Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pmj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A ND1 ASP 247.A OD2 no hydrogen 2.507 N/A ASP 2.A N ASP 247.A OD1 no hydrogen 2.706 N/A ILE 7.A N VAL 15.A O no hydrogen 2.845 N/A PHE 9.A N ARG 13.A O no hydrogen 2.684 N/A GLY 12.A N PHE 9.A O no hydrogen 2.823 N/A ARG 13.A N ASP 11.A OD1 no hydrogen 3.364 N/A ARG 13.A NE.B ASP 11.A OD1 no hydrogen 2.803 N/A ARG 13.A NH1.A ASP 106.A OD1 no hydrogen 3.218 N/A ARG 13.A NH1.B ASP 11.A OD2 no hydrogen 3.095 N/A ARG 13.A NH2.A ASP 106.A OD1 no hydrogen 2.708 N/A ARG 13.A NH2.B ASP 106.A O no hydrogen 3.097 N/A LYS 14.A NZ GLY 12.A O no hydrogen 3.014 N/A VAL 15.A N ILE 7.A O no hydrogen 2.952 N/A ALA 17.A N PRO 5.A O no hydrogen 2.733 N/A GLY 19.A N SER 230.A O no hydrogen 2.778 N/A GLN 20.A N LEU 47.A O no hydrogen 2.733 N/A GLN 20.A NE2 LEU 38.A O no hydrogen 3.321 N/A GLY 21.A N PRO 232.A O no hydrogen 2.917 N/A THR 22.A OG1 ASP 49.A O no hydrogen 2.805 N/A THR 22.A OG1 THR 50.A OG1 no hydrogen 3.003 N/A ARG 24.A NH1 GLU 194.A OE2 no hydrogen 3.343 N/A GLY 25.A N GLU 34.A OE1 no hydrogen 2.858 N/A ALA 29.A N ASN 27.A OD1 no hydrogen 3.056 N/A LYS 30.A N ASN 27.A O no hydrogen 2.702 N/A THR 31.A OG1 ASN 27.A O no hydrogen 3.478 N/A THR 31.A OG1 ARG 28.A O no hydrogen 3.494 N/A GLU 34.A N LYS 30.A O no hydrogen 2.848 N/A VAL 35.A N THR 31.A O no hydrogen 2.821 N/A ARG 36.A N ALA 32.A O no hydrogen 2.962 N/A SER 37.A N ASP 33.A O no hydrogen 2.730 N/A SER 37.A OG THR 234.A O no hydrogen 2.685 N/A LEU 38.A N GLU 34.A O no hydrogen 3.122 N/A GLN 39.A N VAL 35.A O no hydrogen 2.958 N/A THR 40.A N ARG 36.A O no hydrogen 2.909 N/A THR 40.A OG1 ARG 36.A O no hydrogen 2.661 N/A GLY 41.A N SER 37.A O no hydrogen 3.012 N/A LEU 42.A N LEU 38.A O no hydrogen 2.992 N/A ASP 43.A N GLN 39.A O no hydrogen 2.964 N/A LEU 44.A N THR 40.A O no hydrogen 3.071 N/A GLY 45.A N LEU 42.A O no hydrogen 3.027 N/A ILE 48.A N PHE 74.A O no hydrogen 3.005 N/A ASP 49.A N GLN 20.A O no hydrogen 2.925 N/A THR 50.A N VAL 76.A O no hydrogen 2.874 N/A THR 50.A OG1 THR 22.A OG1 no hydrogen 3.003 N/A GLU 52.A N LYS 78.A O no hydrogen 3.466 N/A ALA 57.A N GLY 54.A O no hydrogen 3.149 N/A ALA 58.A N TYR 53.A O no hydrogen 3.080 N/A ARG 60.A N GLY 56.A O no hydrogen 2.987 N/A ARG 60.A NH1 ASN 99.A OD1 no hydrogen 3.154 N/A ILE 61.A N ALA 57.A O no hydrogen 2.983 N/A VAL 62.A N ALA 58.A O no hydrogen 2.938 N/A GLY 63.A N GLU 59.A O no hydrogen 2.869 N/A GLU 64.A N ARG 60.A O no hydrogen 2.996 N/A ALA 65.A N ILE 61.A O no hydrogen 