Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3d5q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 11.A N ARG 8.A O no hydrogen 2.919 N/A GLN 13.A N GLU 10.A O no hydrogen 3.184 N/A GLY 14.A N GLY 38.A O no hydrogen 2.946 N/A LYS 15.A N LEU 12.A O no hydrogen 2.766 N/A LYS 15.A NZ MET 11.A O no hydrogen 2.945 N/A LYS 16.A N ASP 94.A OD2 no hydrogen 2.421 N/A LYS 16.A NZ MET 90.A O no hydrogen 3.415 N/A LYS 16.A NZ GLY 91.A O no hydrogen 3.025 N/A VAL 17.A N HIS 40.A O no hydrogen 3.196 N/A ILE 18.A N MET 95.A O no hydrogen 3.198 N/A VAL 19.A N VAL 42.A O no hydrogen 3.025 N/A THR 20.A N ILE 97.A O no hydrogen 3.054 N/A ALA 22.A N THR 44.A O no hydrogen 3.082 N/A ARG 28.A N LYS 24.A O no hydrogen 2.635 N/A GLU 29.A N GLY 25.A O no hydrogen 3.168 N/A MET 30.A N ILE 26.A O no hydrogen 2.900 N/A ALA 31.A N GLY 27.A O no hydrogen 3.095 N/A TYR 32.A N ARG 28.A O no hydrogen 3.062 N/A HIS 33.A N GLU 29.A O no hydrogen 2.902 N/A HIS 33.A NE2 GLU 214.A O no hydrogen 2.846 N/A LEU 34.A N MET 30.A O no hydrogen 3.045 N/A ALA 35.A N ALA 31.A O no hydrogen 2.989 N/A LYS 36.A N TYR 32.A O no hydrogen 2.896 N/A MET 37.A N LEU 34.A O no hydrogen 2.746 N/A GLY 38.A N ALA 35.A O no hydrogen 2.746 N/A ALA 39.A N LEU 34.A O no hydrogen 3.246 N/A HIS 40.A N LYS 15.A O no hydrogen 2.899 N/A HIS 40.A ND1 SER 65.A OG no hydrogen 2.303 N/A VAL 42.A N VAL 17.A O no hydrogen 2.987 N/A VAL 43.A N HIS 67.A O no hydrogen 3.128 N/A THR 44.A N VAL 19.A O no hydrogen 3.233 N/A THR 44.A OG1 ILE 69.A O no hydrogen 2.592 N/A SER 47.A OG THR 50.A OG1 no hydrogen 2.698 N/A LYS 48.A NZ GLU 49.A OE1 no hydrogen 3.439 N/A GLU 49.A N GLU 49.A OE2 no hydrogen 2.530 N/A THR 50.A OG1 SER 47.A OG no hydrogen 2.698 N/A LEU 51.A N SER 47.A O no hydrogen 3.153 N/A GLN 52.A N LYS 48.A O no hydrogen 2.877 N/A GLN 52.A NE2 TYR 68.A OH no hydrogen 3.077 N/A LYS 53.A N GLU 49.A O no hydrogen 3.387 N/A VAL 54.A N THR 50.A O no hydrogen 3.087 N/A VAL 55.A N LEU 51.A O no hydrogen 2.938 N/A SER 56.A N GLN 52.A O no hydrogen 2.958 N/A SER 56.A OG GLN 52.A O no hydrogen 3.177 N/A SER 56.A OG LYS 53.A O no hydrogen 2.950 N/A HIS 57.A N LYS 53.A O no hydrogen 3.015 N/A CYS 58.A N VAL 54.A O no hydrogen 3.019 N/A CYS 58.A SG VAL 54.A O no hydrogen 2.983 N/A LEU 59.A N VAL 55.A O no hydrogen 3.096 N/A GLU 60.A N SER 56.A O no hydrogen 3.131 N/A LEU 61.A N CYS 58.A O no hydrogen 3.328 N/A GLY 62.A N LEU 59.A O no hydrogen 3.207 N/A SER 65.A OG HIS 40.A ND1 no hydrogen 2.303 N/A HIS 67.A N VAL 41.A O no hydrogen 3.071 N/A ILE 69.A N VAL 43.A O no hydrogen 3.403 N/A GLY 71.A N ALA 45.A O no hydrogen 2.780 N/A GLU 74.A N THR 72.A OG1 no hydrogen 3.036 N/A ASP 75.A N THR 72.A O no hydrogen 3.127 N/A PHE 78.A N