Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1mwk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ASP 97.A O no hydrogen 2.945 N/A PHE 4.A N GLN 15.A O no hydrogen 2.921 N/A ILE 5.A N VAL 99.A O no hydrogen 2.708 N/A ASP 6.A N LYS 13.A O no hydrogen 2.844 N/A ASP 7.A N ASP 7.A OD1 no hydrogen 2.547 N/A GLY 8.A N ASN 11.A O no hydrogen 3.180 N/A ILE 12.A N SER 28.A O no hydrogen 2.731 N/A LYS 13.A N ASP 6.A O no hydrogen 3.111 N/A LYS 13.A NZ ASP 6.A OD2 no hydrogen 3.553 N/A LEU 14.A N HIS 26.A O no hydrogen 2.709 N/A GLN 15.A N PHE 4.A O no hydrogen 3.020 N/A GLN 15.A NE2 ASN 313.A OD1 no hydrogen 3.014 N/A TRP 16.A N LYS 24.A O no hydrogen 3.068 N/A GLN 17.A NE2 GLY 21.A O no hydrogen 3.283 N/A GLU 18.A N THR 22.A O no hydrogen 2.871 N/A THR 22.A N ASP 20.A OD2 no hydrogen 3.003 N/A THR 22.A OG1 ASP 20.A OD1 no hydrogen 3.565 N/A THR 22.A OG1 ASP 20.A OD2 no hydrogen 2.803 N/A LYS 24.A N TRP 16.A O no hydrogen 2.868 N/A LYS 24.A NZ GLU 18.A OE2 no hydrogen 2.705 N/A HIS 26.A N LEU 14.A O no hydrogen 3.031 N/A HIS 26.A NE2 THR 88.A OG1 no hydrogen 3.069 N/A SER 28.A N ILE 12.A O no hydrogen 2.767 N/A ASN 30.A ND2 VAL 66.A O no hydrogen 3.130 N/A SER 31.A OG ASP 58.A O no hydrogen 2.981 N/A LYS 33.A N SER 56.A O no hydrogen 3.025 N/A LYS 33.A NZ SER 56.A OG no hydrogen 3.182 N/A SER 39.A OG LYS 43.A O no hydrogen 2.861 N/A PHE 40.A N ASP 42.A OD1 no hydrogen 3.155 N/A GLY 41.A N SER 39.A OG no hydrogen 3.005 N/A ASN 47.A ND2 ALA 37.A O no hydrogen 3.449 N/A TYR 48.A N TYR 55.A O no hydrogen 2.510 N/A THR 49.A N THR 131.A O no hydrogen 3.153 N/A LEU 50.A N GLU 53.A O no hydrogen 3.212 N/A TYR 55.A N TYR 48.A O no hydrogen 2.747 N/A TYR 55.A OH ASP 76.A OD1 no hydrogen 3.114 N/A SER 56.A N LYS 33.A O no hydrogen 3.036 N/A SER 56.A OG GLU 35.A O no hydrogen 2.672 N/A PHE 57.A N PHE 46.A O no hydrogen 3.108 N/A ASP 58.A N SER 31.A O no hydrogen 2.869 N/A ASP 63.A N SER 61.A OG no hydrogen 3.139 N/A ALA 64.A N SER 61.A O no hydrogen 2.806 N/A THR 68.A N SER 9.A O no hydrogen 2.777 N/A THR 68.A OG1 SER 9.A O no hydrogen 3.144 N/A TRP 72.A N ASN 69.A O no hydrogen 3.216 N/A TRP 72.A N ASN 69.A OD1 no hydrogen 2.972 N/A GLN 73.A N ILE 70.A O no hydrogen 3.019 N/A TYR 74.A N ALA 71.A O no hydrogen 2.947 N/A TYR 74.A OH GLU 106.A OE1 no hydrogen 2.826 N/A SER 75.A N TRP 72.A O no hydrogen 3.040 N/A SER 75.A OG TRP 72.A O no hydrogen 2.618 N/A ASN 78.A N SER 75.A OG no hydrogen 3.357 N/A ASN 78.A ND2 ASP 7.A OD2 no hydrogen 3.399 N/A VAL 80.A N ASP 76.A O no hydrogen 2.962 N/A ALA 81.A N VAL 77.A O no hydrogen 