Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4w8e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A NE2 PRO 3.A O no hydrogen 3.585 N/A LEU 8.A N MET 5.A O no hydrogen 3.319 N/A LYS 9.A N SER 80.A O no hydrogen 2.950 N/A GLU 14.A N ASP 11.A O no hydrogen 3.338 N/A LEU 15.A N PRO 12.A O no hydrogen 3.034 N/A PHE 16.A N PRO 12.A O no hydrogen 2.867 N/A THR 17.A N ILE 34.A O no hydrogen 2.983 N/A THR 17.A OG1 ASN 36.A OD1 no hydrogen 2.678 N/A LEU 19.A N LYS 32.A O no hydrogen 2.775 N/A GLU 20.A N GLU 20.A OE1 no hydrogen 2.900 N/A ILE 22.A N VAL 30.A O no hydrogen 2.930 N/A LYS 24.A NZ GLY 25.A O no hydrogen 3.137 N/A GLY 25.A N GLY 28.A O no hydrogen 2.885 N/A SER 26.A N ASP 154.A OD1 no hydrogen 3.303 N/A SER 26.A OG GLU 62.A OE1 no hydrogen 2.766 N/A SER 26.A OG ASP 154.A OD1 no hydrogen 2.726 N/A GLU 29.A N ILE 46.A O no hydrogen 3.296 N/A VAL 30.A N GLY 23.A O no hydrogen 3.023 N/A PHE 31.A N ILE 44.A O no hydrogen 2.798 N/A LYS 32.A N GLU 20.A O no hydrogen 2.746 N/A LYS 32.A NZ TYR 93.A OH no hydrogen 3.452 N/A GLY 33.A N VAL 42.A O no hydrogen 2.843 N/A ILE 34.A N THR 17.A O no hydrogen 2.930 N/A ASP 35.A N LYS 40.A O no hydrogen 2.860 N/A ASN 36.A N LEU 15.A O no hydrogen 2.933 N/A ARG 37.A N ASP 35.A OD1 no hydrogen 2.975 N/A ARG 37.A NE ASP 35.A OD1 no hydrogen 3.374 N/A GLN 39.A N ASP 35.A O no hydrogen 2.771 N/A GLN 39.A NE2 ASN 36.A O no hydrogen 2.837 N/A LYS 40.A N THR 38.A OG1 no hydrogen 3.126 N/A VAL 42.A N GLY 33.A O no hydrogen 2.814 N/A ALA 43.A N MET 91.A O no hydrogen 2.771 N/A ILE 44.A N PHE 31.A O no hydrogen 2.622 N/A LYS 45.A N ILE 89.A O no hydrogen 2.793 N/A LYS 45.A NZ SER 26.A O no hydrogen 3.125 N/A LYS 45.A NZ GLU 62.A OE1 no hydrogen 2.909 N/A ILE 46.A N GLU 29.A O no hydrogen 2.863 N/A ILE 47.A N LEU 87.A O no hydrogen 3.038 N/A LEU 49.A N THR 85.A O no hydrogen 2.920 N/A ALA 52.A N ASP 48.A O no hydrogen 3.324 N/A GLU 53.A N GLU 55.A OE1 no hydrogen 3.197 N/A ASP 54.A N GLU 55.A OE1 no hydrogen 3.206 N/A GLU 55.A N GLU 55.A OE1 no hydrogen 2.816 N/A ILE 59.A N GLU 55.A O no hydrogen 2.795 N/A GLN 60.A N ILE 56.A O no hydrogen 3.109 N/A GLN 61.A N GLU 57.A O no hydrogen 3.344 N/A GLU 62.A N ASP 58.A O no hydrogen 2.802 N/A ILE 63.A N ILE 59.A O no hydrogen 3.192 N/A THR 64.A N GLN 60.A O no hydrogen 3.199 N/A THR 64.A OG1 GLN 60.A O no hydrogen 2.885 N/A VAL 65.A N GLN 61.A O no hydrogen 2.781 N/A LEU 66.A N GLU 62.A O no hydrogen 3.071 N/A SER 67.A N ILE 63.A O no hydrogen 2.883 N/A SER 67.A