Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nq1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N ARG 277.A O no hydrogen 3.214 N/A ARG 3.A N GLY 280.A O no hydrogen 3.066 N/A ARG 3.A NE GLY 280.A O no hydrogen 2.990 N/A ARG 5.A N VAL 282.A O no hydrogen 2.784 N/A ARG 5.A NH1 GLU 74.A OE1 no hydrogen 2.733 N/A ARG 5.A NH2 TYR 283.A OH no hydrogen 3.151 N/A LYS 6.A NZ GLU 15.A OE1 no hydrogen 3.521 N/A LYS 6.A NZ GLU 15.A OE2 no hydrogen 2.943 N/A ASN 7.A ND2 GLU 90.A OE1 no hydrogen 3.516 N/A VAL 8.A N TYR 88.A O no hydrogen 3.010 N/A LEU 9.A N ASN 7.A OD1 no hydrogen 2.948 N/A HIS 10.A N ASN 7.A O no hydrogen 2.762 N/A LEU 11.A N VAL 8.A O no hydrogen 3.164 N/A THR 12.A N GLU 15.A OE1 no hydrogen 3.155 N/A THR 14.A OG1 ASP 18.A OD2 no hydrogen 3.492 N/A GLU 15.A N THR 12.A OG1 no hydrogen 3.031 N/A LYS 16.A N THR 12.A O no hydrogen 3.185 N/A ARG 17.A N ASP 13.A O no hydrogen 2.880 N/A ASP 18.A N THR 14.A O no hydrogen 2.858 N/A PHE 19.A N GLU 15.A O no hydrogen 3.046 N/A VAL 20.A N LYS 16.A O no hydrogen 3.057 N/A ARG 21.A N ARG 17.A O no hydrogen 3.280 N/A THR 22.A N ASP 18.A O no hydrogen 2.899 N/A THR 22.A OG1 ASP 18.A O no hydrogen 2.947 N/A VAL 23.A N PHE 19.A O no hydrogen 2.997 N/A LEU 24.A N VAL 20.A O no hydrogen 3.072 N/A ILE 25.A N ARG 21.A O no hydrogen 3.149 N/A LEU 26.A N THR 22.A O no hydrogen 3.017 N/A LYS 27.A N VAL 23.A O no hydrogen 2.985 N/A LYS 27.A NZ ASP 33.A OD1 no hydrogen 3.428 N/A LYS 27.A NZ THR 134.A O no hydrogen 2.959 N/A GLU 28.A N LEU 24.A O no hydrogen 2.741 N/A LYS 29.A N ILE 25.A O no hydrogen 2.812 N/A GLY 30.A N LEU 26.A O no hydrogen 3.255 N/A GLY 30.A N LYS 27.A O no hydrogen 3.110 N/A ILE 31.A N LEU 26.A O no hydrogen 3.122 N/A TYR 32.A N LEU 26.A O no hydrogen 3.140 N/A TYR 32.A OH PRO 219.A O no hydrogen 2.776 N/A ARG 34.A N ILE 31.A O no hydrogen 2.925 N/A TYR 35.A N TYR 32.A O no hydrogen 3.203 N/A TYR 35.A OH ASP 76.A OD1 no hydrogen 2.985 N/A ILE 36.A N TYR 32.A O no hydrogen 3.403 N/A ALA 37.A N ASP 33.A O no hydrogen 2.930 N/A TRP 38.A N ARG 34.A O no hydrogen 2.854 N/A HIS 39.A N TYR 35.A O no hydrogen 3.132 N/A GLY 40.A N ILE 36.A O no hydrogen 3.042 N/A ALA 41.A N ALA 37.A O no hydrogen 2.906 N/A ALA 42.A N TRP 38.A O no hydrogen 3.027 N/A GLY 43.A N HIS 39.A O no hydrogen 3.070 N/A LYS 44.A N ALA 41.A O no hydrogen 3.078 N/A PHE 45.A N ALA 42.A O no hydrogen 3.131 N/A HIS 46.A ND1 ARG 53.A O no hydrogen 2.887 N/A THR 47.A N ARG 53.A O no hydrogen 3.330 N/A THR 47.A OG1 THR 47.A O no hydrogen 2.648 N/A THR 47.A OG1 GLN 257.A OE1 no hydrogen 2.920 N/A SER 51.A N PRO 48.A O no hydrogen 2.928 N/A ARG 53.A N SER 51.A OG no hydrogen 