Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xyq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A N SER 2.A O no hydrogen 3.267 N/A GLN 6.A N GLN 3.A O no hydrogen 3.080 N/A GLN 6.A NE2.A GLY 8.A O no hydrogen 2.900 N/A VAL 9.A N VAL 191.A O no hydrogen 2.791 N/A MET 11.A N ALA 189.A O no hydrogen 2.889 N/A TYR 15.A N PRO 12.A O no hydrogen 2.936 N/A LYS 16.A N PRO 12.A O no hydrogen 3.246 N/A LYS 16.A NZ ASN 13.A OD1.B no hydrogen 3.444 N/A LYS 16.A NZ TRP 187.A O no hydrogen 2.664 N/A MET 17.A N ASN 13.A O no hydrogen 3.047 N/A GLN 18.A N TYR 15.A O no hydrogen 3.415 N/A GLN 18.A NE2 LEU 14.A O no hydrogen 2.909 N/A MET 20.A N ASN 224.A OD1 no hydrogen 2.976 N/A CYS 25.A N GLU 170.A OE2 no hydrogen 2.781 N/A CYS 25.A SG ASN 230.A OD1 no hydrogen 3.604 N/A ASP 26.A N ASN 230.A OD1 no hydrogen 2.908 N/A ASN 33.A ND2 VAL 194.A O no hydrogen 2.695 N/A VAL 35.A N ASN 33.A OD1 no hydrogen 3.067 N/A ILE 40.A N PRO 37.A O no hydrogen 3.164 N/A ALA 45.A N MET 41.A O no hydrogen 3.086 N/A LYS 46.A N MET 42.A O no hydrogen 2.770 N/A LYS 46.A NZ ASN 43.A OD1 no hydrogen 3.409 N/A LYS 46.A NZ GLU 200.A OE1 no hydrogen 3.303 N/A LYS 46.A NZ GLU 200.A OE2 no hydrogen 2.608 N/A TYR 47.A N ASN 43.A O no hydrogen 2.998 N/A TYR 47.A OH HIS 69.A NE2 no hydrogen 2.628 N/A THR 48.A N VAL 44.A O no hydrogen 2.936 N/A THR 48.A OG1 VAL 44.A O no hydrogen 2.715 N/A GLN 49.A N ALA 45.A O no hydrogen 3.082 N/A GLN 49.A NE2 SER 237.A O no hydrogen 3.401 N/A GLN 49.A NE2 SER 240.A OG no hydrogen 3.068 N/A LEU 50.A N LYS 46.A O no hydrogen 2.951 N/A CYS 51.A N TYR 47.A O no hydrogen 2.930 N/A CYS 51.A SG TYR 47.A O no hydrogen 3.324 N/A GLN 52.A N THR 48.A O no hydrogen 2.931 N/A GLN 52.A NE2 SER 240.A O no hydrogen 2.934 N/A TYR 53.A N GLN 49.A O no hydrogen 2.956 N/A LEU 54.A N LEU 50.A O no hydrogen 2.829 N/A ASN 55.A N CYS 51.A O no hydrogen 2.895 N/A ASN 55.A ND2 PHE 247.A O no hydrogen 2.806 N/A THR 56.A N TYR 53.A O no hydrogen 2.997 N/A THR 56.A OG1 TYR 53.A O no hydrogen 2.647 N/A LEU 57.A N LEU 54.A O no hydrogen 3.146 N/A VAL 61.A N THR 254.A OG1 no hydrogen 2.844 N/A ARG 66.A N ASP 125.A OD2 no hydrogen 2.798 N/A ARG 66.A NH1 LYS 123.A O no hydrogen 3.072 N/A VAL 67.A N LEU 94.A O no hydrogen 2.836 N/A ILE 68.A N LEU 126.A O no hydrogen 3.096 N/A HIS 69.A N VAL 96.A O no hydrogen 2.776 N/A HIS 69.A ND1 THR 82.A OG1 no hydrogen 2.848 N/A HIS 