Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2itw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 12.A N ILE 85.A O no hydrogen 2.788 N/A LYS 13.A N GLU 16.A OE2 no hydrogen 3.400 N/A GLU 16.A N LYS 13.A O no hydrogen 2.852 N/A LYS 18.A N LEU 35.A O no hydrogen 2.995 N/A LYS 19.A NZ GLN 92.A OE1 no hydrogen 3.438 N/A ILE 20.A N LYS 33.A O no hydrogen 2.705 N/A LYS 21.A N LYS 33.A O no hydrogen 3.393 N/A GLY 26.A N GLY 29.A O no hydrogen 2.936 N/A GLY 29.A N GLY 26.A O no hydrogen 2.835 N/A THR 30.A N GLU 51.A O no hydrogen 3.439 N/A TYR 32.A N ILE 49.A O no hydrogen 2.699 N/A GLY 34.A N VAL 47.A O no hydrogen 3.121 N/A LEU 35.A N LYS 18.A O no hydrogen 2.864 N/A TRP 36.A N ILE 45.A O no hydrogen 2.870 N/A ILE 37.A N GLU 16.A O no hydrogen 2.659 N/A GLU 39.A N GLU 16.A OE1 no hydrogen 3.310 N/A GLU 41.A N PRO 38.A O no hydrogen 3.382 N/A LYS 44.A N ASP 292.A O no hydrogen 3.220 N/A ILE 45.A N TRP 36.A O no hydrogen 2.893 N/A VAL 47.A N GLY 34.A O no hydrogen 2.920 N/A ALA 48.A N THR 95.A O no hydrogen 2.722 N/A ILE 49.A N TYR 32.A O no hydrogen 3.002 N/A LYS 50.A N LEU 93.A O no hydrogen 2.945 N/A GLU 51.A N THR 30.A O no hydrogen 3.048 N/A LEU 52.A N VAL 91.A O no hydrogen 3.053 N/A ARG 53.A NE ARG 53.A O no hydrogen 2.598 N/A THR 56.A OG1 GLU 54.A O no hydrogen 2.858 N/A ALA 60.A N SER 57.A OG no hydrogen 3.375 N/A ASN 61.A ND2 SER 57.A O no hydrogen 3.261 N/A LYS 62.A NZ ASP 66.A OD2 no hydrogen 3.204 N/A GLU 63.A N ALA 60.A O no hydrogen 2.854 N/A ILE 64.A N ALA 60.A O no hydrogen 3.380 N/A LEU 65.A N ASN 61.A O no hydrogen 3.155 N/A GLU 67.A N GLU 63.A O no hydrogen 2.813 N/A ALA 68.A N ILE 64.A O no hydrogen 2.909 N/A TYR 69.A N LEU 65.A O no hydrogen 2.803 N/A VAL 70.A N ASP 66.A O no hydrogen 2.833 N/A MET 71.A N GLU 67.A O no hydrogen 2.743 N/A ALA 72.A N ALA 68.A O no hydrogen 3.058 N/A SER 73.A N VAL 70.A O no hydrogen 2.897 N/A SER 73.A OG ASN 5.A OD1 no hydrogen 3.222 N/A SER 73.A OG TYR 69.A O no hydrogen 2.510 N/A SER 73.A OG VAL 70.A O no hydrogen 3.382 N/A ASP 75.A N TYR 132.A OH no hydrogen 2.832 N/A HIS 78.A N ASN 76.A OD1 no hydrogen 2.946 N/A HIS 78.A ND1 VAL 156.A O no hydrogen 3.305 N/A VAL 79.A N ASN 76.A O no hydrogen 3.198 N/A CYS 80.A N ILE 158.A O no hydrogen 2.888 N/A CYS 80.A SG ILE 158.A O no hydrogen 3.473 N/A ARG 81.A NE.A ALA 296.A O no hydrogen 3.139 N/A ARG 81.A NH2.A TYR 299.A O no