Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wer_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N ASP 33.A OD2.B no hydrogen 2.863 N/A ALA 4.A N GLU 34.A O no hydrogen 3.009 N/A VAL 5.A N.A SER 60.A O no hydrogen 3.180 N/A VAL 5.A N.B SER 60.A O no hydrogen 3.187 N/A LEU 6.A N VAL 36.A O no hydrogen 2.670 N/A ILE 7.A N PHE 62.A O no hydrogen 2.721 N/A VAL 8.A N LYS 38.A O no hydrogen 2.724 N/A ASN 9.A ND2 THR 68.A OG1 no hydrogen 2.982 N/A SER 11.A N ASN 9.A OD1 no hydrogen 2.960 N/A SER 11.A OG ASN 9.A OD1 no hydrogen 2.745 N/A SER 12.A N ASN 9.A O no hydrogen 2.957 N/A ALA 17.A N GLY 14.A O no hydrogen 3.476 N/A LYS 18.A NZ GLU 21.A OE1 no hydrogen 3.188 N/A PHE 20.A N LYS 16.A O no hydrogen 3.062 N/A GLU 21.A N ALA 17.A O no hydrogen 3.090 N/A THR 22.A N LYS 18.A O no hydrogen 3.293 N/A THR 22.A OG1 LYS 18.A O no hydrogen 3.399 N/A LEU 23.A N GLU 19.A O no hydrogen 3.091 N/A ALA 24.A N PHE 20.A O no hydrogen 3.006 N/A GLU 25.A N GLU 21.A O no hydrogen 2.908 N/A GLU 26.A N THR 22.A O no hydrogen 2.999 N/A LYS 27.A N LEU 23.A O no hydrogen 2.924 N/A LYS 27.A NZ ILE 109.A O no hydrogen 2.936 N/A LYS 27.A NZ GLN 110.A O no hydrogen 3.283 N/A LYS 27.A NZ LEU 112.A O no hydrogen 3.222 N/A LEU 28.A N ALA 24.A O no hydrogen 2.896 N/A LYS 29.A N GLU 25.A O no hydrogen 2.969 N/A LYS 29.A NZ GLU 25.A OE2 no hydrogen 3.382 N/A GLN 30.A N LYS 27.A O no hydrogen 3.032 N/A LEU 31.A N LEU 28.A O no hydrogen 2.943 N/A PHE 32.A N LEU 28.A O no hydrogen 2.715 N/A ASP 33.A N.A LYS 2.A O no hydrogen 3.091 N/A ASP 33.A N.B LYS 2.A O no hydrogen 3.072 N/A GLU 34.A N LYS 2.A O no hydrogen 3.455 N/A VAL 36.A N ALA 4.A O no hydrogen 2.847 N/A LYS 38.A N LEU 6.A O no hydrogen 2.771 N/A GLN 39.A NE2 GLU 21.A OE2 no hydrogen 3.119 N/A THR 40.A N VAL 8.A O no hydrogen 2.850 N/A THR 40.A OG1 VAL 8.A O no hydrogen 3.432 N/A GLU 41.A N ASP 45.A OD2 no hydrogen 2.753 N/A LYS 42.A N ASP 45.A OD2 no hydrogen 2.985 N/A LYS 42.A NZ ASP 45.A OD1 no hydrogen 2.776 N/A LYS 42.A NZ ASP 45.A OD2 no hydrogen 3.502 N/A GLY 44.A N GLU 71.A OE2 no hydrogen 2.673 N/A ASP 45.A N LYS 42.A O no hydrogen 3.315 N/A GLU 47.A N GLU 71.A OE1 no hydrogen 3.156 N/A GLN 48.A N GLY 44.A O no hydrogen 2.938 N/A GLN 48.A NE2 GLU 52.A OE2 no hydrogen 3.132 N/A PHE 49.A N ASP 45.A O no hydrogen 2.806 N/A ALA 50.A N ALA 46.A O no hydrogen 2.933 N/A ARG 51.A N GLU 47.A O no hydrogen 2.992 N/A GLU 52.A N GLN 48.A O no hydrogen 2.980 N/A ALA 53.A N PHE 49.A O no hydrogen 2.961 N/A ALA 54.A N ALA 50.A O no hydrogen 