3.188 N/A ARG 53.A NE PRO 178.A O no hydrogen 3.169 N/A ARG 53.A NE TRP 179.A O no hydrogen 3.225 N/A ARG 53.A NH1 THR 47.A O no hydrogen 3.182 N/A ARG 53.A NH2 PRO 178.A O no hydrogen 3.092 N/A ASN 54.A N HIS 57.A O no hydrogen 3.145 N/A ALA 55.A N ALA 42.A O no hydrogen 3.250 N/A ALA 55.A N PHE 45.A O no hydrogen 2.934 N/A ALA 56.A N ASN 54.A OD1 no hydrogen 3.280 N/A MET 58.A N GLU 192.A OE1 no hydrogen 2.775 N/A SER 59.A OG TRP 179.A O no hydrogen 2.745 N/A SER 60.A N SER 59.A OG no hydrogen 2.821 N/A SER 60.A OG ASP 175.A OD2 no hydrogen 2.750 N/A SER 60.A OG GLN 248.A O no hydrogen 3.205 N/A PHE 62.A N SER 59.A O no hydrogen 3.152 N/A TRP 65.A N ALA 61.A O no hydrogen 2.781 N/A TRP 65.A NE1 TYR 264.A O no hydrogen 2.800 N/A HIS 66.A N PHE 62.A O no hydrogen 3.280 N/A HIS 66.A ND1 PHE 62.A O no hydrogen 2.779 N/A ARG 67.A N LEU 63.A O no hydrogen 3.071 N/A ARG 67.A NE ASP 232.A OD2 no hydrogen 2.689 N/A ARG 67.A NH1 GLN 239.A OE1 no hydrogen 3.042 N/A ARG 67.A NH1 VAL 273.A O no hydrogen 3.097 N/A ARG 67.A NH2 ASP 232.A OD2 no hydrogen 3.514 N/A ARG 67.A NH2 GLN 239.A OE1 no hydrogen 3.139 N/A GLU 68.A N PRO 64.A O no hydrogen 3.047 N/A TYR 69.A N TRP 65.A O no hydrogen 2.954 N/A TYR 69.A OH TYR 35.A O no hydrogen 2.636 N/A LEU 70.A N HIS 66.A O no hydrogen 2.935 N/A LEU 71.A N ARG 67.A O no hydrogen 2.986 N/A ARG 72.A N GLU 68.A O no hydrogen 2.935 N/A ARG 72.A NH2 GLU 68.A OE2 no hydrogen 2.736 N/A PHE 73.A N TYR 69.A O no hydrogen 2.987 N/A GLU 74.A N LEU 70.A O no hydrogen 2.698 N/A ARG 75.A N LEU 71.A O no hydrogen 2.895 N/A ASP 76.A N ARG 72.A O no hydrogen 3.164 N/A LEU 77.A N PHE 73.A O no hydrogen 3.042 N/A GLN 78.A N GLU 74.A O no hydrogen 2.873 N/A GLN 78.A NE2 PRO 82.A O no hydrogen 2.803 N/A SER 79.A N ARG 75.A O no hydrogen 2.938 N/A SER 79.A N ASP 76.A O no hydrogen 3.078 N/A SER 79.A OG ARG 75.A O no hydrogen 3.157 N/A ILE 80.A N ASP 76.A O no hydrogen 3.272 N/A ILE 80.A N LEU 77.A O no hydrogen 2.840 N/A ASN 81.A N LEU 77.A O no hydrogen 2.893 N/A VAL 84.A N ASN 81.A O no hydrogen 3.021 N/A THR 85.A OG1 VAL 4.A O no hydrogen 2.796 N/A LEU 86.A N GLU 74.A OE2 no hydrogen 2.639 N/A TYR 88.A N LYS 6.A O no hydrogen 2.950 N/A TRP 89.A N LEU 226.A O no hydrogen 3.029 N/A TRP 89.A NE1 ASP 94.A OD1 no hydrogen 2.849 N/A TRP 91.A N TRP 89.A O no hydrogen 2.943 N/A GLU 92.A N GLU 92.A OE1 no hydrogen 2.980 N/A THR 93.A N GLU 90.A O no hydrogen 3.158 N/A THR 93.A OG1 GLU 90.A O no hydrogen 2.728 N/A ALA 95.A N TRP 91.A O no hydrogen 2.890 N/A GLN 96.A N THR 93.A O no hydrogen 2.842 N/A MET 97.A N ASP 94.A O no hydrogen 2.948 N/A SER 101.A N ASP 99.A OD2 no hydrogen 3.234 N/A