Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cr8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N GLU 30.A OE1 no hydrogen 2.766 N/A ARG 4.A NE GLU 233.A OE1 no hydrogen 2.795 N/A ARG 4.A NH2 GLU 233.A OE1 no hydrogen 3.387 N/A ARG 4.A NH2 GLU 233.A OE2 no hydrogen 3.004 N/A LEU 5.A N GLU 30.A O no hydrogen 2.850 N/A ALA 6.A N GLY 3.A O no hydrogen 3.159 N/A GLY 7.A N GLY 31.A O no hydrogen 3.339 N/A LYS 8.A N LEU 5.A O no hydrogen 3.041 N/A LYS 8.A NZ ASP 234.A OD1 no hydrogen 2.789 N/A ALA 9.A N ASP 81.A OD2 no hydrogen 2.863 N/A ALA 10.A N SER 33.A O no hydrogen 2.888 N/A ILE 11.A N ILE 82.A O no hydrogen 2.927 N/A VAL 12.A N VAL 35.A O no hydrogen 2.937 N/A THR 13.A N VAL 84.A O no hydrogen 2.974 N/A THR 13.A OG1 VAL 84.A O no hydrogen 3.545 N/A ALA 15.A N MET 37.A O no hydrogen 2.959 N/A ALA 16.A N ASP 38.A OD2 no hydrogen 3.083 N/A GLY 17.A N GLY 14.A O no hydrogen 3.101 N/A ARG 21.A N GLY 17.A O no hydrogen 2.860 N/A ARG 21.A NH1 ARG 47.A O no hydrogen 2.562 N/A ALA 22.A N GLY 18.A O no hydrogen 3.102 N/A THR 23.A N ILE 19.A O no hydrogen 2.945 N/A THR 23.A OG1 ILE 19.A O no hydrogen 2.781 N/A VAL 24.A N GLY 20.A O no hydrogen 2.853 N/A GLU 25.A N ARG 21.A O no hydrogen 2.985 N/A ALA 26.A N ALA 22.A O no hydrogen 2.917 N/A TYR 27.A N THR 23.A O no hydrogen 2.821 N/A TYR 27.A OH ALA 228.A O no hydrogen 2.790 N/A LEU 28.A N VAL 24.A O no hydrogen 2.937 N/A ARG 29.A N GLU 25.A O no hydrogen 2.893 N/A GLU 30.A N ALA 26.A O no hydrogen 2.899 N/A GLY 31.A N LEU 28.A O no hydrogen 3.062 N/A ALA 32.A N TYR 27.A O no hydrogen 3.012 N/A SER 33.A N LYS 8.A O no hydrogen 2.828 N/A VAL 35.A N ALA 10.A O no hydrogen 2.926 N/A ALA 36.A N ILE 54.A O no hydrogen 2.870 N/A MET 37.A N VAL 12.A O no hydrogen 2.874 N/A LEU 39.A N ASP 38.A OD1 no hydrogen 2.717 N/A LEU 43.A N LEU 39.A O no hydrogen 2.998 N/A ALA 44.A N ALA 40.A O no hydrogen 2.979 N/A ALA 45.A N PRO 41.A O no hydrogen 3.219 N/A ALA 45.A N ARG 42.A O no hydrogen 3.220 N/A THR 46.A N LEU 43.A O no hydrogen 2.998 N/A TYR 48.A OH ALA 15.A O no hydrogen 2.853 N/A GLU 49.A N GLU 25.A OE2 no hydrogen 2.776 N/A ILE 54.A N VAL 34.A O no hydrogen 2.901 N/A ILE 56.A N ALA 36.A O no hydrogen 2.913 N/A CYS 58.A N ASP 38.A O no hydrogen 2.853 N/A CYS 58.A SG ALA 65.A O no hydrogen 3.895 N/A ALA 61.A N ASP 59.A OD1 no hydrogen 2.954 N/A ASP 62.A N ASP 59.A O no hydrogen 3.060 N/A ALA 65.A N ASP 62.A OD1 no hydrogen 3.132 N/A ILE 66.A N ASP 62.A O no hydrogen 3.072 N/A ASP 67.A N ARG 63.A O no hydrogen 3.399 N/A ALA 68.A N ALA 64.A O no hydrogen 3.065 N/A ALA 69.A N ALA 65.A O no hydrogen 2.905 N/A MET 70.A N ILE 66.A O no hydrogen 3.052 N/A ALA 71.A N ASP 67.A O no hydrogen 2.985 N/A ASP 72.A N ALA 68.A O no hydrogen 2.987 N/A ALA 73.A N ALA 69.A O no hydrogen 2.967 N/A VAL 74.A N MET 70.A O no hydrogen 2.997 N/A ALA 75.A N ALA 71.A O no hydrogen 2.880 N/A ARG 