Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2itq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 11.A N ILE 84.A O no hydrogen 2.907 N/A GLU 15.A N LYS 12.A O no hydrogen 3.025 N/A PHE 16.A N GLU 13.A O no hydrogen 3.405 N/A LYS 17.A N LEU 34.A O no hydrogen 3.049 N/A LYS 18.A NZ GLN 91.A OE1 no hydrogen 2.980 N/A LEU 22.A N VAL 30.A O no hydrogen 2.821 N/A GLY 25.A N GLY 28.A O no hydrogen 2.774 N/A GLY 28.A N GLY 25.A O no hydrogen 3.006 N/A THR 29.A N GLU 50.A O no hydrogen 3.028 N/A VAL 30.A N SER 23.A O no hydrogen 2.693 N/A TYR 31.A N ILE 48.A O no hydrogen 2.878 N/A LYS 32.A N LYS 20.A O no hydrogen 2.955 N/A GLY 33.A N VAL 46.A O no hydrogen 2.860 N/A LEU 34.A N LYS 17.A O no hydrogen 2.966 N/A TRP 35.A N ILE 44.A O no hydrogen 3.034 N/A TRP 35.A NE1 GLU 15.A OE2 no hydrogen 3.279 N/A ILE 36.A N GLU 15.A O no hydrogen 2.789 N/A GLU 38.A N GLU 15.A OE1 no hydrogen 3.070 N/A LYS 43.A N ASP 291.A O no hydrogen 2.956 N/A ILE 44.A N TRP 35.A O no hydrogen 2.924 N/A VAL 46.A N GLY 33.A O no hydrogen 2.978 N/A ALA 47.A N THR 94.A O no hydrogen 2.832 N/A ILE 48.A N TYR 31.A O no hydrogen 2.888 N/A LYS 49.A N LEU 92.A O no hydrogen 2.705 N/A LYS 49.A NZ GLU 66.A OE1 no hydrogen 2.496 N/A LYS 49.A NZ GLU 66.A OE2 no hydrogen 3.464 N/A GLU 50.A N THR 29.A O no hydrogen 3.072 N/A THR 55.A OG1 GLU 53.A O no hydrogen 3.216 N/A ALA 59.A N SER 56.A O no hydrogen 2.781 N/A ALA 59.A N SER 56.A OG no hydrogen 3.392 N/A ASN 60.A ND2 THR 55.A O no hydrogen 3.523 N/A ASN 60.A ND2 SER 56.A O no hydrogen 2.836 N/A LYS 61.A NZ ASP 65.A OD2 no hydrogen 3.427 N/A GLU 62.A N LYS 58.A O no hydrogen 3.397 N/A LEU 64.A N ASN 60.A O no hydrogen 3.159 N/A ASP 65.A N LYS 61.A O no hydrogen 3.066 N/A GLU 66.A N GLU 62.A O no hydrogen 3.056 N/A ALA 67.A N ILE 63.A O no hydrogen 3.158 N/A TYR 68.A N LEU 64.A O no hydrogen 2.921 N/A VAL 69.A N ASP 65.A O no hydrogen 2.962 N/A MET 70.A N GLU 66.A O no hydrogen 2.745 N/A ALA 71.A N ALA 67.A O no hydrogen 2.774 N/A SER 72.A N VAL 69.A O no hydrogen 2.912 N/A SER 72.A OG ASN 4.A OD1 no hydrogen 3.194 N/A SER 72.A OG TYR 68.A O no hydrogen 2.618 N/A ASP 74.A N TYR 131.A OH no hydrogen 2.690 N/A HIS 77.A N ASN 75.A OD1 no hydrogen 2.801 N/A VAL 78.A N ASN 75.A O no hydrogen 3.081 N/A CYS 79.A N ILE 157.A O no hydrogen 2.913 N/A ARG 80.A NE.A ASP 296.A OD1 no hydrogen 2.703 N/A ARG 80.A NH1.B ALA 295.A O no hydrogen 2.971 N/A ARG 80.A NH1.B TYR 298.A O no hydrogen 2.725 N/A ARG 80.A NH2.A ASP 296.A OD1 no hydrogen 3.319 N/A LEU 82.A N ILE 93.A O no hydrogen 2.609 N/A GLY 83.A N ILE 93.A O no hydrogen 3.284 N/A ILE 84.A N ARG 9.A O no hydrogen 2.843 N/A CYS 85.A N GLN 91.A O no hydrogen 2.739 N/A CYS 85.A SG LEU 11.A O no hydrogen 3.490 N/A THR 87.A OG1 THR 89.A O no hydrogen 2.272 N/A GLN 91.A N CYS 85.A O no hydrogen 3.052 N/A LEU 92.A N LYS 49.A O no hydrogen 2.718 N/A ILE 93.A N GLY 83.A O no hydrogen 