Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2d5r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE SER 83.A OG no hydrogen 3.230 N/A ARG 1.A NH2 SER 83.A OG no hydrogen 3.128 N/A CYS 3.A N THR 84.A O no hydrogen 2.885 N/A CYS 3.A SG GLU 4.A O no hydrogen 3.644 N/A VAL 5.A N GLN 86.A O no hydrogen 2.750 N/A TRP 6.A N ASN 9.A OD1 no hydrogen 2.779 N/A ALA 7.A N GLU 119.A O no hydrogen 3.025 N/A CYS 8.A SG ASN 9.A OD1 no hydrogen 3.847 N/A ASN 9.A ND2 GLU 4.A O no hydrogen 3.290 N/A LEU 10.A N ALA 7.A O no hydrogen 3.154 N/A GLU 13.A N ASN 9.A O no hydrogen 3.147 N/A MET 14.A N LEU 10.A O no hydrogen 2.845 N/A LYS 15.A N ASP 11.A O no hydrogen 3.056 N/A LYS 16.A NZ GLU 13.A OE2 no hydrogen 3.435 N/A ILE 17.A N GLU 13.A O no hydrogen 2.875 N/A ARG 18.A N MET 14.A O no hydrogen 2.624 N/A GLN 19.A N LYS 16.A O no hydrogen 2.828 N/A VAL 20.A N LYS 16.A O no hydrogen 2.811 N/A ILE 21.A N ILE 17.A O no hydrogen 3.059 N/A ARG 22.A N GLN 19.A O no hydrogen 2.935 N/A LYS 23.A N VAL 20.A O no hydrogen 3.204 N/A TYR 24.A N VAL 20.A O no hydrogen 2.902 N/A TYR 26.A N MET 72.A O no hydrogen 2.859 N/A TYR 26.A OH GLU 74.A OE1 no hydrogen 3.106 N/A VAL 27.A N LYS 142.A O no hydrogen 2.910 N/A ALA 28.A N THR 70.A O no hydrogen 2.864 N/A MET 29.A N LEU 144.A O no hydrogen 2.847 N/A ASP 30.A N GLY 68.A O no hydrogen 3.102 N/A THR 31.A N ASP 30.A OD1 no hydrogen 3.050 N/A THR 31.A OG1 ASP 151.A OD1 no hydrogen 2.511 N/A GLU 32.A N GLN 66.A O no hydrogen 2.926 N/A GLY 35.A N PHE 33.A O no hydrogen 2.809 N/A ARG 45.A N ASP 49.A OD2 no hydrogen 2.981 N/A ARG 45.A NH1 GLU 167.A OE1 no hydrogen 3.396 N/A ARG 45.A NH2 GLU 167.A OE1 no hydrogen 3.156 N/A ASP 49.A N SER 46.A OG no hydrogen 3.281 N/A TYR 50.A N SER 46.A O no hydrogen 2.985 N/A GLN 51.A N ASN 47.A O no hydrogen 2.984 N/A TYR 52.A N ALA 48.A O no hydrogen 2.987 N/A TYR 52.A OH PRO 165.A O no hydrogen 2.531 N/A GLN 53.A N ASP 49.A O no hydrogen 2.811 N/A GLN 53.A NE2 ASP 49.A OD1 no hydrogen 3.076 N/A GLN 53.A NE2 GLU 166.A O no hydrogen 3.033 N/A LEU 54.A N TYR 50.A O no hydrogen 2.848 N/A LEU 55.A N GLN 51.A O no hydrogen 3.027 N/A ARG 56.A N TYR 52.A O no hydrogen 2.758 N/A ARG 56.A NE GLN 53.A OE1 no hydrogen 2.928 N/A ARG 56.A NH2 GLN 53.A OE1 no hydrogen 2.923 N/A CYS 57.A N GLN 53.A O no hydrogen 3.067 N/A CYS 57.A SG GLN 53.A O no hydrogen 3.695 N/A CYS 57.A SG LEU 54.A O no hydrogen 3.419 N/A CYS 57.A SG ASN 58.A OD1 no hydrogen 3.515 N/A ASN 58.A N LEU 55.A O no hydrogen 3.057 N/A VAL 59.A N LEU 55.A O no hydrogen 2.769 N/A ASP 60.A N ARG 56.A O no hydrogen 2.982 N/A LEU 61.A N ASN 58.A O no hydrogen 3.157 N/A LEU 62.A N ASN 58.A O no hydrogen 3.082 N/A LYS 63.A NZ LYS 90.A O no hydrogen 3.266 N/A LYS 63.A NZ ASP 96.A OD1 no hydrogen 3.539 N/A LYS 63.A NZ ASP 96.A