Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gkv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N LYS 17.A O no hydrogen 2.778 N/A LYS 2.A N GLU 119.A OE2 no hydrogen 2.789 N/A ALA 3.A N THR 15.A O no hydrogen 3.016 N/A ALA 4.A N MET 117.A O no hydrogen 2.892 N/A VAL 5.A N ASP 13.A O no hydrogen 3.041 N/A VAL 6.A N VAL 54.A O no hydrogen 3.043 N/A THR 7.A N HIS 11.A O no hydrogen 2.856 N/A THR 7.A OG1 ASP 9.A OD1 no hydrogen 2.667 N/A THR 7.A OG1 HIS 11.A O no hydrogen 3.159 N/A HIS 10.A N THR 7.A O no hydrogen 3.105 N/A HIS 10.A ND1 LYS 44.A O no hydrogen 2.896 N/A HIS 11.A N THR 7.A OG1 no hydrogen 2.919 N/A HIS 11.A ND1 ASP 9.A OD2 no hydrogen 2.959 N/A VAL 12.A N ASN 315.A OD1 no hydrogen 2.980 N/A ASP 13.A N VAL 5.A O no hydrogen 2.913 N/A THR 15.A N ALA 3.A O no hydrogen 2.818 N/A LYS 17.A N MET 1.A O no hydrogen 2.766 N/A ARG 20.A NH1 SER 21.A O no hydrogen 2.979 N/A ARG 20.A NH1 GLU 26.A OE1 no hydrogen 2.789 N/A ARG 20.A NH2 GLU 26.A OE1 no hydrogen 3.477 N/A ARG 20.A NH2 GLU 26.A OE2 no hydrogen 2.814 N/A LYS 23.A N GLU 26.A OE1 no hydrogen 2.858 N/A GLY 25.A N PRO 69.A O no hydrogen 3.022 N/A GLU 26.A N LYS 23.A O no hydrogen 3.144 N/A ALA 27.A N VAL 123.A O no hydrogen 2.878 N/A LEU 28.A N GLU 66.A O no hydrogen 2.818 N/A LEU 29.A N CYS 121.A O no hydrogen 2.841 N/A LYS 30.A N VAL 63.A O no hydrogen 2.868 N/A MET 31.A N GLU 119.A O no hydrogen 2.851 N/A GLU 32.A N ILE 61.A O no hydrogen 2.768 N/A CYS 33.A N ILE 61.A O no hydrogen 3.149 N/A CYS 34.A N ILE 332.A O no hydrogen 2.920 N/A CYS 34.A SG GLY 35.A O no hydrogen 3.624 N/A GLY 35.A N GLU 59.A O no hydrogen 3.044 N/A VAL 36.A N MET 330.A O no hydrogen 2.938 N/A CYS 37.A N ASP 40.A OD2 no hydrogen 3.057 N/A CYS 37.A SG THR 39.A OG1 no hydrogen 3.728 N/A ASP 40.A N CYS 37.A O no hydrogen 2.825 N/A HIS 42.A N HIS 38.A O no hydrogen 3.009 N/A HIS 42.A ND1 ASP 47.A OD2 no hydrogen 2.847 N/A VAL 43.A N THR 39.A O no hydrogen 2.859 N/A LYS 44.A N ASP 40.A O no hydrogen 2.957 N/A LYS 44.A NZ HIS 10.A O no hydrogen 2.811 N/A LYS 44.A NZ ASN 45.A OD1 no hydrogen 3.072 N/A ASN 45.A N LEU 41.A O no hydrogen 2.947 N/A GLY 46.A N VAL 43.A O no hydrogen 2.997 N/A ASP 47.A N HIS 42.A O no hydrogen 2.996 N/A GLY 49.A N GLY 46.A O no hydrogen 2.870 N/A THR 52.A N ASP 50.A OD2 no hydrogen 2.939 N/A THR 52.A OG1 ASP 50.A OD2 no hydrogen 2.465 N/A GLY 53.A N VAL 6.A O no hydrogen 2.754 N/A VAL 54.A N LYS 51.A O no hydrogen 3.132 N/A ILE 55.A N