Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4f6x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N ASP 5.A OD2 no hydrogen 2.902 N/A ASP 5.A N THR 2.A OG1 no hydrogen 3.188 N/A MET 6.A N THR 2.A O no hydrogen 3.123 N/A ASN 7.A N MET 3.A O no hydrogen 3.143 N/A PHE 8.A N MET 4.A O no hydrogen 2.983 N/A LYS 9.A N ASP 5.A O no hydrogen 2.889 N/A TYR 10.A N MET 6.A O no hydrogen 2.990 N/A TYR 10.A OH ASP 80.A OD2 no hydrogen 3.373 N/A CYS 11.A N ASN 7.A O no hydrogen 3.082 N/A CYS 11.A SG ASN 7.A O no hydrogen 3.329 N/A HIS 12.A N PHE 8.A O no hydrogen 2.873 N/A HIS 12.A NE2 ASP 27.A OD2 no hydrogen 2.893 N/A LYS 13.A N LYS 9.A O no hydrogen 2.981 N/A ILE 14.A N TYR 10.A O no hydrogen 3.097 N/A MET 15.A N CYS 11.A O no hydrogen 3.165 N/A LYS 16.A N HIS 12.A O no hydrogen 2.927 N/A LYS 17.A N LYS 13.A O no hydrogen 3.054 N/A HIS 18.A N ILE 14.A O no hydrogen 3.090 N/A SER 19.A N MET 15.A O no hydrogen 2.795 N/A PHE 22.A N SER 19.A OG no hydrogen 3.122 N/A SER 23.A N SER 19.A O no hydrogen 3.043 N/A SER 23.A OG SER 19.A O no hydrogen 2.559 N/A SER 23.A OG LYS 20.A O no hydrogen 3.135 N/A TYR 24.A N LYS 20.A O no hydrogen 2.727 N/A ALA 25.A N SER 21.A O no hydrogen 3.080 N/A PHE 26.A N PHE 22.A O no hydrogen 2.844 N/A ASP 27.A N SER 23.A O no hydrogen 3.007 N/A LEU 28.A N ALA 25.A O no hydrogen 3.161 N/A LEU 29.A N PHE 26.A O no hydrogen 3.060 N/A GLN 33.A N ASP 32.A OD1 no hydrogen 2.971 N/A GLN 33.A NE2 ASP 32.A OD1 no hydrogen 3.198 N/A ARG 34.A N PRO 30.A O no hydrogen 2.845 N/A ARG 34.A NE GLU 31.A OE1 no hydrogen 3.389 N/A ARG 34.A NH1 ASP 27.A O no hydrogen 2.849 N/A ARG 34.A NH2 GLU 31.A OE1 no hydrogen 3.515 N/A LYS 35.A N GLU 31.A O no hydrogen 2.845 N/A ALA 36.A N ASP 32.A O no hydrogen 3.160 N/A VAL 37.A N GLN 33.A O no hydrogen 2.997 N/A TRP 38.A N ARG 34.A O no hydrogen 3.031 N/A TRP 38.A NE1 ASP 27.A OD1 no hydrogen 2.848 N/A ALA 39.A N LYS 35.A O no hydrogen 3.079 N/A ILE 40.A N ALA 36.A O no hydrogen 3.041 N/A TYR 41.A N VAL 37.A O no hydrogen 2.818 N/A ALA 42.A N TRP 38.A O no hydrogen 2.780 N/A VAL 43.A N ALA 39.A O no hydrogen 2.902 N/A CYS 44.A N ILE 40.A O no hydrogen 3.002 N/A CYS 44.A SG ILE 40.A O no hydrogen 3.317 N/A ARG 45.A N TYR 41.A O no hydrogen 2.897 N/A ARG 45.A NH2 ASP 48.A OD2.B no hydrogen 3.030 N/A LYS 46.A N ALA 42.A O no hydrogen 2.938 N/A LYS 46.A NZ TYR 10.A OH no hydrogen 2.980 N/A ILE 47.A N VAL 43.A O no hydrogen 2.987 N/A ASP 48.A N CYS 44.A O no hydrogen 2.903 N/A ASP 49.A N ARG 45.A O no hydrogen 2.903 N/A SER 50.A N ILE 47.A O no hydrogen 3.218 N/A SER 50.A OG ILE 47.A O no hydrogen 2.879 N/A ASP 52.A N ASP 49.A O no hydrogen 2.887 N/A GLN 55.A N ASP 53.A OD1 no hydrogen 3.294 N/A