OG ILE 63.A O no hydrogen 3.058 N/A SER 67.A OG THR 64.A O no hydrogen 2.725 N/A GLN 68.A N THR 64.A O no hydrogen 2.991 N/A GLN 68.A N VAL 65.A O no hydrogen 3.139 N/A CYS 69.A SG VAL 65.A O no hydrogen 3.110 N/A ASP 70.A N TYR 126.A OH no hydrogen 2.834 N/A TYR 73.A N SER 71.A OG no hydrogen 3.028 N/A VAL 74.A N SER 71.A O no hydrogen 3.370 N/A THR 75.A N LEU 152.A O no hydrogen 2.919 N/A THR 75.A OG1 LEU 152.A O no hydrogen 3.521 N/A LYS 76.A N GLU 92.A OE2 no hydrogen 3.006 N/A TYR 77.A OH SER 80.A OG no hydrogen 2.738 N/A TYR 78.A N ILE 90.A O no hydrogen 2.802 N/A SER 80.A OG TYR 77.A OH no hydrogen 2.738 N/A TYR 81.A N TRP 88.A O no hydrogen 2.845 N/A LEU 82.A N LYS 9.A O no hydrogen 3.140 N/A LYS 83.A N LYS 86.A O no hydrogen 2.798 N/A THR 85.A OG1 ASP 48.A OD2 no hydrogen 3.385 N/A LYS 86.A N LYS 83.A O no hydrogen 2.909 N/A LEU 87.A N ILE 47.A O no hydrogen 3.093 N/A TRP 88.A N TYR 81.A O no hydrogen 2.787 N/A ILE 89.A N LYS 45.A O no hydrogen 2.781 N/A ILE 90.A N GLY 79.A O no hydrogen 3.037 N/A MET 91.A N ALA 43.A O no hydrogen 2.688 N/A GLU 92.A N LYS 76.A O no hydrogen 2.853 N/A GLY 96.A N LEU 144.A O no hydrogen 2.809 N/A SER 98.A N ASP 101.A OD1 no hydrogen 2.864 N/A ALA 99.A N VAL 142.A O no hydrogen 2.715 N/A LEU 100.A N ALA 139.A O no hydrogen 3.295 N/A ASP 101.A N SER 98.A OG no hydrogen 3.044 N/A LEU 102.A N SER 98.A O no hydrogen 3.005 N/A LEU 103.A N ALA 99.A O no hydrogen 3.196 N/A LEU 103.A N LEU 100.A O no hydrogen 3.117 N/A GLU 104.A N ASP 101.A O no hydrogen 2.965 N/A GLY 106.A N LEU 103.A O no hydrogen 3.323 N/A ASP 109.A N GLN 112.A OE1 no hydrogen 2.902 N/A GLN 112.A N ASP 109.A OD2 no hydrogen 2.874 N/A ILE 113.A N ASP 109.A O no hydrogen 3.050 N/A ALA 114.A N GLU 110.A O no hydrogen 2.924 N/A THR 115.A N THR 111.A O no hydrogen 2.972 N/A THR 115.A OG1 THR 111.A O no hydrogen 2.714 N/A THR 115.A OG1 LYS 270.A O no hydrogen 3.511 N/A ILE 116.A N GLN 112.A O no hydrogen 2.965 N/A LEU 117.A N ILE 113.A O no hydrogen 2.891 N/A ARG 118.A N ALA 114.A O no hydrogen 2.913 N/A ARG 118.A NE GLU 119.A OE1 no hydrogen 2.972 N/A ARG 118.A NH2 GLU 119.A OE1 no hydrogen 3.226 N/A ARG 118.A NH2 LYS 270.A O no hydrogen 2.814 N/A GLU 119.A N THR 115.A O no hydrogen 3.263 N/A ILE 120.A N ILE 116.A O no hydrogen 2.998 N/A LEU 121.A N LEU 117.A O no hydrogen 2.808 N/A LYS 122.A N ARG 118.A O no hydrogen 2.952 N/A LYS 122.A NZ GLU 119.A OE1 no hydrogen 3.030 N/A GLY 123.A N GLU 119.A O no hydrogen 3.103 N/A LEU 124.A N ILE 