Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ju2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N GLY 29.A O no hydrogen 2.900 N/A SER 6.A N GLN 243.A O no hydrogen 2.787 N/A SER 6.A OG THR 60.A OG1 no hydrogen 2.815 N/A ILE 7.A N ALA 32.A O no hydrogen 3.134 N/A ASN 8.A N VAL 245.A O no hydrogen 2.831 N/A ASN 8.A ND2 GLU 244.A OE2 no hydrogen 2.865 N/A LEU 9.A N ALA 34.A O no hydrogen 2.910 N/A ALA 10.A N ASN 8.A OD1 no hydrogen 3.070 N/A THR 11.A N ASN 8.A O no hydrogen 2.990 N/A THR 11.A OG1 ASN 8.A O no hydrogen 3.036 N/A THR 11.A OG1 VAL 245.A O no hydrogen 2.863 N/A ILE 12.A N LEU 9.A O no hydrogen 3.257 N/A ARG 13.A N ALA 10.A O no hydrogen 3.189 N/A ARG 13.A NE.B GLU 14.A OE2 no hydrogen 2.896 N/A ARG 13.A NH1.A ASP 38.A OD2 no hydrogen 3.535 N/A ARG 13.A NH2.B GLU 14.A OE2 no hydrogen 2.897 N/A GLN 15.A N GLN 15.A OE1 no hydrogen 2.770 N/A GLN 15.A NE2 TRP 253.A O no hydrogen 2.945 N/A GLN 15.A NE2 ARG 256.A O no hydrogen 2.883 N/A CYS 16.A N ILE 12.A O no hydrogen 3.024 N/A ALA 21.A N GLY 17.A O no hydrogen 3.021 N/A VAL 22.A N PHE 18.A O no hydrogen 3.070 N/A ASP 23.A N ALA 19.A O no hydrogen 3.182 N/A ILE 24.A N GLU 20.A O no hydrogen 2.957 N/A CYS 25.A N ALA 21.A O no hydrogen 2.874 N/A CYS 25.A SG ALA 21.A O no hydrogen 3.443 N/A LEU 26.A N VAL 22.A O no hydrogen 2.815 N/A LYS 27.A N ASP 23.A O no hydrogen 3.139 N/A LYS 27.A NZ ASP 259.A OD1.A no hydrogen 2.980 N/A LYS 27.A NZ ASP 259.A OD1.B no hydrogen 3.317 N/A LYS 27.A NZ ASP 259.A OD2.A no hydrogen 3.339 N/A HIS 28.A N ILE 24.A O no hydrogen 3.211 N/A HIS 28.A N CYS 25.A O no hydrogen 3.081 N/A HIS 28.A NE2 ASP 259.A OD1.A no hydrogen 2.834 N/A HIS 28.A NE2 ASP 259.A OD1.B no hydrogen 2.737 N/A GLY 29.A N LEU 26.A O no hydrogen 3.364 N/A ILE 30.A N CYS 25.A O no hydrogen 2.947 N/A ILE 33.A N LYS 58.A O no hydrogen 2.899 N/A ALA 34.A N ILE 7.A O no hydrogen 2.964 N/A TRP 36.A N GLN 39.A OE1 no hydrogen 2.886 N/A TRP 36.A NE1 ASN 8.A OD1 no hydrogen 2.768 N/A ARG 37.A N CYS 63.A O no hydrogen 2.844 N/A ARG 37.A NH1 ARG 64.A O no hydrogen 3.148 N/A ARG 37.A NH1 ASP 82.A OD2 no hydrogen 3.156 N/A ARG 37.A NH2 ASP 82.A OD1 no hydrogen 2.915 N/A GLN 39.A NE2 LEU 9.A O no hydrogen 3.620 N/A VAL 40.A N TRP 36.A O no hydrogen 3.094 N/A ALA 41.A N ARG 37.A O no hydrogen 2.988 N/A ALA 42.A N ASP 38.A O no hydrogen 2.950 N/A ILE 43.A N GLN 39.A O no hydrogen 3.263 N/A GLY 44.A N VAL 40.A O no hydrogen 2.763 N/A ALA 48.A N GLY 44.A O no hydrogen 2.957 N/A GLY 49.A N LEU 45.A O no hydrogen 2.998 N/A ARG 50.A N GLY 46.A O no hydrogen 3.207 N/A ILE 51.A