Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8j0i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 ILE 51.A O no hydrogen 2.756 N/A PHE 4.A N ILE 12.A O no hydrogen 2.842 N/A LEU 6.A N ASN 10.A O no hydrogen 3.003 N/A ASN 8.A ND2 TYR 141.A OH no hydrogen 3.050 N/A ASN 8.A ND2 ASN 148.A OD1 no hydrogen 3.062 N/A GLY 9.A N LEU 6.A O no hydrogen 2.810 N/A ASN 10.A N ASN 8.A OD1 no hydrogen 3.055 N/A ASN 10.A ND2 ASN 148.A OD1 no hydrogen 2.944 N/A ILE 12.A N PHE 4.A O no hydrogen 2.970 N/A ALA 14.A N LYS 2.A O no hydrogen 3.002 N/A ALA 16.A N PRO 250.A O no hydrogen 3.083 N/A VAL 17.A N HIS 53.A O no hydrogen 3.150 N/A GLY 19.A N THR 253.A OG1 no hydrogen 3.219 N/A THR 22.A OG1 TRP 24.A O no hydrogen 1.880 N/A LYS 26.A NZ LYS 61.A O no hydrogen 3.011 N/A LYS 26.A NZ GLU 65.A OE1 no hydrogen 2.791 N/A LYS 26.A NZ GLU 65.A OE2 no hydrogen 3.112 N/A THR 29.A N THR 32.A OG1 no hydrogen 3.002 N/A THR 29.A OG1 GLU 27.A OE1 no hydrogen 3.379 N/A THR 32.A N THR 29.A O no hydrogen 2.734 N/A THR 32.A OG1 GLU 27.A O no hydrogen 3.315 N/A THR 32.A OG1 THR 29.A O no hydrogen 2.547 N/A PHE 33.A N ASP 30.A O no hydrogen 3.377 N/A SER 34.A N GLU 65.A OE1 no hydrogen 3.027 N/A GLN 35.A NE2 ASP 39.A OD1 no hydrogen 2.763 N/A LEU 37.A N SER 34.A O no hydrogen 3.272 N/A THR 38.A N SER 34.A O no hydrogen 3.310 N/A THR 38.A OG1 GLU 65.A O no hydrogen 2.661 N/A ASP 39.A N GLN 35.A O no hydrogen 2.940 N/A ILE 40.A N GLU 36.A O no hydrogen 3.213 N/A VAL 41.A N LEU 37.A O no hydrogen 3.039 N/A LYS 42.A N THR 38.A O no hydrogen 3.027 N/A LYS 42.A NZ GLU 72.A OE1 no hydrogen 3.484 N/A LEU 43.A N ASP 39.A O no hydrogen 2.855 N/A SER 44.A N ILE 40.A O no hydrogen 2.946 N/A SER 44.A OG ILE 40.A O no hydrogen 2.368 N/A LEU 45.A N VAL 41.A O no hydrogen 2.994 N/A ASP 46.A N LYS 42.A O no hydrogen 2.876 N/A THR 47.A N SER 44.A O no hydrogen 3.283 N/A THR 47.A OG1 LEU 43.A O no hydrogen 2.727 N/A VAL 48.A N SER 44.A O no hydrogen 2.842 N/A ILE 51.A N GLN 1.A OE1 no hydrogen 2.678 N/A VAL 52.A N GLU 79.A O no hydrogen 2.986 N/A HIS 53.A ND1 PRO 13.A O no hydrogen 3.125 N/A HIS 53.A NE2 THR 83.A OG1 no hydrogen 3.163 N/A ILE 54.A N PHE 81.A O no hydrogen 2.742 N/A ASP 55.A N VAL 18.A O no hydrogen 2.915 N/A ALA 56.A N THR 83.A O no hydrogen 2.712 N/A GLU 58.A N LYS 85.A O no hydrogen 3.034 N/A TYR 60.A N