Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bwd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG SER 146.A OG no hydrogen 3.184 N/A LEU 3.A N SER 144.A OG no hydrogen 2.925 N/A VAL 4.A N SER 146.A OG no hydrogen 3.270 N/A VAL 6.A N GLY 114.A O no hydrogen 3.099 N/A ASN 8.A ND2 ASP 11.A OD2 no hydrogen 2.941 N/A TRP 10.A N ASN 8.A OD1 no hydrogen 3.090 N/A ASP 11.A N ASN 8.A OD1 no hydrogen 2.863 N/A LEU 13.A N VAL 290.A O no hydrogen 2.754 N/A GLU 14.A N ARG 338.A O no hydrogen 2.774 N/A GLU 15.A N ARG 338.A O no hydrogen 3.375 N/A VAL 16.A N THR 78.A O no hydrogen 3.032 N/A ILE 17.A N LEU 335.A O no hydrogen 2.880 N/A VAL 18.A N ARG 80.A O no hydrogen 2.918 N/A ALA 21.A N GLU 62.A OE1 no hydrogen 2.816 N/A ALA 24.A N ALA 21.A O no hydrogen 3.099 N/A ARG 25.A N PHE 101.A O no hydrogen 2.955 N/A ARG 25.A NE ASP 99.A OD2 no hydrogen 3.066 N/A VAL 26.A N GLY 51.A O no hydrogen 2.672 N/A THR 28.A N ASP 99.A OD1 no hydrogen 3.136 N/A ARG 31.A NH1 ASP 158.A O no hydrogen 3.141 N/A SER 32.A OG ASP 30.A OD1 no hydrogen 2.597 N/A PHE 34.A N ASP 30.A O no hydrogen 2.916 N/A ALA 35.A N ARG 31.A O no hydrogen 2.643 N/A VAL 36.A N SER 32.A O no hydrogen 2.826 N/A GLU 37.A N VAL 33.A O no hydrogen 2.825 N/A TYR 38.A N VAL 33.A O no hydrogen 3.269 N/A ALA 39.A N PHE 34.A O no hydrogen 2.861 N/A GLY 40.A N TYR 38.A O no hydrogen 2.948 N/A ASP 41.A N TYR 38.A O no hydrogen 3.329 N/A TYR 42.A N TYR 38.A O no hydrogen 3.127 N/A GLN 47.A N SER 44.A O no hydrogen 2.655 N/A ILE 48.A N GLN 45.A O no hydrogen 3.372 N/A SER 50.A N ILE 48.A O no hydrogen 2.888 N/A SER 50.A OG PRO 27.A O no hydrogen 2.652 N/A GLY 51.A N VAL 26.A O no hydrogen 2.877 N/A TYR 53.A N ALA 24.A O no hydrogen 3.115 N/A LEU 58.A N PRO 54.A O no hydrogen 3.407 N/A LYS 59.A N ASP 55.A O no hydrogen 2.722 N/A GLU 60.A N ARG 56.A O no hydrogen 2.950 N/A THR 61.A N VAL 57.A O no hydrogen 2.801 N/A THR 61.A OG1 VAL 57.A O no hydrogen 2.914 N/A GLU 62.A N LEU 58.A O no hydrogen 2.902 N/A GLU 63.A N LYS 59.A O no hydrogen 3.034 N/A GLU 64.A N GLU 60.A O no hydrogen 3.128 N/A LEU 65.A N THR 61.A O no hydrogen 2.672 N/A HIS 66.A N GLU 62.A O no hydrogen 2.952 N/A VAL 67.A N GLU 63.A O no hydrogen 2.957 N/A LEU 68.A N GLU 64.A O no hydrogen 3.088 N/A ALA 69.A N LEU 65.A O no hydrogen 3.217 N/A ALA 70.A N HIS 66.A O no hydrogen 2.929 N/A GLU 71.A N VAL 67.A O no hydrogen 2.893 N/A LEU 72.A N LEU 68.A O no hydrogen 3.004 N/A THR 73.A