Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qeb_Z.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N ASP 172.A OD1 no hydrogen 2.654 N/A GLY 1.A N ASP 224.A OD1 no hydrogen 2.943 N/A LEU 5.A N ILE 2.A O no hydrogen 3.074 N/A PHE 8.A N GLY 4.A O no hydrogen 3.136 N/A ILE 9.A N LEU 5.A O no hydrogen 3.137 N/A ILE 9.A N LEU 6.A O no hydrogen 3.370 N/A LYS 10.A N GLN 7.A O no hydrogen 3.190 N/A ALA 12.A N ILE 9.A O no hydrogen 2.958 N/A SER 13.A N LYS 10.A O no hydrogen 3.255 N/A SER 13.A OG LYS 10.A O no hydrogen 2.740 N/A GLU 14.A N GLU 193.A O no hydrogen 2.831 N/A ILE 16.A N GLY 191.A O no hydrogen 3.104 N/A HIS 17.A NE2 PHE 188.A O no hydrogen 2.922 N/A VAL 18.A N GLY 189.A O no hydrogen 3.068 N/A ARG 19.A N HIS 17.A ND1 no hydrogen 3.189 N/A LYS 20.A N HIS 17.A O no hydrogen 3.027 N/A LYS 20.A NZ GLU 193.A OE1 no hydrogen 3.236 N/A LYS 20.A NZ GLU 193.A OE2 no hydrogen 2.897 N/A TYR 21.A N VAL 18.A O no hydrogen 2.926 N/A TYR 21.A OH GLU 193.A OE2 no hydrogen 3.023 N/A LYS 22.A N ARG 19.A O no hydrogen 3.004 N/A GLY 23.A N GLY 69.A O no hydrogen 2.650 N/A GLN 24.A N TYR 21.A O no hydrogen 3.197 N/A VAL 25.A N GLN 164.A OE1 no hydrogen 3.265 N/A VAL 26.A N LYS 71.A O no hydrogen 2.924 N/A ALA 27.A N ALA 165.A O no hydrogen 3.234 N/A VAL 28.A N ILE 73.A O no hydrogen 2.928 N/A ASP 29.A N ILE 167.A O no hydrogen 2.837 N/A THR 30.A N VAL 75.A O no hydrogen 3.231 N/A THR 30.A OG1 VAL 28.A O no hydrogen 3.408 N/A THR 30.A OG1 VAL 75.A O no hydrogen 2.959 N/A CYS 32.A N ASP 29.A O no hydrogen 2.914 N/A CYS 32.A SG THR 168.A OG1 no hydrogen 3.361 N/A TRP 33.A N THR 30.A O no hydrogen 2.942 N/A LEU 34.A N THR 30.A O no hydrogen 2.799 N/A HIS 35.A N TYR 31.A O no hydrogen 2.646 N/A GLY 37.A N TRP 33.A O no hydrogen 2.944 N/A ALA 38.A N LEU 34.A O no hydrogen 3.199 N/A ALA 38.A N HIS 35.A O no hydrogen 2.829 N/A ILE 39.A N LYS 36.A O no hydrogen 3.213 N/A CYS 41.A N ALA 38.A O no hydrogen 3.284 N/A CYS 41.A SG GLY 37.A O no hydrogen 3.403 N/A CYS 41.A SG ALA 38.A O no hydrogen 3.819 N/A ALA 42.A N ILE 39.A O no hydrogen 3.295 N/A LYS 44.A NZ PRO 50.A O no hydrogen 3.193 N/A LEU 45.A N CYS 41.A O no hydrogen 3.457 N/A ALA 46.A N ALA 42.A O no hydrogen 2.944 N/A LYS 47.A N LYS 44.A O no hydrogen 3.419 N/A LYS 47.A NZ GLU 43.A OE2 no hydrogen 2.910 N/A GLY 48.A N LEU 45.A O no hydrogen 3.476 N/A VAL 55.A N ASP 52.A O no hydrogen 3.119 N/A GLY 56.A N ASP 52.A O no hydrogen 3.393 N/A PHE 57.A N ARG 53.A O no hydrogen 3.136 N/A CYS 58.A N TYR 54.A O no hydrogen 3.364 N/A CYS 58.A SG TYR 54.A O no hydrogen 3.141 N/A MET 