Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6s5q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N HIS 299.A O no hydrogen 3.092 N/A GLU 6.A N ILE 297.A O no hydrogen 2.779 N/A ILE 8.A N VAL 295.A O no hydrogen 2.758 N/A ALA 10.A N GLU 293.A O no hydrogen 3.056 N/A GLY 14.A N HIS 292.A O no hydrogen 3.025 N/A ASN 16.A N SER 29.A O no hydrogen 3.359 N/A ASN 16.A ND2 TYR 76.A O no hydrogen 2.611 N/A TYR 18.A OH VAL 287.A O no hydrogen 2.696 N/A ALA 19.A N TYR 27.A O no hydrogen 3.031 N/A ASP 21.A N GLU 25.A O no hydrogen 3.400 N/A GLY 24.A N ASP 21.A O no hydrogen 2.858 N/A GLU 25.A N ASP 21.A OD1 no hydrogen 2.845 N/A TYR 27.A N ALA 19.A O no hydrogen 2.759 N/A TYR 27.A OH ASP 21.A OD2 no hydrogen 3.022 N/A ALA 28.A N ILE 36.A O no hydrogen 3.164 N/A SER 29.A N ALA 17.A O no hydrogen 3.155 N/A SER 29.A OG ASN 16.A OD1 no hydrogen 2.606 N/A VAL 30.A N ARG 34.A O no hydrogen 3.093 N/A GLU 31.A N TYR 13.A O no hydrogen 2.789 N/A GLY 33.A N VAL 30.A O no hydrogen 3.371 N/A ARG 34.A N ASP 32.A OD1 no hydrogen 3.133 N/A ARG 34.A NE ASP 32.A OD1 no hydrogen 2.972 N/A ARG 34.A NE ASP 32.A OD2 no hydrogen 2.815 N/A ARG 34.A NH2 ASP 32.A OD2 no hydrogen 2.567 N/A ILE 35.A N ALA 49.A O no hydrogen 2.814 N/A ILE 36.A N ALA 28.A O no hydrogen 2.830 N/A LYS 37.A N LEU 46.A O no hydrogen 2.702 N/A LYS 37.A NZ TYR 27.A OH no hydrogen 3.379 N/A TYR 38.A N LEU 26.A O no hydrogen 3.254 N/A TYR 38.A OH ASN 43.A OD1 no hydrogen 3.074 N/A ASP 39.A N LYS 44.A O no hydrogen 3.091 N/A ASN 43.A N LYS 40.A O no hydrogen 3.018 N/A LYS 44.A N ASP 39.A O no hydrogen 3.413 N/A LEU 46.A N LYS 37.A O no hydrogen 2.663 N/A HIS 48.A N ILE 35.A O no hydrogen 2.909 N/A ALA 49.A N ILE 35.A O no hydrogen 3.086 N/A VAL 50.A N GLY 104.A O no hydrogen 3.180 N/A SER 52.A OG LEU 71.A O no hydrogen 2.443 N/A ILE 54.A N SER 52.A OG no hydrogen 3.224 N/A TRP 55.A NE1 ASP 32.A O no hydrogen 3.110 N/A LEU 59.A N ASN 56.A OD1 no hydrogen 3.043 N/A CYS 60.A N ASN 56.A O no hydrogen 3.042 N/A GLU 61.A N ASN 57.A O no hydrogen 3.215 N/A ASN 62.A N ASP 32.A OD2 no hydrogen 2.780 N/A ASN 62.A ND2 ASP 32.A OD2 no hydrogen 3.479 N/A ASN 63.A N CYS 60.A O no hydrogen 2.791 N/A ASN 63.A ND2 CYS 60.A O no hydrogen 3.011 N/A ASN 65.A N ASN 63.A OD1 no hydrogen 2.770 N/A LEU 68.A N ASN 65.A O no hydrogen 2.926 N/A LYS 69.A N GLN 66.A O no hydrogen 3.054 N/A LYS 69.A NZ GLU 31.A OE2 no hydrogen 2.980 N/A