Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7aux_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N GLY 31.A O no hydrogen 2.929 N/A ASN 5.A N THR 33.A O no hydrogen 2.700 N/A SER 7.A N ASN 5.A OD1 no hydrogen 3.084 N/A SER 7.A OG ASN 5.A OD1 no hydrogen 2.906 N/A TRP 8.A N ASN 5.A O no hydrogen 3.221 N/A TRP 8.A NE1 GLU 237.A OE2 no hydrogen 2.718 N/A ASN 9.A N LYS 6.A O no hydrogen 2.951 N/A ASN 9.A ND2 LYS 6.A O no hydrogen 3.256 N/A ALA 10.A N SER 7.A O no hydrogen 3.037 N/A HIS 11.A N TRP 8.A O no hydrogen 2.950 N/A HIS 11.A NE2 GLN 236.A OE1 no hydrogen 2.679 N/A PHE 12.A N ASN 9.A O no hydrogen 3.152 N/A THR 13.A N ASN 9.A O no hydrogen 3.029 N/A THR 13.A OG1 ASN 9.A O no hydrogen 3.335 N/A THR 13.A OG1 ALA 10.A O no hydrogen 3.337 N/A THR 13.A OG1 GLU 14.A OE1 no hydrogen 3.396 N/A HIS 15.A N PHE 12.A O no hydrogen 3.114 N/A SER 17.A N PHE 12.A O no hydrogen 2.976 N/A SER 17.A OG HIS 15.A O no hydrogen 2.805 N/A VAL 20.A N ASN 214.A O no hydrogen 2.729 N/A VAL 21.A N ASN 34.A OD1 no hydrogen 2.997 N/A VAL 22.A N ALA 212.A O no hydrogen 2.784 N/A LEU 23.A N PHE 32.A O no hydrogen 2.705 N/A TRP 24.A N PHE 210.A O no hydrogen 2.928 N/A ASN 25.A N GLN 30.A O no hydrogen 2.848 N/A GLU 26.A N VAL 208.A O no hydrogen 3.137 N/A ASN 27.A N ASN 207.A OD1 no hydrogen 2.980 N/A ASN 27.A ND2 ASP 206.A O no hydrogen 2.771 N/A LYS 28.A N ASN 25.A OD1 no hydrogen 3.077 N/A GLN 29.A NE2 GLU 26.A O no hydrogen 2.751 N/A GLN 30.A N ASN 25.A O no hydrogen 3.286 N/A GLY 31.A N GLU 1.A O no hydrogen 2.771 N/A PHE 32.A N LEU 23.A O no hydrogen 2.824 N/A THR 33.A N GLN 3.A O no hydrogen 3.125 N/A THR 33.A OG1 VAL 21.A O no hydrogen 2.860 N/A ASN 34.A ND2 ASN 9.A OD1 no hydrogen 2.668 N/A ASN 34.A ND2 GLY 19.A O no hydrogen 3.193 N/A ASN 35.A N THR 33.A OG1 no hydrogen 3.314 N/A LEU 36.A N GLU 4.A OE1 no hydrogen 2.860 N/A ARG 38.A N ASN 35.A OD1 no hydrogen 2.912 N/A ARG 38.A NE ASN 214.A OD1 no hydrogen 2.881 N/A ARG 38.A NH1 ASN 214.A OD1 no hydrogen 3.261 N/A ARG 38.A NH1 ASP 216.A OD1 no hydrogen 3.039 N/A ARG 38.A NH2 ASP 216.A OD1 no hydrogen 3.212 N/A ALA 39.A N ASN 35.A O no hydrogen 2.932 N/A ASN 40.A N LYS 37.A O no hydrogen 3.067 N/A ASN 40.A ND2 LEU 36.A O no hydrogen 3.052 N/A GLN 41.A N ARG 38.A O no hydrogen 3.126 N/A PHE 43.A N ILE 140.A O no hydrogen 2.699 N/A ALA 46.A N TRP 133.A O no hydrogen 3.020 N/A THR 48.A N PRO 45.A O no hydrogen 3.148 N/A THR 48.A OG1 PRO 45.A O no hydrogen 2.516 N/A PHE 