OD2 no hydrogen 3.266 N/A ILE 65.A N GLU 32.A O no hydrogen 2.772 N/A GLN 66.A N GLU 32.A O no hydrogen 3.038 N/A GLN 66.A NE2 ASN 88.A OD1 no hydrogen 2.812 N/A GLN 66.A NE2 GLN 216.A OE1 no hydrogen 3.259 N/A LEU 67.A N PHE 87.A O no hydrogen 2.939 N/A GLY 68.A N ASP 30.A O no hydrogen 2.843 N/A LEU 69.A N TRP 85.A O no hydrogen 2.903 N/A THR 70.A N ALA 28.A O no hydrogen 2.921 N/A THR 70.A OG1 THR 84.A OG1 no hydrogen 2.695 N/A THR 70.A OG1 SER 221.A OG no hydrogen 2.850 N/A PHE 71.A N SER 83.A O no hydrogen 2.834 N/A MET 72.A N TYR 26.A O no hydrogen 2.711 N/A ASN 73.A N GLU 77.A O no hydrogen 3.082 N/A ASN 73.A ND2 GLU 77.A OE1 no hydrogen 3.212 N/A GLN 75.A N ASN 73.A OD1 no hydrogen 3.034 N/A GLN 75.A NE2 ASN 73.A OD1 no hydrogen 3.348 N/A GLY 76.A N ASN 73.A O no hydrogen 2.876 N/A GLU 77.A N ASN 73.A OD1 no hydrogen 2.783 N/A SER 83.A N ARG 1.A O no hydrogen 3.184 N/A SER 83.A OG THR 84.A OG1 no hydrogen 3.346 N/A THR 84.A N ARG 1.A O no hydrogen 3.071 N/A THR 84.A OG1 THR 70.A OG1 no hydrogen 2.695 N/A THR 84.A OG1 SER 83.A OG no hydrogen 3.346 N/A TRP 85.A N LEU 69.A O no hydrogen 2.720 N/A TRP 85.A NE1 GLU 13.A OE1 no hydrogen 2.928 N/A GLN 86.A N CYS 3.A O no hydrogen 2.992 N/A PHE 87.A N LEU 67.A O no hydrogen 2.792 N/A ASN 88.A N VAL 5.A O no hydrogen 2.959 N/A ASN 88.A ND2 GLU 4.A OE1 no hydrogen 3.361 N/A ASN 88.A ND2 VAL 5.A O no hydrogen 3.224 N/A PHE 89.A N ILE 65.A O no hydrogen 3.111 N/A LYS 90.A N ILE 121.A O no hydrogen 2.895 N/A LYS 90.A NZ GLU 117.A O no hydrogen 3.269 N/A LYS 90.A NZ GLY 120.A O no hydrogen 3.507 N/A ASN 92.A N ASP 96.A OD2 no hydrogen 2.530 N/A THR 94.A N ASN 92.A OD1 no hydrogen 2.652 N/A GLU 95.A N ASN 92.A O no hydrogen 3.148 N/A GLU 95.A N ASN 92.A OD1 no hydrogen 2.884 N/A ASP 96.A N ASN 92.A O no hydrogen 2.707 N/A ALA 99.A N PRO 34.A O no hydrogen 2.944 N/A GLN 100.A NE2 GLU 104.A OE1 no hydrogen 3.213 N/A SER 102.A OG ASP 101.A OD1 no hydrogen 3.144 N/A ILE 103.A N ALA 99.A O no hydrogen 3.193 N/A GLU 104.A N GLN 100.A O no hydrogen 3.082 N/A LEU 105.A N ASP 101.A O no hydrogen 2.765 N/A LEU 106.A N SER 102.A O no hydrogen 2.933 N/A THR 107.A N ILE 103.A O no hydrogen 2.875 N/A THR 107.A OG1 ILE 103.A O no hydrogen 2.752 N/A THR 108.A N GLU 104.A O no hydrogen 3.046 N/A THR 108.A OG1 GLU 104.A O no hydrogen 3.070 N/A SER 109.A N LEU 105.A O no hydrogen 3.082 N/A SER 109.A N LEU 106.A O no hydrogen 3.115 N/A SER 109.A OG LEU 105.A O no hydrogen 3.067 N/A GLY 110.A N THR 107.A O no hydrogen 3.171 N/A ILE 111.A N LEU 106.A O no hydrogen 3.119 N/A HIS 116.A N GLN 112.A O no hydrogen 3.141 N/A HIS 116.A ND1 PHE 89.A O no hydrogen 2.854 N/A GLU 117.A N PHE 113.A O no hydrogen 2.787 N/A GLU 118.A N LYS 114.A O no hydrogen 3.154 N/A GLU 119.A N LYS 115.A O no hydrogen 2.733 N/A