Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qmq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A ND1 HIS 1.A O no hydrogen 3.108 N/A HIS 4.A N VAL 19.A O no hydrogen 3.125 N/A HIS 4.A ND1 HIS 6.A NE2 no hydrogen 2.831 N/A HIS 6.A N PHE 17.A O no hydrogen 2.846 N/A HIS 6.A ND1 TYR 99.A OH no hydrogen 2.592 N/A HIS 6.A NE2 HIS 4.A ND1 no hydrogen 2.831 N/A VAL 8.A N VAL 15.A O no hydrogen 3.000 N/A THR 10.A N GLY 13.A O no hydrogen 2.954 N/A THR 10.A OG1 GLY 13.A O no hydrogen 2.607 N/A TYR 12.A N THR 10.A OG1 no hydrogen 3.011 N/A TYR 12.A OH ASP 91.A OD2 no hydrogen 3.062 N/A GLY 13.A N THR 10.A O no hydrogen 3.132 N/A VAL 15.A N VAL 8.A O no hydrogen 3.067 N/A PHE 17.A N HIS 6.A O no hydrogen 2.866 N/A THR 18.A N HIS 64.A O no hydrogen 2.907 N/A VAL 19.A N HIS 4.A O no hydrogen 2.826 N/A TYR 20.A N ARG 62.A O no hydrogen 2.936 N/A TYR 20.A OH HIS 3.A ND1 no hydrogen 3.372 N/A TYR 20.A OH TYR 40.A OH no hydrogen 2.628 N/A LYS 24.A NZ THR 22.A O no hydrogen 2.763 N/A LYS 24.A NZ ASN 59.A O no hydrogen 2.874 N/A ARG 27.A N LYS 24.A O no hydrogen 3.159 N/A ALA 29.A N THR 104.A O no hydrogen 3.097 N/A ILE 30.A N VAL 61.A O no hydrogen 2.884 N/A PHE 31.A N ILE 106.A O no hydrogen 2.897 N/A THR 32.A N VAL 63.A O no hydrogen 2.896 N/A THR 32.A OG1 HIS 64.A ND1 no hydrogen 2.770 N/A TYR 33.A N VAL 108.A O no hydrogen 3.012 N/A HIS 34.A ND1 ASP 35.A O no hydrogen 2.897 N/A VAL 36.A N ASP 35.A OD1 no hydrogen 2.779 N/A LEU 38.A N ASP 35.A O no hydrogen 3.107 N/A ASN 39.A N SER 42.A OG no hydrogen 2.997 N/A ASN 39.A ND2 MET 70.A O no hydrogen 3.278 N/A TYR 40.A N ASP 66.A OD1 no hydrogen 2.879 N/A TYR 40.A OH TYR 20.A OH no hydrogen 2.628 N/A SER 42.A N ASN 39.A OD1 no hydrogen 3.201 N/A SER 42.A OG ASN 39.A OD1 no hydrogen 3.376 N/A CYS 43.A N ASN 39.A O no hydrogen 2.910 N/A PHE 44.A N TYR 40.A O no hydrogen 2.851 N/A GLN 45.A N LYS 41.A O no hydrogen 2.966 N/A PHE 48.A N PHE 44.A O no hydrogen 2.820 N/A ARG 49.A N GLN 45.A O no hydrogen 2.871 N/A PHE 50.A N LEU 47.A O no hydrogen 3.190 N/A GLN 54.A N PHE 50.A O no hydrogen 2.891 N/A GLN 54.A NE2 ARG 49.A O no hydrogen 2.734 N/A GLU 55.A N GLY 51.A O no hydrogen 3.334 N/A ILE 56.A N ASP 52.A O no hydrogen 3.359 N/A ILE 57.A N MET 53.A O no hydrogen 2.801 N/A GLN 58.A NE2 GLU 55.A O no hydrogen 2.974 N/A PHE 60.A N ILE 57.A O no hydrogen 2.971 N/A ARG 62.A N TYR 20.A O no hydrogen 