Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k6z_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ASP 2.A OD1 no hydrogen 2.825 N/A THR 4.A OG1 ASP 2.A OD1 no hydrogen 2.697 N/A HIS 5.A N ASP 2.A O no hydrogen 3.268 N/A PHE 6.A N ILE 74.A O no hydrogen 3.047 N/A GLU 7.A N TYR 30.A OH no hydrogen 3.003 N/A ARG 9.A NE GLU 7.A OE2 no hydrogen 3.371 N/A ARG 9.A NH2 GLU 7.A OE2 no hydrogen 3.299 N/A LEU 11.A N LYS 8.A O no hydrogen 3.136 N/A LYS 12.A N ARG 29.A O no hydrogen 3.326 N/A LYS 12.A NZ ARG 9.A O no hydrogen 2.813 N/A ARG 13.A NE ASP 16.A OD1 no hydrogen 3.407 N/A ARG 13.A NH2 ASP 16.A OD1 no hydrogen 3.272 N/A ILE 14.A N LEU 27.A O no hydrogen 2.784 N/A ARG 15.A N LEU 27.A O no hydrogen 3.436 N/A LEU 17.A N VAL 25.A O no hydrogen 2.816 N/A GLY 18.A N VAL 25.A O no hydrogen 2.899 N/A GLY 20.A N GLY 23.A O no hydrogen 2.981 N/A HIS 21.A NE2 ASP 130.A OD1 no hydrogen 2.744 N/A LYS 24.A N SER 45.A O no hydrogen 3.046 N/A LYS 24.A NZ ASP 16.A OD1 no hydrogen 3.010 N/A LYS 24.A NZ ASP 16.A OD2 no hydrogen 3.386 N/A LYS 24.A NZ GLU 26.A OE2 no hydrogen 2.958 N/A VAL 25.A N GLY 18.A O no hydrogen 2.820 N/A GLU 26.A N VAL 43.A O no hydrogen 2.841 N/A LEU 27.A N ARG 15.A O no hydrogen 2.713 N/A CYS 28.A N VAL 41.A O no hydrogen 2.912 N/A CYS 28.A SG GLU 26.A O no hydrogen 3.865 N/A ARG 29.A N LYS 12.A O no hydrogen 2.962 N/A ARG 29.A NH1 GLY 38.A O no hydrogen 2.778 N/A TYR 30.A N GLU 39.A O no hydrogen 2.940 N/A ASP 31.A N PHE 10.A O no hydrogen 2.968 N/A ASP 35.A N ASP 31.A OD2 no hydrogen 2.964 N/A THR 37.A N ASP 31.A OD2 no hydrogen 2.794 N/A THR 37.A OG1 GLU 33.A OE1 no hydrogen 3.245 N/A THR 37.A OG1 ASP 35.A OD2 no hydrogen 2.731 N/A VAL 41.A N CYS 28.A O no hydrogen 2.737 N/A ALA 42.A N MET 83.A O no hydrogen 3.068 N/A VAL 43.A N GLU 26.A O no hydrogen 2.919 N/A LYS 44.A N LEU 81.A O no hydrogen 2.847 N/A LYS 44.A NZ GLU 56.A OE1 no hydrogen 3.420 N/A LYS 44.A NZ GLU 56.A OE2 no hydrogen 2.913 N/A LYS 44.A NZ ASP 148.A OD1 no hydrogen 2.812 N/A SER 45.A N LYS 24.A O no hydrogen 3.058 N/A LYS 47.A N PHE 22.A O no hydrogen 3.520 N/A LYS 47.A NZ GLY 20.A O no hydrogen 3.186 N/A ASP 52.A N HIS 49.A O no hydrogen 3.172 N/A LEU 53.A N HIS 49.A O no hydrogen 3.464 N/A LYS 54.A N ILE 50.A O no hydrogen 2.817 N/A LYS 55.A N ALA 51.A O no hydrogen 2.869 N/A GLU 56.A N ASP 52.A O no hydrogen 2.830 N/A ILE 57.A N LEU 53.A O no hydrogen 2.911 N/A GLU 58.A N LYS 54.A O no hydrogen 3.193 N/A ILE 59.A N LYS 55.A O no hydrogen 3.186 N/A LEU 60.A N GLU 56.A O no hydrogen 2.847 N/A ARG 61.A N ILE 57.A O no hydrogen 3.031 N/A ARG 61.A NE GLU 58.A OE2 no hydrogen 3.199 N/A ARG 61.A NH2 GLU 58.A OE2 no hydrogen 3.259 N/A ASN 62.A N ILE 59.A O no hydrogen 3.301 N/A ASN 62.A ND2 GLU 58.A O no hydrogen 3.019 N/A LEU 63.A N LEU 60.A O no hydrogen 2.933 N/A TYR 64.A N TYR 120.A OH no hydrogen 2.931 N/A ASN 67.A