Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qwr_K.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N TYR 170.A O no hydrogen 3.114 N/A THR 2.A N ASP 17.A OD1 no hydrogen 2.918 N/A THR 2.A OG1 SER 171.A OG no hydrogen 2.596 N/A THR 3.A N VAL 129.A O no hydrogen 2.798 N/A THR 3.A OG1 VAL 129.A O no hydrogen 2.795 N/A LEU 4.A N ALA 15.A O no hydrogen 2.841 N/A ALA 5.A N PHE 127.A O no hydrogen 3.177 N/A PHE 6.A N ILE 13.A O no hydrogen 3.051 N/A ARG 7.A N ASP 125.A O no hydrogen 2.714 N/A ARG 7.A NE ASP 125.A OD1 no hydrogen 2.870 N/A ARG 7.A NH1 PRO 110.A O no hydrogen 3.112 N/A ARG 7.A NH2 ASP 125.A OD1 no hydrogen 3.303 N/A PHE 8.A N GLY 11.A O no hydrogen 2.820 N/A GLN 9.A N TRP 146.A O no hydrogen 3.039 N/A GLN 9.A NE2 LEU 148.A O no hydrogen 2.735 N/A GLY 11.A N PHE 8.A O no hydrogen 2.859 N/A ILE 12.A N VAL 180.A O no hydrogen 2.986 N/A ILE 13.A N PHE 6.A O no hydrogen 3.066 N/A VAL 14.A N TYR 178.A O no hydrogen 2.913 N/A ALA 15.A N LEU 4.A O no hydrogen 3.009 N/A VAL 16.A N ASN 176.A O no hydrogen 3.222 N/A ASP 17.A N THR 2.A O no hydrogen 3.055 N/A SER 18.A N GLY 172.A O no hydrogen 3.211 N/A SER 18.A OG GLN 29.A O no hydrogen 2.580 N/A SER 18.A OG SER 174.A O no hydrogen 3.334 N/A SER 18.A OG SER 174.A OG no hydrogen 2.687 N/A ARG 19.A N ASP 17.A OD2 no hydrogen 3.272 N/A ARG 19.A NE GLN 29.A OE1 no hydrogen 2.938 N/A ARG 19.A NH1 ALA 169.A O no hydrogen 2.826 N/A ARG 19.A NH2 GLN 29.A OE1 no hydrogen 3.285 N/A ALA 20.A N SER 28.A O no hydrogen 2.936 N/A ALA 22.A N TRP 25.A O no hydrogen 2.935 N/A TRP 25.A N ALA 22.A O no hydrogen 3.378 N/A ALA 27.A N ALA 20.A O no hydrogen 2.944 N/A SER 28.A N ALA 20.A O no hydrogen 3.282 N/A THR 30.A N SER 28.A OG no hydrogen 3.200 N/A VAL 31.A N SER 18.A O no hydrogen 2.954 N/A LYS 32.A NZ GLU 36.A OE2 no hydrogen 3.426 N/A LYS 33.A NZ THR 1.A OG1 no hydrogen 3.035 N/A LYS 33.A NZ ASP 17.A OD1 no hydrogen 2.719 N/A LYS 33.A NZ ASP 17.A OD2 no hydrogen 3.223 N/A LYS 33.A NZ ARG 19.A O no hydrogen 2.781 N/A ILE 35.A N GLY 43.A O no hydrogen 2.693 N/A ILE 37.A N LEU 41.A O no hydrogen 3.181 N/A ASN 38.A N LEU 41.A O no hydrogen 3.400 N/A PHE 40.A N ASN 38.A OD1 no hydrogen 2.697 N/A LEU 41.A N ASN 38.A O no hydrogen 3.063 N/A LEU 42.A N CYS 102.A O no hydrogen 2.662 N/A GLY 43.A N ILE 35.A O no hydrogen 3.054 N/A THR 44.A N MET 100.A O no hydrogen 3.146 N/A GLY 48.A N SER 96.A O no hydrogen 2.911 