Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3quj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N LYS 33.A O no hydrogen 2.979 N/A ASN 4.A N ASP 54.A OD2 no hydrogen 2.718 N/A ASN 4.A ND2 LYS 52.A O no hydrogen 3.256 N/A PHE 5.A N ASN 35.A O no hydrogen 2.927 N/A GLY 6.A N ILE 55.A O no hydrogen 2.641 N/A ILE 7.A N PHE 37.A O no hydrogen 2.941 N/A SER 9.A OG PRO 40.A O no hydrogen 3.513 N/A THR 10.A N ILE 8.A O no hydrogen 2.696 N/A THR 10.A OG1 ILE 8.A O no hydrogen 3.402 N/A SER 12.A N GLU 151.A OE1 no hydrogen 3.087 N/A ASN 15.A N SER 12.A OG no hydrogen 3.065 N/A ASN 15.A ND2 GLU 151.A OE1 no hydrogen 3.045 N/A LEU 16.A N SER 12.A O no hydrogen 2.862 N/A LEU 16.A N GLN 13.A O no hydrogen 3.049 N/A LYS 17.A N GLN 13.A O no hydrogen 2.952 N/A LYS 17.A NZ GLN 13.A OE1 no hydrogen 2.847 N/A GLN 19.A NE2 GLU 11.A OE1 no hydrogen 2.653 N/A GLN 19.A NE2 ASN 15.A O no hydrogen 3.430 N/A TRP 20.A N LEU 16.A O no hydrogen 2.852 N/A THR 21.A N LYS 17.A O no hydrogen 2.760 N/A THR 21.A OG1 LYS 17.A O no hydrogen 3.043 N/A LEU 24.A N TRP 20.A O no hydrogen 2.864 N/A GLN 25.A N THR 21.A O no hydrogen 2.963 N/A ASP 26.A N PRO 22.A O no hydrogen 3.238 N/A LYS 28.A N GLN 25.A O no hydrogen 2.735 N/A LYS 29.A N ASP 26.A O no hydrogen 3.015 N/A LYS 29.A NZ ASP 26.A OD2 no hydrogen 3.459 N/A GLY 31.A N GLU 27.A O no hydrogen 3.027 N/A LYS 33.A NZ GLU 27.A OE2 no hydrogen 2.813 N/A VAL 34.A N GLU 27.A OE2 no hydrogen 3.030 N/A ASN 35.A N LEU 3.A O no hydrogen 2.863 N/A PHE 37.A N PHE 5.A O no hydrogen 2.825 N/A TYR 42.A N ASP 117.A OD2 no hydrogen 2.841 N/A GLY 44.A N ASP 41.A O no hydrogen 3.113 N/A GLY 44.A N ASP 41.A OD1 no hydrogen 2.992 N/A ILE 46.A N TYR 42.A O no hydrogen 3.175 N/A GLN 47.A N ALA 43.A O no hydrogen 2.809 N/A GLY 48.A N GLY 44.A O no hydrogen 2.882 N/A PHE 50.A N GLN 47.A O no hydrogen 2.875 N/A ASN 51.A ND2 ARG 49.A O no hydrogen 3.189 N/A LYS 52.A N GLY 48.A O no hydrogen 2.732 N/A VAL 53.A N GLY 48.A O no hydrogen 3.126 N/A ASP 54.A N ASN 4.A O no hydrogen 2.659 N/A ILE 55.A N ASN 4.A O no hydrogen 3.174 N/A ALA 56.A N VAL 201.A O no hydrogen 3.006 N/A TRP 57.A N GLY 6.A O no hydrogen 2.986 N/A TRP 57.A NE1 ASP 198.A OD2 no hydrogen 2.938 N/A TYR 58.A N PRO 199.A O no hydrogen 3.395 N/A TYR 58.A OH ILE 45.A O no hydrogen 3.412 N/A ASN 60.A ND2 PRO 196.A O no hydrogen 3.070 N/A ASN 60.A ND2 GLY 197.A O no hydrogen 3.217 N/A LEU 61.A N THR 121.A OG1 no hydrogen 2.868 N/A SER 62.A OG GLY 59.A