Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wwz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A NE2 GLU 27.A OE1 no hydrogen 2.743 N/A ARG 3.A N GLU 47.A OE1 no hydrogen 3.139 N/A ARG 3.A NH2 GLY 45.A O no hydrogen 3.375 N/A ILE 4.A N GLU 27.A O no hydrogen 3.001 N/A LEU 5.A N VAL 48.A O no hydrogen 3.068 N/A PHE 6.A N HIS 29.A O no hydrogen 2.680 N/A PHE 7.A N CYS 50.A O no hydrogen 3.155 N/A SER 8.A N ALA 33.A O no hydrogen 2.943 N/A SER 8.A OG ASP 55.A OD1 no hydrogen 2.553 N/A SER 9.A N GLN 31.A O no hydrogen 3.119 N/A SER 9.A OG PHE 6.A O no hydrogen 3.016 N/A SER 9.A OG GLN 31.A O no hydrogen 3.110 N/A GLN 10.A N ASP 13.A OD2 no hydrogen 2.840 N/A SER 14.A N GLN 10.A O no hydrogen 3.267 N/A GLU 15.A N ALA 11.A O no hydrogen 3.008 N/A SER 16.A N TYR 12.A O no hydrogen 3.164 N/A SER 16.A OG TYR 12.A O no hydrogen 2.809 N/A SER 16.A OG ASP 13.A O no hydrogen 3.176 N/A PHE 17.A N ASP 13.A O no hydrogen 2.894 N/A GLN 18.A N SER 14.A O no hydrogen 2.995 N/A ALA 19.A N GLU 15.A O no hydrogen 3.174 N/A SER 20.A N SER 16.A O no hydrogen 3.010 N/A SER 20.A OG SER 16.A O no hydrogen 3.304 N/A SER 20.A OG ASP 310.A OD1 no hydrogen 2.678 N/A ASN 21.A N PHE 17.A O no hydrogen 3.059 N/A ASN 21.A N GLN 18.A O no hydrogen 3.261 N/A ASN 21.A ND2 PHE 26.A O no hydrogen 2.838 N/A HIS 22.A N.A ALA 19.A O no hydrogen 3.390 N/A HIS 22.A N.B ALA 19.A O no hydrogen 3.428 N/A HIS 22.A ND1.A ALA 19.A O no hydrogen 2.825 N/A ARG 23.A NH1 ASP 314.A OD1 no hydrogen 2.813 N/A ARG 23.A NH1 ASP 314.A OD2 no hydrogen 3.353 N/A ARG 23.A NH2 ASP 314.A OD2 no hydrogen 2.882 N/A HIS 24.A N ASN 21.A O no hydrogen 2.959 N/A GLY 25.A N ASN 21.A O no hydrogen 3.054 N/A PHE 26.A N ASN 21.A OD1 no hydrogen 2.938 N/A GLU 27.A N MET 2.A O no hydrogen 2.958 N/A HIS 29.A N ILE 4.A O no hydrogen 2.904 N/A HIS 29.A NE2 GLU 27.A OE2 no hydrogen 2.872 N/A GLN 31.A N PHE 6.A O no hydrogen 2.746 N/A ALA 33.A N GLN 31.A OE1 no hydrogen 3.187 N/A LEU 35.A N ASP 55.A OD1 no hydrogen 2.779 N/A GLN 36.A N THR 39.A OG1 no hydrogen 2.679 N/A GLN 36.A NE2 ASP 38.A OD1 no hydrogen 2.612 N/A THR 39.A N GLN 36.A O no hydrogen 2.938 N/A THR 39.A OG1 HIS 34.A O no hydrogen 2.631 N/A THR 39.A OG1 GLN 36.A O no hydrogen 3.072 N/A LEU 42.A N THR 39.A O no hydrogen 2.949 N/A ALA 43.A N ALA 40.A O no hydrogen 2.837 N/A GLN 44.A N VAL 41.A O no hydrogen 2.904 N/A GLY 45.A N GLY 68.A O no hydrogen 3.255 N/A PHE 46.A N ALA 43.A O no hydrogen 3.247 N/A GLU 47.A N GLU 47.A OE2 no hydrogen 2.734 N/A VAL 48.A N ARG 3.A