ASP 75.A OD1 no hydrogen 2.858 N/A ALA 79.A N ASP 75.A O no hydrogen 2.897 N/A GLU 80.A N MET 76.A O no hydrogen 2.891 N/A GLN 81.A N THR 77.A O no hydrogen 2.810 N/A PHE 82.A N PHE 78.A O no hydrogen 2.633 N/A VAL 83.A N GLU 80.A O no hydrogen 3.329 N/A GLN 85.A N GLN 81.A O no hydrogen 3.071 N/A ALA 86.A N PHE 82.A O no hydrogen 3.007 N/A GLY 87.A N VAL 83.A O no hydrogen 2.622 N/A LYS 88.A N ALA 84.A O no hydrogen 2.675 N/A LEU 89.A N GLN 85.A O no hydrogen 3.022 N/A MET 90.A N ALA 86.A O no hydrogen 3.285 N/A GLY 91.A N GLY 87.A O no hydrogen 2.880 N/A GLY 91.A N LYS 88.A O no hydrogen 3.155 N/A GLY 92.A N GLY 87.A O no hydrogen 3.021 N/A ASP 94.A N LYS 16.A O no hydrogen 2.838 N/A MET 95.A N LYS 16.A O no hydrogen 3.286 N/A LEU 96.A N SER 144.A O no hydrogen 2.769 N/A ILE 97.A N ILE 18.A O no hydrogen 2.892 N/A LEU 98.A N VAL 146.A O no hydrogen 2.900 N/A ASN 99.A N THR 20.A OG1 no hydrogen 2.654 N/A HIS 100.A N THR 20.A OG1 no hydrogen 2.924 N/A THR 102.A N ASN 123.A OD1 no hydrogen 3.003 N/A THR 104.A OG1 SER 105.A O no hydrogen 3.420 N/A THR 104.A OG1 HIS 115.A NE2 no hydrogen 3.258 N/A HIS 115.A N ASP 112.A O no hydrogen 3.306 N/A HIS 115.A NE2 THR 104.A OG1 no hydrogen 3.258 N/A ARG 117.A N ILE 113.A O no hydrogen 3.013 N/A LYS 118.A N HIS 114.A O no hydrogen 2.984 N/A SER 119.A N HIS 115.A O no hydrogen 3.032 N/A SER 119.A OG HIS 115.A O no hydrogen 2.727 N/A MET 120.A N VAL 116.A O no hydrogen 3.047 N/A GLU 121.A N ARG 117.A O no hydrogen 2.731 N/A VAL 122.A N LYS 118.A O no hydrogen 2.708 N/A ASN 123.A N SER 119.A O no hydrogen 2.926 N/A ASN 123.A ND2 SER 166.A OG no hydrogen 3.163 N/A PHE 124.A N MET 120.A O no hydrogen 3.231 N/A LEU 125.A N MET 120.A O no hydrogen 2.715 N/A SER 126.A N GLU 121.A O no hydrogen 2.846 N/A SER 126.A OG VAL 122.A O no hydrogen 2.588 N/A TYR 127.A OH HIS 100.A O no hydrogen 2.370 N/A VAL 128.A N PHE 124.A O no hydrogen 3.346 N/A VAL 129.A N LEU 125.A O no hydrogen 2.962 N/A LEU 130.A N SER 126.A O no hydrogen 2.727 N/A THR 131.A N TYR 127.A O no hydrogen 3.002 N/A THR 131.A OG1 TYR 127.A O no hydrogen 2.647 N/A VAL 132.A N VAL 128.A O no hydrogen 2.832 N/A ALA 133.A N VAL 129.A O no hydrogen 2.986 N/A ALA 134.A N THR 131.A O no hydrogen 3.091 N/A LEU 135.A N THR 131.A O no hydrogen 2.877 N/A LEU 138.A N ALA 134.A O no hydrogen 2.923 N/A LYS 139.A N LEU 135.A O no hydrogen 2.596 N/A GLN 140.A N PRO 136.A O no hydrogen 3.264 N/A SER 141.A N MET 137.A O no hydrogen 3.276 N/A SER 141.A N LEU 138.A O no hydrogen 3.101 N/A SER 141.A OG LEU 93.A O no hydrogen 2.474 N/A SER 141.A OG MET 137.A O no hydrogen 3.542 N/A ASN 142.A N LYS 139.A O no hydrogen 3.439 N/A GLY 143.A N LEU 138.A O no hydrogen 3.212 N/A SER 144.A N ASP 