3.003 N/A GLU 55.A N ARG 51.A O no hydrogen 2.883 N/A SER 56.A N GLU 52.A O no hydrogen 3.008 N/A SER 56.A OG GLU 52.A O no hydrogen 3.106 N/A HIS 57.A N ALA 54.A O no hydrogen 2.830 N/A PHE 58.A N ALA 53.A O no hydrogen 2.969 N/A ASP 59.A N LYS 3.A O no hydrogen 2.923 N/A SER 60.A N LYS 3.A O no hydrogen 3.239 N/A SER 60.A OG ASP 59.A OD2 no hydrogen 2.571 N/A SER 60.A OG TYR 277.A OH no hydrogen 2.589 N/A VAL 61.A N LYS 84.A O no hydrogen 2.780 N/A PHE 62.A N VAL 5.A O.A no hydrogen 2.828 N/A PHE 62.A N VAL 5.A O.B no hydrogen 2.855 N/A VAL 63.A N GLY 86.A O no hydrogen 2.920 N/A GLY 65.A N SER 12.A OG no hydrogen 3.301 N/A VAL 69.A N GLY 65.A O no hydrogen 3.122 N/A ASN 70.A N ASP 66.A O no hydrogen 2.827 N/A ASN 70.A ND2 TYR 129.A O no hydrogen 3.318 N/A ASN 70.A ND2 ASP 256.A OD2 no hydrogen 2.565 N/A GLU 71.A N GLY 67.A O no hydrogen 3.168 N/A GLY 72.A N THR 68.A O no hydrogen 2.922 N/A ILE 73.A N VAL 69.A O no hydrogen 2.929 N/A SER 74.A N ASN 70.A O no hydrogen 2.769 N/A SER 74.A OG ASN 70.A O no hydrogen 2.918 N/A SER 74.A OG ASN 70.A OD1 no hydrogen 3.545 N/A GLY 75.A N GLU 71.A O no hydrogen 2.915 N/A GLY 75.A N GLY 72.A O no hydrogen 3.171 N/A LEU 76.A N ILE 73.A O no hydrogen 3.063 N/A ALA 77.A N ILE 73.A O no hydrogen 2.972 N/A GLU 78.A N HIS 273.A NE2 no hydrogen 2.801 N/A GLN 79.A N LEU 76.A O no hydrogen 3.083 N/A TYR 81.A OH PHE 58.A O no hydrogen 2.757 N/A ARG 82.A NE HIS 273.A O no hydrogen 2.987 N/A ARG 82.A NH2 HIS 273.A O no hydrogen 3.186 N/A LYS 84.A N ASP 59.A O no hydrogen 3.000 N/A LYS 84.A NZ ASP 59.A OD1 no hydrogen 3.445 N/A PHE 85.A N THR 275.A O no hydrogen 2.849 N/A GLY 86.A N VAL 61.A O no hydrogen 2.853 N/A PHE 88.A N VAL 63.A O no hydrogen 2.845 N/A LEU 90.A N GLY 64.A O no hydrogen 3.061 N/A ASN 94.A ND2 GLY 91.A O no hydrogen 2.998 N/A ASP 95.A N ASP 66.A OD2 no hydrogen 3.386 N/A ARG 98.A N ASN 94.A O no hydrogen 3.309 N/A ALA 99.A N ASP 95.A O no hydrogen 3.011 N/A LEU 100.A N LEU 96.A O no hydrogen 2.976 N/A ASN 101.A N ARG 98.A O no hydrogen 3.153 N/A LEU 102.A N ALA 97.A O no hydrogen 2.918 N/A GLU 107.A N ASP 104.A OD1 no hydrogen 3.010 N/A ALA 108.A N ASP 104.A O no hydrogen 2.925 N/A ILE 109.A N PRO 105.A O no hydrogen 2.978 N/A GLN 110.A N GLU 106.A O no hydrogen 2.952 N/A GLN 111.A N GLU 107.A O no hydrogen 2.925 N/A LEU 112.A N ILE 109.A O no hydrogen 3.271 N/A GLU 115.A N ASP 113.A OD1 no hydrogen 2.896 N/A LYS 116.A N ASP 113.A O no hydrogen 2.870 N/A SER 118.A N VAL 276.A O.A no hydrogen 2.809 N/A SER 118.A