Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pte_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N TYR 21.A O no hydrogen 2.848 N/A THR 4.A OG1 SER 20.A OG no hydrogen 2.884 N/A VAL 5.A N VAL 19.A O no hydrogen 2.847 N/A ALA 7.A N GLN 17.A O no hydrogen 2.852 N/A THR 8.A N PHE 78.A O no hydrogen 2.850 N/A GLY 10.A N ARG 76.A O no hydrogen 2.885 N/A ARG 15.A N PRO 13.A O no hydrogen 2.822 N/A GLN 17.A N ALA 7.A O no hydrogen 2.822 N/A VAL 19.A N VAL 5.A O no hydrogen 2.785 N/A SER 20.A OG THR 4.A OG1 no hydrogen 2.884 N/A TYR 21.A N THR 3.A O no hydrogen 2.837 N/A THR 22.A N LYS 39.A O no hydrogen 2.911 N/A THR 22.A OG1 LYS 1.A O no hydrogen 2.914 N/A ASP 23.A N THR 22.A OG1 no hydrogen 2.713 N/A LYS 25.A N GLN 37.A O no hydrogen 2.930 N/A ILE 27.A N VAL 35.A O no hydrogen 2.839 N/A GLY 28.A N VAL 35.A O no hydrogen 3.208 N/A GLY 30.A N GLY 33.A O no hydrogen 2.950 N/A GLY 33.A N GLY 30.A O no hydrogen 3.185 N/A VAL 34.A N LYS 51.A O no hydrogen 3.333 N/A VAL 35.A N GLY 28.A O no hydrogen 2.737 N/A TYR 36.A N ILE 49.A O no hydrogen 2.793 N/A GLN 37.A N LYS 25.A O no hydrogen 2.564 N/A ALA 38.A N VAL 47.A O no hydrogen 2.887 N/A LYS 39.A N THR 22.A O no hydrogen 2.863 N/A LEU 40.A N GLU 45.A O no hydrogen 2.857 N/A CYS 41.A N SER 20.A O no hydrogen 2.973 N/A GLY 44.A N LEU 40.A O no hydrogen 2.770 N/A GLU 45.A N SER 43.A OG no hydrogen 3.210 N/A VAL 47.A N ALA 38.A O no hydrogen 2.819 N/A ALA 48.A N LEU 91.A O no hydrogen 2.752 N/A ILE 49.A N TYR 36.A O no hydrogen 2.697 N/A LYS 50.A N LEU 89.A O no hydrogen 2.855 N/A LYS 50.A NZ GLU 60.A OE1 no hydrogen 3.323 N/A LYS 50.A NZ GLU 60.A OE2 no hydrogen 2.635 N/A LYS 50.A NZ ASP 159.A OD1 no hydrogen 3.307 N/A LYS 51.A N VAL 34.A O no hydrogen 2.876 N/A VAL 52.A N LEU 87.A O no hydrogen 2.940 N/A GLN 54.A N VAL 85.A O no hydrogen 2.941 N/A LEU 61.A N ASN 58.A OD1 no hydrogen 2.814 N/A GLN 62.A N ASN 58.A O no hydrogen 3.095 N/A ILE 63.A N ARG 59.A O no hydrogen 2.966 N/A MET 64.A N GLU 60.A O no hydrogen 2.929 N/A ARG 65.A N LEU 61.A O no hydrogen 2.964 N/A ARG 65.A NE GLY 10.A O no hydrogen 3.588 N/A ARG 65.A NH1 ASP 14.A OD1 no hydrogen 2.981 N/A ARG 65.A NH2 ASP 14.A OD1 no hydrogen 2.944 N/A LYS 66.A N ILE 63.A O no hydrogen 3.031 N/A LEU 67.A N MET 64.A O no hydrogen 3.229 N/A ASP 68.A N TYR 130.A OH no hydrogen 2.924 N/A HIS 69.A