N ALA 69.A O no hydrogen 3.064 N/A THR 73.A OG1 ALA 69.A O no hydrogen 2.719 N/A LYS 74.A N ALA 70.A O no hydrogen 2.976 N/A LYS 74.A NZ GLU 71.A OE1 no hydrogen 3.341 N/A LEU 75.A N GLU 71.A O no hydrogen 2.937 N/A GLY 76.A N THR 73.A O no hydrogen 2.779 N/A VAL 77.A N LEU 72.A O no hydrogen 2.988 N/A THR 78.A N GLU 14.A O no hydrogen 2.678 N/A ARG 80.A N VAL 16.A O no hydrogen 2.958 N/A ARG 80.A NH1 GLU 15.A OE2 no hydrogen 2.435 N/A ARG 80.A NH1 GLU 140.A OE2 no hydrogen 3.418 N/A ARG 80.A NH2 GLU 140.A OE1 no hydrogen 3.247 N/A ARG 80.A NH2 GLU 140.A OE2 no hydrogen 2.821 N/A ARG 81.A NH2 GLY 19.A O no hydrogen 2.696 N/A GLY 83.A N ALA 133.A O no hydrogen 2.733 N/A ARG 85.A NE ASP 103.A OD2 no hydrogen 2.811 N/A ARG 85.A NH1 LEU 129.A O no hydrogen 2.567 N/A ARG 85.A NH2 ASP 103.A OD1 no hydrogen 2.661 N/A ARG 85.A NH2 ASP 103.A OD2 no hydrogen 3.036 N/A ARG 85.A NH2 GLU 130.A O no hydrogen 2.638 N/A HIS 87.A NE2 ASP 103.A OD2 no hydrogen 2.674 N/A SER 88.A N ASP 86.A OD1 no hydrogen 2.513 N/A SER 88.A OG ASP 86.A OD1 no hydrogen 2.579 N/A SER 88.A OG ASP 86.A OD2 no hydrogen 3.354 N/A ALA 89.A N ASP 86.A OD1 no hydrogen 2.969 N/A ILE 91.A N THR 98.A O no hydrogen 2.682 N/A LYS 92.A NZ THR 93.A O no hydrogen 2.791 N/A THR 93.A N TRP 96.A O no hydrogen 2.983 N/A TRP 96.A N THR 93.A OG1 no hydrogen 3.281 N/A TRP 96.A NE1 ARG 155.A O no hydrogen 3.098 N/A THR 98.A N ILE 91.A O no hydrogen 2.921 N/A GLY 100.A N HIS 87.A O no hydrogen 2.647 N/A TYR 104.A N HIS 102.A ND1 no hydrogen 3.069 N/A TYR 104.A OH GLY 328.A O no hydrogen 2.970 N/A CYS 105.A SG GLY 327.A O no hydrogen 3.755 N/A ARG 107.A NH1 HIS 331.A O no hydrogen 3.091 N/A ARG 107.A NH2 ASP 336.A OD1 no hydrogen 2.303 N/A ASP 108.A N CYS 105.A O no hydrogen 3.413 N/A LEU 111.A N ILE 118.A O no hydrogen 3.017 N/A SER 112.A OG ASP 336.A O no hydrogen 3.177 N/A VAL 113.A N THR 116.A O no hydrogen 3.249 N/A GLN 115.A NE2 SER 5.A OG no hydrogen 2.921 N/A ILE 117.A N ARG 147.A O no hydrogen 2.863 N/A ILE 118.A N LEU 111.A O no hydrogen 2.754 N/A GLU 119.A N LEU 149.A O no hydrogen 2.767 N/A THR 120.A N GLY 109.A O no hydrogen 3.321 N/A THR 120.A OG1 PHE 178.A O no hydrogen 2.892 N/A ALA 123.A N ASP 179.A OD1 no hydrogen 3.356 N/A ARG 125.A NE LEU 156.A O no hydrogen 3.091 N/A ARG 125.A NH1 ASP 30.A OD1 no hydrogen 3.209 N/A ARG 125.A NH1 ASP 30.A OD2 no hydrogen 3.104 N/A ARG 125.A NH2 LEU 156.A O no hydrogen 2.935 N/A ARG 125.A NH2 