ALA 57.A O no hydrogen 3.076 N/A LYS 61.A N GLU 58.A O no hydrogen 3.208 N/A THR 62.A OG1 THR 20.A O no hydrogen 2.454 N/A TYR 63.A OH ASP 84.A OD1 no hydrogen 2.753 N/A TYR 63.A OH ASP 84.A OD2 no hydrogen 2.695 N/A GLU 65.A N GLU 65.A OE2 no hydrogen 2.919 N/A LEU 66.A N THR 62.A O no hydrogen 3.123 N/A GLY 67.A N TYR 63.A O no hydrogen 2.794 N/A ALA 68.A N PRO 64.A O no hydrogen 2.944 N/A ALA 69.A N GLU 65.A O no hydrogen 3.193 N/A LEU 70.A N LEU 66.A O no hydrogen 2.839 N/A LYS 71.A N GLY 67.A O no hydrogen 3.065 N/A GLU 72.A N ALA 68.A O no hydrogen 3.165 N/A GLU 72.A N ALA 69.A O no hydrogen 3.165 N/A THR 73.A N ALA 69.A O no hydrogen 2.984 N/A THR 73.A OG1 ASP 46.A OD1 no hydrogen 2.411 N/A LYS 75.A N THR 73.A OG1 no hydrogen 3.224 N/A LYS 75.A NZ GLY 50.A O no hydrogen 2.287 N/A LYS 75.A NZ GLU 79.A OE2 no hydrogen 3.439 N/A ARG 77.A NH1 ARG 77.A O no hydrogen 3.124 N/A ARG 77.A NH1 ASP 113.A OD2 no hydrogen 3.123 N/A ARG 77.A NH2 TYR 111.A O no hydrogen 2.681 N/A ARG 77.A NH2 ASP 113.A OD2 no hydrogen 3.190 N/A GLU 78.A N GLU 78.A OE2 no hydrogen 2.842 N/A GLU 79.A N PRO 76.A O no hydrogen 2.961 N/A ILE 80.A N ARG 77.A O no hydrogen 2.903 N/A PHE 81.A N VAL 52.A O no hydrogen 2.879 N/A ILE 82.A N ASP 113.A OD2 no hydrogen 2.782 N/A THR 83.A N ILE 54.A O no hydrogen 2.870 N/A THR 83.A OG1 HIS 53.A NE2 no hydrogen 3.163 N/A ASP 84.A N LEU 114.A O no hydrogen 2.883 N/A LYS 85.A N ASP 84.A OD1 no hydrogen 2.659 N/A LYS 85.A NZ ASP 55.A OD1 no hydrogen 3.402 N/A LYS 85.A NZ ASP 55.A OD2 no hydrogen 2.753 N/A LYS 85.A NZ ALA 56.A O no hydrogen 3.215 N/A PHE 86.A N LEU 116.A O no hydrogen 2.861 N/A SER 87.A N GLU 58.A OE2 no hydrogen 3.135 N/A SER 87.A OG HIS 90.A O no hydrogen 2.591 N/A SER 88.A OG SER 119.A O no hydrogen 2.554 N/A LYS 91.A N ASP 123.A OD2 no hydrogen 3.020 N/A LYS 91.A NZ GLU 94.A OE2 no hydrogen 2.398 N/A LYS 91.A NZ ASP 125.A O no hydrogen 2.936 N/A SER 93.A OG GLU 58.A OE1 no hydrogen 2.602 N/A LYS 97.A N GLN 136.A OE1 no hydrogen 3.185 N/A SER 98.A OG ASP 95.A OD1 no hydrogen 3.012 N/A ALA 99.A N ASP 95.A O no hydrogen 2.964 N/A LEU 100.A N PRO 96.A O no hydrogen 2.908 N/A GLU 101.A N LYS 97.A O no hydrogen 3.032 N/A THR 102.A N SER 98.A O no hydrogen 3.019 N/A THR 102.A OG1 SER 98.A O no hydrogen 3.077 N/A ALA 103.A N ALA 99.A O no hydrogen 2.899 N/A