Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qlg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A N ASP 1.A OD1 no hydrogen 2.715 N/A ARG 7.A NH1 PRO 76.A O no hydrogen 2.931 N/A ARG 7.A NH2 GLU 74.A O no hydrogen 2.705 N/A ARG 7.A NH2 PRO 76.A O no hydrogen 3.477 N/A SER 9.A N PRO 6.A O no hydrogen 2.948 N/A SER 9.A OG PRO 6.A O no hydrogen 2.562 N/A ARG 11.A N THR 28.A O no hydrogen 2.852 N/A GLU 13.A N MET 26.A O no hydrogen 2.844 N/A VAL 14.A N MET 26.A O no hydrogen 3.165 N/A LYS 15.A NZ GLU 23.A OE2 no hydrogen 3.366 N/A LEU 16.A N VAL 24.A O no hydrogen 2.722 N/A GLY 19.A N GLY 22.A O no hydrogen 3.008 N/A GLU 23.A N THR 39.A O no hydrogen 3.221 N/A GLU 23.A N THR 39.A OG1 no hydrogen 3.094 N/A VAL 24.A N GLY 17.A O no hydrogen 3.015 N/A TRP 25.A N ILE 37.A O no hydrogen 2.600 N/A TRP 25.A NE1 GLU 23.A OE1 no hydrogen 2.771 N/A MET 26.A N VAL 14.A O no hydrogen 2.769 N/A GLY 27.A N VAL 35.A O no hydrogen 2.983 N/A THR 28.A N ARG 11.A O no hydrogen 2.878 N/A THR 28.A OG1 GLU 13.A OE2 no hydrogen 2.426 N/A TRP 29.A N THR 33.A O no hydrogen 2.921 N/A ASN 30.A N SER 9.A O no hydrogen 2.814 N/A THR 32.A N TRP 29.A O no hydrogen 3.364 N/A THR 32.A OG1 ASN 30.A O no hydrogen 3.341 N/A THR 32.A OG1 THR 33.A OG1 no hydrogen 3.287 N/A THR 33.A N TRP 29.A O no hydrogen 3.108 N/A THR 33.A OG1 TRP 29.A O no hydrogen 3.295 N/A THR 33.A OG1 THR 32.A OG1 no hydrogen 3.287 N/A ARG 34.A NH1 THR 28.A OG1 no hydrogen 3.420 N/A ARG 34.A NH2 GLU 13.A OE1 no hydrogen 2.860 N/A VAL 35.A N GLY 27.A O no hydrogen 2.953 N/A ALA 36.A N THR 81.A O no hydrogen 2.894 N/A ILE 37.A N TRP 25.A O no hydrogen 2.787 N/A LYS 38.A N ILE 79.A O no hydrogen 2.965 N/A LYS 38.A NZ GLU 53.A OE1 no hydrogen 2.953 N/A THR 39.A N GLU 23.A O no hydrogen 2.740 N/A LEU 40.A N ILE 77.A O no hydrogen 3.437 N/A LYS 41.A N PHE 21.A O no hydrogen 2.609 N/A THR 44.A N LYS 41.A O no hydrogen 2.994 N/A THR 44.A OG1 LYS 41.A O no hydrogen 2.698 N/A GLU 48.A N GLU 48.A OE1 no hydrogen 2.803 N/A PHE 50.A N SER 46.A O no hydrogen 2.910 N/A LEU 51.A N PRO 47.A O no hydrogen 2.900 N/A GLN 52.A N ALA 49.A O no hydrogen 3.231 N/A ALA 54.A N LEU 51.A O no hydrogen 3.000 N/A GLN 55.A N LEU 51.A O no hydrogen 2.959 N/A VAL 56.A N GLN 52.A O no hydrogen 3.341 N/A MET 57.A N GLU 53.A O no hydrogen 3.002 N/A LYS 58.A N GLN 55.A O no hydrogen 3.233 N/A LYS 59.A N VAL 56.A O no hydrogen 3.027 N/A LYS 59.A NZ GLN 55.A O no hydrogen 3.191 N/A ARG 61.A N TYR 119.A OH no hydrogen 3.316 N/A LYS 64.A N HIS 62.A ND1 no hydrogen 3.082 N/A LYS 64.A NZ GLN 112.A OE1 no hydrogen 2.611 N/A LEU 65.A N HIS 62.A O no hydrogen 2.830 N/A VAL 66.A N VAL 145.A O no hydrogen 3.171 N/A GLN 67.A N GLU 82.A OE2 no hydrogen 2.871 N/A GLN 67.A NE2 LEU 68.A O no hydrogen 3.456 N/A TYR 69.A N VAL 80.A O no hydrogen 