2.816 N/A VAL 82.A N ASN 78.A O no hydrogen 3.063 N/A HIS 83.A N VAL 79.A O no hydrogen 3.037 N/A HIS 84.A N VAL 80.A O no hydrogen 2.855 N/A ALA 85.A N ALA 81.A O no hydrogen 3.079 N/A LEU 86.A N VAL 82.A O no hydrogen 2.980 N/A LEU 87.A N HIS 83.A O no hydrogen 2.940 N/A THR 88.A N HIS 84.A O no hydrogen 3.112 N/A THR 88.A N ALA 85.A O no hydrogen 3.191 N/A THR 88.A OG1 HIS 26.A NE2 no hydrogen 3.069 N/A THR 88.A OG1 HIS 84.A O no hydrogen 3.188 N/A THR 88.A OG1 ALA 85.A O no hydrogen 3.363 N/A SER 89.A N LEU 86.A O no hydrogen 3.219 N/A SER 89.A OG LEU 86.A O no hydrogen 2.550 N/A LEU 91.A N SER 89.A OG no hydrogen 3.078 N/A SER 94.A OG GLU 95.A O no hydrogen 3.122 N/A VAL 96.A N THR 139.A O no hydrogen 2.753 N/A ASP 97.A N MET 1.A O no hydrogen 2.941 N/A ILE 98.A N ASP 142.A O no hydrogen 2.831 N/A VAL 99.A N VAL 3.A O no hydrogen 3.107 N/A CYS 100.A N LYS 144.A O no hydrogen 2.947 N/A CYS 100.A SG LYS 144.A O no hydrogen 3.799 N/A THR 101.A N ASP 7.A OD1 no hydrogen 3.140 N/A THR 101.A OG1 ASP 7.A OD1 no hydrogen 3.042 N/A LEU 102.A N MET 146.A O no hydrogen 3.211 N/A GLU 106.A N PRO 103.A O no hydrogen 2.846 N/A TYR 107.A N PRO 103.A O no hydrogen 2.816 N/A TYR 108.A N LEU 104.A O no hydrogen 3.118 N/A ASP 109.A N GLN 113.A O no hydrogen 2.864 N/A ASN 111.A N ASP 109.A OD1 no hydrogen 2.503 N/A ASN 112.A N ASP 109.A O no hydrogen 2.705 N/A ASN 115.A N TYR 107.A O no hydrogen 2.701 N/A ASN 118.A ND2 GLU 106.A O no hydrogen 2.927 N/A ILE 119.A N ASN 115.A O no hydrogen 3.146 N/A GLU 120.A N THR 116.A O no hydrogen 2.920 N/A ARG 121.A N GLU 117.A O no hydrogen 3.103 N/A LYS 122.A N ASN 118.A O no hydrogen 2.790 N/A LYS 122.A NZ ASP 7.A OD2 no hydrogen 3.116 N/A LYS 122.A NZ GLN 73.A O no hydrogen 3.088 N/A LYS 122.A NZ ASN 78.A OD1 no hydrogen 2.924 N/A LYS 123.A N ILE 119.A O no hydrogen 2.941 N/A LYS 123.A NZ GLU 120.A OE1 no hydrogen 3.400 N/A ALA 124.A N GLU 120.A O no hydrogen 2.850 N/A ASN 125.A N ARG 121.A O no hydrogen 3.216 N/A ASN 125.A N LYS 122.A O no hydrogen 3.257 N/A ASN 125.A ND2 SER 75.A O no hydrogen 2.947 N/A PHE 126.A N LYS 123.A O no hydrogen 3.250 N/A ARG 127.A N ALA 124.A O no hydrogen 2.937 N/A ARG 127.A NH2 LYS 123.A O no hydrogen 2.546 N/A LYS 128.A N ASN 125.A O no hydrogen 3.461 N/A LYS 128.A NZ ASP 76.A OD2 no hydrogen 2.683 N/A LYS 128.A NZ ASN 125.A OD1 no hydrogen 2.780 N/A THR 131.A N THR 49.A O no hydrogen 3.012 N/A ASN 133.A N ASN 47.A O no hydrogen 3.075 N/A GLY 135.A N LEU 132.A O no hydrogen 3.432 N/A THR 137.A OG1 ILE 130.A O no hydrogen 2.967 N/A THR 137.A OG1 