GLY 120.A N HIS 116.A O no hydrogen 2.924 N/A ILE 121.A N ASN 88.A O no hydrogen 2.816 N/A TYR 125.A OH ASP 11.A OD2 no hydrogen 3.118 N/A PHE 126.A N GLU 122.A O no hydrogen 2.934 N/A ALA 127.A N THR 123.A O no hydrogen 2.704 N/A GLU 128.A N GLN 124.A O no hydrogen 3.398 N/A LEU 129.A N TYR 125.A O no hydrogen 3.051 N/A LEU 130.A N PHE 126.A O no hydrogen 2.830 N/A MET 131.A N ALA 127.A O no hydrogen 3.081 N/A THR 132.A N GLU 128.A O no hydrogen 2.947 N/A THR 132.A OG1 GLU 128.A O no hydrogen 3.280 N/A THR 132.A OG1 LEU 129.A O no hydrogen 3.491 N/A SER 133.A OG LEU 129.A O no hydrogen 2.932 N/A LYS 142.A N ASN 25.A O no hydrogen 3.094 N/A TRP 143.A N VAL 181.A O no hydrogen 2.950 N/A LEU 144.A N VAL 27.A O no hydrogen 3.058 N/A SER 145.A N TYR 183.A O no hydrogen 2.871 N/A SER 145.A OG SER 148.A OG no hydrogen 2.748 N/A HIS 147.A N ASP 184.A OD2 no hydrogen 2.827 N/A SER 148.A N ASP 184.A OD1 no hydrogen 3.068 N/A SER 148.A OG SER 145.A OG no hydrogen 2.748 N/A SER 148.A OG ASP 184.A OD1 no hydrogen 2.980 N/A PHE 152.A N SER 148.A O no hydrogen 2.942 N/A GLY 153.A N GLY 149.A O no hydrogen 2.972 N/A TYR 154.A N TYR 150.A O no hydrogen 2.773 N/A LEU 155.A N ASP 151.A O no hydrogen 3.246 N/A ILE 156.A N PHE 152.A O no hydrogen 2.865 N/A LYS 157.A N GLY 153.A O no hydrogen 3.011 N/A LYS 157.A NZ VAL 59.A O no hydrogen 3.124 N/A LYS 157.A NZ ASP 60.A O no hydrogen 3.561 N/A LYS 157.A NZ LEU 62.A O no hydrogen 2.783 N/A ILE 158.A N TYR 154.A O no hydrogen 3.110 N/A LEU 159.A N LEU 155.A O no hydrogen 2.893 N/A THR 160.A N ILE 156.A O no hydrogen 3.037 N/A THR 160.A OG1 ILE 156.A O no hydrogen 2.773 N/A THR 160.A OG1 SER 162.A OG no hydrogen 3.331 N/A ASN 161.A N ILE 158.A O no hydrogen 3.064 N/A SER 162.A N LYS 157.A O no hydrogen 3.336 N/A SER 162.A OG THR 160.A OG1 no hydrogen 3.331 N/A SER 162.A OG ASN 163.A O no hydrogen 3.397 N/A LEU 164.A N ASP 60.A OD1 no hydrogen 2.913 N/A PHE 171.A N GLU 167.A O no hydrogen 3.205 N/A PHE 172.A N GLU 168.A O no hydrogen 3.215 N/A GLU 173.A N LEU 169.A O no hydrogen 3.105 N/A ILE 174.A N ASP 170.A O no hydrogen 3.095 N/A LEU 175.A N PHE 171.A O no hydrogen 2.796 N/A ARG 176.A N PHE 172.A O no hydrogen 3.011 N/A ARG 176.A NH1 GLU 173.A OE2 no hydrogen 3.084 N/A LEU 177.A N GLU 173.A O no hydrogen 3.310 N/A PHE 178.A N ILE 174.A O no hydrogen 3.304 N/A PHE 179.A N LEU 175.A O no hydrogen 2.683 N/A TYR 183.A N TRP 143.A O no hydrogen 2.775 N/A TYR 183.A OH ASP 242.A OD2 no hydrogen 2.740 N/A VAL 185.A N SER 145.A O no hydrogen 2.574 N/A LYS 186.A N ASP 184.A OD2 no hydrogen 3.115 N/A LYS 186.A NZ GLY 197.A O no hydrogen 2.944 N/A LEU 188.A N ASP 184.A O no hydrogen 2.991 N/A MET 189.A N VAL 185.A O no hydrogen 2.928 N/A LYS 190.A N TYR 187.A O no hydrogen 2.976 N/A SER 191.A N LEU 188.A O