O no hydrogen 3.382 N/A VAL 49.A N LEU 72.A O no hydrogen 3.063 N/A CYS 50.A N LEU 5.A O no hydrogen 2.726 N/A CYS 50.A SG ALA 74.A O no hydrogen 3.480 N/A ALA 51.A N ALA 74.A O no hydrogen 2.818 N/A PHE 52.A N ASP 55.A OD2 no hydrogen 3.011 N/A ASN 54.A N ASN 54.A OD1 no hydrogen 2.531 N/A ASP 55.A N PHE 52.A O no hydrogen 3.043 N/A ASP 56.A N LEU 35.A O no hydrogen 2.901 N/A LEU 57.A N HIS 82.A O no hydrogen 2.855 N/A SER 58.A N ASP 56.A OD1 no hydrogen 3.111 N/A SER 58.A OG ASP 56.A OD1 no hydrogen 2.660 N/A ARG 59.A NH1 GLU 63.A OE1 no hydrogen 2.504 N/A LEU 62.A N SER 58.A O no hydrogen 3.039 N/A GLU 63.A N ARG 59.A O no hydrogen 2.713 N/A ARG 64.A N PRO 60.A O no hydrogen 3.196 N/A LEU 65.A N VAL 61.A O no hydrogen 3.127 N/A ALA 66.A N LEU 62.A O no hydrogen 2.843 N/A ALA 67.A N GLU 63.A O no hydrogen 3.158 N/A GLY 68.A N LEU 65.A O no hydrogen 2.937 N/A GLY 69.A N ALA 66.A O no hydrogen 3.254 N/A THR 70.A N LEU 65.A O no hydrogen 2.996 N/A THR 70.A OG1 PHE 46.A O no hydrogen 2.833 N/A THR 70.A OG1 LEU 65.A O no hydrogen 3.472 N/A ARG 71.A N GLU 47.A O no hydrogen 2.840 N/A LEU 72.A N GLU 47.A O no hydrogen 3.072 N/A VAL 73.A N PRO 94.A O no hydrogen 3.064 N/A ALA 74.A N VAL 49.A O no hydrogen 2.886 N/A LEU 75.A N VAL 96.A O no hydrogen 2.866 N/A ARG 76.A N ALA 51.A O no hydrogen 2.968 N/A ARG 76.A NE ASP 13.A OD1 no hydrogen 3.109 N/A ARG 76.A NH1 PHE 7.A O no hydrogen 3.311 N/A ARG 76.A NH1 CYS 50.A O no hydrogen 3.293 N/A ARG 76.A NH2 PHE 7.A O no hydrogen 2.809 N/A ARG 76.A NH2 ASP 13.A OD2 no hydrogen 3.495 N/A SER 77.A OG GLY 79.A O no hydrogen 2.788 N/A ALA 78.A N TYR 101.A OH no hydrogen 3.048 N/A HIS 82.A ND1 ASP 55.A O no hydrogen 2.877 N/A VAL 83.A N TYR 80.A O no hydrogen 2.845 N/A ASP 84.A N LEU 57.A O no hydrogen 2.700 N/A ALA 87.A N ASP 84.A OD1 no hydrogen 3.280 N/A ALA 88.A N ASP 84.A O no hydrogen 3.014 N/A GLU 89.A N LEU 85.A O no hydrogen 2.717 N/A ALA 90.A N ALA 86.A O no hydrogen 2.842 N/A LEU 91.A N ALA 87.A O no hydrogen 3.261 N/A GLY 92.A N GLU 89.A O no hydrogen 3.425 N/A LEU 93.A N ALA 88.A O no hydrogen 3.016 N/A VAL 96.A N VAL 73.A O no hydrogen 3.044 N/A HIS 97.A N ASN 326.A O no hydrogen 3.169 N/A HIS 97.A ND1 ALA 78.A O no hydrogen 2.966 N/A VAL 98.A N SER 77.A O no hydrogen 3.009 N/A ALA 105.A N SER 102.A OG no hydrogen 3.286 N/A VAL 106.A N SER 102.A O no hydrogen 3.207 N/A ALA 107.A N PRO 103.A O no hydrogen 2.980 N/A GLU 108.A N HIS 104.A O no hydrogen 2.945 N/A HIS 109.A N ALA 105.A O no hydrogen 3.078 N/A HIS 109.A NE2 