Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6jxt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 9.A N LEU 80.A O no hydrogen 3.300 N/A LEU 11.A N ILE 82.A O no hydrogen 2.621 N/A LYS 12.A N GLU 15.A OE1 no hydrogen 3.092 N/A LYS 12.A NZ GLU 38.A OE1 no hydrogen 3.234 N/A LYS 12.A NZ GLU 38.A OE2 no hydrogen 3.275 N/A GLU 15.A N LYS 12.A O no hydrogen 3.032 N/A LYS 17.A N LEU 34.A O no hydrogen 2.944 N/A LYS 18.A NZ GLN 89.A OE1 no hydrogen 2.596 N/A ILE 19.A N LYS 32.A O no hydrogen 2.922 N/A LYS 20.A N LYS 32.A O no hydrogen 3.413 N/A LEU 22.A N VAL 30.A O no hydrogen 2.845 N/A GLY 23.A N VAL 30.A O no hydrogen 3.349 N/A GLY 25.A N GLY 28.A O no hydrogen 3.057 N/A THR 29.A N GLU 50.A O no hydrogen 2.989 N/A VAL 30.A N GLY 23.A O no hydrogen 2.957 N/A TYR 31.A N ILE 48.A O no hydrogen 2.818 N/A LYS 32.A N LYS 20.A O no hydrogen 2.734 N/A LEU 34.A N LYS 17.A O no hydrogen 3.100 N/A TRP 35.A N ILE 44.A O no hydrogen 2.992 N/A TRP 35.A NE1 GLU 15.A OE2 no hydrogen 2.998 N/A ILE 36.A N GLU 15.A O no hydrogen 2.935 N/A ILE 44.A N TRP 35.A O no hydrogen 2.685 N/A VAL 46.A N GLY 33.A O no hydrogen 2.892 N/A ALA 47.A N THR 92.A O no hydrogen 2.882 N/A ILE 48.A N TYR 31.A O no hydrogen 2.871 N/A LYS 49.A N LEU 90.A O no hydrogen 2.700 N/A LYS 49.A NZ ASP 157.A OD2 no hydrogen 2.960 N/A GLU 50.A N THR 29.A O no hydrogen 2.876 N/A LEU 51.A N VAL 88.A O no hydrogen 3.041 N/A ARG 52.A N PHE 27.A O no hydrogen 2.864 N/A ASN 58.A N PRO 55.A O no hydrogen 3.081 N/A ILE 61.A N ALA 57.A O no hydrogen 2.926 N/A LEU 62.A N ASN 58.A O no hydrogen 2.996 N/A ASP 63.A N LYS 59.A O no hydrogen 3.333 N/A GLU 64.A N GLU 60.A O no hydrogen 3.391 N/A ALA 65.A N ILE 61.A O no hydrogen 2.995 N/A TYR 66.A N LEU 62.A O no hydrogen 3.038 N/A MET 68.A N GLU 64.A O no hydrogen 3.391 N/A ALA 69.A N ALA 65.A O no hydrogen 3.016 N/A ALA 69.A N TYR 66.A O no hydrogen 3.214 N/A SER 70.A N TYR 66.A O no hydrogen 3.156 N/A SER 70.A N VAL 67.A O no hydrogen 2.752 N/A SER 70.A OG VAL 67.A O no hydrogen 2.555 N/A ASP 72.A N TYR 129.A OH no hydrogen 2.856 N/A HIS 75.A N ASN 73.A OD1 no hydrogen 3.072 N/A HIS 75.A ND1 VAL 153.A O no hydrogen 3.191 N/A VAL 76.A N ASN 73.A O no hydrogen 3.448 N/A CYS 77.A N ILE 155.A O no hydrogen 2.811 N/A ARG 78.A NE ALA 69.A O no hydrogen 3.074 N/A LEU 79.A N MET 68.A O no hydrogen 3.151 N/A GLY 81.A N ILE 91.A O no hydrogen 3.147 N/A ILE 82.A N ARG 9.A O no hydrogen 2.895 N/A CYS 83.A N GLN 89.A O no hydrogen 3.082 N/A CYS 83.A SG LEU 11.A O no hydrogen 3.651 N/A CYS 83.A SG THR 85.A OG1 no hydrogen 3.438 N/A THR 87.A OG1 LEU 51.A O no hydrogen 