Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8i9z_CE.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG GLU 2.A OE1 no hydrogen 3.497 N/A LEU 6.A N GLU 2.A O no hydrogen 3.021 N/A SER 9.A N GLU 61.A OE2 no hydrogen 2.885 N/A SER 9.A OG THR 12.A OG1 no hydrogen 2.349 N/A SER 9.A OG GLU 61.A OE1 no hydrogen 2.891 N/A SER 9.A OG GLU 61.A OE2 no hydrogen 3.255 N/A THR 12.A OG1 SER 9.A O no hydrogen 3.264 N/A THR 12.A OG1 SER 9.A OG no hydrogen 2.349 N/A THR 12.A OG1 GLU 61.A OE1 no hydrogen 2.991 N/A THR 12.A OG1 GLU 61.A OE2 no hydrogen 3.340 N/A THR 13.A N SER 9.A O no hydrogen 3.043 N/A THR 13.A OG1 SER 9.A O no hydrogen 2.669 N/A LYS 14.A N GLU 10.A O no hydrogen 3.110 N/A LYS 14.A NZ LYS 14.A O no hydrogen 3.451 N/A LYS 14.A NZ GLU 18.A OE2 no hydrogen 3.441 N/A ALA 15.A N LYS 11.A O no hydrogen 3.060 N/A ALA 15.A N THR 12.A O no hydrogen 3.232 N/A ILE 16.A N THR 12.A O no hydrogen 3.112 N/A ALA 17.A N THR 13.A O no hydrogen 3.330 N/A GLU 18.A N LYS 14.A O no hydrogen 3.212 N/A MET 19.A N ALA 15.A O no hydrogen 3.185 N/A GLY 20.A N ALA 17.A O no hydrogen 3.070 N/A PHE 21.A N ILE 16.A O no hydrogen 3.279 N/A THR 25.A N GLN 28.A OE1 no hydrogen 3.466 N/A GLU 26.A N THR 25.A OG1 no hydrogen 2.366 N/A GLN 28.A NE2 GLY 50.A O no hydrogen 3.045 N/A ARG 29.A N THR 25.A O no hydrogen 3.100 N/A ARG 29.A NH2 GLU 26.A OE2 no hydrogen 2.330 N/A ARG 30.A N GLU 26.A O no hydrogen 3.445 N/A ARG 30.A NH2 ASN 209.A O no hydrogen 3.379 N/A ALA 35.A N ALA 31.A O no hydrogen 3.372 N/A LEU 36.A N ILE 32.A O no hydrogen 2.862 N/A ALA 37.A N PRO 33.A O no hydrogen 3.043 N/A GLY 38.A N PRO 34.A O no hydrogen 3.235 N/A LEU 42.A N LEU 206.A O no hydrogen 3.118 N/A GLY 43.A N LEU 184.A O no hydrogen 3.241 N/A ALA 44.A N ILE 208.A O no hydrogen 2.673 N/A SER 49.A OG LYS 46.A O no hydrogen 2.504 N/A LYS 51.A NZ GLU 155.A OE2 no hydrogen 3.188 N/A ALA 54.A N LYS 51.A O no hydrogen 3.161 N/A VAL 60.A N LEU 56.A O no hydrogen 2.953 N/A GLU 61.A N ILE 57.A O no hydrogen 3.106 N/A MET 62.A N PRO 58.A O no hydrogen 3.144 N/A LEU 63.A N ALA 59.A O no hydrogen 3.210 N/A SER 64.A N VAL 60.A O no hydrogen 2.915 N/A SER 64.A OG VAL 60.A O no hydrogen 2.978 N/A SER 64.A OG GLN 102.A OE1 no hydrogen 3.260 N/A SER 65.A N GLU 61.A O no hydrogen 2.988 N/A SER 65.A OG MET 62.A O no hydrogen 3.435 N/A LEU 66.A N MET 62.A O no hydrogen 3.051 N/A ARG 67.A N SER 64.A O no hydrogen 3.313 N/A PHE 68.A N LEU 63.A O no hydrogen 3.073 N/A LYS 69.A N ASN 72.A OD1 no hydrogen 2.765 N/A ASN 72.A N