Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qpn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N TYR 150.A OH no hydrogen 3.533 N/A SER 3.A N GLU 6.A OE1 no hydrogen 2.718 N/A GLU 6.A N SER 3.A OG no hydrogen 3.093 N/A LEU 7.A N SER 3.A O no hydrogen 2.650 N/A ALA 8.A N ASP 4.A O no hydrogen 3.199 N/A ALA 9.A N TRP 5.A O no hydrogen 3.242 N/A ALA 10.A N GLU 6.A O no hydrogen 2.746 N/A ARG 11.A N LEU 7.A O no hydrogen 3.028 N/A ALA 12.A N ALA 8.A O no hydrogen 2.796 N/A ALA 13.A N ALA 9.A O no hydrogen 2.808 N/A ILE 14.A N ALA 10.A O no hydrogen 2.699 N/A ALA 15.A N ARG 11.A O no hydrogen 2.808 N/A ARG 16.A N ALA 12.A O no hydrogen 2.934 N/A GLY 17.A N ALA 13.A O no hydrogen 2.895 N/A LEU 18.A N ILE 14.A O no hydrogen 2.939 N/A ASP 19.A N ALA 15.A O no hydrogen 2.988 N/A GLU 20.A N ARG 16.A O no hydrogen 3.077 N/A ASP 21.A N GLY 17.A O no hydrogen 3.242 N/A LEU 22.A N LEU 18.A O no hydrogen 2.886 N/A ARG 23.A NH1 ASP 19.A OD2 no hydrogen 3.269 N/A ARG 23.A NH2 ASP 19.A OD2 no hydrogen 2.961 N/A GLY 25.A N LEU 22.A O no hydrogen 3.139 N/A THR 30.A N ASP 27.A O no hydrogen 3.154 N/A THR 30.A OG1 ASP 27.A O no hydrogen 2.942 N/A THR 30.A OG1 ASP 27.A OD2 no hydrogen 2.896 N/A LEU 31.A N ASP 27.A O no hydrogen 3.159 N/A ALA 32.A N VAL 28.A O no hydrogen 2.946 N/A THR 33.A N THR 29.A O no hydrogen 3.095 N/A THR 33.A OG1 THR 29.A O no hydrogen 2.986 N/A VAL 34.A N THR 30.A O no hydrogen 2.631 N/A ALA 38.A N PRO 35.A O no hydrogen 3.029 N/A THR 40.A N ALA 94.A O no hydrogen 2.806 N/A THR 40.A OG1 THR 96.A OG1 no hydrogen 2.890 N/A ALA 42.A N LEU 92.A O no hydrogen 2.757 N/A SER 43.A N ASP 283.A O no hydrogen 2.756 N/A SER 43.A OG THR 91.A OG1 no hydrogen 2.955 N/A LEU 44.A N MET 90.A O no hydrogen 2.894 N/A VAL 45.A N GLY 281.A O no hydrogen 2.843 N/A THR 46.A N GLU 87.A O no hydrogen 3.095 N/A THR 46.A OG1 PRO 84.A O no hydrogen 3.358 N/A THR 46.A OG1 PRO 85.A O no hydrogen 2.975 N/A THR 46.A OG1 GLU 87.A O no hydrogen 3.396 N/A ARG 47.A N ASP 279.A O no hydrogen 2.720 N/A ARG 47.A NH2 ASP 283.A OD1 no hydrogen 2.660 N/A GLY 50.A N VAL 83.A O no hydrogen 3.028 N/A VAL 51.A N THR 118.A OG1 no hydrogen 2.845 N/A VAL 52.A N ALA 81.A O no hydrogen 3.005 N/A ALA 53.A N SER 114.A OG no hydrogen 2.975 N/A GLY 54.A N ASP 79.A OD2 no hydrogen 3.022 N/A LEU 55.A N ASP 79.A OD1 no hydrogen 3.195 N/A ALA 58.A N GLY 54.A O no hydrogen 3.319 N/A ALA 58.A N LEU 55.A O no hydrogen 2.812 N/A LEU 59.A N LEU 55.A O no hydrogen 3.127 N/A LEU 60.A N ASP 56.A O no hydrogen 