59.A N VAL 55.A O no hydrogen 3.411 N/A LYS 60.A N GLY 56.A O no hydrogen 2.855 N/A LYS 60.A NZ GLN 187.A OE1 no hydrogen 2.895 N/A PHE 61.A N CYS 58.A O no hydrogen 3.248 N/A VAL 62.A N CYS 58.A O no hydrogen 3.089 N/A ASN 63.A N MET 59.A O no hydrogen 2.801 N/A LEU 65.A N PHE 61.A O no hydrogen 3.018 N/A LEU 65.A N VAL 62.A O no hydrogen 2.945 N/A LEU 66.A N VAL 62.A O no hydrogen 2.950 N/A SER 67.A N ASN 63.A O no hydrogen 2.952 N/A SER 67.A OG ASN 63.A O no hydrogen 3.363 N/A SER 67.A OG MET 64.A O no hydrogen 2.694 N/A HIS 68.A N LEU 65.A O no hydrogen 3.223 N/A GLY 69.A N LEU 66.A O no hydrogen 2.834 N/A LYS 71.A N GLN 24.A O no hydrogen 3.023 N/A ILE 73.A N VAL 26.A O no hydrogen 2.835 N/A LEU 74.A N ASP 142.A O no hydrogen 2.994 N/A VAL 75.A N VAL 28.A O no hydrogen 3.046 N/A PHE 76.A N LEU 144.A O no hydrogen 3.038 N/A CYS 79.A N PRO 147.A O no hydrogen 2.944 N/A SER 83.A OG TYR 311.A O no hydrogen 3.414 N/A LYS 84.A N LEU 81.A O no hydrogen 3.038 N/A LYS 84.A NZ GLU 149.A OE2 no hydrogen 3.123 N/A LYS 84.A NZ ASP 224.A OD2 no hydrogen 3.203 N/A LYS 85.A NZ THR 80.A O no hydrogen 3.512 N/A ARG 89.A NH1 GLU 93.A OE1 no hydrogen 3.288 N/A SER 90.A N GLU 86.A O no hydrogen 3.152 N/A SER 90.A OG GLU 93.A OE2 no hydrogen 3.395 N/A ARG 91.A N GLU 88.A O no hydrogen 3.304 N/A ARG 92.A N ARG 89.A O no hydrogen 2.916 N/A GLU 93.A N ARG 89.A O no hydrogen 3.380 N/A ARG 94.A N SER 90.A O no hydrogen 2.984 N/A ARG 95.A N ARG 92.A O no hydrogen 3.147 N/A GLN 96.A N ARG 92.A O no hydrogen 3.143 N/A LEU 99.A N ARG 95.A O no hydrogen 2.805 N/A LEU 100.A N ALA 97.A O no hydrogen 3.215 N/A LYS 103.A N LEU 100.A O no hydrogen 3.185 N/A GLN 104.A N LEU 100.A O no hydrogen 2.984 N/A ARG 107.A N GLN 104.A O no hydrogen 2.940 N/A GLU 108.A N LEU 105.A O no hydrogen 3.272 N/A LYS 110.A NZ GLU 113.A OE1 no hydrogen 3.454 N/A LYS 110.A NZ GLU 113.A OE2 no hydrogen 3.398 N/A SER 112.A OG GLU 116.A OE2 no hydrogen 3.152 N/A ALA 114.A N VAL 111.A O no hydrogen 2.997 N/A ARG 115.A N VAL 111.A O no hydrogen 2.912 N/A GLU 116.A N SER 112.A O no hydrogen 3.208 N/A CYS 117.A SG LYS 101.A O no hydrogen 3.724 N/A CYS 117.A SG GLU 113.A O no hydrogen 3.389 N/A PHE 118.A N ALA 114.A O no hydrogen 3.380 N/A THR 119.A OG1 ARG 115.A O no hydrogen 3.436 N/A ARG 120.A N GLU 116.A O no hydrogen 3.216 N/A ARG 120.A N CYS 117.A O no hydrogen 3.246 N/A SER 121.A N PHE 118.A O no hydrogen 3.063 N/A SER 121.A OG ARG 95.A O no hydrogen 2.774 N/A SER 121.A OG SER 121.A O no hydrogen 2.645 N/A HIS 126.A NE2 GLY 78.A O no hydrogen 3.175 N/A ALA 129.A N THR 