2.601 N/A GLN 89.A N CYS 83.A O no hydrogen 3.031 N/A LEU 90.A N LYS 49.A O no hydrogen 2.723 N/A ILE 91.A N GLY 81.A O no hydrogen 2.908 N/A THR 92.A N ALA 47.A O no hydrogen 3.129 N/A LEU 94.A N PRO 45.A O no hydrogen 3.258 N/A PHE 97.A N VAL 147.A O no hydrogen 3.307 N/A GLY 98.A N MET 95.A O no hydrogen 3.068 N/A LEU 100.A N VAL 145.A O no hydrogen 2.795 N/A LEU 101.A N ALA 142.A O no hydrogen 3.298 N/A TYR 103.A N CYS 99.A O no hydrogen 3.027 N/A VAL 104.A N LEU 100.A O no hydrogen 2.740 N/A ARG 105.A N LEU 101.A O no hydrogen 3.395 N/A ARG 105.A NE GLY 211.A O no hydrogen 2.909 N/A ARG 105.A NH2 GLY 211.A O no hydrogen 3.018 N/A GLU 106.A N ASP 102.A O no hydrogen 3.066 N/A HIS 107.A N TYR 103.A O no hydrogen 3.027 N/A ASN 110.A N HIS 107.A O no hydrogen 2.980 N/A SER 113.A N ASP 284.A OD1 no hydrogen 3.123 N/A SER 113.A OG GLN 276.A OE1 no hydrogen 3.501 N/A SER 113.A OG ASP 284.A OD1 no hydrogen 3.339 N/A SER 113.A OG ASP 284.A OD2 no hydrogen 2.669 N/A LEU 116.A N GLY 112.A O no hydrogen 3.404 N/A LEU 117.A N SER 113.A O no hydrogen 3.083 N/A ASN 118.A N GLN 114.A O no hydrogen 2.910 N/A TRP 119.A N TYR 115.A O no hydrogen 3.080 N/A TRP 119.A NE1 PRO 150.A O no hydrogen 2.898 N/A CYS 120.A N LEU 116.A O no hydrogen 3.114 N/A CYS 120.A SG LEU 116.A O no hydrogen 3.432 N/A VAL 121.A N LEU 117.A O no hydrogen 3.076 N/A GLN 122.A N ASN 118.A O no hydrogen 2.986 N/A GLN 122.A NE2 GLN 151.A O no hydrogen 2.806 N/A ILE 123.A N TRP 119.A O no hydrogen 2.944 N/A ALA 124.A N CYS 120.A O no hydrogen 3.197 N/A LYS 125.A N VAL 121.A O no hydrogen 2.967 N/A GLY 126.A N GLN 122.A O no hydrogen 3.068 N/A MET 127.A N ILE 123.A O no hydrogen 2.966 N/A ASN 128.A N ALA 124.A O no hydrogen 2.844 N/A TYR 129.A N LYS 125.A O no hydrogen 3.045 N/A LEU 130.A N GLY 126.A O no hydrogen 3.180 N/A GLU 131.A N MET 127.A O no hydrogen 2.922 N/A ASP 132.A N ASN 128.A O no hydrogen 2.991 N/A ARG 133.A N TYR 129.A O no hydrogen 3.168 N/A ARG 133.A NH1 SER 70.A O no hydrogen 3.292 N/A ARG 133.A NH1 TYR 129.A OH no hydrogen 2.783 N/A ARG 133.A NH2 SER 70.A OG no hydrogen 2.661 N/A ARG 134.A N GLU 131.A O no hydrogen 2.704 N/A LEU 135.A N LEU 130.A O no hydrogen 2.794 N/A HIS 137.A N ASP 196.A OD2 no hydrogen 2.863 N/A HIS 137.A NE2 THR 156.A O no hydrogen 2.898 N/A ARG 138.A N ASP 196.A OD1 no hydrogen 2.934 N/A ASP 139.A N HIS 137.A ND1 no hydrogen 3.084 N/A ALA 142.A N GLU 206.A OE2 no hydrogen 2.973 N/A ARG 143.A NH2 ASP 139.A OD1 no hydrogen 3.026 N/A ASN 144.A N ALA 141.A O no hydrogen 2.983 N/A ASN 144.A ND2 ASP 139.A O no hydrogen 2.861 N/A ASN 144.A ND2 ASP 139.A OD2 no