LEU 104.A N LEU 100.A O no hydrogen 2.777 N/A ASN 105.A N GLU 101.A O no hydrogen 3.248 N/A LYS 106.A N THR 102.A O no hydrogen 3.043 N/A LYS 106.A NZ GLU 28.A OE1 no hydrogen 3.129 N/A LYS 106.A NZ GLU 28.A OE2 no hydrogen 2.420 N/A LEU 107.A N ALA 103.A O no hydrogen 2.923 N/A GLY 108.A N LEU 104.A O no hydrogen 2.846 N/A VAL 109.A N LEU 104.A O no hydrogen 3.211 N/A VAL 112.A N LYS 145.A O no hydrogen 2.968 N/A ASP 113.A N ILE 82.A O no hydrogen 2.867 N/A LEU 114.A N ILE 82.A O no hydrogen 3.098 N/A TYR 115.A N ASN 148.A O no hydrogen 2.974 N/A TYR 115.A OH PRO 96.A O no hydrogen 3.202 N/A LEU 116.A N ASP 84.A O no hydrogen 2.991 N/A ILE 117.A N GLY 150.A O no hydrogen 3.208 N/A HIS 118.A N PHE 86.A O no hydrogen 3.128 N/A SER 119.A OG PHE 121.A O no hydrogen 3.403 N/A PHE 121.A N SER 119.A OG no hydrogen 3.212 N/A ASP 123.A N SER 88.A O no hydrogen 2.818 N/A ASP 125.A N ASP 123.A OD1 no hydrogen 2.780 N/A LEU 126.A N ASP 123.A O no hydrogen 2.957 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.589 N/A THR 132.A N ASP 129.A OD1 no hydrogen 2.947 N/A THR 132.A OG1 ASP 129.A OD1 no hydrogen 2.586 N/A ALA 133.A N ASP 129.A O no hydrogen 2.880 N/A TRP 134.A N LEU 130.A O no hydrogen 2.936 N/A TRP 134.A NE1 GLU 138.A OE1 no hydrogen 3.136 N/A TRP 134.A NE1 ILE 168.A O no hydrogen 2.995 N/A LYS 135.A N GLU 131.A O no hydrogen 3.264 N/A LYS 135.A NZ GLU 131.A O no hydrogen 3.153 N/A GLN 136.A N THR 132.A O no hydrogen 3.146 N/A GLN 136.A NE2 ASP 95.A OD2 no hydrogen 2.696 N/A LEU 137.A N ALA 133.A O no hydrogen 3.137 N/A GLU 138.A N TRP 134.A O no hydrogen 2.932 N/A GLU 139.A N LYS 135.A O no hydrogen 3.102 N/A LEU 140.A N GLN 136.A O no hydrogen 2.994 N/A TYR 141.A N LEU 137.A O no hydrogen 2.904 N/A LYS 142.A N GLU 138.A O no hydrogen 3.067 N/A LYS 142.A NZ GLU 167.A OE1 no hydrogen 3.031 N/A LYS 142.A NZ GLU 167.A OE2 no hydrogen 3.083 N/A SER 143.A N GLU 139.A O no hydrogen 2.865 N/A GLY 144.A N TYR 141.A O no hydrogen 3.188 N/A LYS 145.A N LEU 140.A O no hydrogen 2.961 N/A ALA 146.A N LEU 140.A O no hydrogen 3.057 N/A LYS 147.A N VAL 112.A O no hydrogen 3.045 N/A LYS 147.A NZ GLY 144.A O no hydrogen 3.359 N/A ASN 148.A ND2 ASP 113.A O no hydrogen 2.892 N/A ILE 149.A N GLN 171.A OE1 no hydrogen 2.827 N/A GLY 150.A N TYR 115.A O no hydrogen 2.923 N/A VAL 151.A N VAL 172.A