Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ec8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N LEU 4.A O no hydrogen 3.144 N/A LEU 7.A N LEU 5.A O no hydrogen 3.087 N/A SER 14.A N THR 35.A O no hydrogen 3.048 N/A HIS 16.A N LEU 33.A O no hydrogen 2.597 N/A LYS 19.A N PRO 17.A O no hydrogen 3.024 N/A LEU 22.A N TYR 84.A O no hydrogen 2.741 N/A VAL 24.A N PHE 86.A O no hydrogen 2.726 N/A VAL 26.A N ARG 88.A O no hydrogen 3.371 N/A GLY 27.A N ALA 63.A O no hydrogen 2.713 N/A ASP 28.A N ARG 25.A O no hydrogen 2.927 N/A ILE 30.A N THR 60.A O no hydrogen 2.701 N/A ARG 31.A NE GLU 29.A OE2 no hydrogen 2.578 N/A ARG 31.A NH2 GLU 29.A OE1 no hydrogen 3.355 N/A ARG 31.A NH2 GLU 29.A OE2 no hydrogen 2.653 N/A LEU 32.A N TRP 58.A O no hydrogen 2.702 N/A LEU 33.A N HIS 16.A O no hydrogen 2.844 N/A CYS 34.A N ASN 56.A O no hydrogen 2.973 N/A CYS 34.A SG SER 14.A O no hydrogen 3.460 N/A THR 35.A N SER 14.A O no hydrogen 2.827 N/A PHE 39.A N ASP 36.A O no hydrogen 3.040 N/A VAL 40.A N THR 74.A O no hydrogen 2.825 N/A LYS 41.A N THR 74.A O no hydrogen 3.290 N/A LYS 41.A NZ THR 43.A OG1 no hydrogen 2.703 N/A LYS 41.A NZ GLU 52.A OE1 no hydrogen 2.944 N/A TRP 42.A N ASN 53.A O no hydrogen 3.117 N/A TRP 42.A NE1 ASN 56.A O no hydrogen 2.791 N/A THR 43.A N THR 72.A O no hydrogen 2.893 N/A PHE 44.A N ASN 51.A O no hydrogen 2.896 N/A GLU 45.A N LYS 70.A O no hydrogen 2.972 N/A ASN 51.A N PHE 44.A O no hydrogen 3.259 N/A ASN 51.A ND2 THR 50.A O no hydrogen 3.480 N/A ASN 53.A N TRP 42.A O no hydrogen 3.104 N/A TRP 58.A N LEU 32.A O no hydrogen 2.563 N/A TRP 58.A NE1 THR 60.A OG1 no hydrogen 2.799 N/A THR 60.A N ILE 30.A O no hydrogen 2.970 N/A ALA 63.A N ASP 28.A O no hydrogen 2.817 N/A GLU 64.A N ASN 67.A OD1 no hydrogen 2.682 N/A THR 68.A N ALA 65.A O no hydrogen 3.039 N/A THR 68.A OG1 ALA 65.A O no hydrogen 2.576 N/A GLY 69.A N VAL 85.A O no hydrogen 2.897 N/A LYS 70.A N GLU 45.A O no hydrogen 3.235 N/A TYR 71.A N ILE 83.A O no hydrogen 2.937 N/A TYR 71.A OH ASN 67.A O no hydrogen 2.917 N/A THR 72.A N THR 43.A O no hydrogen 2.769 N/A CYS 73.A N ASN 81.A O no hydrogen 2.638 N/A THR 74.A N LYS 41.A O no hydrogen 2.923 N/A ASN 75.A N LEU 79.A O no hydrogen 2.792 N/A LYS 76.A N GLY 38.A O no hydrogen 2.602 N/A GLY 78.A N ASN 75.A O no hydrogen 3.161 N/A LEU 79.A N ASN 75.A OD1 no hydrogen 2.821 N/A ASN 81.A N CYS 73.A O no hydrogen 2.952 N/A ASN 81.A ND2 PRO 13.A O no hydrogen 3.651 N/A SER 82.A N ASN 81.A OD1 no hydrogen 2.637 N/A ILE 83.A N TYR 71.A O no hydrogen 2.975 