NE2 GLU 325.A OE1 no hydrogen 2.788 N/A CYS 70.A SG.A ASN 71.A OD1 no hydrogen 3.883 N/A ASN 71.A N HIS 69.A ND1 no hydrogen 3.001 N/A ASN 71.A ND2 GLN 123.A OE1 no hydrogen 3.056 N/A ASN 71.A ND2 LEU 155.A O no hydrogen 2.913 N/A ILE 72.A N HIS 69.A O no hydrogen 3.038 N/A VAL 73.A N LEU 157.A O no hydrogen 2.980 N/A ARG 76.A N VAL 90.A O no hydrogen 2.777 N/A ARG 76.A NE ASP 92.A OD1 no hydrogen 2.491 N/A TYR 77.A N VAL 90.A O no hydrogen 3.367 N/A PHE 78.A N THR 8.A O no hydrogen 2.867 N/A PHE 79.A N ASN 88.A O no hydrogen 2.995 N/A SER 81.A N TYR 86.A O no hydrogen 3.038 N/A SER 81.A OG ASN 88.A OD1 no hydrogen 2.957 N/A TYR 86.A N SER 81.A O no hydrogen 2.780 N/A LEU 87.A N VAL 52.A O no hydrogen 2.802 N/A ASN 88.A N PHE 79.A O no hydrogen 2.728 N/A LEU 89.A N LYS 50.A O no hydrogen 2.779 N/A VAL 90.A N TYR 77.A O no hydrogen 2.801 N/A LEU 91.A N ALA 48.A O no hydrogen 2.704 N/A ASP 92.A N ARG 74.A O no hydrogen 3.247 N/A TYR 93.A N LEU 46.A O no hydrogen 3.212 N/A GLU 96.A N LEU 148.A O no hydrogen 2.972 N/A THR 97.A N GLU 96.A OE1 no hydrogen 3.403 N/A VAL 98.A N LEU 146.A O no hydrogen 2.873 N/A TYR 99.A N PRO 143.A O no hydrogen 3.222 N/A ARG 100.A N THR 97.A OG1 no hydrogen 3.026 N/A ARG 100.A NE GLU 96.A OE1 no hydrogen 2.726 N/A ARG 100.A NH2 GLU 96.A OE1 no hydrogen 3.562 N/A ARG 100.A NH2 GLU 96.A OE2 no hydrogen 3.008 N/A VAL 101.A N THR 97.A O no hydrogen 3.018 N/A ALA 102.A N VAL 98.A O no hydrogen 2.852 N/A ARG 103.A N TYR 99.A O no hydrogen 3.166 N/A HIS 104.A N ARG 100.A O no hydrogen 3.062 N/A TYR 105.A N VAL 101.A O no hydrogen 3.151 N/A SER 106.A N ALA 102.A O no hydrogen 2.833 N/A SER 106.A OG GLY 212.A O no hydrogen 3.275 N/A ARG 107.A N ARG 103.A O no hydrogen 2.856 N/A ALA 108.A N HIS 104.A O no hydrogen 3.185 N/A ALA 108.A N TYR 105.A O no hydrogen 3.024 N/A LYS 109.A N SER 106.A O no hydrogen 3.030 N/A GLN 110.A N TYR 105.A O no hydrogen 2.925 N/A TYR 116.A N PRO 113.A O no hydrogen 2.909 N/A VAL 117.A N PRO 113.A O no hydrogen 3.282 N/A LYS 118.A N VAL 114.A O no hydrogen 2.760 N/A LYS 118.A NZ GLU 301.A OE1 no hydrogen 2.622 N/A LEU 119.A N ILE 115.A O no hydrogen 2.983 N/A TYR 120.A N TYR 116.A O no hydrogen 2.847 N/A MET 121.A N VAL 117.A O no hydrogen 3.111 N/A TYR 122.A N LYS 118.A O no hydrogen 2.915 N/A TYR 122.A OH LEU 318.A O no hydrogen 2.618 N/A GLN 123.A