2.826 N/A THR 61.A N VAL 57.A O no hydrogen 3.026 N/A THR 61.A N ALA 58.A O no hydrogen 3.018 N/A THR 61.A OG1 VAL 57.A O no hydrogen 2.827 N/A LEU 62.A N ALA 58.A O no hydrogen 3.201 N/A ASN 63.A N LEU 59.A O no hydrogen 2.936 N/A GLU 64.A N LEU 60.A O no hydrogen 3.192 N/A VAL 65.A N THR 61.A O no hydrogen 3.092 N/A VAL 65.A N LEU 62.A O no hydrogen 2.924 N/A LEU 66.A N LEU 62.A O no hydrogen 2.595 N/A GLY 67.A N ASN 63.A O no hydrogen 2.824 N/A GLY 70.A N GLY 67.A O no hydrogen 2.647 N/A TYR 71.A OH ASN 63.A OD1 no hydrogen 2.461 N/A ARG 72.A N GLU 93.A O no hydrogen 2.708 N/A ARG 72.A NE GLU 93.A OE1 no hydrogen 2.886 N/A ARG 72.A NH2 GLU 93.A OE1 no hydrogen 3.014 N/A ARG 72.A NH2 GLU 93.A OE2 no hydrogen 2.998 N/A LEU 74.A N THR 91.A O no hydrogen 2.819 N/A ASP 75.A N THR 91.A O no hydrogen 3.026 N/A ARG 76.A NE VAL 77.A O no hydrogen 2.935 N/A ARG 76.A NH1 ASP 56.A OD1 no hydrogen 2.933 N/A ARG 76.A NH2 VAL 77.A O no hydrogen 3.270 N/A VAL 77.A N LEU 89.A O no hydrogen 2.676 N/A GLY 80.A N VAL 52.A O no hydrogen 2.741 N/A ALA 81.A N GLU 78.A O no hydrogen 3.267 N/A ARG 82.A NH2 ASP 125.A OD2 no hydrogen 3.348 N/A VAL 83.A N GLY 50.A O no hydrogen 2.738 N/A GLU 87.A N PRO 84.A O no hydrogen 3.278 N/A LEU 89.A N LEU 44.A O no hydrogen 2.773 N/A THR 91.A N ASP 75.A O no hydrogen 2.545 N/A THR 91.A OG1 SER 43.A OG no hydrogen 2.955 N/A LEU 92.A N ALA 42.A O no hydrogen 2.857 N/A GLU 93.A N ARG 72.A O no hydrogen 2.669 N/A ALA 94.A N THR 40.A O no hydrogen 2.820 N/A GLN 95.A NE2 ALA 36.A O no hydrogen 3.022 N/A THR 96.A N ALA 38.A O no hydrogen 3.048 N/A THR 96.A OG1 THR 40.A OG1 no hydrogen 2.890 N/A ARG 97.A NE VAL 34.A O no hydrogen 2.534 N/A ARG 97.A NH2 VAL 34.A O no hydrogen 2.907 N/A LEU 99.A N GLN 95.A O no hydrogen 3.157 N/A LEU 100.A N THR 96.A O no hydrogen 3.055 N/A THR 101.A N ARG 97.A O no hydrogen 3.221 N/A THR 101.A N GLY 98.A O no hydrogen 3.165 N/A THR 101.A OG1 ARG 97.A O no hydrogen 3.380 N/A ALA 102.A N GLY 98.A O no hydrogen 3.031 N/A GLU 103.A N LEU 99.A O no hydrogen 2.851 N/A ARG 104.A NH1 ASN 108.A OD1 no hydrogen 2.655 N/A MET 106.A N ALA 102.A O no hydrogen 2.947 N/A LEU 107.A N GLU 103.A O no hydrogen 2.903 N/A ASN 108.A N ARG 104.A O no hydrogen 2.892 N/A LEU 109.A N THR 105.A O no hydrogen 3.177 N/A VAL 110.A N MET 106.A O no hydrogen 3.009 N/A GLY 111.A N LEU 107.A O no hydrogen 2.811 N/A HIS 112.A N ASN 108.A O no hydrogen 3.247 N/A HIS 112.A NE2 GLN 148.A OE1 no hydrogen 2.994 N/A LEU 113.A N LEU 109.A O no hydrogen 