69.A NE2 TYR 47.A OH no hydrogen 2.628 N/A PHE 70.A N ILE 128.A O no hydrogen 2.775 N/A ALA 72.A N SER 98.A O no hydrogen 2.858 N/A GLY 73.A N ASP 99.A OD1 no hydrogen 3.004 N/A SER 74.A N VAL 78.A O no hydrogen 3.227 N/A SER 74.A OG VAL 78.A O no hydrogen 2.989 N/A GLY 77.A N SER 74.A O no hydrogen 3.086 N/A THR 82.A OG1 HIS 69.A ND1 no hydrogen 2.848 N/A THR 82.A OG1 ASP 97.A OD2 no hydrogen 2.725 N/A ALA 83.A N ALA 79.A O no hydrogen 3.055 N/A VAL 84.A N PRO 80.A O no hydrogen 3.107 N/A LEU 85.A N GLY 81.A O no hydrogen 2.954 N/A ARG 86.A N THR 82.A O no hydrogen 2.833 N/A ARG 86.A NE.B ASP 106.A O no hydrogen 3.187 N/A ARG 86.A NH1.A THR 93.A O no hydrogen 3.023 N/A ARG 86.A NH1.B THR 93.A O no hydrogen 3.501 N/A ARG 86.A NH1.B ASP 108.A OD2 no hydrogen 3.485 N/A ARG 86.A NH2.A THR 93.A O no hydrogen 3.196 N/A ARG 86.A NH2.B ASP 106.A O no hydrogen 2.929 N/A ARG 86.A NH2.B ASP 108.A OD1 no hydrogen 2.812 N/A GLN 87.A N ALA 83.A O no hydrogen 3.078 N/A TRP 88.A N VAL 84.A O no hydrogen 2.842 N/A TRP 88.A NE1 ASN 55.A OD1 no hydrogen 2.790 N/A LEU 89.A N LEU 85.A O no hydrogen 2.831 N/A THR 93.A N PRO 90.A O no hydrogen 3.082 N/A THR 93.A OG1 PRO 90.A O no hydrogen 2.673 N/A LEU 94.A N MET 65.A O no hydrogen 2.930 N/A LEU 95.A N ASP 108.A OD2 no hydrogen 2.895 N/A VAL 96.A N VAL 67.A O no hydrogen 2.991 N/A ASP 97.A N SER 109.A O no hydrogen 2.941 N/A SER 98.A N HIS 69.A O no hydrogen 2.893 N/A SER 98.A OG LEU 111.A O no hydrogen 3.124 N/A ASP 99.A N LEU 111.A O no hydrogen 3.238 N/A ASN 101.A N ASP 99.A OD2 no hydrogen 3.056 N/A VAL 104.A N GLY 77.A O no hydrogen 2.779 N/A SER 105.A OG ASP 97.A OD1 no hydrogen 3.403 N/A SER 105.A OG ASP 97.A OD2 no hydrogen 2.463 N/A ALA 107.A N SER 105.A OG no hydrogen 3.035 N/A ASP 108.A N LEU 95.A O no hydrogen 2.869 N/A THR 110.A OG1 ASP 97.A OD1 no hydrogen 2.768 N/A LEU 111.A N ASP 97.A O no hydrogen 2.855 N/A GLY 113.A N ASP 99.A O no hydrogen 2.873 N/A ALA 116.A N ASP 114.A OD1 no hydrogen 3.020 N/A THR 117.A N ASP 114.A O no hydrogen 2.944 N/A THR 117.A OG1 ASP 114.A O no hydrogen 2.560 N/A VAL 118.A N CYS 115.A O no hydrogen 2.893 N/A THR 120.A OG1 ASN 122.A OD1 no hydrogen 3.365 N/A THR 120.A OG1 VAL 286.A O no hydrogen 3.231 N/A ASN 122.A N THR 120.A OG1 no hydrogen 3.265 N/A ASN 122.A ND2 ARG 284.A O no hydrogen 2.806 N/A TRP 124.A N LYS 157.A O no hydrogen 2.744 N/A ASP 125.A N ARG 66.A