ASN 58.A N ILE 54.A O no hydrogen 2.791 N/A GLN 59.A N GLN 55.A O no hydrogen 2.984 N/A ILE 60.A N PHE 56.A O no hydrogen 2.848 N/A LYS 61.A N LEU 57.A O no hydrogen 2.954 N/A GLU 62.A N ASN 58.A O no hydrogen 2.891 N/A ASP 63.A N GLN 59.A O no hydrogen 2.866 N/A ILE 64.A N ILE 60.A O no hydrogen 2.970 N/A GLN 65.A N LYS 61.A O no hydrogen 3.017 N/A SER 66.A N GLU 62.A O no hydrogen 2.982 N/A SER 66.A OG GLU 62.A O no hydrogen 2.954 N/A ILE 67.A N ASP 63.A O no hydrogen 3.145 N/A GLU 68.A N ILE 64.A O no hydrogen 2.960 N/A LYS 69.A N GLN 65.A O no hydrogen 2.911 N/A TYR 70.A N SER 66.A O no hydrogen 2.717 N/A GLU 73.A N TYR 70.A O no hydrogen 3.210 N/A HIS 75.A NE2 TYR 70.A O no hydrogen 2.787 N/A GLN 78.A N ASP 63.A OD2 no hydrogen 2.856 N/A SER 79.A N ASP 63.A OD1 no hydrogen 2.788 N/A SER 79.A OG ASP 63.A OD1 no hydrogen 2.459 N/A ARG 81.A NE TYR 74.A OH no hydrogen 3.538 N/A ARG 81.A NH2 TYR 74.A OH no hydrogen 2.830 N/A ILE 83.A N ASP 80.A OD1 no hydrogen 3.388 N/A MET 84.A N ASP 80.A O no hydrogen 3.033 N/A MET 85.A N ARG 81.A O no hydrogen 2.715 N/A ALA 86.A N ARG 82.A O no hydrogen 3.249 N/A LEU 87.A N ILE 83.A O no hydrogen 2.843 N/A GLN 88.A N MET 84.A O no hydrogen 2.837 N/A GLN 88.A NE2 PRO 71.A O no hydrogen 2.671 N/A GLN 88.A NE2 GLU 73.A O no hydrogen 2.785 N/A HIS 89.A N MET 85.A O no hydrogen 3.069 N/A VAL 90.A N ALA 86.A O no hydrogen 2.955 N/A ALA 91.A N LEU 87.A O no hydrogen 2.847 N/A GLN 92.A N GLN 88.A O no hydrogen 3.006 N/A GLN 92.A N HIS 89.A O no hydrogen 3.312 N/A GLN 92.A NE2 PRO 71.A O no hydrogen 2.883 N/A HIS 93.A N VAL 90.A O no hydrogen 2.891 N/A HIS 93.A ND1 HIS 89.A O no hydrogen 2.798 N/A LYS 94.A N VAL 90.A O no hydrogen 2.836 N/A GLN 99.A NE2 ASN 103.A OD1 no hydrogen 2.887 N/A SER 100.A N ALA 97.A O no hydrogen 2.927 N/A SER 100.A OG GLU 136.A OE1 no hydrogen 2.541 N/A TYR 102.A N PHE 98.A O no hydrogen 3.131 N/A TYR 102.A OH GLU 68.A OE1 no hydrogen 2.862 N/A ASN 103.A N GLN 99.A O no hydrogen 2.880 N/A ASN 103.A ND2 TYR 128.A OH no hydrogen 3.090 N/A LEU 104.A N SER 100.A O no hydrogen 3.120 N/A ILE 105.A N PHE 101.A O no hydrogen 2.876 N/A ASP 106.A N TYR 102.A O no hydrogen 2.893 N/A THR 107.A N ASN 103.A O no hydrogen 3.045 N/A THR 107.A OG1 ASN 103.A O no hydrogen 2.781 N/A VAL 108.A N LEU 104.A O no hydrogen 2.972 N/A TYR 109.A N ILE 105.A O no hydrogen 2.831 N/A TYR 109.A OH ASN 58.A OD1 no hydrogen 2.324 N/A LYS 110.A N ASP 106.A O no hydrogen 3.058 N/A ASP 111.A N THR 107.A O no hydrogen 2.976 N/A ASP 111.A N VAL 108.A O no hydrogen 3.096 N/A GLU 118.A N GLU 122.A OE1 no hydrogen 2.988 N/A ASP 120.A N GLN 184.A OE1 no hydrogen 2.828 N/A GLU 122.A N THR 119.A O no hydrogen 3.149 N/A LEU 123.A