Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2der_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N ASP 118.A OD2 no hydrogen 2.690 N/A LYS 3.A NZ GLY 116.A O no hydrogen 3.176 N/A VAL 4.A N GLN 27.A O no hydrogen 2.772 N/A ILE 5.A N TYR 119.A O no hydrogen 3.045 N/A VAL 6.A N GLU 29.A O no hydrogen 3.080 N/A GLY 7.A N ALA 121.A O no hydrogen 3.295 N/A MET 8.A N LEU 31.A O no hydrogen 2.852 N/A GLY 11.A N SER 9.A OG no hydrogen 3.140 N/A SER 15.A OG GLY 11.A O no hydrogen 2.767 N/A VAL 16.A N VAL 12.A O no hydrogen 2.893 N/A SER 17.A OG THR 122.A O no hydrogen 3.124 N/A ALA 18.A N SER 14.A O no hydrogen 3.001 N/A TRP 19.A N SER 15.A O no hydrogen 3.131 N/A LEU 20.A N VAL 16.A O no hydrogen 3.090 N/A LEU 21.A N SER 17.A O no hydrogen 3.337 N/A GLN 22.A N ALA 18.A O no hydrogen 2.885 N/A GLN 22.A NE2 LEU 61.A O no hydrogen 3.677 N/A GLN 23.A N TRP 19.A O no hydrogen 2.892 N/A GLN 24.A N LEU 21.A O no hydrogen 2.628 N/A GLY 25.A N GLN 22.A O no hydrogen 2.720 N/A GLN 27.A N LYS 2.A O no hydrogen 2.966 N/A GLY 30.A N GLU 64.A O no hydrogen 2.768 N/A LEU 31.A N VAL 6.A O no hydrogen 3.215 N/A PHE 32.A N HIS 66.A O no hydrogen 3.250 N/A LYS 34.A N VAL 68.A O no hydrogen 3.209 N/A LYS 34.A NZ GLU 37.A OE2 no hydrogen 3.235 N/A LYS 34.A NZ GLU 38.A OE2 no hydrogen 3.328 N/A ASP 39.A N GLU 43.A OE1 no hydrogen 2.916 N/A GLU 43.A N ASP 40.A O no hydrogen 2.878 N/A TYR 44.A N ASP 40.A O no hydrogen 3.202 N/A CYS 45.A N GLY 41.A O no hydrogen 3.300 N/A THR 46.A N GLU 43.A O no hydrogen 2.908 N/A THR 46.A OG1 GLU 42.A O no hydrogen 3.015 N/A THR 46.A OG1 GLU 43.A O no hydrogen 3.282 N/A ALA 47.A N GLU 43.A O no hydrogen 3.237 N/A ALA 48.A N TYR 44.A O no hydrogen 2.949 N/A ASP 50.A N THR 46.A O no hydrogen 2.712 N/A ASP 50.A N ALA 47.A O no hydrogen 2.666 N/A LEU 51.A N ALA 47.A O no hydrogen 2.648 N/A ALA 52.A N ALA 48.A O no hydrogen 2.783 N/A ASP 53.A N ALA 49.A O no hydrogen 3.328 N/A ALA 54.A N ASP 50.A O no hydrogen 2.517 N/A GLN 55.A N LEU 51.A O no hydrogen 2.719 N/A GLN 55.A NE2 ASP 59.A OD1 no hydrogen 2.834 N/A GLN 55.A NE2 ASP 59.A OD2 no hydrogen 3.532 N/A ALA 56.A N ALA 52.A O no hydrogen 2.658 N/A VAL 57.A N ASP 53.A O no hydrogen 3.137 N/A CYS 58.A N ALA 54.A O no hydrogen 3.338 N/A CYS 58.A SG ALA 54.A O no hydrogen 3.722 N/A ASP 59.A N GLN 55.A O no hydrogen 3.156 N/A LYS 60.A N ALA 56.A O no hydrogen 3.446 N/A LEU 61.A N VAL 57.A O no hydrogen 2.983 N/A ILE 63.A