THR 294.A OG1 no hydrogen 2.884 N/A ALA 110.A N VAL 106.A O no hydrogen 3.143 N/A VAL 111.A N ALA 107.A O no hydrogen 3.124 N/A GLY 112.A N GLU 108.A O no hydrogen 2.941 N/A LEU 113.A N HIS 109.A O no hydrogen 2.989 N/A ILE 114.A N ALA 110.A O no hydrogen 3.043 N/A LEU 115.A N VAL 111.A O no hydrogen 3.007 N/A THR 116.A N GLY 112.A O no hydrogen 2.956 N/A THR 116.A OG1 GLY 112.A O no hydrogen 2.770 N/A LEU 117.A N LEU 113.A O no hydrogen 3.096 N/A ASN 118.A N ILE 114.A O no hydrogen 2.969 N/A ASN 118.A ND2 PHE 141.A O no hydrogen 2.727 N/A ARG 119.A N LEU 115.A O no hydrogen 2.937 N/A ARG 120.A N LEU 117.A O no hydrogen 3.373 N/A ARG 120.A NH1 ASN 118.A O no hydrogen 2.842 N/A ARG 120.A NH1 TYR 255.A OH no hydrogen 2.909 N/A LEU 121.A N THR 116.A O no hydrogen 3.072 N/A ALA 124.A N ARG 120.A O no hydrogen 2.910 N/A TYR 125.A N LEU 121.A O no hydrogen 2.884 N/A ASN 126.A N HIS 122.A O no hydrogen 3.267 N/A ARG 127.A N ARG 123.A O no hydrogen 3.054 N/A ARG 127.A NH1 SER 134.A O no hydrogen 2.910 N/A ARG 127.A NH1 HIS 136.A O no hydrogen 2.867 N/A ARG 127.A NH2 HIS 136.A O no hydrogen 2.771 N/A THR 128.A N ALA 124.A O no hydrogen 2.943 N/A THR 128.A OG1 ALA 124.A O no hydrogen 3.265 N/A THR 128.A OG1 TYR 125.A O no hydrogen 3.326 N/A ARG 129.A N TYR 125.A O no hydrogen 2.998 N/A ARG 129.A NH2 ASN 126.A OD1 no hydrogen 3.023 N/A GLU 130.A N ARG 127.A O no hydrogen 3.046 N/A GLY 131.A N THR 128.A O no hydrogen 2.994 N/A ASP 132.A N ARG 127.A O no hydrogen 2.943 N/A SER 134.A N ASP 132.A OD1 no hydrogen 2.980 N/A SER 134.A OG ASP 132.A OD1 no hydrogen 2.765 N/A SER 134.A OG ASP 132.A OD2 no hydrogen 3.552 N/A LEU 138.A N LEU 135.A O no hydrogen 3.117 N/A PHE 141.A N ASN 118.A OD1 no hydrogen 2.846 N/A GLY 145.A N GLY 168.A O no hydrogen 2.904 N/A LYS 146.A N LEU 143.A O no hydrogen 3.073 N/A LYS 146.A NZ ASP 142.A O no hydrogen 2.867 N/A ARG 147.A N ASP 200.A OD2 no hydrogen 2.947 N/A ARG 147.A NE GLU 170.A OE1 no hydrogen 3.448 N/A VAL 148.A N GLU 170.A O no hydrogen 2.891 N/A GLY 149.A N ILE 201.A O no hydrogen 2.691 N/A VAL 150.A N LEU 172.A O no hydrogen 2.792 N/A ILE 151.A N SER 203.A O no hydrogen 3.031 N/A GLY 152.A N TYR 174.A O no hydrogen 2.901 N/A THR 153.A N ASP 175.A OD1 no hydrogen 3.185 N/A THR 153.A OG1 TYR 189.A OH no hydrogen 2.746 N/A GLU 158.A N GLY 154.A O no hydrogen 2.868 N/A THR 159.A N GLN 155.A O no hydrogen 3.057 N/A THR 159.A OG1 GLN 155.A O no hydrogen 2.677 N/A PHE 160.A N ILE 156.A O no hydrogen 2.889 N/A ALA 161.A N GLY 157.A O no hydrogen 