N GLU 47.A O no hydrogen 3.058 N/A VAL 52.A N ALA 48.A O no hydrogen 2.925 N/A ARG 53.A N GLY 49.A O no hydrogen 2.864 N/A ALA 54.A N ARG 50.A O no hydrogen 2.898 N/A ASN 55.A ND2 ILE 51.A O no hydrogen 2.937 N/A GLY 56.A N ARG 53.A O no hydrogen 2.856 N/A LEU 57.A N VAL 52.A O no hydrogen 2.641 N/A LYS 58.A N THR 31.A O no hydrogen 3.242 N/A LYS 58.A NZ ASP 96.A OD2 no hydrogen 3.262 N/A THR 60.A N ILE 33.A O no hydrogen 2.897 N/A THR 60.A OG1 SER 6.A OG no hydrogen 2.815 N/A THR 60.A OG1 ILE 33.A O no hydrogen 3.352 N/A THR 60.A OG1 GLU 244.A OE1 no hydrogen 2.789 N/A LEU 62.A N CYS 97.A O no hydrogen 3.023 N/A CYS 63.A N PRO 35.A O no hydrogen 3.073 N/A GLY 65.A N VAL 99.A O no hydrogen 2.765 N/A GLY 66.A N ASN 83.A OD1 no hydrogen 2.742 N/A PHE 67.A N VAL 101.A O no hydrogen 2.808 N/A PHE 68.A N ALA 102.A O no hydrogen 2.967 N/A SER 74.A OG ASP 72.A OD2.B no hydrogen 2.725 N/A ARG 76.A N ASP 72.A O no hydrogen 2.957 N/A ARG 76.A NH1 ALA 70.A O no hydrogen 3.044 N/A GLU 77.A N ALA 73.A O no hydrogen 2.774 N/A LYS 78.A N SER 74.A O no hydrogen 2.944 N/A ALA 79.A N GLY 75.A O no hydrogen 3.094 N/A ILE 80.A N ARG 76.A O no hydrogen 2.994 N/A ASP 81.A N GLU 77.A O no hydrogen 2.855 N/A ASP 82.A N LYS 78.A O no hydrogen 3.072 N/A ASN 83.A N ALA 79.A O no hydrogen 3.029 N/A ASN 83.A ND2 GLY 66.A O no hydrogen 2.920 N/A ASN 83.A ND2 ALA 79.A O no hydrogen 2.874 N/A ARG 84.A N ILE 80.A O no hydrogen 3.046 N/A ARG 84.A NH1 ASP 81.A OD1 no hydrogen 3.425 N/A ARG 85.A N ASP 81.A O no hydrogen 3.124 N/A ALA 86.A N ASP 82.A O no hydrogen 2.880 N/A VAL 87.A N ASN 83.A O no hydrogen 2.882 N/A ASP 88.A N ARG 84.A O no hydrogen 3.090 N/A GLU 89.A N ARG 85.A O no hydrogen 3.068 N/A ALA 90.A N ALA 86.A O no hydrogen 3.024 N/A ALA 91.A N VAL 87.A O no hydrogen 2.928 N/A GLU 92.A N ASP 88.A O no hydrogen 3.090 N/A LEU 93.A N GLU 89.A O no hydrogen 3.131 N/A GLY 94.A N ALA 91.A O no hydrogen 3.044 N/A ALA 95.A N ALA 90.A O no hydrogen 2.959 N/A ASP 96.A N LEU 59.A O no hydrogen 2.814 N/A CYS 97.A SG THR 60.A O no hydrogen 3.431 N/A LEU 98.A N PRO 136.A O no hydrogen 2.956 N/A VAL 99.A N LEU 62.A O no hydrogen 3.053 N/A LEU 100.A N ALA 138.A O no hydrogen 2.628 N/A VAL 101.A N GLY 65.A O no hydrogen 2.913 N/A LEU 105.A N ALA 148.A O no hydrogen 2.812 N/A SER 109.A N PRO 106.A O no hydrogen 2.956 N/A ASN 111.A N SER 109.A OG no hydrogen 2.910 N/A ALA 114.A N ASN 111.A OD1 no hydrogen 3.074 N/A ALA 115.A N ASN 111.A O no hydrogen 3.050 N/A ARG 116.A N ILE 112.A O no hydrogen 2.932 N/A ARG 116.A NE CYS 152.A O no hydrogen 2.664 N/A ARG 116.A