Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qrd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N ASP 95.A OD1 no hydrogen 3.290 N/A ARG 3.A NH1 GLU 35.A OE2 no hydrogen 2.708 N/A ARG 4.A N ASP 95.A OD2 no hydrogen 2.929 N/A ALA 5.A N GLU 35.A O no hydrogen 2.896 N/A LEU 6.A N LEU 96.A O no hydrogen 3.021 N/A ILE 7.A N VAL 37.A O no hydrogen 2.961 N/A VAL 8.A N ILE 98.A O no hydrogen 3.000 N/A LEU 9.A N SER 39.A O no hydrogen 3.165 N/A ALA 10.A N GLN 100.A O no hydrogen 3.181 N/A GLU 13.A N HIS 11.A ND1 no hydrogen 3.489 N/A SER 16.A N GLU 13.A O no hydrogen 3.396 N/A SER 16.A OG GLU 13.A O no hydrogen 3.050 N/A ASN 18.A ND2 THR 147.A OG1 no hydrogen 2.763 N/A TYR 19.A N SER 16.A OG no hydrogen 2.974 N/A ALA 20.A N SER 16.A O no hydrogen 3.116 N/A MET 21.A N PHE 17.A O no hydrogen 2.757 N/A LYS 22.A N ASN 18.A O no hydrogen 3.216 N/A LYS 22.A NZ GLU 38.A OE1 no hydrogen 3.343 N/A GLU 23.A N TYR 19.A O no hydrogen 3.151 N/A ALA 24.A N ALA 20.A O no hydrogen 2.988 N/A ALA 25.A N MET 21.A O no hydrogen 3.238 N/A VAL 26.A N LYS 22.A O no hydrogen 3.158 N/A GLU 27.A N GLU 23.A O no hydrogen 3.340 N/A ALA 28.A N ALA 24.A O no hydrogen 2.977 N/A LEU 29.A N ALA 25.A O no hydrogen 3.302 N/A LYS 30.A N VAL 26.A O no hydrogen 2.879 N/A LYS 31.A N GLU 27.A O no hydrogen 3.055 N/A LYS 31.A NZ GLU 27.A OE2 no hydrogen 3.203 N/A LYS 32.A N LEU 29.A O no hydrogen 3.258 N/A GLY 33.A N LYS 30.A O no hydrogen 3.049 N/A TRP 34.A N LEU 29.A O no hydrogen 2.942 N/A GLU 35.A N ARG 3.A O no hydrogen 2.984 N/A VAL 37.A N ALA 5.A O no hydrogen 2.896 N/A SER 39.A N ILE 7.A O no hydrogen 2.898 N/A SER 39.A OG GLU 87.A OE1 no hydrogen 2.997 N/A LEU 41.A N LEU 9.A O no hydrogen 3.249 N/A ALA 43.A N ASP 40.A OD1 no hydrogen 3.484 N/A MET 44.A N ASP 40.A O no hydrogen 3.005 N/A MET 44.A N LEU 41.A O no hydrogen 3.212 N/A ASN 45.A N TYR 42.A O no hydrogen 2.925 N/A PHE 46.A N LEU 41.A O no hydrogen 3.233 N/A SER 51.A N ASP 54.A OD2 no hydrogen 3.391 N/A ASN 53.A N SER 51.A OG no hydrogen 3.168 N/A ASP 54.A N SER 51.A O no hydrogen 3.050 N/A ILE 55.A N ARG 52.A O no hydrogen 3.204 N/A THR 56.A N ARG 79.A O no hydrogen 2.698 N/A LYS 60.A N GLU 70.A OE1 no hydrogen 3.031 N/A ASP 61.A N GLU 70.A OE2 no hydrogen 3.117 N/A ASN 64.A N ASP 61.A OD1 no hydrogen 3.127 N/A GLN 66.A NE2 ASN 64.A OD1 no hydrogen 3.176 N/A TYR 67.A OH ASP 54.A OD2 no hydrogen 2.615 N/A GLU 70.A N GLN 66.A O no hydrogen 3.255 N/A SER 71.A N TYR 67.A O no hydrogen 3.070 N/A SER 71.A OG TYR 67.A O no hydrogen 2.685 N/A SER 72.A N PRO 68.A O no hydrogen 3.315 N/A SER 72.A OG PRO 68.A O no hydrogen 2.915 N/A SER 