N VAL 276.A O.B no hydrogen 2.845 N/A SER 118.A OG ALA 119.A O no hydrogen 2.921 N/A LEU 120.A N LEU 274.A O no hydrogen 2.800 N/A ASP 121.A N VAL 197.A O no hydrogen 2.892 N/A VAL 122.A N LEU 270.A O no hydrogen 2.966 N/A GLY 123.A N PHE 130.A O no hydrogen 2.939 N/A LYS 124.A N LYS 268.A O.A no hydrogen 2.864 N/A LYS 124.A N LYS 268.A O.B no hydrogen 3.005 N/A LYS 124.A NZ GLU 78.A OE1 no hydrogen 2.786 N/A ILE 125.A N ASP 128.A O no hydrogen 2.802 N/A ASN 126.A N THR 266.A O no hydrogen 2.965 N/A ASN 126.A ND2 PRO 264.A O no hydrogen 3.405 N/A ASP 128.A N ILE 125.A O no hydrogen 2.765 N/A TYR 129.A OH GLU 78.A OE1 no hydrogen 2.571 N/A PHE 130.A N GLY 123.A O no hydrogen 2.945 N/A ASN 131.A ND2 SER 184.A O no hydrogen 2.721 N/A VAL 132.A N ASP 256.A OD1 no hydrogen 2.908 N/A VAL 133.A N VAL 179.A O no hydrogen 2.807 N/A ALA 134.A N ASN 254.A O no hydrogen 2.765 N/A ILE 135.A N VAL 177.A O no hydrogen 2.686 N/A LEU 143.A N LEU 140.A O.B no hydrogen 3.123 N/A ALA 144.A N GLY 141.A O.A no hydrogen 3.313 N/A ALA 144.A N GLY 141.A O.B no hydrogen 3.250 N/A TYR 145.A N LYS 142.A O.A no hydrogen 3.245 N/A PHE 146.A N LEU 143.A O no hydrogen 3.070 N/A ILE 147.A N LEU 143.A O no hydrogen 3.337 N/A SER 148.A N ALA 144.A O no hydrogen 2.820 N/A SER 148.A OG ALA 144.A O no hydrogen 3.268 N/A GLY 149.A N TYR 145.A O no hydrogen 2.624 N/A ALA 150.A N PHE 146.A O no hydrogen 2.315 N/A LYS 151.A N PHE 146.A O no hydrogen 3.265 N/A HIS 152.A N SER 148.A O no hydrogen 3.032 N/A LEU 153.A N.A GLY 149.A O no hydrogen 3.235 N/A LEU 153.A N.B GLY 149.A O no hydrogen 3.353 N/A ALA 154.A N.A ALA 150.A O no hydrogen 3.351 N/A ALA 154.A N.A LYS 151.A O no hydrogen 2.933 N/A ALA 154.A N.B LYS 151.A O no hydrogen 2.384 N/A ASN 155.A N.A LYS 151.A O no hydrogen 3.145 N/A ALA 156.A N.A LEU 153.A O.B no hydrogen 2.063 N/A ALA 156.A N.B LEU 153.A O.B no hydrogen 2.870 N/A GLN 157.A NE2 GLU 249.A OE1 no hydrogen 3.080 N/A GLN 157.A NE2 GLU 249.A OE2 no hydrogen 3.408 N/A THR 158.A OG1 GLU 173.A OE2 no hydrogen 3.564 N/A TYR 159.A N SER 174.A O no hydrogen 2.782 N/A HIS 162.A N SER 244.A O no hydrogen 2.710 N/A HIS 162.A ND1 THR 171.A OG1 no hydrogen 3.061 N/A HIS 162.A NE2 GLU 169.A OE1 no hydrogen 2.849 N/A LEU 163.A N GLN 170.A O no hydrogen 2.743 N/A SER 164.A N THR 242.A O no hydrogen 2.943 N/A SER 164.A OG GLU 169.A OE1 no hydrogen 3.006 N/A SER 164.A OG GLU 169.A OE2 no hydrogen 2.571 N/A LEU 165.A N LYS 168.A O no hydrogen 2.787 N/A ASP 166.A N GLU 240.A O no hydrogen 2.903 N/A LYS 