2.879 N/A THR 94.A N ALA 47.A O no hydrogen 2.956 N/A THR 94.A OG1 ALA 47.A O no hydrogen 3.487 N/A THR 94.A OG1 GLN 95.A O no hydrogen 3.318 N/A GLN 95.A N ARG 80.A O.A no hydrogen 3.060 N/A GLN 95.A N ARG 80.A O.B no hydrogen 3.073 N/A GLN 95.A NE2 ASP 296.A OD1 no hydrogen 3.173 N/A GLN 95.A NE2 ASP 296.A OD2 no hydrogen 3.186 N/A LEU 96.A N PRO 45.A O no hydrogen 3.108 N/A PHE 99.A N VAL 149.A O no hydrogen 3.179 N/A GLY 100.A N MET 97.A O no hydrogen 2.936 N/A CYS 101.A SG ALA 144.A O no hydrogen 3.818 N/A CYS 101.A SG ARG 145.A O no hydrogen 3.182 N/A LEU 102.A N VAL 147.A O no hydrogen 2.855 N/A LEU 103.A N ALA 144.A O no hydrogen 3.170 N/A TYR 105.A N CYS 101.A O no hydrogen 3.053 N/A VAL 106.A N LEU 102.A O no hydrogen 2.960 N/A VAL 106.A N LEU 103.A O no hydrogen 3.222 N/A ARG 107.A N LEU 103.A O no hydrogen 3.218 N/A ARG 107.A NE GLY 215.A O no hydrogen 2.626 N/A ARG 107.A NH2 GLY 215.A O no hydrogen 2.881 N/A GLU 108.A N ASP 104.A O no hydrogen 2.919 N/A HIS 109.A N VAL 106.A O no hydrogen 3.238 N/A LYS 110.A NZ PHE 214.A O no hydrogen 3.251 N/A ASN 112.A N HIS 109.A O no hydrogen 2.698 N/A ILE 113.A N LYS 110.A O no hydrogen 2.855 N/A SER 115.A OG ASP 288.A OD1 no hydrogen 3.090 N/A GLN 116.A NE2 ALA 276.A O no hydrogen 2.764 N/A LEU 118.A N GLY 114.A O no hydrogen 3.251 N/A LEU 119.A N SER 115.A O no hydrogen 2.945 N/A ASN 120.A N GLN 116.A O no hydrogen 3.028 N/A TRP 121.A N TYR 117.A O no hydrogen 2.841 N/A TRP 121.A NE1 PRO 152.A O no hydrogen 2.937 N/A CYS 122.A N LEU 118.A O no hydrogen 3.151 N/A CYS 122.A SG LEU 118.A O no hydrogen 3.229 N/A VAL 123.A N LEU 119.A O no hydrogen 3.049 N/A GLN 124.A N ASN 120.A O no hydrogen 2.891 N/A GLN 124.A NE2 GLN 153.A O no hydrogen 3.052 N/A ILE 125.A N TRP 121.A O no hydrogen 2.913 N/A ALA 126.A N CYS 122.A O no hydrogen 3.199 N/A LYS 127.A N VAL 123.A O no hydrogen 2.904 N/A GLY 128.A N GLN 124.A O no hydrogen 2.981 N/A MET 129.A N ILE 125.A O no hydrogen 2.959 N/A ASN 130.A N ALA 126.A O no hydrogen 2.778 N/A TYR 131.A N LYS 127.A O no hydrogen 3.014 N/A LEU 132.A N GLY 128.A O no hydrogen 2.914 N/A GLU 133.A N MET 129.A O no hydrogen 2.868 N/A ASP 134.A N ASN 130.A O no hydrogen 2.975 N/A ARG 135.A N TYR 131.A O no hydrogen 2.979 N/A ARG 135.A NE SER 72.A O no hydrogen 3.314 N/A ARG 136.A N GLU 133.A O no hydrogen 2.670 N/A ARG 136.A NH2 LEU 166.A O no hydrogen 3.561 N/A LEU 137.A N LEU 132.A O no hydrogen 2.720 N/A VAL 138.A N LYS 164.A O no hydrogen 3.053 N/A HIS 139.A N ASP 200.A OD1 no hydrogen 2.725 N/A HIS 139.A NE2 THR 158.A O no hydrogen 2.933 N/A ARG 140.A N ASP 200.A OD2 no hydrogen 3.066 N/A ARG 140.A NH1 LEU 162.A O no hydrogen 2.831 N/A ASP 141.A N HIS 139.A ND1 no hydrogen 2.890 N/A ALA 144.A N GLU 210.A OE2 no hydrogen 3.022 N/A ARG 145.A NH1 ASP 141.A OD1 no hydrogen 2.754 N/A ASN 146.A N ALA 143.A O no hydrogen 2.955 N/A ASN 146.A ND2 ASP 141.A O no