Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1gwr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N LEU 1.A O no hydrogen 3.028 N/A SER 4.A OG LEU 1.A O no hydrogen 2.883 N/A LEU 5.A N ALA 2.A O no hydrogen 3.167 N/A THR 6.A N GLN 9.A OE1 no hydrogen 2.629 N/A THR 6.A OG1 GLN 9.A OE1 no hydrogen 2.950 N/A GLN 9.A N THR 6.A OG1 no hydrogen 3.132 N/A MET 10.A N THR 6.A O no hydrogen 3.132 N/A VAL 11.A N ALA 7.A O no hydrogen 3.159 N/A SER 12.A N ASP 8.A O no hydrogen 2.984 N/A SER 12.A OG ASP 8.A O no hydrogen 3.281 N/A ALA 13.A N GLN 9.A O no hydrogen 2.725 N/A LEU 14.A N MET 10.A O no hydrogen 3.094 N/A LEU 15.A N VAL 11.A O no hydrogen 2.928 N/A ASP 16.A N SER 12.A O no hydrogen 2.861 N/A ASP 16.A N ALA 13.A O no hydrogen 2.709 N/A ALA 17.A N ALA 13.A O no hydrogen 2.928 N/A GLU 18.A N LEU 14.A O no hydrogen 3.346 N/A SER 24.A N ASN 99.A OD1 no hydrogen 3.056 N/A SER 24.A OG GLU 25.A O no hydrogen 3.417 N/A SER 30.A N SER 33.A OG no hydrogen 2.735 N/A SER 30.A OG SER 33.A OG no hydrogen 3.137 N/A SER 33.A N SER 30.A OG no hydrogen 2.686 N/A SER 33.A OG SER 30.A O no hydrogen 3.362 N/A SER 33.A OG SER 30.A OG no hydrogen 3.137 N/A MET 34.A N SER 30.A O no hydrogen 2.929 N/A MET 35.A N GLU 31.A O no hydrogen 3.139 N/A GLY 36.A N ALA 32.A O no hydrogen 2.862 N/A LEU 37.A N SER 33.A O no hydrogen 3.055 N/A LEU 38.A N MET 34.A O no hydrogen 3.226 N/A THR 39.A N MET 35.A O no hydrogen 3.202 N/A ASN 40.A N GLY 36.A O no hydrogen 3.175 N/A ASN 40.A ND2 TYR 226.A OH no hydrogen 3.118 N/A LEU 41.A N LEU 37.A O no hydrogen 2.826 N/A ALA 42.A N LEU 38.A O no hydrogen 2.676 N/A ASP 43.A N THR 39.A O no hydrogen 2.997 N/A ARG 44.A N ASN 40.A O no hydrogen 3.279 N/A ARG 44.A N LEU 41.A O no hydrogen 2.910 N/A ARG 44.A NE ASN 40.A OD1 no hydrogen 2.878 N/A ARG 44.A NH1 TYR 23.A O no hydrogen 2.574 N/A ARG 44.A NH2 TYR 23.A O no hydrogen 3.281 N/A ARG 44.A NH2 ASN 40.A OD1 no hydrogen 2.541 N/A GLU 45.A N LEU 41.A O no hydrogen 2.882 N/A LEU 46.A N ALA 42.A O no hydrogen 3.041 N/A MET 49.A N GLU 45.A O no hydrogen 2.967 N/A ILE 50.A N LEU 46.A O no hydrogen 2.802 N/A ASN 51.A N VAL 47.A O no hydrogen 3.462 N/A TRP 52.A N HIS 48.A O no hydrogen 2.831 N/A TRP 52.A N MET 49.A O no hydrogen 3.073 N/A ALA 53.A N MET 49.A O no hydrogen 3.007 N/A LYS 54.A N ILE 50.A O no hydrogen 3.411 N/A ARG 55.A N TRP 52.A O no hydrogen 2.953 N/A VAL 56.A N ALA 53.A O no hydrogen 2.602 N/A PHE 59.A N VAL 56.A O no hydrogen 3.061 N/A ASP 61.A N GLY 58.A O no hydrogen 3.174 N/A LEU 62.A N PHE 59.A O no hydrogen 3.185 N/A THR 63.A N GLU 160.A OE1 no hydrogen 2.801 N/A THR 63.A OG1 ASP 66.A OD2 no hydrogen 3.048 N/A THR 63.A OG1 GLU 160.A OE1 no hydrogen 3.218 N/A ASP 66.A N THR 63.A O no hydrogen 2.861 N/A ASP 66.A N THR 63.A OG1 no hydrogen 3.185 N/A GLN 