49.A N ALA 46.A O no hydrogen 2.762 N/A ASN 52.A N PHE 49.A O no hydrogen 2.954 N/A ASN 52.A ND2 TYR 99.A O no hydrogen 3.535 N/A SER 53.A OG TYR 99.A OH no hydrogen 2.691 N/A LEU 54.A N ILE 50.A O no hydrogen 3.195 N/A ILE 55.A N PRO 51.A O no hydrogen 2.969 N/A ALA 56.A N ASN 52.A O no hydrogen 2.950 N/A LEU 57.A N SER 53.A O no hydrogen 2.890 N/A ASP 58.A N LEU 54.A O no hydrogen 3.078 N/A LEU 59.A N ILE 55.A O no hydrogen 3.109 N/A GLY 60.A N ALA 56.A O no hydrogen 3.046 N/A VAL 62.A N ALA 56.A O no hydrogen 3.174 N/A LYS 63.A N GLN 67.A OE1 no hydrogen 2.807 N/A GLU 65.A N GLU 65.A OE2 no hydrogen 2.544 N/A HIS 66.A N ASP 64.A OD1 no hydrogen 2.848 N/A GLN 67.A N ASP 64.A OD1 no hydrogen 2.860 N/A PHE 69.A N HIS 85.A O no hydrogen 2.669 N/A LYS 70.A NZ ASP 84.A OD2 no hydrogen 2.513 N/A TRP 71.A N ASP 84.A OD1 no hydrogen 2.878 N/A TRP 71.A NE1 GLN 74.A O no hydrogen 2.850 N/A GLN 74.A N ASP 72.A OD1 no hydrogen 2.771 N/A ARG 76.A N ASN 82.A OD1 no hydrogen 2.859 N/A ARG 76.A NH1 ASP 72.A OD2 no hydrogen 2.976 N/A ARG 76.A NH2 ASP 72.A OD1 no hydrogen 3.159 N/A ARG 76.A NH2 ASP 72.A OD2 no hydrogen 3.448 N/A TRP 81.A N ILE 78.A O no hydrogen 2.978 N/A TRP 81.A NE1 TYR 93.A O no hydrogen 3.065 N/A ASN 82.A N ALA 79.A O no hydrogen 3.058 N/A ASN 82.A ND2 ARG 76.A O no hydrogen 3.183 N/A ARG 83.A N TRP 81.A O no hydrogen 2.975 N/A HIS 85.A N PHE 69.A O no hydrogen 3.105 N/A HIS 85.A ND1 THR 89.A OG1 no hydrogen 2.768 N/A HIS 85.A NE2 THR 80.A O no hydrogen 2.762 N/A ASN 86.A N THR 89.A OG1 no hydrogen 3.277 N/A THR 89.A N ASN 86.A OD1 no hydrogen 2.841 N/A THR 89.A OG1 HIS 85.A ND1 no hydrogen 2.768 N/A THR 89.A OG1 ASN 86.A OD1 no hydrogen 3.511 N/A ALA 90.A N ASN 86.A O no hydrogen 3.016 N/A MET 91.A N LEU 87.A O no hydrogen 3.190 N/A LYS 92.A N ILE 88.A O no hydrogen 3.149 N/A LYS 92.A NZ TYR 93.A OH no hydrogen 3.240 N/A TYR 93.A N THR 89.A O no hydrogen 2.961 N/A SER 94.A N MET 91.A O no hydrogen 3.144 N/A VAL 95.A N ALA 90.A O no hydrogen 2.862 N/A VAL 98.A N VAL 95.A O no hydrogen 3.149 N/A TYR 99.A OH SER 53.A OG no hydrogen 2.691 N/A GLN 100.A N VAL 96.A O no hydrogen 2.699 N/A GLN 100.A NE2 ASP 130.A O no hydrogen 3.277 N/A GLU 101.A N PRO 97.A O no hydrogen 3.038 N/A PHE 102.A N VAL 98.A O no hydrogen 3.090 N/A ALA 103.A N TYR 99.A O no hydrogen 2.778 N/A ARG 104.A N GLN 100.A O no hydrogen 3.043 N/A ARG 104.A NE GLU 101.A OE1 no hydrogen 3.278 N/A ARG 104.A NH1 ASP 130.A OD2 no hydrogen 2.875 N/A ARG 