LYS 69.A O no hydrogen 3.005 N/A THR 74.A OG1 VAL 144.A O no hydrogen 3.532 N/A ALA 76.A N ASN 125.A O no hydrogen 3.426 N/A ILE 77.A N SER 150.A O no hydrogen 3.145 N/A VAL 78.A N LEU 127.A O no hydrogen 2.749 N/A VAL 79.A N ILE 152.A O no hydrogen 2.740 N/A THR 80.A N ALA 129.A O no hydrogen 2.800 N/A THR 82.A OG1 ASP 326.A OD2 no hydrogen 3.436 N/A ARG 83.A NH1 GLY 109.A O no hydrogen 3.191 N/A ALA 86.A N ARG 83.A O no hydrogen 2.750 N/A LEU 87.A N ARG 83.A O no hydrogen 3.266 N/A ILE 89.A N LEU 85.A O no hydrogen 3.128 N/A PHE 90.A N ALA 86.A O no hydrogen 2.959 N/A GLY 91.A N LEU 87.A O no hydrogen 2.824 N/A VAL 92.A N GLN 88.A O no hydrogen 3.022 N/A ALA 93.A N ILE 89.A O no hydrogen 2.983 N/A ARG 94.A N PHE 90.A O no hydrogen 3.143 N/A LEU 96.A N VAL 92.A O no hydrogen 3.018 N/A MET 97.A N ALA 93.A O no hydrogen 2.959 N/A HIS 100.A N MET 97.A O no hydrogen 3.279 N/A GLN 102.A NE2 PHE 68.A O no hydrogen 3.173 N/A THR 103.A OG1 GLY 123.A O no hydrogen 3.213 N/A GLY 105.A N LEU 126.A O no hydrogen 2.965 N/A VAL 107.A N ILE 128.A O no hydrogen 2.945 N/A ARG 113.A NH2 ASP 136.A OD1 no hydrogen 2.377 N/A GLU 116.A N ASN 112.A O no hydrogen 3.239 N/A ALA 117.A N ARG 113.A O no hydrogen 3.145 N/A GLU 118.A N ARG 114.A O no hydrogen 3.145 N/A LYS 119.A N ALA 115.A O no hydrogen 3.053 N/A LYS 119.A NZ VAL 106.A O no hydrogen 2.742 N/A LEU 120.A N GLU 116.A O no hydrogen 2.919 N/A GLY 121.A N ALA 117.A O no hydrogen 3.067 N/A LYS 122.A N GLU 118.A O no hydrogen 3.207 N/A GLY 123.A N LYS 119.A O no hydrogen 3.209 N/A ASN 125.A N THR 103.A OG1 no hydrogen 2.852 N/A LEU 127.A N ALA 76.A O no hydrogen 3.037 N/A ILE 128.A N GLY 105.A O no hydrogen 3.062 N/A ALA 129.A N VAL 78.A O no hydrogen 2.775 N/A THR 130.A N VAL 107.A O no hydrogen 3.222 N/A ARG 133.A NH1 ALA 111.A O no hydrogen 3.490 N/A ARG 133.A NH1 GLU 116.A OE1 no hydrogen 2.708 N/A LEU 134.A N THR 130.A O no hydrogen 2.968 N/A LEU 135.A N PRO 131.A O no hydrogen 3.255 N/A HIS 137.A N ARG 133.A O no hydrogen 3.101 N/A HIS 137.A ND1 THR 141.A OG1 no hydrogen 2.863 N/A HIS 137.A NE2 GLU 116.A OE1 no hydrogen 2.947 N/A LEU 138.A N LEU 134.A O no hydrogen 2.964 N/A GLN 139.A N LEU 135.A O no hydrogen 3.016 N/A ASN 140.A N ASP 136.A O no hydrogen 3.093 N/A ASN 140.A ND2 ASP 136.A O no hydrogen 3.492 N/A ASN 140.A ND2 ASP 136.A OD1 no hydrogen 2.934 N/A THR 141.A OG1 HIS 137.A ND1 no hydrogen 2.863 N/A ASN 147.A ND2 ASN 72.A O no hydrogen 2.767 N/A LYS 149.A N GLY 75.A O no hydrogen 3.099 N/A LYS 149.A NZ ASP 