N THR 119.A O no hydrogen 3.328 N/A PHE 124.A N ASP 120.A O no hydrogen 2.763 N/A GLY 125.A N ALA 121.A O no hydrogen 2.935 N/A TYR 126.A N GLU 122.A O no hydrogen 3.015 N/A CYS 127.A N LEU 123.A O no hydrogen 2.870 N/A CYS 127.A SG LEU 123.A O no hydrogen 3.498 N/A TYR 128.A N PHE 124.A O no hydrogen 2.909 N/A TYR 128.A OH GLU 136.A OE1 no hydrogen 2.698 N/A TYR 128.A OH GLU 136.A OE2 no hydrogen 3.324 N/A GLY 129.A N GLY 125.A O no hydrogen 3.051 N/A VAL 130.A N TYR 126.A O no hydrogen 2.937 N/A GLY 132.A N CYS 127.A O no hydrogen 3.042 N/A THR 133.A N TYR 128.A O no hydrogen 2.904 N/A THR 133.A OG1 GLY 129.A O no hydrogen 2.714 N/A GLY 135.A N ALA 131.A O no hydrogen 3.145 N/A GLU 136.A N GLY 132.A O no hydrogen 2.946 N/A VAL 137.A N THR 133.A O no hydrogen 2.967 N/A LEU 138.A N VAL 134.A O no hydrogen 2.957 N/A THR 139.A N GLU 136.A O no hydrogen 3.263 N/A THR 139.A OG1 GLY 135.A O no hydrogen 2.875 N/A THR 139.A OG1 GLU 136.A O no hydrogen 3.473 N/A ILE 141.A N LEU 138.A O no hydrogen 3.022 N/A LEU 142.A N LEU 138.A O no hydrogen 3.226 N/A LEU 142.A N THR 139.A O no hydrogen 3.034 N/A SER 143.A OG THR 139.A O no hydrogen 3.040 N/A GLU 146.A N GLU 146.A OE1 no hydrogen 2.870 N/A THR 147.A N THR 150.A OG1 no hydrogen 3.154 N/A GLN 149.A N GLN 149.A OE1 no hydrogen 2.495 N/A THR 150.A OG1 THR 147.A O no hydrogen 3.483 N/A TYR 151.A N THR 147.A O no hydrogen 3.150 N/A ASP 152.A N HIS 148.A O no hydrogen 2.901 N/A VAL 153.A N GLN 149.A O no hydrogen 2.922 N/A ALA 154.A N THR 150.A O no hydrogen 3.095 N/A ARG 155.A N TYR 151.A O no hydrogen 2.904 N/A ARG 155.A NE GLU 136.A OE2 no hydrogen 2.826 N/A ARG 155.A NH2 GLU 136.A OE2 no hydrogen 3.069 N/A ARG 156.A N ASP 152.A O no hydrogen 2.917 N/A ARG 156.A NH1 ASP 152.A OD2 no hydrogen 2.680 N/A ARG 156.A NH2 ASP 152.A OD2 no hydrogen 3.074 N/A LEU 157.A N VAL 153.A O no hydrogen 2.918 N/A GLY 158.A N ALA 154.A O no hydrogen 2.975 N/A GLU 159.A N ARG 155.A O no hydrogen 2.966 N/A SER 160.A N ARG 156.A O no hydrogen 2.981 N/A SER 160.A OG ARG 156.A O no hydrogen 2.863 N/A LEU 161.A N LEU 157.A O no hydrogen 2.926 N/A GLN 162.A N GLY 158.A O no hydrogen 2.997 N/A LEU 163.A N GLU 159.A O no hydrogen 3.022 N/A ILE 164.A N SER 160.A O no hydrogen 2.872 N/A ASN 165.A N LEU 161.A O no hydrogen 2.917 N/A ILE 166.A N GLN 162.A O no hydrogen 2.866 N/A LEU 167.A N LEU 163.A O no hydrogen 2.997 N/A ARG 168.A N ILE 164.A O no hydrogen 2.916 N/A ARG 168.A NE ASP 169.A OD1 no hydrogen 2.584 N/A ARG 168.A NE ASP 169.A OD2 no hydrogen 3.343 N/A ARG 168.A NH2 ASP 169.A OD1 no hydrogen 3.340 N/A ARG 168.A NH2 ASP 169.A OD2 no hydrogen 2.824 N/A ASP 169.A N ILE 166.A O no hydrogen 3.066 N/A ASP 173.A N ASP 169.A O no hydrogen 2.852 N/A PHE 174.A N VAL 170.A O no hydrogen 2.949 N/A GLU 175.A N GLY 171.A O no hydrogen 2.995 N/A ASN 176.A N GLU 172.A O no hydrogen 3.113 N/A ASN 176.A N ASP 173.A O no hydrogen 2.965 N/A GLU 177.A N PHE 174.A O no hydrogen 2.760 N/A ARG 178.A N ASP 173.A O no hydrogen 2.763 N/A SER 182.A N TYR 212.A OH no hydrogen 3.225 N/A SER 182.A OG ASP 120.A OD1 no hydrogen 2.593 N/A SER 182.A OG TYR 212.A OH no hydrogen 3.343 N/A LYS 183.A N PHE 117.A O no hydrogen 2.895 N/A LYS 183.A NZ MET 116.A O no hydrogen 3.458 N/A LYS 183.A NZ GLU 118.A OE2 no hydrogen 2.712 N/A GLN 184.A N GLU 118.A O no hydrogen 2.971 N/A ARG 185.A N SER 182.A OG no hydrogen 3.144 N/A ARG 185.A NE ASP 120.A OD2 no hydrogen 2.843 N/A ARG 185.A NH1 GLN 188.A OE1 no hydrogen 2.985 N/A ARG 185.A NH2 ASP 120.A OD2 no hydrogen 2.976 N/A LEU 186.A N SER 182.A O no hydrogen 2.858 N/A LYS 187.A N LYS 183.A O no hydrogen 2.798 N/A GLN 188.A N GLN 184.A O no hydrogen 3.051 N/A TYR 189.A N ARG 185.A O no hydrogen 3.026 N/A GLU 190.A N LYS 187.A O no hydrogen 3.190 N/A VAL 191.A N LEU 186.A O no hydrogen 2.930 N/A GLU 195.A N ASP 192.A OD1 no hydrogen 3.239 N/A VAL 196.A N ASP 192.A O no hydrogen 3.002 N/A TYR 197.A N ILE 193.A O no hydrogen 2.822 N/A TYR 197.A OH GLU 175.A OE2 no hydrogen 2.814 N/A GLN 198.A N ALA 194.A O no hydrogen 2.951 N/A GLN 198.A NE2 ASN 199.A OD1 no hydrogen 3.281 N/A ASN 199.A N GLU 195.A O no hydrogen 2.801 N/A ASN 199.A ND2 GLU 195.A OE2 no hydrogen 2.701 N/A GLY 200.A N VAL 196.A O no hydrogen 2.727 N/A TYR 205.A N ASN 202.A OD1 no hydrogen 2.771 N/A ILE 206.A N ASN 202.A O no hydrogen 3.160 N/A ASP 207.A N ASN 203.A O no hydrogen 3.075 N/A LEU 208.A N HIS 204.A O no hydrogen 2.970 N/A TRP 209.A N TYR 205.A O no hydrogen 2.734 N/A TRP 209.A NE1 LEU 167.A O no hydrogen 2.971 N/A GLU 210.A N ILE 206.A O no hydrogen 2.832 N/A TYR 211.A N ASP 207.A O no hydrogen 2.927 N/A TYR 212.A N LEU 208.A O no hydrogen 3.265 N/A TYR 212.A OH ASP 120.A OD1 no hydrogen 2.565 N/A ALA 213.A N TRP 209.A O no hydrogen 2.847 N/A ALA 214.A N GLU 210.A O no hydrogen 2.840 N/A ILE 215.A N TYR 211.A O no hydrogen 3.300 N/A ALA 216.A N TYR 212.A O no hydrogen 2.957 N/A GLU 217.A N ALA 213.A O no hydrogen 2.916 N/A LYS 218.A N ALA 214.A O no hydrogen 3.040 N/A LYS 218.A NZ ASP 222.A OD2 no hydrogen 3.354 N/A ASP 219.A N ILE 215.A O no hydrogen 3.030 N/A PHE 220.A N ALA 216.A O no hydrogen 2.947 N/A ARG 221.A N GLU 217.A O no hydrogen 2.947 N/A ASP 222.A N LYS 218.A O no hydrogen 3.066 N/A VAL 223.A N ASP 219.A O no hydrogen 2.876 N/A MET 224.A N PHE 220.A O no hydrogen 2.863 N/A ASP 225.A N ARG 221.A O no hydrogen 2.934 N/A GLN 226.A N VAL 223.A O no hydrogen 