PHE 138.A O no hydrogen 3.543 N/A THR 139.A N SER 94.A O no hydrogen 2.965 N/A LYS 141.A N VAL 96.A O no hydrogen 2.853 N/A ASP 142.A N ASP 97.A OD1 no hydrogen 2.733 N/A LYS 144.A N ILE 98.A O no hydrogen 2.912 N/A MET 146.A N CYS 100.A O no hydrogen 2.936 N/A GLU 148.A N LEU 102.A O no hydrogen 3.063 N/A SER 149.A OG ASP 170.A OD1 no hydrogen 2.858 N/A ALA 152.A N SER 149.A O no hydrogen 3.179 N/A GLY 153.A N ILE 150.A O no hydrogen 3.055 N/A TYR 154.A N PRO 151.A O no hydrogen 3.030 N/A LEU 157.A N GLY 153.A O no hydrogen 2.978 N/A GLN 158.A N TYR 154.A O no hydrogen 2.817 N/A GLU 159.A N VAL 156.A O no hydrogen 3.090 N/A LEU 160.A N LEU 157.A O no hydrogen 2.818 N/A ASP 161.A N ASP 164.A OD1 no hydrogen 2.882 N/A ASP 164.A N ASP 161.A O no hydrogen 2.636 N/A SER 165.A N THR 274.A OG1 no hydrogen 2.965 N/A SER 165.A OG GLN 180.A OE1 no hydrogen 2.883 N/A LEU 166.A N VAL 181.A O no hydrogen 2.719 N/A LEU 167.A N HIS 275.A O no hydrogen 2.862 N/A ILE 168.A N SER 179.A O no hydrogen 2.783 N/A ILE 169.A N MET 277.A O no hydrogen 2.785 N/A ASP 170.A N ASP 177.A O no hydrogen 2.826 N/A LEU 171.A N ILE 279.A O no hydrogen 2.993 N/A GLY 172.A N THR 175.A O no hydrogen 2.775 N/A LEU 176.A N ASP 194.A O no hydrogen 2.931 N/A ASP 177.A N ASP 170.A O no hydrogen 2.885 N/A ILE 178.A N TYR 192.A O no hydrogen 2.840 N/A SER 179.A N ILE 168.A O no hydrogen 3.063 N/A GLN 180.A N LYS 190.A O no hydrogen 2.797 N/A GLN 180.A NE2 SER 271.A O no hydrogen 3.297 N/A VAL 181.A N LEU 166.A O no hydrogen 2.782 N/A MET 182.A N GLY 187.A O no hydrogen 2.959 N/A GLY 183.A N ASP 164.A O no hydrogen 2.862 N/A LYS 184.A N LEU 157.A O no hydrogen 3.059 N/A LYS 184.A NZ LEU 160.A O no hydrogen 2.568 N/A SER 186.A N MET 182.A O no hydrogen 3.395 N/A SER 186.A OG GLY 183.A O no hydrogen 2.858 N/A SER 189.A N GLN 180.A O no hydrogen 2.947 N/A SER 189.A OG GLN 180.A O no hydrogen 3.055 N/A ILE 191.A N ASN 112.A OD1 no hydrogen 2.898 N/A TYR 192.A N ILE 178.A O no hydrogen 2.776 N/A ASP 194.A N LEU 176.A O no hydrogen 2.905 N/A SER 196.A N ASP 194.A OD2 no hydrogen 2.946 N/A SER 196.A OG ASP 194.A OD2 no hydrogen 2.986 N/A VAL 199.A N GLY 172.A O no hydrogen 3.016 N/A SER 200.A N GLY 173.A O no hydrogen 2.861 N/A SER 200.A OG GLY 173.A O no hydrogen 3.283 N/A LEU 201.A N GLY 198.A O no hydrogen 3.066 N/A VAL 202.A N VAL 199.A O no hydrogen 2.805 N/A THR 203.A N VAL 199.A O no hydrogen 2.967 N/A THR 203.A OG1 VAL 199.A O no hydrogen 3.561 N/A SER 204.A N SER 200.A O no hydrogen 2.754 N/A SER 204.A OG SER 200.A O no hydrogen 2.743 N/A SER 204.A OG