2.979 N/A ILE 66.A N VAL 62.A O no hydrogen 2.932 N/A LYS 67.A N GLU 64.A O no hydrogen 3.002 N/A ARG 69.A N ILE 66.A O no hydrogen 3.024 N/A ARG 69.A NE GLU 72.A OE1 no hydrogen 3.255 N/A ARG 69.A NH1 GLN 39.A O no hydrogen 3.394 N/A ARG 69.A NH1 ASP 43.A OD1 no hydrogen 3.057 N/A ARG 69.A NH2 ASP 43.A OD1 no hydrogen 2.626 N/A ARG 69.A NH2 GLU 72.A OE1 no hydrogen 2.764 N/A ARG 70.A NH1 ARG 70.A O no hydrogen 2.872 N/A ARG 70.A NH1 ALA 73.A O no hydrogen 2.901 N/A ARG 70.A NH1 ASP 106.A OD2 no hydrogen 3.244 N/A ARG 70.A NH2 CYS 104.A O no hydrogen 2.772 N/A ARG 70.A NH2 ASP 106.A OD2 no hydrogen 2.866 N/A GLU 72.A N ARG 69.A O no hydrogen 2.951 N/A ALA 73.A N ARG 70.A O no hydrogen 3.051 N/A PHE 74.A N THR 46.A O no hydrogen 2.972 N/A VAL 75.A N ASP 106.A OD2 no hydrogen 2.766 N/A VAL 76.A N ILE 48.A O no hydrogen 2.881 N/A SER 77.A N LEU 107.A O no hydrogen 3.100 N/A SER 77.A OG GLU 59.A OE2 no hydrogen 2.831 N/A LYS 78.A NZ ASP 49.A OD1 no hydrogen 3.323 N/A LYS 78.A NZ ASP 49.A OD2 no hydrogen 2.883 N/A LYS 78.A NZ THR 50.A O no hydrogen 2.973 N/A LYS 78.A NZ TYR 53.A OH no hydrogen 3.176 N/A VAL 79.A N LEU 109.A O no hydrogen 2.743 N/A LEU 80.A N GLU 52.A OE2 no hydrogen 2.751 N/A ASN 83.A N LEU 80.A O no hydrogen 2.882 N/A ASN 83.A ND2 GLU 52.A OE2 no hydrogen 2.977 N/A ALA 84.A N PRO 81.A O no hydrogen 3.125 N/A ARG 86.A N GLU 120.A OE2 no hydrogen 3.222 N/A ARG 86.A NH1 ARG 86.A O no hydrogen 3.438 N/A ARG 86.A NH1 GLU 127.A OE1 no hydrogen 2.588 N/A ARG 86.A NH2 GLU 127.A OE1 no hydrogen 2.742 N/A GLY 88.A N SER 85.A OG no hydrogen 3.050 N/A THR 89.A N SER 85.A O no hydrogen 2.920 N/A THR 89.A OG1 SER 85.A O no hydrogen 2.733 N/A ALA 91.A N ALA 87.A O no hydrogen 3.076 N/A ALA 92.A N GLY 88.A O no hydrogen 2.803 N/A CYS 93.A N THR 89.A O no hydrogen 2.851 N/A GLU 94.A N VAL 90.A O no hydrogen 3.095 N/A ARG 95.A N ALA 91.A O no hydrogen 3.204 N/A ARG 95.A NH1 GLU 52.A OE1 no hydrogen 2.790 N/A SER 96.A N ALA 92.A O no hydrogen 3.078 N/A SER 96.A OG GLU 59.A OE1 no hydrogen 3.511 N/A SER 96.A OG GLU 59.A OE2 no hydrogen 2.528 N/A SER 96.A OG ALA 92.A O no hydrogen 3.486 N/A LEU 97.A N CYS 93.A O no hydrogen 2.983 N/A ARG 98.A N GLU 94.A O no hydrogen 2.949 N/A ASN 99.A N ARG 95.A O no hydrogen 2.895 N/A ASN 99.A ND2 GLU 59.A OE1 no hydrogen 3.436 N/A LEU 100.A N SER 96.A O no hydrogen 2.821 N/A GLY 101.A N LEU 97.A O no hydrogen 2.861 N/A GLY 101.A N ARG 98.A O no hydrogen 3.258 N/A ILE 102.A N LEU 97.A O no hydrogen 3.133 N/A CYS 104.A SG VAL 105.A O no hydrogen 3.669 N/A CYS 104.A