no hydrogen 3.001 N/A SER 191.A OG TYR 245.A OH no hydrogen 2.556 N/A CYS 192.A N MET 189.A O no hydrogen 3.118 N/A CYS 192.A SG LEU 188.A O no hydrogen 3.625 N/A LEU 195.A N CYS 192.A O no hydrogen 2.949 N/A LYS 196.A N GLN 205.A OE1 no hydrogen 3.159 N/A VAL 202.A N GLY 198.A O no hydrogen 3.037 N/A ALA 203.A N LEU 199.A O no hydrogen 2.892 N/A GLU 204.A N GLN 200.A O no hydrogen 3.203 N/A GLN 205.A N GLU 201.A O no hydrogen 2.985 N/A LEU 206.A N VAL 202.A O no hydrogen 2.824 N/A GLU 207.A N GLU 204.A O no hydrogen 3.073 N/A LEU 208.A N ALA 203.A O no hydrogen 2.816 N/A ARG 210.A NE LEU 208.A O no hydrogen 2.987 N/A GLN 214.A NE2 GLN 200.A OE1 no hydrogen 3.192 N/A HIS 215.A N PRO 213.A O no hydrogen 2.486 N/A GLN 216.A N PRO 213.A O no hydrogen 3.217 N/A GLN 216.A NE2 SER 109.A O no hydrogen 2.746 N/A ALA 217.A N GLN 66.A OE1 no hydrogen 2.886 N/A SER 219.A OG ILE 211.A O no hydrogen 3.188 N/A SER 219.A OG PRO 213.A O no hydrogen 3.328 N/A ASP 220.A N GLN 216.A O no hydrogen 2.953 N/A SER 221.A N ALA 217.A O no hydrogen 2.978 N/A SER 221.A OG THR 70.A OG1 no hydrogen 2.850 N/A SER 221.A OG ALA 217.A O no hydrogen 3.451 N/A SER 221.A OG GLY 218.A O no hydrogen 2.615 N/A LEU 222.A N GLY 218.A O no hydrogen 3.199 N/A LEU 223.A N SER 219.A O no hydrogen 3.342 N/A THR 224.A N ASP 220.A O no hydrogen 2.898 N/A THR 224.A OG1 ASP 220.A O no hydrogen 3.153 N/A GLY 225.A N SER 221.A O no hydrogen 3.035 N/A MET 226.A N LEU 222.A O no hydrogen 3.036 N/A ALA 227.A N LEU 223.A O no hydrogen 2.776 N/A PHE 228.A N THR 224.A O no hydrogen 2.830 N/A PHE 229.A N GLY 225.A O no hydrogen 3.237 N/A LYS 230.A N MET 226.A O no hydrogen 3.152 N/A LYS 230.A NZ LEU 206.A O no hydrogen 2.634 N/A MET 231.A N ALA 227.A O no hydrogen 2.928 N/A ARG 232.A N PHE 228.A O no hydrogen 2.700 N/A ARG 232.A NH1 GLU 74.A O no hydrogen 3.486 N/A ARG 232.A NH1 GLU 233.A OE1 no hydrogen 3.212 N/A ARG 232.A NH2 GLU 74.A O no hydrogen 2.823 N/A GLU 233.A N PHE 229.A O no hydrogen 3.305 N/A GLU 233.A N LYS 230.A O no hydrogen 3.081 N/A MET 234.A N LYS 230.A O no hydrogen 2.879 N/A PHE 235.A N MET 231.A O no hydrogen 2.950 N/A PHE 236.A N MET 231.A O no hydrogen 3.212 N/A ASP 238.A N ARG 232.A O no hydrogen 2.967 N/A ASP 238.A N PHE 236.A O no hydrogen 2.501 N/A ALA 243.A N ASP 241.A OD2 no hydrogen 3.303 N/A LYS 244.A N ASP 241.A O no hydrogen 3.123 N/A LYS 244.A NZ TYR 245.A OH no hydrogen 3.037 N/A TYR 245.A N ASP 241.A O no hydrogen 2.906 N/A TYR 245.A OH SER 191.A OG no hydrogen 2.556 N/A CYS 246.A N ASP 242.A O no hydrogen 3.014 N/A CYS 246.A SG PRO 180.A O no hydrogen 3.614 N/A GLY 247.A N ILE 182.A O no hydrogen 2.938 N/A HIS 248.A N TYR 245.A O no hydrogen 3.407 N/A TYR 250.A N ASP 184.A OD1 no hydrogen 2.762 N/A LEU 252.A N LEU 249.A O no hydrogen 3.251 N/A