2.827 N/A ARG 62.A NH1 PHE 60.A O no hydrogen 2.991 N/A VAL 63.A N ILE 30.A O no hydrogen 2.785 N/A HIS 64.A N THR 18.A O no hydrogen 2.845 N/A HIS 64.A ND1 THR 32.A OG1 no hydrogen 2.770 N/A VAL 65.A N THR 32.A O no hydrogen 3.055 N/A ASP 66.A N THR 16.A O no hydrogen 2.827 N/A ALA 67.A N HIS 34.A NE2 no hydrogen 3.020 N/A MET 70.A N ALA 67.A O no hydrogen 2.860 N/A GLU 71.A N GLU 71.A OE1 no hydrogen 2.779 N/A ALA 74.A N GLU 71.A O no hydrogen 2.942 N/A PHE 77.A N ASN 194.A OD1 no hydrogen 2.927 N/A TYR 81.A N PRO 78.A O no hydrogen 2.946 N/A TYR 83.A OH PRO 68.A O no hydrogen 2.655 N/A SER 85.A N GLN 88.A OE1 no hydrogen 2.962 N/A GLN 88.A N SER 85.A OG no hydrogen 2.974 N/A LEU 89.A N SER 85.A O no hydrogen 2.901 N/A ALA 90.A N LEU 86.A O no hydrogen 2.998 N/A ASP 91.A N ASP 87.A O no hydrogen 2.994 N/A MET 92.A N LEU 89.A O no hydrogen 3.231 N/A ILE 93.A N ALA 90.A O no hydrogen 3.200 N/A ILE 96.A N MET 92.A O no hydrogen 3.282 N/A LEU 97.A N ILE 93.A O no hydrogen 2.982 N/A GLN 98.A N PRO 94.A O no hydrogen 2.845 N/A TYR 99.A N CYS 95.A O no hydrogen 2.985 N/A TYR 99.A OH HIS 6.A ND1 no hydrogen 2.592 N/A LEU 100.A N ILE 96.A O no hydrogen 3.095 N/A ASN 101.A N GLN 98.A O no hydrogen 3.258 N/A PHE 102.A N LEU 97.A O no hydrogen 3.006 N/A ILE 105.A N THR 127.A O no hydrogen 2.809 N/A ILE 106.A N ALA 29.A O no hydrogen 2.795 N/A GLY 107.A N GLY 130.A O no hydrogen 2.925 N/A VAL 108.A N PHE 31.A O no hydrogen 2.926 N/A GLY 109.A N VAL 132.A O no hydrogen 3.010 N/A VAL 110.A N TYR 33.A O no hydrogen 3.256 N/A GLY 111.A N ILE 134.A O no hydrogen 2.755 N/A ALA 112.A N ASP 35.A OD1 no hydrogen 2.964 N/A GLY 113.A N VAL 110.A O no hydrogen 2.951 N/A TYR 115.A N GLY 111.A O no hydrogen 3.107 N/A TYR 115.A OH ARG 206.A O no hydrogen 2.529 N/A ILE 116.A N ALA 112.A O no hydrogen 2.965 N/A LEU 117.A N GLY 113.A O no hydrogen 3.001 N/A SER 118.A N ALA 114.A O no hydrogen 3.023 N/A SER 118.A OG ALA 114.A O no hydrogen 2.821 N/A ARG 119.A N TYR 115.A O no hydrogen 2.876 N/A ARG 119.A NE ASP 87.A OD1 no hydrogen 2.860 N/A ARG 119.A NH2 TYR 115.A OH no hydrogen 3.064 N/A ARG 119.A NH2 ASP 207.A O no hydrogen 3.137 N/A TYR 120.A N ILE 116.A O no hydrogen 2.964 N/A TYR 120.A OH THR 127.A OG1 no hydrogen 2.701 N/A ALA 121.A N LEU 117.A O no hydrogen 2.912 N/A LEU 122.A N SER 118.A O no hydrogen 2.990 N/A ASN 123.A N ARG 119.A O no hydrogen 2.999 