O no hydrogen 3.174 N/A ALA 63.A N GLY 59.A O no hydrogen 2.782 N/A ALA 65.A N SER 62.A O no hydrogen 2.953 N/A VAL 66.A N ALA 63.A O no hydrogen 2.777 N/A ARG 68.A N GLU 64.A O no hydrogen 2.628 N/A ARG 68.A NE GLU 64.A OE2 no hydrogen 2.430 N/A ALA 69.A N ALA 65.A O no hydrogen 2.766 N/A GLY 71.A N ALA 65.A O no hydrogen 3.118 N/A GLN 72.A N TRP 202.A O no hydrogen 2.873 N/A VAL 73.A N ASP 243.A OD1 no hydrogen 2.760 N/A PHE 74.A N ILE 200.A O no hydrogen 3.041 N/A GLN 76.A N ARG 239.A O no hydrogen 2.722 N/A GLN 76.A NE2 GLY 197.A O no hydrogen 3.032 N/A THR 77.A N ASP 198.A O no hydrogen 2.866 N/A THR 77.A OG1 ASP 198.A O no hydrogen 2.975 N/A ALA 80.A N GLY 234.A O no hydrogen 2.835 N/A GLY 82.A N ALA 79.A O no hydrogen 2.782 N/A SER 83.A N ASP 81.A OD1 no hydrogen 3.050 N/A SER 83.A OG ASP 81.A OD1 no hydrogen 2.531 N/A TYR 86.A N ILE 195.A O no hydrogen 2.813 N/A TRP 87.A N THR 169.A OG1 no hydrogen 2.964 N/A SER 88.A N SER 192.A OG no hydrogen 2.694 N/A SER 88.A OG SER 122.A O no hydrogen 2.666 N/A VAL 89.A N ASN 167.A O no hydrogen 2.962 N/A LEU 90.A N TRP 190.A O no hydrogen 3.077 N/A ILE 91.A N ALA 165.A O no hydrogen 2.975 N/A VAL 92.A N LYS 187.A O no hydrogen 3.149 N/A ASN 93.A ND2 VAL 157.A O no hydrogen 3.299 N/A LYS 94.A N GLU 185.A O no hydrogen 2.845 N/A LYS 94.A NZ ASP 95.A OD1 no hydrogen 3.359 N/A ASP 95.A N ASN 93.A OD1 no hydrogen 2.991 N/A SER 96.A N ASN 93.A O no hydrogen 2.859 N/A ILE 98.A N SER 96.A OG no hydrogen 3.351 N/A ASN 99.A N ASP 103.A OD1 no hydrogen 2.864 N/A ASP 103.A N ASN 100.A OD1 no hydrogen 3.061 N/A LEU 104.A N ASN 100.A O no hydrogen 3.055 N/A LEU 105.A N LEU 101.A O no hydrogen 2.687 N/A ALA 106.A N ASN 102.A O no hydrogen 2.908 N/A LYS 107.A N ASP 103.A O no hydrogen 3.094 N/A LYS 107.A N LEU 104.A O no hydrogen 3.261 N/A ARG 108.A NE ASP 141.A OD1 no hydrogen 2.909 N/A ARG 108.A NH1 LEU 105.A O no hydrogen 2.785 N/A ASP 110.A N LYS 107.A O no hydrogen 2.764 N/A LEU 111.A N ARG 108.A O no hydrogen 3.159 N/A THR 112.A N ASP 163.A OD2 no hydrogen 2.565 N/A PHE 113.A N ARG 144.A O no hydrogen 2.770 N/A GLY 114.A N VAL 164.A O no hydrogen 2.647 N/A ASN 115.A N VAL 146.A O no hydrogen 2.650 N/A GLY 116.A N ASN 115.A OD1 no hydrogen 3.121 N/A ASN 119.A N ASP 117.A OD1 no hydrogen 2.928 N/A SER 120.A N ASP 117.A O no hydrogen 2.682 N/A GLY 123.A N SER 120.A OG no hydrogen 2.731 N/A PHE 124.A N SER 120.A O no hydrogen 3.015 N/A LEU 125.A N SER 120.A O no hydrogen 3.056 