72.A OG VAL 69.A O no hydrogen 3.179 N/A LEU 73.A N VAL 69.A O no hydrogen 3.267 N/A ALA 74.A N GLU 70.A O no hydrogen 2.962 N/A TYR 75.A N SER 71.A O no hydrogen 2.915 N/A LYS 76.A N SER 72.A O no hydrogen 2.840 N/A GLU 77.A N LEU 73.A O no hydrogen 2.851 N/A GLY 78.A N TYR 75.A O no hydrogen 3.310 N/A ARG 79.A N ALA 74.A O no hydrogen 2.859 N/A ARG 79.A NE GLU 77.A OE1 no hydrogen 3.182 N/A ARG 79.A NH1 THR 56.A O no hydrogen 2.794 N/A ARG 79.A NH2 GLU 77.A OE1 no hydrogen 3.293 N/A SER 81.A N ASP 54.A O no hydrogen 2.843 N/A SER 81.A OG ASP 83.A OD1 no hydrogen 2.969 N/A VAL 85.A N SER 81.A O no hydrogen 3.195 N/A ALA 86.A N PRO 82.A O no hydrogen 3.288 N/A GLU 87.A N ASP 83.A O no hydrogen 3.469 N/A GLN 88.A N ILE 84.A O no hydrogen 3.008 N/A GLN 88.A NE2 VAL 119.A O no hydrogen 3.063 N/A LYS 89.A N VAL 85.A O no hydrogen 3.028 N/A LYS 90.A N ALA 86.A O no hydrogen 3.374 N/A LYS 90.A NZ GLU 38.A O no hydrogen 3.024 N/A LYS 90.A NZ GLU 87.A OE2 no hydrogen 3.015 N/A LEU 91.A N GLU 87.A O no hydrogen 3.163 N/A GLU 92.A N GLN 88.A O no hydrogen 2.976 N/A ALA 93.A N LYS 89.A O no hydrogen 3.207 N/A ALA 93.A N LYS 90.A O no hydrogen 3.126 N/A ALA 94.A N LYS 90.A O no hydrogen 3.177 N/A ALA 94.A N LEU 91.A O no hydrogen 3.170 N/A ASP 95.A N ARG 4.A O no hydrogen 2.807 N/A LEU 96.A N ARG 4.A O no hydrogen 3.175 N/A VAL 97.A N LYS 141.A O no hydrogen 3.162 N/A ILE 98.A N LEU 6.A O no hydrogen 3.062 N/A PHE 99.A N LEU 143.A O no hydrogen 3.114 N/A GLN 100.A N VAL 8.A O no hydrogen 2.990 N/A GLN 100.A NE2 ASN 18.A OD1 no hydrogen 2.795 N/A PHE 101.A N SER 145.A O no hydrogen 3.078 N/A LEU 103.A N THR 147.A O no hydrogen 2.912 N/A TYR 104.A N GLY 107.A O no hydrogen 2.988 N/A GLY 107.A N TYR 104.A O no hydrogen 3.011 N/A LYS 113.A N PRO 109.A O no hydrogen 3.004 N/A LYS 113.A NZ GLU 117.A OE2 no hydrogen 3.069 N/A GLY 114.A N ALA 110.A O no hydrogen 2.937 N/A TRP 115.A N ILE 111.A O no hydrogen 3.305 N/A TRP 115.A N LEU 112.A O no hydrogen 3.144 N/A TRP 115.A NE1 GLU 87.A OE1 no hydrogen 2.946 N/A PHE 116.A N LEU 112.A O no hydrogen 3.229 N/A GLU 117.A N LYS 113.A O no hydrogen 3.126 N/A ARG 118.A N GLY 114.A O no hydrogen 3.030 N/A ARG 118.A NE ASN 47.A O no hydrogen 2.843 N/A ARG 118.A NH1 ASP 54.A OD1 no hydrogen 3.184 N/A ARG 118.A NH1 ASP 83.A OD1 no hydrogen 3.535 N/A ARG 118.A NH1 ASP 83.A OD2 no hydrogen 3.477 N/A ARG 118.A NH2 ASN 47.A O no hydrogen 2.640 N/A ARG 118.A NH2 ASP 83.A OD2 no hydrogen 2.829 N/A VAL 119.A N TRP 115.A O no hydrogen 2.883 N/A LEU 120.A N PHE 116.A O no hydrogen 3.314 N/A GLY 123.A N TYR 126.A O no hydrogen 2.691 N/A PHE 124.A