Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pb1_I.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N PRO 1.A O no hydrogen 3.259 N/A HIS 6.A N SER 2.A O no hydrogen 2.784 N/A LEU 7.A N TYR 3.A O no hydrogen 2.951 N/A ALA 8.A N VAL 4.A O no hydrogen 2.832 N/A SER 9.A N ALA 5.A O no hydrogen 3.002 N/A SER 9.A OG ALA 5.A O no hydrogen 2.926 N/A ASP 10.A N HIS 6.A O no hydrogen 2.748 N/A PHE 11.A N LEU 7.A O no hydrogen 3.034 N/A GLY 12.A N ALA 8.A O no hydrogen 2.863 N/A VAL 13.A N SER 9.A O no hydrogen 2.849 N/A ARG 14.A N ASP 10.A O no hydrogen 3.200 N/A ARG 14.A NH2 ALA 57.A O no hydrogen 2.700 N/A VAL 15.A N PHE 11.A O no hydrogen 3.184 N/A PHE 16.A N GLY 12.A O no hydrogen 3.018 N/A GLN 17.A N VAL 13.A O no hydrogen 3.022 N/A GLN 17.A NE2 THR 247.A O no hydrogen 2.989 N/A GLN 18.A N ARG 14.A O no hydrogen 3.417 N/A VAL 19.A N VAL 15.A O no hydrogen 3.067 N/A ALA 20.A N PHE 16.A O no hydrogen 2.754 N/A GLN 21.A N GLN 17.A O no hydrogen 2.841 N/A GLN 21.A NE2 ASN 248.A OD1 no hydrogen 3.038 N/A ALA 22.A N GLN 18.A O no hydrogen 3.296 N/A SER 23.A N ALA 20.A O no hydrogen 3.223 N/A SER 23.A OG VAL 19.A O no hydrogen 2.754 N/A LYS 24.A NZ SER 244.A OG no hydrogen 3.131 N/A ARG 26.A N SER 23.A O no hydrogen 3.168 N/A ASN 27.A ND2 GLU 374.A O no hydrogen 2.903 N/A VAL 28.A N GLN 371.A O no hydrogen 3.114 N/A VAL 29.A N THR 278.A OG1 no hydrogen 2.877 N/A PHE 30.A N MET 369.A O no hydrogen 2.885 N/A SER 31.A N GLN 318.A OE1 no hydrogen 2.834 N/A SER 31.A OG LEU 367.A O no hydrogen 2.692 N/A GLY 34.A N SER 31.A OG no hydrogen 2.968 N/A VAL 35.A N SER 31.A O no hydrogen 3.200 N/A ALA 36.A N PRO 32.A O no hydrogen 3.222 N/A SER 37.A N TYR 33.A O no hydrogen 2.817 N/A SER 37.A OG ASP 91.A OD2 no hydrogen 2.684 N/A VAL 38.A N GLY 34.A O no hydrogen 3.001 N/A LEU 39.A N VAL 35.A O no hydrogen 3.163 N/A ALA 40.A N ALA 36.A O no hydrogen 2.946 N/A MET 41.A N SER 37.A O no hydrogen 3.322 N/A LEU 42.A N VAL 38.A O no hydrogen 3.014 N/A GLN 43.A N LEU 39.A O no hydrogen 3.017 N/A GLN 43.A NE2 PHE 60.A O no hydrogen 2.974 N/A LEU 44.A N MET 41.A O no hydrogen 3.093 N/A THR 45.A N LEU 42.A O no hydrogen 2.849 N/A THR 45.A OG1 LEU 42.A O no hydrogen 2.566 N/A THR 46.A N GLN 43.A O no hydrogen 3.161 N/A THR 46.A OG1 GLN 43.A O no hydrogen 2.744 N/A GLY 47.A N ASP 301.A O no hydrogen 2.929 N/A GLN 51.A N GLY 47.A O no hydrogen 3.103 N/A GLN 52.A N GLY 48.A O no hydrogen 2.957 N/A GLN 53.A N GLU 49.A O no hydrogen 2.999 N/A GLN 53.A NE2 ASP 293.A OD1 no hydrogen 