N/A TYR 84.A N SER 20.A O no hydrogen 2.875 N/A TYR 84.A OH LYS 143.A O no hydrogen 3.214 N/A VAL 85.A N GLY 69.A O no hydrogen 2.753 N/A PHE 86.A N LEU 22.A O no hydrogen 3.003 N/A VAL 87.A N THR 68.A OG1 no hydrogen 3.359 N/A ARG 88.A NE ASP 116.A OD2 no hydrogen 3.152 N/A ALA 91.A N ASP 89.A OD2 no hydrogen 2.878 N/A LEU 95.A N PRO 113.A O no hydrogen 3.315 N/A ASP 97.A N ARG 111.A O no hydrogen 3.140 N/A SER 99.A N ASP 97.A OD2 no hydrogen 3.148 N/A GLY 102.A N LYS 175.A O no hydrogen 2.898 N/A LYS 103.A NZ GLU 104.A O no hydrogen 3.506 N/A GLU 104.A N ARG 177.A O no hydrogen 2.720 N/A ASP 105.A N VAL 151.A O no hydrogen 3.029 N/A ASN 106.A N LYS 103.A O no hydrogen 2.961 N/A THR 108.A N ILE 148.A O no hydrogen 3.197 N/A VAL 110.A N ILE 146.A O no hydrogen 2.680 N/A ARG 111.A NH2 ASP 97.A O no hydrogen 3.367 N/A LEU 114.A N PRO 142.A O no hydrogen 3.247 N/A THR 115.A N LEU 93.A O no hydrogen 3.374 N/A THR 115.A OG1 LYS 92.A O no hydrogen 2.635 N/A GLU 118.A N ASP 116.A OD1 no hydrogen 2.865 N/A THR 120.A N ASP 165.A O no hydrogen 3.507 N/A TYR 122.A OH CYS 112.A O no hydrogen 3.126 N/A SER 123.A N SER 163.A O no hydrogen 2.845 N/A LYS 125.A N HIS 161.A O no hydrogen 3.139 N/A CYS 127.A N LYS 130.A O no hydrogen 3.083 N/A ILE 139.A N MET 147.A O no hydrogen 3.113 N/A ASP 141.A N GLY 145.A O no hydrogen 2.557 N/A LYS 143.A N ASP 141.A OD1 no hydrogen 2.703 N/A ILE 146.A N VAL 110.A O no hydrogen 3.090 N/A LYS 149.A N ARG 137.A O no hydrogen 2.991 N/A SER 150.A N ASP 107.A OD2 no hydrogen 2.796 N/A VAL 151.A N ASN 106.A O no hydrogen 3.316 N/A ARG 153.A NH2 GLU 104.A OE1 no hydrogen 2.666 N/A TYR 155.A N LYS 152.A O no hydrogen 2.826 N/A HIS 156.A N ARG 153.A O no hydrogen 2.913 N/A ARG 157.A NE ASP 238.A OD1 no hydrogen 3.410 N/A LEU 158.A N TYR 155.A O no hydrogen 3.123 N/A HIS 161.A N LYS 125.A O no hydrogen 3.353 N/A CYS 162.A SG CYS 112.A O no hydrogen 3.647 N/A VAL 167.A N VAL 164.A O no hydrogen 3.046 N/A LEU 174.A N LEU 158.A O no hydrogen 2.833 N/A VAL 176.A N HIS 156.A ND1 no hydrogen 2.893 N/A ARG 177.A N GLY 102.A O no hydrogen 2.734 N/A ALA 179.A N GLU 104.A OE1 no hydrogen 2.869 N/A LYS 181.A NZ ASP 105.A OD1 no hydrogen 3.401 N/A LYS 181.A NZ ASP 105.A OD2 no hydrogen 2.800 N/A VAL 185.A N LYS 208.A O no hydrogen 3.361 N/A SER 187.A N THR 206.A O no hydrogen 2.735 N/A SER 187.A OG THR 206.A O no hydrogen 3.494 N/A SER 189.A OG TYR 193.A OH no hydrogen 3.322 N/A TYR 193.A N THR 276.A O no hydrogen 3.001 N/A TYR 193.A OH SER 189.A OG no hydrogen 3.322 