SER 101.A OG ASP 99.A OD1 no hydrogen 3.112 N/A SER 101.A OG ASP 99.A OD2 no hydrogen 2.837 N/A GLN 102.A N ASP 99.A O no hydrogen 2.947 N/A GLN 102.A NE2 ASP 99.A OD1 no hydrogen 3.296 N/A GLN 102.A NE2 SER 101.A OG no hydrogen 3.044 N/A SER 103.A N PRO 100.A O no hydrogen 3.001 N/A SER 103.A OG ASP 94.A OD1 no hydrogen 2.592 N/A SER 103.A OG ASP 94.A OD2 no hydrogen 3.448 N/A ILE 105.A N SER 103.A OG no hydrogen 3.313 N/A TRP 106.A N SER 103.A O no hydrogen 3.083 N/A SER 107.A N GLN 104.A O no hydrogen 3.231 N/A SER 107.A OG GLN 104.A O no hydrogen 3.190 N/A SER 107.A OG ASP 109.A OD1 no hydrogen 2.743 N/A PHE 110.A N SER 107.A O no hydrogen 3.033 N/A MET 111.A N ILE 105.A O no hydrogen 3.231 N/A GLY 112.A N SER 107.A O no hydrogen 2.937 N/A GLY 113.A N THR 125.A OG1 no hydrogen 3.039 N/A ASN 116.A N ILE 122.A O no hydrogen 2.930 N/A ASP 120.A N PRO 117.A O no hydrogen 2.979 N/A PHE 121.A N ASN 116.A O no hydrogen 2.504 N/A VAL 123.A N LEU 146.A O no hydrogen 2.922 N/A ALA 129.A N GLY 126.A O no hydrogen 3.394 N/A ALA 130.A N VAL 123.A O no hydrogen 3.075 N/A ARG 132.A N ALA 129.A O no hydrogen 2.961 N/A ARG 132.A NE GLY 126.A O no hydrogen 3.231 N/A ARG 132.A NH2 GLY 126.A O no hydrogen 2.716 N/A TRP 133.A NE1 ASN 220.A O no hydrogen 3.122 N/A THR 135.A OG1 SER 143.A OG no hydrogen 2.275 N/A ILE 136.A N ASN 220.A OD1 no hydrogen 3.061 N/A ASP 137.A N ASN 141.A O no hydrogen 2.812 N/A GLN 139.A N ASP 137.A OD2 no hydrogen 3.185 N/A GLY 140.A N ASP 137.A O no hydrogen 2.928 N/A ASN 141.A N ASP 137.A OD2 no hydrogen 2.724 N/A SER 143.A N THR 135.A O no hydrogen 2.777 N/A SER 143.A OG THR 135.A OG1 no hydrogen 2.275 N/A GLY 145.A N THR 135.A OG1 no hydrogen 2.952 N/A LYS 147.A N GLN 211.A OE1 no hydrogen 2.874 N/A LYS 147.A NZ ASP 120.A OD2 no hydrogen 3.112 N/A ARG 148.A N PHE 121.A O no hydrogen 3.349 N/A ARG 148.A NE ASP 221.A OD2 no hydrogen 2.706 N/A ARG 148.A NH1 MET 111.A O no hydrogen 2.797 N/A ARG 148.A NH1 GLY 113.A O no hydrogen 3.119 N/A ARG 148.A NH2 MET 111.A O no hydrogen 3.126 N/A ARG 148.A NH2 ASP 221.A OD1 no hydrogen 2.876 N/A ARG 148.A NH2 ASP 221.A OD2 no hydrogen 3.433 N/A ASN 149.A N VAL 208.A O no hydrogen 2.901 N/A GLY 151.A N TRP 207.A O no hydrogen 2.665 N/A ALA 156.A N THR 153.A OG1 no hydrogen 3.202 N/A THR 158.A OG1 LEU 159.A O no hydrogen 3.133 N/A THR 161.A N ASP 164.A OD2 no hydrogen 2.846 N/A THR 161.A OG1 ASP 164.A OD2 no hydrogen 2.921 N/A ASP 164.A N THR 161.A OG1 no hydrogen 3.364 N/A VAL 165.A N THR 161.A O no hydrogen 3.033 N/A LEU 166.A N ARG 162.A O no hydrogen 2.790 N/A ASN 167.A N ASP 163.A O no hydrogen 2.879 N/A ALA 168.A N ASP 164.A O no hydrogen 