hydrogen 2.695 N/A LEU 83.A N ILE 94.A O no hydrogen 2.720 N/A GLY 84.A N ILE 94.A O no hydrogen 3.242 N/A ILE 85.A N ARG 10.A O no hydrogen 2.987 N/A CYS 86.A N GLN 92.A O no hydrogen 2.813 N/A CYS 86.A SG LEU 12.A O no hydrogen 3.009 N/A THR 88.A OG1 THR 90.A O no hydrogen 2.223 N/A GLN 92.A N CYS 86.A O no hydrogen 2.988 N/A LEU 93.A N LYS 50.A O no hydrogen 2.813 N/A ILE 94.A N GLY 84.A O no hydrogen 2.762 N/A THR 95.A N ALA 48.A O no hydrogen 2.934 N/A THR 95.A OG1 ALA 48.A O no hydrogen 3.209 N/A GLN 96.A N ARG 81.A O no hydrogen 3.160 N/A GLN 96.A NE2 ASP 295.A OD2 no hydrogen 2.621 N/A GLN 96.A NE2 ASP 297.A OD1 no hydrogen 2.971 N/A GLN 96.A NE2 ASP 297.A OD2 no hydrogen 3.098 N/A LEU 97.A N PRO 46.A O no hydrogen 3.262 N/A PHE 100.A N VAL 150.A O no hydrogen 3.179 N/A GLY 101.A N MET 98.A O no hydrogen 2.938 N/A LEU 103.A N VAL 148.A O no hydrogen 2.861 N/A LEU 104.A N ALA 145.A O no hydrogen 3.135 N/A TYR 106.A N CYS 102.A O no hydrogen 3.062 N/A VAL 107.A N LEU 103.A O no hydrogen 2.786 N/A ARG 108.A N LEU 104.A O no hydrogen 3.338 N/A ARG 108.A NE GLY 216.A O no hydrogen 2.986 N/A ARG 108.A NH2 GLY 216.A O no hydrogen 2.805 N/A GLU 109.A N ASP 105.A O no hydrogen 2.807 N/A HIS 110.A N VAL 107.A O no hydrogen 3.170 N/A LYS 111.A NZ PHE 215.A O no hydrogen 3.537 N/A ASN 113.A N HIS 110.A O no hydrogen 2.629 N/A ILE 114.A N LYS 111.A O no hydrogen 3.381 N/A SER 116.A N ASP 289.A OD1 no hydrogen 3.172 N/A SER 116.A OG ASP 289.A OD2 no hydrogen 3.032 N/A GLN 117.A NE2 GLN 117.A O no hydrogen 3.444 N/A GLN 117.A NE2 ASN 121.A OD1 no hydrogen 3.140 N/A GLN 117.A NE2 ALA 277.A O no hydrogen 3.094 N/A TYR 118.A N GLY 115.A O no hydrogen 2.938 N/A LEU 119.A N GLY 115.A O no hydrogen 3.294 N/A LEU 120.A N SER 116.A O no hydrogen 2.939 N/A ASN 121.A N GLN 117.A O no hydrogen 3.098 N/A TRP 122.A N TYR 118.A O no hydrogen 2.766 N/A TRP 122.A NE1 PRO 153.A O no hydrogen 2.758 N/A CYS 123.A N LEU 119.A O no hydrogen 3.088 N/A CYS 123.A SG LEU 119.A O no hydrogen 3.251 N/A VAL 124.A N LEU 120.A O no hydrogen 2.878 N/A GLN 125.A N ASN 121.A O no hydrogen 2.829 N/A GLN 125.A NE2 GLN 154.A O no hydrogen 3.073 N/A ILE 126.A N TRP 122.A O no hydrogen 2.911 N/A ALA 127.A N CYS 123.A O no hydrogen 2.981 N/A LYS 128.A N VAL 124.A O no hydrogen 2.894 N/A GLY 129.A N GLN 125.A O no hydrogen 2.911 N/A MET 130.A N ILE 126.A O no hydrogen 2.921 N/A