N CYS 58.A O no hydrogen 2.855 N/A HIS 66.A N GLY 30.A O no hydrogen 2.601 N/A HIS 66.A ND1 GLY 30.A O no hydrogen 3.145 N/A THR 67.A OG1 HIS 66.A O no hydrogen 2.815 N/A VAL 68.A N PHE 32.A O no hydrogen 3.404 N/A PHE 70.A N LYS 34.A O no hydrogen 3.035 N/A GLU 73.A N GLU 73.A OE1 no hydrogen 2.385 N/A TYR 74.A N PHE 70.A O no hydrogen 2.861 N/A TRP 75.A N ALA 71.A O no hydrogen 3.319 N/A ASP 76.A N ALA 72.A O no hydrogen 3.048 N/A ASN 77.A N GLU 73.A O no hydrogen 2.733 N/A ASN 77.A ND2 GLU 101.A OE2 no hydrogen 2.795 N/A VAL 78.A N TYR 74.A O no hydrogen 2.792 N/A PHE 79.A N TYR 74.A O no hydrogen 3.080 N/A GLU 80.A N TRP 75.A O no hydrogen 2.811 N/A PHE 82.A N VAL 78.A O no hydrogen 3.016 N/A LEU 83.A N PHE 79.A O no hydrogen 3.116 N/A ALA 84.A N GLU 80.A O no hydrogen 3.001 N/A GLU 85.A N LEU 81.A O no hydrogen 3.014 N/A TYR 86.A N LEU 83.A O no hydrogen 3.008 N/A LYS 87.A N LEU 83.A O no hydrogen 3.203 N/A GLY 89.A N TYR 86.A O no hydrogen 2.771 N/A ARG 90.A N GLU 85.A O no hydrogen 2.724 N/A ARG 90.A NH1 GLU 341.A OE2 no hydrogen 3.424 N/A THR 91.A OG1 THR 219.A OG1 no hydrogen 3.356 N/A ILE 96.A N ASN 93.A O no hydrogen 2.925 N/A LEU 97.A N PRO 94.A O no hydrogen 3.215 N/A CYS 98.A N PRO 94.A O no hydrogen 3.058 N/A ASN 99.A N ASP 95.A O no hydrogen 3.093 N/A ASN 99.A ND2 PHE 150.A O no hydrogen 3.010 N/A LYS 100.A N ILE 96.A O no hydrogen 3.334 N/A GLU 101.A N LEU 97.A O no hydrogen 2.660 N/A ILE 102.A N CYS 98.A O no hydrogen 3.049 N/A LYS 103.A N CYS 98.A O no hydrogen 3.032 N/A PHE 104.A N ASN 99.A O no hydrogen 2.857 N/A LYS 105.A N ILE 102.A O no hydrogen 2.697 N/A ALA 106.A N GLU 101.A O no hydrogen 3.195 N/A PHE 107.A N ILE 102.A O no hydrogen 3.321 N/A GLU 109.A N LYS 105.A O no hydrogen 2.513 N/A PHE 110.A N ALA 106.A O no hydrogen 2.877 N/A ALA 111.A N PHE 107.A O no hydrogen 2.933 N/A ALA 112.A N LEU 108.A O no hydrogen 3.379 N/A GLU 113.A N GLU 109.A O no hydrogen 2.911 N/A ASP 114.A N PHE 110.A O no hydrogen 2.744 N/A ASP 118.A N LYS 3.A O no hydrogen 2.594 N/A TYR 119.A N LYS 3.A O no hydrogen 3.230 N/A ILE 120.A N GLN 161.A O no hydrogen 2.847 N/A ALA 121.A N ILE 5.A O no hydrogen 3.008 N/A THR 122.A OG1 HIS 124.A ND1 no hydrogen 3.188 N/A HIS 124.A ND1 THR 122.A OG1 no hydrogen 3.188 N/A TYR 125.A N GLN 147.A OE1 no hydrogen 3.312 N/A TYR 125.A OH LEU 141.A O no hydrogen 2.475 N/A VAL 126.A N HIS 124.A O no hydrogen 2.691 N/A ARG 127.A N LEU 138.A O no hydrogen 