Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xjr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 6.A N SER 255.A OG.B no hydrogen 2.926 N/A GLY 10.A N HIS 7.A O no hydrogen 2.975 N/A ALA 14.A N ILE 251.A O no hydrogen 3.065 N/A CYS 15.A N TYR 201.A O no hydrogen 2.886 N/A LEU 16.A N CYS 249.A O no hydrogen 2.933 N/A ALA 18.A N GLN 246.A OE1 no hydrogen 2.813 N/A ARG 21.A NH2 TYR 201.A OH no hydrogen 2.947 N/A LYS 22.A N SER 239.A O no hydrogen 2.902 N/A LYS 22.A NZ ASP 241.A OD1 no hydrogen 3.007 N/A LYS 22.A NZ ASP 241.A OD2 no hydrogen 3.329 N/A GLY 24.A N VAL 237.A O no hydrogen 2.898 N/A MET 25.A N GLN 62.A O no hydrogen 2.772 N/A ASN 26.A N THR 127.A O no hydrogen 2.861 N/A ILE 27.A N VAL 59.A O no hydrogen 2.800 N/A ASN 28.A N GLU 125.A O no hydrogen 2.884 N/A ASN 28.A ND2 GLU 125.A OE1 no hydrogen 2.922 N/A PHE 29.A N GLY 57.A O no hydrogen 2.967 N/A TYR 30.A N THR 123.A O no hydrogen 2.802 N/A GLN 31.A N THR 54.A O no hydrogen 2.914 N/A TYR 32.A OH ASP 36.A O no hydrogen 2.680 N/A SER 33.A OG GLN 31.A OE1 no hydrogen 3.034 N/A LYS 35.A N ALA 211.A O no hydrogen 2.781 N/A LYS 35.A NZ GLY 104.A O no hydrogen 2.866 N/A ASP 36.A N SER 33.A O no hydrogen 3.087 N/A SER 38.A N ASP 36.A OD1 no hydrogen 2.970 N/A SER 38.A OG.A ASP 36.A OD1 no hydrogen 3.251 N/A THR 39.A N ASP 36.A OD1 no hydrogen 2.944 N/A THR 39.A OG1 ASP 36.A OD1 no hydrogen 3.355 N/A THR 39.A OG1 ASP 36.A OD2 no hydrogen 2.596 N/A TYR 40.A N TYR 32.A OH no hydrogen 3.062 N/A TYR 40.A OH.B ASP 147.A OD2.B no hydrogen 2.759 N/A SER 41.A N SER 38.A O no hydrogen 2.985 N/A SER 41.A OG LYS 180.A O no hydrogen 2.685 N/A ASN 42.A N THR 39.A O no hydrogen 3.378 N/A ASN 42.A ND2.B THR 39.A O no hydrogen 3.107 N/A TYR 45.A N ASN 42.A OD1.A no hydrogen 2.827 N/A TYR 45.A OH THR 123.A OG1 no hydrogen 2.746 N/A MET 46.A N ASN 42.A O no hydrogen 3.097 N/A ALA 47.A N ALA 43.A O no hydrogen 2.892 N/A TYR 48.A N ALA 44.A O no hydrogen 3.044 N/A GLY 49.A N ALA 44.A O no hydrogen 2.859 N/A TYR 50.A N TYR 45.A O no hydrogen 2.981 N/A TYR 50.A OH GLU 125.A OE2 no hydrogen 2.635 N/A ALA 51.A N TYR 48.A O no hydrogen 3.086 N/A SER 52.A N GLY 49.A O no hydrogen 2.927 N/A SER 52.A OG.B GLY 49.A O no hydrogen 2.673 N/A LYS 53.A N TYR 50.A O no hydrogen 3.185 N/A LEU 56.A N PHE 29.A O no hydrogen 2.736 N/A VAL 59.A N ILE 27.A O no hydrogen 2.921 N/A GLN 62.A N MET 25.A O no hydrogen 2.934 N/A GLN 62.A NE2 GLY 60.A O no hydrogen 2.955 N/A THR 63.A OG1 ASN 232.A OD1.A no hydrogen 3.432 N/A ILE 65.A N ASP 231.A O no hydrogen 2.962 N/A SER 66.A N ASP 231.A OD1.B no hydrogen 3.151 N/A SER 66.A OG ASP 231.A OD1.A no hydrogen 2.613 N/A ILE 67.A N LEU 217.A O no hydrogen 2.887 N/A TYR 69.A N GLY 215.A O no hydrogen 2.803 N/A CYS 73.A N PHE 80.A O no hydrogen 2.805 N/A VAL 74.A N ASN 101.A OD1 no hydrogen 2.847 N/A