O no hydrogen 2.899 N/A LEU 126.A N ARG 66.A O no hydrogen 3.283 N/A ILE 127.A N SER 163.A O no hydrogen 3.057 N/A ILE 128.A N ILE 68.A O no hydrogen 2.995 N/A SER 129.A N ALA 165.A O no hydrogen 2.922 N/A ASP 130.A N PHE 70.A O no hydrogen 2.908 N/A MET 131.A N SER 129.A OG no hydrogen 3.246 N/A ARG 135.A N ASP 133.A OD1 no hydrogen 3.366 N/A ASN 140.A ND2 GLU 170.A O no hydrogen 3.052 N/A SER 142.A N TYR 219.A OH no hydrogen 2.896 N/A LYS 143.A N TRP 173.A O no hydrogen 2.912 N/A LYS 143.A NZ ASP 141.A O no hydrogen 2.905 N/A LYS 143.A NZ HIS 171.A O no hydrogen 2.844 N/A PHE 147.A N GLU 144.A O no hydrogen 3.149 N/A THR 148.A N GLY 145.A O no hydrogen 3.177 N/A TYR 149.A OH VAL 118.A O no hydrogen 2.887 N/A LEU 150.A N PHE 146.A O no hydrogen 2.890 N/A CYS 151.A N PHE 147.A O no hydrogen 2.970 N/A CYS 151.A SG PHE 147.A O no hydrogen 3.435 N/A CYS 151.A SG ASN 174.A OD1 no hydrogen 3.791 N/A GLY 152.A N THR 148.A O no hydrogen 3.306 N/A PHE 153.A N TYR 149.A O no hydrogen 2.780 N/A ILE 154.A N LEU 150.A O no hydrogen 2.872 N/A LYS 155.A N CYS 151.A O no hydrogen 3.030 N/A GLN 156.A N GLY 152.A O no hydrogen 2.894 N/A LYS 157.A N PHE 153.A O no hydrogen 2.693 N/A LYS 157.A NZ THR 120.A O no hydrogen 3.226 N/A LEU 158.A N ILE 154.A O no hydrogen 3.231 N/A ALA 159.A N TRP 124.A O no hydrogen 2.899 N/A GLY 161.A N TYR 208.A O no hydrogen 2.744 N/A GLY 162.A N ALA 159.A O no hydrogen 2.761 N/A SER 163.A N ASP 125.A O no hydrogen 3.054 N/A ILE 164.A N GLY 205.A O no hydrogen 2.893 N/A ALA 165.A N ILE 127.A O no hydrogen 2.926 N/A VAL 166.A N LEU 203.A O no hydrogen 2.826 N/A LYS 167.A N SER 129.A O no hydrogen 2.900 N/A LYS 167.A NZ ASP 130.A OD1 no hydrogen 2.870 N/A LYS 167.A NZ GLU 200.A OE2 no hydrogen 3.018 N/A ILE 168.A N ALA 201.A O no hydrogen 2.818 N/A THR 169.A N SER 172.A O no hydrogen 2.854 N/A GLU 170.A N SER 199.A OG no hydrogen 3.067 N/A SER 172.A N THR 169.A OG1 no hydrogen 2.945 N/A TRP 173.A NE1 ASN 140.A OD1 no hydrogen 2.929 N/A ASN 174.A ND2 LYS 143.A O no hydrogen 2.753 N/A ALA 175.A N SER 142.A OG no hydrogen 2.749 N/A LEU 177.A N ASN 174.A OD1 no hydrogen 2.870 N/A TYR 178.A N ASN 174.A O no hydrogen 3.294 N/A TYR 178.A OH HIS 222.A ND1 no hydrogen 2.780 N/A LYS 179.A N ALA 175.A O no hydrogen 3.072 N/A LEU 180.A N ASP 176.A O no hydrogen 2.923 N/A MET 181.A N LEU 177.A O no hydrogen 3.159 N/A MET 181.A N TYR 178.A