LYS 69.A NZ GLN 66.A OE1 no hydrogen 2.430 N/A LYS 69.A NZ ASP 144.A OD1 no hydrogen 3.372 N/A LYS 69.A NZ ASP 144.A OD2 no hydrogen 2.874 N/A LEU 71.A N LEU 68.A O no hydrogen 2.815 N/A CYS 72.A N LEU 68.A O no hydrogen 2.907 N/A CYS 72.A SG LEU 68.A O no hydrogen 3.947 N/A GLY 73.A N LYS 69.A O no hydrogen 2.686 N/A ARG 74.A N ASP 91.A OD2 no hydrogen 2.646 N/A ARG 74.A NE GLU 31.A OE1 no hydrogen 2.706 N/A ARG 74.A NH1 ASN 16.A OD1 no hydrogen 2.918 N/A ARG 74.A NH1 VAL 75.A O no hydrogen 2.893 N/A ARG 74.A NH2 GLY 14.A O no hydrogen 2.699 N/A ARG 74.A NH2 GLU 31.A OE1 no hydrogen 3.112 N/A TYR 76.A N ALA 90.A O no hydrogen 2.894 N/A TYR 76.A OH ASP 144.A OD2 no hydrogen 2.667 N/A ASP 77.A N ALA 90.A O no hydrogen 3.520 N/A PHE 78.A N ASP 77.A OD1 no hydrogen 2.818 N/A GLY 79.A N TYR 88.A O no hydrogen 3.120 N/A HIS 81.A N ARG 86.A O no hydrogen 2.779 N/A TYR 82.A N GLN 128.A OE1 no hydrogen 3.279 N/A TYR 82.A OH PHE 20.A O no hydrogen 2.623 N/A GLN 85.A N TYR 82.A O no hydrogen 2.514 N/A ARG 86.A N HIS 81.A O no hydrogen 3.111 N/A LEU 87.A N VAL 99.A O no hydrogen 2.798 N/A TYR 88.A N GLY 79.A O no hydrogen 2.833 N/A ILE 89.A N GLY 97.A O no hydrogen 3.157 N/A ALA 90.A N ASP 77.A O no hydrogen 2.949 N/A ASP 91.A N GLY 95.A O no hydrogen 3.074 N/A CYS 92.A N ARG 74.A O no hydrogen 3.006 N/A CYS 92.A SG LYS 119.A O no hydrogen 3.911 N/A TYR 93.A N ASP 91.A OD1 no hydrogen 2.626 N/A TYR 93.A OH ASP 144.A OD1 no hydrogen 2.783 N/A PHE 94.A N ASP 91.A OD1 no hydrogen 2.822 N/A GLY 95.A N ASP 91.A O no hydrogen 3.075 N/A LEU 96.A N ALA 110.A O no hydrogen 3.060 N/A GLY 97.A N ILE 89.A O no hydrogen 3.121 N/A PHE 98.A N ILE 107.A O no hydrogen 2.939 N/A VAL 99.A N LEU 87.A O no hydrogen 3.099 N/A GLY 103.A N GLY 100.A O no hydrogen 2.692 N/A GLY 104.A N HIS 48.A O no hydrogen 2.950 N/A HIS 105.A ND1 SER 52.A O no hydrogen 2.671 N/A ALA 106.A N VAL 50.A O no hydrogen 2.808 N/A GLN 108.A NE2 PHE 94.A O no hydrogen 2.943 N/A LEU 109.A N LEU 96.A O no hydrogen 2.734 N/A GLY 113.A N VAL 116.A O no hydrogen 3.053 N/A VAL 116.A N GLY 113.A O no hydrogen 2.751 N/A PHE 118.A N THR 111.A O no hydrogen 2.566 N/A TRP 120.A N ASP 137.A OD1 no hydrogen 2.763 N/A TYR 122.A N THR 136.A O no hydrogen 2.618 N/A TYR 122.A OH GLU 276.A OE1 no hydrogen 2.507 N/A LEU 124.A N ASP 77.A OD2 no hydrogen 2.832 N/A ALA 125.A N TYR 134.A O no hydrogen 2.858 N/A ASP 127.A N PHE 132.A O no