N/A VAL 126.A N THR 121.A O no hydrogen 3.003 N/A GLY 128.A N PHE 124.A O no hydrogen 2.843 N/A TYR 129.A N LEU 125.A O no hydrogen 2.866 N/A TYR 129.A N VAL 126.A O no hydrogen 3.135 N/A TYR 130.A N VAL 126.A O no hydrogen 3.125 N/A VAL 131.A N PRO 127.A O no hydrogen 3.052 N/A PHE 132.A N PRO 127.A O no hydrogen 2.973 N/A ALA 133.A N GLY 128.A O no hydrogen 2.887 N/A LYS 134.A N TYR 129.A O no hydrogen 2.817 N/A ASN 135.A ND2 VAL 131.A O no hydrogen 3.014 N/A ASN 136.A N ALA 133.A O no hydrogen 2.965 N/A ILE 137.A N PHE 132.A O no hydrogen 2.999 N/A SER 138.A N ASP 141.A OD1 no hydrogen 3.319 N/A SER 140.A N SER 138.A OG no hydrogen 3.319 N/A ASP 141.A N SER 138.A O no hydrogen 3.117 N/A PHE 142.A N ALA 139.A O no hydrogen 3.303 N/A LYS 143.A N LEU 111.A O no hydrogen 2.838 N/A VAL 146.A N PHE 113.A O no hydrogen 3.200 N/A ALA 148.A N ASN 115.A O no hydrogen 2.781 N/A GLU 151.A N THR 10.A O no hydrogen 3.090 N/A ASN 153.A N GLY 149.A O no hydrogen 3.121 N/A ASN 153.A ND2 ASN 115.A O no hydrogen 3.183 N/A ALA 154.A N HIS 150.A O no hydrogen 2.802 N/A LEU 155.A N GLU 151.A O no hydrogen 2.714 N/A ALA 156.A N THR 152.A O no hydrogen 2.927 N/A VAL 157.A N ASN 153.A O no hydrogen 3.106 N/A ALA 158.A N ALA 154.A O no hydrogen 3.221 N/A ASN 159.A N LEU 155.A O no hydrogen 3.003 N/A LYS 160.A N VAL 157.A O no hydrogen 2.838 N/A LYS 160.A NZ ASN 93.A OD1 no hydrogen 3.301 N/A LYS 160.A NZ ASP 95.A OD2 no hydrogen 2.672 N/A GLN 161.A N ALA 156.A O no hydrogen 2.779 N/A ASP 163.A N THR 112.A O no hydrogen 3.094 N/A ASP 163.A N THR 112.A OG1 no hydrogen 2.756 N/A VAL 164.A N THR 112.A O no hydrogen 3.143 N/A ALA 165.A N ILE 91.A O no hydrogen 2.986 N/A THR 166.A N GLY 114.A O no hydrogen 3.062 N/A THR 166.A OG1 GLY 123.A O no hydrogen 2.752 N/A ASN 167.A N VAL 89.A O no hydrogen 3.011 N/A ASN 167.A ND2 HIS 150.A O no hydrogen 2.812 N/A ASN 167.A ND2 THR 166.A O no hydrogen 3.019 N/A ASN 168.A ND2 SER 122.A OG no hydrogen 3.034 N/A THR 169.A N TRP 87.A O no hydrogen 3.079 N/A THR 169.A OG1 TRP 87.A O no hydrogen 3.402 N/A ASN 171.A N ASN 168.A OD1 no hydrogen 2.933 N/A ASN 171.A ND2 ASN 167.A OD1 no hydrogen 2.891 N/A LEU 172.A N ASN 168.A O no hydrogen 3.061 N/A ASP 173.A N THR 169.A O no hydrogen 3.391 N/A LYS 174.A N GLU 170.A O no hydrogen 2.921 N/A LYS 174.A NZ GLN 19.A OE1 no hydrogen 2.766 N/A LYS 174.A NZ LEU 233.A O no hydrogen 2.691 N/A LEU 175.A N ASN 171.A O no hydrogen 2.878 N/A LYS 176.A N LEU 172.A O no