O no hydrogen 3.058 N/A GLY 182.A N LYS 179.A O no hydrogen 3.045 N/A HIS 183.A N LEU 180.A O no hydrogen 2.887 N/A PHE 184.A N MET 181.A O no hydrogen 3.372 N/A SER 185.A N ASN 207.A O no hydrogen 2.837 N/A SER 185.A OG GLU 273.A O no hydrogen 2.957 N/A TRP 186.A N ALA 206.A O no hydrogen 3.248 N/A THR 188.A N ILE 204.A O no hydrogen 2.998 N/A THR 188.A OG1 ALA 189.A O no hydrogen 3.565 N/A PHE 190.A N PHE 202.A O no hydrogen 2.806 N/A VAL 191.A N VAL 9.A O no hydrogen 2.900 N/A ASN 193.A N PRO 7.A O no hydrogen 2.979 N/A ASN 193.A ND2 GLN 3.A O no hydrogen 3.113 N/A ASN 193.A ND2 GLN 6.A O no hydrogen 2.754 N/A VAL 194.A N GLN 49.A OE1 no hydrogen 2.815 N/A ASN 195.A N THR 192.A O no hydrogen 3.281 N/A ASN 195.A ND2 GLU 200.A OE1 no hydrogen 2.892 N/A SER 198.A N ASN 195.A O no hydrogen 3.066 N/A SER 199.A N ASN 29.A OD1 no hydrogen 3.116 N/A SER 199.A OG ASN 29.A OD1 no hydrogen 2.895 N/A GLU 200.A N SER 198.A OG no hydrogen 3.083 N/A ALA 201.A N ILE 168.A O no hydrogen 2.886 N/A PHE 202.A N PHE 190.A O no hydrogen 2.797 N/A LEU 203.A N VAL 166.A O no hydrogen 2.758 N/A ILE 204.A N THR 188.A O no hydrogen 2.883 N/A GLY 205.A N ILE 164.A O no hydrogen 2.947 N/A ALA 206.A N TRP 186.A O no hydrogen 2.789 N/A ASN 207.A N SER 163.A OG no hydrogen 3.087 N/A ASN 207.A ND2 THR 58.A O no hydrogen 3.150 N/A ASN 207.A ND2 THR 58.A OG1 no hydrogen 2.770 N/A TYR 208.A N GLY 162.A O no hydrogen 2.759 N/A LEU 209.A N HIS 183.A O no hydrogen 2.892 N/A LYS 213.A N GLY 182.A O no hydrogen 2.714 N/A LYS 213.A NZ SER 185.A O no hydrogen 2.734 N/A GLU 214.A N GLY 182.A O no hydrogen 3.291 N/A THR 220.A N ASP 217.A OD1 no hydrogen 3.148 N/A MET 221.A N ASP 217.A O no hydrogen 2.923 N/A HIS 222.A N GLY 218.A O no hydrogen 3.043 N/A HIS 222.A ND1 TYR 178.A OH no hydrogen 2.780 N/A HIS 222.A NE2 GLU 170.A O no hydrogen 2.777 N/A ALA 223.A N TYR 219.A O no hydrogen 3.182 N/A ASN 224.A N THR 220.A O no hydrogen 2.919 N/A ASN 224.A ND2 GLN 18.A O no hydrogen 2.747 N/A TYR 225.A N MET 221.A O no hydrogen 2.853 N/A TYR 225.A OH SER 199.A O no hydrogen 2.509 N/A ILE 226.A N HIS 222.A O no hydrogen 2.899 N/A PHE 227.A N ALA 223.A O no hydrogen 2.938 N/A TRP 228.A N ASN 224.A O no hydrogen 3.030 N/A ARG 229.A N TYR 225.A O no hydrogen 3.049 N/A ARG 229.A NH1.B SER 198.A O no hydrogen 2.890 N/A ARG 229.A NH1.B TYR 225.A OH no hydrogen 3.107 N/A ARG 229.A NH2.A ALA 