3.177 N/A ILE 54.A N THR 50.A O no hydrogen 3.309 N/A GLN 55.A N GLN 51.A O no hydrogen 2.927 N/A GLN 55.A NE2 GLN 43.A OE1 no hydrogen 3.455 N/A ALA 56.A N GLN 52.A O no hydrogen 2.830 N/A ALA 57.A N GLN 53.A O no hydrogen 3.042 N/A MET 58.A N ILE 54.A O no hydrogen 2.871 N/A GLY 59.A N GLN 55.A O no hydrogen 2.861 N/A ILE 62.A N GLN 43.A OE1 no hydrogen 2.861 N/A ASP 64.A N LYS 61.A O no hydrogen 2.881 N/A MET 67.A N ASP 64.A O no hydrogen 3.086 N/A ALA 70.A N GLY 66.A O no hydrogen 3.043 N/A LEU 71.A N MET 67.A O no hydrogen 2.939 N/A ARG 72.A N ALA 68.A O no hydrogen 2.969 N/A ARG 72.A NE LEU 112.A O no hydrogen 3.143 N/A ARG 72.A NH2 LEU 112.A O no hydrogen 3.245 N/A HIS 73.A N PRO 69.A O no hydrogen 2.835 N/A LEU 74.A N ALA 70.A O no hydrogen 2.882 N/A TYR 75.A N LEU 71.A O no hydrogen 3.043 N/A LYS 76.A N ARG 72.A O no hydrogen 3.185 N/A GLU 77.A N HIS 73.A O no hydrogen 3.112 N/A LEU 78.A N LEU 74.A O no hydrogen 3.010 N/A MET 79.A N TYR 75.A O no hydrogen 2.956 N/A ASN 83.A N GLY 80.A O no hydrogen 3.228 N/A ASN 83.A ND2 ILE 87.A O no hydrogen 3.091 N/A LYS 84.A N GLU 86.A OE1 no hydrogen 2.939 N/A LYS 84.A NZ PRO 81.A O no hydrogen 3.275 N/A GLU 86.A N ASN 83.A OD1 no hydrogen 2.758 N/A ILE 87.A N ASN 83.A OD1 no hydrogen 2.870 N/A SER 88.A N TYR 166.A O no hydrogen 3.015 N/A THR 90.A N ALA 164.A O no hydrogen 2.970 N/A ALA 92.A N VAL 162.A O no hydrogen 3.089 N/A PHE 94.A N VAL 160.A O no hydrogen 2.765 N/A VAL 95.A N LYS 118.A O no hydrogen 2.847 N/A GLN 96.A N ARG 158.A O no hydrogen 2.961 N/A GLN 96.A NE2 ASP 121.A OD1 no hydrogen 3.154 N/A ARG 97.A N VAL 120.A O no hydrogen 2.809 N/A LEU 99.A N GLN 96.A O no hydrogen 3.224 N/A VAL 102.A N LEU 305.A O no hydrogen 2.947 N/A PHE 105.A N VAL 102.A O no hydrogen 3.166 N/A HIS 108.A N GLY 104.A O no hydrogen 3.195 N/A PHE 109.A N PHE 105.A O no hydrogen 2.765 N/A PHE 110.A N MET 106.A O no hydrogen 2.883 N/A ARG 111.A N PRO 107.A O no hydrogen 2.879 N/A LEU 112.A N HIS 108.A O no hydrogen 3.022 N/A PHE 113.A N PHE 109.A O no hydrogen 2.945 N/A ARG 114.A N PHE 110.A O no hydrogen 2.745 N/A ARG 114.A NH1 ARG 111.A O no hydrogen 2.885 N/A LYS 118.A N ILE 93.A O no hydrogen 2.887 N/A LYS 118.A NZ THR 116.A O no hydrogen 2.864 N/A VAL 120.A N VAL 95.A O no hydrogen 2.957 N/A PHE 122.A N GLN 96.A OE1 no hydrogen 2.827 N/A SER 123.A N ASP 121.A OD1 no hydrogen 3.265 N/A SER 123.A OG ASP 121.A OD1 no hydrogen 2.843 N/A SER 123.A OG ASP 121.A OD2 no hydrogen 3.283 N/A ALA 128.A N GLU 124.A O no hydrogen 