N/A HIS 124.A N TYR 120.A O no hydrogen 2.810 N/A THR 127.A N HIS 124.A O no hydrogen 3.061 N/A THR 127.A OG1 TYR 120.A OH no hydrogen 2.701 N/A THR 127.A OG1 HIS 124.A O no hydrogen 2.737 N/A VAL 128.A N PRO 125.A O no hydrogen 3.314 N/A GLU 129.A N ILE 105.A O no hydrogen 2.895 N/A LEU 131.A N PRO 221.A O no hydrogen 2.968 N/A VAL 132.A N GLY 107.A O no hydrogen 2.758 N/A LEU 133.A N MET 223.A O no hydrogen 2.892 N/A ILE 134.A N GLY 109.A O no hydrogen 2.934 N/A ASN 135.A N VAL 225.A O no hydrogen 2.963 N/A ASN 135.A ND2 GLY 258.A O no hydrogen 2.756 N/A ASN 139.A N ASP 137.A OD1 no hydrogen 3.206 N/A ALA 140.A N ASP 207.A OD1 no hydrogen 2.845 N/A GLY 142.A N ASP 145.A OD2 no hydrogen 2.734 N/A TRP 146.A N GLY 142.A O no hydrogen 2.941 N/A ALA 147.A N TRP 143.A O no hydrogen 2.828 N/A ALA 148.A N MET 144.A O no hydrogen 2.989 N/A HIS 149.A N ASP 145.A O no hydrogen 2.979 N/A LYS 150.A N TRP 146.A O no hydrogen 2.866 N/A LEU 151.A N ALA 147.A O no hydrogen 2.952 N/A THR 152.A N ALA 148.A O no hydrogen 2.986 N/A THR 152.A OG1 ALA 148.A O no hydrogen 3.035 N/A GLY 153.A N HIS 149.A O no hydrogen 2.969 N/A LEU 154.A N LYS 150.A O no hydrogen 3.277 N/A LEU 154.A N LEU 151.A O no hydrogen 3.158 N/A THR 155.A N THR 152.A O no hydrogen 3.090 N/A THR 155.A OG1 THR 152.A O no hydrogen 3.517 N/A SER 157.A N ASP 160.A OD2 no hydrogen 3.002 N/A ASP 160.A N SER 157.A OG no hydrogen 3.081 N/A MET 161.A N SER 157.A O no hydrogen 2.924 N/A ILE 162.A N ILE 158.A O no hydrogen 2.945 N/A LEU 163.A N PRO 159.A O no hydrogen 2.887 N/A GLY 164.A N ASP 160.A O no hydrogen 2.988 N/A HIS 165.A N MET 161.A O no hydrogen 2.991 N/A HIS 165.A N ILE 162.A O no hydrogen 3.040 N/A HIS 165.A NE2 ASP 35.A OD1 no hydrogen 2.842 N/A LEU 166.A N ILE 162.A O no hydrogen 3.068 N/A PHE 167.A N LEU 163.A O no hydrogen 2.799 N/A SER 168.A N GLU 171.A OE1 no hydrogen 2.899 N/A SER 168.A OG GLU 171.A OE1 no hydrogen 3.535 N/A GLU 171.A N SER 168.A OG no hydrogen 3.051 N/A LEU 172.A N SER 168.A O no hydrogen 3.059 N/A SER 173.A N GLN 169.A O no hydrogen 3.012 N/A SER 173.A OG GLN 169.A O no hydrogen 2.768 N/A GLY 174.A N GLU 171.A O no hydrogen 3.038 N/A ILE 179.A N SER 176.A OG no hydrogen 3.290 N/A GLN 180.A N SER 176.A O no hydrogen 2.969 N/A GLN 180.A NE2 ASN 175.A O no hydrogen 2.844 N/A LYS 181.A N GLU 177.A O no hydrogen 2.917 N/A TYR 182.A N LEU 178.A O no hydrogen 