hydrogen 2.637 N/A LEU 148.A N LYS 156.A O no hydrogen 2.802 N/A VAL 149.A N GLY 100.A O no hydrogen 2.786 N/A LYS 150.A N HIS 154.A O no hydrogen 2.892 N/A LYS 150.A NZ ASP 294.A OD2 no hydrogen 3.226 N/A LYS 150.A NZ ASP 296.A OD2 no hydrogen 2.504 N/A THR 151.A N HIS 154.A O no hydrogen 3.466 N/A GLN 153.A N THR 151.A OG1 no hydrogen 3.100 N/A HIS 154.A N THR 151.A O no hydrogen 2.632 N/A HIS 154.A NE2 PRO 76.A O no hydrogen 2.903 N/A VAL 155.A N GLN 124.A OE1 no hydrogen 2.901 N/A LYS 156.A N LEU 148.A O no hydrogen 2.839 N/A LYS 156.A NZ GLN 95.A OE1 no hydrogen 2.910 N/A LYS 156.A NZ ASP 296.A OD2 no hydrogen 2.732 N/A ILE 157.A N HIS 77.A O no hydrogen 2.895 N/A THR 158.A N ASN 146.A O no hydrogen 2.828 N/A ALA 163.A N PHE 160.A O no hydrogen 2.894 N/A LYS 164.A N VAL 138.A O no hydrogen 2.985 N/A LYS 164.A NZ TYR 173.A OH no hydrogen 3.336 N/A LEU 166.A N ARG 136.A O no hydrogen 3.169 N/A GLY 167.A N GLU 170.A OE1 no hydrogen 3.269 N/A GLU 170.A N GLY 167.A O no hydrogen 3.271 N/A TYR 173.A N TYR 195.A O no hydrogen 2.924 N/A ALA 175.A N ARG 193.A O no hydrogen 3.174 N/A LYS 183.A NZ TYR 219.A O no hydrogen 3.469 N/A LYS 183.A NZ ILE 222.A O no hydrogen 3.146 N/A TRP 184.A NE1 GLU 210.A OE2 no hydrogen 2.945 N/A MET 185.A N ILE 182.A O no hydrogen 3.181 N/A SER 189.A OG ILE 194.A O no hydrogen 2.382 N/A ILE 190.A N ALA 186.A O no hydrogen 3.262 N/A LEU 191.A N LEU 187.A O no hydrogen 2.972 N/A HIS 192.A N GLU 188.A O no hydrogen 3.237 N/A ARG 193.A N SER 189.A O no hydrogen 2.762 N/A ILE 194.A N GLU 188.A O no hydrogen 3.452 N/A TYR 195.A N TYR 173.A O no hydrogen 3.044 N/A THR 196.A N SER 199.A OG no hydrogen 2.756 N/A GLN 198.A NE2 ALA 259.A O no hydrogen 3.162 N/A GLN 198.A NE2 PRO 263.A O no hydrogen 3.285 N/A SER 199.A N THR 196.A O no hydrogen 3.010 N/A SER 199.A OG THR 196.A O no hydrogen 2.720 N/A ASP 200.A N THR 196.A O no hydrogen 3.126 N/A VAL 201.A N HIS 197.A O no hydrogen 3.016 N/A TRP 202.A N GLN 198.A O no hydrogen 3.498 N/A SER 203.A OG TRP 184.A O no hydrogen 2.442 N/A SER 203.A OG SER 199.A O no hydrogen 3.366 N/A TYR 204.A N ASP 200.A O no hydrogen 2.816 N/A TYR 204.A OH CYS 122.A O no hydrogen 2.429 N/A GLY 205.A N VAL 201.A O no hydrogen 2.829 N/A VAL 206.A N TRP 202.A O no hydrogen 3.131 N/A THR 207.A N SER 203.A O no hydrogen 2.773 N/A THR 207.A OG1 SER 203.A O no hydrogen 2.358 N/A VAL 208.A N TYR 204.A O no hydrogen 2.844 N/A TRP 209.A N GLY 205.A O no hydrogen 3.143 N/A TRP 209.A NE1 PRO 238.A O no hydrogen 2.910 N/A GLU 210.A N VAL 206.A O no hydrogen 2.826 N/A LEU 211.A N THR 207.A O no hydrogen 2.929 N/A MET 212.A N VAL 208.A O no hydrogen 2.750 N/A THR 213.A N TRP 209.A O no hydrogen 2.933 N/A THR 213.A OG1 TRP 209.A O no hydrogen 3.149 N/A THR 213.A OG1 GLU 210.A O no hydrogen 3.269 N/A PHE 214.A N LEU 211.A O no hydrogen 2.859 N/A GLY 215.A N GLU 210.A O no hydrogen 2.799 N/A SER 216.A N