2.844 N/A ARG 129.A N VAL 125.A O no hydrogen 3.052 N/A ARG 129.A NE THR 150.A O no hydrogen 2.872 N/A ARG 129.A NH2 GLY 151.A O no hydrogen 3.133 N/A PHE 130.A N GLU 126.A O no hydrogen 3.149 N/A ILE 131.A N ARG 127.A O no hydrogen 2.839 N/A ILE 132.A N ALA 128.A O no hydrogen 2.992 N/A ASN 133.A N ARG 129.A O no hydrogen 3.012 N/A ASN 133.A ND2 ARG 129.A O no hydrogen 2.969 N/A ASN 133.A ND2 THR 150.A OG1 no hydrogen 3.059 N/A ASP 134.A N PHE 130.A O no hydrogen 2.786 N/A TRP 135.A N ILE 131.A O no hydrogen 2.981 N/A TRP 135.A NE1 THR 90.A OG1 no hydrogen 2.801 N/A VAL 136.A N ILE 132.A O no hydrogen 3.254 N/A LYS 137.A N ASN 133.A O no hydrogen 2.888 N/A THR 138.A N ASP 134.A O no hydrogen 3.038 N/A HIS 139.A N TRP 135.A O no hydrogen 3.156 N/A HIS 139.A ND1 TRP 135.A O no hydrogen 2.941 N/A THR 140.A N VAL 136.A O no hydrogen 3.110 N/A THR 140.A OG1 VAL 136.A O no hydrogen 2.869 N/A THR 140.A OG1 LYS 137.A O no hydrogen 3.547 N/A THR 140.A OG1 ILE 144.A O no hydrogen 3.141 N/A LYS 141.A N THR 138.A O no hydrogen 2.945 N/A GLY 142.A N LYS 137.A O no hydrogen 2.735 N/A MET 143.A N THR 140.A O no hydrogen 2.984 N/A ILE 144.A N THR 140.A OG1 no hydrogen 2.941 N/A LEU 147.A N ASN 133.A OD1 no hydrogen 2.776 N/A LEU 148.A N GLU 279.A OE1 no hydrogen 2.748 N/A GLY 149.A N GLU 279.A OE2 no hydrogen 2.637 N/A THR 150.A OG1 LEU 147.A O no hydrogen 3.216 N/A GLY 151.A N LEU 148.A O no hydrogen 3.091 N/A ALA 152.A N GLY 149.A O no hydrogen 3.111 N/A VAL 153.A N THR 150.A O no hydrogen 3.017 N/A GLN 155.A NE2 SER 123.A O no hydrogen 2.760 N/A THR 157.A N GLN 154.A O no hydrogen 2.945 N/A THR 157.A OG1 GLN 154.A O no hydrogen 3.068 N/A ARG 158.A NH1 PRO 310.A O no hydrogen 3.371 N/A VAL 160.A N PHE 94.A O no hydrogen 2.805 N/A LEU 161.A N LEU 315.A O no hydrogen 3.019 N/A VAL 162.A N ALA 92.A O no hydrogen 2.865 N/A ASN 163.A N LEU 317.A O no hydrogen 2.964 N/A ASN 163.A ND2 THR 90.A O no hydrogen 2.822 N/A ALA 164.A N THR 90.A O no hydrogen 3.076 N/A LEU 165.A N LYS 319.A O no hydrogen 3.010 N/A TYR 166.A N SER 88.A O no hydrogen 2.948 N/A TYR 166.A OH GLU 323.A OE2 no hydrogen 3.210 N/A PHE 167.A N LYS 321.A O no hydrogen 2.886 N/A ASN 168.A N GLU 86.A O no hydrogen 2.877 N/A ASN 168.A ND2 GLU 323.A O no hydrogen 3.357 N/A GLN 170.A N GLU 86.A OE2 no hydrogen 2.763 N/A TRP 171.A N SER 327.A O no hydrogen 3.272 N/A TRP 171.A NE1 ASN 325.A O no hydrogen 2.674 N/A LYS 172.A N PRO 223.A O no hydrogen 2.980 N/A LYS 172.A NZ ASP 227.A OD2 no hydrogen 3.343 N/A PHE 