N/A PHE 52.A N GLY 48.A O no hydrogen 3.122 N/A GLN 53.A N ALA 49.A O no hydrogen 2.742 N/A PHE 54.A N ALA 50.A O no hydrogen 2.769 N/A TRP 55.A N ASP 51.A O no hydrogen 2.932 N/A GLU 56.A N PHE 52.A O no hydrogen 3.020 N/A THR 57.A OG1 GLN 53.A O no hydrogen 2.446 N/A TRP 58.A N PHE 54.A O no hydrogen 3.061 N/A LEU 59.A N TRP 55.A O no hydrogen 2.756 N/A GLY 60.A N GLU 56.A O no hydrogen 3.232 N/A SER 61.A N THR 57.A O no hydrogen 3.203 N/A GLN 62.A N TRP 58.A O no hydrogen 3.060 N/A CYS 63.A N LEU 59.A O no hydrogen 2.891 N/A CYS 63.A SG LEU 59.A O no hydrogen 3.250 N/A ARG 64.A N GLY 60.A O no hydrogen 2.966 N/A LEU 65.A N SER 61.A O no hydrogen 3.034 N/A HIS 66.A N GLN 62.A O no hydrogen 3.091 N/A GLU 67.A N CYS 63.A O no hydrogen 3.297 N/A LEU 68.A N ARG 64.A O no hydrogen 3.136 N/A ARG 69.A N LEU 65.A O no hydrogen 3.042 N/A GLU 70.A N HIS 66.A O no hydrogen 2.743 N/A ARG 73.A NH2 TYR 104.A O no hydrogen 3.254 N/A VAL 76.A N GLU 108.A OE2 no hydrogen 2.708 N/A ALA 77.A N GLU 108.A OE1 no hydrogen 2.989 N/A ALA 78.A N SER 75.A OG no hydrogen 3.098 N/A ALA 79.A N SER 75.A O no hydrogen 2.942 N/A SER 80.A N VAL 76.A O no hydrogen 2.952 N/A SER 80.A OG VAL 76.A O no hydrogen 3.127 N/A SER 80.A OG ALA 77.A O no hydrogen 2.777 N/A LYS 81.A N ALA 77.A O no hydrogen 2.999 N/A ILE 82.A N ALA 78.A O no hydrogen 3.066 N/A LEU 83.A N ALA 79.A O no hydrogen 3.428 N/A SER 84.A N SER 80.A O no hydrogen 2.925 N/A SER 84.A OG LYS 81.A O no hydrogen 3.180 N/A ASN 85.A N LYS 81.A O no hydrogen 2.883 N/A LEU 86.A N ILE 82.A O no hydrogen 3.056 N/A VAL 87.A N LEU 83.A O no hydrogen 3.020 N/A TYR 88.A N SER 84.A O no hydrogen 3.067 N/A GLN 89.A N ASN 85.A O no hydrogen 3.400 N/A GLN 89.A N LEU 86.A O no hydrogen 3.148 N/A LYS 91.A N TYR 88.A O no hydrogen 3.184 N/A LYS 91.A NZ ASP 118.A O no hydrogen 2.968 N/A ALA 93.A N TYR 90.A O no hydrogen 2.913 N/A SER 96.A N ASP 51.A OD2 no hydrogen 3.255 N/A MET 97.A N SER 117.A OG no hydrogen 3.020 N/A GLY 98.A N ALA 46.A O no hydrogen 2.894 N/A THR 99.A N VAL 115.A O no hydrogen 2.692 N/A THR 99.A OG1 THR 44.A O no hydrogen 2.319 N/A THR 99.A OG1 GLU 56.A OE2 no hydrogen 2.428 N/A ILE 101.A N TYR 113.A O no hydrogen 2.920 N/A CYS 102.A N LEU 42.A O no hydrogen 2.843 N/A CYS 102.A SG MET 100.A O no hydrogen 3.669 N/A GLY 103.A N THR 111.A O no hydrogen 3.169 N/A TYR 104.A N PHE 40.A O no hydrogen 3.399 N/A THR 105.A OG1 GLU 