125.A O no hydrogen 3.311 N/A HIS 130.A N HIS 126.A O no hydrogen 3.052 N/A LYS 131.A N ALA 127.A O no hydrogen 3.427 N/A LYS 131.A NZ ASP 52.A OD1 no hydrogen 3.227 N/A VAL 132.A N MET 128.A O no hydrogen 3.386 N/A ILE 133.A N ALA 129.A O no hydrogen 3.025 N/A LYS 134.A N HIS 130.A O no hydrogen 2.951 N/A LYS 134.A NZ ASP 338.A OD1 no hydrogen 2.824 N/A LYS 134.A NZ ASP 338.A OD2 no hydrogen 3.005 N/A ALA 135.A N LYS 131.A O no hydrogen 3.161 N/A ALA 136.A N VAL 132.A O no hydrogen 3.112 N/A ARG 137.A N ILE 133.A O no hydrogen 2.927 N/A ARG 137.A NH2 CYS 143.A O no hydrogen 3.490 N/A SER 138.A N LYS 134.A O no hydrogen 3.323 N/A SER 138.A OG ALA 135.A O no hydrogen 2.727 N/A GLN 139.A N ALA 136.A O no hydrogen 3.092 N/A GLY 140.A N ARG 137.A O no hydrogen 2.981 N/A VAL 141.A N ALA 136.A O no hydrogen 2.928 N/A CYS 143.A SG ILE 133.A O no hydrogen 3.972 N/A LEU 144.A N LEU 74.A O no hydrogen 2.811 N/A VAL 145.A N ALA 325.A O no hydrogen 2.788 N/A ALA 146.A N PHE 76.A O no hydrogen 2.681 N/A TYR 148.A OH GLN 314.A O no hydrogen 2.995 N/A ALA 150.A N ASP 77.A OD1 no hydrogen 2.980 N/A GLN 153.A N GLU 149.A O no hydrogen 3.389 N/A GLN 153.A NE2 PHE 287.A O no hydrogen 3.137 N/A LEU 154.A N ALA 150.A O no hydrogen 2.715 N/A ALA 155.A N ASP 151.A O no hydrogen 2.964 N/A TYR 156.A N ALA 152.A O no hydrogen 3.020 N/A LEU 157.A N GLN 153.A O no hydrogen 3.132 N/A ASN 158.A N LEU 154.A O no hydrogen 3.177 N/A ASN 158.A ND2 VAL 163.A O no hydrogen 3.033 N/A LYS 159.A N ALA 155.A O no hydrogen 2.894 N/A LYS 159.A NZ GLY 177.A O no hydrogen 3.378 N/A LYS 159.A NZ GLU 211.A OE2 no hydrogen 3.172 N/A ALA 160.A N TYR 156.A O no hydrogen 2.735 N/A GLY 161.A N ASN 158.A O no hydrogen 3.109 N/A VAL 163.A N LEU 157.A O no hydrogen 3.075 N/A GLN 164.A N VAL 25.A O no hydrogen 3.010 N/A GLN 164.A NE2 GLY 161.A O no hydrogen 3.061 N/A ILE 166.A N LYS 180.A O no hydrogen 2.946 N/A ILE 167.A N ALA 27.A O no hydrogen 2.971 N/A THR 168.A N ILE 182.A O no hydrogen 3.025 N/A THR 168.A OG1 ASP 29.A OD2 no hydrogen 3.171 N/A ASP 170.A N THR 168.A OG1 no hydrogen 2.914 N/A ASP 172.A N ASP 170.A OD1 no hydrogen 3.311 N/A LEU 174.A N SER 171.A O no hydrogen 2.998 N/A PHE 176.A N ASP 172.A O no hydrogen 3.007 N/A GLY 177.A N LEU 174.A O no hydrogen 3.057 N/A CYS 178.A N LEU 173.A O no hydrogen 3.248 N/A CYS 178.A SG LEU 173.A O no hydrogen 3.141 N/A LYS 179.A N ASN 158.A OD1 no hydrogen 2.903 N/A LYS 180.A NZ GLU 193.A OE1 no hydrogen 3.283 N/A LYS 180.A NZ ASP 195.A OD2 no hydrogen 3.003 N/A VAL 181.A N ILE 194.A O no hydrogen 3.131 N/A ILE 182.A N ILE 