N VAL 121.A O no hydrogen 2.803 N/A ALA 125.A N VAL 121.A O no hydrogen 2.797 N/A THR 130.A N THR 127.A O no hydrogen 3.315 N/A TYR 132.A N PHE 178.A O no hydrogen 3.036 N/A LYS 134.A N MET 131.A O no hydrogen 3.419 N/A LYS 134.A NZ ALA 129.A O no hydrogen 3.404 N/A GLY 135.A N TYR 132.A O no hydrogen 3.136 N/A PHE 137.A N CYS 179.A O no hydrogen 2.902 N/A GLN 138.A N GLY 135.A O no hydrogen 3.196 N/A LYS 140.A N PHE 137.A O no hydrogen 3.167 N/A LYS 140.A NZ LEU 91.A O no hydrogen 3.363 N/A LYS 140.A NZ GLU 92.A O no hydrogen 3.330 N/A LYS 140.A NZ ALA 94.A O no hydrogen 3.167 N/A LYS 141.A N ASP 95.A O no hydrogen 3.198 N/A LYS 141.A NZ TRP 215.A O no hydrogen 2.886 N/A THR 142.A N GLN 182.A O no hydrogen 2.995 N/A THR 142.A OG1 VAL 97.A O no hydrogen 2.956 N/A LEU 143.A N VAL 97.A O no hydrogen 3.383 N/A SER 145.A N PHE 99.A O no hydrogen 2.919 N/A SER 145.A OG GLN 100.A OE1 no hydrogen 2.817 N/A ILE 146.A N GLN 187.A O no hydrogen 2.940 N/A THR 147.A N PHE 101.A O no hydrogen 3.410 N/A THR 148.A N VAL 189.A O no hydrogen 3.138 N/A TYR 155.A N GLY 152.A O no hydrogen 3.423 N/A SER 156.A N SER 153.A O no hydrogen 3.415 N/A SER 156.A OG SER 153.A O no hydrogen 2.729 N/A GLY 159.A N SER 156.A O no hydrogen 3.116 N/A HIS 161.A N MET 154.A O no hydrogen 2.947 N/A GLY 162.A N GLY 159.A O no hydrogen 2.971 N/A MET 164.A N TYR 155.A O no hydrogen 3.159 N/A ASN 165.A N ASP 163.A OD1 no hydrogen 3.220 N/A ASN 165.A ND2 ASP 163.A OD1 no hydrogen 3.179 N/A ASN 165.A ND2 ASP 266.A OD1 no hydrogen 3.128 N/A VAL 166.A N ASP 163.A O no hydrogen 2.913 N/A LEU 168.A N MET 164.A O no hydrogen 3.198 N/A GLN 172.A N LEU 168.A O no hydrogen 2.899 N/A SER 173.A N TRP 169.A O no hydrogen 2.980 N/A ILE 175.A N ILE 171.A O no hydrogen 3.198 N/A LEU 176.A N ILE 171.A O no hydrogen 3.313 N/A ARG 177.A N GLN 172.A O no hydrogen 3.033 N/A ARG 177.A NH1 PHE 181.A O no hydrogen 2.793 N/A PHE 178.A N SER 173.A O no hydrogen 2.902 N/A CYS 179.A N LEU 176.A O no hydrogen 3.301 N/A CYS 179.A SG ILE 175.A O no hydrogen 3.451 N/A GLY 180.A N ARG 177.A O no hydrogen 2.790 N/A PHE 181.A N LEU 176.A O no hydrogen 3.212 N/A GLN 182.A N LYS 140.A O no hydrogen 3.075 N/A LEU 184.A N THR 142.A O no hydrogen 2.885 N/A GLN 187.A N LEU 144.A O no hydrogen 3.013 N/A VAL 189.A N ILE 146.A O no hydrogen 2.957 N/A SER 191.A N GLY 150.A O no hydrogen 3.229 N/A ILE 192.A N THR 148.A O no hydrogen 3.287 N/A HIS 194.A N SER 191.A O no hydrogen 2.920 N/A THR 195.A N ILE 192.A O no hydrogen 3.379 N/A ARG 200.A N PRO 196.A O no hydrogen 3.116 N/A VAL 201.A N PRO 197.A O no hydrogen 3.480 N/A VAL 203.A N ALA 199.A