N/A LEU 195.A N GLU 278.A O no hydrogen 2.704 N/A GLU 197.A N VAL 280.A O no hydrogen 2.816 N/A GLY 198.A N ALA 252.A O no hydrogen 2.791 N/A GLU 199.A N ARG 196.A O no hydrogen 3.017 N/A GLU 200.A N GLU 199.A OE2 no hydrogen 2.906 N/A PHE 201.A N ILE 249.A O no hydrogen 2.812 N/A VAL 203.A N LEU 247.A O no hydrogen 3.058 N/A CYS 205.A N ALA 245.A O no hydrogen 3.384 N/A CYS 205.A SG SER 187.A O no hydrogen 3.356 N/A THR 206.A N SER 187.A O no hydrogen 2.602 N/A ILE 207.A N ARG 243.A O no hydrogen 2.963 N/A LYS 208.A N VAL 185.A O no hydrogen 3.092 N/A ASP 209.A N TYR 241.A O no hydrogen 2.638 N/A VAL 210.A N ASP 209.A OD2 no hydrogen 2.327 N/A SER 211.A OG SER 213.A OG no hydrogen 2.676 N/A SER 213.A N SER 211.A OG no hydrogen 3.039 N/A SER 213.A OG SER 211.A OG no hydrogen 2.676 N/A VAL 214.A N SER 211.A O no hydrogen 3.074 N/A TYR 215.A N ASN 265.A O no hydrogen 2.813 N/A THR 217.A N TYR 263.A O no hydrogen 3.108 N/A THR 217.A OG1 TRP 218.A O no hydrogen 3.155 N/A TRP 218.A N GLU 229.A OE1 no hydrogen 2.981 N/A TRP 218.A NE1 ALA 245.A O no hydrogen 2.786 N/A LYS 219.A N MET 261.A O no hydrogen 2.951 N/A SER 223.A N ARG 220.A O no hydrogen 3.078 N/A SER 223.A OG ASN 222.A OD1 no hydrogen 2.928 N/A LEU 227.A N THR 225.A OG1 no hydrogen 2.712 N/A LYS 230.A N THR 246.A O no hydrogen 2.949 N/A ASN 232.A N GLN 244.A O no hydrogen 2.927 N/A SER 233.A OG TYR 231.A OH no hydrogen 2.513 N/A TRP 234.A N GLU 242.A O no hydrogen 2.751 N/A HIS 236.A N ASN 240.A O no hydrogen 2.724 N/A HIS 236.A NE2 GLU 242.A OE1 no hydrogen 2.558 N/A TYR 241.A N ASP 209.A O no hydrogen 2.691 N/A GLU 242.A N TRP 234.A O no hydrogen 3.065 N/A ARG 243.A N ILE 207.A O no hydrogen 2.871 N/A ARG 243.A NE TYR 241.A OH no hydrogen 2.783 N/A ARG 243.A NH1 VAL 214.A O no hydrogen 3.303 N/A ARG 243.A NH1 SER 216.A OG no hydrogen 2.860 N/A ARG 243.A NH2 VAL 214.A O no hydrogen 2.787 N/A ARG 243.A NH2 TYR 241.A OH no hydrogen 2.953 N/A GLN 244.A N ASN 232.A O no hydrogen 2.662 N/A ALA 245.A N CYS 205.A O no hydrogen 3.078 N/A THR 246.A N LYS 230.A O no hydrogen 3.094 N/A LEU 247.A N VAL 203.A O no hydrogen 2.764 N/A ILE 249.A N PHE 201.A O no hydrogen 2.749 N/A SER 250.A OG GLU 200.A OE1 no hydrogen 2.931 N/A ALA 252.A N GLU 199.A O no hydrogen 2.792 N/A ARG 253.A N ASP 256.A OD2 no hydrogen 2.348 N/A ASP 256.A N ARG 253.A O no hydrogen 2.679 N/A SER 257.A OG VAL 254.A O no hydrogen 2.838 N/A GLY 258.A N LEU 277.A O no hydrogen 3.005 N/A PHE 260.A N THR 275.A O no hydrogen 2.903 N/A MET 261.A N LYS 219.A