108.A OE2 no hydrogen 2.822 N/A GLY 109.A N THR 105.A O no hydrogen 2.781 N/A THR 111.A N GLY 103.A O no hydrogen 2.970 N/A THR 111.A OG1 GLY 109.A O no hydrogen 3.035 N/A TYR 113.A N ILE 101.A O no hydrogen 3.035 N/A TYR 114.A N LEU 122.A O no hydrogen 2.754 N/A TYR 114.A OH ASP 116.A OD2 no hydrogen 2.982 N/A VAL 115.A N THR 99.A O no hydrogen 2.988 N/A ASP 116.A N THR 120.A O no hydrogen 3.144 N/A SER 117.A N MET 97.A O no hydrogen 2.751 N/A SER 117.A OG LEU 95.A O no hydrogen 3.173 N/A SER 117.A OG MET 97.A O no hydrogen 3.360 N/A GLY 119.A N ASP 116.A O no hydrogen 3.043 N/A THR 120.A N ASP 116.A OD1 no hydrogen 3.059 N/A THR 120.A OG1 ASP 116.A OD1 no hydrogen 3.419 N/A THR 120.A OG1 ASP 116.A OD2 no hydrogen 3.569 N/A THR 120.A OG1 ASP 118.A OD1 no hydrogen 3.199 N/A ARG 121.A NE SER 80.A OG no hydrogen 2.940 N/A ARG 121.A NH1 ALA 77.A O no hydrogen 2.961 N/A ARG 121.A NH1 SER 80.A OG no hydrogen 3.331 N/A LEU 122.A N TYR 114.A O no hydrogen 2.871 N/A GLY 124.A N ILE 112.A O no hydrogen 3.193 N/A PHE 127.A N ALA 5.A O no hydrogen 3.209 N/A CYS 128.A N TYR 137.A OH no hydrogen 3.001 N/A VAL 129.A N THR 3.A O no hydrogen 2.800 N/A GLY 130.A N GLN 133.A OE1 no hydrogen 3.235 N/A SER 131.A OG THR 1.A O no hydrogen 2.983 N/A SER 131.A OG ASP 168.A OD2 no hydrogen 2.640 N/A GLY 132.A N THR 1.A O no hydrogen 3.019 N/A GLN 133.A N GLY 130.A O no hydrogen 3.155 N/A ALA 136.A N GLY 132.A O no hydrogen 3.347 N/A TYR 137.A N GLN 133.A O no hydrogen 2.858 N/A GLY 138.A N THR 134.A O no hydrogen 3.070 N/A LEU 140.A N ALA 136.A O no hydrogen 2.880 N/A ASP 141.A N TYR 137.A O no hydrogen 2.768 N/A SER 142.A OG GLY 138.A O no hydrogen 2.819 N/A SER 142.A OG VAL 139.A O no hydrogen 3.046 N/A SER 142.A OG ASN 143.A OD1 no hydrogen 3.436 N/A ASN 143.A N VAL 139.A O no hydrogen 3.258 N/A ASN 143.A N LEU 140.A O no hydrogen 3.285 N/A TYR 144.A N ASP 141.A O no hydrogen 3.350 N/A TYR 144.A OH ARG 7.A O no hydrogen 2.567 N/A ASP 152.A N SER 149.A OG no hydrogen 3.158 N/A ALA 153.A N SER 149.A O no hydrogen 2.810 N/A LEU 154.A N VAL 150.A O no hydrogen 3.148 N/A TYR 155.A N GLU 151.A O no hydrogen 3.276 N/A TYR 155.A OH GLU 204.A OE1 no hydrogen 2.648 N/A LEU 156.A N ASP 152.A O no hydrogen 3.006 N/A GLY 157.A N ALA 153.A O no hydrogen 3.063 N/A LYS 158.A N LEU 154.A O no hydrogen 3.020 N/A ARG 159.A N TYR 155.A O no hydrogen 2.637 N/A ARG 159.A NE GLU 204.A OE2 no