SG GLY 132.A O no hydrogen 3.242 N/A VAL 105.A N LYS 133.A O no hydrogen 3.013 N/A ASP 106.A N VAL 75.A O no hydrogen 2.949 N/A LEU 107.A N VAL 75.A O no hydrogen 3.244 N/A TYR 108.A N ALA 136.A O no hydrogen 2.962 N/A LEU 109.A N SER 77.A O no hydrogen 2.876 N/A LEU 110.A N GLY 138.A O no hydrogen 3.218 N/A HIS 111.A N VAL 79.A O no hydrogen 3.167 N/A ARG 113.A NH1 ASP 146.A OD1 no hydrogen 3.197 N/A ARG 113.A NH1 GLU 148.A OE1 no hydrogen 3.539 N/A ARG 113.A NH2 GLU 148.A OE2 no hydrogen 2.568 N/A GLU 120.A N PRO 117.A O no hydrogen 3.008 N/A THR 121.A OG1 ALA 84.A O no hydrogen 2.576 N/A VAL 122.A N LEU 118.A O no hydrogen 2.919 N/A ALA 123.A N ALA 119.A O no hydrogen 2.930 N/A ALA 124.A N GLU 120.A O no hydrogen 3.069 N/A PHE 125.A N THR 121.A O no hydrogen 2.958 N/A GLU 126.A N VAL 122.A O no hydrogen 2.850 N/A GLU 127.A N ALA 123.A O no hydrogen 3.078 N/A LEU 128.A N ALA 124.A O no hydrogen 2.967 N/A LYS 129.A N PHE 125.A O no hydrogen 3.031 N/A LYS 129.A NZ GLU 126.A OE2 no hydrogen 3.156 N/A LYS 130.A N GLU 126.A O no hydrogen 2.976 N/A ALA 131.A N GLU 127.A O no hydrogen 2.858 N/A GLY 132.A N LYS 129.A O no hydrogen 3.147 N/A LYS 133.A N LEU 128.A O no hydrogen 2.853 N/A LYS 133.A NZ GLU 94.A OE1 no hydrogen 3.066 N/A ILE 134.A N LEU 128.A O no hydrogen 3.303 N/A ARG 135.A N VAL 105.A O no hydrogen 2.953 N/A ARG 135.A NE ASP 106.A OD1 no hydrogen 3.334 N/A ARG 135.A NH2 ASP 106.A OD1 no hydrogen 2.815 N/A TRP 137.A NE1 GLU 126.A OE2 no hydrogen 2.811 N/A GLY 138.A N TYR 108.A O no hydrogen 3.062 N/A VAL 139.A N ALA 160.A O no hydrogen 2.992 N/A SER 140.A OG GLN 162.A O no hydrogen 2.698 N/A ASN 141.A N GLN 162.A O no hydrogen 2.788 N/A ASN 141.A ND2 HIS 111.A O no hydrogen 2.939 N/A ASP 143.A N ASP 146.A OD2 no hydrogen 2.678 N/A VAL 144.A N ASP 143.A OD1 no hydrogen 2.727 N/A GLU 148.A N ASP 145.A O no hydrogen 3.285 N/A SER 150.A N GLU 147.A O no hydrogen 3.084 N/A ALA 151.A N GLU 148.A O no hydrogen 2.944 N/A VAL 152.A N LEU 149.A O no hydrogen 3.099 N/A GLY 155.A N VAL 152.A O no hydrogen 2.900 N/A ASN 157.A N ASP 154.A O no hydrogen 2.910 N/A ASN 157.A ND2 GLU 126.A OE2 no hydrogen 2.717 N/A VAL 158.A N GLY 155.A O no hydrogen 3.198 N/A ALA 159.A N TRP 137.A O no hydrogen 2.751 N/A ASN 161.A N PRO 186.A O no hydrogen 3.186 N/A ASN 161.A ND2 PHE 142.A O no hydrogen 2.824 N/A GLN 162.A N VAL 139.A O no hydrogen 3.007 N/A GLN 162.A NE2 ASP 49.A OD1 no hydrogen 2.660 N/A TYR 165.A N TYR 189.A O no hydrogen 3.336 N/A TYR 165.A OH GLU 173.A OE2 no hydrogen 2.419 N/A ASN 166.A ND2 