175.A N GLU 326.A O no hydrogen 2.982 N/A SER 179.A N PRO 176.A O no hydrogen 3.136 N/A THR 180.A N ASP 177.A O no hydrogen 3.211 N/A THR 180.A OG1 GLU 326.A OE2 no hydrogen 2.675 N/A HIS 181.A N MET 197.A O no hydrogen 3.184 N/A HIS 181.A ND1 SER 179.A O no hydrogen 2.818 N/A ARG 183.A N VAL 195.A O no hydrogen 2.953 N/A ARG 183.A NH1 HIS 181.A NE2 no hydrogen 3.229 N/A PHE 185.A N VAL 193.A O no hydrogen 3.039 N/A HIS 186.A N ASP 351.A O no hydrogen 2.742 N/A LYS 187.A N SER 191.A O no hydrogen 2.954 N/A LYS 187.A NZ GLU 374.A OE1 no hydrogen 2.927 N/A SER 188.A OG ASP 25.A OD1 no hydrogen 2.581 N/A GLY 190.A N LYS 187.A O no hydrogen 3.175 N/A SER 191.A N ASP 189.A OD1 no hydrogen 2.818 N/A SER 191.A OG ASP 189.A OD1 no hydrogen 2.477 N/A SER 191.A OG ASP 189.A OD2 no hydrogen 3.265 N/A VAL 193.A N PHE 185.A O no hydrogen 3.239 N/A VAL 195.A N ARG 183.A O no hydrogen 3.015 N/A MET 197.A N HIS 181.A O no hydrogen 2.880 N/A MET 198.A N LEU 271.A O no hydrogen 2.671 N/A GLN 200.A N LEU 269.A O no hydrogen 3.121 N/A ASN 202.A N ARG 267.A O no hydrogen 3.016 N/A PHE 204.A N LEU 265.A O no hydrogen 2.861 N/A ASN 205.A ND2 GLU 221.A OE1 no hydrogen 2.806 N/A TYR 206.A N THR 263.A O no hydrogen 2.877 N/A TYR 206.A OH ASP 218.A OD1 no hydrogen 2.626 N/A THR 207.A N ILE 219.A O no hydrogen 3.031 N/A PHE 209.A N TYR 217.A O no hydrogen 3.093 N/A THR 211.A N HIS 215.A O no hydrogen 2.835 N/A THR 211.A OG1 ASP 213.A OD2 no hydrogen 3.419 N/A THR 211.A OG1 HIS 215.A O no hydrogen 3.535 N/A GLY 214.A N THR 211.A O no hydrogen 3.120 N/A HIS 215.A N THR 211.A OG1 no hydrogen 2.878 N/A TYR 217.A N PHE 209.A O no hydrogen 3.117 N/A ASP 218.A N ALA 235.A O no hydrogen 2.940 N/A ILE 219.A N THR 207.A O no hydrogen 2.926 N/A LEU 220.A N ILE 233.A O no hydrogen 2.891 N/A GLU 221.A N ASN 205.A O no hydrogen 2.969 N/A LEU 222.A N MET 231.A O no hydrogen 2.716 N/A TYR 224.A N LEU 229.A O no hydrogen 2.922 N/A HIS 225.A N GLN 170.A O no hydrogen 2.847 N/A HIS 225.A NE2 GLU 86.A OE1 no hydrogen 2.618 N/A ASP 227.A N TYR 224.A O no hydrogen 2.967 N/A SER 230.A N ARG 359.A O no hydrogen 3.026 N/A SER 230.A OG GLU 221.A OE2 no hydrogen 2.595 N/A MET 231.A N LEU 222.A O no hydrogen 2.817 N/A PHE 232.A N VAL 357.A O no hydrogen 2.737 N/A ILE 233.A N LEU 220.A O no hydrogen 2.920 N/A ALA 234.A N LEU 355.A O no hydrogen 2.993 N/A ALA 235.A N ASP 218.A O no hydrogen 3.239 N/A TYR 237.A N TYR 216.A O no hydrogen 2.984 N/A LYS 239.A NZ ASP 351.A OD1 no hydrogen 2.812 N/A VAL 241.A N GLU 