O no hydrogen 3.490 N/A CYS 262.A N VAL 273.A O no hydrogen 2.764 N/A TYR 263.A N THR 217.A O no hydrogen 3.014 N/A ALA 264.A N ALA 271.A O no hydrogen 2.618 N/A ASN 265.A N TYR 215.A O no hydrogen 2.712 N/A ASN 266.A N GLY 269.A O no hydrogen 2.982 N/A ASN 266.A ND2 ALA 182.A O no hydrogen 3.222 N/A ASN 266.A ND2 ASP 209.A OD1 no hydrogen 2.842 N/A GLY 269.A N ASN 266.A OD1 no hydrogen 2.786 N/A SER 270.A OG TYR 263.A OH no hydrogen 3.138 N/A ALA 271.A N ALA 264.A O no hydrogen 2.806 N/A VAL 273.A N CYS 262.A O no hydrogen 2.969 N/A THR 275.A N PHE 260.A O no hydrogen 2.951 N/A THR 275.A OG1 LYS 190.A O no hydrogen 3.144 N/A THR 276.A N ALA 191.A O no hydrogen 3.293 N/A LEU 277.A N GLY 258.A O no hydrogen 3.134 N/A GLU 278.A N TYR 193.A O no hydrogen 3.094 N/A VAL 280.A N LEU 195.A O no hydrogen 2.673 N/A PHE 284.A N PHE 312.A O no hydrogen 2.727 N/A ASN 286.A N GLU 310.A O no hydrogen 2.984 N/A ASN 286.A ND2 GLU 310.A OE1 no hydrogen 3.566 N/A MET 290.A N ILE 306.A O no hydrogen 3.312 N/A VAL 295.A N ASN 378.A O no hydrogen 2.821 N/A VAL 297.A N TYR 380.A O no hydrogen 2.986 N/A GLU 301.A N ASN 298.A O no hydrogen 3.182 N/A VAL 303.A N LEU 351.A O no hydrogen 3.012 N/A LEU 305.A N LEU 349.A O no hydrogen 2.968 N/A VAL 307.A N SER 347.A O no hydrogen 3.010 N/A GLU 308.A N PHE 288.A O no hydrogen 2.702 N/A TYR 309.A N TYR 345.A O no hydrogen 2.875 N/A GLU 310.A N ASN 286.A O no hydrogen 2.907 N/A ALA 311.A N ILE 343.A O no hydrogen 2.593 N/A PHE 312.A N PHE 284.A O no hydrogen 2.906 N/A GLU 316.A N SER 367.A O no hydrogen 3.046 N/A GLN 319.A N LEU 365.A O no hydrogen 2.880 N/A TRP 320.A NE1 SER 347.A OG no hydrogen 3.194 N/A ILE 321.A N THR 363.A O no hydrogen 2.901 N/A TYR 322.A N ARG 325.A O no hydrogen 3.037 N/A THR 326.A OG1 GLN 319.A OE1 no hydrogen 3.233 N/A THR 326.A OG1 TRP 320.A O no hydrogen 2.620 N/A PHE 327.A N TRP 320.A O no hydrogen 2.911 N/A GLU 332.A N GLU 348.A O no hydrogen 2.748 N/A TYR 334.A N VAL 346.A O no hydrogen 2.956 N/A TYR 334.A OH GLU 348.A OE2 no hydrogen 3.098 N/A LYS 336.A N ARG 344.A O no hydrogen 3.288 N/A LYS 336.A NZ GLU 308.A OE1 no hydrogen 2.967 N/A ASN 342.A ND2 ARG 344.A O no hydrogen 2.955 N/A TYR 345.A N TYR 309.A O no hydrogen 2.665 N/A SER 347.A N VAL 307.A O no hydrogen 2.945 N/A SER 347.A OG GLU 332.A O no hydrogen 2.798 N/A LEU 349.A N LEU 305.A O no hydrogen 2.723 N/A HIS 350.A N LYS 330.A O no hydrogen 2.735 N/A LEU 351.A N VAL 303.A O no hydrogen 2.876 N/A GLY 356.A N ASP 299.A OD1 no hydrogen 3.163 N/A THR 357.A