SER 75.A N GLY 78.A O no hydrogen 2.953 N/A SER 75.A OG SER 77.A OG no hydrogen 3.173 N/A SER 75.A OG GLY 78.A O no hydrogen 2.850 N/A SER 77.A N SER 75.A OG no hydrogen 3.138 N/A SER 77.A OG SER 75.A OG no hydrogen 3.173 N/A GLY 78.A N SER 75.A O no hydrogen 3.167 N/A PHE 80.A N CYS 73.A O no hydrogen 3.169 N/A CYS 82.A N ILE 71.A O no hydrogen 2.906 N/A CYS 82.A SG PRO 83.A O no hydrogen 3.340 N/A GLN 84.A N GLN 84.A OE1.B no hydrogen 2.754 N/A GLN 84.A NE2.B THR 216.A OG1 no hydrogen 3.110 N/A GLU 85.A N GLU 85.A OE1 no hydrogen 2.787 N/A ASP 86.A N PRO 83.A O no hydrogen 2.846 N/A SER 87.A N GLN 84.A O no hydrogen 3.058 N/A SER 87.A OG GLN 84.A O no hydrogen 2.739 N/A TYR 88.A N GLY 92.A O no hydrogen 2.947 N/A TRP 91.A NE1 ASN 101.A O no hydrogen 2.846 N/A GLY 92.A N TYR 88.A O no hydrogen 2.798 N/A CYS 93.A N GLY 97.A O no hydrogen 3.074 N/A LYS 94.A N ASP 86.A O no hydrogen 2.849 N/A MET 96.A N CYS 93.A O no hydrogen 2.785 N/A CYS 99.A N TRP 91.A O no hydrogen 2.852 N/A SER 100.A N VAL 74.A O no hydrogen 2.921 N/A SER 100.A OG VAL 74.A O no hydrogen 3.415 N/A ASN 101.A ND2 PRO 72.A O no hydrogen 2.823 N/A ASN 101.A ND2 TYR 107.A OH no hydrogen 2.861 N/A GLY 104.A N SER 102.A OG no hydrogen 2.876 N/A TYR 107.A N THR 120.A OG1 no hydrogen 3.199 N/A TYR 107.A OH SER 102.A O no hydrogen 2.620 N/A SER 109.A N THR 117.A O no hydrogen 2.936 N/A ASP 111.A N SER 109.A OG no hydrogen 2.910 N/A PHE 113.A N ASP 111.A O no hydrogen 3.213 N/A GLY 114.A N THR 110.A O no hydrogen 2.995 N/A PHE 115.A N LEU 112.A O no hydrogen 3.094 N/A THR 117.A N SER 109.A O no hydrogen 3.149 N/A THR 118.A OG1 THR 118.A O no hydrogen 2.758 N/A THR 118.A OG1 ASN 121.A O no hydrogen 2.961 N/A THR 118.A OG1 ASN 121.A OD1 no hydrogen 3.465 N/A THR 120.A OG1 ASN 121.A OD1 no hydrogen 2.739 N/A ASN 121.A N THR 118.A O no hydrogen 2.985 N/A ASN 121.A ND2 TYR 32.A O no hydrogen 3.034 N/A VAL 122.A N ASN 210.A O no hydrogen 3.085 N/A THR 123.A N TYR 30.A O no hydrogen 3.037 N/A THR 123.A OG1 TYR 45.A OH no hydrogen 2.746 N/A THR 123.A OG1 SER 209.A OG.A no hydrogen 2.977 N/A THR 123.A OG1 SER 209.A OG.B no hydrogen 2.813 N/A LEU 124.A N TYR 208.A O no hydrogen 2.808 N/A GLU 125.A N ASN 28.A O no hydrogen 2.852 N/A MET 126.A N VAL 206.A O no hydrogen 2.756 N/A THR 127.A N ASN 26.A O no hydrogen 2.870 N/A GLY 128.A N LEU 204.A O no hydrogen 3.126 N/A TYR 129.A N TYR 238.A O no hydrogen 2.713 N/A PHE 130.A N TYR 202.A O no hydrogen 2.792 N/A LEU 131.A N TYR 236.A O no hydrogen 2.804 N/A GLN 134.A N TYR 138.A OH no hydrogen 3.230 N/A GLN 134.A NE2.A ASP 225.A OD2 no hydrogen 3.014 N/A GLY 136.A N MET 196.A O no hydrogen 2.924 N/A TYR 138.A N VAL 194.A O no hydrogen 2.864 N/A TYR 138.A OH GLN 134.A O no hydrogen 2.611 N/A THR 139.A N GLU 222.A O no hydrogen 2.986 N/A THR 139.A OG1 THR 193.A OG1.B no