238.A O no hydrogen 3.117 N/A ALA 245.A N PRO 242.A O no hydrogen 3.061 N/A LEU 246.A N LEU 243.A O no hydrogen 2.800 N/A THR 247.A N LEU 243.A O no hydrogen 3.161 N/A ASN 248.A N SER 244.A O no hydrogen 2.921 N/A ILE 249.A N LEU 246.A O no hydrogen 3.024 N/A LEU 250.A N THR 247.A O no hydrogen 3.461 N/A LEU 254.A N SER 251.A OG no hydrogen 3.107 N/A ILE 255.A N SER 251.A O no hydrogen 3.283 N/A SER 256.A N ALA 252.A O no hydrogen 3.269 N/A SER 256.A OG GLN 253.A O no hydrogen 3.379 N/A HIS 257.A N GLN 253.A O no hydrogen 2.946 N/A TRP 258.A N LEU 254.A O no hydrogen 2.936 N/A TRP 258.A NE1 TYR 217.A OH no hydrogen 3.060 N/A LYS 259.A N ILE 255.A O no hydrogen 3.135 N/A LYS 259.A NZ GLU 221.A OE1 no hydrogen 2.963 N/A LYS 259.A NZ GLU 221.A OE2 no hydrogen 3.321 N/A GLY 260.A N SER 256.A O no hydrogen 2.866 N/A ASN 261.A N HIS 257.A O no hydrogen 3.125 N/A ASN 261.A N TRP 258.A O no hydrogen 3.206 N/A MET 262.A N LYS 259.A O no hydrogen 3.143 N/A THR 263.A N TYR 206.A O no hydrogen 3.122 N/A ARG 264.A NH2 LYS 203.A O no hydrogen 3.241 N/A LEU 265.A N PHE 204.A O no hydrogen 2.856 N/A ARG 267.A N ASN 202.A O no hydrogen 2.839 N/A ARG 267.A NH1 PRO 266.A O no hydrogen 2.773 N/A LEU 268.A N GLU 346.A O no hydrogen 2.863 N/A LEU 269.A N GLN 200.A O no hydrogen 2.886 N/A VAL 270.A N ILE 348.A O no hydrogen 2.994 N/A LEU 271.A N MET 198.A O no hydrogen 2.775 N/A LYS 273.A N PRO 196.A O no hydrogen 3.198 N/A LYS 273.A NZ GLU 326.A OE1 no hydrogen 3.454 N/A PHE 274.A N VAL 324.A O no hydrogen 3.106 N/A SER 275.A OG GLU 323.A OE1 no hydrogen 3.353 N/A LEU 276.A N ILE 322.A O no hydrogen 3.095 N/A THR 278.A N VAL 320.A O no hydrogen 2.966 N/A THR 278.A OG1 VAL 29.A O no hydrogen 3.535 N/A VAL 280.A N GLN 318.A O no hydrogen 2.743 N/A LEU 282.A N ALA 316.A O no hydrogen 2.921 N/A ARG 283.A N ASP 281.A OD1 no hydrogen 3.214 N/A ARG 283.A NE GLU 287.A OE2 no hydrogen 2.883 N/A ARG 283.A NH2 GLU 287.A OE2 no hydrogen 3.312 N/A LEU 286.A N LEU 282.A O no hydrogen 3.099 N/A GLU 287.A N ARG 283.A O no hydrogen 2.848 N/A ASN 288.A N LYS 284.A O no hydrogen 2.830 N/A LEU 289.A N LEU 286.A O no hydrogen 3.139 N/A GLY 290.A N GLU 287.A O no hydrogen 2.962 N/A MET 291.A N LEU 286.A O no hydrogen 3.073 N/A THR 292.A OG1 ASP 293.A OD1 no hydrogen 3.486 N/A ASP 293.A N GLN 53.A OE1 no hydrogen 3.066 N/A PHE 295.A N THR 292.A O no hydrogen 3.365 N/A ARG 296.A N ASP 293.A O no hydrogen 2.908 N/A ARG 296.A NE GLN 299.A OE1 no hydrogen 2.644 N/A ARG 296.A NH2 GLN 299.A OE1 no hydrogen 