2.901 N/A SER 114.A N VAL 110.A O no hydrogen 2.872 N/A SER 114.A OG ALA 53.A O no hydrogen 2.966 N/A SER 114.A OG VAL 110.A O no hydrogen 2.835 N/A GLY 115.A N GLY 111.A O no hydrogen 2.978 N/A ILE 116.A N HIS 112.A O no hydrogen 3.120 N/A ALA 117.A N LEU 113.A O no hydrogen 3.149 N/A THR 118.A N SER 114.A O no hydrogen 2.873 N/A THR 118.A OG1 VAL 51.A O no hydrogen 3.268 N/A THR 118.A OG1 SER 114.A O no hydrogen 2.902 N/A ALA 119.A N GLY 115.A O no hydrogen 3.082 N/A THR 120.A N ILE 116.A O no hydrogen 2.856 N/A THR 120.A OG1 VAL 152.A O no hydrogen 3.213 N/A ALA 121.A N ALA 117.A O no hydrogen 3.048 N/A ALA 122.A N THR 118.A O no hydrogen 3.192 N/A ALA 122.A N ALA 119.A O no hydrogen 3.029 N/A TRP 123.A N ALA 119.A O no hydrogen 3.165 N/A VAL 124.A N THR 120.A O no hydrogen 2.982 N/A ASP 125.A N ALA 121.A O no hydrogen 2.945 N/A ALA 126.A N ALA 122.A O no hydrogen 2.934 N/A VAL 127.A N TRP 123.A O no hydrogen 3.179 N/A ARG 128.A N ASP 125.A O no hydrogen 3.033 N/A THR 130.A N VAL 127.A O no hydrogen 3.130 N/A LYS 133.A N ASP 264.A O no hydrogen 3.128 N/A LYS 133.A NZ ASP 264.A O no hydrogen 2.893 N/A ARG 135.A N LEU 266.A O no hydrogen 2.750 N/A ARG 135.A NE GLU 245.A OE2 no hydrogen 3.166 N/A ARG 135.A NH2 GLU 245.A OE1 no hydrogen 2.877 N/A LYS 139.A N THR 137.A OG1 no hydrogen 3.046 N/A THR 140.A OG1 ARG 138.A O no hydrogen 3.413 N/A LEU 144.A N LEU 141.A O no hydrogen 3.010 N/A ARG 145.A NE THR 140.A OG1 no hydrogen 2.842 N/A ARG 145.A NH1 LEU 162.A O no hydrogen 2.544 N/A ARG 145.A NH2 THR 140.A OG1 no hydrogen 3.051 N/A GLN 148.A N LEU 144.A O no hydrogen 2.821 N/A LYS 149.A N ARG 145.A O no hydrogen 2.780 N/A LYS 149.A NZ ASP 136.A OD1 no hydrogen 2.474 N/A LYS 149.A NZ THR 137.A O no hydrogen 2.918 N/A LYS 149.A NZ ARG 161.A O no hydrogen 3.057 N/A TYR 150.A N ALA 146.A O no hydrogen 2.997 N/A TYR 150.A OH ASP 79.A OD2 no hydrogen 2.607 N/A ALA 151.A N LEU 147.A O no hydrogen 2.903 N/A VAL 152.A N GLN 148.A O no hydrogen 3.191 N/A ARG 153.A N LYS 149.A O no hydrogen 3.285 N/A ARG 153.A NH1 GLU 6.A OE2 no hydrogen 3.198 N/A ARG 153.A NH2 GLU 6.A OE2 no hydrogen 2.603 N/A THR 154.A N TYR 150.A O no hydrogen 3.037 N/A THR 154.A OG1 TYR 150.A O no hydrogen 2.882 N/A GLY 155.A N ALA 151.A O no hydrogen 2.984 N/A GLY 156.A N ARG 153.A O no hydrogen 3.100 N/A GLY 157.A N VAL 152.A O no hydrogen 2.743 N/A VAL 158.A N ILE 134.A O no hydrogen 2.827 N/A HIS 160.A N ASP 136.A OD1 no hydrogen 2.762 N/A HIS 160.A NE2 GLU 198.A OE2 no hydrogen 3.146 N/A ARG 