hydrogen 3.225 N/A VAL 145.A N ALA 142.A O no hydrogen 3.229 N/A LEU 146.A N LYS 154.A O no hydrogen 2.832 N/A VAL 147.A N GLY 98.A O no hydrogen 2.850 N/A LYS 148.A N HIS 152.A O no hydrogen 2.817 N/A THR 149.A N HIS 152.A O no hydrogen 3.054 N/A GLN 151.A N THR 149.A OG1 no hydrogen 3.038 N/A HIS 152.A N THR 149.A O no hydrogen 2.707 N/A HIS 152.A NE2 PRO 74.A O no hydrogen 2.728 N/A VAL 153.A N GLN 122.A OE1 no hydrogen 2.798 N/A LYS 154.A N LEU 146.A O no hydrogen 2.916 N/A ILE 155.A N HIS 75.A O no hydrogen 2.823 N/A THR 156.A N ASN 144.A O no hydrogen 2.800 N/A LEU 160.A N ASP 157.A O no hydrogen 3.483 N/A LEU 164.A N LEU 160.A O no hydrogen 3.012 N/A GLY 165.A N LYS 162.A O no hydrogen 2.758 N/A ALA 166.A N LEU 163.A O no hydrogen 2.653 N/A HIS 171.A N ALA 167.A O no hydrogen 2.872 N/A ALA 172.A N ALA 168.A O no hydrogen 2.717 N/A GLU 173.A N GLU 169.A O no hydrogen 2.762 N/A LYS 175.A N GLY 174.A O no hydrogen 2.234 N/A LYS 179.A NZ ILE 218.A O no hydrogen 3.007 N/A TRP 180.A N PRO 177.A O no hydrogen 3.090 N/A TRP 180.A NE1 GLU 206.A OE2 no hydrogen 2.664 N/A MET 181.A N ILE 178.A O no hydrogen 3.016 N/A SER 185.A OG ILE 190.A O no hydrogen 2.683 N/A ILE 186.A N ALA 182.A O no hydrogen 3.076 N/A LEU 187.A N LEU 183.A O no hydrogen 3.014 N/A HIS 188.A N GLU 184.A O no hydrogen 2.831 N/A ARG 189.A N SER 185.A O no hydrogen 2.776 N/A ILE 190.A N GLU 184.A O no hydrogen 3.474 N/A THR 192.A N SER 195.A OG no hydrogen 2.812 N/A GLN 194.A NE2 ALA 255.A O no hydrogen 3.486 N/A GLN 194.A NE2 PRO 259.A O no hydrogen 3.328 N/A SER 195.A N THR 192.A OG1 no hydrogen 3.180 N/A SER 195.A OG THR 192.A O no hydrogen 2.921 N/A ASP 196.A N THR 192.A O no hydrogen 2.841 N/A VAL 197.A N HIS 193.A O no hydrogen 2.873 N/A TRP 198.A N GLN 194.A O no hydrogen 3.258 N/A SER 199.A N SER 195.A O no hydrogen 3.267 N/A SER 199.A OG TRP 180.A O no hydrogen 2.721 N/A TYR 200.A N ASP 196.A O no hydrogen 2.828 N/A TYR 200.A OH CYS 120.A O no hydrogen 2.612 N/A GLY 201.A N VAL 197.A O no hydrogen 2.945 N/A VAL 202.A N TRP 198.A O no hydrogen 3.065 N/A THR 203.A N SER 199.A O no hydrogen 2.741 N/A THR 203.A OG1 SER 199.A O no hydrogen 2.866 N/A VAL 204.A N TYR 200.A O no hydrogen 2.823 N/A TRP 205.A N GLY 201.A O no hydrogen 2.916 N/A TRP 205.A NE1 PRO 234.A O no hydrogen 2.755 N/A GLU 206.A N VAL 202.A O no hydrogen 2.895 N/A LEU 207.A N THR 203.A O no hydrogen 3.102 N/A MET 208.A N VAL 204.A O no hydrogen 2.795 N/A THR 209.A N TRP 205.A O no hydrogen 3.100 N/A THR 209.A OG1 TRP 205.A O no hydrogen 3.268 N/A THR 209.A OG1 GLU 206.A O no hydrogen 3.465 N/A PHE 210.A N LEU 207.A