ASP 114.A OD2 no hydrogen 3.151 N/A LEU 56.A N ALA 4.A O no hydrogen 2.952 N/A GLY 57.A N ASP 40.A OD1 no hydrogen 2.902 N/A GLY 60.A N VAL 82.A O no hydrogen 3.025 N/A ILE 61.A N CYS 33.A O no hydrogen 2.926 N/A GLY 62.A N ALA 80.A O no hydrogen 3.076 N/A VAL 63.A N LYS 30.A O no hydrogen 2.874 N/A VAL 64.A N ASP 78.A O no hydrogen 2.808 N/A ALA 65.A N LEU 28.A O no hydrogen 2.917 N/A GLY 68.A N GLU 26.A O no hydrogen 2.723 N/A VAL 71.A N GLY 68.A O no hydrogen 3.480 N/A SER 73.A OG ASP 126.A OD2 no hydrogen 2.707 N/A LYS 75.A N ASP 78.A OD2 no hydrogen 3.005 N/A LYS 75.A NZ ASP 78.A OD1 no hydrogen 2.935 N/A GLY 77.A N VAL 64.A O no hydrogen 2.845 N/A ASP 78.A N LYS 75.A O no hydrogen 3.129 N/A ARG 79.A NH1 LEU 135.A O no hydrogen 2.936 N/A ARG 79.A NH2 LEU 135.A O no hydrogen 2.866 N/A ARG 79.A NH2 SER 137.A OG no hydrogen 2.920 N/A ALA 80.A N GLY 62.A O no hydrogen 2.932 N/A SER 81.A OG VAL 129.A O no hydrogen 2.708 N/A VAL 82.A N GLY 60.A O no hydrogen 2.805 N/A TYR 86.A N LYS 107.A O no hydrogen 3.159 N/A TYR 86.A OH ILE 122.A O no hydrogen 2.685 N/A GLU 87.A N LYS 107.A O no hydrogen 3.355 N/A ASN 96.A N CYS 92.A O no hydrogen 3.075 N/A ASN 96.A ND2 GLY 90.A O no hydrogen 3.000 N/A SER 97.A N TYR 94.A O no hydrogen 3.377 N/A SER 97.A OG GLU 93.A O no hydrogen 2.516 N/A SER 97.A OG TYR 94.A O no hydrogen 3.274 N/A ASN 99.A N TYR 94.A O no hydrogen 2.964 N/A ASN 99.A ND2 SER 97.A OG no hydrogen 3.102 N/A THR 101.A OG1 LEU 283.A O no hydrogen 2.822 N/A LEU 102.A N ASN 99.A O no hydrogen 3.000 N/A CYS 103.A N GLU 100.A O no hydrogen 3.015 N/A ARG 104.A NE LEU 102.A O no hydrogen 2.899 N/A ARG 104.A NH2 LEU 102.A O no hydrogen 3.317 N/A VAL 106.A N CYS 103.A O no hydrogen 3.223 N/A LYS 107.A N GLU 87.A O no hydrogen 2.788 N/A LYS 107.A NZ GLU 87.A OE2 no hydrogen 2.397 N/A ASN 108.A N SER 112.A OG no hydrogen 2.950 N/A ASN 108.A ND2 TRP 84.A O no hydrogen 2.911 N/A ALA 109.A N TRP 84.A O no hydrogen 3.263 N/A GLY 110.A N VAL 113.A O no hydrogen 3.002 N/A TYR 111.A N ASN 108.A O no hydrogen 3.132 N/A TYR 111.A OH PHE 48.A O no hydrogen 2.992 N/A SER 112.A N ASN 108.A O no hydrogen 2.965 N/A VAL 113.A N ASN 108.A O no hydrogen 3.336 N/A GLY 115.A N ILE 55.A O no hydrogen 2.857 N/A GLY 116.A N GLY 57.A O no hydrogen 2.794 N/A MET 117.A N LEU 56.A O no hydrogen 2.915 N/A GLU 119.A N LYS 2.A O no hydrogen 2.918 N/A CYS 121.A N LEU 29.A O no hydrogen 2.959 N/A CYS 121.A SG GLY 115.A O no hydrogen 3.370 N/A