76.A N ASP 72.A O no hydrogen 2.936 N/A ARG 76.A NE ASP 72.A OD1 no hydrogen 2.957 N/A ARG 76.A NH2 ASP 72.A OD1 no hydrogen 3.540 N/A ARG 76.A NH2 ASP 72.A OD2 no hydrogen 2.898 N/A LEU 77.A N ALA 73.A O no hydrogen 2.972 N/A GLY 78.A N VAL 74.A O no hydrogen 2.839 N/A GLY 78.A N ALA 75.A O no hydrogen 3.303 N/A GLY 79.A N VAL 74.A O no hydrogen 3.123 N/A ASP 81.A N ALA 9.A O no hydrogen 2.832 N/A ILE 82.A N ALA 9.A O no hydrogen 2.992 N/A LEU 83.A N ARG 139.A O no hydrogen 2.845 N/A VAL 84.A N ILE 11.A O no hydrogen 2.815 N/A ALA 85.A N ILE 141.A O no hydrogen 2.833 N/A GLY 86.A N THR 13.A OG1 no hydrogen 2.878 N/A GLY 87.A N THR 13.A OG1 no hydrogen 3.019 N/A LEU 89.A N ASN 111.A OD1 no hydrogen 2.617 N/A THR 93.A N GLU 154.A O no hydrogen 3.089 N/A GLY 94.A N GLU 154.A O no hydrogen 3.225 N/A LEU 97.A N ASN 95.A OD1 no hydrogen 3.033 N/A ASP 98.A N ASN 95.A O no hydrogen 2.997 N/A LEU 99.A N PHE 96.A O no hydrogen 3.149 N/A ASP 103.A N SER 100.A OG no hydrogen 3.190 N/A TRP 104.A N SER 100.A O no hydrogen 2.977 N/A ASP 105.A N ASP 101.A O no hydrogen 2.807 N/A ARG 106.A N ALA 102.A O no hydrogen 3.027 N/A ARG 106.A NH1 ASP 103.A OD1 no hydrogen 2.773 N/A ARG 106.A NH2 ASP 103.A OD1 no hydrogen 2.753 N/A TYR 107.A N ASP 103.A O no hydrogen 3.125 N/A TYR 107.A OH LYS 90.A O no hydrogen 2.792 N/A VAL 108.A N TRP 104.A O no hydrogen 2.975 N/A ASP 109.A N ASP 105.A O no hydrogen 2.744 N/A VAL 110.A N ARG 106.A O no hydrogen 3.043 N/A ASN 111.A N TYR 107.A O no hydrogen 2.833 N/A ASN 111.A ND2 LEU 89.A O no hydrogen 2.773 N/A MET 112.A N VAL 108.A O no hydrogen 3.013 N/A THR 113.A N VAL 108.A O no hydrogen 2.997 N/A GLY 114.A N ASP 109.A O no hydrogen 2.895 N/A THR 115.A OG1 ASN 111.A O no hydrogen 2.730 N/A PHE 116.A N MET 112.A O no hydrogen 2.929 N/A LEU 117.A N THR 113.A O no hydrogen 2.890 N/A THR 118.A N GLY 114.A O no hydrogen 3.048 N/A THR 118.A OG1 GLY 114.A O no hydrogen 2.802 N/A CYS 119.A N THR 115.A O no hydrogen 2.857 N/A CYS 119.A SG THR 115.A O no hydrogen 3.349 N/A ARG 120.A N PHE 116.A O no hydrogen 2.841 N/A ALA 121.A N LEU 117.A O no hydrogen 3.156 N/A GLY 122.A N THR 118.A O no hydrogen 2.902 N/A ALA 123.A N CYS 119.A O no hydrogen 2.755 N/A ARG 124.A N ARG 120.A O no hydrogen 3.046 N/A ALA 125.A N ALA 121.A O no hydrogen 2.952 N/A MET 126.A N GLY 122.A O no hydrogen 2.866 N/A VAL 127.A N ALA 123.A O no hydrogen 3.065 N/A ALA 128.A N ARG 124.A O no hydrogen 2.882 N/A ALA 129.A N ALA 125.A O no hydrogen 2.797 N/A ALA 129.A N MET 126.A O no hydrogen 3.229 N/A GLY 130.A N VAL 127.A O no hydrogen 3.081 N/A ALA 131.A N MET 126.A O no hydrogen 2.897 N/A GLY 132.A N ARG 136.A O no hydrogen 2.746 N/A LYS 133.A N GLY 130.A O no hydrogen 3.178 N/A ARG 136.A N LYS 133.A O no hydrogen 2.958 N/A ALA 138.A N GLY 180.A O no hydrogen 2.926 N/A ARG 139.A N ASP 81.A O no hydrogen 2.829 N/A ARG 139.A NH1 LEU 