N LEU 119.A O no hydrogen 3.217 N/A GLN 123.A NE2 LEU 119.A O no hydrogen 2.880 N/A GLN 123.A NE2 ALA 153.A O no hydrogen 2.964 N/A LEU 124.A N TYR 120.A O no hydrogen 2.983 N/A PHE 125.A N MET 121.A O no hydrogen 2.882 N/A ARG 126.A N TYR 122.A O no hydrogen 2.927 N/A ARG 126.A NE GLU 325.A OE1 no hydrogen 2.923 N/A ARG 126.A NH1 ASN 320.A OD1 no hydrogen 2.688 N/A ARG 126.A NH2 ASN 320.A OD1 no hydrogen 2.968 N/A ARG 126.A NH2 GLU 325.A OE1 no hydrogen 3.234 N/A ARG 126.A NH2 GLU 325.A OE2 no hydrogen 3.143 N/A SER 127.A N GLN 123.A O no hydrogen 2.991 N/A SER 127.A OG LEU 124.A O no hydrogen 2.687 N/A LEU 128.A N LEU 124.A O no hydrogen 2.993 N/A ALA 129.A N PHE 125.A O no hydrogen 2.844 N/A TYR 130.A N ARG 126.A O no hydrogen 3.009 N/A ILE 131.A N SER 127.A O no hydrogen 2.984 N/A HIS 132.A N LEU 128.A O no hydrogen 2.823 N/A HIS 132.A NE2 ASP 198.A OD2 no hydrogen 2.899 N/A SER 133.A N ALA 129.A O no hydrogen 3.133 N/A SER 133.A N TYR 130.A O no hydrogen 3.103 N/A SER 133.A OG TYR 130.A O no hydrogen 2.701 N/A PHE 134.A N ILE 131.A O no hydrogen 2.991 N/A GLY 135.A N HIS 132.A O no hydrogen 2.784 N/A ILE 136.A N ILE 131.A O no hydrogen 3.112 N/A CYS 137.A N LYS 164.A O no hydrogen 2.792 N/A CYS 137.A SG ASP 198.A OD1 no hydrogen 3.516 N/A CYS 137.A SG ASP 198.A OD2 no hydrogen 3.450 N/A HIS 138.A N ASP 198.A OD2 no hydrogen 2.816 N/A HIS 138.A NE2 CYS 158.A O no hydrogen 2.847 N/A ARG 139.A N ASP 198.A OD1 no hydrogen 2.880 N/A ARG 139.A NE SER 162.A O no hydrogen 2.768 N/A ARG 139.A NH1 TYR 193.A OH no hydrogen 2.846 N/A ARG 139.A NH2 SER 162.A O no hydrogen 3.085 N/A ASP 140.A N HIS 138.A ND1 no hydrogen 3.049 N/A LYS 142.A NZ ASP 140.A OD2 no hydrogen 3.520 N/A LYS 142.A NZ SER 178.A OG no hydrogen 2.971 N/A GLN 144.A N GLN 144.A OE1 no hydrogen 2.749 N/A ASN 145.A N LYS 142.A O no hydrogen 2.885 N/A ASN 145.A ND2 ASP 140.A O no hydrogen 2.790 N/A LEU 146.A N PRO 143.A O no hydrogen 3.201 N/A LEU 147.A N LYS 156.A O no hydrogen 2.889 N/A LEU 148.A N GLU 96.A O no hydrogen 2.669 N/A ASP 149.A N VAL 154.A O no hydrogen 2.993 N/A THR 152.A N ASP 149.A OD1 no hydrogen 3.064 N/A ALA 153.A N ASP 149.A O no hydrogen 2.771 N/A VAL 154.A N THR 152.A OG1 no hydrogen 3.406 N/A LEU 155.A N GLN 123.A OE1 no hydrogen 2.996 N/A LYS 156.A N LEU 147.A O no hydrogen 2.887 N/A LYS 156.A NZ CYS 70.A O no