CYS 121.A SG ILE 122.A O no hydrogen 3.583 N/A VAL 123.A N ALA 27.A O no hydrogen 2.855 N/A ALA 125.A N GLY 25.A O no hydrogen 2.836 N/A TYR 127.A N VAL 124.A O no hydrogen 3.009 N/A ALA 128.A N ALA 125.A O no hydrogen 3.298 N/A VAL 131.A N ARG 79.A O no hydrogen 2.967 N/A LEU 135.A N PRO 132.A O no hydrogen 3.318 N/A SER 137.A OG GLU 32.A OE1 no hydrogen 2.405 N/A ALA 139.A N ASP 136.A OD1 no hydrogen 2.935 N/A ALA 140.A N ASP 136.A O no hydrogen 2.934 N/A SER 141.A N SER 137.A O no hydrogen 2.914 N/A SER 141.A OG ALA 138.A O no hydrogen 2.605 N/A ILE 143.A N ALA 139.A O no hydrogen 3.324 N/A THR 144.A N ALA 140.A O no hydrogen 3.108 N/A THR 144.A N SER 141.A O no hydrogen 3.089 N/A THR 144.A OG1 ALA 140.A O no hydrogen 2.901 N/A ALA 146.A N GLU 59.A OE2 no hydrogen 3.052 N/A GLY 147.A N SER 142.A O no hydrogen 2.899 N/A VAL 148.A N ILE 143.A O no hydrogen 2.808 N/A THR 149.A N CYS 145.A O no hydrogen 2.949 N/A THR 149.A OG1 CYS 145.A O no hydrogen 2.674 N/A THR 150.A N ALA 146.A O no hydrogen 3.350 N/A THR 150.A OG1 ALA 146.A O no hydrogen 2.814 N/A THR 150.A OG1 GLY 147.A O no hydrogen 3.213 N/A TYR 151.A N GLY 147.A O no hydrogen 2.855 N/A TYR 151.A OH GLU 292.A OE1 no hydrogen 2.706 N/A LYS 152.A N VAL 148.A O no hydrogen 2.957 N/A LYS 152.A NZ ASP 289.A OD2 no hydrogen 2.887 N/A ALA 153.A N THR 149.A O no hydrogen 2.910 N/A VAL 154.A N THR 150.A O no hydrogen 2.930 N/A LYS 155.A N TYR 151.A O no hydrogen 2.969 N/A LEU 156.A N LYS 152.A O no hydrogen 2.747 N/A SER 157.A N ALA 153.A O no hydrogen 2.903 N/A SER 157.A N VAL 154.A O no hydrogen 3.308 N/A SER 157.A OG VAL 154.A O no hydrogen 2.697 N/A LYS 158.A N LYS 155.A O no hydrogen 3.388 N/A ILE 159.A N SER 157.A OG no hydrogen 3.142 N/A ARG 160.A N GLN 163.A OE1 no hydrogen 2.938 N/A GLY 162.A N ASN 186.A O no hydrogen 2.887 N/A GLN 163.A N ARG 160.A O no hydrogen 3.114 N/A TRP 164.A N HIS 230.A ND1 no hydrogen 3.054 N/A ILE 165.A N LYS 188.A O no hydrogen 2.803 N/A ALA 166.A N ALA 231.A O no hydrogen 2.913 N/A ILE 167.A N ILE 190.A O no hydrogen 2.729 N/A TYR 168.A N VAL 233.A O no hydrogen 2.950 N/A TYR 168.A OH SER 244.A OG no hydrogen 2.761 N/A GLY 169.A N ILE 192.A O no hydrogen 2.801 N/A LEU 170.A N ASP 193.A OD2 no hydrogen 2.768 N/A ASN 175.A N GLY 171.A O no hydrogen 2.883 N/A ALA 177.A N LEU 173.A O no hydrogen 2.748 N/A LEU 178.A N GLY 174.A O no hydrogen 2.962 N/A GLN 179.A N ASN 175.A O no hydrogen 3.138 N/A GLN 179.A NE2 ASN 175.A OD1 