 2.935 N/A LEU 66.A N PHE 62.A O no hydrogen 3.009 N/A SER 67.A N LYS 64.A O no hydrogen 3.453 N/A GLY 68.A N GLN 74.A OE1.B no hydrogen 2.913 N/A ASN 71.A N HIS 69.A ND1 no hydrogen 3.047 N/A ASN 71.A ND2 ILE 161.A O no hydrogen 3.247 N/A ILE 72.A N HIS 69.A O no hydrogen 3.137 N/A VAL 73.A N LEU 163.A O no hydrogen 3.260 N/A GLN 74.A N GLU 98.A OE2 no hydrogen 3.135 N/A PHE 75.A N SER 67.A OG no hydrogen 2.875 N/A CYS 76.A N LEU 96.A O no hydrogen 2.800 N/A CYS 76.A SG GLN 74.A OE1.A no hydrogen 3.491 N/A SER 77.A N LEU 96.A O no hydrogen 3.254 N/A ALA 79.A N LEU 94.A O no hydrogen 2.798 N/A ILE 81.A N GLU 92.A O no hydrogen 2.699 N/A GLU 85.A N GLY 82.A O no hydrogen 3.002 N/A SER 86.A N GLY 82.A O no hydrogen 3.315 N/A SER 86.A OG LYS 83.A O no hydrogen 3.359 N/A SER 86.A OG GLN 90.A O no hydrogen 2.567 N/A THR 88.A OG1 GLU 92.A OE2 no hydrogen 3.154 N/A GLY 89.A N SER 86.A OG no hydrogen 3.134 N/A GLN 90.A N THR 88.A OG1 no hydrogen 3.266 N/A ALA 91.A N SER 47.A O no hydrogen 2.834 N/A GLU 92.A N ILE 81.A O no hydrogen 2.782 N/A PHE 93.A N LEU 45.A O no hydrogen 2.871 N/A LEU 94.A N ALA 79.A O no hydrogen 2.687 N/A LEU 95.A N LYS 43.A O no hydrogen 2.886 N/A LEU 96.A N SER 77.A O no hydrogen 2.712 N/A THR 97.A N ALA 41.A O no hydrogen 2.958 N/A THR 97.A OG1 GLU 98.A O no hydrogen 2.912 N/A GLU 98.A N GLN 74.A O no hydrogen 3.023 N/A LYS 101.A N LEU 155.A O no hydrogen 2.881 N/A LEU 104.A N LEU 153.A O no hydrogen 3.003 N/A GLU 106.A N GLN 103.A O no hydrogen 2.986 N/A PHE 107.A N GLN 103.A O no hydrogen 3.476 N/A LEU 108.A N LEU 104.A O no hydrogen 3.067 N/A LYS 109.A N VAL 105.A O no hydrogen 2.953 N/A LYS 110.A N GLU 106.A O no hydrogen 3.229 N/A MET 111.A N LEU 108.A O no hydrogen 3.143 N/A GLU 112.A N LYS 109.A O no hydrogen 3.423 N/A ARG 114.A N MET 111.A O no hydrogen 2.864 N/A SER 118.A OG THR 121.A OG1 no hydrogen 2.875 N/A CYS 119.A SG GLN 213.A O no hydrogen 2.957 N/A THR 121.A N SER 118.A OG no hydrogen 3.258 N/A THR 121.A OG1 SER 118.A OG no hydrogen 2.875 N/A THR 121.A OG1 GLU 259.A OE2 no hydrogen 2.691 N/A VAL 122.A N SER 118.A O no hydrogen 3.072 N/A LEU 123.A N CYS 119.A O no hydrogen 2.803 N/A LYS 124.A N ASP 120.A O no hydrogen 3.014 N/A LYS 124.A NZ SER 255.A OG no hydrogen 3.182 N/A LYS 124.A NZ PRO 256.A O no hydrogen 3.130 N/A ILE 125.A N THR 121.A O no hydrogen 3.043 N/A PHE 126.A N VAL 122.A O no hydrogen 2.878 N/A TYR 127.A N LEU 123.A O no hydrogen 2.931 N/A GLN 128.A N LYS 124.A O no hydrogen 3.150 N/A GLN 128.A NE2 PRO 253.A O no hydrogen 2.924 N/A GLN 128.A NE2 SER 255.A O no hydrogen 2.919 N/A THR 129.A N ILE 125.A O no hydrogen 3.122 N/A THR 129.A OG1 ILE 125.A O no hydrogen 2.898 N/A CYS 130.A N PHE 126.A O no hydrogen 2.882 N/A CYS 130.A SG PHE 126.A