THR 213.A OG1 no hydrogen 3.112 N/A SER 216.A OG THR 213.A O no hydrogen 3.115 N/A SER 216.A OG THR 213.A OG1 no hydrogen 3.110 N/A GLU 226.A N PRO 223.A O no hydrogen 3.001 N/A SER 228.A OG SER 225.A O no hydrogen 3.510 N/A SER 229.A N GLU 226.A O no hydrogen 2.584 N/A ILE 230.A N GLU 226.A O no hydrogen 3.072 N/A LEU 231.A N ILE 227.A O no hydrogen 3.025 N/A GLU 232.A N SER 229.A O no hydrogen 2.757 N/A LYS 233.A N SER 229.A O no hydrogen 2.725 N/A GLU 235.A N ILE 230.A O no hydrogen 3.207 N/A ARG 236.A NE GLU 235.A O no hydrogen 2.449 N/A ARG 236.A NH2 LEU 231.A O no hydrogen 2.775 N/A GLN 239.A NE2 CYS 243.A O no hydrogen 3.008 N/A CYS 243.A N PRO 240.A O no hydrogen 2.891 N/A THR 244.A N TYR 282.A O no hydrogen 3.281 N/A THR 244.A OG1 TYR 282.A O no hydrogen 2.713 N/A TYR 248.A N THR 244.A O no hydrogen 3.020 N/A TYR 248.A OH LEU 237.A O no hydrogen 2.474 N/A MET 249.A N ILE 245.A O no hydrogen 2.940 N/A ILE 250.A N VAL 247.A O no hydrogen 3.019 N/A MET 251.A N VAL 247.A O no hydrogen 3.320 N/A VAL 252.A N TYR 248.A O no hydrogen 3.016 N/A LYS 253.A N MET 249.A O no hydrogen 3.077 N/A CYS 254.A N ILE 250.A O no hydrogen 3.309 N/A CYS 254.A SG ILE 250.A O no hydrogen 3.439 N/A TRP 255.A N VAL 252.A O no hydrogen 2.844 N/A MET 256.A N LYS 253.A O no hydrogen 3.142 N/A SER 261.A N ASP 258.A O no hydrogen 2.451 N/A SER 261.A OG ASP 258.A OD2 no hydrogen 2.706 N/A ARG 262.A N ALA 259.A O no hydrogen 3.284 N/A ARG 262.A NE MET 256.A O no hydrogen 2.898 N/A ARG 262.A NH1 GLU 188.A OE2 no hydrogen 2.597 N/A ARG 262.A NH1 MET 256.A O no hydrogen 2.918 N/A ARG 262.A NH2 GLU 188.A OE1 no hydrogen 3.396 N/A ARG 262.A NH2 GLN 198.A O no hydrogen 2.781 N/A LYS 264.A N GLU 267.A OE1 no hydrogen 3.019 N/A LYS 264.A NZ ASP 260.A O no hydrogen 3.550 N/A LYS 264.A NZ ARG 262.A O no hydrogen 2.547 N/A GLU 267.A N LYS 264.A O no hydrogen 2.620 N/A LEU 268.A N LYS 264.A O no hydrogen 3.182 N/A ILE 269.A N PHE 265.A O no hydrogen 3.105 N/A ILE 270.A N ARG 266.A O no hydrogen 3.390 N/A GLU 271.A N GLU 267.A O no hydrogen 2.921 N/A PHE 272.A N LEU 268.A O no hydrogen 2.971 N/A SER 273.A N ILE 269.A O no hydrogen 2.880 N/A LYS 274.A N ILE 270.A O no hydrogen 2.931 N/A LYS 274.A NZ GLU 271.A OE1 no hydrogen 3.077 N/A MET 275.A N GLU 271.A O no hydrogen 3.169 N/A ALA 276.A N PHE 272.A O no hydrogen 2.768 N/A ARG 277.A N LYS 274.A O no hydrogen 3.109 N/A ASP 278.A N MET 275.A O no hydrogen 3.133 N/A ARG 281.A N ASP 278.A O no hydrogen 3.110 N/A TYR 282.A N PRO 279.A O no hydrogen 2.983 N/A LEU 283.A N PRO 279.A O no hydrogen 2.977 N/A VAL 284.A N ILE 242.A O no hydrogen 2.792 N/A ASP 288.A N ILE 285.A O no hydrogen 3.000 N/A VAL 293.A N LYS 43.A O no hydrogen 2.936 N/A ASP 296.A N ASP 294.A OD2 no hydrogen 2.881 N/A GLU 297.A N ASP 294.A O no hydrogen 2.999 N/A TYR 298.A N ALA 295.A O no hydrogen 2.903 N/A TYR 298.A OH GLU 40.A OE1 no hydrogen 2.597 N/A