NH1 CYS 152.A O no hydrogen 3.382 N/A ARG 116.A NH1 ASN 154.A OD1 no hydrogen 2.829 N/A ARG 117.A N ASP 113.A O no hydrogen 2.956 N/A MET 118.A N ALA 114.A O no hydrogen 3.000 N/A VAL 119.A N ALA 115.A O no hydrogen 3.027 N/A VAL 120.A N ARG 116.A O no hydrogen 3.071 N/A GLU 121.A N ARG 117.A O no hydrogen 2.954 N/A GLY 122.A N MET 118.A O no hydrogen 2.968 N/A ILE 123.A N VAL 119.A O no hydrogen 2.885 N/A ALA 124.A N VAL 120.A O no hydrogen 2.914 N/A ALA 125.A N GLU 121.A O no hydrogen 2.804 N/A VAL 126.A N GLY 122.A O no hydrogen 3.036 N/A VAL 126.A N ILE 123.A O no hydrogen 3.113 N/A LEU 127.A N ILE 123.A O no hydrogen 2.893 N/A HIS 129.A NE2 ASP 88.A OD1 no hydrogen 2.618 N/A ALA 130.A N VAL 126.A O no hydrogen 3.167 N/A ARG 131.A N LEU 127.A O no hydrogen 2.819 N/A ARG 131.A NE PRO 168.A O no hydrogen 2.917 N/A ARG 131.A NH1 LEU 166.A O no hydrogen 3.312 N/A ARG 131.A NH1 PRO 168.A O no hydrogen 2.932 N/A ALA 132.A N PRO 128.A O no hydrogen 2.979 N/A ALA 133.A N HIS 129.A O no hydrogen 3.076 N/A GLY 134.A N ARG 131.A O no hydrogen 3.116 N/A VAL 135.A N ALA 130.A O no hydrogen 2.813 N/A LEU 137.A N GLY 169.A O no hydrogen 3.020 N/A ALA 138.A N LEU 98.A O no hydrogen 2.829 N/A ILE 139.A N GLY 171.A O no hydrogen 2.804 N/A GLU 140.A N LEU 100.A O no hydrogen 2.989 N/A LEU 142.A N VAL 153.A O no hydrogen 2.801 N/A HIS 143.A N HIS 178.A ND1 no hydrogen 3.084 N/A MET 145.A N HIS 143.A ND1 no hydrogen 3.037 N/A TYR 146.A N HIS 143.A O no hydrogen 2.858 N/A TYR 146.A OH MET 213.A O no hydrogen 2.579 N/A ALA 147.A N PRO 144.A O no hydrogen 3.191 N/A ARG 150.A N TYR 146.A O no hydrogen 3.014 N/A ALA 151.A N TYR 146.A O no hydrogen 3.027 N/A CYS 152.A N GLY 103.A O no hydrogen 3.015 N/A CYS 152.A SG GLY 103.A O no hydrogen 3.423 N/A ASN 154.A N GLN 158.A OE1 no hydrogen 2.892 N/A ASN 154.A ND2 LEU 142.A O no hydrogen 3.210 N/A ASN 154.A ND2 HIS 143.A O no hydrogen 3.530 N/A ASN 154.A ND2 ALA 151.A O no hydrogen 2.830 N/A GLN 158.A N THR 155.A OG1 no hydrogen 2.982 N/A GLN 158.A NE2 CYS 152.A O no hydrogen 3.186 N/A ALA 159.A N THR 155.A O no hydrogen 2.983 N/A LEU 160.A N LEU 156.A O no hydrogen 2.818 N/A ASP 161.A N GLY 157.A O no hydrogen 2.896 N/A ILE 162.A N GLN 158.A O no hydrogen 3.199 N/A CYS 163.A N ALA 159.A O no hydrogen 3.085 N/A CYS 163.A SG ALA 159.A O no hydrogen 3.366 N/A CYS 163.A SG VAL 170.A O no hydrogen 3.516 N/A GLU 164.A N LEU 160.A O no hydrogen 2.850 N/A THR 165.A N ASP 161.A O no hydrogen 3.116 N/A THR 165.A OG1 ASP 161.A O no hydrogen 2.980 N/A LEU 166.A N ILE 162.A O no hydrogen 2.922 N/A GLY 167.A