ND2 HIS 65.A NE2 no hydrogen 2.865 N/A ILE 68.A N HIS 65.A O no hydrogen 3.169 N/A VAL 69.A N ILE 146.A O no hydrogen 2.843 N/A LYS 70.A N GLU 84.A OE2 no hydrogen 2.799 N/A LYS 70.A NZ GLU 84.A OE1 no hydrogen 3.377 N/A LYS 72.A N ILE 82.A O no hydrogen 2.772 N/A GLY 73.A N ILE 82.A O no hydrogen 3.052 N/A ILE 74.A N THR 4.A O no hydrogen 2.882 N/A CYS 75.A SG PHE 6.A O no hydrogen 3.497 N/A GLU 77.A N GLY 78.A O no hydrogen 2.895 N/A LYS 80.A N CYS 75.A O no hydrogen 2.875 N/A LEU 81.A N LYS 44.A O no hydrogen 2.809 N/A ILE 82.A N GLY 73.A O no hydrogen 2.907 N/A MET 83.A N ALA 42.A O no hydrogen 2.801 N/A GLU 84.A N LYS 70.A O no hydrogen 2.869 N/A GLY 89.A N LEU 86.A O no hydrogen 3.108 N/A SER 90.A N GLU 93.A OE1 no hydrogen 3.288 N/A SER 90.A OG GLU 93.A OE1 no hydrogen 3.207 N/A SER 90.A OG GLU 93.A OE2 no hydrogen 3.214 N/A LEU 91.A N VAL 136.A O no hydrogen 2.789 N/A GLU 93.A N SER 90.A O no hydrogen 3.296 N/A TYR 94.A N SER 90.A O no hydrogen 3.008 N/A LEU 95.A N LEU 91.A O no hydrogen 2.890 N/A ASN 98.A N TYR 94.A O no hydrogen 2.891 N/A ASN 98.A ND2 TYR 94.A O no hydrogen 2.872 N/A LYS 101.A NZ ASN 98.A OD1 no hydrogen 3.187 N/A ILE 102.A N ASN 98.A O no hydrogen 3.054 N/A LYS 105.A NZ LEU 278.A O no hydrogen 2.794 N/A GLN 106.A NE2 HIS 142.A ND1 no hydrogen 3.364 N/A GLN 107.A N ASN 103.A O no hydrogen 2.869 N/A LEU 108.A N LEU 104.A O no hydrogen 2.925 N/A LYS 109.A N LYS 105.A O no hydrogen 2.829 N/A TYR 110.A N GLN 106.A O no hydrogen 3.006 N/A TYR 110.A OH GLU 141.A O no hydrogen 2.723 N/A ALA 111.A N GLN 107.A O no hydrogen 3.211 N/A VAL 112.A N LEU 108.A O no hydrogen 3.149 N/A GLN 113.A N LYS 109.A O no hydrogen 3.152 N/A GLN 113.A NE2 HIS 142.A O no hydrogen 2.735 N/A ILE 114.A N TYR 110.A O no hydrogen 2.892 N/A CYS 115.A N ALA 111.A O no hydrogen 2.850 N/A CYS 115.A SG ALA 111.A O no hydrogen 3.364 N/A LYS 116.A N VAL 112.A O no hydrogen 2.741 N/A GLY 117.A N GLN 113.A O no hydrogen 2.962 N/A MET 118.A N ILE 114.A O no hydrogen 2.897 N/A ASP 119.A N CYS 115.A O no hydrogen 2.903 N/A TYR 120.A N LYS 116.A O no hydrogen 3.036 N/A LEU 121.A N GLY 117.A O no hydrogen 3.176 N/A GLY 122.A N MET 118.A O no hydrogen 2.958 N/A SER 123.A N ASP 119.A O no hydrogen 2.706 N/A SER 123.A OG ASP 119.A O no hydrogen 2.958 N/A SER 123.A OG TYR 120.A O no hydrogen 2.875 N/A ARG 124.A N TYR 120.A O no hydrogen 3.209 N/A ARG 124.A NE TYR 120.A OH no hydrogen 3.201 N/A GLN 125.A N GLY 122.A O no hydrogen 2.820 N/A VAL 127.A N LYS 153.A O no hydrogen 2.820 N/A HIS 128.A N ASP 188.A OD2 no hydrogen 2.803 N/A HIS 128.A NE2 ASP 148.A O no hydrogen 2.895 N/A ARG 129.A N ASP 188.A OD1 no hydrogen 2.988 N/A ARG 129.A NH1 LEU 151.A O no hydrogen 2.779 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 3.140 N/A ALA 133.A N GLU 198.A OE1 no hydrogen 2.942 N/A ARG 134.A NH1 ASP 130.A OD2 no hydrogen 3.530 