SER 190.A O no hydrogen 2.857 N/A ASN 166.A ND2 ASP 193.A OD1 no hydrogen 3.210 N/A ALA 168.A N ASN 166.A OD1 no hydrogen 2.760 N/A ARG 169.A N ASN 166.A O no hydrogen 2.994 N/A ARG 169.A NE ASP 193.A OD1 no hydrogen 3.150 N/A ARG 169.A NH1 GLU 272.A OE2 no hydrogen 2.752 N/A ARG 169.A NH2 ASP 193.A OD2 no hydrogen 3.180 N/A ARG 170.A NE GLU 173.A OE2 no hydrogen 2.842 N/A ARG 170.A NH1 ASP 259.A OD1 no hydrogen 2.940 N/A ARG 170.A NH1 PHE 262.A O no hydrogen 2.630 N/A ARG 170.A NH2 GLU 173.A OE1 no hydrogen 3.254 N/A ARG 170.A NH2 GLU 173.A OE2 no hydrogen 3.273 N/A ARG 170.A NH2 ASP 259.A OD1 no hydrogen 3.223 N/A GLU 173.A N ARG 170.A O no hydrogen 2.972 N/A PHE 174.A N GLY 171.A O no hydrogen 3.305 N/A LEU 176.A N ASP 175.A OD1 no hydrogen 2.794 N/A LEU 177.A N ILE 172.A O no hydrogen 2.855 N/A ARG 179.A N ASP 175.A O no hydrogen 3.035 N/A ARG 179.A NH1 GLU 147.A OE2 no hydrogen 3.133 N/A ARG 179.A NH2 GLU 147.A OE2 no hydrogen 2.790 N/A CYS 180.A N LEU 176.A O no hydrogen 2.968 N/A CYS 180.A SG LEU 176.A O no hydrogen 3.556 N/A ARG 181.A N LEU 177.A O no hydrogen 2.900 N/A ARG 181.A NE SER 226.A O no hydrogen 2.886 N/A ARG 181.A NH2 SER 226.A O no hydrogen 2.891 N/A ALA 182.A N PRO 178.A O no hydrogen 3.001 N/A GLN 183.A N ARG 179.A O no hydrogen 2.933 N/A GLN 183.A N CYS 180.A O no hydrogen 3.186 N/A GLY 184.A N ARG 181.A O no hydrogen 3.178 N/A VAL 185.A N CYS 180.A O no hydrogen 2.933 N/A VAL 187.A N GLY 227.A O no hydrogen 2.905 N/A TYR 189.A N VAL 163.A O no hydrogen 2.943 N/A TYR 189.A OH ASN 141.A OD1 no hydrogen 2.570 N/A ASP 193.A N SER 190.A O no hydrogen 2.965 N/A GLY 195.A N LEU 192.A O no hydrogen 2.757 N/A ARG 196.A N ASP 193.A O no hydrogen 3.045 N/A ARG 196.A NE ASP 193.A OD2 no hydrogen 2.745 N/A ARG 196.A NH1 ASP 193.A OD1 no hydrogen 2.740 N/A ARG 196.A NH1 GLU 194.A OE1 no hydrogen 2.920 N/A ARG 196.A NH2 GLU 194.A OE1 no hydrogen 2.768 N/A LEU 197.A N LEU 192.A O no hydrogen 3.406 N/A LEU 198.A N GLY 195.A O no hydrogen 3.081 N/A HIS 199.A N ARG 196.A O no hydrogen 3.471 N/A ASP 200.A N LEU 197.A O no hydrogen 3.133 N/A LEU 203.A N ASP 200.A O no hydrogen 3.176 N/A LEU 203.A N ASP 200.A OD2 no hydrogen 3.077 N/A ILE 204.A N ASP 200.A O no hydrogen 3.006 N/A HIS 205.A N ALA 201.A O no hydrogen 2.987 N/A ILE 206.A N ASP 202.A O no hydrogen 2.950 N/A ALA 207.A N LEU 203.A O no hydrogen 2.681 N/A LYS 208.A N ILE 204.A O no hydrogen 2.758 N/A ALA 209.A N HIS 205.A O no hydrogen 3.111 N/A HIS 210.A N ILE 206.A O no hydrogen 3.262 N/A HIS 210.A N ALA 207.A O no hydrogen 