2.933 N/A ARG 162.A N GLU 158.A O no hydrogen 2.958 N/A ARG 162.A NH1 GLU 158.A OE2 no hydrogen 3.419 N/A ARG 162.A NH2 GLU 158.A OE2 no hydrogen 3.017 N/A ILE 163.A N THR 159.A O no hydrogen 3.329 N/A MET 164.A N PHE 160.A O no hydrogen 3.004 N/A ALA 165.A N ALA 161.A O no hydrogen 3.041 N/A GLY 166.A N ARG 162.A O no hydrogen 3.165 N/A GLY 166.A N ILE 163.A O no hydrogen 3.027 N/A PHE 167.A N MET 164.A O no hydrogen 3.069 N/A GLY 168.A N ALA 165.A O no hydrogen 2.778 N/A CYS 169.A N MET 164.A O no hydrogen 3.447 N/A CYS 169.A SG LEU 143.A O no hydrogen 3.263 N/A GLU 170.A N LYS 146.A O no hydrogen 2.788 N/A LEU 172.A N VAL 148.A O no hydrogen 2.906 N/A ALA 173.A N ARG 188.A O no hydrogen 2.897 N/A TYR 174.A N VAL 150.A O no hydrogen 2.932 N/A TYR 177.A N ASP 175.A OD2 no hydrogen 2.847 N/A ASN 179.A N TYR 189.A OH no hydrogen 3.025 N/A ARG 181.A NE ASN 179.A OD1 no hydrogen 3.348 N/A ILE 182.A N ASN 179.A OD1 no hydrogen 3.085 N/A ALA 184.A N PRO 180.A O no hydrogen 2.975 N/A LEU 185.A N ARG 181.A O no hydrogen 3.270 N/A GLY 186.A N GLN 183.A O no hydrogen 2.775 N/A GLY 187.A N ILE 182.A O no hydrogen 2.904 N/A ARG 188.A N LEU 171.A O no hydrogen 2.969 N/A ARG 188.A NH2 GLU 198.A OE1 no hydrogen 2.961 N/A ARG 188.A NH2 GLU 198.A OE2 no hydrogen 3.148 N/A TYR 189.A OH THR 153.A OG1 no hydrogen 2.746 N/A LEU 190.A N ALA 173.A O no hydrogen 3.072 N/A LEU 195.A N ALA 191.A O no hydrogen 2.829 N/A LEU 196.A N LEU 192.A O no hydrogen 2.997 N/A ALA 197.A N ASP 193.A O no hydrogen 3.092 N/A GLU 198.A N ALA 194.A O no hydrogen 3.053 N/A SER 199.A N LEU 195.A O no hydrogen 3.103 N/A SER 199.A OG LEU 195.A O no hydrogen 2.934 N/A ASP 200.A N ARG 147.A O no hydrogen 2.887 N/A ILE 201.A N ARG 147.A O no hydrogen 3.226 N/A VAL 202.A N MET 229.A O no hydrogen 2.865 N/A SER 203.A N GLY 149.A O no hydrogen 2.896 N/A SER 203.A OG HIS 205.A NE2 no hydrogen 2.716 N/A LEU 204.A N ILE 231.A O no hydrogen 2.935 N/A HIS 205.A N ILE 151.A O no hydrogen 2.705 N/A THR 209.A N THR 212.A OG1 no hydrogen 2.758 N/A THR 209.A OG1 THR 212.A OG1 no hydrogen 3.180 N/A THR 212.A N THR 209.A O no hydrogen 2.935 N/A THR 212.A N THR 209.A OG1 no hydrogen 3.339 N/A THR 212.A OG1 PRO 207.A O no hydrogen 2.858 N/A THR 212.A OG1 THR 209.A O no hydrogen 3.241 N/A THR 212.A OG1 THR 209.A OG1 no hydrogen 3.180 N/A ARG 213.A NH2 GLU 262.A OE2 no hydrogen 3.250 N/A HIS 214.A N ALA 237.A O no hydrogen 2.840 N/A HIS 214.A NE2 GLU 262.A OE1 no hydrogen 2.880 N/A LEU 215.A N THR 212.A O no hydrogen 3.032 N/A