N CYS 163.A O no hydrogen 2.819 N/A GLY 171.A N LEU 137.A O no hydrogen 2.793 N/A VAL 172.A N ALA 197.A O no hydrogen 2.777 N/A ALA 173.A N ILE 139.A O no hydrogen 2.976 N/A ILE 174.A N ALA 200.A O no hydrogen 2.896 N/A VAL 176.A N HIS 202.A O no hydrogen 3.072 N/A TYR 177.A N ASP 175.A OD1 no hydrogen 2.978 N/A HIS 178.A N ASP 175.A O no hydrogen 2.943 N/A VAL 179.A N ASP 175.A O no hydrogen 3.220 N/A TRP 180.A N VAL 176.A O no hydrogen 2.974 N/A TRP 181.A NE1 HIS 178.A O no hydrogen 2.796 N/A ASP 182.A N VAL 179.A O no hydrogen 2.956 N/A ASP 184.A N ASP 182.A OD1 no hydrogen 2.916 N/A LEU 185.A N ASP 182.A O no hydrogen 2.975 N/A ASN 187.A ND2 ASP 184.A OD1 no hydrogen 2.848 N/A GLN 188.A N ASP 184.A O no hydrogen 3.101 N/A GLN 188.A NE2 ASP 184.A OD2 no hydrogen 2.973 N/A ILE 189.A N LEU 185.A O no hydrogen 2.946 N/A ALA 190.A N ALA 186.A O no hydrogen 3.136 N/A ARG 191.A N ASN 187.A O no hydrogen 2.838 N/A ARG 191.A NH1 GLY 157.A O no hydrogen 3.292 N/A ARG 191.A NH1 ASP 161.A OD1 no hydrogen 3.206 N/A ARG 191.A NH1 GLN 188.A OE1 no hydrogen 2.912 N/A ARG 191.A NH2 ASP 161.A OD1 no hydrogen 2.771 N/A ARG 191.A NH2 GLU 164.A OE1 no hydrogen 3.310 N/A ALA 192.A N GLN 188.A O no hydrogen 2.797 N/A GLY 193.A N ILE 189.A O no hydrogen 2.918 N/A LYS 194.A N ALA 190.A O no hydrogen 3.047 N/A MET 195.A N ARG 191.A O no hydrogen 3.099 N/A LYS 196.A N GLY 193.A O no hydrogen 2.850 N/A ALA 197.A N ALA 192.A O no hydrogen 2.883 N/A LEU 199.A N VAL 172.A O no hydrogen 2.865 N/A HIS 202.A N ILE 174.A O no hydrogen 2.828 N/A HIS 202.A ND1 GLU 246.A OE1 no hydrogen 3.171 N/A ILE 203.A N GLU 244.A O no hydrogen 2.796 N/A CYS 204.A SG ASP 175.A OD1 no hydrogen 3.788 N/A ASP 205.A N GLY 218.A O no hydrogen 2.951 N/A TRP 206.A N ASP 205.A OD2 no hydrogen 2.919 N/A THR 210.A OG1 LEU 207.A O no hydrogen 2.723 N/A LYS 211.A N ASP 216.A OD2 no hydrogen 2.820 N/A LYS 211.A NZ ASP 216.A OD1 no hydrogen 3.176 N/A LYS 211.A NZ ASP 216.A OD2 no hydrogen 2.696 N/A LEU 214.A N ASP 212.A OD2 no hydrogen 2.886 N/A THR 215.A N ASP 212.A OD2 no hydrogen 2.919 N/A THR 215.A OG1 ASP 212.A OD2 no hydrogen 3.138 N/A ARG 217.A N PHE 248.A O no hydrogen 2.893 N/A ARG 217.A NH1 ASP 175.A OD2 no hydrogen 3.017 N/A ARG 217.A NH1 GLU 246.A O no hydrogen 2.973 N/A ARG 217.A NH1 GLU 246.A OE1 no hydrogen 3.309 N/A GLY 218.A N ASP 205.A O no hydrogen 2.883 N/A GLY 221.A N ASP 205.A OD1 no hydrogen 2.912 N/A ASP 222.A N MET 219.A O no hydrogen 2.949 N/A GLY 223.A N ASP 205.A OD1 no hydrogen 2.886 N/A VAL 224.A N TRP 206.A O no hydrogen 3.012 N/A ILE 225.A N ASP 