2.844 N/A ALA 300.A N ARG 296.A O no hydrogen 2.856 N/A ASP 301.A N THR 50.A OG1 no hydrogen 2.823 N/A THR 303.A N ASP 301.A OD1 no hydrogen 2.959 N/A THR 303.A OG1 ASP 301.A OD1 no hydrogen 2.393 N/A SER 304.A OG THR 46.A O no hydrogen 2.846 N/A LEU 305.A N PHE 302.A O no hydrogen 3.006 N/A SER 306.A N PHE 302.A O no hydrogen 3.106 N/A SER 306.A OG LYS 100.A O no hydrogen 2.832 N/A VAL 313.A N MET 294.A O no hydrogen 2.977 N/A ALA 314.A N LEU 159.A O no hydrogen 3.012 N/A LEU 317.A N LEU 161.A O no hydrogen 3.057 N/A GLN 318.A N VAL 280.A O no hydrogen 3.027 N/A GLN 318.A NE2 SER 31.A O no hydrogen 3.046 N/A GLN 318.A NE2 ASN 163.A OD1 no hydrogen 2.772 N/A LYS 319.A N ASN 163.A O no hydrogen 2.867 N/A LYS 319.A NZ HIS 146.A O no hydrogen 2.894 N/A VAL 320.A N THR 278.A O no hydrogen 2.966 N/A LYS 321.A N LEU 165.A O no hydrogen 3.029 N/A ILE 322.A N LEU 276.A O no hydrogen 2.956 N/A GLU 323.A N PHE 167.A O no hydrogen 2.983 N/A VAL 324.A N PHE 274.A O no hydrogen 2.709 N/A GLU 326.A N GLU 326.A OE1 no hydrogen 2.854 N/A ILE 348.A N LEU 268.A O no hydrogen 2.800 N/A ILE 350.A N VAL 270.A O no hydrogen 2.879 N/A ARG 352.A NH1 PRO 353.A O no hydrogen 2.970 N/A ARG 352.A NH2 GLU 238.A O no hydrogen 3.338 N/A ARG 352.A NH2 VAL 241.A O no hydrogen 2.409 N/A PHE 354.A N VAL 372.A O no hydrogen 3.231 N/A LEU 355.A N ALA 234.A O no hydrogen 2.957 N/A PHE 356.A N GLY 370.A O no hydrogen 2.968 N/A VAL 357.A N PHE 232.A O no hydrogen 2.853 N/A VAL 358.A N PHE 368.A O no hydrogen 2.784 N/A ARG 359.A N SER 230.A O no hydrogen 2.934 N/A HIS 360.A N THR 365.A O no hydrogen 2.895 N/A HIS 360.A ND1 THR 363.A OG1 no hydrogen 2.876 N/A ASN 361.A N THR 228.A O no hydrogen 2.917 N/A ASN 361.A ND2 ASP 227.A O no hydrogen 2.843 N/A ASN 361.A ND2 SER 230.A OG no hydrogen 3.163 N/A THR 363.A OG1 HIS 360.A ND1 no hydrogen 2.876 N/A THR 363.A OG1 HIS 360.A O no hydrogen 3.561 N/A THR 363.A OG1 THR 365.A OG1 no hydrogen 2.726 N/A GLY 364.A N HIS 360.A O no hydrogen 2.794 N/A THR 365.A N THR 363.A OG1 no hydrogen 3.197 N/A THR 365.A OG1 THR 363.A OG1 no hydrogen 2.726 N/A VAL 366.A N SER 9.A OG no hydrogen 2.944 N/A LEU 367.A N VAL 358.A O no hydrogen 2.919 N/A PHE 368.A N VAL 358.A O no hydrogen 3.265 N/A MET 369.A N PHE 30.A O no hydrogen 2.926 N/A GLY 370.A N PHE 356.A O no hydrogen 3.117 N/A GLN 371.A N VAL 28.A O no hydrogen 2.991 N/A VAL 372.A N PHE 354.A O no hydrogen 2.798 N/A MET 373.A N ASN 27.A OD1 no hydrogen 2.657 N/A GLU 374.A N ASN 27.A OD1 no hydrogen 2.998 N/A