ASP 158.A OD1 no hydrogen 3.292 N/A ARG 127.A N LEU 124.A O no hydrogen 2.830 N/A ARG 127.A NE GLU 130.A OE1 no hydrogen 2.703 N/A ARG 127.A NH1 ASP 108.A OD2 no hydrogen 2.577 N/A ARG 127.A NH2 GLU 130.A OE1 no hydrogen 3.242 N/A ARG 127.A NH2 GLU 130.A OE2 no hydrogen 2.712 N/A PHE 128.A N ARG 125.A O no hydrogen 2.933 N/A GLU 130.A N ARG 127.A O no hydrogen 3.208 N/A SER 131.A OG GLU 119.A OE1 no hydrogen 2.456 N/A LEU 132.A N LEU 129.A O no hydrogen 2.940 N/A TYR 134.A N SER 131.A O no hydrogen 2.954 N/A TYR 134.A OH ASP 103.A OD1 no hydrogen 3.274 N/A LYS 135.A N LEU 132.A O no hydrogen 3.256 N/A LEU 138.A N TYR 134.A O no hydrogen 3.019 N/A LEU 139.A N LYS 135.A O no hydrogen 2.901 N/A GLU 140.A N ASP 136.A O no hydrogen 3.194 N/A TYR 141.A N LEU 137.A O no hydrogen 2.887 N/A TYR 141.A OH GLU 15.A OE2 no hydrogen 2.848 N/A PHE 142.A N LEU 138.A O no hydrogen 2.605 N/A ALA 143.A N LEU 139.A O no hydrogen 2.887 N/A SER 144.A N PHE 142.A O no hydrogen 2.662 N/A SER 144.A OG TYR 141.A O no hydrogen 3.086 N/A GLY 145.A N PHE 142.A O no hydrogen 3.025 N/A SER 146.A N TYR 141.A O no hydrogen 3.366 N/A SER 146.A OG SER 2.A OG no hydrogen 3.184 N/A SER 146.A OG TYR 141.A O no hydrogen 3.519 N/A ARG 147.A N GLN 115.A O no hydrogen 2.741 N/A ARG 147.A NE THR 116.A OG1 no hydrogen 2.699 N/A ARG 147.A NH2 THR 116.A OG1 no hydrogen 3.283 N/A TRP 148.A NE1 GLU 119.A OE2 no hydrogen 2.853 N/A LEU 149.A N ILE 117.A O no hydrogen 2.803 N/A SER 150.A OG ALA 151.A O no hydrogen 2.618 N/A ALA 151.A N GLU 119.A O no hydrogen 2.867 N/A LYS 153.A NZ PHE 128.A O no hydrogen 2.767 N/A ARG 155.A N GLU 175.A OE1 no hydrogen 3.063 N/A LEU 156.A N GLU 175.A OE2 no hydrogen 2.759 N/A THR 157.A OG1 ASP 159.A OD1 no hydrogen 2.478 N/A SER 160.A N THR 157.A O no hydrogen 3.202 N/A TYR 161.A N ASP 158.A O no hydrogen 3.344 N/A TYR 161.A OH ALA 123.A O no hydrogen 2.326 N/A ALA 162.A N ARG 170.A O no hydrogen 2.713 N/A ALA 165.A N ALA 162.A O no hydrogen 2.841 N/A GLY 168.A N ASP 196.A OD2 no hydrogen 3.329 N/A ARG 170.A N ASP 196.A OD1 no hydrogen 2.993 N/A ARG 170.A NE ALA 165.A O no hydrogen 2.886 N/A THR 172.A N SER 160.A O no hydrogen 2.803 N/A THR 172.A OG1 ASP 159.A O no hydrogen 2.787 N/A PHE 178.A N PRO 121.A O no hydrogen 3.036 N/A ASP 179.A N SER 197.A O no hydrogen 3.111 N/A ALA 180.A N ASP 108.A O no hydrogen 2.691 N/A ASN 182.A N ASP 179.A O no hydrogen 3.196 N/A ASN 182.A ND2 LEU 193.A O no hydrogen 