OG1 GLU 358.A OE2 no hydrogen 3.461 N/A GLU 358.A N LYS 355.A O no hydrogen 2.723 N/A GLY 360.A N VAL 379.A O no hydrogen 3.012 N/A TYR 362.A N PHE 377.A O no hydrogen 2.835 N/A TYR 362.A OH GLU 358.A O no hydrogen 3.097 N/A THR 363.A N ILE 321.A O no hydrogen 3.027 N/A PHE 364.A N ILE 375.A O no hydrogen 3.046 N/A LEU 365.A N GLN 319.A O no hydrogen 2.631 N/A VAL 366.A N ALA 373.A O no hydrogen 2.992 N/A SER 367.A N HIS 317.A O no hydrogen 2.808 N/A ASN 368.A N VAL 371.A O no hydrogen 2.863 N/A ASN 368.A ND2 PHE 284.A O no hydrogen 3.141 N/A ASN 368.A ND2 PRO 313.A O no hydrogen 3.618 N/A VAL 371.A N ASN 368.A OD1 no hydrogen 2.672 N/A ASN 372.A ND2 ASN 372.A O no hydrogen 2.326 N/A ALA 373.A N VAL 366.A O no hydrogen 2.778 N/A ILE 375.A N PHE 364.A O no hydrogen 3.294 N/A PHE 377.A N TYR 362.A O no hydrogen 2.619 N/A ASN 378.A N THR 293.A O no hydrogen 2.799 N/A VAL 379.A N GLY 360.A O no hydrogen 2.887 N/A TYR 380.A N VAL 295.A O no hydrogen 2.742 N/A ASN 382.A N VAL 297.A O no hydrogen 2.893 N/A THR 383.A N PHE 405.A O no hydrogen 3.270 N/A GLU 386.A N ALA 403.A O no hydrogen 2.668 N/A THR 389.A N VAL 401.A O no hydrogen 3.083 N/A THR 389.A OG1 ASP 391.A OD1 no hydrogen 3.360 N/A ASP 391.A N GLN 399.A O no hydrogen 3.260 N/A LEU 398.A N ILE 439.A O no hydrogen 3.184 N/A GLN 399.A N ASP 391.A O no hydrogen 2.864 N/A CYS 400.A N SER 437.A O no hydrogen 3.343 N/A VAL 401.A N THR 389.A O no hydrogen 2.895 N/A ALA 402.A N VAL 435.A O no hydrogen 3.249 N/A ALA 403.A N GLU 386.A O no hydrogen 3.014 N/A GLY 404.A N LEU 433.A O no hydrogen 3.378 N/A PHE 405.A N THR 383.A O no hydrogen 3.495 N/A THR 409.A N TYR 450.A O no hydrogen 2.568 N/A ASP 411.A N LYS 448.A O no hydrogen 2.650 N/A TRP 412.A NE1 SER 437.A OG no hydrogen 3.214 N/A THR 423.A N GLN 436.A O no hydrogen 2.677 N/A VAL 435.A N ALA 402.A O no hydrogen 2.720 N/A ILE 439.A N LEU 398.A O no hydrogen 3.128 N/A SER 441.A N ASP 440.A OD2 no hydrogen 2.803 N/A SER 442.A OG ASP 440.A O no hydrogen 3.496 N/A ALA 443.A N SER 441.A O no hydrogen 2.779 N/A LYS 448.A N ASP 411.A O no hydrogen 2.757 N/A LYS 448.A NZ TYR 413.A OH no hydrogen 3.514 N/A ALA 449.A N THR 456.A O no hydrogen 2.756 N/A TYR 450.A N THR 409.A O no hydrogen 2.984 N/A TYR 450.A OH ASP 411.A OD1 no hydrogen 2.915 N/A ASN 451.A N GLY 454.A O no hydrogen 3.071 N/A VAL 453.A N ASN 451.A OD1 no hydrogen 2.467 N/A GLY 454.A N ASN 451.A OD1 no hydrogen 3.261 N/A SER 457.A OG CYS 447.A O no hydrogen 3.495 N/A ALA 458.A N CYS 447.A O no hydrogen 3.353 N/A