179.A OD1 no hydrogen 3.153 N/A LEU 151.A N GLN 181.A O no hydrogen 3.052 N/A ILE 152.A N ILE 77.A O no hydrogen 2.789 N/A ILE 153.A N MET 183.A O no hydrogen 3.106 N/A ASP 154.A N VAL 79.A O no hydrogen 2.792 N/A ALA 156.A N PHE 185.A O no hydrogen 2.911 N/A ARG 158.A N GLU 155.A O no hydrogen 3.159 N/A ILE 159.A N GLU 155.A O no hydrogen 3.168 N/A LEU 160.A N ALA 156.A O no hydrogen 3.172 N/A GLU 161.A N ASP 157.A O no hydrogen 3.217 N/A ILE 162.A N ARG 158.A O no hydrogen 3.045 N/A GLY 163.A N ILE 159.A O no hydrogen 3.271 N/A PHE 164.A N ILE 159.A O no hydrogen 3.252 N/A MET 168.A N PHE 164.A O no hydrogen 3.102 N/A ARG 169.A N GLU 165.A O no hydrogen 3.276 N/A GLN 170.A N ASP 166.A O no hydrogen 3.145 N/A ILE 171.A N GLU 167.A O no hydrogen 2.810 N/A VAL 172.A N MET 168.A O no hydrogen 3.294 N/A LYS 173.A N ARG 169.A O no hydrogen 3.407 N/A ILE 174.A N GLN 170.A O no hydrogen 3.252 N/A LEU 175.A N ILE 171.A O no hydrogen 3.099 N/A ARG 180.A NE PRO 176.A O no hydrogen 2.909 N/A GLN 181.A N LYS 149.A O no hydrogen 3.096 N/A THR 182.A N ASP 40.A OD2 no hydrogen 3.335 N/A MET 183.A N LEU 151.A O no hydrogen 2.967 N/A PHE 185.A N ILE 153.A O no hydrogen 2.963 N/A SER 186.A N GLY 43.A O no hydrogen 3.273 N/A SER 186.A OG THR 188.A O no hydrogen 2.849 N/A THR 188.A N ASP 157.A OD2 no hydrogen 2.925 N/A THR 188.A OG1 ASP 157.A OD2 no hydrogen 3.153 N/A LYS 192.A N THR 190.A OG1 no hydrogen 2.967 N/A LYS 192.A NZ GLU 165.A OE1 no hydrogen 2.561 N/A VAL 193.A N THR 190.A OG1 no hydrogen 3.300 N/A GLU 194.A N THR 190.A O no hydrogen 3.156 N/A ASP 195.A N THR 191.A O no hydrogen 2.898 N/A LEU 196.A N LYS 192.A O no hydrogen 2.878 N/A ALA 197.A N VAL 193.A O no hydrogen 2.816 N/A ARG 198.A N GLU 194.A O no hydrogen 2.951 N/A ARG 198.A NH2 ASP 195.A OD1 no hydrogen 2.715 N/A ILE 199.A N ASP 195.A O no hydrogen 3.311 N/A SER 200.A N LEU 196.A O no hydrogen 3.246 N/A SER 200.A OG LEU 196.A O no hydrogen 2.841 N/A LEU 201.A N ALA 197.A O no hydrogen 3.087 N/A ARG 202.A NH2 GLY 38.A O no hydrogen 3.420 N/A ILE 208.A N LEU 42.A O no hydrogen 3.120 N/A VAL 210.A N ALA 44.A O no hydrogen 3.116 N/A GLN 224.A N PRO 369.A O no hydrogen 3.154 N/A GLN 224.A NE2 TYR 331.A OH no hydrogen 3.079 N/A GLY 225.A N SER 348.A O no hydrogen 2.739 N/A TYR 226.A N VAL 371.A O no hydrogen 2.957 N/A VAL 227.A N LEU 350.A O no hydrogen 3.278 N/A VAL 229.A N LEU 352.A O no hydrogen 2.874 N/A ASP 232.A N ASP 232.A OD2 no hydrogen 2.377 N/A LYS 233.A N GLU 230.A O no hydrogen 3.188 N/A ARG 