166.A O no hydrogen 2.808 N/A LEU 183.A N LEU 192.A O no hydrogen 2.856 N/A LYS 184.A N GLU 169.A OE1 no hydrogen 3.019 N/A ASP 186.A N ASN 190.A O no hydrogen 3.098 N/A PHE 188.A N ASP 186.A OD2 no hydrogen 2.912 N/A GLY 189.A N ASP 186.A O no hydrogen 3.240 N/A GLY 191.A N ILE 16.A O no hydrogen 3.299 N/A LEU 192.A N LEU 183.A O no hydrogen 2.753 N/A GLU 193.A N GLU 14.A O no hydrogen 3.022 N/A ILE 194.A N VAL 181.A O no hydrogen 2.863 N/A GLN 196.A N LYS 179.A O no hydrogen 2.789 N/A ALA 197.A N ASP 195.A OD1 no hydrogen 3.244 N/A ARG 198.A N ASP 195.A O no hydrogen 2.981 N/A LEU 199.A N GLN 196.A O no hydrogen 3.138 N/A CYS 202.A N LEU 199.A O no hydrogen 3.088 N/A CYS 202.A SG LEU 199.A O no hydrogen 3.598 N/A GLN 204.A NE2 GLU 11.A OE2 no hydrogen 3.033 N/A LEU 205.A N CYS 202.A O no hydrogen 3.087 N/A LYS 213.A NZ ASP 207.A OD2 no hydrogen 2.936 N/A PHE 214.A N THR 210.A O no hydrogen 2.886 N/A ARG 215.A N GLU 211.A O no hydrogen 3.111 N/A ARG 215.A NH1 ASN 278.A OD1 no hydrogen 2.802 N/A TYR 216.A N GLU 212.A O no hydrogen 3.149 N/A TYR 216.A OH GLU 212.A OE2 no hydrogen 3.116 N/A MET 217.A N LYS 213.A O no hydrogen 2.909 N/A CYS 218.A N PHE 214.A O no hydrogen 3.209 N/A CYS 218.A SG PHE 214.A O no hydrogen 3.293 N/A ILE 219.A N ARG 215.A O no hydrogen 3.275 N/A LEU 220.A N TYR 216.A O no hydrogen 3.129 N/A SER 221.A N MET 217.A O no hydrogen 2.894 N/A SER 221.A OG MET 217.A O no hydrogen 3.334 N/A SER 221.A OG CYS 218.A O no hydrogen 2.718 N/A GLY 222.A N ILE 219.A O no hydrogen 3.094 N/A CYS 223.A N LEU 226.A O no hydrogen 2.887 N/A CYS 223.A SG LEU 226.A O no hydrogen 3.413 N/A TYR 225.A OH GLU 149.A OE1 no hydrogen 2.866 N/A SER 228.A OG SER 221.A O no hydrogen 3.473 N/A SER 228.A OG ILE 232.A O no hydrogen 2.874 N/A ALA 237.A N GLY 233.A O no hydrogen 2.955 N/A CYS 238.A N LEU 234.A O no hydrogen 2.694 N/A CYS 238.A SG GLN 204.A O no hydrogen 3.334 N/A CYS 238.A SG LEU 205.A O no hydrogen 3.386 N/A LYS 239.A N ALA 235.A O no hydrogen 3.058 N/A VAL 240.A N LYS 236.A O no hydrogen 3.095 N/A LEU 241.A N ALA 237.A O no hydrogen 3.326 N/A ARG 242.A N CYS 238.A O no hydrogen 2.850 N/A LEU 243.A N LYS 239.A O no hydrogen 2.971 N/A ALA 244.A N VAL 240.A O no hydrogen 3.201 N/A ASP 248.A N ASN 246.A OD1 no hydrogen 3.322 N/A LYS 251.A N ASP 248.A OD1 no hydrogen 3.202 N/A VAL 252.A N ASP 248.A O no hydrogen 3.391 N/A ILE 253.A N ILE 249.A O no hydrogen 2.970 N/A LYS 254.A N VAL 250.A O no hydrogen 3.259 N/A LYS 255.A N LYS 251.A O no hydrogen 3.289 N/A ILE 256.A N ILE 253.A O no hydrogen 3.317 N/A TYR 259.A N LYS 