3.259 N/A LEU 169.A N VAL 165.A O no hydrogen 3.032 N/A LYS 170.A N ASN 167.A O no hydrogen 3.143 N/A LYS 170.A NZ ASN 167.A OD1 no hydrogen 3.453 N/A ILE 171.A N ALA 168.A O no hydrogen 3.038 N/A TYR 174.A OH SER 60.A O no hydrogen 2.692 N/A THR 176.A N ASP 175.A OD1 no hydrogen 2.827 N/A THR 176.A OG1 GLN 184.A O no hydrogen 2.945 N/A TRP 179.A N THR 176.A O no hydrogen 2.960 N/A ASP 180.A N SER 183.A OG no hydrogen 3.093 N/A THR 182.A N ASP 180.A OD2 no hydrogen 3.184 N/A THR 182.A OG1 ASP 180.A OD1 no hydrogen 3.544 N/A THR 182.A OG1 ASP 180.A OD2 no hydrogen 2.729 N/A SER 183.A N ASP 180.A O no hydrogen 3.157 N/A SER 183.A OG ASP 175.A OD1 no hydrogen 3.467 N/A SER 183.A OG THR 176.A O no hydrogen 2.748 N/A SER 183.A OG ASP 180.A O no hydrogen 3.123 N/A SER 186.A OG TYR 174.A O no hydrogen 3.248 N/A SER 186.A OG ASP 175.A OD1 no hydrogen 2.805 N/A PHE 187.A N GLN 173.A O no hydrogen 2.812 N/A ARG 188.A N TYR 174.A O no hydrogen 2.750 N/A ARG 188.A NE ASP 175.A OD2 no hydrogen 2.753 N/A ARG 188.A NH1 GLU 192.A OE2 no hydrogen 2.973 N/A ARG 188.A NH2 ASP 175.A OD1 no hydrogen 3.141 N/A ARG 188.A NH2 ASP 175.A OD2 no hydrogen 3.255 N/A ARG 188.A NH2 ASP 180.A O no hydrogen 2.813 N/A ASN 189.A N SER 186.A OG no hydrogen 2.970 N/A ASN 189.A ND2 MET 181.A O no hydrogen 2.751 N/A ASN 189.A ND2 SER 183.A O no hydrogen 3.045 N/A GLN 190.A N SER 186.A O no hydrogen 3.034 N/A LEU 191.A N PHE 187.A O no hydrogen 2.771 N/A GLU 192.A N ARG 188.A O no hydrogen 2.905 N/A GLY 193.A N ASN 189.A O no hydrogen 3.119 N/A PHE 194.A N ASN 189.A O no hydrogen 3.087 N/A GLY 197.A N PHE 194.A O no hydrogen 3.217 N/A GLN 199.A N GLY 193.A O no hydrogen 2.996 N/A HIS 201.A N LEU 191.A O no hydrogen 3.148 N/A HIS 201.A ND1 GLU 192.A O no hydrogen 3.007 N/A HIS 201.A NE2 HIS 228.A NE2 no hydrogen 3.010 N/A ASN 202.A N GLU 192.A O no hydrogen 2.850 N/A ARG 203.A N GLN 199.A O no hydrogen 3.177 N/A ARG 203.A NE PRO 198.A O no hydrogen 2.942 N/A ARG 203.A NH1 THR 158.A O no hydrogen 2.841 N/A VAL 204.A N LEU 200.A O no hydrogen 3.017 N/A HIS 205.A N HIS 201.A O no hydrogen 3.332 N/A HIS 205.A ND1 MET 212.A O no hydrogen 2.958 N/A HIS 205.A NE2 HIS 201.A NE2 no hydrogen 2.868 N/A ARG 206.A N ASN 202.A O no hydrogen 2.980 N/A ARG 206.A NH2 GLY 213.A O no hydrogen 3.178 N/A TRP 207.A N ARG 203.A O no hydrogen 2.739 N/A VAL 208.A N VAL 204.A O no hydrogen 2.932 N/A GLY 209.A N HIS 205.A O no hydrogen 3.147 N/A GLN 211.A N GLN 211.A OE1 no hydrogen 2.828 N/A GLN 211.A NE2 GLY 145.A O no hydrogen 3.145 N/A GLY 213.A N GLY 210.A O no hydrogen 2.924 N/A VAL 214.A N GLN 211.A O no hydrogen 3.299 N/A THR 217.A N VAL 214.A O no