231.A O no hydrogen 2.697 N/A ARG 139.A NH1 GLU 233.A O no hydrogen 2.489 N/A ARG 139.A NH2 ASP 234.A O no hydrogen 3.527 N/A ILE 140.A N LEU 182.A O no hydrogen 2.886 N/A ILE 141.A N LEU 83.A O no hydrogen 2.820 N/A THR 142.A N ASN 184.A O no hydrogen 2.950 N/A THR 142.A OG1 THR 169.A OG1 no hydrogen 2.822 N/A THR 142.A OG1 ASN 184.A O no hydrogen 3.427 N/A ILE 143.A N ALA 85.A O no hydrogen 3.118 N/A GLY 144.A N ILE 186.A O no hydrogen 2.758 N/A VAL 146.A N PRO 188.A O no hydrogen 3.192 N/A ASN 147.A N SER 145.A OG no hydrogen 2.905 N/A ASN 147.A ND2 SER 145.A OG no hydrogen 3.112 N/A ASN 147.A ND2 GLU 152.A OE2 no hydrogen 3.055 N/A SER 148.A N SER 145.A O no hydrogen 2.812 N/A SER 148.A OG SER 145.A O no hydrogen 3.103 N/A SER 148.A OG LYS 162.A O no hydrogen 2.988 N/A PHE 149.A N VAL 146.A O no hydrogen 3.080 N/A MET 150.A N VAL 146.A O no hydrogen 3.123 N/A GLU 152.A N ASN 147.A OD1 no hydrogen 2.968 N/A VAL 159.A N ALA 155.A O no hydrogen 2.920 N/A ALA 160.A N ALA 156.A O no hydrogen 2.937 N/A ALA 161.A N ALA 157.A O no hydrogen 3.020 N/A LYS 162.A N TYR 158.A O no hydrogen 2.956 N/A LYS 162.A NZ ILE 143.A O no hydrogen 3.176 N/A LYS 162.A NZ GLY 144.A O no hydrogen 3.314 N/A GLY 163.A N VAL 159.A O no hydrogen 2.980 N/A GLY 164.A N ALA 160.A O no hydrogen 2.904 N/A VAL 165.A N ALA 161.A O no hydrogen 2.944 N/A ALA 166.A N LYS 162.A O no hydrogen 2.980 N/A MET 167.A N GLY 163.A O no hydrogen 3.117 N/A LEU 168.A N GLY 164.A O no hydrogen 2.872 N/A THR 169.A N VAL 165.A O no hydrogen 2.896 N/A THR 169.A OG1 THR 142.A OG1 no hydrogen 2.822 N/A THR 169.A OG1 VAL 165.A O no hydrogen 2.680 N/A ARG 170.A N ALA 166.A O no hydrogen 3.342 N/A ARG 170.A NE GLY 241.A O no hydrogen 2.907 N/A ARG 170.A NH2 GLY 241.A O no hydrogen 3.508 N/A ALA 171.A N MET 167.A O no hydrogen 2.922 N/A MET 172.A N LEU 168.A O no hydrogen 2.828 N/A ALA 173.A N THR 169.A O no hydrogen 2.943 N/A VAL 174.A N ARG 170.A O no hydrogen 2.999 N/A ASP 175.A N ALA 171.A O no hydrogen 2.920 N/A LEU 176.A N MET 172.A O no hydrogen 2.733 N/A HIS 179.A N LEU 176.A O no hydrogen 2.908 N/A GLY 180.A N ALA 177.A O no hydrogen 3.056 N/A ILE 181.A N LEU 176.A O no hydrogen 3.189 N/A LEU 182.A N ALA 138.A O no hydrogen 3.015 N/A VAL 183.A N THR 240.A OG1 no hydrogen 2.979 N/A ASN 184.A N ILE 140.A O no hydrogen 3.010 N/A ASN 184.A ND2 ILE 239.A O no hydrogen 2.900 N/A MET 185.A N SER 242.A O no hydrogen 2.857 N/A ILE 186.A N THR 142.A O no hydrogen 2.877 N/A ALA 187.A N ILE 244.A O no hydrogen 2.889 N/A GLY 189.A N ILE 246.A O no hydrogen 2.840 N/A ASP 192.A N GLY 219.A O no hydrogen 2.816 N/A THR 194.A N ASP 192.A OD1 no hydrogen 2.841 N/A THR 194.A OG1 ASP 192.A OD1 no hydrogen 2.689 N/A THR 194.A OG1 THR 198.A OG1 no hydrogen 3.280 N/A ASN 196.A N THR 194.A OG1 no hydrogen 2.981 N/A ASN 196.A ND2 ASN 196.A O no hydrogen 2.771 N/A THR 198.A N THR 194.A