3.392 N/A ARG 128.A NE ASP 130.A OD1 no hydrogen 2.592 N/A ARG 128.A NH1 SER 162.A O no hydrogen 2.547 N/A ARG 128.A NH2 ASP 130.A OD1 no hydrogen 3.070 N/A ARG 128.A NH2 ASP 130.A OD2 no hydrogen 3.339 N/A ALA 129.A N ARG 136.A O no hydrogen 3.140 N/A VAL 131.A N LYS 134.A O no hydrogen 2.945 N/A LYS 134.A N VAL 131.A O no hydrogen 3.286 N/A LYS 134.A NZ GLU 157.A OE2 no hydrogen 3.289 N/A SER 135.A OG HIS 156.A O no hydrogen 2.945 N/A ARG 136.A N ALA 129.A O no hydrogen 2.701 N/A LEU 138.A N ARG 127.A O no hydrogen 2.812 N/A ARG 139.A N GLU 332.A O no hydrogen 2.898 N/A ARG 139.A NE GLY 331.A O no hydrogen 2.711 N/A ARG 139.A NH1 ASP 296.A OD1 no hydrogen 3.490 N/A ARG 139.A NH2 ASP 296.A OD2 no hydrogen 2.903 N/A ARG 139.A NH2 GLY 331.A O no hydrogen 2.877 N/A LYS 145.A N ASP 142.A O no hydrogen 2.631 N/A LYS 145.A NZ ASN 144.A OD1 no hydrogen 3.278 N/A ASP 146.A N SER 143.A O no hydrogen 3.294 N/A GLN 147.A N TYR 125.A O no hydrogen 3.139 N/A SER 148.A OG ASP 146.A OD1 no hydrogen 2.613 N/A SER 148.A OG ASP 146.A OD2 no hydrogen 2.825 N/A SER 148.A OG TYR 329.A OH no hydrogen 2.655 N/A TYR 149.A OH SER 325.A O no hydrogen 3.076 N/A PHE 150.A N GLN 147.A O no hydrogen 2.805 N/A LEU 151.A N SER 148.A O no hydrogen 2.911 N/A TYR 152.A OH SER 325.A OG no hydrogen 2.726 N/A SER 155.A N GLN 158.A OE1 no hydrogen 3.114 N/A HIS 156.A N VAL 275.A O no hydrogen 2.975 N/A GLN 158.A N SER 155.A O no hydrogen 2.398 N/A GLN 158.A N SER 155.A OG no hydrogen 3.261 N/A ILE 159.A N SER 155.A O no hydrogen 2.677 N/A ALA 160.A N HIS 156.A O no hydrogen 2.654 N/A SER 162.A N GLN 158.A O no hydrogen 3.045 N/A SER 162.A N ILE 159.A O no hydrogen 2.925 N/A SER 162.A OG GLN 158.A O no hydrogen 3.354 N/A GLU 168.A N PRO 165.A O no hydrogen 2.958 N/A LEU 169.A N VAL 166.A O no hydrogen 3.451 N/A GLN 173.A N GLU 170.A O no hydrogen 2.780 N/A LYS 176.A N PRO 172.A O no hydrogen 3.250 N/A LYS 176.A N GLN 173.A O no hydrogen 2.730 N/A LYS 176.A NZ GLU 179.A OE1 no hydrogen 2.714 N/A ILE 177.A N GLN 173.A O no hydrogen 2.756 N/A ALA 178.A N VAL 174.A O no hydrogen 3.138 N/A GLU 179.A N LYS 176.A O no hydrogen 2.488 N/A ASP 180.A N LYS 176.A O no hydrogen 2.991 N/A GLY 182.A N GLU 179.A O no hydrogen 2.756 N/A LEU 183.A N ALA 178.A O no hydrogen 2.757 N/A PHE 189.A N LYS 185.A O no hydrogen 3.149 N/A LEU 190.A N PHE 186.A O no hydrogen 3.085 N/A GLY 191.A N ARG 187.A O no hydrogen 3.320 N/A ARG 192.A N GLU 