hydrogen 3.001 N/A GLN 128.A NE2 PHE 80.A O no hydrogen 3.248 N/A ALA 130.A N ASP 127.A OD1 no hydrogen 3.027 N/A VAL 133.A N TYR 163.A O no hydrogen 2.965 N/A TYR 134.A N ALA 125.A O no hydrogen 2.756 N/A VAL 135.A N ILE 161.A O no hydrogen 3.009 N/A THR 136.A N ALA 123.A O no hydrogen 2.982 N/A ASP 137.A N ARG 159.A O no hydrogen 3.011 N/A VAL 138.A N TRP 120.A O no hydrogen 2.786 N/A SER 139.A OG ASP 155.A OD2 no hydrogen 2.513 N/A THR 140.A N THR 157.A OG1 no hydrogen 3.137 N/A TYR 142.A N SER 139.A OG no hydrogen 3.133 N/A ARG 145.A N ASP 143.A OD1 no hydrogen 3.092 N/A ARG 145.A NE GLN 66.A O no hydrogen 3.095 N/A ARG 145.A NH1 ASP 143.A OD2 no hydrogen 3.087 N/A ARG 145.A NH2 GLN 66.A O no hydrogen 3.159 N/A GLY 146.A N ASP 143.A O no hydrogen 2.696 N/A ILE 150.A N GLY 146.A O no hydrogen 2.818 N/A ILE 151.A N VAL 147.A O no hydrogen 3.093 N/A ARG 152.A N GLN 148.A O no hydrogen 2.751 N/A ARG 152.A NH2 TYR 142.A OH no hydrogen 3.422 N/A ILE 153.A N ASP 149.A O no hydrogen 2.886 N/A ASN 154.A N ILE 151.A O no hydrogen 3.185 N/A ASP 155.A N ILE 150.A O no hydrogen 2.925 N/A THR 157.A N ASP 155.A OD1 no hydrogen 2.814 N/A THR 157.A OG1 THR 140.A OG1 no hydrogen 3.365 N/A THR 157.A OG1 ASP 155.A OD1 no hydrogen 2.447 N/A THR 157.A OG1 ASP 155.A OD2 no hydrogen 3.337 N/A GLY 158.A N LEU 177.A O no hydrogen 2.934 N/A ARG 159.A N ASP 137.A O no hydrogen 2.985 N/A ARG 159.A NH1 GLY 113.A O no hydrogen 3.213 N/A ARG 159.A NH1 VAL 116.A O no hydrogen 3.424 N/A ARG 159.A NH2 VAL 116.A O no hydrogen 3.401 N/A ARG 159.A NH2 ASP 137.A OD2 no hydrogen 2.991 N/A LEU 160.A N MET 174.A O no hydrogen 2.985 N/A ILE 161.A N VAL 135.A O no hydrogen 2.814 N/A LYS 162.A N THR 171.A O no hydrogen 2.783 N/A LYS 162.A NZ TYR 134.A OH no hydrogen 3.372 N/A TYR 163.A N VAL 133.A O no hydrogen 2.963 N/A ASP 164.A N GLU 169.A O no hydrogen 2.855 N/A SER 166.A N ASP 164.A OD1 no hydrogen 3.279 N/A SER 166.A OG ASP 164.A OD1 no hydrogen 2.948 N/A THR 167.A N ASP 164.A O no hydrogen 3.291 N/A GLU 169.A N THR 167.A OG1 no hydrogen 3.142 N/A THR 171.A N LYS 162.A O no hydrogen 2.802 N/A LEU 173.A N LEU 160.A O no hydrogen 2.796 N/A MET 174.A N LEU 160.A O no hydrogen 3.333 N/A LEU 177.A N GLY 158.A O no hydrogen 3.013 N/A ASN 178.A N GLU 196.A OE1 no hydrogen 2.824 N/A ASN 178.A ND2 SER 199.A OG no hydrogen 2.350 N/A THR 183.A OG1 LEU 193.A O no hydrogen 2.749 N/A GLU 184.A N LEU 193.A