94.A O no hydrogen 2.751 N/A SER 144.A OG SER 189.A OG no hydrogen 3.134 N/A SER 144.A OG GLY 224.A O no hydrogen 3.559 N/A ILE 145.A N SER 189.A O no hydrogen 2.698 N/A VAL 146.A N LEU 96.A O no hydrogen 2.820 N/A VAL 147.A N THR 191.A O no hydrogen 2.686 N/A VAL 148.A N LEU 98.A O no hydrogen 3.163 N/A SER 149.A N CYS 193.A O no hydrogen 2.559 N/A LEU 151.A N LEU 195.A O no hydrogen 3.213 N/A ALA 152.A N SER 150.A OG no hydrogen 2.792 N/A GLY 153.A N SER 150.A O no hydrogen 2.373 N/A LYS 154.A N LEU 151.A O no hydrogen 2.504 N/A LYS 154.A NZ ASP 171.A OD2 no hydrogen 2.811 N/A LYS 154.A NZ GLU 230.A OE1 no hydrogen 2.664 N/A VAL 155.A N LEU 151.A O no hydrogen 2.885 N/A SER 164.A N VAL 160.A O no hydrogen 2.667 N/A SER 164.A OG ALA 152.A O no hydrogen 2.672 N/A ALA 165.A N ALA 161.A O no hydrogen 2.796 N/A SER 166.A N ALA 162.A O no hydrogen 3.208 N/A SER 166.A OG TYR 163.A O no hydrogen 2.605 N/A LYS 167.A N TYR 163.A O no hydrogen 3.283 N/A LYS 167.A NZ VAL 148.A O no hydrogen 2.704 N/A PHE 168.A N SER 164.A O no hydrogen 2.904 N/A ALA 169.A N ALA 165.A O no hydrogen 2.957 N/A LEU 170.A N SER 166.A O no hydrogen 2.982 N/A ASP 171.A N LYS 167.A O no hydrogen 3.283 N/A GLY 172.A N PHE 168.A O no hydrogen 2.913 N/A PHE 173.A N ALA 169.A O no hydrogen 2.731 N/A PHE 174.A N LEU 170.A O no hydrogen 2.906 N/A SER 175.A N ASP 171.A O no hydrogen 2.872 N/A SER 175.A OG ASP 171.A O no hydrogen 2.657 N/A SER 175.A OG ASP 171.A OD1 no hydrogen 2.266 N/A SER 176.A N GLY 172.A O no hydrogen 3.329 N/A SER 176.A OG.B GLY 172.A O no hydrogen 2.777 N/A ILE 177.A N PHE 173.A O no hydrogen 3.152 N/A ARG 178.A N PHE 174.A O no hydrogen 2.936 N/A ARG 178.A NE ILE 190.A O no hydrogen 3.166 N/A ARG 178.A NH2 ILE 190.A O no hydrogen 3.032 N/A LYS 179.A N SER 175.A O no hydrogen 3.210 N/A LYS 179.A NZ GLU 252.A OE2 no hydrogen 2.771 N/A GLU 180.A N SER 176.A O no hydrogen 2.923 N/A TYR 181.A N ILE 177.A O no hydrogen 2.479 N/A SER 182.A N ARG 178.A O no hydrogen 2.879 N/A VAL 183.A N LYS 179.A O no hydrogen 3.388 N/A SER 184.A N GLU 180.A O no hydrogen 3.250 N/A SER 184.A OG GLU 180.A O no hydrogen 3.217 N/A SER 184.A OG TYR 181.A O no hydrogen 3.482 N/A ARG 185.A N SER 182.A O no hydrogen 3.308 N/A VAL 186.A N TYR 181.A O no hydrogen 3.039 N/A SER 189.A N GLY 143.A O no hydrogen 3.238 N/A SER 189.A OG SER 144.A OG no hydrogen 3.134 N/A THR 191.A N ILE 145.A O no hydrogen 2.814 N/A THR 191.A OG1 GLN 228.A O no hydrogen 2.409 N/A LEU 192.A N GLU 229.A O no hydrogen 3.241 N/A CYS 193.A N VAL 147.A O no hydrogen 2.679 N/A CYS 193.A SG VAL 147.A O no hydrogen 3.804 N/A VAL 194.A N VAL 231.A O no hydrogen 2.814 N/A LEU 195.A N SER 149.A O no hydrogen 3.290 N/A GLY 196.A N TYR 233.A O