3.025 N/A HIS 210.A NE2 ASN 254.A OD1 no hydrogen 2.834 N/A GLN 211.A N LYS 208.A O no hydrogen 2.966 N/A ALA 212.A N ALA 207.A O no hydrogen 2.853 N/A THR 213.A N GLN 216.A OE1 no hydrogen 2.884 N/A THR 213.A OG1 GLU 242.A OE2 no hydrogen 2.606 N/A GLN 216.A N THR 213.A OG1 no hydrogen 3.307 N/A GLN 216.A NE2 GLU 242.A O no hydrogen 2.913 N/A VAL 217.A N THR 213.A O no hydrogen 2.985 N/A ALA 218.A N PRO 214.A O no hydrogen 2.956 N/A LEU 219.A N ALA 215.A O no hydrogen 3.120 N/A ALA 220.A N GLN 216.A O no hydrogen 2.824 N/A PHE 221.A N VAL 217.A O no hydrogen 2.989 N/A LYS 223.A N LEU 219.A O no hydrogen 2.988 N/A THR 224.A N PHE 221.A O no hydrogen 2.988 N/A THR 224.A OG1 ALA 220.A O no hydrogen 2.812 N/A THR 224.A OG1 PHE 221.A O no hydrogen 2.925 N/A CYS 225.A N LEU 222.A O no hydrogen 3.162 N/A CYS 225.A SG TYR 165.A OH no hydrogen 3.640 N/A CYS 225.A SG PHE 221.A O no hydrogen 3.708 N/A ILE 229.A N VAL 187.A O no hydrogen 2.957 N/A SER 230.A N ALA 17.A O no hydrogen 3.038 N/A ILE 231.A N ALA 188.A O no hydrogen 3.451 N/A SER 236.A N THR 234.A OG1 no hydrogen 3.083 N/A ARG 239.A N SER 236.A OG no hydrogen 3.374 N/A ALA 240.A N SER 236.A O no hydrogen 2.955 N/A ARG 241.A N PRO 237.A O no hydrogen 3.256 N/A GLU 242.A N GLU 238.A O no hydrogen 3.105 N/A ASN 243.A N ARG 239.A O no hydrogen 2.805 N/A ARG 244.A N ALA 240.A O no hydrogen 3.046 N/A ARG 244.A NE LEU 44.A O no hydrogen 3.122 N/A ARG 244.A NH1 ASP 2.A O no hydrogen 3.120 N/A ARG 244.A NH1 ARG 244.A O no hydrogen 2.822 N/A ARG 244.A NH2 ASP 2.A O no hydrogen 2.731 N/A ASP 245.A N ARG 241.A O no hydrogen 3.107 N/A ALA 246.A N GLU 242.A O no hydrogen 3.198 N/A ALA 246.A N ASN 243.A O no hydrogen 3.288 N/A ILE 248.A N ALA 246.A O no hydrogen 3.157 N/A THR 251.A N ASN 254.A OD1 no hydrogen 2.783 N/A ASN 254.A N THR 251.A OG1 no hydrogen 3.026 N/A LEU 255.A N THR 251.A O no hydrogen 3.049 N/A ALA 256.A N THR 252.A O no hydrogen 3.065 N/A GLU 257.A N GLU 253.A O no hydrogen 3.126 N/A LEU 258.A N ASN 254.A O no hydrogen 3.033 N/A ASP 259.A N LEU 255.A O no hydrogen 3.004 N/A ARG 260.A N ALA 256.A O no hydrogen 2.910 N/A HIS 261.A N GLU 257.A O no hydrogen 2.832 N/A HIS 261.A NE2 ASP 200.A OD1 no hydrogen 2.805 N/A PHE 262.A N LEU 258.A O no hydrogen 2.557 N/A LYS 268.A NZ ASP 143.A OD1 no hydrogen 3.452 N/A LYS 268.A NZ ASP 143.A OD2 no hydrogen 2.842 N/A LYS 268.A NZ ASP 175.A OD2 no hydrogen 2.914 N/A LYS 268.A NZ THR 269.A O no hydrogen 2.833 N/A THR 269.A OG1 ARG 267.A O no hydrogen 3.561 N/A ILE 274.A N TYR 189.A OH no hydrogen 3.036 N/A