O no hydrogen 2.963 N/A SER 152.A OG HIS 118.A O no hydrogen 3.290 N/A SER 152.A OG GLN 174.A O no hydrogen 3.271 N/A ASN 153.A N GLN 174.A O no hydrogen 2.940 N/A ASN 153.A ND2 HIS 118.A O no hydrogen 3.258 N/A PHE 154.A N ASN 173.A OD1 no hydrogen 3.436 N/A THR 155.A N ASP 158.A OD2 no hydrogen 3.217 N/A ASP 158.A N THR 155.A OG1 no hydrogen 3.034 N/A LEU 159.A N THR 155.A O no hydrogen 2.955 N/A LYS 160.A N VAL 156.A O no hydrogen 2.956 N/A LYS 161.A N GLU 157.A O no hydrogen 3.096 N/A VAL 162.A N ASP 158.A O no hydrogen 3.276 N/A LEU 163.A N LEU 159.A O no hydrogen 2.734 N/A ALA 164.A N LYS 160.A O no hydrogen 3.002 N/A ILE 165.A N VAL 162.A O no hydrogen 3.106 N/A ALA 166.A N VAL 162.A O no hydrogen 2.855 N/A ILE 168.A N GLU 138.A OE1 no hydrogen 2.340 N/A GLN 171.A N ILE 149.A O no hydrogen 3.006 N/A ASN 173.A N LEU 198.A O no hydrogen 2.902 N/A ASN 173.A ND2 PHE 154.A O no hydrogen 3.293 N/A GLN 174.A N VAL 151.A O no hydrogen 2.990 N/A GLN 174.A NE2 ASP 55.A OD1 no hydrogen 2.970 N/A GLN 174.A NE2 GLU 200.A OE2 no hydrogen 3.233 N/A ILE 175.A N GLU 200.A O no hydrogen 2.865 N/A PHE 177.A N TYR 202.A O no hydrogen 3.410 N/A SER 178.A N LEU 181.A O no hydrogen 3.385 N/A PHE 180.A N SER 178.A OG no hydrogen 2.918 N/A LEU 181.A N SER 178.A O no hydrogen 2.999 N/A GLN 182.A N ALA 304.A O no hydrogen 3.204 N/A GLN 182.A N GLN 305.A OE1 no hydrogen 3.276 N/A GLN 182.A NE2 PRO 179.A O no hydrogen 2.828 N/A GLN 182.A NE2 THR 280.A O no hydrogen 3.394 N/A ASN 183.A N ALA 304.A O no hydrogen 2.947 N/A GLN 184.A NE2 ASN 153.A OD1 no hydrogen 3.060 N/A ILE 188.A N THR 185.A O no hydrogen 3.325 N/A VAL 189.A N ASN 183.A OD1 no hydrogen 2.745 N/A PHE 191.A N GLY 187.A O no hydrogen 3.065 N/A SER 192.A N ILE 188.A O no hydrogen 2.935 N/A SER 192.A OG ILE 188.A O no hydrogen 3.216 N/A GLN 193.A N VAL 189.A O no hydrogen 3.043 N/A GLN 193.A NE2 ARG 246.A O no hydrogen 3.116 N/A LYS 194.A N GLU 190.A O no hydrogen 3.015 N/A ASN 195.A N SER 192.A O no hydrogen 3.016 N/A ASN 195.A ND2 PHE 191.A O no hydrogen 3.097 N/A ASP 196.A N GLN 193.A O no hydrogen 3.242 N/A ILE 197.A N SER 192.A O no hydrogen 2.992 N/A LEU 198.A N GLN 171.A O no hydrogen 3.056 N/A GLU 200.A N ASN 173.A O no hydrogen 3.328 N/A ALA 201.A N LEU 249.A O no hydrogen 2.839 N/A TYR 202.A N ILE 175.A O no hydrogen 2.763 N/A