67.A N THR 63.A O no hydrogen 3.035 N/A GLN 67.A NE2 LEU 62.A O no hydrogen 2.934 N/A VAL 68.A N LEU 64.A O no hydrogen 2.948 N/A HIS 69.A N HIS 65.A O no hydrogen 3.198 N/A LEU 70.A N ASP 66.A O no hydrogen 2.883 N/A LEU 71.A N GLN 67.A O no hydrogen 3.121 N/A GLU 72.A N VAL 68.A O no hydrogen 2.626 N/A CYS 73.A N HIS 69.A O no hydrogen 2.994 N/A CYS 73.A N LEU 70.A O no hydrogen 3.161 N/A ALA 74.A N LEU 70.A O no hydrogen 3.002 N/A ALA 74.A N LEU 71.A O no hydrogen 3.141 N/A TRP 75.A N LEU 71.A O no hydrogen 3.031 N/A ILE 78.A N ALA 74.A O no hydrogen 2.905 N/A LEU 79.A N TRP 75.A O no hydrogen 2.943 N/A MET 80.A N LEU 76.A O no hydrogen 2.959 N/A ILE 81.A N GLU 77.A O no hydrogen 2.792 N/A GLY 82.A N ILE 78.A O no hydrogen 3.226 N/A LEU 83.A N LEU 79.A O no hydrogen 3.117 N/A VAL 84.A N MET 80.A O no hydrogen 2.946 N/A TRP 85.A N ILE 81.A O no hydrogen 3.022 N/A ARG 86.A N GLY 82.A O no hydrogen 2.872 N/A ARG 86.A NE LEU 95.A O no hydrogen 3.251 N/A ARG 86.A NH2 PHE 96.A O no hydrogen 3.106 N/A SER 87.A N LEU 83.A O no hydrogen 3.031 N/A SER 87.A N VAL 84.A O no hydrogen 3.119 N/A SER 87.A OG LEU 83.A O no hydrogen 2.652 N/A MET 88.A N TRP 85.A O no hydrogen 3.435 N/A HIS 90.A N SER 87.A O no hydrogen 3.063 N/A LYS 93.A N HIS 90.A O no hydrogen 2.886 N/A LEU 94.A N LEU 102.A O no hydrogen 2.765 N/A LEU 95.A N SER 87.A OG no hydrogen 2.844 N/A PHE 96.A N LEU 94.A O no hydrogen 3.103 N/A ALA 97.A N LEU 100.A O no hydrogen 3.477 N/A ASN 99.A ND2 SER 24.A O no hydrogen 2.577 N/A LEU 100.A N ALA 97.A O no hydrogen 3.103 N/A LEU 102.A N LEU 94.A O no hydrogen 3.130 N/A ASP 103.A N GLN 106.A OE1 no hydrogen 3.095 N/A ARG 104.A NE ASP 118.A OD1 no hydrogen 2.490 N/A ARG 104.A NE ASP 118.A OD2 no hydrogen 3.228 N/A ARG 104.A NH2 ASP 118.A OD2 no hydrogen 2.866 N/A ASN 105.A ND2 ASP 103.A OD1 no hydrogen 3.534 N/A GLN 106.A N ASP 103.A O no hydrogen 2.816 N/A GLN 106.A N ASP 103.A OD1 no hydrogen 3.220 N/A GLY 107.A N ASP 103.A O no hydrogen 3.222 N/A GLY 107.A N ARG 104.A O no hydrogen 2.829 N/A LYS 108.A N ASN 105.A O no hydrogen 3.238 N/A CYS 109.A N GLN 106.A O no hydrogen 2.984 N/A CYS 109.A SG GLN 106.A O no hydrogen 3.431 N/A VAL 110.A N GLY 107.A O no hydrogen 3.273 N/A GLU 111.A N GLU 31.A OE1 no hydrogen 2.823 N/A MET 113.A N VAL 110.A O no hydrogen 3.268 N/A PHE 117.A N MET 113.A O no hydrogen 2.958 N/A ASP 118.A N VAL 114.A O no hydrogen 2.900 N/A MET 119.A N GLU 115.A O no hydrogen 3.104 N/A LEU 120.A N ILE 116.A O no hydrogen 3.157 N/A LEU 121.A N PHE 117.A O no hydrogen 2.779 N/A ALA 122.A N ASP 118.A O no hydrogen 2.979 N/A THR 123.A N MET 119.A O no hydrogen 2.989 N/A THR 123.A OG1 MET 119.A O no hydrogen 2.802 N/A SER 124.A N LEU 120.A O no hydrogen 2.721 N/A SER 124.A OG VAL 84.A O no hydrogen 3.118 N/A SER 125.A N LEU 