no hydrogen 2.961 N/A GLN 179.A NE2 VAL 303.A O no hydrogen 2.961 N/A TYR 180.A N LEU 176.A O no hydrogen 2.868 N/A TYR 180.A OH ALA 293.A O no hydrogen 2.913 N/A ALA 181.A N ALA 177.A O no hydrogen 2.853 N/A LYS 182.A N LEU 178.A O no hydrogen 2.944 N/A LYS 182.A NZ ALA 187.A O no hydrogen 3.362 N/A LYS 182.A NZ ASP 208.A OD1 no hydrogen 2.633 N/A LYS 182.A NZ ASP 208.A OD2 no hydrogen 3.285 N/A ASN 183.A N GLN 179.A O no hydrogen 2.801 N/A ASN 183.A ND2 LYS 301.A O no hydrogen 2.971 N/A VAL 184.A N TYR 180.A O no hydrogen 2.923 N/A PHE 185.A N TYR 180.A O no hydrogen 2.882 N/A ALA 187.A N ALA 181.A O no hydrogen 2.859 N/A LYS 188.A N GLN 163.A O no hydrogen 2.787 N/A VAL 189.A N ASP 208.A OD1 no hydrogen 2.827 N/A ILE 190.A N ILE 165.A O no hydrogen 2.868 N/A ALA 191.A N LEU 209.A O no hydrogen 2.909 N/A ILE 192.A N ILE 167.A O no hydrogen 2.923 N/A ASP 193.A N ILE 211.A O no hydrogen 3.158 N/A VAL 194.A N ASP 193.A OD1 no hydrogen 2.513 N/A ASN 195.A N ASP 193.A OD1 no hydrogen 3.104 N/A GLN 198.A N ASN 195.A OD1 no hydrogen 3.147 N/A GLN 198.A NE2 ILE 326.A O no hydrogen 3.104 N/A LEU 199.A N ASN 195.A O no hydrogen 3.142 N/A LYS 200.A N ASP 196.A O no hydrogen 2.741 N/A LEU 201.A N GLU 197.A O no hydrogen 3.099 N/A ALA 202.A N GLN 198.A O no hydrogen 3.013 N/A THR 203.A N LEU 199.A O no hydrogen 2.941 N/A THR 203.A OG1 LEU 199.A O no hydrogen 3.137 N/A GLU 204.A N LYS 200.A O no hydrogen 3.045 N/A MET 205.A N LEU 201.A O no hydrogen 2.983 N/A GLY 206.A N THR 203.A O no hydrogen 3.035 N/A ALA 207.A N ALA 202.A O no hydrogen 2.956 N/A LEU 209.A N VAL 189.A O no hydrogen 3.110 N/A ILE 211.A N ALA 191.A O no hydrogen 2.851 N/A ASN 212.A ND2 VAL 194.A O no hydrogen 3.521 N/A ASN 212.A ND2 ASP 196.A OD1 no hydrogen 2.833 N/A SER 213.A N ASP 193.A O no hydrogen 2.956 N/A SER 213.A OG ASP 193.A O no hydrogen 3.493 N/A HIS 214.A N ASN 212.A OD1 no hydrogen 2.788 N/A THR 215.A N ASN 212.A O no hydrogen 3.061 N/A THR 215.A OG1 ASN 212.A O no hydrogen 3.203 N/A GLU 216.A N ASN 212.A O no hydrogen 2.823 N/A ILE 221.A N ASP 217.A O no hydrogen 2.985 N/A VAL 222.A N ALA 218.A O no hydrogen 2.884 N/A GLN 223.A N ALA 219.A O no hydrogen 2.907 N/A GLN 223.A NE2 ASP 247.A O no hydrogen 2.919 N/A GLN 223.A NE2 VAL 249.A O no hydrogen 2.981 N/A GLU 224.A N LYS 220.A O no hydrogen 2.933 N/A LYS 225.A N ILE 221.A O no hydrogen 2.926 N/A THR 226.A N VAL 222.A O no hydrogen 2.958 N/A THR 226.A OG1 VAL 222.A O no hydrogen 