TYR 202.A OH ASN 153.A OD1 no hydrogen 2.440 N/A GLY 206.A N SER 203.A O no hydrogen 3.464 N/A LEU 208.A N LEU 205.A O no hydrogen 2.848 N/A GLN 209.A N LEU 205.A O no hydrogen 3.034 N/A GLN 209.A N GLY 206.A O no hydrogen 3.004 N/A LYS 210.A N GLY 206.A O no hydrogen 3.211 N/A GLN 217.A N ASP 214.A O no hydrogen 3.066 N/A GLN 218.A N ALA 215.A O no hydrogen 3.080 N/A TYR 221.A N GLN 218.A O no hydrogen 3.043 N/A TYR 221.A OH PRO 207.A O no hydrogen 2.982 N/A GLN 222.A N GLN 218.A O no hydrogen 3.043 N/A GLN 222.A NE2 ASP 216.A O no hydrogen 2.662 N/A TYR 223.A N PRO 219.A O no hydrogen 2.885 N/A LEU 224.A N PHE 220.A O no hydrogen 3.190 N/A LYS 225.A N TYR 221.A O no hydrogen 3.064 N/A GLU 226.A N GLN 222.A O no hydrogen 2.997 N/A LEU 227.A N TYR 223.A O no hydrogen 2.978 N/A SER 228.A N LEU 224.A O no hydrogen 2.956 N/A SER 228.A OG LYS 233.A O no hydrogen 2.426 N/A GLU 229.A N LYS 225.A O no hydrogen 3.043 N/A LYS 230.A N GLU 226.A O no hydrogen 2.975 N/A LYS 230.A NZ TYR 231.A OH no hydrogen 2.995 N/A LYS 230.A NZ GLU 275.A OE1 no hydrogen 2.557 N/A TYR 231.A N LEU 227.A O no hydrogen 2.980 N/A TYR 231.A OH GLU 275.A OE2 no hydrogen 2.884 N/A LYS 233.A N SER 228.A O no hydrogen 3.204 N/A LYS 233.A NZ SER 268.A OG no hydrogen 2.973 N/A THR 234.A N GLN 237.A OE1 no hydrogen 3.185 N/A GLN 237.A N THR 234.A OG1 no hydrogen 3.072 N/A GLN 237.A NE2 GLN 262.A O no hydrogen 2.897 N/A VAL 238.A N THR 234.A O no hydrogen 3.096 N/A LEU 239.A N GLU 235.A O no hydrogen 3.097 N/A LEU 240.A N ALA 236.A O no hydrogen 2.930 N/A LEU 241.A N GLN 237.A O no hydrogen 2.925 N/A TRP 242.A N VAL 238.A O no hydrogen 2.879 N/A TRP 242.A NE1 VAL 276.A O no hydrogen 3.185 N/A TRP 242.A NE1 THR 280.A OG1 no hydrogen 3.237 N/A VAL 243.A N LEU 239.A O no hydrogen 3.006 N/A TYR 244.A N LEU 240.A O no hydrogen 3.200 N/A LYS 245.A N LEU 241.A O no hydrogen 2.814 N/A LYS 245.A NZ ASP 270.A OD1 no hydrogen 3.121 N/A ARG 246.A N TRP 242.A O no hydrogen 3.058 N/A ARG 246.A N VAL 243.A O no hydrogen 2.924 N/A ARG 246.A NH1 GLN 182.A OE1 no hydrogen 3.203 N/A ARG 246.A NH1 THR 280.A OG1 no hydrogen 3.296 N/A GLY 247.A N TYR 244.A O no hydrogen 2.876 N/A ILE 248.A N VAL 243.A O no hydrogen 3.207 N/A LEU 249.A N LEU 199.A O no hydrogen 2.902 N/A VAL 251.A N ALA 201.A O no hydrogen 2.802 N/A THR 252.A N ALA 16.A O