hydrogen 3.240 N/A THR 177.A N LYS 174.A O no hydrogen 2.955 N/A SER 178.A N LYS 174.A O no hydrogen 3.060 N/A ALA 179.A N LEU 175.A O no hydrogen 2.960 N/A LYS 182.A NZ ASN 159.A OD1 no hydrogen 2.803 N/A LEU 183.A N ALA 179.A O no hydrogen 3.182 N/A LYS 184.A N PRO 180.A O no hydrogen 3.288 N/A LYS 184.A NZ GLU 181.A OE1 no hydrogen 2.748 N/A LYS 184.A NZ GLU 181.A OE2 no hydrogen 3.385 N/A GLU 185.A N LYS 182.A O no hydrogen 3.014 N/A LEU 186.A N LEU 183.A O no hydrogen 3.071 N/A LYS 187.A N VAL 92.A O no hydrogen 2.889 N/A LYS 187.A NZ SER 96.A O no hydrogen 3.361 N/A LYS 187.A NZ ASN 99.A OD1 no hydrogen 2.815 N/A ILE 189.A N LEU 90.A O no hydrogen 2.746 N/A SER 192.A N SER 88.A O no hydrogen 2.966 N/A SER 192.A OG SER 88.A O no hydrogen 3.419 N/A SER 192.A OG PRO 193.A O no hydrogen 2.799 N/A ILE 195.A N TYR 86.A O no hydrogen 2.819 N/A ILE 200.A N ALA 75.A O no hydrogen 2.910 N/A VAL 201.A N ALA 56.A O no hydrogen 3.088 N/A TRP 202.A N GLN 72.A O no hydrogen 2.989 N/A TRP 202.A NE1 GLN 72.A OE1 no hydrogen 2.807 N/A ARG 203.A N ASP 54.A O no hydrogen 3.147 N/A ARG 203.A NE ASP 54.A OD1 no hydrogen 2.861 N/A ARG 203.A NH1 ASN 205.A OD1 no hydrogen 2.776 N/A ARG 203.A NH2 ASP 54.A OD1 no hydrogen 2.732 N/A LYS 204.A N ASN 70.A O no hydrogen 3.006 N/A ASN 205.A ND2 ASN 51.A OD1 no hydrogen 3.080 N/A LEU 206.A N ARG 203.A O no hydrogen 3.384 N/A THR 210.A N SER 207.A OG no hydrogen 3.187 N/A THR 210.A OG1 SER 207.A OG no hydrogen 2.914 N/A LYS 211.A N SER 207.A O no hydrogen 2.879 N/A LYS 211.A NZ LYS 204.A O no hydrogen 2.791 N/A ASP 212.A N GLU 208.A O no hydrogen 2.964 N/A LYS 213.A N THR 209.A O no hydrogen 3.024 N/A ILE 214.A N THR 210.A O no hydrogen 2.813 N/A TYR 215.A N LYS 211.A O no hydrogen 2.932 N/A ASP 216.A N ASP 212.A O no hydrogen 2.747 N/A PHE 217.A N LYS 213.A O no hydrogen 3.137 N/A PHE 218.A N ILE 214.A O no hydrogen 3.043 N/A ASN 219.A ND2 ASP 216.A O no hydrogen 2.764 N/A TYR 220.A N PHE 218.A O no hydrogen 3.363 N/A GLY 221.A N GLU 226.A OE1 no hydrogen 2.730 N/A LYS 222.A NZ ASN 219.A OD1 no hydrogen 2.931 N/A GLU 226.A N THR 223.A OG1 no hydrogen 3.338 N/A LYS 227.A N THR 223.A O no hydrogen 2.931 N/A ALA 228.A N PRO 224.A O no hydrogen 3.183 N/A VAL 229.A N GLU 225.A O no hydrogen 3.205 N/A LEU 230.A N GLU 226.A O no hydrogen 2.933 N/A GLU 231.A N LYS 227.A O no hydrogen 3.063 N/A ARG 232.A N ALA 228.A O no hydrogen 3.101 N/A LEU 233.A N LEU 230.A O no hydrogen 2.966 N/A GLY 234.A N