104.A NH2 GLU 101.A OE1 no hydrogen 3.074 N/A GLN 105.A N GLU 101.A O no hydrogen 3.132 N/A GLN 105.A NE2 GLU 101.A OE2 no hydrogen 2.856 N/A GLY 107.A N ALA 103.A O no hydrogen 2.713 N/A ARG 110.A NE ILE 106.A O no hydrogen 2.946 N/A ARG 110.A NH1 ILE 106.A O no hydrogen 3.130 N/A MET 111.A N GLY 107.A O no hydrogen 2.985 N/A SER 112.A N GLU 108.A O no hydrogen 2.898 N/A LYS 113.A N ALA 109.A O no hydrogen 3.206 N/A MET 114.A N ARG 110.A O no hydrogen 3.082 N/A LEU 115.A N MET 111.A O no hydrogen 3.070 N/A HIS 116.A N SER 112.A O no hydrogen 3.125 N/A ALA 117.A N LYS 113.A O no hydrogen 3.000 N/A PHE 118.A N MET 114.A O no hydrogen 2.717 N/A ASP 119.A N HIS 116.A O no hydrogen 3.146 N/A TYR 120.A N LEU 115.A O no hydrogen 3.180 N/A ASN 122.A N ARG 139.A O no hydrogen 2.921 N/A ASN 122.A ND2 GLY 137.A O no hydrogen 2.799 N/A GLU 123.A N TYR 120.A O no hydrogen 2.879 N/A ASP 124.A N ASN 122.A OD1 no hydrogen 3.318 N/A SER 126.A N ASP 124.A OD1 no hydrogen 3.041 N/A SER 126.A OG ASP 124.A OD1 no hydrogen 2.205 N/A SER 126.A OG ASP 124.A OD2 no hydrogen 3.146 N/A ASN 128.A ND2 SER 131.A OG no hydrogen 2.621 N/A SER 131.A N ASN 128.A O no hydrogen 3.036 N/A SER 131.A OG ASP 135.A OD1 no hydrogen 2.749 N/A SER 131.A OG ASP 135.A OD2 no hydrogen 3.475 N/A LEU 134.A N SER 131.A O no hydrogen 3.013 N/A ASP 135.A N SER 131.A O no hydrogen 2.938 N/A GLY 136.A N PHE 132.A O no hydrogen 2.763 N/A ARG 139.A N ASN 122.A OD1 no hydrogen 2.923 N/A ARG 139.A NH1 GLY 136.A O no hydrogen 2.924 N/A ARG 139.A NH1 ILE 138.A O no hydrogen 2.889 N/A ILE 140.A N PHE 43.A O no hydrogen 2.706 N/A SER 141.A N GLU 144.A OE1 no hydrogen 2.941 N/A SER 141.A OG THR 143.A OG1 no hydrogen 3.036 N/A THR 143.A N ALA 39.A O no hydrogen 3.113 N/A THR 143.A OG1 ASN 40.A OD1 no hydrogen 2.876 N/A THR 143.A OG1 SER 141.A OG no hydrogen 3.036 N/A GLU 144.A N SER 141.A OG no hydrogen 3.269 N/A GLN 145.A N SER 141.A O no hydrogen 2.819 N/A GLN 145.A NE2 THR 48.A OG1 no hydrogen 3.048 N/A ILE 146.A N ALA 142.A O no hydrogen 3.215 N/A SER 147.A N THR 143.A O no hydrogen 3.103 N/A SER 147.A OG THR 143.A O no hydrogen 3.336 N/A PHE 148.A N GLU 144.A O no hydrogen 3.084 N/A LEU 149.A N GLN 145.A O no hydrogen 2.862 N/A ARG 150.A N ILE 146.A O no hydrogen 2.983 N/A ARG 150.A NE GLU 26.A OE2 no hydrogen 2.764 N/A ARG 150.A NH1 GLU 26.A OE1 no hydrogen 3.212 N/A LYS 151.A N SER 147.A O no hydrogen 3.446 N/A LYS 151.A NZ PHE 118.A O no hydrogen 3.434 N/A LEU 152.A