ASN 131.A N ALA 127.A O no hydrogen 2.804 N/A TYR 132.A N LYS 128.A O no hydrogen 2.963 N/A LEU 133.A N GLY 129.A O no hydrogen 2.830 N/A GLU 134.A N MET 130.A O no hydrogen 2.675 N/A ASP 135.A N ASN 131.A O no hydrogen 3.066 N/A ARG 136.A N TYR 132.A O no hydrogen 3.017 N/A ARG 136.A NH1 ARG 136.A O no hydrogen 3.221 N/A ARG 137.A N GLU 134.A O no hydrogen 2.962 N/A ARG 137.A NH2 LEU 167.A O no hydrogen 3.250 N/A ARG 137.A NH2 GLU 171.A O no hydrogen 3.469 N/A LEU 138.A N LEU 133.A O no hydrogen 2.892 N/A VAL 139.A N LYS 165.A O no hydrogen 3.061 N/A HIS 140.A N ASP 201.A OD1 no hydrogen 2.737 N/A HIS 140.A NE2 THR 159.A O no hydrogen 2.708 N/A ARG 141.A N ASP 201.A OD2 no hydrogen 3.132 N/A ARG 141.A NH1 LEU 163.A O no hydrogen 2.605 N/A ASP 142.A N HIS 140.A ND1 no hydrogen 2.876 N/A ALA 145.A N GLU 211.A OE2 no hydrogen 2.914 N/A ARG 146.A NH1 ASP 142.A OD1 no hydrogen 2.909 N/A ASN 147.A N ALA 144.A O no hydrogen 2.854 N/A ASN 147.A ND2 ASP 142.A O no hydrogen 2.549 N/A LEU 149.A N LYS 157.A O no hydrogen 2.766 N/A VAL 150.A N GLY 101.A O no hydrogen 2.833 N/A LYS 151.A N HIS 155.A O no hydrogen 2.916 N/A LYS 151.A NZ ASP 295.A OD2 no hydrogen 3.354 N/A LYS 151.A NZ ASP 297.A OD2 no hydrogen 2.652 N/A THR 152.A N HIS 155.A O no hydrogen 3.340 N/A GLN 154.A N THR 152.A OG1 no hydrogen 3.272 N/A GLN 154.A NE2 THR 152.A OG1 no hydrogen 3.019 N/A HIS 155.A N THR 152.A O no hydrogen 2.649 N/A HIS 155.A NE2 PRO 77.A O no hydrogen 2.801 N/A VAL 156.A N GLN 125.A OE1 no hydrogen 2.904 N/A LYS 157.A N LEU 149.A O no hydrogen 2.942 N/A LYS 157.A NZ GLN 96.A OE1 no hydrogen 2.803 N/A LYS 157.A NZ ASP 297.A OD1 no hydrogen 2.734 N/A LYS 157.A NZ ASP 297.A OD2 no hydrogen 3.236 N/A ILE 158.A N HIS 78.A O no hydrogen 2.825 N/A THR 159.A N ASN 147.A O no hydrogen 2.834 N/A ASP 160.A N THR 159.A OG1 no hydrogen 2.454 N/A LYS 165.A N VAL 139.A O no hydrogen 3.015 N/A LYS 165.A NZ TYR 174.A OH no hydrogen 2.637 N/A LEU 167.A N ARG 137.A O no hydrogen 3.204 N/A GLY 168.A N GLU 171.A OE1 no hydrogen 2.931 N/A LYS 172.A NZ GLU 170.A O no hydrogen 3.348 N/A TYR 174.A N TYR 196.A O no hydrogen 2.921 N/A ALA 176.A N ARG 194.A O no hydrogen 3.249 N/A LYS 184.A NZ PRO 219.A O no hydrogen 3.461 N/A LYS 184.A NZ TYR 220.A O no hydrogen 3.324 N/A LYS 184.A NZ ILE 223.A O no hydrogen 3.039 N/A TRP 185.A N PRO 182.A O no hydrogen 3.322 N/A TRP 185.A NE1 GLU 