GLU 231.A O no hydrogen 2.784 N/A TRP 235.A N LEU 230.A O no hydrogen 2.834 N/A ALA 236.A N VAL 78.A O no hydrogen 2.837 N/A ARG 239.A N GLN 76.A O no hydrogen 2.930 N/A SER 241.A N PHE 74.A O no hydrogen 3.196 N/A SER 241.A OG SER 242.A O no hydrogen 3.338 N/A SER 241.A OG GLN 245.A OE1 no hydrogen 2.763 N/A SER 242.A N SER 241.A OG no hydrogen 2.797 N/A LEU 244.A N SER 242.A OG no hydrogen 3.103 N/A GLN 245.A N SER 242.A O no hydrogen 3.088 N/A GLN 245.A NE2 ASN 60.A OD1 no hydrogen 2.863 N/A GLN 245.A NE2 GLY 197.A O no hydrogen 2.996 N/A LEU 246.A N ASP 243.A O no hydrogen 3.173 N/A VAL 247.A N LEU 244.A O no hydrogen 3.217 N/A ILE 249.A N LEU 246.A O no hydrogen 2.938 N/A ARG 250.A N LEU 246.A O no hydrogen 3.059 N/A ARG 250.A NH1 ASP 67.A OD1 no hydrogen 3.356 N/A ARG 250.A NH1 ASP 67.A OD2 no hydrogen 3.067 N/A ARG 250.A NH2 ASP 67.A OD1 no hydrogen 2.988 N/A GLN 251.A N VAL 247.A O no hydrogen 3.013 N/A LEU 252.A N PRO 248.A O no hydrogen 2.714 N/A ALA 253.A N ILE 249.A O no hydrogen 3.032 N/A LEU 254.A N ARG 250.A O no hydrogen 3.091 N/A PHE 255.A N GLN 251.A O no hydrogen 2.743 N/A LYS 256.A N LEU 252.A O no hydrogen 3.030 N/A GLU 257.A N ALA 253.A O no hydrogen 3.024 N/A SER 259.A N LYS 256.A O no hydrogen 3.053 N/A VAL 260.A N GLU 257.A O no hydrogen 2.967 N/A ASP 262.A N GLN 258.A O no hydrogen 3.032 N/A ASN 263.A N SER 259.A O no hydrogen 2.965 N/A THR 269.A OG1 ALA 266.A O no hydrogen 2.900 N/A ALA 270.A N ALA 266.A O no hydrogen 2.858 N/A ILE 271.A N LYS 267.A O no hydrogen 3.145 N/A GLN 272.A N THR 268.A O no hydrogen 2.850 N/A GLN 272.A NE2 ASP 276.A OD1 no hydrogen 3.036 N/A ALA 273.A N THR 269.A O no hydrogen 2.888 N/A GLN 274.A N ALA 270.A O no hydrogen 3.245 N/A LEU 275.A N ILE 271.A O no hydrogen 2.935 N/A ASP 276.A N GLN 272.A O no hydrogen 2.923 N/A ASP 277.A N ALA 273.A O no hydrogen 3.023 N/A LEU 278.A N GLN 274.A O no hydrogen 3.225 N/A ASP 279.A N LEU 275.A O no hydrogen 2.856 N/A ARG 280.A N ASP 276.A O no hydrogen 2.861 N/A ARG 280.A NH1 ASP 277.A OD1 no hydrogen 3.041 N/A LEU 281.A N ASP 277.A O no hydrogen 3.155 N/A ASN 282.A N LEU 278.A O no hydrogen 2.816 N/A ASN 283.A N ASP 279.A O no hydrogen 2.915 N/A ALA 284.A N ARG 280.A O no hydrogen 3.017 N/A LEU 285.A N LEU 281.A O no hydrogen 2.915 N/A SER 286.A N ASN 282.A O no hydrogen 3.197 N/A SER 286.A OG ASN 282.A O no hydrogen 3.317 N/A ALA 287.A N ASN 283.A O no hydrogen 2.974 N/A SER 291.A OG LYS 292.A O no hydrogen 3.084 N/A