N PHE 148.A O no hydrogen 3.096 N/A TYR 153.A N LEU 149.A O no hydrogen 2.850 N/A HIS 154.A N ARG 150.A O no hydrogen 3.069 N/A HIS 154.A NE2 GLU 26.A OE1 no hydrogen 2.782 N/A ASN 155.A N LEU 152.A O no hydrogen 3.076 N/A LYS 156.A N LYS 151.A O no hydrogen 2.775 N/A LEU 157.A N GLN 164.A OE1 no hydrogen 3.225 N/A HIS 158.A ND1 ALA 117.A O no hydrogen 3.291 N/A SER 160.A N ASP 58.A OD1 no hydrogen 2.841 N/A SER 160.A OG ASP 58.A OD1 no hydrogen 3.287 N/A SER 160.A OG SER 163.A OG no hydrogen 2.361 N/A ARG 162.A NH1 LYS 63.A O no hydrogen 2.609 N/A ARG 162.A NH2 LYS 63.A O no hydrogen 3.385 N/A SER 163.A N SER 160.A OG no hydrogen 3.149 N/A SER 163.A OG ASP 58.A OD1 no hydrogen 3.086 N/A SER 163.A OG SER 160.A OG no hydrogen 2.361 N/A GLN 164.A N SER 160.A O no hydrogen 3.280 N/A GLN 164.A NE2 ASN 155.A O no hydrogen 3.524 N/A GLN 164.A NE2 LEU 157.A O no hydrogen 3.227 N/A GLN 164.A NE2 VAL 159.A O no hydrogen 3.064 N/A GLN 164.A NE2 SER 160.A O no hydrogen 3.378 N/A ARG 165.A N GLU 161.A O no hydrogen 2.776 N/A ARG 165.A NE GLU 161.A OE2 no hydrogen 2.720 N/A ARG 165.A NH2 GLU 161.A OE2 no hydrogen 3.433 N/A ILE 166.A N ARG 162.A O no hydrogen 2.941 N/A VAL 167.A N SER 163.A O no hydrogen 3.113 N/A LYS 168.A N GLN 164.A O no hydrogen 3.073 N/A LYS 168.A NZ LEU 152.A O no hydrogen 3.364 N/A LYS 168.A NZ TYR 153.A O no hydrogen 3.282 N/A LYS 168.A NZ ASN 155.A OD1 no hydrogen 2.784 N/A GLN 169.A N ARG 165.A O no hydrogen 3.036 N/A ALA 170.A N ILE 166.A O no hydrogen 2.920 N/A MET 171.A N VAL 167.A O no hydrogen 2.849 N/A MET 171.A N LYS 168.A O no hydrogen 3.256 N/A LEU 172.A N GLN 169.A O no hydrogen 3.056 N/A THR 173.A N ILE 181.A O no hydrogen 2.836 N/A THR 173.A OG1 MET 171.A O no hydrogen 2.897 N/A THR 173.A OG1 ALA 183.A O no hydrogen 3.445 N/A GLU 174.A N ILE 181.A O no hydrogen 3.153 N/A ASN 176.A N TYR 179.A O no hydrogen 2.986 N/A ASP 178.A N ASN 176.A OD1 no hydrogen 2.628 N/A TYR 179.A N ASN 176.A OD1 no hydrogen 2.905 N/A TYR 179.A OH GLU 174.A OE2 no hydrogen 2.937 N/A ILE 180.A N GLU 203.A O no hydrogen 3.044 N/A ILE 181.A N GLU 174.A O no hydrogen 2.641 N/A ARG 182.A N TRP 201.A O no hydrogen 3.141 N/A ARG 182.A NE GLU 203.A OE1 no hydrogen 2.827 N/A ARG 182.A NH1 LYS 168.A O no hydrogen 2.947 N/A ALA 183.A N MET 171.A O no hydrogen 2.979 N/A LYS 184.A N VAL 199.A O no hydrogen 2.747 N/A LYS 184.A NZ MET 91.A O no hydrogen 3.376 N/A LYS 184.A NZ SER 94.A OG no hydrogen 2.630 N/A LYS 184.A NZ THR 185.A O no hydrogen 3.021 N/A GLY 186.A N TRP 197.A O no hydrogen 3.029 N/A TYR 187.A OH MET 217.A O no hydrogen 3.087 N/A SER 188.A N ILE 195.A O no hydrogen 2.933 N/A ARG 190.A NH1 ASP 135.A OD2 no hydrogen 2.770 N/A LYS 194.A N GLU 192.A OE2 no hydrogen 3.249 N/A LYS 194.A NZ GLU 192.A OE1 no hydrogen 2.806 N/A ILE 195.A N SER 188.A O no hydrogen 3.262 N/A GLY 196.A N MET 215.A O no hydrogen 2.775 N/A TRP 197.A N GLY 186.A O no hydrogen 2.739 N/A TRP 197.A NE1 LEU 44.A O no hydrogen 2.632 N/A TRP 198.A N MET 213.A O no hydrogen 2.947 N/A VAL 199.A N LYS 184.A O no hydrogen 3.035 N/A GLY 200.A N PHE 211.A O no hydrogen 2.859 N/A TRP 201.A N ARG 182.A O no hydrogen 2.844 N/A TRP 201.A NE1 GLU 203.A OE1 no hydrogen 2.878 N/A VAL 202.A N TRP 209.A O no hydrogen 2.633 N/A GLU 203.A N ILE 180.A O no hydrogen 2.745 N/A LEU 204.A N ASN 207.A O no hydrogen 2.841 N/A ASN 207.A ND2 ASN 25.A OD1 no hydrogen 2.913 N/A VAL 208.A N ASN 207.A OD1 no hydrogen 2.804 N/A TRP 209.A N VAL 202.A O no hydrogen 2.866 N/A PHE 210.A N TRP 24.A O no hydrogen 3.097 N/A PHE 211.A N GLY 200.A O no hydrogen 2.829 N/A ALA 212.A N VAL 22.A O no hydrogen 2.992 N/A MET 213.A N TRP 198.A O no hydrogen 2.852 N/A ASN 214.A N VAL 20.A O no hydrogen 2.948 N/A MET 215.A N GLY 196.A O no hydrogen 3.020 N/A ASP 216.A N GLN 18.A O no hydrogen 2.990 N/A MET 217.A N LYS 194.A O no hydrogen 2.721 N/A ASP 221.A N THR 219.A OG1 no hydrogen 3.032 N/A GLY 222.A N THR 219.A O no hydrogen 3.506 N/A LEU 223.A N SER 220.A O no hydrogen 3.339 N/A LEU 225.A N GLY 222.A O no hydrogen 2.799 N/A ARG 226.A N LEU 223.A O no hydrogen 2.974 N/A ARG 226.A NE LEU 223.A O no hydrogen 2.862 N/A ARG 226.A NH2 GLY 186.A O no hydrogen 2.921 N/A GLN 227.A N GLN 227.A OE1 no hydrogen 2.695 N/A ALA 228.A N GLY 224.A O no hydrogen 3.163 N/A ILE 229.A N LEU 225.A O no hydrogen 2.876 N/A THR 230.A OG1 ARG 226.A O no hydrogen 2.778 N/A LYS 231.A N GLN 227.A O no hydrogen 2.934 N/A LYS 231.A NZ GLU 174.A OE1 no hydrogen 2.775 N/A GLU 232.A N ALA 228.A O no hydrogen 3.006 N/A VAL 233.A N ILE 229.A O no hydrogen 3.037 N/A LEU 234.A N THR 230.A O no hydrogen 2.826 N/A LYS 235.A N LYS 231.A O no hydrogen 2.761 N/A LYS 235.A NZ GLU 232.A OE1 no hydrogen 3.371 N/A GLN 236.A N GLU 232.A O no hydrogen 2.965 N/A GLN 236.A NE2 SER 7.A OG no hydrogen 2.967 N/A GLU 237.A N VAL 233.A O no hydrogen 3.002 N/A LYS 238.A N LYS 235.A O no hydrogen 2.978 N/A ILE 239.A N LEU 234.A O no hydrogen 2.973 N/A