2.906 N/A VAL 71.A N TRP 3.A O no hydrogen 2.800 N/A VAL 72.A N TYR 78.A O no hydrogen 2.942 N/A SER 73.A N GLU 4.A OE2 no hydrogen 2.984 N/A SER 73.A OG GLU 4.A OE2 no hydrogen 2.684 N/A TYR 78.A N VAL 72.A O no hydrogen 3.374 N/A ILE 79.A N LYS 38.A O no hydrogen 2.935 N/A VAL 80.A N ALA 70.A O no hydrogen 2.930 N/A THR 81.A N ALA 36.A O no hydrogen 3.011 N/A THR 81.A OG1 GLU 82.A O no hydrogen 2.889 N/A GLU 82.A N GLN 67.A O no hydrogen 3.090 N/A SER 85.A OG GLU 139.A OE1 no hydrogen 2.776 N/A LYS 86.A N VAL 137.A O no hydrogen 3.141 N/A LEU 89.A N ILE 135.A O no hydrogen 2.613 N/A ASP 91.A N SER 88.A OG no hydrogen 3.259 N/A PHE 92.A N SER 88.A O no hydrogen 3.120 N/A LEU 93.A N LEU 89.A O no hydrogen 2.900 N/A LYS 94.A N LEU 90.A O no hydrogen 3.399 N/A GLY 95.A N PHE 92.A O no hydrogen 3.353 N/A GLY 98.A N GLY 95.A O no hydrogen 2.960 N/A TYR 100.A N MET 97.A O no hydrogen 3.116 N/A LEU 101.A N GLY 98.A O no hydrogen 3.294 N/A ARG 102.A N GLN 105.A OE1 no hydrogen 2.941 N/A ARG 102.A NH1 LYS 99.A O no hydrogen 3.072 N/A ARG 102.A NH1 LEU 101.A O no hydrogen 3.135 N/A ARG 102.A NH1 ASN 258.A O no hydrogen 3.202 N/A LEU 103.A N LEU 259.A OXT no hydrogen 2.985 N/A LEU 106.A N ARG 102.A O no hydrogen 2.959 N/A VAL 107.A N LEU 103.A O no hydrogen 2.722 N/A ASP 108.A N PRO 104.A O no hydrogen 3.196 N/A MET 109.A N GLN 105.A O no hydrogen 3.166 N/A ALA 110.A N LEU 106.A O no hydrogen 3.064 N/A ALA 111.A N VAL 107.A O no hydrogen 3.035 N/A GLN 112.A N ASP 108.A O no hydrogen 3.309 N/A GLN 112.A NE2 ASP 108.A O no hydrogen 3.141 N/A GLN 112.A NE2 LEU 141.A O no hydrogen 3.180 N/A ILE 113.A N MET 109.A O no hydrogen 3.224 N/A ALA 114.A N ALA 110.A O no hydrogen 2.904 N/A SER 115.A N ALA 111.A O no hydrogen 2.782 N/A SER 115.A N GLN 112.A O no hydrogen 2.903 N/A GLY 116.A N GLN 112.A O no hydrogen 2.799 N/A MET 117.A N ILE 113.A O no hydrogen 2.739 N/A ALA 118.A N ALA 114.A O no hydrogen 2.847 N/A TYR 119.A N SER 115.A O no hydrogen 3.110 N/A VAL 120.A N GLY 116.A O no hydrogen 3.010 N/A GLU 121.A N MET 117.A O no hydrogen 2.767 N/A ARG 122.A N ALA 118.A O no hydrogen 2.841 N/A MET 123.A N TYR 119.A O no hydrogen 2.994 N/A ASN 124.A N GLU 121.A O no hydrogen 3.024 N/A TYR 125.A N VAL 120.A O no hydrogen 3.018 N/A HIS 127.A N ASP 170.A OD2 no hydrogen 2.632 N/A HIS 127.A NE2 ALA 146.A O no hydrogen 2.950 N/A ARG 128.A N ASP 170.A OD1 no hydrogen 2.937 N/A ASP 129.A N HIS 127.A ND1 no hydrogen 3.066 N/A ARG 131.A NE ASP 129.A OD1 no hydrogen 3.010 N/A ARG 131.A NH2 ASP 129.A OD2 no hydrogen 3.252 N/A ALA 132.A N GLU 180.A OE1 no hydrogen 2.967 N/A ASN 134.A N ARG 131.A O no hydrogen 2.823 N/A ASN 134.A ND2 ASP 129.A O no hydrogen 2.801 N/A ASN 134.A ND2 ASP 129.A OD2 no hydrogen 2.916 N/A ILE 135.A N ALA 132.A O no hydrogen 2.882 N/A LEU 