120.A O no hydrogen 2.774 N/A ASP 125.A N LEU 121.A O no hydrogen 2.801 N/A TYR 126.A N LYS 122.A O no hydrogen 2.985 N/A LEU 127.A N GLY 123.A O no hydrogen 2.984 N/A HIS 128.A N LEU 124.A O no hydrogen 2.794 N/A HIS 128.A ND1 LYS 132.A O no hydrogen 3.097 N/A SER 129.A N ASP 125.A O no hydrogen 3.057 N/A SER 129.A OG ASP 125.A O no hydrogen 3.359 N/A SER 129.A OG TYR 126.A O no hydrogen 2.738 N/A GLU 130.A N TYR 126.A O no hydrogen 3.260 N/A GLU 130.A N LEU 127.A O no hydrogen 3.102 N/A LYS 131.A N HIS 128.A O no hydrogen 3.179 N/A LYS 131.A NZ SER 129.A O no hydrogen 2.810 N/A LYS 132.A N LEU 127.A O no hydrogen 2.914 N/A LYS 132.A NZ GLN 68.A O no hydrogen 3.103 N/A ILE 133.A N GLY 159.A O no hydrogen 2.888 N/A HIS 134.A N ASP 192.A OD2 no hydrogen 2.772 N/A HIS 134.A NE2 ALA 153.A O no hydrogen 2.761 N/A ARG 135.A N ASP 192.A OD1 no hydrogen 2.853 N/A ARG 135.A NE VAL 157.A O no hydrogen 2.719 N/A ARG 135.A NH1 VAL 157.A O no hydrogen 3.044 N/A ARG 135.A NH1 ALA 158.A O no hydrogen 3.436 N/A ARG 135.A NH2 TYR 187.A OH no hydrogen 2.866 N/A ASP 136.A N HIS 134.A ND1 no hydrogen 2.959 N/A LYS 138.A NZ THR 173.A OG1 no hydrogen 2.770 N/A ALA 139.A N GLU 202.A OE1 no hydrogen 2.944 N/A ASN 141.A N LYS 138.A O no hydrogen 2.961 N/A ASN 141.A ND2 ASP 136.A O no hydrogen 2.788 N/A ASN 141.A ND2 ASP 136.A OD2 no hydrogen 3.096 N/A VAL 142.A N ALA 139.A O no hydrogen 3.149 N/A LEU 143.A N LYS 151.A O no hydrogen 2.825 N/A LEU 144.A N GLY 97.A O no hydrogen 2.896 N/A SER 145.A N GLU 149.A O no hydrogen 2.833 N/A SER 145.A OG GLU 149.A OE2 no hydrogen 2.708 N/A HIS 147.A N SER 145.A OG no hydrogen 3.153 N/A GLY 148.A N SER 145.A O no hydrogen 3.129 N/A GLU 149.A N SER 145.A OG no hydrogen 3.067 N/A LYS 151.A N LEU 143.A O no hydrogen 2.874 N/A LYS 151.A NZ PRO 72.A O no hydrogen 3.112 N/A LYS 151.A NZ GLU 92.A OE1 no hydrogen 2.769 N/A LYS 151.A NZ GLU 92.A OE2 no hydrogen 3.468 N/A LEU 152.A N TYR 73.A O no hydrogen 2.801 N/A ALA 153.A N ASN 141.A O no hydrogen 2.901 N/A ALA 158.A N PHE 155.A O no hydrogen 3.297 N/A GLY 159.A N ILE 133.A O no hydrogen 2.779 N/A GLN 160.A NE2 GLU 130.A O no hydrogen 3.425 N/A GLN 160.A NE2 LEU 161.A O no hydrogen 3.035 N/A LEU 161.A N LYS 131.A O no hydrogen 2.731 N/A THR 162.A N GLN 165.A O no hydrogen 2.806 N/A GLN 165.A N THR 162.A OG1 no hydrogen 2.926 N/A LYS 167.A NZ ASP 188.A OD2 no hydrogen 3.233 N/A ARG 168.A N TYR 187.A O no hydrogen 2.819 N/A ARG 168.A NH1 GLN 160.A O no hydrogen 2.909 N/A THR 173.A