2.690 N/A GLY 227.A N GLN 223.A O no hydrogen 2.917 N/A GLY 228.A N THR 226.A OG1 no hydrogen 3.086 N/A ALA 229.A N ALA 248.A O no hydrogen 2.968 N/A HIS 230.A N TRP 164.A O no hydrogen 2.822 N/A ALA 231.A N TRP 164.A O no hydrogen 3.293 N/A ALA 232.A N ARG 254.A O no hydrogen 2.855 N/A VAL 233.A N ALA 166.A O no hydrogen 2.923 N/A VAL 234.A N VAL 256.A O no hydrogen 2.924 N/A THR 235.A N TYR 168.A O no hydrogen 2.783 N/A THR 235.A OG1 TYR 168.A O no hydrogen 2.935 N/A LYS 239.A N GLU 263.A OE2 no hydrogen 2.828 N/A LYS 239.A NZ GLU 263.A OE1 no hydrogen 3.195 N/A ALA 241.A N ALA 238.A O no hydrogen 3.063 N/A ASN 243.A N LYS 239.A O no hydrogen 3.033 N/A SER 244.A N ALA 240.A O no hydrogen 2.919 N/A SER 244.A OG TYR 168.A OH no hydrogen 2.761 N/A ALA 245.A N ALA 241.A O no hydrogen 3.066 N/A VAL 246.A N PHE 242.A O no hydrogen 3.419 N/A ALA 248.A N ALA 245.A O no hydrogen 3.020 N/A ARG 250.A N ALA 229.A O no hydrogen 2.880 N/A ARG 250.A NE GLY 228.A O no hydrogen 2.854 N/A ARG 250.A NH2 GLY 228.A O no hydrogen 2.918 N/A GLY 252.A N ASP 275.A O no hydrogen 2.833 N/A GLY 253.A N ARG 250.A O no hydrogen 2.900 N/A ARG 254.A N HIS 230.A O no hydrogen 3.412 N/A ARG 254.A NE GLU 278.A OE2 no hydrogen 2.941 N/A ARG 254.A NH1 LEU 156.A O no hydrogen 2.840 N/A ARG 254.A NH2 GLU 278.A OE2 no hydrogen 3.068 N/A VAL 255.A N GLU 278.A O no hydrogen 2.752 N/A VAL 256.A N ALA 232.A O no hydrogen 2.724 N/A ALA 257.A N VAL 280.A O no hydrogen 2.780 N/A VAL 258.A N VAL 234.A O no hydrogen 2.992 N/A GLY 259.A N VAL 234.A O no hydrogen 3.014 N/A GLU 263.A N PRO 261.A O no hydrogen 2.753 N/A SER 266.A N ASN 243.A OD1 no hydrogen 2.650 N/A ARG 271.A N ASP 268.A OD1 no hydrogen 3.020 N/A ARG 271.A NE VAL 246.A O no hydrogen 3.337 N/A ARG 271.A NH1 ASP 275.A OD1 no hydrogen 2.868 N/A ARG 271.A NH2 VAL 246.A O no hydrogen 2.736 N/A ARG 271.A NH2 VAL 249.A O no hydrogen 2.871 N/A LEU 272.A N ASP 268.A O no hydrogen 2.931 N/A VAL 273.A N ILE 269.A O no hydrogen 2.943 N/A LEU 274.A N PRO 270.A O no hydrogen 2.818 N/A ASP 275.A N ARG 271.A O no hydrogen 3.091 N/A GLY 276.A N VAL 273.A O no hydrogen 3.086 N/A ILE 277.A N LEU 272.A O no hydrogen 3.081 N/A GLU 278.A N GLY 253.A O no hydrogen 2.959 N/A VAL 280.A N VAL 255.A O no hydrogen 2.889 N/A SER 282.A N ALA 257.A O no hydrogen 3.098 N/A THR 286.A N ASP 289.A OD2 no hydrogen 2.764 N/A ARG 287.A N GLU 100.A OE2 no hydrogen 2.902 N/A ARG 287.A NE GLU 100.A OE1 no hydrogen 3.391 N/A ARG 