161.A NH1 LEU 164.A O no hydrogen 3.179 N/A LEU 162.A N ASP 166.A OD2 no hydrogen 3.121 N/A ASP 166.A N GLY 163.A O no hydrogen 3.294 N/A ALA 168.A N PRO 196.A O no hydrogen 2.642 N/A ILE 170.A N GLU 198.A O no hydrogen 2.769 N/A VAL 175.A N LYS 171.A O no hydrogen 2.992 N/A ALA 176.A N ASP 172.A O no hydrogen 2.855 N/A ALA 177.A N ASN 173.A O no hydrogen 3.191 N/A ALA 178.A N HIS 174.A O no hydrogen 2.893 N/A GLY 179.A N VAL 175.A O no hydrogen 2.661 N/A ASP 183.A N SER 180.A OG no hydrogen 3.196 N/A ALA 184.A N SER 180.A O no hydrogen 3.080 N/A LEU 185.A N VAL 181.A O no hydrogen 3.085 N/A ARG 186.A N VAL 182.A O no hydrogen 2.962 N/A ALA 187.A N ASP 183.A O no hydrogen 2.911 N/A VAL 188.A N ALA 184.A O no hydrogen 2.965 N/A ARG 189.A N LEU 185.A O no hydrogen 2.987 N/A ARG 189.A NH1 GLU 216.A OE1 no hydrogen 3.487 N/A ARG 189.A NH2 GLU 213.A O no hydrogen 2.909 N/A ARG 189.A NH2 LYS 214.A O no hydrogen 3.037 N/A ASN 190.A N ARG 186.A O no hydrogen 3.059 N/A ASN 190.A N ALA 187.A O no hydrogen 3.083 N/A ASN 190.A ND2 ARG 186.A O no hydrogen 2.866 N/A ALA 191.A N ALA 187.A O no hydrogen 2.925 N/A ALA 192.A N VAL 188.A O no hydrogen 2.851 N/A LEU 195.A N ALA 192.A O no hydrogen 3.132 N/A CYS 197.A N GLU 216.A OE1 no hydrogen 2.955 N/A GLU 198.A N ALA 168.A O no hydrogen 2.730 N/A VAL 199.A N LEU 217.A O no hydrogen 2.882 N/A GLU 200.A N ILE 170.A O no hydrogen 2.989 N/A VAL 201.A N LEU 219.A O no hydrogen 2.879 N/A ASP 202.A N GLN 206.A OE1 no hydrogen 3.178 N/A GLN 206.A N SER 203.A OG no hydrogen 2.831 N/A LEU 207.A N SER 203.A O no hydrogen 3.059 N/A ASP 208.A N LEU 204.A O no hydrogen 2.952 N/A ALA 209.A N GLU 205.A O no hydrogen 3.049 N/A VAL 210.A N GLN 206.A O no hydrogen 2.957 N/A VAL 210.A N LEU 207.A O no hydrogen 3.096 N/A LEU 211.A N LEU 207.A O no hydrogen 2.851 N/A GLU 213.A N VAL 210.A O no hydrogen 2.786 N/A LYS 214.A N LEU 211.A O no hydrogen 2.897 N/A ILE 218.A N MET 243.A O no hydrogen 2.963 N/A LEU 219.A N VAL 199.A O no hydrogen 2.760 N/A LEU 220.A N GLU 245.A O no hydrogen 2.905 N/A ASP 221.A N VAL 201.A O no hydrogen 2.924 N/A ASN 222.A N SER 247.A O no hydrogen 2.774 N/A ASN 222.A ND2 ASP 221.A OD2 no hydrogen 3.429 N/A THR 228.A N ALA 224.A O no hydrogen 3.012 N/A THR 228.A N VAL 225.A O no hydrogen 3.060 N/A THR 228.A OG1 ALA 224.A O no hydrogen 2.915 N/A GLN 229.A N VAL 225.A O no hydrogen 2.976 N/A THR 230.A N TRP 226.A O no hydrogen 3.167 N/A THR 230.A OG1 TRP 226.A O no hydrogen 2.969 N/A ALA 231.A N GLN 227.A O no hydrogen 