hydrogen 3.313 N/A THR 217.A OG1 GLN 211.A O no hydrogen 3.141 N/A ALA 218.A N VAL 214.A O no hydrogen 2.953 N/A ASN 220.A N THR 217.A O no hydrogen 2.884 N/A ASN 220.A ND2 ILE 136.A O no hydrogen 3.063 N/A ASN 220.A ND2 THR 217.A O no hydrogen 2.758 N/A ASP 221.A N ALA 218.A O no hydrogen 3.447 N/A VAL 223.A N ASP 221.A OD1 no hydrogen 2.936 N/A PHE 224.A N ASP 221.A O no hydrogen 2.814 N/A PHE 225.A N PRO 222.A O no hydrogen 3.051 N/A HIS 227.A N VAL 223.A O no hydrogen 2.746 N/A HIS 228.A N PHE 224.A O no hydrogen 2.999 N/A ALA 229.A N PHE 225.A O no hydrogen 3.000 N/A ASN 230.A N LEU 226.A O no hydrogen 3.375 N/A ASN 230.A N HIS 227.A O no hydrogen 2.930 N/A ASN 230.A ND2 GLU 92.A OE1 no hydrogen 2.730 N/A VAL 231.A N HIS 227.A O no hydrogen 3.092 N/A ASP 232.A N HIS 228.A O no hydrogen 2.942 N/A ARG 233.A N ALA 229.A O no hydrogen 2.922 N/A ARG 233.A NE ASN 230.A OD1 no hydrogen 2.799 N/A ARG 233.A NH2 GLU 92.A OE2 no hydrogen 2.721 N/A ARG 233.A NH2 ASN 230.A OD1 no hydrogen 2.741 N/A ILE 234.A N ASN 230.A O no hydrogen 2.817 N/A TRP 235.A N VAL 231.A O no hydrogen 3.016 N/A ALA 236.A N ASP 232.A O no hydrogen 2.869 N/A VAL 237.A N ARG 233.A O no hydrogen 2.923 N/A TRP 238.A N ILE 234.A O no hydrogen 2.956 N/A TRP 238.A NE1 ILE 171.A O no hydrogen 2.787 N/A GLN 239.A N TRP 235.A O no hydrogen 2.825 N/A GLN 239.A NE2 MET 274.A O no hydrogen 2.793 N/A ILE 240.A N ALA 236.A O no hydrogen 3.268 N/A ILE 240.A N VAL 237.A O no hydrogen 2.975 N/A ILE 241.A N VAL 237.A O no hydrogen 2.925 N/A HIS 242.A N TRP 238.A O no hydrogen 2.953 N/A HIS 242.A NE2 LEU 169.A O no hydrogen 2.936 N/A GLN 245.A N HIS 242.A O no hydrogen 3.215 N/A TYR 247.A N ASN 246.A OD1 no hydrogen 2.732 N/A TYR 247.A OH GLN 257.A O no hydrogen 2.693 N/A GLY 256.A N ASP 261.A OD2 no hydrogen 3.005 N/A GLN 257.A N PRO 254.A O no hydrogen 2.867 N/A ASN 258.A N ASP 261.A OD2 no hydrogen 2.813 N/A ASP 261.A N ASN 258.A O no hydrogen 2.898 N/A MET 263.A N THR 268.A O no hydrogen 2.769 N/A TRP 266.A N MET 263.A O no hydrogen 2.802 N/A THR 269.A N ASP 272.A OD2 no hydrogen 2.697 N/A GLU 271.A N PHE 259.A O no hydrogen 3.105 N/A ASP 272.A N THR 269.A OG1 no hydrogen 3.224 N/A VAL 273.A N PRO 270.A O no hydrogen 3.039 N/A MET 274.A N GLU 271.A O no hydrogen 3.265 N/A HIS 276.A ND1 TYR 281.A O no hydrogen 2.750 N/A LYS 278.A N ASN 275.A O no hydrogen 2.934 N/A LEU 279.A N HIS 276.A O no hydrogen 3.024 N/A GLY 280.A N ARG 277.A O no hydrogen 3.118 N/A TYR 281.A OH ASP 232.A OD1 no hydrogen 2.765 N/A VAL 282.A N ARG 3.A O no hydrogen 2.867 N/A TYR 283.A OH ALA 229.A O no hydrogen 3.113 N/A TYR 283.A OH ASP 232.A OD1 no hydrogen 2.602 N/A