188.A O no hydrogen 3.285 N/A ARG 192.A N PHE 189.A O no hydrogen 2.978 N/A TYR 193.A N LEU 190.A O no hydrogen 2.846 N/A LEU 194.A N LEU 190.A O no hydrogen 2.752 N/A LYS 200.A N ASN 249.A O no hydrogen 3.447 N/A LYS 200.A NZ GLU 208.A OE2 no hydrogen 2.912 N/A ILE 201.A N GLY 210.A O no hydrogen 2.430 N/A ILE 202.A N LEU 251.A O no hydrogen 2.866 N/A THR 203.A OG1 ASP 207.A OD2 no hydrogen 2.512 N/A ASP 205.A N THR 203.A OG1 no hydrogen 2.957 N/A GLY 206.A N THR 203.A O no hydrogen 2.794 N/A ILE 209.A N ILE 201.A O no hydrogen 3.090 N/A GLN 213.A NE2 GLU 211.A OE1 no hydrogen 3.206 N/A THR 219.A OG1 THR 91.A OG1 no hydrogen 3.356 N/A GLY 221.A N VAL 241.A O no hydrogen 2.887 N/A GLN 222.A N THR 219.A O no hydrogen 2.968 N/A GLN 222.A NE2 TYR 217.A O no hydrogen 3.038 N/A GLN 222.A NE2 LYS 224.A O no hydrogen 3.453 N/A THR 231.A N GLU 233.A O no hydrogen 3.214 N/A GLU 233.A N THR 231.A O no hydrogen 2.566 N/A TYR 240.A N ALA 254.A O no hydrogen 3.206 N/A VAL 241.A N GLN 222.A O no hydrogen 3.233 N/A VAL 242.A N VAL 252.A O no hydrogen 2.884 N/A ASP 243.A N VAL 252.A O no hydrogen 3.371 N/A LYS 244.A NZ GLY 89.A O no hydrogen 3.089 N/A LYS 244.A NZ HIS 218.A O no hydrogen 3.131 N/A ASP 245.A N ILE 250.A O no hydrogen 2.711 N/A ASN 248.A ND2 ASP 245.A OD1 no hydrogen 2.379 N/A ILE 250.A N ASP 245.A O no hydrogen 3.092 N/A LEU 251.A N LYS 200.A O no hydrogen 3.387 N/A VAL 252.A N ASP 243.A O no hydrogen 3.072 N/A VAL 253.A N ILE 202.A O no hydrogen 3.011 N/A ALA 254.A N TYR 240.A O no hydrogen 2.803 N/A GLN 255.A NE2 GLU 237.A O no hydrogen 2.890 N/A GLY 256.A N PRO 238.A O no hydrogen 3.429 N/A HIS 259.A N GLY 256.A O no hydrogen 2.603 N/A LEU 262.A N HIS 259.A O no hydrogen 2.891 N/A SER 264.A N VAL 317.A O no hydrogen 3.238 N/A VAL 265.A N LEU 344.A O no hydrogen 2.532 N/A LEU 267.A N VAL 311.A O no hydrogen 3.027 N/A ILE 268.A N GLN 342.A O no hydrogen 2.761 N/A ALA 269.A N ILE 309.A O no hydrogen 3.241 N/A GLN 270.A N ILE 339.A O no hydrogen 2.827 N/A GLN 271.A N ASP 307.A OD2 no hydrogen 2.939 N/A GLN 271.A NE2 GLN 270.A OE1 no hydrogen 3.621 N/A LEU 272.A N ASP 307.A OD1 no hydrogen 3.034 N/A HIS 273.A N GLY 337.A O no hydrogen 2.811 N/A VAL 275.A N LEU 335.A O no hydrogen 3.072 N/A ARG 277.A N TRP 274.A O no hydrogen 2.387 N/A ARG 277.A NH2 THR 153.A O no hydrogen 3.044 N/A GLU 278.A N ASP 276.A OD1 no hydrogen 2.841 N/A MET 284.A N VAL 301.A O no hydrogen 2.657 N/A ARG 285.A