hydrogen 2.877 N/A PHE 140.A N GLY 192.A O no hydrogen 2.825 N/A SER 141.A N SER 220.A O no hydrogen 2.893 N/A SER 141.A OG.B ILE 190.A O.B no hydrogen 3.506 N/A PHE 142.A N ILE 190.A O.A no hydrogen 3.019 N/A PHE 142.A N ILE 190.A O.B no hydrogen 2.957 N/A ALA 143.A N PRO 218.A O no hydrogen 2.964 N/A THR 144.A OG1 ASP 188.A OD1.B no hydrogen 2.908 N/A ASP 146.A N THR 216.A O no hydrogen 2.915 N/A ASP 147.A N SER 209.A O no hydrogen 3.015 N/A SER 148.A N SER 209.A O no hydrogen 3.119 N/A SER 148.A OG TYR 40.A O no hydrogen 2.768 N/A ALA 149.A N GLY 178.A O no hydrogen 3.076 N/A ILE 150.A N VAL 207.A O no hydrogen 2.888 N/A LEU 151.A N ILE 176.A O no hydrogen 3.024 N/A SER 152.A N LYS 205.A O no hydrogen 2.822 N/A VAL 153.A N THR 175.A OG1 no hydrogen 2.999 N/A GLY 154.A N PRO 203.A O no hydrogen 2.771 N/A GLY 155.A N GLU 13.A O no hydrogen 2.863 N/A SER 156.A N PHE 159.A O no hydrogen 2.952 N/A SER 156.A OG GLU 13.A OE2 no hydrogen 2.826 N/A SER 156.A OG GLU 160.A OE1 no hydrogen 3.428 N/A SER 156.A OG GLU 160.A OE2 no hydrogen 3.264 N/A ILE 157.A N GLY 154.A O no hydrogen 3.045 N/A ALA 158.A N GLY 154.A O no hydrogen 2.886 N/A CYS 161.A SG ALA 14.A O no hydrogen 3.177 N/A CYS 161.A SG CYS 249.A O no hydrogen 4.036 N/A CYS 162.A N TYR 129.A OH no hydrogen 2.960 N/A CYS 162.A SG GLN 246.A OE1 no hydrogen 3.411 N/A ALA 163.A N GLU 160.A O no hydrogen 2.978 N/A GLN 164.A NE2 THR 127.A OG1 no hydrogen 3.352 N/A GLN 164.A NE2 SER 239.A OG no hydrogen 3.077 N/A GLU 165.A N ASP 242.A OD1 no hydrogen 2.752 N/A GLN 166.A N ALA 163.A O no hydrogen 3.251 N/A GLN 166.A NE2 ASP 242.A OD2 no hydrogen 2.854 N/A ASN 173.A N SER 171.A OG no hydrogen 3.104 N/A THR 175.A N LEU 151.A O no hydrogen 2.795 N/A ILE 176.A N LEU 151.A O no hydrogen 2.889 N/A ILE 179.A N ASN 177.A OD1 no hydrogen 3.000 N/A LYS 180.A N SER 148.A OG no hydrogen 3.058 N/A LYS 180.A NZ.A TYR 40.A OH.A no hydrogen 2.464 N/A ASN 189.A N.B ALA 143.A O no hydrogen 2.997 N/A ILE 190.A N.B PHE 142.A O no hydrogen 3.123 N/A THR 191.A N ASN 189.A OD1.A no hydrogen 2.955 N/A THR 191.A OG1 ASN 189.A OD1.A no hydrogen 3.206 N/A GLY 192.A N PHE 140.A O no hydrogen 2.973 N/A THR 193.A OG1.B THR 139.A OG1 no hydrogen 2.877 N/A VAL 194.A N TYR 138.A O no hydrogen 2.902 N/A MET 196.A N GLY 136.A O no hydrogen 2.897 N/A TYR 197.A N TYR 202.A OH no hydrogen 2.964 N/A ALA 198.A N THR 135.A OG1 no hydrogen 2.872 N/A GLY 199.A N PRO 132.A O no hydrogen 3.113 N/A TYR 200.A N TYR 197.A O no hydrogen 3.427 N/A TYR 200.A OH HIS 257.A ND1.B no hydrogen 2.740 N/A TYR 201.A N CYS 15.A O no hydrogen 2.950 N/A TYR 202.A N PHE 130.A O no hydrogen 2.881 N/A LEU 204.A N GLY 128.A O no hydrogen 2.821 N/A LYS 205.A N SER 152.A O no hydrogen 2.932 N/A LYS 205.A NZ ALA 47.A O no hydrogen 2.754 N/A VAL 206.A N MET 126.A O no hydrogen 2.947 N/A VAL 