3.209 N/A VAL 183.A N ALA 180.A O no hydrogen 2.760 N/A LEU 184.A N LEU 191.A O no hydrogen 3.028 N/A ARG 185.A N GLU 9.A OE1 no hydrogen 2.834 N/A ARG 185.A NE SER 112.A O no hydrogen 3.009 N/A ARG 185.A NH1 GLU 9.A OE1 no hydrogen 3.333 N/A ARG 185.A NH1 ASP 336.A OD2 no hydrogen 3.368 N/A ARG 185.A NH2 SER 112.A O no hydrogen 3.537 N/A ARG 185.A NH2 SER 112.A OG no hydrogen 3.028 N/A ARG 185.A NH2 ASP 336.A OD1 no hydrogen 3.311 N/A ARG 185.A NH2 ASP 336.A OD2 no hydrogen 2.918 N/A PHE 186.A N ASP 189.A O no hydrogen 3.093 N/A GLY 187.A N HIS 7.A O no hydrogen 2.807 N/A THR 188.A N GLU 344.A O no hydrogen 3.163 N/A THR 188.A OG1 GLU 344.A O no hydrogen 3.009 N/A THR 188.A OG1 THR 345.A OG1 no hydrogen 2.870 N/A ASP 189.A N PHE 186.A O no hydrogen 3.185 N/A LEU 190.A N THR 215.A O no hydrogen 2.956 N/A LEU 191.A N LEU 184.A O no hydrogen 2.944 N/A TYR 192.A N HIS 217.A O no hydrogen 2.687 N/A TYR 192.A OH ASN 199.A O no hydrogen 2.526 N/A LEU 193.A N ASN 182.A O no hydrogen 2.780 N/A VAL 194.A N CYS 219.A O no hydrogen 2.861 N/A SER 195.A N GLY 198.A O no hydrogen 3.024 N/A SER 195.A OG THR 226.A O no hydrogen 2.750 N/A ASP 196.A N SER 225.A O no hydrogen 2.883 N/A SER 197.A N SER 195.A OG no hydrogen 3.382 N/A SER 197.A OG ASN 182.A OD1 no hydrogen 2.817 N/A SER 197.A OG THR 226.A O no hydrogen 2.942 N/A ASN 199.A N VAL 177.A O no hydrogen 3.010 N/A ASN 199.A ND2 GLU 175.A O no hydrogen 2.929 N/A LEU 201.A N ASP 173.A OD1 no hydrogen 2.900 N/A ALA 203.A N ASN 199.A O no hydrogen 3.205 N/A LYS 204.A N GLU 200.A O no hydrogen 2.753 N/A TRP 205.A N LEU 201.A O no hydrogen 2.739 N/A LEU 206.A N GLY 202.A O no hydrogen 2.630 N/A GLN 207.A N ALA 203.A O no hydrogen 2.941 N/A GLN 207.A NE2 GLN 207.A O no hydrogen 3.045 N/A SER 208.A N LYS 204.A O no hydrogen 3.394 N/A ALA 209.A N TRP 205.A O no hydrogen 3.173 N/A VAL 210.A N LEU 206.A O no hydrogen 3.222 N/A GLY 211.A N GLN 207.A O no hydrogen 2.974 N/A TYR 214.A N GLY 211.A O no hydrogen 3.241 N/A TYR 214.A OH VAL 113.A O no hydrogen 3.293 N/A THR 215.A N THR 188.A O no hydrogen 3.098 N/A THR 215.A OG1 HIS 217.A NE2 no hydrogen 2.899 N/A VAL 216.A N GLN 207.A OE1 no hydrogen 2.830 N/A HIS 217.A N LEU 190.A O no hydrogen 2.524 N/A HIS 217.A NE2 ASP 189.A OD1 no hydrogen 2.517 N/A CYS 219.A N TYR 192.A O no hydrogen 2.857 N/A THR 226.A OG1 SER 225.A O no hydrogen 3.566 N/A HIS 227.A NE2 ASP 179.A OD2 no hydrogen 2.572 N/A VAL 228.A N ALA 181.A