hydrogen 2.763 N/A LEU 157.A N ASN 71.A O no hydrogen 2.705 N/A CYS 158.A N ASN 145.A O no hydrogen 2.984 N/A CYS 158.A SG.A ASN 145.A O no hydrogen 3.599 N/A GLY 161.A N ASP 159.A OD1 no hydrogen 3.018 N/A ALA 163.A N PHE 160.A O no hydrogen 3.214 N/A LYS 164.A N CYS 137.A O no hydrogen 2.962 N/A LYS 164.A NZ PRO 171.A O no hydrogen 3.405 N/A LYS 164.A NZ ASN 172.A OD1 no hydrogen 2.891 N/A LEU 166.A N GLY 135.A O no hydrogen 2.981 N/A GLU 170.A N VAL 167.A O no hydrogen 3.022 N/A ASN 172.A N THR 191.A O no hydrogen 2.898 N/A ASN 172.A ND2 THR 191.A O no hydrogen 3.422 N/A CYS 177.A SG.A TYR 181.A O no hydrogen 3.503 N/A CYS 177.A SG.A SER 201.A OG no hydrogen 3.427 N/A CYS 177.A SG.B TYR 181.A O no hydrogen 3.398 N/A CYS 177.A SG.B SER 201.A OG no hydrogen 3.499 N/A SER 178.A OG ASP 140.A OD1 no hydrogen 2.813 N/A ARG 179.A NE ASP 219.A OD1 no hydrogen 2.627 N/A TYR 181.A N SER 178.A O no hydrogen 2.958 N/A TYR 181.A OH GLU 208.A OE1 no hydrogen 2.598 N/A ARG 182.A NH1 SER 174.A O no hydrogen 3.028 N/A ARG 182.A NH1 ILE 176.A O no hydrogen 2.960 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.749 N/A ILE 187.A N ALA 183.A O no hydrogen 3.158 N/A PHE 188.A N PRO 184.A O no hydrogen 2.970 N/A GLY 189.A N LEU 186.A O no hydrogen 2.749 N/A ALA 190.A N GLU 185.A O no hydrogen 2.899 N/A TYR 193.A OH VAL 173.A O no hydrogen 2.629 N/A SER 196.A N THR 194.A OG1 no hydrogen 3.240 N/A SER 196.A OG THR 194.A OG1 no hydrogen 2.834 N/A SER 196.A OG PRO 284.A O no hydrogen 3.535 N/A ILE 197.A N THR 194.A O no hydrogen 3.202 N/A ASP 198.A N SER 195.A O no hydrogen 3.042 N/A TRP 200.A N SER 196.A O no hydrogen 3.117 N/A SER 201.A N ILE 197.A O no hydrogen 3.075 N/A SER 201.A OG TYR 181.A O no hydrogen 2.682 N/A SER 201.A OG ILE 197.A O no hydrogen 3.216 N/A ALA 202.A N ASP 198.A O no hydrogen 2.950 N/A GLY 203.A N VAL 199.A O no hydrogen 2.911 N/A CYS 204.A N TRP 200.A O no hydrogen 3.010 N/A CYS 204.A SG TYR 180.A O no hydrogen 3.652 N/A CYS 204.A SG TRP 200.A O no hydrogen 3.507 N/A VAL 205.A N SER 201.A O no hydrogen 3.065 N/A LEU 206.A N ALA 202.A O no hydrogen 2.942 N/A ALA 207.A N GLY 203.A O no hydrogen 2.954 N/A GLU 208.A N CYS 204.A O no hydrogen 3.004 N/A LEU 209.A N VAL 205.A O no hydrogen 2.916 N/A LEU 210.A N LEU 206.A O no hydrogen 3.096 N/A LEU 211.A N ALA 207.A O no hydrogen 2.806 N/A GLY 