2.883 N/A TYR 182.A OH SER 42.A O no hydrogen 2.604 N/A ARG 183.A N ILE 179.A O no hydrogen 2.739 N/A ARG 183.A NH1 ASN 175.A OD1 no hydrogen 3.120 N/A ARG 183.A NH2 LEU 172.A O no hydrogen 2.888 N/A ARG 183.A NH2 ASN 175.A OD1 no hydrogen 3.559 N/A GLY 184.A N GLN 180.A O no hydrogen 3.226 N/A ILE 185.A N LYS 181.A O no hydrogen 3.057 N/A ILE 186.A N TYR 182.A O no hydrogen 3.089 N/A GLN 187.A N ARG 183.A O no hydrogen 2.830 N/A GLN 187.A NE2 ASP 160.A OD1 no hydrogen 2.911 N/A HIS 188.A N GLY 184.A O no hydrogen 3.051 N/A ALA 189.A N ILE 186.A O no hydrogen 3.321 N/A ASN 191.A ND2 GLY 69.A O no hydrogen 2.941 N/A LEU 192.A N ALA 189.A O no hydrogen 3.132 N/A ASN 194.A ND2 GLY 69.A O no hydrogen 2.969 N/A ASN 194.A ND2 PRO 75.A O no hydrogen 2.886 N/A ILE 195.A N ASN 191.A O no hydrogen 2.965 N/A GLU 196.A N LEU 192.A O no hydrogen 2.865 N/A TYR 198.A N ASN 194.A O no hydrogen 3.205 N/A TYR 198.A OH HIS 34.A O no hydrogen 2.837 N/A TRP 199.A N ILE 195.A O no hydrogen 2.862 N/A ASN 200.A N GLU 196.A O no hydrogen 2.902 N/A SER 201.A N LEU 197.A O no hydrogen 3.024 N/A SER 201.A OG.A PRO 84.A O no hydrogen 2.726 N/A SER 201.A OG.A LEU 197.A O no hydrogen 3.514 N/A SER 201.A OG.B PRO 84.A O no hydrogen 2.895 N/A TYR 202.A N TYR 198.A O no hydrogen 2.894 N/A ASN 203.A N TRP 199.A O no hydrogen 2.814 N/A ASN 204.A N ASN 200.A O no hydrogen 2.938 N/A ASN 204.A N SER 201.A O no hydrogen 3.246 N/A ASN 204.A ND2.A ASN 200.A O no hydrogen 2.963 N/A ARG 205.A N TYR 202.A O no hydrogen 3.184 N/A ARG 205.A NE ASP 137.A O no hydrogen 2.956 N/A ARG 205.A NH1 TYR 202.A O no hydrogen 2.977 N/A ARG 205.A NH2 ASP 137.A O no hydrogen 3.137 N/A ARG 206.A NE ASP 87.A OD2 no hydrogen 2.501 N/A ARG 206.A NH2 ASP 87.A OD2 no hydrogen 3.288 N/A LEU 208.A N PRO 138.A O no hydrogen 2.762 N/A ARG 212.A N GLU 215.A O no hydrogen 2.857 N/A GLU 215.A N ARG 212.A O no hydrogen 2.965 N/A THR 216.A OG1.B PHE 210.A O no hydrogen 3.294 N/A THR 216.A OG1.B LEU 218.A O no hydrogen 3.553 N/A THR 217.A N PHE 210.A O no hydrogen 2.990 N/A THR 217.A OG1 ASN 209.A O no hydrogen 2.687 N/A CYS 220.A SG PRO 221.A O no hydrogen 3.695 N/A VAL 222.A N GLN 247.A O no hydrogen 3.032 N/A MET 223.A N LEU 131.A O no hydrogen 2.880 N/A LEU 224.A N SER 249.A O no hydrogen 2.803 N/A VAL 225.A N LEU 133.A O no hydrogen 2.971 N/A VAL 226.A N LEU 251.A O no hydrogen 3.059 N/A ASP 228.A N MET 253.A