O no hydrogen 3.316 N/A ARG 131.A N TYR 127.A O no hydrogen 2.776 N/A ALA 132.A N GLN 128.A O no hydrogen 3.226 N/A VAL 133.A N THR 129.A O no hydrogen 3.170 N/A GLN 134.A N CYS 130.A O no hydrogen 2.815 N/A HIS 135.A N ARG 131.A O no hydrogen 3.020 N/A MET 136.A N ALA 132.A O no hydrogen 3.325 N/A HIS 137.A N VAL 133.A O no hydrogen 3.003 N/A HIS 137.A NE2 ASP 187.A OD2 no hydrogen 2.759 N/A ARG 138.A N GLN 134.A O no hydrogen 3.013 N/A GLN 139.A N MET 136.A O no hydrogen 3.296 N/A GLN 139.A NE2 HIS 135.A O no hydrogen 3.058 N/A ILE 143.A N MET 136.A O no hydrogen 2.936 N/A ILE 144.A N THR 170.A O no hydrogen 2.912 N/A HIS 145.A N ASP 187.A OD2 no hydrogen 2.872 N/A HIS 145.A NE2 CYS 164.A O no hydrogen 3.215 N/A ARG 146.A N ASP 187.A OD1 no hydrogen 2.841 N/A ARG 146.A NE SER 168.A O no hydrogen 2.855 N/A ARG 146.A NH1 SER 168.A O no hydrogen 2.962 N/A ASP 147.A N HIS 145.A ND1 no hydrogen 3.071 N/A GLU 151.A N GLU 151.A OE1 no hydrogen 2.794 N/A ASN 152.A N LYS 149.A O no hydrogen 3.213 N/A ASN 152.A ND2.B ASP 147.A O no hydrogen 3.026 N/A LEU 154.A N LYS 162.A O no hydrogen 2.781 N/A LEU 155.A N GLY 102.A O no hydrogen 2.933 N/A SER 156.A N THR 160.A O no hydrogen 2.725 N/A SER 156.A OG GLN 158.A OE1 no hydrogen 3.358 N/A SER 156.A OG THR 160.A O no hydrogen 3.276 N/A SER 156.A OG THR 160.A OG1 no hydrogen 2.698 N/A GLN 158.A N SER 156.A OG no hydrogen 3.238 N/A GLY 159.A N SER 156.A O no hydrogen 2.902 N/A THR 160.A N SER 156.A OG no hydrogen 2.940 N/A THR 160.A OG1 SER 156.A OG no hydrogen 2.698 N/A ILE 161.A N GLN 128.A OE1 no hydrogen 2.927 N/A LYS 162.A N LEU 154.A O no hydrogen 2.746 N/A LYS 162.A NZ PRO 70.A O no hydrogen 3.426 N/A LYS 162.A NZ ILE 72.A O no hydrogen 3.469 N/A LYS 162.A NZ GLU 98.A OE2 no hydrogen 2.631 N/A LEU 163.A N ASN 71.A O no hydrogen 2.797 N/A CYS 164.A SG ASN 152.A O no hydrogen 3.844 N/A ALA 169.A N PHE 166.A O no hydrogen 3.219 N/A THR 170.A N ILE 144.A O no hydrogen 2.933 N/A THR 171.A OG1 PRO 142.A O no hydrogen 2.661 N/A PHE 180.A N SER 178.A OG no hydrogen 2.871 N/A ILE 182.A N GLU 184.A OE1 no hydrogen 2.943 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.962 N/A LYS 185.A NZ PRO 229.A O no hydrogen 2.864 N/A LYS 185.A NZ ARG 232.A O no hydrogen 2.787 N/A GLN 186.A N GLY 183.A O no hydrogen 2.943 N/A ILE 188.A N GLU 184.A O no hydrogen 3.284 N/A TRP 189.A N LYS 185.A O no hydrogen 3.140 N/A ALA 190.A N GLN 186.A O no hydrogen 3.154 N/A LEU 191.A N ASP 187.A O no hydrogen 2.906 N/A GLY 192.A N ILE 188.A O no hydrogen 2.915 N/A CYS 193.A N TRP 189.A O no hydrogen 3.154 N/A CYS 193.A SG TRP 189.A O no hydrogen 3.714 N/A CYS 193.A SG HIS 203.A NE2 no hydrogen 3.400 N/A ILE 194.A N ALA 190.A O no hydrogen 3.217 N/A LEU 195.A N LEU 191.A O