234.A NH2 PHE 322.A O no hydrogen 2.902 N/A LEU 237.A N LYS 233.A O no hydrogen 3.185 N/A LEU 238.A N ARG 234.A O no hydrogen 3.222 N/A PHE 239.A N PHE 235.A O no hydrogen 2.679 N/A SER 240.A N LEU 236.A O no hydrogen 2.958 N/A SER 240.A OG LEU 236.A O no hydrogen 3.002 N/A PHE 241.A N LEU 237.A O no hydrogen 2.826 N/A LEU 242.A N LEU 238.A O no hydrogen 2.944 N/A LYS 243.A N PHE 239.A O no hydrogen 3.160 N/A LYS 243.A NZ ASP 271.A O no hydrogen 3.488 N/A MET 245.A N PHE 241.A O no hydrogen 2.896 N/A LYS 249.A N ASP 317.A OD2 no hydrogen 2.547 N/A ILE 250.A N GLY 299.A O no hydrogen 3.040 N/A ILE 251.A N TRP 318.A O no hydrogen 3.397 N/A VAL 252.A N LEU 301.A O no hydrogen 3.015 N/A PHE 253.A N VAL 320.A O no hydrogen 2.641 N/A PHE 254.A N CYS 303.A O no hydrogen 2.810 N/A SER 255.A N ASP 323.A OD2 no hydrogen 3.247 N/A SER 256.A OG SER 407.A O no hydrogen 3.215 N/A VAL 260.A N SER 256.A O no hydrogen 3.120 N/A LYS 261.A N CYS 257.A O no hydrogen 2.876 N/A LYS 261.A NZ TYR 396.A OH no hydrogen 3.256 N/A TYR 262.A N ASN 258.A O no hydrogen 2.941 N/A TYR 263.A N SER 259.A O no hydrogen 3.280 N/A SER 264.A N VAL 260.A O no hydrogen 2.889 N/A SER 264.A OG VAL 260.A O no hydrogen 3.448 N/A SER 264.A OG LYS 261.A O no hydrogen 3.021 N/A GLU 265.A N LYS 261.A O no hydrogen 3.345 N/A LEU 266.A N TYR 262.A O no hydrogen 2.828 N/A LEU 267.A N TYR 263.A O no hydrogen 3.157 N/A GLN 268.A N GLU 265.A O no hydrogen 3.486 N/A TYR 269.A N LEU 266.A O no hydrogen 3.365 N/A LEU 272.A N LEU 267.A O no hydrogen 2.962 N/A LEU 275.A N THR 300.A O no hydrogen 2.730 N/A LYS 280.A N HIS 278.A ND1 no hydrogen 3.294 N/A GLN 281.A N HIS 278.A O no hydrogen 3.424 N/A GLN 281.A NE2 ASP 276.A OD2 no hydrogen 3.483 N/A GLN 281.A NE2 HIS 278.A NE2 no hydrogen 3.173 N/A GLN 283.A N GLU 95.A OE1 no hydrogen 3.076 N/A GLN 283.A N GLU 95.A OE2 no hydrogen 2.856 N/A GLN 283.A NE2 GLN 283.A O no hydrogen 3.208 N/A GLN 284.A NE2 GLN 284.A O no hydrogen 3.129 N/A GLN 284.A NE2 ASN 288.A OD1 no hydrogen 2.581 N/A ARG 286.A N LYS 282.A O no hydrogen 3.026 N/A ARG 286.A NH1 HIS 278.A O no hydrogen 3.424 N/A THR 287.A N GLN 283.A O no hydrogen 3.122 N/A THR 287.A OG1 GLN 284.A O no hydrogen 3.515 N/A ASN 288.A N GLN 284.A O no hydrogen 3.085 N/A THR 289.A N LYS 285.A O no hydrogen 2.986 N/A THR 289.A OG1 LYS 285.A O no hydrogen 2.389 N/A PHE 290.A N ARG 286.A O no hydrogen 3.140 N/A PHE 291.A N THR 287.A O no hydrogen 3.021 N/A GLU 292.A N ASN 288.A O no hydrogen 2.948 N/A PHE 293.A N THR 289.A O no