ILE 216.A N LEU 238.A O no hydrogen 3.029 N/A ARG 220.A N ASP 217.A OD1 no hydrogen 2.946 N/A ARG 220.A NE ASP 193.A OD1 no hydrogen 3.212 N/A ARG 220.A NH1 LEU 215.A O no hydrogen 2.785 N/A LEU 221.A N ASP 217.A O no hydrogen 2.907 N/A ALA 222.A N ALA 218.A O no hydrogen 3.042 N/A THR 223.A N GLN 219.A O no hydrogen 3.071 N/A THR 223.A OG1 GLN 219.A O no hydrogen 3.280 N/A MET 224.A N ARG 220.A O no hydrogen 3.229 N/A MET 224.A N LEU 221.A O no hydrogen 3.245 N/A LYS 225.A NZ ASP 200.A OD1 no hydrogen 2.930 N/A GLY 227.A N GLN 252.A O no hydrogen 2.882 N/A ALA 228.A N LYS 225.A O no hydrogen 3.051 N/A MET 229.A N ASP 200.A O no hydrogen 3.060 N/A LEU 230.A N TYR 255.A O no hydrogen 3.031 N/A ILE 231.A N VAL 202.A O no hydrogen 2.824 N/A ASN 232.A N GLY 257.A O no hydrogen 2.901 N/A ASN 232.A ND2 ARG 235.A O no hydrogen 3.038 N/A GLY 234.A N ASN 232.A OD1 no hydrogen 2.885 N/A LEU 238.A N ARG 235.A O no hydrogen 3.066 N/A VAL 239.A N GLY 236.A O no hydrogen 3.358 N/A ASN 240.A N ILE 216.A O no hydrogen 3.023 N/A ALA 243.A N ASN 240.A O no hydrogen 3.051 N/A LEU 244.A N ALA 241.A O no hydrogen 2.929 N/A ILE 245.A N ALA 242.A O no hydrogen 3.315 N/A LEU 248.A N LEU 244.A O no hydrogen 2.870 N/A LYS 249.A N ILE 245.A O no hydrogen 2.990 N/A LYS 249.A NZ GLU 246.A OE2 no hydrogen 2.913 N/A SER 250.A N GLU 246.A O no hydrogen 3.001 N/A SER 250.A OG GLU 246.A O no hydrogen 3.461 N/A SER 250.A OG ALA 247.A O no hydrogen 3.256 N/A GLY 251.A N LEU 248.A O no hydrogen 3.214 N/A GLN 252.A N SER 250.A OG no hydrogen 3.130 N/A GLN 252.A NE2 LEU 221.A O no hydrogen 3.112 N/A GLN 252.A NE2 MET 224.A O no hydrogen 2.916 N/A LEU 253.A N ALA 247.A O no hydrogen 3.086 N/A TYR 255.A N ALA 228.A O no hydrogen 3.315 N/A LEU 256.A N ASN 290.A O no hydrogen 3.069 N/A GLY 257.A N LEU 230.A O no hydrogen 2.921 N/A LEU 258.A N VAL 292.A O no hydrogen 2.991 N/A ASP 259.A N ASN 232.A O no hydrogen 3.027 N/A TYR 261.A N GLU 264.A OE1 no hydrogen 2.964 N/A TYR 261.A OH ASP 279.A OD1 no hydrogen 3.369 N/A TYR 261.A OH ASP 279.A OD2 no hydrogen 2.807 N/A GLU 264.A N TYR 261.A O no hydrogen 2.890 N/A ASP 266.A N GLU 263.A O no hydrogen 3.191 N/A ILE 267.A N GLU 264.A O no hydrogen 2.843 N/A PHE 268.A N GLU 264.A O no hydrogen 2.777 N/A ARG 272.A NE ILE 267.A O no hydrogen 2.834 N/A SER 273.A N ASP 271.A OD1 no hydrogen 2.967 N/A SER 273.A OG ASP 271.A OD1 no hydrogen 2.637 N/A SER 273.A OG ASP 271.A OD2 no hydrogen 3.536 N/A GLN 275.A N ARG 272.A O no hydrogen 3.451 N/A LEU 282.A N ASP 279.A OD1 