121.A O no hydrogen 2.939 N/A SER 125.A OG LEU 121.A O no hydrogen 3.165 N/A ARG 126.A N ALA 122.A O no hydrogen 2.744 N/A ARG 126.A NH2 GLN 195.A OE1 no hydrogen 2.524 N/A PHE 127.A N THR 123.A O no hydrogen 2.902 N/A ARG 128.A N SER 124.A O no hydrogen 3.135 N/A ARG 128.A NE MET 88.A O no hydrogen 2.592 N/A ARG 128.A NH2 SER 87.A O no hydrogen 3.391 N/A ARG 128.A NH2 MET 88.A O no hydrogen 2.675 N/A MET 129.A N SER 125.A O no hydrogen 2.780 N/A MET 130.A N ARG 126.A O no hydrogen 3.176 N/A ASN 131.A N ARG 128.A O no hydrogen 3.043 N/A LEU 132.A N PHE 127.A O no hydrogen 3.002 N/A GLN 133.A N GLU 136.A OE1 no hydrogen 2.784 N/A GLN 133.A NE2 ASN 131.A O no hydrogen 3.084 N/A PHE 137.A N GLN 133.A O no hydrogen 2.735 N/A VAL 138.A N GLY 134.A O no hydrogen 3.188 N/A CYS 139.A N GLU 135.A O no hydrogen 3.308 N/A CYS 139.A N GLU 136.A O no hydrogen 2.809 N/A CYS 139.A SG GLU 135.A O no hydrogen 3.618 N/A LEU 140.A N GLU 136.A O no hydrogen 2.865 N/A LYS 141.A N PHE 137.A O no hydrogen 3.045 N/A LYS 141.A NZ GLU 18.A OE1 no hydrogen 2.747 N/A SER 142.A OG VAL 138.A O no hydrogen 3.555 N/A ILE 143.A N CYS 139.A O no hydrogen 2.995 N/A ILE 144.A N LEU 140.A O no hydrogen 2.810 N/A LEU 145.A N LYS 141.A O no hydrogen 3.102 N/A LEU 146.A N SER 142.A O no hydrogen 2.948 N/A ASN 147.A N ILE 143.A O no hydrogen 2.761 N/A ASN 147.A N ILE 144.A O no hydrogen 3.265 N/A SER 148.A OG LEU 70.A O no hydrogen 3.099 N/A SER 148.A OG LEU 145.A O no hydrogen 3.336 N/A LEU 158.A N THR 154.A O no hydrogen 3.189 N/A GLU 160.A N LYS 156.A O no hydrogen 2.908 N/A LYS 161.A N SER 157.A O no hydrogen 2.876 N/A LYS 161.A NZ VAL 150.A O no hydrogen 2.894 N/A ASP 162.A N LEU 158.A O no hydrogen 3.088 N/A HIS 163.A N GLU 159.A O no hydrogen 3.364 N/A ILE 164.A N GLU 160.A O no hydrogen 3.097 N/A HIS 165.A N LYS 161.A O no hydrogen 2.854 N/A ARG 166.A N ASP 162.A O no hydrogen 2.871 N/A VAL 167.A N HIS 163.A O no hydrogen 3.063 N/A VAL 167.A N ILE 164.A O no hydrogen 3.165 N/A LEU 168.A N ILE 164.A O no hydrogen 3.186 N/A ASP 169.A N HIS 165.A O no hydrogen 3.057 N/A LYS 170.A N ARG 166.A O no hydrogen 3.215 N/A LYS 170.A NZ ASP 173.A OD2 no hydrogen 3.550 N/A ILE 171.A N VAL 167.A O no hydrogen 2.741 N/A THR 172.A N LEU 168.A O no hydrogen 2.793 N/A THR 172.A OG1 LEU 168.A O no hydrogen 3.339 N/A ASP 173.A N ASP 169.A O no hydrogen 2.782 N/A THR 174.A N LYS 170.A O no hydrogen 2.797 N/A THR 174.A OG1 LYS 170.A O no hydrogen 2.675 N/A LEU 175.A N ILE 171.A O no hydrogen 3.004 N/A ILE 176.A N THR 172.A O no hydrogen 3.145 N/A HIS 177.A N ASP 173.A O no hydrogen 2.762 N/A LEU 178.A N THR 174.A O no hydrogen 2.863 N/A MET 179.A N LEU 175.A O no hydrogen 3.175 N/A ALA 180.A N ILE 176.A O no hydrogen 3.031 N/A LYS 181.A N HIS 177.A O no hydrogen 2.925 N/A ALA 182.A