hydrogen 3.067 N/A CYS 294.A N PHE 290.A O no hydrogen 2.797 N/A CYS 294.A SG PHE 290.A O no hydrogen 3.200 N/A ASN 295.A N PHE 291.A O no hydrogen 3.133 N/A ASN 295.A ND2 PHE 291.A O no hydrogen 2.501 N/A GLY 299.A N LYS 248.A O no hydrogen 2.837 N/A LEU 301.A N ILE 250.A O no hydrogen 2.941 N/A ILE 302.A N LEU 275.A O no hydrogen 2.889 N/A CYS 303.A N VAL 252.A O no hydrogen 3.220 N/A CYS 303.A SG THR 304.A O no hydrogen 3.774 N/A ASP 305.A N PHE 254.A O no hydrogen 3.244 N/A ALA 307.A N THR 304.A OG1 no hydrogen 3.163 N/A ALA 308.A N THR 304.A O no hydrogen 3.201 N/A ARG 309.A N ASP 305.A O no hydrogen 2.835 N/A LEU 311.A N ALA 308.A O no hydrogen 3.078 N/A GLN 315.A NE2 VAL 316.A O no hydrogen 2.891 N/A ILE 319.A N ARG 347.A O no hydrogen 3.150 N/A VAL 320.A N ILE 251.A O no hydrogen 2.736 N/A GLN 321.A N LEU 349.A O no hydrogen 2.979 N/A GLN 321.A NE2 ASP 305.A OD1 no hydrogen 2.679 N/A GLN 321.A NE2 ASP 305.A OD2 no hydrogen 3.169 N/A GLN 321.A NE2 ASP 323.A O no hydrogen 2.801 N/A PHE 322.A N PHE 253.A O no hydrogen 3.092 N/A TYR 331.A N ASP 327.A O no hydrogen 2.834 N/A ILE 332.A N PRO 328.A O no hydrogen 3.284 N/A HIS 333.A N ARG 329.A O no hydrogen 3.401 N/A ARG 334.A N ASP 330.A O no hydrogen 3.276 N/A VAL 335.A N TYR 331.A O no hydrogen 2.937 N/A GLY 336.A N ILE 332.A O no hydrogen 2.957 N/A ARG 337.A NH2 HIS 333.A O no hydrogen 3.542 N/A THR 338.A N ARG 334.A O no hydrogen 2.887 N/A THR 338.A OG1 ARG 334.A O no hydrogen 2.568 N/A ALA 339.A N VAL 335.A O no hydrogen 3.055 N/A ARG 340.A N GLY 336.A O no hydrogen 3.175 N/A ARG 347.A N ASP 317.A O no hydrogen 2.892 N/A ARG 347.A NE TYR 373.A OH no hydrogen 3.002 N/A SER 348.A OG GLN 224.A OE1 no hydrogen 2.997 N/A LEU 349.A N ILE 319.A O no hydrogen 2.888 N/A LEU 350.A N GLY 225.A O no hydrogen 2.947 N/A PHE 351.A N GLN 321.A O no hydrogen 3.022 N/A LEU 352.A N VAL 227.A O no hydrogen 2.829 N/A GLU 356.A N GLN 353.A O no hydrogen 3.048 N/A PHE 359.A N GLU 356.A O no hydrogen 3.501 N/A LEU 360.A N LEU 357.A O no hydrogen 3.354 N/A HIS 362.A N GLY 358.A O no hydrogen 3.071 N/A LEU 363.A N PHE 359.A O no hydrogen 2.617 N/A LYS 364.A N LEU 360.A O no hydrogen 2.806 N/A ALA 365.A N ALA 361.A O no hydrogen 3.022 N/A ALA 366.A N HIS 362.A O no hydrogen 3.286 N/A LYS 367.A N LYS 364.A O no hydrogen 3.098 N/A VAL 368.A N LEU 363.A O no hydrogen 3.480 N/A VAL 371.A N GLN 224.A O no hydrogen 2.991 N/A TYR 373.A N TYR 226.A O no hydrogen 3.220 N/A ILE 380.A N ASN 378.A O no hydrogen 2.702 N/A LEU 381.A N SER 