no hydrogen 2.830 N/A THR 252.A OG1 ALA 16.A O no hydrogen 3.528 N/A THR 253.A OG1 SER 254.A O no hydrogen 3.432 N/A SER 254.A OG LYS 256.A O no hydrogen 2.812 N/A ILE 260.A N LYS 256.A O no hydrogen 3.126 N/A LYS 261.A N ILE 257.A O no hydrogen 2.923 N/A GLN 262.A N GLU 258.A O no hydrogen 3.010 N/A ALA 263.A N ARG 259.A O no hydrogen 2.951 N/A GLN 264.A N ILE 260.A O no hydrogen 3.204 N/A GLN 264.A NE2 PRO 49.A O no hydrogen 3.119 N/A GLN 264.A NE2 ILE 51.A O no hydrogen 3.169 N/A ASP 265.A N GLN 262.A O no hydrogen 3.220 N/A SER 268.A N ASP 265.A O no hydrogen 2.952 N/A SER 268.A OG ASP 265.A O no hydrogen 2.552 N/A SER 268.A OG ASP 265.A OD2 no hydrogen 2.859 N/A THR 272.A N GLU 275.A OE2 no hydrogen 2.757 N/A GLU 275.A N THR 272.A OG1 no hydrogen 3.226 N/A VAL 276.A N THR 272.A O no hydrogen 3.024 N/A LYS 277.A N GLU 273.A O no hydrogen 3.135 N/A LYS 278.A N GLU 274.A O no hydrogen 2.974 N/A ILE 279.A N GLU 275.A O no hydrogen 3.109 N/A THR 280.A N VAL 276.A O no hydrogen 3.194 N/A THR 280.A OG1 VAL 276.A O no hydrogen 3.212 N/A ASP 281.A N LYS 277.A O no hydrogen 2.912 N/A LEU 282.A N LYS 278.A O no hydrogen 2.875 N/A GLY 283.A N ILE 279.A O no hydrogen 2.849 N/A LEU 284.A N THR 280.A O no hydrogen 2.773 N/A GLN 285.A N ASP 281.A O no hydrogen 3.196 N/A HIS 286.A N GLY 283.A O no hydrogen 2.864 N/A HIS 286.A ND1 GLU 287.A O no hydrogen 3.096 N/A VAL 289.A N PHE 180.A O no hydrogen 2.921 N/A ARG 290.A NE ASN 301.A OD1 no hydrogen 2.770 N/A ARG 290.A NH1 GLN 184.A O no hydrogen 3.101 N/A ARG 290.A NH2 GLN 184.A O no hydrogen 2.524 N/A ARG 290.A NH2 ASN 301.A OD1 no hydrogen 3.374 N/A LEU 291.A N GLU 176.A OE1 no hydrogen 2.667 N/A TYR 292.A N GLU 176.A OE2 no hydrogen 3.164 N/A PHE 296.A N TRP 293.A O no hydrogen 3.117 N/A TYR 297.A N TRP 293.A O no hydrogen 2.944 N/A TYR 297.A OH ASN 153.A O no hydrogen 2.480 N/A THR 298.A N VAL 294.A O no hydrogen 3.315 N/A THR 298.A OG1 VAL 294.A O no hydrogen 3.392 N/A LYS 299.A NZ TYR 300.A OH no hydrogen 3.196 N/A TYR 300.A N TYR 297.A O no hydrogen 2.906 N/A ASN 301.A N THR 298.A O no hydrogen 2.930 N/A GLU 303.A N TYR 300.A O no hydrogen 3.069 N/A ALA 304.A N ASN 301.A O no hydrogen 3.048 N/A GLN 305.A NE2 PRO 179.A O no hydrogen 3.450 N/A GLN 305.A NE2 HIS 286.A O no hydrogen 3.080 N/A LYS 306.A N GLU 303.A O no hydrogen 3.389 N/A