NE THR 300.A OG1 no hydrogen 3.155 N/A ARG 285.A NH2 ASP 314.A OD1 no hydrogen 3.025 N/A CYS 286.A N CYS 299.A O no hydrogen 3.299 N/A CYS 286.A SG THR 287.A O no hydrogen 3.740 N/A THR 287.A N TYR 329.A O no hydrogen 3.293 N/A THR 287.A OG1 ASP 296.A OD2 no hydrogen 2.877 N/A THR 287.A OG1 TYR 329.A O no hydrogen 3.166 N/A VAL 288.A N ILE 297.A O no hydrogen 3.001 N/A LYS 289.A NZ GLN 294.A O no hydrogen 2.592 N/A LYS 289.A NZ ASP 296.A OD1 no hydrogen 2.639 N/A THR 290.A N GLN 294.A OE1 no hydrogen 3.280 N/A ARG 291.A NH2 THR 219.A OG1 no hydrogen 2.788 N/A GLN 294.A N ARG 291.A O no hydrogen 3.108 N/A GLN 294.A NE2 THR 295.A O no hydrogen 3.530 N/A ILE 297.A N VAL 288.A O no hydrogen 3.284 N/A CYS 299.A N CYS 286.A O no hydrogen 3.038 N/A THR 300.A N ILE 312.A O no hydrogen 2.784 N/A VAL 301.A N MET 284.A O no hydrogen 2.733 N/A LYS 302.A N GLU 310.A O no hydrogen 2.841 N/A LYS 302.A NZ GLU 310.A OE1 no hydrogen 3.253 N/A LYS 302.A NZ GLU 310.A OE2 no hydrogen 2.899 N/A ALA 303.A N GLY 282.A O no hydrogen 2.537 N/A ASP 305.A N ARG 308.A O no hydrogen 3.166 N/A ARG 308.A N ASP 306.A OD2 no hydrogen 3.243 N/A ILE 309.A N ALA 269.A O no hydrogen 2.944 N/A GLU 310.A N LYS 302.A O no hydrogen 2.924 N/A VAL 311.A N LEU 267.A O no hydrogen 2.954 N/A ILE 312.A N THR 300.A O no hydrogen 2.826 N/A PHE 313.A N VAL 265.A O no hydrogen 2.877 N/A VAL 317.A N SER 264.A O no hydrogen 2.992 N/A VAL 320.A N ALA 318.A O no hydrogen 3.084 N/A THR 321.A OG1 ALA 319.A O no hydrogen 3.087 N/A GLY 323.A N ILE 340.A O no hydrogen 2.792 N/A GLN 324.A N THR 321.A O no hydrogen 3.054 N/A GLN 324.A NE2 THR 91.A O no hydrogen 3.033 N/A SER 325.A OG TYR 152.A OH no hydrogen 2.726 N/A ALA 326.A N GLY 338.A O no hydrogen 2.629 N/A VAL 327.A N LYS 289.A O no hydrogen 3.134 N/A PHE 328.A N GLY 336.A O no hydrogen 3.207 N/A TYR 329.A N THR 287.A O no hydrogen 3.041 N/A TYR 329.A OH SER 148.A OG no hydrogen 2.655 N/A ASN 330.A N VAL 333.A O no hydrogen 2.890 N/A CYS 334.A N LEU 137.A O no hydrogen 2.834 N/A LEU 335.A N PHE 328.A O no hydrogen 2.887 N/A GLY 337.A N HIS 273.A O no hydrogen 2.827 N/A GLY 338.A N ALA 326.A O no hydrogen 2.971 N/A ILE 339.A N GLN 270.A O no hydrogen 2.767 N/A ILE 340.A N GLN 324.A O no hydrogen 2.844 N/A GLU 341.A N ILE 268.A O no hydrogen 2.583 N/A GLN 342.A N ILE 268.A O no hydrogen 3.206 N/A ARG 343.A NH1 ARG 261.A O no hydrogen 3.463 N/A LEU 344.A N GLY 266.A O no hydrogen 2.785 N/A