LEU 201.A O no hydrogen 3.327 N/A VAL 206.A N VAL 202.A O no hydrogen 3.060 N/A LYS 207.A N THR 203.A O no hydrogen 2.917 N/A LYS 207.A NZ SER 219.A OG no hydrogen 2.881 N/A ASP 208.A N SER 204.A O no hydrogen 2.934 N/A ALA 209.A N ALA 205.A O no hydrogen 3.213 N/A LEU 210.A N VAL 206.A O no hydrogen 3.202 N/A LEU 210.A N LYS 207.A O no hydrogen 3.372 N/A LEU 212.A N LYS 207.A O no hydrogen 3.069 N/A SER 218.A N THR 215.A O no hydrogen 3.105 N/A SER 218.A OG ALA 213.A O no hydrogen 2.563 N/A SER 218.A OG THR 215.A O no hydrogen 2.512 N/A TYR 220.A N LYS 216.A O no hydrogen 3.121 N/A LEU 221.A N GLY 217.A O no hydrogen 3.278 N/A ALA 222.A N SER 218.A O no hydrogen 2.777 N/A ASP 223.A N SER 219.A O no hydrogen 2.864 N/A ASP 224.A N TYR 220.A O no hydrogen 2.888 N/A ILE 225.A N LEU 221.A O no hydrogen 2.918 N/A ILE 226.A N ALA 222.A O no hydrogen 3.083 N/A ILE 227.A N ASP 223.A O no hydrogen 2.943 N/A HIS 228.A N ASP 224.A O no hydrogen 2.939 N/A ARG 229.A N ILE 226.A O no hydrogen 3.177 N/A ARG 229.A NH2 ILE 226.A O no hydrogen 2.815 N/A ASP 231.A N HIS 228.A O no hydrogen 2.865 N/A TYR 234.A N ASP 231.A OD1 no hydrogen 2.809 N/A LEU 235.A N ASP 231.A O no hydrogen 3.339 N/A LYS 236.A N ASN 232.A O no hydrogen 2.978 N/A GLN 237.A N ASN 233.A O no hydrogen 3.133 N/A GLN 237.A NE2 ASN 233.A O no hydrogen 3.284 N/A ARG 238.A N TYR 234.A O no hydrogen 3.064 N/A ARG 238.A NE TYR 234.A OH no hydrogen 2.916 N/A ARG 238.A NH2 TYR 234.A OH no hydrogen 3.432 N/A ILE 239.A N LEU 235.A O no hydrogen 2.729 N/A ASP 241.A N ILE 239.A O no hydrogen 3.104 N/A ASN 243.A N ASP 241.A OD1 no hydrogen 2.629 N/A LYS 244.A N ASP 241.A OD1 no hydrogen 3.112 N/A LYS 244.A NZ ALA 209.A O no hydrogen 3.280 N/A ILE 245.A N ASP 241.A O no hydrogen 3.070 N/A SER 246.A N GLU 242.A O no hydrogen 3.303 N/A SER 246.A OG GLU 242.A O no hydrogen 3.415 N/A ILE 247.A N ASN 243.A O no hydrogen 3.120 N/A VAL 248.A N LYS 244.A O no hydrogen 2.837 N/A THR 249.A N ILE 245.A O no hydrogen 2.836 N/A THR 249.A OG1 ILE 245.A O no hydrogen 3.093 N/A GLU 250.A N SER 246.A O no hydrogen 3.175 N/A ALA 251.A N ILE 247.A O no hydrogen 3.154 N/A MET 252.A N VAL 248.A O no hydrogen 2.940 N/A ASN 253.A N THR 249.A O no hydrogen 2.865 N/A GLU 254.A N GLU 250.A O no hydrogen 2.945 N/A ALA 255.A N ALA 251.A O no hydrogen 2.875 N/A LEU 256.A N MET 252.A O no hydrogen 2.879 N/A ARG 257.A N ASN 253.A O no hydrogen 3.109 N/A LYS 258.A N GLU 254.A O no hydrogen 3.130 N/A LEU 259.A N ALA 255.A O no hydrogen 2.926 N/A GLU 260.A N LEU 256.A O no hydrogen 2.849 N/A GLN 261.A N