212.A N GLU 208.A O no hydrogen 2.816 N/A ASP 223.A N SER 220.A OG no hydrogen 3.148 N/A GLN 224.A N SER 220.A O no hydrogen 3.033 N/A GLN 224.A NE2 GLY 218.A O no hydrogen 2.904 N/A LEU 225.A N GLY 221.A O no hydrogen 2.852 N/A VAL 226.A N VAL 222.A O no hydrogen 3.016 N/A GLU 227.A N ASP 223.A O no hydrogen 3.054 N/A ILE 228.A N GLN 224.A O no hydrogen 2.950 N/A ILE 229.A N LEU 225.A O no hydrogen 2.836 N/A LYS 230.A N VAL 226.A O no hydrogen 2.892 N/A VAL 231.A N ILE 228.A O no hydrogen 2.997 N/A LEU 232.A N ILE 228.A O no hydrogen 2.830 N/A GLY 233.A N ILE 229.A O no hydrogen 2.774 N/A THR 234.A N ILE 255.A O no hydrogen 2.970 N/A THR 234.A OG1 PRO 253.A O no hydrogen 2.496 N/A THR 234.A OG1 ILE 255.A O no hydrogen 3.317 N/A THR 236.A N GLN 239.A OE1 no hydrogen 2.942 N/A THR 236.A OG1 GLN 239.A OE1 no hydrogen 3.533 N/A GLN 239.A N THR 236.A OG1 no hydrogen 2.954 N/A ILE 240.A N THR 236.A O no hydrogen 2.794 N/A ARG 241.A N ARG 237.A O no hydrogen 2.768 N/A GLU 242.A N GLU 238.A O no hydrogen 2.920 N/A MET 243.A N GLN 239.A O no hydrogen 3.125 N/A MET 243.A N ILE 240.A O no hydrogen 2.827 N/A ASN 244.A N ILE 240.A O no hydrogen 2.580 N/A ASN 244.A ND2 PHE 188.A O no hydrogen 2.578 N/A TYR 247.A N ASN 244.A O no hydrogen 3.432 N/A ILE 255.A N THR 234.A OG1 no hydrogen 2.832 N/A ILE 255.A N PRO 253.A O no hydrogen 3.120 N/A HIS 258.A N VAL 231.A O no hydrogen 3.031 N/A LYS 262.A N PRO 259.A O no hydrogen 2.846 N/A VAL 263.A N TRP 260.A O no hydrogen 3.123 N/A THR 268.A N ARG 265.A O no hydrogen 3.135 N/A THR 268.A OG1 ARG 265.A O no hydrogen 2.695 N/A ALA 272.A N PRO 269.A O no hydrogen 3.019 N/A ILE 273.A N PRO 269.A O no hydrogen 3.323 N/A ALA 274.A N PRO 270.A O no hydrogen 2.870 N/A LEU 275.A N GLU 271.A O no hydrogen 2.979 N/A CYS 276.A N ALA 272.A O no hydrogen 2.999 N/A CYS 276.A SG ALA 272.A O no hydrogen 3.685 N/A SER 277.A N ILE 273.A O no hydrogen 3.039 N/A SER 277.A OG ILE 273.A O no hydrogen 3.529 N/A SER 277.A OG ALA 274.A O no hydrogen 2.742 N/A ARG 278.A N LEU 275.A O no hydrogen 3.041 N/A ARG 278.A NH1 ALA 286.A O no hydrogen 2.900 N/A LEU 279.A N LEU 275.A O no hydrogen 3.182 N/A LEU 279.A N CYS 276.A O no hydrogen 3.097 N/A LEU 280.A N CYS 276.A O no hydrogen 2.966 N/A TYR 282.A OH GLY 233.A O no hydrogen 2.603 N/A ALA 286.A N THR 283.A O no hydrogen 2.927 N/A ARG 287.A N