no hydrogen 2.966 N/A ASP 199.A N ALA 211.A O no hydrogen 2.952 N/A THR 200.A N ILE 198.A O no hydrogen 2.846 N/A ALA 203.A N THR 200.A OG1 no hydrogen 3.058 N/A MET 204.A N THR 200.A O no hydrogen 2.927 N/A LYS 205.A N GLU 201.A O no hydrogen 2.833 N/A ALA 206.A N ALA 203.A O no hydrogen 2.900 N/A VAL 207.A N ALA 203.A O no hydrogen 3.235 N/A ALA 211.A N LEU 197.A O no hydrogen 3.078 N/A LYS 213.A N ASP 199.A OD2 no hydrogen 2.494 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.872 N/A GLU 215.A N PRO 212.A O no hydrogen 3.041 N/A CYS 216.A N PRO 212.A O no hydrogen 3.206 N/A ALA 217.A N LYS 213.A O no hydrogen 3.187 N/A GLU 219.A N GLU 215.A O no hydrogen 2.930 N/A ILE 220.A N CYS 216.A O no hydrogen 2.796 N/A ILE 221.A N ALA 217.A O no hydrogen 2.780 N/A LYS 222.A N LEU 218.A O no hydrogen 2.630 N/A LYS 222.A NZ GLU 219.A OE1 no hydrogen 3.158 N/A GLY 223.A N GLU 219.A O no hydrogen 2.560 N/A GLY 224.A N ILE 220.A O no hydrogen 3.055 N/A ALA 225.A N ILE 221.A O no hydrogen 2.817 N/A LEU 226.A N LYS 222.A O no hydrogen 2.684 N/A ARG 227.A N GLY 224.A O no hydrogen 3.092 N/A ARG 227.A NH1 ASN 142.A O no hydrogen 2.951 N/A ARG 227.A NH1 GLY 143.A O no hydrogen 3.189 N/A ARG 227.A NH2 ASN 142.A O no hydrogen 3.518 N/A ARG 227.A NH2 ASN 187.A O no hydrogen 2.935 N/A GLN 228.A N GLY 223.A O no hydrogen 3.222 N/A VAL 231.A N LEU 192.A O no hydrogen 3.034 N/A TYR 232.A OH GLU 230.A OE2 no hydrogen 2.714 N/A TYR 233.A N VAL 194.A O no hydrogen 3.042 N/A TYR 233.A OH GLU 215.A OE1 no hydrogen 2.631 N/A SER 235.A OG GLN 209.A O no hydrogen 2.237 N/A SER 235.A OG GLN 209.A OE1 no hydrogen 3.215 N/A SER 235.A OG SER 235.A O no hydrogen 2.296 N/A SER 236.A OG THR 239.A OG1 no hydrogen 3.407 N/A THR 239.A N SER 236.A OG no hydrogen 3.187 N/A THR 239.A OG1 SER 236.A OG no hydrogen 3.407 N/A THR 240.A N SER 236.A O no hydrogen 3.120 N/A THR 240.A OG1 LEU 237.A O no hydrogen 2.723 N/A LEU 241.A N TRP 238.A O no hydrogen 3.040 N/A LEU 242.A N THR 239.A O no hydrogen 2.808 N/A ASN 245.A ND2 SER 247.A OG no hydrogen 3.378 N/A ARG 248.A NE GLU 252.A OE1 no hydrogen 2.803 N/A ARG 248.A NH1 ASP 171.A OD2 no hydrogen 2.980 N/A ARG 248.A NH2 ASP 171.A OD1 no hydrogen 2.989 N/A LYS 249.A N ASN 245.A O no hydrogen 3.348 N/A ILE 250.A N PRO 246.A O no hydrogen 2.948 N/A LEU 251.A N SER 247.A O no hydrogen 2.966 N/A GLU 252.A N ARG 248.A O no hydrogen 3.004 N/A PHE 253.A N LYS 249.A O no hydrogen 3.114 N/A PHE 253.A N ILE 250.A O no hydrogen 3.022 N/A LEU 254.A N ILE 250.A O no hydrogen 2.759 N/A TYR 255.A N LEU 251.A O no hydrogen 3.076 N/A THR 257.A OG1 LEU 254.A O no hydrogen 3.096 N/A SER 258.A N TYR 255.A O no hydrogen 3.194 N/A SER 258.A OG TYR 255.A O no hydrogen 2.656 N/A