168.A N LEU 165.A O no hydrogen 2.787 N/A GLN 170.A N LEU 163.A O no hydrogen 2.917 N/A THR 171.A OG1 HIS 162.A ND1 no hydrogen 3.061 N/A THR 171.A OG1 GLU 246.A OE2 no hydrogen 2.656 N/A ILE 172.A N PHE 161.A O no hydrogen 2.930 N/A SER 174.A N TYR 159.A O no hydrogen 3.063 N/A SER 174.A OG THR 176.A O no hydrogen 3.179 N/A SER 174.A OG LEU 207.A O no hydrogen 2.598 N/A SER 175.A N ASP 209.A OD1.A no hydrogen 3.213 N/A SER 175.A N ASP 209.A OD1.B no hydrogen 3.133 N/A SER 175.A OG THR 176.A OG1 no hydrogen 2.931 N/A SER 175.A OG ASP 209.A OD1.A no hydrogen 3.369 N/A SER 175.A OG ASP 209.A OD1.B no hydrogen 3.351 N/A SER 175.A OG ASP 209.A OD2.A no hydrogen 2.844 N/A SER 175.A OG ASP 209.A OD2.B no hydrogen 2.745 N/A THR 176.A N SER 174.A OG no hydrogen 3.194 N/A THR 176.A OG1 SER 175.A OG no hydrogen 2.931 N/A VAL 177.A N ILE 135.A O no hydrogen 2.916 N/A LEU 178.A N VAL 205.A O no hydrogen 2.842 N/A VAL 179.A N VAL 133.A O no hydrogen 2.853 N/A GLY 180.A N HIS 203.A O no hydrogen 2.742 N/A LEU 181.A N ASN 131.A O no hydrogen 3.214 N/A THR 182.A OG1 SER 184.A O no hydrogen 3.198 N/A ASN 183.A ND2 GLU 189.A O no hydrogen 2.764 N/A SER 184.A N THR 182.A OG1 no hydrogen 3.380 N/A SER 184.A OG ASP 95.A OD1 no hydrogen 2.739 N/A ILE 185.A N PHE 188.A O no hydrogen 3.283 N/A GLY 186.A N ASP 95.A OD2 no hydrogen 2.592 N/A GLY 187.A N ASP 95.A OD1 no hydrogen 2.633 N/A PHE 188.A N ILE 185.A O no hydrogen 3.082 N/A LEU 191.A N PHE 188.A O no hydrogen 3.403 N/A LEU 192.A N ASN 183.A O no hydrogen 3.152 N/A ALA 195.A N LEU 192.A O no hydrogen 2.979 N/A GLN 196.A N ASP 199.A OD2 no hydrogen 2.830 N/A ASP 199.A N GLN 196.A O no hydrogen 3.142 N/A GLY 200.A N ASP 121.A OD2 no hydrogen 2.655 N/A LYS 201.A N ASP 199.A OD1 no hydrogen 2.939 N/A LEU 202.A N PHE 238.A O no hydrogen 2.887 N/A HIS 203.A N GLY 180.A O no hydrogen 2.816 N/A HIS 203.A ND1 TYR 235.A OH no hydrogen 2.759 N/A HIS 203.A NE2 ASP 199.A OD2 no hydrogen 2.842 N/A LEU 204.A N LEU 236.A O no hydrogen 2.666 N/A VAL 205.A N LEU 178.A O no hydrogen 2.865 N/A TYR 206.A N VAL 234.A O no hydrogen 3.094 N/A LEU 207.A N THR 176.A O no hydrogen 3.194 N/A LYS 208.A N ASN 232.A O no hydrogen 2.919 N/A LYS 208.A NZ THR 230.A O no hydrogen 2.643 N/A SER 211.A OG.A ASP 214.A OD2 no hydrogen 3.519 N/A TRP 213.A N.A SER 211.A OG.B no hydrogen 2.345 N/A ASP 214.A N SER 211.A OG.B no hydrogen 3.091 N/A VAL 216.A N LEU 212.A O.B no hydrogen 3.349 N/A LYS 217.A NZ ASP 214.A OD1 no hydrogen 3.410 N/A ALA 218.A N ALA 215.A O no