N/A ARG 134.A NH2 ASP 130.A OD1 no hydrogen 2.715 N/A ASN 135.A N ALA 132.A O no hydrogen 2.885 N/A LEU 137.A N LYS 145.A O no hydrogen 2.751 N/A VAL 138.A N GLY 89.A O no hydrogen 2.782 N/A GLU 139.A N GLN 143.A O no hydrogen 2.763 N/A SER 140.A N GLN 143.A O no hydrogen 3.122 N/A HIS 142.A N SER 140.A OG no hydrogen 3.403 N/A GLN 143.A N SER 140.A O no hydrogen 3.038 N/A GLN 143.A NE2 GLU 66.A O no hydrogen 2.748 N/A VAL 144.A N GLN 113.A OE1 no hydrogen 2.814 N/A LYS 145.A N LEU 137.A O no hydrogen 2.791 N/A LYS 145.A NZ GLU 84.A OE2 no hydrogen 2.702 N/A LYS 145.A NZ GLU 139.A OE1 no hydrogen 3.562 N/A ILE 146.A N ASN 67.A O no hydrogen 2.765 N/A GLY 147.A N ASN 135.A O no hydrogen 2.912 N/A GLY 150.A N ASP 148.A OD2 no hydrogen 2.943 N/A THR 152.A N PHE 149.A O no hydrogen 3.123 N/A THR 152.A OG1 PHE 149.A O no hydrogen 3.409 N/A LYS 153.A N VAL 127.A O no hydrogen 2.890 N/A LYS 159.A N GLU 156.A O no hydrogen 3.222 N/A VAL 162.A N SER 181.A O no hydrogen 3.067 N/A ARG 166.A N ASP 164.A OD1 no hydrogen 3.411 N/A TRP 172.A N PRO 169.A O no hydrogen 3.144 N/A TRP 172.A NE1 GLU 198.A OE1 no hydrogen 2.752 N/A TYR 173.A N VAL 170.A O no hydrogen 2.948 N/A TYR 173.A OH ARG 129.A O no hydrogen 2.733 N/A GLU 176.A N GLU 176.A OE1 no hydrogen 2.863 N/A CYS 177.A N ALA 174.A O no hydrogen 3.371 N/A CYS 177.A SG LYS 182.A O no hydrogen 3.907 N/A LEU 178.A N ALA 174.A O no hydrogen 3.303 N/A MET 179.A N PRO 175.A O no hydrogen 2.732 N/A GLN 180.A N GLU 176.A O no hydrogen 3.053 N/A SER 181.A OG CYS 177.A O no hydrogen 3.530 N/A TYR 184.A N SER 187.A OG no hydrogen 2.911 N/A SER 187.A N TYR 184.A O no hydrogen 2.850 N/A SER 187.A OG GLU 176.A OE2 no hydrogen 3.538 N/A SER 187.A OG TYR 184.A O no hydrogen 2.740 N/A VAL 189.A N ALA 186.A O no hydrogen 3.164 N/A TRP 190.A N ALA 186.A O no hydrogen 3.407 N/A SER 191.A N SER 187.A O no hydrogen 3.170 N/A SER 191.A OG TRP 172.A O no hydrogen 2.982 N/A SER 191.A OG SER 187.A O no hydrogen 3.443 N/A PHE 192.A N ASP 188.A O no hydrogen 2.992 N/A GLY 193.A N VAL 189.A O no hydrogen 3.098 N/A VAL 194.A N TRP 190.A O no hydrogen 3.357 N/A VAL 194.A N SER 191.A O no hydrogen 3.050 N/A THR 195.A N SER 191.A O no hydrogen 2.932 N/A THR 195.A OG1 SER 191.A O no hydrogen 3.102 N/A LEU 196.A N PHE 192.A O no hydrogen 2.722 N/A HIS 197.A N GLY 193.A O no hydrogen 3.123 N/A HIS 197.A NE2 PRO 240.A O no hydrogen 2.746 N/A GLU 198.A N VAL 194.A O no hydrogen 3.038 N/A LEU 199.A N THR 195.A O no hydrogen 2.895 N/A LEU 200.A N LEU 196.A O no hydrogen 3.019 N/A THR 201.A N HIS 197.A O no hydrogen 3.037 N/A THR 201.A N GLU 198.A O no hydrogen 3.292 N/A THR 201.A OG1 HIS 197.A O no hydrogen 3.337 N/A THR 201.A OG1 GLU 198.A O no hydrogen 3.345 N/A TYR 202.A N LEU 199.A O no hydrogen 2.943 N/A TYR 202.A OH ILE 102.A O no hydrogen 2.947 N/A CYS 203.A N GLU 198.A O no hydrogen 2.745 N/A