O no hydrogen 2.759 N/A GLN 229.A N GLU 233.A OE1 no hydrogen 2.744 N/A GLN 229.A NE2 ASP 228.A OD1 no hydrogen 3.060 N/A ALA 230.A N GLY 227.A O no hydrogen 3.195 N/A HIS 232.A NE2 HIS 165.A O no hydrogen 3.027 N/A GLU 233.A N ALA 230.A O no hydrogen 3.145 N/A VAL 236.A N HIS 232.A O no hydrogen 3.097 N/A VAL 237.A N GLU 233.A O no hydrogen 2.939 N/A GLU 238.A N ASP 234.A O no hydrogen 2.890 N/A CYS 239.A N ALA 235.A O no hydrogen 2.934 N/A CYS 239.A SG ALA 235.A O no hydrogen 3.364 N/A ASN 240.A N VAL 236.A O no hydrogen 2.960 N/A SER 241.A N VAL 237.A O no hydrogen 3.259 N/A SER 241.A OG GLU 238.A O no hydrogen 2.536 N/A LYS 242.A N CYS 239.A O no hydrogen 3.030 N/A LYS 242.A NZ GLU 238.A OE2 no hydrogen 3.123 N/A LEU 243.A N CYS 239.A O no hydrogen 3.172 N/A THR 246.A N ASP 244.A OD1 no hydrogen 2.866 N/A THR 246.A OG1 ASP 244.A OD1 no hydrogen 2.957 N/A THR 246.A OG1 ASP 244.A OD2 no hydrogen 3.134 N/A GLN 247.A N ASP 244.A O no hydrogen 2.945 N/A GLN 247.A NE2 LYS 219.A O no hydrogen 3.444 N/A THR 248.A OG1 ASP 244.A O no hydrogen 2.782 N/A SER 249.A N VAL 222.A O no hydrogen 2.931 N/A LEU 251.A N LEU 224.A O no hydrogen 2.879 N/A LYS 252.A NZ GLU 233.A OE2 no hydrogen 2.874 N/A MET 253.A N VAL 226.A O no hydrogen 2.808 N/A SER 256.A OG GLY 257.A O no hydrogen 3.170 N/A GLY 258.A N GLU 171.A OE1 no hydrogen 2.830 N/A GLN 259.A NE2 LEU 166.A O no hydrogen 3.045 N/A GLN 261.A N GLN 261.A OE1 no hydrogen 2.759 N/A GLN 261.A NE2 CYS 43.A O no hydrogen 3.247 N/A GLN 261.A NE2 GLN 259.A OE1 no hydrogen 2.890 N/A LEU 262.A N GLN 259.A O no hydrogen 2.789 N/A THR 263.A N GLN 259.A O no hydrogen 3.234 N/A THR 263.A OG1 SER 256.A O no hydrogen 2.612 N/A GLN 264.A N PRO 260.A O no hydrogen 2.863 N/A GLN 264.A NE2 ASP 255.A O no hydrogen 3.112 N/A LEU 268.A N GLN 264.A O no hydrogen 3.043 N/A THR 269.A N PRO 265.A O no hydrogen 2.817 N/A THR 269.A OG1 PRO 265.A O no hydrogen 2.690 N/A GLU 270.A N GLY 266.A O no hydrogen 3.288 N/A ALA 271.A N LYS 267.A O no hydrogen 3.277 N/A PHE 272.A N LEU 268.A O no hydrogen 2.814 N/A LYS 273.A N THR 269.A O no hydrogen 2.761 N/A LYS 273.A NZ TYR 274.A OH no hydrogen 3.440 N/A TYR 274.A N GLU 270.A O no hydrogen 3.180 N/A PHE 275.A N ALA 271.A O no hydrogen 2.940 N/A LEU 276.A N PHE 272.A O no hydrogen 2.997 N/A LEU 276.A N LYS 273.A O no hydrogen 3.184 N/A GLN 277.A N LYS 273.A O no hydrogen 2.841 N/A