PRO 284.A O no hydrogen 3.344 N/A ARG 287.A NE GLU 281.A O no hydrogen 2.843 N/A ARG 287.A NH1 GLU 185.A OE2 no hydrogen 2.729 N/A ARG 287.A NH1 SER 196.A O no hydrogen 3.194 N/A ARG 287.A NH2 GLU 185.A OE1 no hydrogen 2.742 N/A ARG 287.A NH2 GLU 185.A OE2 no hydrogen 3.395 N/A ARG 287.A NH2 GLU 281.A O no hydrogen 3.186 N/A LEU 288.A N ARG 278.A O no hydrogen 3.142 N/A THR 289.A N GLU 292.A OE2 no hydrogen 3.005 N/A GLU 292.A N THR 289.A OG1 no hydrogen 3.091 N/A ALA 293.A N THR 289.A O no hydrogen 2.927 N/A CYS 294.A N PRO 290.A O no hydrogen 2.984 N/A CYS 294.A SG TYR 122.A O no hydrogen 3.843 N/A CYS 294.A SG PRO 290.A O no hydrogen 3.557 N/A ALA 295.A N LEU 291.A O no hydrogen 3.213 N/A ALA 295.A N GLU 292.A O no hydrogen 3.050 N/A HIS 296.A N ALA 293.A O no hydrogen 2.900 N/A PHE 298.A N HIS 296.A ND1 no hydrogen 2.948 N/A PHE 299.A N HIS 296.A O no hydrogen 3.058 N/A ASP 300.A N SER 297.A O no hydrogen 2.879 N/A LEU 302.A N PHE 299.A O no hydrogen 2.964 N/A ARG 303.A N ASP 300.A O no hydrogen 2.809 N/A ARG 303.A NH1 CYS 294.A O no hydrogen 2.945 N/A ARG 303.A NH2 HIS 296.A O no hydrogen 2.937 N/A ARG 303.A NH2 ASP 300.A OD1 no hydrogen 2.878 N/A ASP 304.A N GLU 301.A O no hydrogen 3.140 N/A ASN 306.A N ASP 304.A OD1 no hydrogen 2.730 N/A VAL 307.A N ASP 304.A O no hydrogen 3.111 N/A LEU 309.A N ARG 313.A O no hydrogen 2.860 N/A ASN 311.A ND2 ASP 151.A O no hydrogen 2.773 N/A GLY 312.A N LEU 309.A O no hydrogen 3.003 N/A ARG 313.A N ASN 311.A OD1 no hydrogen 2.919 N/A PHE 321.A N PHE 319.A O no hydrogen 2.868 N/A THR 322.A N GLU 325.A OE2 no hydrogen 3.457 N/A GLN 324.A NE2 SER 133.A OG no hydrogen 2.709 N/A GLU 325.A N THR 322.A OG1 no hydrogen 3.195 N/A LEU 326.A N THR 322.A O no hydrogen 3.201 N/A LEU 326.A N THR 323.A O no hydrogen 3.189 N/A SER 327.A N GLN 324.A O no hydrogen 3.175 N/A SER 327.A OG GLN 324.A O no hydrogen 2.610 N/A ASN 329.A N LEU 326.A O no hydrogen 2.914 N/A LEU 332.A N ASN 329.A O no hydrogen 3.003 N/A ALA 333.A N PRO 330.A O no hydrogen 2.920 N/A THR 334.A N PRO 331.A O no hydrogen 3.255 N/A THR 334.A OG1 PRO 331.A O no hydrogen 3.222 N/A ILE 335.A N LEU 332.A O no hydrogen 2.938 N/A LEU 336.A N LEU 332.A O no hydrogen 2.855 N/A ILE 337.A N ALA 333.A O no hydrogen 2.926 N/A HIS 340.A NE2 ARG 303.A O no hydrogen 3.185 N/A ALA 341.A N PRO 338.A O no hydrogen 2.993 N/A