CYS 203.A SG GLU 198.A O no hydrogen 4.012 N/A SER 207.A N ASP 204.A O no hydrogen 2.939 N/A SER 207.A OG ASP 204.A O no hydrogen 3.532 N/A SER 207.A OG ASP 204.A OD2 no hydrogen 3.527 N/A SER 208.A N SER 205.A O no hydrogen 3.133 N/A SER 208.A OG SER 205.A O no hydrogen 2.770 N/A LEU 212.A N SER 208.A O no hydrogen 3.162 N/A LEU 214.A N MET 210.A O no hydrogen 2.974 N/A LYS 215.A N ALA 211.A O no hydrogen 3.114 N/A MET 216.A N PHE 213.A O no hydrogen 3.066 N/A ILE 217.A N LEU 214.A O no hydrogen 2.964 N/A GLY 218.A N LEU 214.A O no hydrogen 2.674 N/A MET 224.A N HIS 221.A O no hydrogen 2.758 N/A THR 225.A OG1 GLY 222.A O no hydrogen 2.708 N/A ARG 228.A N MET 224.A O no hydrogen 2.892 N/A LEU 229.A N THR 225.A O no hydrogen 3.134 N/A VAL 230.A N VAL 226.A O no hydrogen 3.073 N/A THR 232.A N ARG 228.A O no hydrogen 3.048 N/A THR 232.A OG1 ARG 228.A O no hydrogen 3.018 N/A LEU 233.A N LEU 229.A O no hydrogen 3.223 N/A LYS 234.A N VAL 230.A O no hydrogen 3.068 N/A GLU 235.A N ASN 231.A O no hydrogen 2.831 N/A LYS 237.A N THR 232.A O no hydrogen 3.165 N/A ARG 238.A NE TRP 257.A O no hydrogen 3.155 N/A ARG 238.A NH1 LEU 233.A O no hydrogen 3.158 N/A ARG 238.A NH1 LYS 237.A O no hydrogen 2.958 N/A ARG 238.A NH2 TRP 257.A O no hydrogen 2.807 N/A CYS 241.A SG PRO 242.A O no hydrogen 3.520 N/A CYS 241.A SG CYS 245.A O no hydrogen 3.670 N/A CYS 245.A N PRO 242.A O no hydrogen 3.291 N/A CYS 245.A SG PRO 246.A O no hydrogen 3.344 N/A GLU 248.A N GLU 248.A OE1 no hydrogen 2.755 N/A TYR 250.A N PRO 246.A O no hydrogen 3.089 N/A TYR 250.A OH LEU 239.A O no hydrogen 2.682 N/A GLN 251.A N ASP 247.A O no hydrogen 2.773 N/A GLN 251.A NE2 ASP 247.A OD1 no hydrogen 3.288 N/A LEU 252.A N VAL 249.A O no hydrogen 2.909 N/A MET 253.A N VAL 249.A O no hydrogen 3.076 N/A ARG 254.A N TYR 250.A O no hydrogen 2.755 N/A LYS 255.A N GLN 251.A O no hydrogen 3.101 N/A CYS 256.A N MET 253.A O no hydrogen 3.163 N/A CYS 256.A SG VAL 189.A O no hydrogen 3.562 N/A CYS 256.A SG LEU 252.A O no hydrogen 3.777 N/A TRP 257.A N ARG 254.A O no hydrogen 2.940 N/A TRP 257.A NE1 TRP 190.A O no hydrogen 3.067 N/A SER 262.A OG ASN 263.A OD1 no hydrogen 3.005 N/A ARG 264.A N GLN 260.A O no hydrogen 2.902 N/A ARG 264.A NH1 GLU 176.A OE2 no hydrogen 2.752 N/A ARG 264.A NH1 ALA 186.A O no hydrogen 3.542 N/A ARG 264.A NH2 GLU 176.A OE1 no hydrogen 3.467 N/A THR 265.A OG1 SER 266.A O no hydrogen 3.155 N/A ILE 271.A N PHE 267.A O no hydrogen 2.980 N/A GLU 272.A N GLN 268.A O no hydrogen 3.347 N/A GLY 273.A N ASN 269.A O no hydrogen 2.973 N/A PHE 274.A N LEU 270.A O no hydrogen 2.807 N/A GLU 275.A N ILE 271.A O no hydrogen 2.776 N/A ALA 276.A N GLU 272.A O no hydrogen 3.113 N/A LEU 277.A N PHE 274.A O no hydrogen 3.004 N/A LEU 278.A N PHE 274.A O no hydrogen 3.276 N/A LEU 278.A N GLU 275.A O no hydrogen 3.109 N/A LYS 279.A N GLU 275.A O no hydrogen 3.088 N/A