O no hydrogen 2.997 N/A LEU 204.A N ARG 200.A O no hydrogen 3.179 N/A GLU 205.A N VAL 201.A O no hydrogen 3.002 N/A GLY 206.A N GLN 202.A O no hydrogen 2.976 N/A TRP 207.A N VAL 203.A O no hydrogen 3.180 N/A TRP 207.A NE1 MET 21.A O no hydrogen 3.091 N/A LYS 208.A N LEU 204.A O no hydrogen 3.133 N/A LYS 208.A NZ GLU 205.A OE2 no hydrogen 3.106 N/A LYS 209.A N GLU 205.A O no hydrogen 3.053 N/A ARG 210.A N GLY 206.A O no hydrogen 3.186 N/A ARG 210.A NE GLU 217.A OE2 no hydrogen 3.112 N/A ARG 210.A NH1 GLU 185.A O no hydrogen 3.099 N/A ARG 210.A NH1 PRO 186.A O no hydrogen 3.485 N/A ARG 210.A NH1 GLN 187.A OE1 no hydrogen 3.156 N/A ARG 210.A NH2 GLU 185.A O no hydrogen 2.929 N/A ARG 210.A NH2 GLU 217.A OE1 no hydrogen 3.008 N/A LEU 211.A N TRP 207.A O no hydrogen 3.150 N/A GLU 212.A N LYS 209.A O no hydrogen 3.273 N/A THR 213.A N ARG 210.A O no hydrogen 3.045 N/A GLU 216.A N THR 213.A O no hydrogen 3.083 N/A GLU 217.A N VAL 214.A O no hydrogen 3.096 N/A LEU 220.A N VAL 183.A O no hydrogen 2.890 N/A SER 225.A N ASP 133.A OD1 no hydrogen 2.965 N/A SER 225.A OG ASP 133.A OD1 no hydrogen 3.505 N/A SER 225.A OG ASP 133.A OD2 no hydrogen 3.226 N/A LEU 227.A N PRO 224.A O no hydrogen 3.350 N/A PHE 228.A N SER 225.A O no hydrogen 3.294 N/A ASP 229.A N LEU 237.A O no hydrogen 2.910 N/A ASN 231.A N ASP 229.A O no hydrogen 3.175 N/A GLY 235.A N ASN 231.A O no hydrogen 3.076 N/A PHE 236.A N ASN 231.A O no hydrogen 3.398 N/A LYS 239.A N LEU 227.A O no hydrogen 2.924 N/A LYS 239.A NZ SER 226.A O no hydrogen 3.052 N/A GLN 243.A N LYS 239.A O no hydrogen 3.016 N/A GLN 243.A NE2 LEU 238.A O no hydrogen 2.859 N/A GLU 244.A N LYS 240.A O no hydrogen 3.041 N/A GLU 245.A N GLU 241.A O no hydrogen 2.929 N/A GLN 246.A N VAL 242.A O no hydrogen 3.058 N/A LYS 247.A N GLU 244.A O no hydrogen 3.310 N/A LYS 248.A N GLU 245.A O no hydrogen 3.358 N/A ASN 249.A N GLN 246.A O no hydrogen 2.929 N/A GLY 252.A N SER 262.A O no hydrogen 2.927 N/A LEU 253.A N HIS 257.A O no hydrogen 2.888 N/A SER 254.A N HIS 257.A O no hydrogen 3.240 N/A HIS 257.A N SER 254.A OG no hydrogen 3.366 N/A GLY 260.A N HIS 258.A ND1 no hydrogen 3.215 N/A LYS 261.A N HIS 258.A O no hydrogen 3.119 N/A LYS 261.A NZ GLN 246.A O no hydrogen 3.046 N/A LYS 261.A NZ ASN 249.A O no hydrogen 3.231 N/A LYS 261.A NZ PHE 251.A O no hydrogen 3.190 N/A GLN 268.A N ASN 165.A OD1 no hydrogen 2.916 N/A GLN 268.A NE2 GLN 172.A OE1 no hydrogen 2.910 N/A ILE 269.A N ASP 266.A O no hydrogen 3.114 N/A LYS 270.A N ASP 266.A O no hydrogen 2.919 N/A LYS 270.A NZ ASP 266.A OD2 no hydrogen 3.455 N/A ALA 271.A N GLU 185.A OE2 no hydrogen 3.039 N/A