207.A N ILE 150.A O no hydrogen 3.039 N/A TYR 208.A N LEU 124.A O no hydrogen 2.937 N/A TYR 208.A OH ASP 146.A O no hydrogen 2.672 N/A SER 209.A N SER 148.A O no hydrogen 2.832 N/A SER 209.A OG.A VAL 122.A O no hydrogen 3.538 N/A SER 209.A OG.A THR 123.A OG1 no hydrogen 2.977 N/A SER 209.A OG.B THR 123.A OG1 no hydrogen 2.813 N/A ASN 210.A N VAL 122.A O no hydrogen 3.044 N/A ASN 210.A ND2 PRO 119.A O no hydrogen 2.785 N/A ASN 210.A ND2 SER 213.A O no hydrogen 2.935 N/A ASN 210.A ND2 TRP 214.A O no hydrogen 3.192 N/A ALA 211.A N ASP 147.A OD2.A no hydrogen 3.089 N/A ALA 211.A N ASP 147.A OD2.B no hydrogen 2.853 N/A TRP 214.A NE1 CYS 82.A O no hydrogen 2.811 N/A GLY 215.A N TYR 69.A O no hydrogen 3.083 N/A THR 216.A N ASP 146.A O no hydrogen 2.943 N/A LEU 217.A N ILE 67.A O no hydrogen 2.876 N/A ILE 219.A N SER 66.A OG no hydrogen 2.910 N/A SER 220.A N SER 141.A O no hydrogen 3.001 N/A SER 220.A OG.A SER 230.A OG no hydrogen 2.816 N/A SER 220.A OG.B SER 141.A OG.A no hydrogen 2.695 N/A VAL 221.A N VAL 229.A O no hydrogen 2.847 N/A GLU 222.A N THR 139.A O no hydrogen 2.798 N/A LEU 223.A N THR 227.A O no hydrogen 2.829 N/A ASP 225.A N GLN 134.A OE1.A no hydrogen 3.079 N/A GLY 226.A N LEU 223.A O no hydrogen 2.848 N/A THR 227.A N ASP 225.A OD1 no hydrogen 2.992 N/A THR 227.A OG1 ASP 225.A OD1 no hydrogen 2.718 N/A VAL 229.A N VAL 221.A O no hydrogen 2.823 N/A SER 230.A OG SER 220.A OG.A no hydrogen 2.816 N/A ASP 231.A N ILE 219.A O no hydrogen 2.917 N/A ASN 232.A N SER 230.A O no hydrogen 2.761 N/A PHE 233.A N THR 63.A O no hydrogen 2.775 N/A GLU 234.A N ASN 232.A OD1.A no hydrogen 2.968 N/A GLU 234.A N ASN 232.A OD1.B no hydrogen 2.990 N/A TYR 236.A N PHE 233.A O no hydrogen 2.876 N/A TYR 238.A N TYR 129.A O no hydrogen 2.927 N/A SER 239.A N LYS 22.A O no hydrogen 2.800 N/A SER 239.A OG GLY 24.A O no hydrogen 2.741 N/A PHE 240.A N GLN 164.A OE1 no hydrogen 2.988 N/A ASP 242.A N GLU 165.A OE2 no hydrogen 2.807 N/A ASP 243.A N CYS 162.A O no hydrogen 2.893 N/A SER 245.A N ASP 243.A OD1 no hydrogen 3.032 N/A SER 245.A OG.A ASP 243.A OD1 no hydrogen 2.748 N/A GLN 246.A N ASP 243.A O no hydrogen 3.253 N/A GLN 246.A NE2 LEU 16.A O no hydrogen 2.910 N/A GLN 246.A NE2 ASN 248.A OD1 no hydrogen 2.863 N/A CYS 249.A N GLN 246.A O no hydrogen 3.201 N/A ILE 251.A N ALA 14.A O no hydrogen 2.791 N/A SER 255.A N.A ASP 253.A OD1 no hydrogen 3.092 N/A SER 255.A OG.A ASP 253.A OD1 no hydrogen 2.991 N/A SER 255.A OG.B ASP 253.A OD1 no hydrogen 2.352 N/A SER 255.A OG.B ASP 253.A OD2 no hydrogen 3.092 N/A ILE 256.A N.A ASP 253.A O no hydrogen 3.149 N/A ILE 256.A N.B ASP 253.A O no hydrogen 3.077 N/A HIS 257.A N.A PRO 254.A O no hydrogen 3.500 N/A HIS 257.A N.B ASP 253.A O no hydrogen 3.076 N/A HIS 257.A N.B PRO 254.A O no hydrogen 3.279 N/A HIS 257.A ND1.B TYR 200.A OH no hydrogen 2.740 N/A