no hydrogen 2.965 N/A TYR 196.A N GLY 192.A O no hydrogen 2.986 N/A TYR 196.A OH SER 206.A O no hydrogen 2.402 N/A LEU 197.A N CYS 193.A O no hydrogen 2.900 N/A LEU 198.A N ILE 194.A O no hydrogen 2.869 N/A CYS 199.A N LEU 195.A O no hydrogen 3.119 N/A CYS 199.A SG LEU 195.A O no hydrogen 3.530 N/A PHE 200.A N TYR 196.A O no hydrogen 2.915 N/A ARG 201.A N LEU 197.A O no hydrogen 2.742 N/A ARG 201.A NH1 GLU 112.A O no hydrogen 3.550 N/A ARG 201.A NH2 GLY 115.A O no hydrogen 3.144 N/A HIS 203.A ND1 PHE 205.A O no hydrogen 3.052 N/A PHE 205.A N HIS 203.A ND1 no hydrogen 3.200 N/A GLN 213.A N ASP 211.A OD1 no hydrogen 2.699 N/A TYR 214.A N ASP 211.A OD1 no hydrogen 3.029 N/A TYR 214.A N ASP 211.A OD2 no hydrogen 3.086 N/A TYR 214.A OH LEU 117.A O no hydrogen 2.535 N/A THR 215.A OG1 ASP 211.A O no hydrogen 2.709 N/A PHE 217.A N TYR 214.A O no hydrogen 2.754 N/A HIS 218.A N THR 215.A O no hydrogen 2.963 N/A HIS 218.A NE2 ASP 211.A OD2 no hydrogen 2.619 N/A LEU 220.A N PHE 217.A O no hydrogen 3.164 N/A ILE 221.A N PHE 217.A O no hydrogen 3.015 N/A ARG 222.A N HIS 218.A O no hydrogen 3.202 N/A ALA 223.A N SER 219.A O no hydrogen 2.967 N/A MET 224.A N LEU 220.A O no hydrogen 2.893 N/A LEU 225.A N ILE 221.A O no hydrogen 2.993 N/A GLU 230.A N ASN 228.A OD1 no hydrogen 2.974 N/A GLU 231.A N ASN 228.A O no hydrogen 3.097 N/A ARG 232.A N ASN 228.A O no hydrogen 2.987 N/A ARG 232.A NE GLN 226.A O no hydrogen 2.802 N/A ARG 232.A NH1 GLN 226.A O no hydrogen 2.879 N/A ARG 232.A NH2 LYS 185.A O no hydrogen 2.789 N/A LEU 233.A N ALA 223.A O no hydrogen 3.349 N/A SER 234.A N GLU 237.A OE1 no hydrogen 2.900 N/A GLU 237.A N SER 234.A OG no hydrogen 3.147 N/A VAL 238.A N SER 234.A O no hydrogen 3.048 N/A VAL 239.A N ILE 235.A O no hydrogen 2.901 N/A HIS 240.A N ALA 236.A O no hydrogen 3.035 N/A LEU 242.A N VAL 238.A O no hydrogen 2.996 N/A GLN 243.A N VAL 239.A O no hydrogen 2.918 N/A GLN 243.A NE2 TYR 127.A OH no hydrogen 3.282 N/A GLU 244.A N HIS 240.A O no hydrogen 3.117 N/A ILE 245.A N GLN 241.A O no hydrogen 2.968 N/A ALA 246.A N LEU 242.A O no hydrogen 2.949 N/A ALA 247.A N GLN 243.A O no hydrogen 3.062 N/A ALA 248.A N GLU 244.A O no hydrogen 3.066 N/A ARG 249.A N ILE 245.A O no hydrogen 3.119 N/A ARG 249.A NE ASP 120.A OD1 no hydrogen 3.034 N/A ASN 250.A N ALA 247.A O no hydrogen 3.010 N/A VAL 251.A N ALA 246.A O no hydrogen 2.967 N/A LYS 254.A N ASN 252.A OD1 no hydrogen 3.295 N/A SER 255.A N ASN 252.A O no hydrogen 3.108 N/A SER 255.A OG ASN 252.A O no hydrogen 2.680 N/A ILE 257.A N GLY 159.A O no hydrogen 2.923 N/A THR 258.A OG1 GLU 259.A OE1 no hydrogen 3.169 N/A GLU 259.A N GLU 259.A OE1 no hydrogen 2.565 N/A LEU 260.A N ILE 257.A O no hydrogen 3.003 N/A LEU 261.A N THR 258.A O no hydrogen 2.916 N/A