OG1 no hydrogen 3.245 N/A THR 198.A OG1 THR 194.A OG1 no hydrogen 3.280 N/A GLY 199.A N ASP 192.A OD2 no hydrogen 3.051 N/A SER 201.A OG THR 198.A O no hydrogen 3.155 N/A ARG 204.A N GLU 202.A OE2 no hydrogen 3.018 N/A ARG 204.A NH1 GLU 207.A OE1 no hydrogen 3.203 N/A LEU 205.A N GLU 202.A OE1 no hydrogen 3.006 N/A ALA 206.A N GLU 202.A O no hydrogen 2.746 N/A GLU 207.A N PRO 203.A O no hydrogen 2.927 N/A GLN 208.A N ARG 204.A O no hydrogen 3.028 N/A VAL 209.A N LEU 205.A O no hydrogen 2.907 N/A LEU 210.A N ALA 206.A O no hydrogen 3.167 N/A ASP 211.A N GLU 207.A O no hydrogen 2.992 N/A GLU 212.A N GLN 208.A O no hydrogen 2.789 N/A VAL 213.A N VAL 209.A O no hydrogen 3.137 N/A LEU 215.A N GLY 248.A O no hydrogen 3.024 N/A GLY 216.A N VAL 213.A O no hydrogen 2.800 N/A ARG 217.A NH1 PRO 218.A O no hydrogen 3.122 N/A ARG 217.A NH1 GLU 223.A OE1 no hydrogen 2.950 N/A ARG 217.A NH1 GLU 223.A OE2 no hydrogen 3.431 N/A ARG 217.A NH2 GLU 223.A OE2 no hydrogen 2.710 N/A GLY 219.A N PRO 190.A O no hydrogen 2.734 N/A LEU 220.A N GLU 223.A OE1 no hydrogen 2.785 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.760 N/A GLU 223.A N LEU 220.A O no hydrogen 2.882 N/A VAL 224.A N PRO 221.A O no hydrogen 2.944 N/A ALA 225.A N PRO 221.A O no hydrogen 2.985 N/A THR 226.A N GLU 222.A O no hydrogen 3.158 N/A ALA 227.A N VAL 224.A O no hydrogen 3.092 N/A VAL 229.A N ALA 225.A O no hydrogen 3.180 N/A PHE 230.A N THR 226.A O no hydrogen 3.066 N/A LEU 231.A N ALA 227.A O no hydrogen 2.947 N/A ALA 232.A N ALA 228.A O no hydrogen 3.172 N/A GLU 233.A N VAL 229.A O no hydrogen 3.090 N/A SER 236.A N GLU 233.A O no hydrogen 3.159 N/A SER 236.A OG PHE 230.A O no hydrogen 2.582 N/A SER 237.A OG ASP 234.A O no hydrogen 3.459 N/A ILE 239.A N SER 236.A O no hydrogen 3.288 N/A THR 240.A OG1 VAL 183.A O no hydrogen 3.445 N/A GLY 241.A N VAL 183.A O no hydrogen 2.697 N/A SER 242.A N ASN 184.A OD1 no hydrogen 2.966 N/A SER 242.A OG ASN 184.A OD1 no hydrogen 2.825 N/A ILE 244.A N MET 185.A O no hydrogen 2.995 N/A ILE 246.A N ALA 187.A O no hydrogen 2.971 N/A GLY 249.A N ASP 247.A OD1 no hydrogen 2.986 N/A LEU 250.A N ASP 247.A O no hydrogen 3.076 N/A SER 251.A N ASP 247.A OD2 no hydrogen 2.861 N/A SER 251.A OG ASP 247.A OD2 no hydrogen 2.596 N/A ALA 252.A N GLY 249.A O no hydrogen 3.045 N/A MET 253.A N LEU 250.A O no hydrogen 3.506 N/A MET 258.A N PHE 255.A O no hydrogen 2.924 N/A ARG 259.A N GLY 256.A O no hydrogen 3.190 N/A ARG 259.A NH1 LEU 210.A O no hydrogen 3.238 N/A ARG 259.A NH1 ASP 211.A O no hydrogen 3.010 N/A ARG 259.A NH1 GLY 256.A O no hydrogen 2.995 N/A ARG 259.A NH2 LEU 210.A O no hydrogen 3.003 N/A ARG 262.A N ARG 259.A O no hydrogen 3.017 N/A ARG 262.A NE ASP 211.A OD1 no hydrogen 2.776 N/A ARG 262.A NH2 ASP 211.A OD1 no hydrogen 2.906 N/A ARG 263.A N ARG 259.A O no hydrogen 3.056 N/A ARG 263.A NH1 MET 258.A O no hydrogen 2.633 N/A