OG1 ASP 136.A OD1 no hydrogen 2.678 N/A TRP 176.A N THR 173.A O no hydrogen 2.899 N/A TRP 176.A NE1 GLU 202.A OE1 no hydrogen 2.982 N/A MET 177.A N PRO 174.A O no hydrogen 3.098 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.816 N/A VAL 181.A N ALA 178.A O no hydrogen 3.075 N/A ILE 182.A N ALA 178.A O no hydrogen 3.275 N/A LYS 183.A N PRO 179.A O no hydrogen 3.015 N/A GLN 184.A N VAL 181.A O no hydrogen 2.959 N/A SER 185.A N GLU 180.A O no hydrogen 2.869 N/A TYR 187.A N ARG 168.A O no hydrogen 2.861 N/A LYS 190.A N ASP 188.A OD1 no hydrogen 3.025 N/A LYS 190.A NZ PRO 250.A O no hydrogen 3.448 N/A LYS 190.A NZ ARG 253.A O no hydrogen 2.868 N/A ALA 191.A N ASP 188.A O no hydrogen 3.032 N/A ASP 192.A N SER 189.A O no hydrogen 2.862 N/A TRP 194.A N LYS 190.A O no hydrogen 3.177 N/A SER 195.A N ALA 191.A O no hydrogen 3.128 N/A SER 195.A OG TRP 176.A O no hydrogen 2.716 N/A SER 195.A OG ALA 191.A O no hydrogen 3.332 N/A LEU 196.A N ASP 192.A O no hydrogen 2.782 N/A GLY 197.A N ILE 193.A O no hydrogen 3.014 N/A ILE 198.A N TRP 194.A O no hydrogen 2.997 N/A THR 199.A N SER 195.A O no hydrogen 2.881 N/A THR 199.A OG1 SER 195.A O no hydrogen 2.804 N/A ALA 200.A N LEU 196.A O no hydrogen 2.806 N/A ILE 201.A N GLY 197.A O no hydrogen 3.132 N/A GLU 202.A N ILE 198.A O no hydrogen 2.863 N/A LEU 203.A N THR 199.A O no hydrogen 2.724 N/A ALA 204.A N ALA 200.A O no hydrogen 3.008 N/A ARG 205.A N ILE 201.A O no hydrogen 2.761 N/A ARG 205.A NH1 GLU 231.A O no hydrogen 3.259 N/A GLY 206.A N GLU 202.A O no hydrogen 2.718 N/A SER 211.A OG GLU 212.A OE2 no hydrogen 3.554 N/A LEU 213.A N HIS 210.A O no hydrogen 2.976 N/A MET 216.A N HIS 214.A ND1 no hydrogen 3.136 N/A LYS 217.A N HIS 214.A O no hydrogen 3.042 N/A PHE 220.A N LYS 217.A O no hydrogen 3.178 N/A LEU 221.A N LYS 217.A O no hydrogen 3.200 N/A ILE 222.A N VAL 218.A O no hydrogen 2.912 N/A LYS 224.A N PHE 220.A O no hydrogen 3.258 N/A ASN 225.A N LEU 221.A O no hydrogen 2.791 N/A TYR 234.A N GLY 232.A O no hydrogen 2.952 N/A TYR 234.A OH ALA 204.A O no hydrogen 2.949 N/A SER 235.A N GLU 110.A OE2 no hydrogen 2.826 N/A SER 235.A OG GLU 110.A OE1 no hydrogen 2.559 N/A LYS 239.A N SER 235.A O no hydrogen 3.162 N/A LYS 239.A NZ GLY 232.A O no hydrogen 3.141 N/A GLU 240.A N LYS 236.A O no hydrogen 2.962 N/A PHE 241.A N PRO 237.A O no hydrogen 2.796 N/A VAL 242.A N LEU 238.A O no hydrogen 3.086 N/A GLU 243.A N LYS 239.A O no hydrogen 2.959 N/A ALA 244.A N GLU 240.A O no hydrogen 2.940 N/A CYS 245.A