O no hydrogen 3.277 N/A THR 231.A N VAL 228.A O no hydrogen 3.020 N/A ILE 232.A N VAL 228.A O no hydrogen 3.196 N/A VAL 233.A N LEU 241.A O no hydrogen 2.817 N/A LEU 235.A N LEU 239.A O no hydrogen 3.015 N/A ARG 236.A NH1 HIS 311.A O no hydrogen 2.913 N/A LEU 239.A N ARG 236.A O no hydrogen 3.041 N/A VAL 240.A N GLU 260.A O no hydrogen 3.036 N/A LEU 241.A N VAL 233.A O no hydrogen 3.041 N/A THR 242.A N ILE 262.A O no hydrogen 3.082 N/A THR 242.A OG1 ASN 261.A OD1 no hydrogen 3.417 N/A ASN 243.A N THR 231.A O no hydrogen 2.964 N/A ARG 246.A N ASN 243.A O no hydrogen 2.907 N/A VAL 247.A N ASN 243.A O no hydrogen 2.806 N/A GLU 250.A N ASN 248.A OD1 no hydrogen 2.614 N/A ASN 251.A ND2 LYS 221.A O no hydrogen 3.211 N/A MET 252.A N ASN 248.A O no hydrogen 3.289 N/A LEU 256.A N PRO 253.A O no hydrogen 3.432 N/A ARG 257.A N ASP 254.A O no hydrogen 3.120 N/A ARG 257.A NE MET 252.A O no hydrogen 3.296 N/A TRP 259.A N LEU 256.A O no hydrogen 2.999 N/A TRP 259.A NE1 TYR 346.A O no hydrogen 2.855 N/A GLU 260.A N GLY 238.A O no hydrogen 2.922 N/A ILE 262.A N VAL 240.A O no hydrogen 2.871 N/A CYS 264.A N THR 242.A O no hydrogen 3.238 N/A CYS 264.A SG PRO 265.A O no hydrogen 3.031 N/A VAL 268.A N GLN 301.A OE1 no hydrogen 2.813 N/A THR 273.A N THR 325.A OG1 no hydrogen 3.143 N/A HIS 278.A N ARG 324.A O no hydrogen 3.020 N/A HIS 278.A ND1 THR 325.A O no hydrogen 2.668 N/A HIS 278.A NE2 GLU 37.A OE1 no hydrogen 3.018 N/A CYS 279.A N ARG 324.A O no hydrogen 3.169 N/A CYS 279.A SG HIS 278.A O no hydrogen 3.775 N/A TRP 282.A N SER 280.A OG no hydrogen 3.257 N/A ILE 283.A N SER 280.A O no hydrogen 3.119 N/A GLY 284.A N VAL 281.A O no hydrogen 3.097 N/A MET 285.A N TRP 282.A O no hydrogen 3.113 N/A ASN 286.A N ILE 283.A O no hydrogen 2.607 N/A ASN 286.A ND2 ASP 229.A O no hydrogen 3.178 N/A LEU 287.A N MET 285.A O no hydrogen 2.613 N/A LEU 288.A N VAL 296.A O no hydrogen 3.318 N/A VAL 290.A N LEU 294.A O no hydrogen 2.693 N/A ARG 291.A N LEU 294.A O no hydrogen 3.164 N/A ARG 291.A NH1 ASP 293.A OD1 no hydrogen 2.809 N/A LEU 294.A N ARG 291.A O no hydrogen 2.890 N/A ALA 295.A N ASN 314.A O no hydrogen 3.061 N/A VAL 296.A N LEU 288.A O no hydrogen 2.740 N/A ARG 299.A N LEU 318.A O no hydrogen 2.815 N/A ARG 300.A N ASP 298.A OD1 no hydrogen 2.769 N/A ARG 300.A NE ASP 298.A OD1 no hydrogen 2.797 N/A ARG 300.A NH2 ASP 298.A OD2 no hydrogen 2.428 N/A ARG 300.A NH2 LEU 320.A O no hydrogen 3.009 N/A GLN 301.A N