2.958 N/A VAL 232.A N THR 228.A O no hydrogen 2.949 N/A GLN 233.A N GLN 229.A O no hydrogen 2.863 N/A ARG 234.A N THR 230.A O no hydrogen 2.892 N/A ARG 234.A NH1 ASP 208.A OD1 no hydrogen 2.810 N/A ARG 235.A N ALA 231.A O no hydrogen 2.993 N/A ARG 235.A NE ASP 236.A OD1 no hydrogen 2.843 N/A ARG 235.A NH1 VAL 242.A O no hydrogen 2.686 N/A ARG 235.A NH1 ASP 264.A OD2 no hydrogen 2.790 N/A ASP 236.A N VAL 232.A O no hydrogen 2.896 N/A SER 237.A N GLN 233.A O no hydrogen 3.180 N/A SER 237.A N ARG 234.A O no hydrogen 3.144 N/A SER 237.A OG GLN 233.A O no hydrogen 2.926 N/A SER 237.A OG ARG 234.A O no hydrogen 3.087 N/A ARG 238.A N ARG 234.A O no hydrogen 2.754 N/A ARG 238.A NH1 ASP 208.A OD1 no hydrogen 2.748 N/A ARG 238.A NH2 ASP 208.A OD1 no hydrogen 3.240 N/A ALA 239.A N ARG 235.A O no hydrogen 2.834 N/A VAL 242.A N ALA 239.A O no hydrogen 2.946 N/A MET 243.A N GLU 216.A O no hydrogen 3.185 N/A LEU 244.A N ASP 264.A OD2 no hydrogen 2.981 N/A GLU 245.A N ILE 218.A O no hydrogen 2.971 N/A SER 246.A N TYR 265.A O no hydrogen 3.089 N/A SER 247.A N LEU 220.A O no hydrogen 2.955 N/A SER 251.A N THR 254.A OG1 no hydrogen 3.031 N/A SER 251.A OG THR 254.A OG1 no hydrogen 3.088 N/A GLN 253.A N SER 251.A OG no hydrogen 3.164 N/A THR 254.A N SER 251.A O no hydrogen 3.062 N/A THR 254.A N SER 251.A OG no hydrogen 3.135 N/A THR 254.A OG1 SER 251.A O no hydrogen 2.922 N/A THR 254.A OG1 SER 251.A OG no hydrogen 3.088 N/A TYR 258.A N THR 254.A O no hydrogen 2.990 N/A TYR 258.A OH PHE 223.A O no hydrogen 2.962 N/A ALA 259.A N ALA 255.A O no hydrogen 2.872 N/A GLU 260.A N ALA 256.A O no hydrogen 2.806 N/A THR 261.A N TYR 258.A O no hydrogen 3.020 N/A THR 261.A OG1 TYR 258.A O no hydrogen 2.758 N/A GLY 262.A N ALA 259.A O no hydrogen 3.061 N/A VAL 263.A N THR 261.A OG1 no hydrogen 3.404 N/A ASP 264.A N LEU 244.A O no hydrogen 3.164 N/A TYR 265.A N LEU 244.A O no hydrogen 3.241 N/A LEU 266.A N LYS 133.A O no hydrogen 2.977 N/A ALA 267.A N SER 246.A O no hydrogen 2.994 N/A VAL 268.A N ARG 135.A O no hydrogen 2.894 N/A THR 272.A N GLY 269.A O no hydrogen 3.208 N/A THR 272.A OG1 LYS 139.A O no hydrogen 2.662 N/A THR 272.A OG1 GLY 269.A O no hydrogen 3.478 N/A HIS 273.A N GLY 269.A O no hydrogen 3.172 N/A HIS 273.A ND1 SER 274.A OG no hydrogen 2.947 N/A SER 274.A OG HIS 273.A ND1 no hydrogen 2.947 N/A LEU 278.A N GLY 111.A O no hydrogen 2.965 N/A ASP 279.A N GLU 48.A OE2 no hydrogen 3.058 N/A GLY 281.A N VAL 45.A O no hydrogen 2.847 N/A ASP 283.A N SER 43.A O no hydrogen 2.681 N/A