N PHE 241.A O no hydrogen 3.244 N/A CYS 245.A SG PHE 241.A O no hydrogen 3.562 N/A LEU 246.A N VAL 242.A O no hydrogen 2.944 N/A LYS 248.A NZ PRO 223.A O no hydrogen 2.875 N/A LYS 248.A NZ ASN 225.A O no hydrogen 2.804 N/A GLU 249.A N ASN 247.A OD1 no hydrogen 3.024 N/A SER 251.A N GLU 249.A OE1 no hydrogen 3.135 N/A SER 251.A OG GLU 249.A OE1 no hydrogen 2.667 N/A PHE 252.A N GLU 249.A O no hydrogen 3.098 N/A ARG 253.A N PRO 250.A O no hydrogen 3.040 N/A ARG 253.A NE ASN 247.A O no hydrogen 2.787 N/A ARG 253.A NH1 GLU 180.A OE2 no hydrogen 2.738 N/A ARG 253.A NH1 LYS 190.A O no hydrogen 2.962 N/A ARG 253.A NH2 GLU 180.A OE1 no hydrogen 2.830 N/A ARG 253.A NH2 GLU 180.A OE2 no hydrogen 3.502 N/A ARG 253.A NH2 ASN 247.A O no hydrogen 3.116 N/A THR 255.A N GLU 258.A OE2 no hydrogen 3.027 N/A LYS 257.A NZ ASP 125.A OD1 no hydrogen 3.103 N/A GLU 258.A N THR 255.A OG1 no hydrogen 3.093 N/A LEU 259.A N THR 255.A O no hydrogen 3.003 N/A LEU 260.A N ALA 256.A O no hydrogen 3.051 N/A LYS 261.A N GLU 258.A O no hydrogen 3.050 N/A HIS 262.A N LEU 259.A O no hydrogen 2.951 N/A PHE 264.A N HIS 262.A ND1 no hydrogen 2.973 N/A LEU 266.A N HIS 262.A O no hydrogen 2.969 N/A ARG 267.A N LYS 263.A O no hydrogen 2.875 N/A ASN 268.A N PHE 264.A O no hydrogen 3.235 N/A ASN 268.A ND2 PHE 264.A O no hydrogen 2.910 N/A ALA 269.A N ILE 265.A O no hydrogen 2.946 N/A LYS 270.A N THR 115.A OG1 no hydrogen 3.001 N/A LYS 270.A NZ ARG 267.A O no hydrogen 3.356 N/A LYS 270.A NZ ALA 269.A O no hydrogen 3.566 N/A TYR 274.A N LYS 271.A O no hydrogen 3.318 N/A LEU 275.A N THR 272.A O no hydrogen 2.962 N/A THR 276.A N SER 273.A O no hydrogen 3.112 N/A THR 276.A OG1 SER 273.A O no hydrogen 3.029 N/A GLU 277.A N TYR 274.A O no hydrogen 3.266 N/A LEU 278.A N LEU 275.A O no hydrogen 2.991 N/A ILE 279.A N LEU 275.A O no hydrogen 3.177 N/A ASP 280.A N THR 276.A O no hydrogen 2.826 N/A ARG 281.A N GLU 277.A O no hydrogen 2.960 N/A ARG 281.A NH1 PRO 107.A O no hydrogen 3.038 N/A ARG 281.A NH2 LEU 102.A O no hydrogen 2.875 N/A ARG 281.A NH2 GLY 106.A O no hydrogen 2.979 N/A TYR 282.A N LEU 278.A O no hydrogen 2.962 N/A LYS 283.A N ILE 279.A O no hydrogen 2.962 N/A ARG 284.A N ASP 280.A O no hydrogen 2.963 N/A TRP 285.A N ARG 281.A O no hydrogen 2.962 N/A LYS 286.A N TYR 282.A O no hydrogen 2.879 N/A ALA 287.A N LYS 283.A O no hydrogen 3.076 N/A GLU 288.A N ARG 284.A O no hydrogen 3.216 N/A GLU 288.A N TRP 285.A O no hydrogen 3.157 N/A GLN 289.A N TRP 285.A O no hydrogen 3.180 N/A