hydrogen 2.938 N/A ARG 159.A NH1 ARG 159.A O no hydrogen 3.067 N/A SER 160.A N LEU 156.A O no hydrogen 2.881 N/A SER 160.A OG LEU 156.A O no hydrogen 2.788 N/A ILE 161.A N GLY 157.A O no hydrogen 3.311 N/A LEU 162.A N LYS 158.A O no hydrogen 3.099 N/A ALA 163.A N ARG 159.A O no hydrogen 2.985 N/A ALA 164.A N SER 160.A O no hydrogen 3.256 N/A ALA 165.A N ILE 161.A O no hydrogen 2.702 N/A HIS 166.A N LEU 162.A O no hydrogen 2.912 N/A ARG 167.A N ALA 163.A O no hydrogen 3.262 N/A ASP 168.A N ALA 164.A O no hydrogen 2.711 N/A TYR 170.A N ASP 168.A OD1 no hydrogen 3.213 N/A TYR 170.A OH ASN 24.A OD1 no hydrogen 2.880 N/A SER 171.A N ASP 168.A O no hydrogen 3.400 N/A SER 171.A OG THR 2.A OG1 no hydrogen 2.596 N/A SER 171.A OG ASP 168.A OD2 no hydrogen 2.710 N/A GLY 172.A N ASP 17.A OD2 no hydrogen 3.118 N/A SER 174.A OG SER 18.A OG no hydrogen 2.687 N/A VAL 175.A N HIS 191.A O no hydrogen 2.769 N/A ASN 176.A N VAL 16.A O no hydrogen 2.987 N/A LEU 177.A N GLY 189.A O no hydrogen 3.390 N/A TYR 178.A N VAL 14.A O no hydrogen 2.833 N/A TYR 178.A OH GLU 36.A OE2 no hydrogen 3.123 N/A HIS 179.A N ILE 186.A O no hydrogen 2.891 N/A HIS 179.A NE2 GLY 10.A O no hydrogen 2.912 N/A VAL 180.A N ILE 12.A O no hydrogen 2.753 N/A THR 181.A N GLY 184.A O no hydrogen 2.823 N/A THR 181.A OG1 GLY 184.A O no hydrogen 3.023 N/A GLY 184.A N THR 181.A O no hydrogen 3.186 N/A TRP 185.A N PRO 39.A O no hydrogen 3.081 N/A TRP 185.A NE1 ASN 38.A O no hydrogen 2.899 N/A ILE 186.A N HIS 179.A O no hydrogen 2.656 N/A HIS 188.A N LEU 177.A O no hydrogen 3.145 N/A ASN 190.A ND2 SER 174.A OG no hydrogen 2.920 N/A HIS 191.A N VAL 175.A O no hydrogen 2.769 N/A HIS 191.A NE2 HIS 188.A O no hydrogen 2.912 N/A VAL 193.A N GLY 173.A O no hydrogen 3.130 N/A GLY 194.A N ASP 192.A OD2 no hydrogen 2.778 N/A LEU 196.A N ASP 192.A O no hydrogen 2.896 N/A PHE 197.A N VAL 193.A O no hydrogen 3.032 N/A LYS 199.A N GLU 195.A O no hydrogen 3.140 N/A LYS 199.A NZ GLU 203.A OE2 no hydrogen 3.122 N/A VAL 200.A N LEU 196.A O no hydrogen 2.874 N/A LYS 201.A N PHE 197.A O no hydrogen 2.772 N/A LYS 201.A NZ PHE 207.A O no hydrogen 2.748 N/A GLU 202.A N TRP 198.A O no hydrogen 2.949 N/A GLU 203.A N LYS 199.A O no hydrogen 3.129 N/A GLU 204.A N VAL 200.A O no hydrogen 2.839 N/A GLY 205.A N LYS 201.A O no hydrogen 2.798 N/A SER 206.A OG GLU 204.A OE2 no hydrogen 2.857 N/A ASN 209.A ND2 HIS 166.A NE2 no hydrogen 3.645 N/A