136.A N LYS 144.A O no hydrogen 3.070 N/A VAL 137.A N GLY 87.A O no hydrogen 2.881 N/A GLY 138.A N VAL 142.A O no hydrogen 2.821 N/A CYS 143.A N GLN 112.A OE1 no hydrogen 2.934 N/A CYS 143.A SG LEU 141.A O no hydrogen 3.784 N/A LYS 144.A N LEU 136.A O no hydrogen 3.006 N/A LYS 144.A NZ GLU 82.A OE1 no hydrogen 2.863 N/A LYS 144.A NZ GLU 82.A OE2 no hydrogen 3.091 N/A VAL 145.A N LYS 64.A O no hydrogen 2.826 N/A ALA 146.A N ASN 134.A O no hydrogen 3.039 N/A LYS 153.A NZ MET 192.A O no hydrogen 3.221 N/A TRP 154.A N PRO 151.A O no hydrogen 2.889 N/A TRP 154.A NE1 GLU 180.A OE1 no hydrogen 2.836 N/A THR 155.A N ILE 152.A O no hydrogen 3.140 N/A THR 155.A OG1 PRO 151.A O no hydrogen 2.696 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.893 N/A ALA 159.A N ALA 156.A O no hydrogen 2.882 N/A ALA 160.A N ALA 156.A O no hydrogen 3.011 N/A LEU 161.A N PRO 157.A O no hydrogen 2.787 N/A TYR 162.A N GLU 158.A O no hydrogen 3.140 N/A ARG 164.A N GLU 158.A O no hydrogen 2.981 N/A PHE 165.A N GLY 163.A O no hydrogen 3.185 N/A THR 166.A N SER 169.A OG no hydrogen 2.939 N/A LYS 168.A N THR 166.A OG1 no hydrogen 3.205 N/A LYS 168.A NZ ARG 232.A O no hydrogen 2.692 N/A SER 169.A N THR 166.A O no hydrogen 3.037 N/A SER 169.A N THR 166.A OG1 no hydrogen 3.284 N/A SER 169.A OG THR 166.A O no hydrogen 2.882 N/A ASP 170.A N THR 166.A O no hydrogen 2.924 N/A VAL 171.A N ILE 167.A O no hydrogen 3.031 N/A TRP 172.A N LYS 168.A O no hydrogen 3.408 N/A SER 173.A N SER 169.A O no hydrogen 3.081 N/A SER 173.A OG TRP 154.A O no hydrogen 2.620 N/A SER 173.A OG SER 169.A O no hydrogen 3.390 N/A PHE 174.A N ASP 170.A O no hydrogen 2.952 N/A GLY 175.A N VAL 171.A O no hydrogen 2.922 N/A ILE 176.A N TRP 172.A O no hydrogen 2.979 N/A LEU 177.A N SER 173.A O no hydrogen 2.596 N/A LEU 178.A N PHE 174.A O no hydrogen 2.906 N/A THR 179.A N ILE 176.A O no hydrogen 3.095 N/A THR 179.A OG1 ILE 176.A O no hydrogen 2.628 N/A GLU 180.A N ILE 176.A O no hydrogen 3.435 N/A LEU 181.A N LEU 177.A O no hydrogen 3.103 N/A THR 182.A N LEU 178.A O no hydrogen 3.250 N/A THR 182.A N THR 179.A O no hydrogen 3.187 N/A THR 182.A OG1 LEU 178.A O no hydrogen 2.707 N/A THR 182.A OG1 THR 179.A O no hydrogen 3.185 N/A THR 183.A N THR 179.A O no hydrogen 2.855 N/A THR 183.A OG1 THR 179.A O no hydrogen 2.809 N/A LYS 184.A NZ GLY 98.A O no hydrogen 3.302 N/A LYS 184.A NZ LEU 101.A O no hydrogen 2.782 N/A LYS 184.A NZ ASN 258.A O no hydrogen 3.088 N/A GLY 185.A N GLU 180.A O no hydrogen 2.863 N/A ARG 186.A N THR 183.A OG1 no hydrogen 3.272 N/A MET 192.A N TYR 189.A O no hydrogen 2.957 N/A VAL 193.A N GLU 196.A OE2 no hydrogen 3.378 N/A GLU 196.A N VAL 193.A O no hydrogen 3.249 N/A VAL 197.A N VAL 193.A O no hydrogen 3.251 N/A LEU 198.A N ASN 194.A O no hydrogen 3.235 N/A ASP 199.A N ARG 195.A O no