ARG 257.A O no hydrogen 2.929 N/A ARG 262.A N LYS 258.A O no hydrogen 3.041 N/A VAL 263.A N LEU 259.A O no hydrogen 3.018 N/A LEU 264.A N GLU 260.A O no hydrogen 2.937 N/A ASN 265.A N GLN 261.A O no hydrogen 2.903 N/A THR 266.A N ARG 262.A O no hydrogen 3.376 N/A THR 266.A N VAL 263.A O no hydrogen 3.171 N/A THR 266.A OG1 ARG 262.A O no hydrogen 3.208 N/A LEU 267.A N VAL 263.A O no hydrogen 2.979 N/A ASN 268.A N LEU 264.A O no hydrogen 2.879 N/A GLU 269.A N THR 266.A O no hydrogen 2.930 N/A PHE 270.A N LEU 267.A O no hydrogen 2.887 N/A THR 274.A N SER 165.A O no hydrogen 2.771 N/A THR 274.A OG1 SER 165.A O no hydrogen 3.266 N/A THR 274.A OG1 HIS 275.A ND1 no hydrogen 2.514 N/A HIS 275.A N SER 165.A O no hydrogen 3.087 N/A HIS 275.A ND1 THR 274.A OG1 no hydrogen 2.514 N/A VAL 276.A N ARG 300.A O no hydrogen 2.929 N/A MET 277.A N LEU 167.A O no hydrogen 2.870 N/A VAL 278.A N PHE 302.A O no hydrogen 2.950 N/A ILE 279.A N ILE 169.A O no hydrogen 2.762 N/A GLY 280.A N ASN 305.A OD1 no hydrogen 2.910 N/A GLY 282.A N LEU 171.A O no hydrogen 2.824 N/A ALA 283.A N GLY 280.A O no hydrogen 3.056 N/A LEU 285.A N GLY 282.A O no hydrogen 3.098 N/A ILE 286.A N ALA 283.A O no hydrogen 3.305 N/A CYS 287.A N ALA 283.A O no hydrogen 2.990 N/A VAL 290.A N ILE 286.A O no hydrogen 3.045 N/A LYS 291.A N CYS 287.A O no hydrogen 3.167 N/A LYS 291.A NZ ASP 298.A OD2 no hydrogen 3.488 N/A LYS 292.A N ASP 288.A O no hydrogen 3.037 N/A HIS 293.A N ALA 289.A O no hydrogen 3.029 N/A THR 294.A N VAL 290.A O no hydrogen 2.778 N/A THR 294.A OG1 VAL 290.A O no hydrogen 2.789 N/A THR 294.A OG1 LYS 291.A O no hydrogen 3.563 N/A GLN 295.A N LYS 291.A O no hydrogen 2.967 N/A ARG 300.A N ARG 297.A O no hydrogen 2.857 N/A PHE 301.A N ASP 298.A O no hydrogen 3.133 N/A PHE 302.A N VAL 276.A O no hydrogen 2.887 N/A LYS 303.A NZ GLU 284.A OE1 no hydrogen 2.922 N/A ASN 305.A ND2 GLY 280.A O no hydrogen 3.410 N/A ASN 306.A N ASP 310.A OD1 no hydrogen 3.064 N/A SER 307.A N ASP 310.A OD1 no hydrogen 3.376 N/A SER 307.A N ASP 310.A OD2 no hydrogen 3.381 N/A TYR 309.A N SER 307.A OG no hydrogen 3.366 N/A ASP 310.A N SER 307.A O no hydrogen 3.280 N/A ASN 313.A N TYR 309.A O no hydrogen 2.803 N/A GLY 314.A N ASP 310.A O no hydrogen 2.917 N/A MET 315.A N LEU 311.A O no hydrogen 2.933 N/A TYR 316.A N VAL 312.A O no hydrogen 2.932 N/A LEU 317.A N ASN 313.A O no hydrogen 2.888 N/A ILE 318.A N GLY 314.A O no hydrogen 3.084 N/A GLY 319.A N MET 315.A O no hydrogen 3.078 N/A ASN 320.A N TYR 316.A O no hydrogen 2.650 N/A ASN 320.A ND2 GLN 17.A OE1 no hydrogen 3.697 N/A