N LEU 178.A O no hydrogen 3.134 N/A GLY 183.A N ALA 180.A O no hydrogen 2.621 N/A LEU 184.A N MET 179.A O no hydrogen 2.847 N/A THR 185.A N GLN 188.A OE1 no hydrogen 2.631 N/A GLN 189.A N THR 185.A O no hydrogen 2.952 N/A GLN 189.A N LEU 186.A O no hydrogen 3.087 N/A GLN 189.A NE2 LEU 184.A O no hydrogen 2.810 N/A HIS 190.A N LEU 186.A O no hydrogen 3.389 N/A GLN 191.A N GLN 187.A O no hydrogen 3.136 N/A ARG 192.A N GLN 188.A O no hydrogen 3.147 N/A ARG 192.A NE GLU 136.A OE2 no hydrogen 2.684 N/A ARG 192.A NH1 MET 130.A O no hydrogen 3.059 N/A ARG 192.A NH2 MET 130.A O no hydrogen 3.514 N/A ARG 192.A NH2 GLU 136.A OE1 no hydrogen 2.650 N/A ARG 192.A NH2 GLU 136.A OE2 no hydrogen 3.065 N/A LEU 193.A N GLN 189.A O no hydrogen 2.878 N/A ALA 194.A N HIS 190.A O no hydrogen 3.305 N/A GLN 195.A N GLN 191.A O no hydrogen 3.219 N/A GLN 195.A NE2 GLN 191.A O no hydrogen 3.071 N/A LEU 196.A N ARG 192.A O no hydrogen 2.887 N/A LEU 197.A N LEU 193.A O no hydrogen 2.777 N/A LEU 198.A N ALA 194.A O no hydrogen 2.772 N/A ILE 199.A N GLN 195.A O no hydrogen 3.356 N/A ILE 199.A N LEU 196.A O no hydrogen 3.108 N/A LEU 200.A N LEU 197.A O no hydrogen 3.275 N/A ILE 203.A N ILE 199.A O no hydrogen 2.948 N/A ARG 204.A N LEU 200.A O no hydrogen 2.744 N/A HIS 205.A N SER 201.A O no hydrogen 3.220 N/A MET 206.A N HIS 202.A O no hydrogen 2.836 N/A SER 207.A N ILE 203.A O no hydrogen 2.904 N/A ASN 208.A N ARG 204.A O no hydrogen 3.080 N/A LYS 209.A N HIS 205.A O no hydrogen 3.269 N/A GLY 210.A N MET 206.A O no hydrogen 2.685 N/A MET 211.A N SER 207.A O no hydrogen 2.773 N/A GLU 212.A N ASN 208.A O no hydrogen 3.226 N/A HIS 213.A N LYS 209.A O no hydrogen 3.157 N/A HIS 213.A NE2 GLU 111.A O no hydrogen 2.985 N/A LEU 214.A N GLY 210.A O no hydrogen 3.030 N/A TYR 215.A N MET 211.A O no hydrogen 2.932 N/A SER 216.A N GLU 212.A O no hydrogen 2.831 N/A MET 217.A N HIS 213.A O no hydrogen 2.936 N/A LYS 218.A N LEU 214.A O no hydrogen 2.809 N/A CYS 219.A N TYR 215.A O no hydrogen 2.967 N/A CYS 219.A SG SER 216.A O no hydrogen 3.652 N/A LYS 220.A N SER 216.A O no hydrogen 3.015 N/A LYS 220.A N MET 217.A O no hydrogen 3.359 N/A LYS 220.A NZ GLU 111.A OE1 no hydrogen 2.478 N/A ASN 221.A N LYS 218.A O no hydrogen 3.137 N/A VAL 222.A N MET 217.A O no hydrogen 3.194 N/A LEU 229.A N ASP 43.A OD1 no hydrogen 3.143 N/A LEU 230.A N TYR 226.A O no hydrogen 2.490 N/A GLU 231.A N ASP 227.A O no hydrogen 3.071 N/A MET 232.A N LEU 228.A O no hydrogen 3.139 N/A LEU 233.A N LEU 229.A O no hydrogen 2.968 N/A ASP 234.A N LEU 230.A O no hydrogen 2.881 N/A ALA 235.A N GLU 231.A O no hydrogen 3.302 N/A ALA 235.A N MET 232.A O no hydrogen 3.309 N/A HIS 236.A N LEU 233.A O no hydrogen 3.347 N/A HIS 236.A NE2 GLU 72.A O no hydrogen 2.942 N/A LEU 238.A N ASP 234.A O no hydrogen 2.959 N/A