O no hydrogen 2.954 N/A GLY 211.A N GLU 206.A O no hydrogen 2.700 N/A SER 212.A N THR 209.A OG1 no hydrogen 2.991 N/A ILE 223.A N ALA 220.A O no hydrogen 3.109 N/A ILE 226.A N GLU 222.A O no hydrogen 3.097 N/A LEU 227.A N ILE 223.A O no hydrogen 3.007 N/A GLU 228.A N SER 224.A O no hydrogen 3.176 N/A LYS 229.A N SER 225.A O no hydrogen 3.084 N/A LYS 229.A NZ GLU 231.A OE1 no hydrogen 3.444 N/A GLY 230.A N LEU 227.A O no hydrogen 2.955 N/A GLU 231.A N ILE 226.A O no hydrogen 3.059 N/A ARG 232.A NE TRP 251.A O no hydrogen 3.009 N/A ARG 232.A NH1 LEU 227.A O no hydrogen 3.002 N/A ARG 232.A NH1 GLU 231.A O no hydrogen 2.634 N/A ARG 232.A NH2 TRP 251.A O no hydrogen 2.987 N/A CYS 239.A N PRO 236.A O no hydrogen 3.039 N/A THR 240.A N TYR 278.A O no hydrogen 3.231 N/A THR 240.A OG1 TYR 278.A O no hydrogen 2.783 N/A VAL 243.A N THR 240.A O no hydrogen 2.960 N/A TYR 244.A N THR 240.A O no hydrogen 3.146 N/A TYR 244.A OH LEU 233.A O no hydrogen 2.553 N/A MET 245.A N ILE 241.A O no hydrogen 2.871 N/A MET 247.A N VAL 243.A O no hydrogen 3.237 N/A VAL 248.A N TYR 244.A O no hydrogen 2.829 N/A LYS 249.A N MET 245.A O no hydrogen 3.046 N/A CYS 250.A N ILE 246.A O no hydrogen 3.394 N/A CYS 250.A SG ILE 246.A O no hydrogen 3.275 N/A TRP 251.A N VAL 248.A O no hydrogen 3.096 N/A MET 252.A N LYS 249.A O no hydrogen 3.404 N/A SER 257.A N ASP 254.A OD2 no hydrogen 3.254 N/A SER 257.A OG ASP 254.A OD2 no hydrogen 2.770 N/A ARG 258.A N ALA 255.A O no hydrogen 3.127 N/A ARG 258.A NE MET 252.A O no hydrogen 2.976 N/A ARG 258.A NH1 GLU 184.A OE1 no hydrogen 3.290 N/A ARG 258.A NH1 GLU 184.A OE2 no hydrogen 3.048 N/A ARG 258.A NH1 GLN 194.A O no hydrogen 2.891 N/A ARG 258.A NH2 GLU 184.A OE2 no hydrogen 2.505 N/A ARG 258.A NH2 MET 252.A O no hydrogen 3.064 N/A LYS 260.A N GLU 263.A OE1 no hydrogen 3.343 N/A LEU 264.A N LYS 260.A O no hydrogen 3.072 N/A ILE 265.A N PHE 261.A O no hydrogen 3.093 N/A ILE 266.A N ARG 262.A O no hydrogen 3.354 N/A GLU 267.A N GLU 263.A O no hydrogen 2.884 N/A PHE 268.A N LEU 264.A O no hydrogen 2.954 N/A SER 269.A N ILE 265.A O no hydrogen 2.832 N/A SER 269.A OG ILE 265.A O no hydrogen 2.610 N/A LYS 270.A N ILE 266.A O no hydrogen 2.913 N/A MET 271.A N GLU 267.A O no hydrogen 3.115 N/A ALA 272.A N PHE 268.A O no hydrogen 2.912 N/A ARG 273.A N SER 269.A O no hydrogen 3.250 N/A ASP 274.A N MET 271.A O no hydrogen 3.111 N/A ARG 277.A N ASP 274.A O no hydrogen 3.170 N/A TYR 278.A N PRO 275.A O no hydrogen 3.060 N/A LEU 279.A N PRO 275.A O no hydrogen 3.142 N/A VAL 280.A N ILE 238.A O no hydrogen 2.920 N/A ASP 284.A N ILE 281.A O no hydrogen 3.306 N/A