O no hydrogen 3.290 N/A VAL 185.A N GLU 184.A OE2 no hydrogen 2.952 N/A SER 186.A N PHE 191.A O no hydrogen 3.027 N/A SER 186.A OG ASP 188.A OD1 no hydrogen 2.762 N/A SER 186.A OG PHE 191.A O no hydrogen 3.063 N/A GLY 189.A N SER 186.A O no hydrogen 2.894 N/A SER 190.A N ASP 188.A OD1 no hydrogen 3.000 N/A SER 190.A OG ASP 188.A OD1 no hydrogen 2.847 N/A SER 190.A OG ASP 188.A OD2 no hydrogen 3.202 N/A PHE 191.A N SER 186.A OG no hydrogen 3.076 N/A VAL 192.A N TYR 205.A O no hydrogen 2.874 N/A LEU 193.A N GLU 184.A O no hydrogen 2.835 N/A VAL 194.A N LEU 203.A O no hydrogen 3.017 N/A GLY 195.A N GLY 182.A O no hydrogen 2.880 N/A GLU 196.A N ARG 201.A O no hydrogen 3.084 N/A PHE 197.A N ILE 179.A O no hydrogen 3.014 N/A SER 199.A N GLU 196.A O no hydrogen 3.259 N/A ARG 201.A NE GLU 196.A OE2 no hydrogen 2.930 N/A ARG 201.A NH2 GLU 196.A OE1 no hydrogen 3.520 N/A ARG 201.A NH2 GLU 196.A OE2 no hydrogen 2.967 N/A ILE 202.A N LEU 219.A O no hydrogen 2.985 N/A LEU 203.A N VAL 194.A O no hydrogen 2.892 N/A LYS 204.A N GLU 216.A O no hydrogen 2.787 N/A LYS 204.A NZ GLU 256.A O no hydrogen 2.606 N/A TYR 205.A N VAL 192.A O no hydrogen 2.698 N/A TRP 206.A N THR 214.A O no hydrogen 2.888 N/A TRP 206.A NE1 GLU 216.A OE2 no hydrogen 3.123 N/A LEU 207.A N SER 190.A O no hydrogen 2.938 N/A LYS 208.A N SER 190.A O no hydrogen 3.268 N/A ALA 212.A N GLY 209.A O no hydrogen 3.054 N/A ASN 213.A N TRP 206.A O no hydrogen 2.766 N/A ASN 213.A ND2 TYR 205.A OH no hydrogen 2.948 N/A GLU 216.A N LYS 204.A O no hydrogen 2.752 N/A LEU 218.A N ILE 202.A O no hydrogen 2.861 N/A VAL 221.A N HIS 200.A O no hydrogen 3.008 N/A ARG 222.A NE ASP 241.A OD1 no hydrogen 3.045 N/A ARG 222.A NH2 ASN 242.A O no hydrogen 2.954 N/A GLY 225.A N ALA 238.A O no hydrogen 2.808 N/A ASN 226.A N GLU 276.A O no hydrogen 2.920 N/A ASN 226.A ND2 GLN 277.A OE1 no hydrogen 3.123 N/A LYS 228.A N TRP 236.A O no hydrogen 2.911 N/A ARG 229.A N GLU 184.A OE1 no hydrogen 2.669 N/A ARG 229.A NH1 VAL 185.A O no hydrogen 2.715 N/A THR 230.A N ASP 234.A O no hydrogen 2.981 N/A THR 230.A OG1 ASP 234.A O no hydrogen 3.475 N/A THR 230.A OG1 ASP 234.A OD1 no hydrogen 2.548 N/A ASP 232.A N THR 230.A OG1 no hydrogen 3.154 N/A GLY 233.A N THR 230.A O no hydrogen 3.179 N/A PHE 235.A N PHE 254.A O no hydrogen 2.940 N/A TRP 236.A N LYS 228.A O no hydrogen 3.049 N/A TRP 236.A NE1 GLU 280.A OE1 no hydrogen 3.254 N/A VAL 237.A N ILE 