287.A NE GLU 100.A OE2 no hydrogen 3.086 N/A ARG 287.A NH1 ASP 126.A O no hydrogen 3.042 N/A ARG 287.A NH2 GLU 100.A OE1 no hydrogen 2.869 N/A GLN 288.A NE2 GLU 292.A OE2 no hydrogen 2.905 N/A ASP 289.A N THR 286.A OG1 no hydrogen 3.137 N/A LEU 290.A N THR 286.A O no hydrogen 3.029 N/A THR 291.A N ARG 287.A O no hydrogen 3.012 N/A THR 291.A OG1 ARG 287.A O no hydrogen 3.223 N/A GLU 292.A N GLN 288.A O no hydrogen 2.934 N/A ALA 293.A N ASP 289.A O no hydrogen 2.775 N/A PHE 294.A N LEU 290.A O no hydrogen 2.780 N/A GLN 295.A N THR 291.A O no hydrogen 3.098 N/A GLN 295.A NE2 GLU 299.A OE1 no hydrogen 2.559 N/A PHE 296.A N GLU 292.A O no hydrogen 3.189 N/A ALA 297.A N ALA 293.A O no hydrogen 3.344 N/A ALA 298.A N PHE 294.A O no hydrogen 2.824 N/A GLU 299.A N GLN 295.A O no hydrogen 3.016 N/A GLY 300.A N ALA 297.A O no hydrogen 2.981 N/A LYS 301.A N PHE 296.A O no hydrogen 2.950 N/A VAL 303.A N GLN 179.A OE1 no hydrogen 2.636 N/A ALA 307.A N ARG 329.A O no hydrogen 3.026 N/A ARG 309.A N VAL 331.A O no hydrogen 2.829 N/A ARG 309.A NE ASP 313.A OD1 no hydrogen 2.989 N/A ARG 309.A NH1 GLU 320.A OE1 no hydrogen 3.388 N/A ARG 309.A NH1 GLU 320.A OE2 no hydrogen 2.821 N/A ARG 309.A NH2 GLU 320.A OE1 no hydrogen 2.964 N/A ASP 313.A N PRO 310.A O no hydrogen 2.938 N/A ILE 314.A N LEU 311.A O no hydrogen 3.156 N/A ASN 315.A ND2 VAL 12.A O no hydrogen 2.944 N/A ILE 317.A N ASP 313.A O no hydrogen 2.813 N/A PHE 318.A N ILE 314.A O no hydrogen 3.060 N/A THR 319.A N ASN 315.A O no hydrogen 3.111 N/A THR 319.A OG1 ASN 315.A O no hydrogen 3.391 N/A GLU 320.A N THR 316.A O no hydrogen 2.941 N/A MET 321.A N ILE 317.A O no hydrogen 2.757 N/A GLU 322.A N PHE 318.A O no hydrogen 2.910 N/A GLU 323.A N THR 319.A O no hydrogen 2.951 N/A GLY 324.A N MET 321.A O no hydrogen 2.982 N/A LYS 325.A N GLU 320.A O no hydrogen 2.821 N/A ARG 327.A NH1 GLY 324.A O no hydrogen 3.242 N/A ARG 327.A NH1 ILE 326.A O no hydrogen 3.127 N/A ARG 329.A N LYS 305.A O no hydrogen 2.934 N/A ARG 329.A NE GLU 59.A OE1 no hydrogen 2.920 N/A ARG 329.A NE GLU 59.A OE2 no hydrogen 2.979 N/A ARG 329.A NH2 GLU 59.A OE2 no hydrogen 2.937 N/A VAL 331.A N ALA 307.A O no hydrogen 2.822 N/A ILE 332.A N CYS 34.A O no hydrogen 2.811 N/A ASP 333.A N ARG 309.A O no hydrogen 2.807 N/A PHE 334.A N GLU 32.A O no hydrogen 2.808 N/A ARG 335.A N ASP 333.A OD1 no hydrogen 2.966 N/A ARG 335.A NE ASP 333.A OD1 no hydrogen 2.834 N/A ARG 335.A NH2 ASP 333.A OD2 no hydrogen 3.132 N/A