255.A O no hydrogen 3.138 N/A LEU 260.A N GLY 257.A O no hydrogen 3.371 N/A MET 262.A N GLY 257.A O no hydrogen 3.118 N/A TYR 270.A N PRO 267.A O no hydrogen 3.084 N/A ASN 272.A N GLU 268.A O no hydrogen 3.304 N/A GLY 273.A N ASP 269.A O no hydrogen 3.028 N/A PHE 274.A N TYR 270.A O no hydrogen 2.769 N/A ARG 276.A N ASN 272.A O no hydrogen 3.156 N/A ALA 277.A N GLY 273.A O no hydrogen 2.820 N/A ASN 278.A N PHE 274.A O no hydrogen 2.923 N/A ASN 279.A N ILE 275.A O no hydrogen 2.874 N/A ASN 279.A ND2 TYR 311.A OH no hydrogen 3.049 N/A THR 280.A N ARG 276.A O no hydrogen 2.817 N/A THR 280.A OG1 ARG 276.A O no hydrogen 2.731 N/A PHE 281.A N ALA 277.A O no hydrogen 3.217 N/A LEU 282.A N ASN 278.A O no hydrogen 3.131 N/A TYR 283.A N ASN 279.A O no hydrogen 2.748 N/A GLN 284.A NE2 TYR 225.A OH no hydrogen 3.316 N/A GLN 284.A NE2 THR 280.A O no hydrogen 3.459 N/A LEU 285.A N ALA 312.A O no hydrogen 3.286 N/A VAL 286.A N ILE 295.A O no hydrogen 2.792 N/A ASP 288.A N LYS 293.A O no hydrogen 2.942 N/A ILE 290.A N ASP 288.A OD1 no hydrogen 2.869 N/A LYS 291.A N ASP 288.A OD1 no hydrogen 3.244 N/A ARG 292.A NH1 ASP 343.A OD2 no hydrogen 2.947 N/A LEU 294.A N ASP 318.A OD1 no hydrogen 3.326 N/A LEU 297.A N GLN 284.A O no hydrogen 2.907 N/A ASN 298.A ND2 LEU 282.A O no hydrogen 2.963 N/A TYR 300.A OH TYR 315.A OH no hydrogen 2.914 N/A GLU 301.A N TYR 283.A OH no hydrogen 3.330 N/A VAL 304.A N ASP 302.A O no hydrogen 3.099 N/A GLU 307.A N ASP 305.A OD1 no hydrogen 3.071 N/A THR 308.A N ASP 305.A O no hydrogen 2.941 N/A THR 308.A OG1 ASP 305.A O no hydrogen 2.725 N/A ALA 312.A N LEU 309.A O no hydrogen 3.322 N/A GLY 313.A N SER 310.A O no hydrogen 2.894 N/A GLN 314.A NE2 TYR 315.A O no hydrogen 3.363 N/A TYR 315.A OH TYR 300.A OH no hydrogen 2.914 N/A SER 319.A N ASP 317.A OD1 no hydrogen 3.086 N/A SER 319.A OG ASP 317.A OD1 no hydrogen 3.137 N/A ILE 320.A N ASP 317.A O no hydrogen 2.790 N/A ALA 321.A N ASP 317.A O no hydrogen 3.020 N/A LEU 322.A N ASP 318.A O no hydrogen 2.923 N/A ILE 324.A N ILE 320.A O no hydrogen 3.088 N/A ALA 325.A N ALA 321.A O no hydrogen 2.962 N/A LEU 326.A N LEU 322.A O no hydrogen 3.049 N/A GLY 327.A N ILE 324.A O no hydrogen 3.081 N/A ASN 328.A N GLN 323.A O no hydrogen 2.962 N/A ASN 328.A ND2 GLN 323.A OE1 no hydrogen 3.546 N/A ASN 328.A ND2 TYR 340.A O no hydrogen 2.883 N/A LYS 329.A N GLN 323.A O no hydrogen 3.395 N/A ASP 330.A N GLU 335.A O no hydrogen 2.830 N/A ASN 332.A N ASP 330.A OD1 no hydrogen 2.851 N/A ILE 337.A N ASN 328.A O no hydrogen 2.727 N/A THR 344.A N ASN 341.A OD1 no hydrogen 3.313 N/A