hydrogen 3.305 N/A GLN 200.A N GLU 196.A O no hydrogen 2.877 N/A VAL 201.A N VAL 197.A O no hydrogen 2.826 N/A GLU 202.A N LEU 198.A O no hydrogen 2.904 N/A ARG 203.A N ASP 199.A O no hydrogen 2.872 N/A GLY 204.A N VAL 201.A O no hydrogen 3.229 N/A TYR 205.A N GLN 200.A O no hydrogen 2.891 N/A ARG 206.A NE TRP 225.A O no hydrogen 2.948 N/A ARG 206.A NH1 VAL 201.A O no hydrogen 2.988 N/A ARG 206.A NH1 TYR 205.A O no hydrogen 2.771 N/A ARG 206.A NH2 TRP 225.A O no hydrogen 2.886 N/A CYS 209.A SG PRO 210.A O no hydrogen 3.505 N/A CYS 209.A SG CYS 213.A O no hydrogen 2.755 N/A CYS 213.A N PRO 210.A O no hydrogen 2.941 N/A CYS 213.A SG PRO 214.A O no hydrogen 3.386 N/A SER 216.A OG TYR 245.A OH no hydrogen 2.674 N/A SER 216.A OG GLU 250.A OE1 no hydrogen 2.265 N/A LEU 217.A N PRO 214.A O no hydrogen 3.193 N/A HIS 218.A N PRO 214.A O no hydrogen 3.466 N/A HIS 218.A NE2 MET 207.A O no hydrogen 2.972 N/A ASP 219.A N GLU 215.A O no hydrogen 2.794 N/A LEU 220.A N SER 216.A O no hydrogen 3.418 N/A MET 221.A N LEU 217.A O no hydrogen 2.968 N/A CYS 222.A N HIS 218.A O no hydrogen 2.831 N/A CYS 222.A SG HIS 218.A O no hydrogen 3.498 N/A GLN 223.A N ASP 219.A O no hydrogen 2.899 N/A CYS 224.A N LEU 220.A O no hydrogen 3.249 N/A CYS 224.A SG LEU 220.A O no hydrogen 3.245 N/A TRP 225.A N CYS 222.A O no hydrogen 3.200 N/A ARG 226.A N GLN 223.A O no hydrogen 3.335 N/A ARG 226.A NH1 GLU 231.A O no hydrogen 3.329 N/A GLU 230.A N ASP 228.A OD1 no hydrogen 3.240 N/A GLU 231.A N ASP 228.A O no hydrogen 2.859 N/A ARG 232.A NE LYS 168.A O no hydrogen 3.079 N/A ARG 232.A NH1 ARG 226.A O no hydrogen 2.513 N/A ARG 232.A NH2 GLU 158.A OE1 no hydrogen 3.418 N/A ARG 232.A NH2 LYS 168.A O no hydrogen 3.137 N/A PHE 235.A N GLU 121.A OE2 no hydrogen 2.994 N/A GLU 236.A N GLU 121.A OE1 no hydrogen 3.151 N/A TYR 237.A N THR 234.A OG1 no hydrogen 3.011 N/A LEU 238.A N THR 234.A O no hydrogen 2.901 N/A GLN 239.A N PHE 235.A O no hydrogen 2.634 N/A GLN 239.A NE2 GLU 243.A OE2 no hydrogen 2.668 N/A PHE 241.A N TYR 237.A O no hydrogen 2.966 N/A LEU 242.A N LEU 238.A O no hydrogen 3.169 N/A GLU 243.A N GLN 239.A O no hydrogen 3.056 N/A ASP 244.A N ALA 240.A O no hydrogen 3.018 N/A TYR 245.A N LEU 242.A O no hydrogen 3.427 N/A TYR 245.A OH SER 216.A OG no hydrogen 2.674 N/A THR 247.A N ASP 244.A O no hydrogen 2.997 N/A SER 248.A N ASP 244.A O no hydrogen 2.882 N/A SER 248.A OG ASP 244.A O no hydrogen 3.526 N/A THR 249.A N TYR 245.A O no hydrogen 2.934 N/A GLU 250.A N TYR 245.A O no hydrogen 2.954 N/A TYR 253.A OH LEU 259.A O no hydrogen 3.330 N/A TYR 253.A OH LEU 259.A OXT no hydrogen 2.418 N/A GLY 256.A N LEU 259.A O no hydrogen 2.847 N/A ASN 258.A N GLU 212.A OE1 no hydrogen 3.176 N/A ASN 258.A ND2 GLU 212.A OE2 no hydrogen 3.535 N/A LEU 259.A N GLU 212.A OE1 no hydrogen 3.469 N/A