ASP 298.A O no hydrogen 2.981 N/A GLN 301.A NE2 VAL 268.A O no hydrogen 3.054 N/A ILE 305.A N GLN 301.A O no hydrogen 2.744 N/A ARG 306.A N THR 302.A O no hydrogen 3.037 N/A LEU 307.A N ALA 303.A O no hydrogen 3.039 N/A LEU 308.A N LEU 304.A O no hydrogen 3.051 N/A GLU 309.A N ILE 305.A O no hydrogen 2.939 N/A LYS 310.A N ARG 306.A O no hydrogen 2.890 N/A HIS 311.A N LEU 307.A O no hydrogen 3.180 N/A HIS 311.A N LEU 308.A O no hydrogen 3.118 N/A GLY 312.A N GLU 309.A O no hydrogen 2.737 N/A MET 313.A N LEU 308.A O no hydrogen 3.241 N/A ASN 314.A N ASP 293.A O no hydrogen 2.573 N/A LEU 316.A N ALA 295.A O no hydrogen 3.145 N/A GLN 319.A NE2 THR 321.A OG1 no hydrogen 3.066 N/A LEU 320.A N ASP 298.A OD2 no hydrogen 3.144 N/A THR 321.A N GLU 64.A OE1 no hydrogen 2.587 N/A THR 321.A N GLU 64.A OE2 no hydrogen 3.414 N/A THR 321.A OG1 GLU 64.A OE1 no hydrogen 3.510 N/A THR 321.A OG1 GLU 64.A OE2 no hydrogen 2.803 N/A HIS 322.A NE2 GLU 60.A OE1 no hydrogen 2.683 N/A SER 323.A OG LEU 320.A O no hydrogen 2.958 N/A SER 323.A OG GLY 328.A O no hydrogen 3.183 N/A ARG 324.A NE CYS 279.A O no hydrogen 2.733 N/A ARG 324.A NH1 ASP 269.A OD1 no hydrogen 2.848 N/A ARG 324.A NH2 CYS 279.A O no hydrogen 2.697 N/A THR 325.A N HIS 322.A O no hydrogen 2.969 N/A THR 325.A OG1 THR 273.A O no hydrogen 3.551 N/A LEU 326.A N HIS 322.A O no hydrogen 2.984 N/A GLY 327.A N SER 323.A O no hydrogen 2.800 N/A GLY 328.A N SER 323.A O no hydrogen 3.288 N/A GLY 329.A N ASN 286.A OD1 no hydrogen 3.115 N/A HIS 331.A N ASN 286.A O no hydrogen 2.923 N/A HIS 331.A ND1 ASP 229.A OD1 no hydrogen 2.394 N/A HIS 331.A NE2 GLU 9.A OE2 no hydrogen 3.132 N/A CYS 332.A N ASN 286.A OD1 no hydrogen 2.599 N/A CYS 332.A SG ASP 108.A OD1 no hydrogen 3.749 N/A CYS 332.A SG ASP 229.A OD2 no hydrogen 2.804 N/A ALA 333.A N GLY 329.A O no hydrogen 2.990 N/A THR 334.A N HIS 331.A O no hydrogen 3.289 N/A THR 334.A OG1 PHE 330.A O no hydrogen 2.871 N/A THR 334.A OG1 HIS 331.A O no hydrogen 3.339 N/A LEU 335.A N ILE 17.A O no hydrogen 2.918 N/A VAL 337.A N GLU 15.A O no hydrogen 3.033 N/A ARG 338.A N GLU 15.A O no hydrogen 3.320 N/A ARG 338.A NE LEU 3.A O no hydrogen 2.817 N/A ARG 338.A NH1 GLU 14.A OE1 no hydrogen 3.024 N/A ARG 338.A NH2 LEU 3.A O no hydrogen 3.427 N/A ARG 339.A N SER 5.A O no hydrogen 3.056 N/A ARG 339.A NE ASP 11.A O no hydrogen 2.992 N/A THR 340.A N PRO 12.A O no hydrogen 2.967 N/A THR 345.A OG1 THR 188.A OG1 no hydrogen 2.870 N/A