hydrogen 3.072 N/A VAL 219.A N VAL 216.A O no hydrogen 3.150 N/A LEU 222.A N ALA 218.A O no hydrogen 3.127 N/A LEU 223.A N VAL 219.A O no hydrogen 3.153 N/A LYS 224.A N PRO 220.A O no hydrogen 3.112 N/A GLY 225.A N LEU 222.A O no hydrogen 3.176 N/A VAL 226.A N LEU 191.A O no hydrogen 2.742 N/A GLN 228.A NE2 ASP 227.A OD1 no hydrogen 2.988 N/A THR 230.A N LEU 233.A O no hydrogen 2.784 N/A THR 230.A OG1 ASP 221.A OD2 no hydrogen 2.671 N/A ASN 232.A N THR 230.A OG1 no hydrogen 2.945 N/A ASN 232.A ND2 ASP 221.A OD2 no hydrogen 2.856 N/A LEU 233.A N THR 230.A OG1 no hydrogen 3.117 N/A VAL 234.A N TYR 206.A O no hydrogen 2.943 N/A TYR 235.A N SER 229.A OG no hydrogen 2.873 N/A TYR 235.A OH HIS 203.A ND1 no hydrogen 2.759 N/A LEU 236.A N LEU 204.A O no hydrogen 2.825 N/A PHE 238.A N LEU 202.A O no hydrogen 3.056 N/A LYS 239.A N ASP 166.A OD1 no hydrogen 3.087 N/A LYS 239.A N ASP 166.A OD2 no hydrogen 3.180 N/A GLU 240.A N ASP 166.A OD1 no hydrogen 3.043 N/A GLY 241.A N LEU 267.A O no hydrogen 2.890 N/A THR 242.A N SER 164.A O no hydrogen 2.904 N/A THR 242.A OG1 THR 266.A OG1 no hydrogen 2.623 N/A ILE 243.A N ILE 265.A O no hydrogen 2.875 N/A SER 244.A N HIS 162.A O no hydrogen 3.039 N/A GLU 246.A N PRO 160.A O no hydrogen 2.809 N/A GLN 248.A NE2 LEU 263.A O no hydrogen 3.637 N/A THR 253.A N ALA 261.A O no hydrogen 3.034 N/A THR 253.A OG1 ALA 261.A O no hydrogen 2.687 N/A ASN 254.A N ALA 134.A O no hydrogen 2.882 N/A VAL 255.A N ASP 258.A O no hydrogen 2.564 N/A ASP 256.A N VAL 132.A O no hydrogen 2.941 N/A ASP 258.A N VAL 255.A O no hydrogen 2.989 N/A GLY 260.A N THR 253.A O no hydrogen 2.751 N/A LEU 263.A N LEU 251.A O no hydrogen 2.972 N/A ILE 265.A N ILE 243.A O no hydrogen 3.019 N/A THR 266.A N ASN 126.A OD1 no hydrogen 2.742 N/A THR 266.A OG1 THR 242.A OG1 no hydrogen 2.623 N/A LEU 267.A N GLY 241.A O no hydrogen 2.673 N/A LYS 268.A N.A LYS 124.A O no hydrogen 2.927 N/A LYS 268.A N.B LYS 124.A O no hydrogen 2.960 N/A ILE 269.A N LYS 239.A O no hydrogen 2.955 N/A LEU 270.A N VAL 122.A O no hydrogen 2.715 N/A LYS 272.A N ASP 121.A OD1 no hydrogen 2.659 N/A HIS 273.A N LEU 120.A O no hydrogen 2.866 N/A LEU 274.A N LEU 120.A O no hydrogen 3.066 N/A VAL 276.A N.A SER 118.A O no hydrogen 2.875 N/A VAL 276.A N.B SER 118.A O no hydrogen 2.880 N/A TYR 277.A N PHE 85.A O no hydrogen 3.021 N/A TYR 277.A OH SER 60.A OG no hydrogen 2.589 N/A CYS 278.A N LYS 116.A O no hydrogen 2.937 N/A CYS 278.A SG GLY 279.A O no hydrogen 3.667 N/A GLY 279.A N LEU 100.A O no hydrogen 3.369 N/A