211.A OE2 no hydrogen 2.735 N/A MET 186.A N ILE 183.A O no hydrogen 3.191 N/A SER 190.A N ALA 187.A O no hydrogen 3.208 N/A SER 190.A OG ILE 195.A O no hydrogen 2.569 N/A ILE 191.A N ALA 187.A O no hydrogen 3.226 N/A LEU 192.A N LEU 188.A O no hydrogen 3.044 N/A ARG 194.A N SER 190.A O no hydrogen 2.967 N/A TYR 196.A N TYR 174.A O no hydrogen 3.172 N/A THR 197.A N SER 200.A OG no hydrogen 2.935 N/A GLN 199.A N THR 197.A OG1 no hydrogen 2.881 N/A GLN 199.A NE2 ALA 260.A O no hydrogen 3.266 N/A GLN 199.A NE2 ARG 263.A O no hydrogen 3.443 N/A GLN 199.A NE2 PRO 264.A O no hydrogen 3.421 N/A SER 200.A N THR 197.A O no hydrogen 3.044 N/A SER 200.A OG THR 197.A O no hydrogen 2.843 N/A ASP 201.A N THR 197.A O no hydrogen 3.303 N/A ASP 201.A N HIS 198.A O no hydrogen 2.933 N/A VAL 202.A N HIS 198.A O no hydrogen 3.147 N/A TRP 203.A N GLN 199.A O no hydrogen 3.266 N/A SER 204.A N SER 200.A O no hydrogen 3.276 N/A SER 204.A OG TRP 185.A O no hydrogen 2.885 N/A SER 204.A OG SER 200.A O no hydrogen 3.164 N/A TYR 205.A N ASP 201.A O no hydrogen 2.844 N/A TYR 205.A OH CYS 123.A O no hydrogen 2.557 N/A GLY 206.A N VAL 202.A O no hydrogen 2.858 N/A VAL 207.A N TRP 203.A O no hydrogen 3.138 N/A THR 208.A N SER 204.A O no hydrogen 2.753 N/A THR 208.A OG1 SER 204.A O no hydrogen 2.771 N/A VAL 209.A N TYR 205.A O no hydrogen 2.688 N/A TRP 210.A N GLY 206.A O no hydrogen 2.974 N/A TRP 210.A NE1 PRO 239.A O no hydrogen 2.832 N/A GLU 211.A N VAL 207.A O no hydrogen 2.713 N/A LEU 212.A N THR 208.A O no hydrogen 2.932 N/A MET 213.A N VAL 209.A O no hydrogen 2.955 N/A THR 214.A N TRP 210.A O no hydrogen 3.293 N/A THR 214.A OG1 TRP 210.A O no hydrogen 3.194 N/A THR 214.A OG1 GLU 211.A O no hydrogen 3.504 N/A PHE 215.A N LEU 212.A O no hydrogen 3.041 N/A GLY 216.A N GLU 211.A O no hydrogen 2.777 N/A SER 217.A N THR 214.A OG1 no hydrogen 2.928 N/A SER 217.A OG THR 214.A O no hydrogen 3.553 N/A GLU 227.A N PRO 224.A O no hydrogen 2.931 N/A SER 230.A N GLU 227.A O no hydrogen 2.898 N/A ILE 231.A N GLU 227.A O no hydrogen 3.224 N/A LEU 232.A N ILE 228.A O no hydrogen 2.895 N/A GLU 233.A N SER 230.A O no hydrogen 2.560 N/A LYS 234.A N SER 230.A O no hydrogen 2.850 N/A GLY 235.A N LEU 232.A O no hydrogen 3.230 N/A ARG 237.A NE GLU 236.A O no hydrogen 2.510 N/A ARG 237.A NH2 LEU 232.A O no hydrogen 2.599 N/A GLN 240.A NE2 CYS 244.A O no hydrogen 2.946 N/A CYS 244.A N