2.840 N/A GLN 226.A NE2 ASP 222.A O no hydrogen 3.547 N/A ILE 227.A N MET 224.A O no hydrogen 3.184 N/A VAL 229.A N GLN 226.A O no hydrogen 3.174 N/A PHE 230.A N ILE 227.A O no hydrogen 3.135 N/A SER 231.A N LEU 142.A O no hydrogen 2.951 N/A SER 231.A OG GLU 233.A OE1 no hydrogen 2.984 N/A ALA 234.A N SER 231.A O no hydrogen 2.884 N/A ALA 234.A N SER 231.A OG no hydrogen 3.312 N/A GLN 235.A N SER 231.A O no hydrogen 2.948 N/A GLN 235.A NE2 PHE 230.A O no hydrogen 2.789 N/A ILE 238.A N ALA 234.A O no hydrogen 2.794 N/A GLU 239.A N GLN 235.A O no hydrogen 2.892 N/A LEU 240.A N PRO 236.A O no hydrogen 2.833 N/A ALA 241.A N ILE 237.A O no hydrogen 2.850 N/A ALA 242.A N ILE 238.A O no hydrogen 2.972 N/A ARG 243.A N GLU 239.A O no hydrogen 2.798 N/A ILE 244.A N LEU 240.A O no hydrogen 2.810 N/A TYR 245.A N ALA 241.A O no hydrogen 3.018 N/A TYR 245.A OH ASN 165.A OD1 no hydrogen 3.026 N/A ILE 246.A N ALA 242.A O no hydrogen 2.757 N/A GLU 247.A N ARG 243.A O no hydrogen 2.939 N/A ILE 248.A N TYR 245.A O no hydrogen 3.217 N/A LEU 249.A N ILE 246.A O no hydrogen 2.922 N/A GLU 251.A N GLU 247.A O no hydrogen 3.173 N/A VAL 252.A N ILE 248.A O no hydrogen 2.939 N/A ARG 253.A N LEU 249.A O no hydrogen 2.995 N/A ARG 253.A NE GLU 210.A OE2 no hydrogen 2.908 N/A ARG 253.A NH1 ASP 250.A OD2 no hydrogen 3.362 N/A ARG 253.A NH2 GLU 210.A OE1 no hydrogen 2.908 N/A ARG 253.A NH2 GLU 217.A OE2 no hydrogen 2.676 N/A GLN 254.A N ASP 250.A O no hydrogen 2.694 N/A ALA 255.A N GLU 251.A O no hydrogen 2.934 N/A ASN 256.A N ARG 253.A O no hydrogen 2.935 N/A TYR 257.A N VAL 252.A O no hydrogen 2.782 N/A TYR 257.A OH GLU 210.A OE2 no hydrogen 2.561 N/A THR 258.A N ALA 255.A O no hydrogen 3.292 N/A HIS 260.A N THR 258.A OG1 no hydrogen 2.917 N/A ARG 262.A NE GLU 172.A OE2 no hydrogen 3.165 N/A ARG 262.A NH2 GLU 172.A OE1 no hydrogen 2.847 N/A ARG 262.A NH2 GLU 172.A OE2 no hydrogen 3.230 N/A ARG 268.A NH1 ARG 268.A O no hydrogen 3.013 N/A LYS 270.A N GLU 266.A O no hydrogen 3.112 N/A LYS 270.A NZ VAL 265.A O no hydrogen 2.773 N/A ALA 271.A N LYS 267.A O no hydrogen 3.157 N/A LYS 272.A N ARG 268.A O no hydrogen 3.073 N/A LEU 273.A N LYS 269.A O no hydrogen 3.009 N/A PHE 274.A N LYS 270.A O no hydrogen 3.126 N/A HIS 275.A N ALA 271.A O no hydrogen 2.988 N/A GLU 276.A N LYS 272.A O no hydrogen 2.931 N/A ILE 277.A N LEU 273.A O no hydrogen 2.952 N/A ASN 278.A N PHE 274.A O no hydrogen 3.109 N/A SER 279.A N HIS 275.A O no hydrogen 3.292 N/A SER 279.A OG GLU 276.A O no hydrogen 2.649 N/A LYS 280.A NZ GLU 239.A OE1 no hydrogen 3.513 N/A LYS 280.A NZ GLU 239.A OE2 no hydrogen 2.489 N/A TYR 281.A N ASN 278.A O no hydrogen 3.079 N/A TYR 281.A OH GLU 239.A OE1 no hydrogen 3.134 N/A