205.A OD2 no hydrogen 2.913 N/A LYS 228.A NZ ASN 271.A O no hydrogen 3.529 N/A GLY 229.A N ASP 226.A OD1 no hydrogen 2.925 N/A ILE 230.A N ASP 226.A O no hydrogen 2.995 N/A ARG 231.A N LEU 227.A O no hydrogen 2.867 N/A ARG 231.A NE GLU 235.A OE2 no hydrogen 2.799 N/A ARG 231.A NH1 HIS 201.A ND1 no hydrogen 3.123 N/A ARG 231.A NH1 GLY 241.A O no hydrogen 3.098 N/A ARG 231.A NH2 GLU 235.A OE2 no hydrogen 3.450 N/A ARG 231.A NH2 GLY 241.A O no hydrogen 2.702 N/A ARG 232.A N LYS 228.A O no hydrogen 2.842 N/A ARG 233.A N GLY 229.A O no hydrogen 3.254 N/A ILE 234.A N ILE 230.A O no hydrogen 2.971 N/A GLU 235.A N ARG 231.A O no hydrogen 2.873 N/A ALA 236.A N ARG 232.A O no hydrogen 2.902 N/A ALA 237.A N ARG 233.A O no hydrogen 2.921 N/A GLY 238.A N GLU 235.A O no hydrogen 2.770 N/A PHE 239.A N ILE 234.A O no hydrogen 3.055 N/A GLN 243.A N GLY 4.A O no hydrogen 2.915 N/A GLN 243.A NE2 CYS 273.A O no hydrogen 3.486 N/A GLU 244.A N HIS 201.A O no hydrogen 2.834 N/A VAL 245.A N SER 6.A O no hydrogen 2.804 N/A GLU 246.A N ILE 203.A O no hydrogen 3.074 N/A ILE 247.A N THR 11.A OG1 no hydrogen 3.100 N/A ALA 250.A N THR 215.A O no hydrogen 2.936 N/A TRP 253.A N SER 249.A OG no hydrogen 2.986 N/A TRP 254.A N SER 249.A O no hydrogen 2.945 N/A TRP 254.A NE1 ALA 10.A O no hydrogen 2.755 N/A LYS 255.A N ASN 252.A O no hydrogen 3.003 N/A LYS 255.A NZ ASP 251.A OD1 no hydrogen 3.290 N/A ARG 256.A N TRP 253.A O no hydrogen 3.323 N/A ARG 256.A NE ASN 252.A OD1 no hydrogen 2.898 N/A ARG 256.A NH1 GLU 260.A OE2 no hydrogen 2.901 N/A ARG 256.A NH2 ASN 252.A OD1 no hydrogen 3.087 N/A VAL 261.A N PRO 257.A O no hydrogen 3.235 N/A ILE 262.A N ALA 258.A O no hydrogen 3.011 N/A ALA 263.A N ASP 259.A O no hydrogen 3.057 N/A THR 264.A N GLU 260.A O no hydrogen 3.055 N/A THR 264.A OG1 GLU 260.A O no hydrogen 2.695 N/A CYS 265.A N VAL 261.A O no hydrogen 2.965 N/A CYS 265.A SG VAL 261.A O no hydrogen 3.249 N/A VAL 266.A N ILE 262.A O no hydrogen 3.039 N/A GLU 267.A N ALA 263.A O no hydrogen 3.025 N/A ARG 268.A N THR 264.A O no hydrogen 2.791 N/A ARG 268.A NE GLU 267.A OE2.A no hydrogen 3.146 N/A ARG 268.A NH1 MET 220.A O no hydrogen 2.766 N/A ARG 268.A NH1 ASP 222.A OD1 no hydrogen 2.789 N/A ARG 268.A NH2 ASP 222.A OD1 no hydrogen 3.162 N/A TYR 269.A N CYS 265.A O no hydrogen 2.964 N/A TYR 269.A OH GLU 3.A O no hydrogen 2.744 N/A ARG 270.A N VAL 266.A O no hydrogen 3.142 N/A ASN 271.A N GLU 267.A O no hydrogen 3.059 N/A CYS 272.A N ARG 268.A O no hydrogen 2.609 N/A CYS 273.A N TYR 269.A O no hydrogen 3.362 N/A CYS 273.A SG ARG 268.A O no hydrogen 3.797 N/A