240.A OG no hydrogen 2.974 N/A VAL 383.A N LEU 381.A O no hydrogen 2.750 N/A GLN 384.A NE2 GLU 388.A OE2 no hydrogen 2.612 N/A GLN 384.A NE2 LYS 433.A O no hydrogen 2.712 N/A LEU 387.A N VAL 383.A O no hydrogen 2.860 N/A GLU 388.A N GLN 384.A O no hydrogen 2.790 N/A LYS 389.A N SER 385.A O no hydrogen 3.058 N/A LEU 390.A N GLN 386.A O no hydrogen 3.132 N/A ILE 391.A N LEU 387.A O no hydrogen 3.030 N/A SER 392.A N GLU 388.A O no hydrogen 3.370 N/A SER 392.A OG GLU 388.A O no hydrogen 3.164 N/A SER 392.A OG LYS 389.A O no hydrogen 3.140 N/A THR 393.A N LEU 390.A O no hydrogen 3.387 N/A THR 393.A OG1 LYS 389.A O no hydrogen 2.329 N/A ASN 394.A N LEU 390.A O no hydrogen 2.933 N/A LEU 397.A N ASN 394.A OD1 no hydrogen 3.010 N/A ASN 398.A N ASN 394.A O no hydrogen 3.068 N/A GLN 399.A N TYR 395.A O no hydrogen 2.959 N/A SER 400.A N TYR 396.A O no hydrogen 3.013 N/A SER 400.A OG TYR 396.A O no hydrogen 3.153 N/A ALA 401.A N LEU 397.A O no hydrogen 2.998 N/A LYS 402.A N ASN 398.A O no hydrogen 3.121 N/A GLU 403.A N GLN 399.A O no hydrogen 3.042 N/A GLY 404.A N SER 400.A O no hydrogen 3.047 N/A TYR 405.A N ALA 401.A O no hydrogen 2.958 N/A TYR 405.A OH LEU 428.A O no hydrogen 3.189 N/A ARG 406.A N LYS 402.A O no hydrogen 2.809 N/A SER 407.A N GLU 403.A O no hydrogen 3.070 N/A SER 407.A OG GLU 403.A O no hydrogen 2.972 N/A SER 407.A OG GLY 404.A O no hydrogen 3.032 N/A TYR 408.A N GLY 404.A O no hydrogen 3.008 N/A ILE 409.A N TYR 405.A O no hydrogen 3.413 N/A HIS 410.A N ARG 406.A O no hydrogen 3.263 N/A ALA 411.A N SER 407.A O no hydrogen 3.097 N/A TYR 412.A N TYR 408.A O no hydrogen 2.990 N/A ALA 413.A N ILE 409.A O no hydrogen 2.674 N/A SER 414.A N HIS 410.A O no hydrogen 3.067 N/A SER 414.A OG HIS 410.A O no hydrogen 3.070 N/A HIS 415.A ND1 LEU 417.A O no hydrogen 3.061 N/A HIS 415.A NE2 PRO 325.A O no hydrogen 3.249 N/A PHE 421.A N LEU 417.A O no hydrogen 3.324 N/A HIS 424.A N ASP 422.A OD1 no hydrogen 3.311 N/A VAL 431.A N ASP 427.A O no hydrogen 3.392 N/A ALA 432.A N LEU 428.A O no hydrogen 3.288 N/A LYS 433.A N VAL 429.A O no hydrogen 3.124 N/A SER 434.A N LYS 430.A O no hydrogen 3.293 N/A SER 434.A OG VAL 431.A O no hydrogen 2.706 N/A PHE 435.A N VAL 431.A O no hydrogen 3.287 N/A GLY 436.A N LYS 433.A O no hydrogen 3.269 N/A PHE 437.A N ALA 432.A O no hydrogen 2.755 N/A ARG 452.A NH1 SER 456.A O no hydrogen 2.712 N/A SER 456.A N ALA 453.A O no hydrogen 3.195 N/A SER 456.A OG ALA 453.A O no hydrogen 2.768 N/A GLN 460.A NE2 PRO 458.A O no hydrogen 3.225 N/A