252.A O no hydrogen 2.888 N/A ALA 238.A N ASN 226.A O no hydrogen 3.247 N/A SER 239.A N ARG 250.A O no hydrogen 2.711 N/A SER 239.A OG ARG 222.A O no hydrogen 2.469 N/A SER 240.A N GLY 223.A O no hydrogen 2.991 N/A SER 240.A OG ILE 275.A O no hydrogen 3.334 N/A ASP 241.A N THR 248.A O no hydrogen 2.932 N/A ASN 242.A ND2 THR 246.A O no hydrogen 3.420 N/A ASN 243.A N THR 246.A O no hydrogen 3.209 N/A THR 248.A N ASP 241.A O no hydrogen 2.770 N/A ARG 250.A N SER 239.A O no hydrogen 2.716 N/A ARG 250.A NH1 ASP 241.A OD2 no hydrogen 2.929 N/A GLY 251.A N VAL 264.A O no hydrogen 2.803 N/A ILE 252.A N VAL 237.A O no hydrogen 3.020 N/A ARG 253.A N GLU 262.A O no hydrogen 2.852 N/A ARG 253.A NE ASP 234.A OD2 no hydrogen 3.154 N/A ARG 253.A NH1 GLU 262.A OE2 no hydrogen 2.288 N/A PHE 254.A N PHE 235.A O no hydrogen 2.963 N/A ASP 255.A N ASN 259.A O no hydrogen 3.036 N/A PHE 257.A N ASP 255.A OD1 no hydrogen 2.799 N/A GLY 258.A N ASP 255.A O no hydrogen 2.824 N/A ASN 259.A N ASP 255.A OD1 no hydrogen 3.145 N/A LEU 261.A N ARG 253.A O no hydrogen 2.735 N/A GLU 262.A N ARG 253.A O no hydrogen 3.318 N/A VAL 264.A N GLY 251.A O no hydrogen 2.829 N/A ILE 266.A N PRO 249.A O no hydrogen 3.071 N/A TYR 270.A N PRO 267.A O no hydrogen 3.068 N/A LYS 271.A N PRO 267.A O no hydrogen 3.134 N/A GLU 273.A N TYR 270.A O no hydrogen 2.958 N/A ILE 275.A N SER 240.A OG no hydrogen 3.061 N/A GLU 276.A N GLY 288.A O no hydrogen 2.810 N/A GLN 277.A N GLY 288.A O no hydrogen 3.241 N/A GLN 279.A N PHE 286.A O no hydrogen 2.959 N/A HIS 281.A N ALA 284.A O no hydrogen 2.811 N/A ALA 284.A N HIS 281.A O no hydrogen 3.018 N/A LEU 285.A N LEU 298.A O no hydrogen 3.132 N/A PHE 286.A N GLN 279.A O no hydrogen 2.817 N/A VAL 287.A N GLY 296.A O no hydrogen 2.932 N/A GLY 288.A N GLN 277.A O no hydrogen 2.806 N/A SER 289.A N PRO 15.A O no hydrogen 3.043 N/A PHE 291.A N SER 289.A OG no hydrogen 3.186 N/A HIS 292.A NE2 GLU 273.A OE2 no hydrogen 2.615 N/A VAL 295.A N ILE 8.A O no hydrogen 2.756 N/A ILE 297.A N GLU 6.A O no hydrogen 2.758 N/A LEU 298.A N LEU 285.A O no hydrogen 2.940 N/A HIS 299.A N PHE 4.A O no hydrogen 2.717 N/A HIS 299.A NE2 GLU 6.A OE1 no hydrogen 3.166 N/A ASN 300.A ND2 PRO 2.A O no hydrogen 2.649 N/A TYR 301.A OH GLU 280.A OE1 no hydrogen 2.987 N/A LYS 302.A N GLU 3.A OE1 no hydrogen 2.849 N/A LYS 302.A NZ ASN 300.A O no hydrogen 2.980 N/A SER 303.A OG TYR 301.A O no hydrogen 3.333 N/A