PRO 241.A O no hydrogen 2.891 N/A THR 245.A N TYR 283.A O no hydrogen 3.140 N/A THR 245.A OG1 TYR 283.A O no hydrogen 2.535 N/A TYR 249.A N THR 245.A O no hydrogen 3.035 N/A TYR 249.A OH LEU 238.A O no hydrogen 2.410 N/A MET 250.A N ILE 246.A O no hydrogen 2.770 N/A ILE 251.A N VAL 248.A O no hydrogen 2.915 N/A MET 252.A N VAL 248.A O no hydrogen 3.376 N/A VAL 253.A N TYR 249.A O no hydrogen 2.994 N/A LYS 254.A N MET 250.A O no hydrogen 2.997 N/A CYS 255.A N ILE 251.A O no hydrogen 3.131 N/A CYS 255.A SG ILE 251.A O no hydrogen 3.549 N/A TRP 256.A N VAL 253.A O no hydrogen 2.790 N/A MET 257.A N LYS 254.A O no hydrogen 3.041 N/A ASP 261.A N ASP 259.A OD1 no hydrogen 3.417 N/A SER 262.A N ASP 259.A O no hydrogen 2.564 N/A SER 262.A OG ASP 259.A OD2 no hydrogen 2.787 N/A ARG 263.A N ALA 260.A O no hydrogen 3.374 N/A ARG 263.A NE MET 257.A O no hydrogen 2.620 N/A ARG 263.A NH1 GLU 189.A OE2 no hydrogen 2.612 N/A ARG 263.A NH1 MET 257.A O no hydrogen 2.968 N/A ARG 263.A NH2 GLU 189.A OE1 no hydrogen 3.335 N/A ARG 263.A NH2 GLU 189.A OE2 no hydrogen 3.220 N/A ARG 263.A NH2 GLN 199.A O no hydrogen 3.105 N/A LYS 265.A N GLU 268.A OE1 no hydrogen 2.863 N/A LYS 265.A NZ ARG 263.A O no hydrogen 2.697 N/A GLU 268.A N LYS 265.A O no hydrogen 2.446 N/A LEU 269.A N LYS 265.A O no hydrogen 3.015 N/A ILE 270.A N PHE 266.A O no hydrogen 2.943 N/A ILE 271.A N ARG 267.A O no hydrogen 3.415 N/A GLU 272.A N GLU 268.A O no hydrogen 2.712 N/A PHE 273.A N LEU 269.A O no hydrogen 2.989 N/A SER 274.A N ILE 270.A O no hydrogen 3.005 N/A LYS 275.A N ILE 271.A O no hydrogen 2.925 N/A LYS 275.A NZ GLU 272.A OE1 no hydrogen 3.045 N/A LYS 275.A NZ GLU 272.A OE2 no hydrogen 3.329 N/A MET 276.A N GLU 272.A O no hydrogen 3.127 N/A ALA 277.A N PHE 273.A O no hydrogen 2.678 N/A ARG 278.A N LYS 275.A O no hydrogen 3.259 N/A ASP 279.A N MET 276.A O no hydrogen 3.025 N/A ARG 282.A N ASP 279.A O no hydrogen 2.960 N/A TYR 283.A N PRO 280.A O no hydrogen 3.185 N/A LEU 284.A N PRO 280.A O no hydrogen 3.087 N/A VAL 285.A N ILE 243.A O no hydrogen 2.816 N/A ASP 289.A N ILE 286.A O no hydrogen 3.138 N/A VAL 294.A N LYS 44.A O no hydrogen 3.088 N/A ASP 297.A N ASP 295.A OD2 no hydrogen 3.202 N/A GLU 298.A N ASP 295.A O no hydrogen 2.849 N/A TYR 299.A N ALA 296.A O no hydrogen 3.051 N/A TYR 299.A OH GLU 41.A OE1 no hydrogen 2.327 N/A TYR 299.A OH GLU 41.A OE2 no hydrogen 3.264 N/A