no hydrogen 3.066 N/A ALA 283.A N ASP 279.A O no hydrogen 3.030 N/A ARG 284.A N ASP 280.A O no hydrogen 3.094 N/A LEU 285.A N VAL 281.A O no hydrogen 3.055 N/A LEU 286.A N LEU 282.A O no hydrogen 3.038 N/A SER 287.A N ARG 284.A O no hydrogen 3.214 N/A SER 287.A OG ALA 283.A O no hydrogen 3.552 N/A SER 287.A OG ARG 284.A O no hydrogen 3.263 N/A PHE 288.A N LEU 285.A O no hydrogen 3.288 N/A ASN 290.A N ASN 290.A OD1 no hydrogen 2.520 N/A ASN 290.A ND2 GLY 254.A O no hydrogen 2.907 N/A VAL 291.A N PHE 288.A O no hydrogen 3.441 N/A VAL 292.A N LEU 256.A O no hydrogen 3.034 N/A THR 294.A N LEU 258.A O no hydrogen 2.856 N/A THR 294.A OG1 HIS 109.A NE2 no hydrogen 2.884 N/A THR 294.A OG1 ASP 259.A OD1 no hydrogen 2.601 N/A HIS 296.A N ASP 259.A O no hydrogen 2.961 N/A HIS 296.A N THR 294.A O no hydrogen 2.996 N/A HIS 296.A ND1 GLU 264.A OE2 no hydrogen 2.581 N/A GLN 297.A N ASP 259.A OD1 no hydrogen 2.796 N/A ALA 298.A N ASP 259.A OD2 no hydrogen 3.011 N/A LEU 300.A N GLN 297.A O no hydrogen 2.911 N/A THR 301.A N PHE 299.A O no hydrogen 3.002 N/A ARG 302.A NH1 GLU 15.A OE2 no hydrogen 2.975 N/A ALA 304.A N THR 301.A OG1 no hydrogen 3.109 N/A LEU 305.A N THR 301.A O no hydrogen 3.046 N/A ALA 306.A N ARG 302.A O no hydrogen 2.957 N/A ALA 307.A N GLU 303.A O no hydrogen 3.029 N/A ILE 308.A N ALA 304.A O no hydrogen 3.021 N/A ALA 309.A N LEU 305.A O no hydrogen 2.860 N/A ASP 310.A N ALA 306.A O no hydrogen 2.914 N/A THR 311.A N ALA 307.A O no hydrogen 2.918 N/A THR 311.A OG1 ALA 307.A O no hydrogen 3.073 N/A THR 312.A N ILE 308.A O no hydrogen 2.991 N/A THR 312.A OG1 ILE 308.A O no hydrogen 2.942 N/A LEU 313.A N ALA 309.A O no hydrogen 2.980 N/A ASP 314.A N ASP 310.A O no hydrogen 3.071 N/A ASN 315.A N THR 311.A O no hydrogen 2.807 N/A ASN 315.A ND2 HIS 97.A O no hydrogen 3.014 N/A ILE 316.A N THR 312.A O no hydrogen 2.977 N/A ALA 317.A N LEU 313.A O no hydrogen 2.889 N/A ALA 318.A N ASP 314.A O no hydrogen 2.977 N/A TRP 319.A N ASN 315.A O no hydrogen 3.140 N/A GLN 320.A N ILE 316.A O no hydrogen 3.036 N/A ASP 321.A N ALA 317.A O no hydrogen 3.022 N/A ASP 321.A N ALA 318.A O no hydrogen 3.172 N/A GLY 322.A N TRP 319.A O no hydrogen 2.898 N/A THR 323.A N ALA 318.A O no hydrogen 2.957 N/A THR 323.A OG1 THR 323.A O no hydrogen 2.348 N/A ARG 325.A NE ASN 315.A OD1 no hydrogen 3.203 N/A ARG 325.A NH2 ASN 315.A OD1 no hydrogen 3.140 N/A ASN 326.A ND2 ASN 315.A OD1 no hydrogen 2.804 N/A ARG 327.A NH1 PRO 324.A O no hydrogen 3.453 N/A VAL 328.A N VAL 95.A O no hydrogen 3.058 N/A