196.A O no hydrogen 2.791 N/A ARG 229.A NH2.A SER 198.A O no hydrogen 2.389 N/A ARG 229.A NH2.B SER 198.A O no hydrogen 3.077 N/A ASN 230.A N ILE 226.A O no hydrogen 2.849 N/A ASN 230.A ND2 GLU 23.A OE1 no hydrogen 3.471 N/A ASN 230.A ND2 LYS 24.A O no hydrogen 2.976 N/A THR 231.A N PHE 227.A O no hydrogen 3.079 N/A THR 231.A N TRP 228.A O no hydrogen 3.354 N/A THR 231.A OG1 PHE 227.A O no hydrogen 2.706 N/A ASN 232.A N TRP 228.A O no hydrogen 2.992 N/A ASN 232.A ND2 TYR 15.A OH no hydrogen 2.801 N/A ASN 232.A ND2 TRP 228.A O no hydrogen 3.310 N/A SER 237.A N ASN 193.A O no hydrogen 2.951 N/A SER 237.A OG ALA 4.A O no hydrogen 2.545 N/A SER 238.A OG VAL 35.A O no hydrogen 2.758 N/A TYR 239.A N SER 237.A OG no hydrogen 3.238 N/A SER 240.A OG GLN 52.A OE1 no hydrogen 2.677 N/A LEU 241.A N SER 238.A O no hydrogen 2.990 N/A PHE 242.A N TYR 239.A O no hydrogen 3.212 N/A SER 245.A N ASP 243.A OD1 no hydrogen 3.119 N/A SER 245.A OG ASP 243.A OD1 no hydrogen 2.712 N/A LYS 246.A NZ SER 245.A OG no hydrogen 3.289 N/A PHE 247.A N MET 244.A O no hydrogen 3.255 N/A LEU 249.A N TRP 88.A O no hydrogen 2.856 N/A ARG 252.A NE LEU 59.A O no hydrogen 2.835 N/A ARG 252.A NH2 LEU 57.A O no hydrogen 3.463 N/A THR 254.A N VAL 61.A O no hydrogen 2.929 N/A MET 257.A N ILE 278.A O no hydrogen 2.881 N/A SER 258.A OG GLU 281.A OE2 no hydrogen 3.025 N/A LYS 260.A N GLN 263.A OE1 no hydrogen 2.818 N/A GLN 263.A N LYS 260.A O no hydrogen 2.911 N/A ILE 264.A N GLU 261.A O no hydrogen 3.273 N/A ILE 268.A N ASN 265.A OD1 no hydrogen 3.235 N/A TYR 269.A N ASN 265.A O no hydrogen 2.962 N/A SER 270.A N ASP 266.A O no hydrogen 3.008 N/A LEU 271.A N MET 267.A O no hydrogen 3.084 N/A LEU 272.A N ILE 268.A O no hydrogen 2.893 N/A GLU 273.A N TYR 269.A O no hydrogen 2.796 N/A LYS 274.A N SER 270.A O no hydrogen 3.182 N/A LYS 274.A N LEU 271.A O no hydrogen 3.274 N/A GLY 275.A N LEU 272.A O no hydrogen 3.220 N/A ARG 276.A N LEU 271.A O no hydrogen 2.956 N/A ILE 278.A N ALA 255.A O no hydrogen 2.898 N/A ILE 279.A N LEU 160.A O no hydrogen 2.986 N/A ARG 280.A N MET 257.A O no hydrogen 3.024 N/A ARG 280.A NE ASP 125.A OD1 no hydrogen 2.749 N/A ARG 280.A NH1 GLU 281.A O no hydrogen 3.073 N/A ARG 280.A NH2 ASN 64.A O no hydrogen 3.166 N/A ARG 280.A NH2 ASP 125.A OD1 no hydrogen 3.501 N/A ARG 280.A NH2 ASP 125.A OD2 no hydrogen 2.990 N/A VAL 286.A N ASN 122.A OD1 no hydrogen 3.100 N/A