Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qck_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 249.A O no hydrogen 2.772 N/A VAL 6.A N SER 247.A O no hydrogen 2.930 N/A GLN 8.A N PRO 5.A O no hydrogen 2.933 N/A PHE 9.A N VAL 6.A O no hydrogen 3.381 N/A HIS 12.A N GLN 8.A O no hydrogen 2.934 N/A ILE 13.A N PHE 9.A O no hydrogen 2.837 N/A GLY 14.A N VAL 10.A O no hydrogen 3.025 N/A GLU 15.A N LYS 11.A O no hydrogen 3.144 N/A LEU 16.A N HIS 12.A O no hydrogen 2.993 N/A TYR 17.A N ILE 13.A O no hydrogen 2.977 N/A TYR 17.A OH ASP 277.A OD1 no hydrogen 2.675 N/A SER 18.A N GLU 15.A O no hydrogen 3.251 N/A SER 18.A OG GLU 15.A O no hydrogen 2.618 N/A GLN 21.A N TYR 17.A O no hydrogen 2.848 N/A GLN 21.A NE2 TYR 17.A O no hydrogen 2.803 N/A HIS 22.A N ASN 19.A O no hydrogen 3.282 N/A PHE 24.A N LEU 16.A O no hydrogen 3.242 N/A SER 25.A N GLN 21.A O no hydrogen 3.011 N/A SER 25.A OG GLN 21.A O no hydrogen 3.276 N/A SER 25.A OG GLU 269.A OE1 no hydrogen 3.181 N/A SER 25.A OG GLU 269.A OE2 no hydrogen 2.867 N/A GLU 26.A N HIS 22.A O no hydrogen 2.983 N/A ASP 27.A N GLY 23.A O no hydrogen 3.006 N/A PHE 28.A N PHE 24.A O no hydrogen 2.967 N/A GLU 29.A N SER 25.A O no hydrogen 2.874 N/A GLU 30.A N GLU 26.A O no hydrogen 2.981 N/A VAL 31.A N ASP 27.A O no hydrogen 2.969 N/A GLN 32.A N PHE 28.A O no hydrogen 2.851 N/A ARG 33.A N GLU 29.A O no hydrogen 2.883 N/A CYS 34.A N VAL 31.A O no hydrogen 3.049 N/A CYS 34.A SG VAL 31.A O no hydrogen 2.945 N/A CYS 34.A SG LYS 256.A O no hydrogen 4.010 N/A ALA 36.A N ARG 33.A O no hydrogen 2.709 N/A MET 38.A N THR 35.A O no hydrogen 2.783 N/A THR 41.A OG1 ASP 63.A OD2 no hydrogen 2.762 N/A GLU 43.A N ASP 63.A OD2 no hydrogen 2.654 N/A HIS 44.A N ASP 63.A OD1 no hydrogen 3.284 N/A SER 45.A OG ALA 61.A O no hydrogen 3.331 N/A SER 45.A OG TYR 79.A OH no hydrogen 2.663 N/A ASN 46.A N GLU 43.A O no hydrogen 3.156 N/A ASN 46.A ND2 ALA 42.A O no hydrogen 3.122 N/A HIS 47.A N HIS 44.A O no hydrogen 3.127 N/A GLU 49.A N HIS 47.A ND1 no hydrogen 3.146 N/A ASN 50.A N HIS 47.A O no hydrogen 2.827 N/A ASN 50.A ND2 HIS 44.A O no hydrogen 2.980 N/A LYS 53.A N ASN 50.A O no hydrogen 2.772 N/A LYS 53.A NZ ASN 50.A OD1 no hydrogen 2.833 N/A ASN 54.A N LYS 51.A O no hydrogen 3.046 N/A ASN 54.A ND2 SER 45.A O no hydrogen 2.841 N/A ARG 55.A N GLN 98.A OE1 no hydrogen 2.880 N/A ARG 55.A NE GLY 99.A O no hydrogen 2.862 N/A ARG 55.A NH2 GLY 99.A O no hydrogen 3.234 N/A ARG 55.A NH2 PRO 100.A O no hydrogen 2.986 N/A TYR 56.A OH SER 224.A OG no hydrogen 2.641 N/A ILE 59.A N TYR 56.A O no hydrogen 3.121 N/A LEU 60.A N ASN 263.A OD1 no hydrogen 2.975 N/A ALA 61.A N SER 45.A OG no hydrogen 2.796 N/A ASP 63.A N THR 41.A O no hydrogen 2.836 N/A HIS 64.A NE2 THR 260.A O no hydrogen 2.871 N/A SER 65.A N TYR 62.A O no hydrogen 3.335 N/A SER 65.A OG TYR 62.A O no hydrogen 3.533 N/A SER 65.A OG GLN 261.A O no hydrogen 2.590 N/A ARG 66.A N ASP 63.A O no hydrogen 3.247 N/A ARG 66.A NH2 ASP 78.A OD2 no hydrogen 2.883 N/A VAL 67.A N ALA 82.A O no hydrogen 2.909 N/A LEU 69.A N ASP 78.A O no hydrogen 2.719 N/A ARG 70.A N GLU 114.A OE1 no hydrogen 2.987 N/A LEU 72.A N SER 77.A OG no hydrogen 2.819 N/A SER 77.A N SER 74.A O no hydrogen 3.049 N/A SER 77.A OG SER 74.A O no hydrogen 2.956 N/A TYR 79.A N HIS 76.A O no hydrogen 3.375 N/A TYR 79.A OH SER 45.A OG no hydrogen 2.663 N/A TYR 79.A OH ASN 54.A OD1 no hydrogen 2.528 N/A ASN 81.A ND2 ASN 54.A OD1 no hydrogen 3.085 N/A ASN 81.A ND2 ILE 59.A O no hydrogen 2.800 N/A ASN 83.A N ALA 96.A O no hydrogen 2.958 N/A ASN 83.A ND2 TYR 62.A O no hydrogen 2.922 N/A ASN 83.A ND2 SER 65.A OG no hydrogen 2.793 N/A TYR 84.A N SER 65.A O no hydrogen 2.929 N/A TYR 84.A OH GLN 115.A OE1 no hydrogen 2.785 N/A VAL 85.A N TYR 94.A O no hydrogen 2.806 N/A ASP 86.A N GLN 261.A OE1 no hydrogen 2.732 N/A GLY 87.A N LYS 90.A O no hydrogen 2.828 N/A TYR 88.A OH ASP 245.A OD2 no hydrogen 2.649 N/A LYS 92.A N ASP 86.A OD1 no hydrogen 3.193 N/A TYR 94.A N VAL 85.A O no hydrogen 3.045 N/A TYR 94.A OH ASP 237.A OD2 no hydrogen 2.628 N/A TYR 94.A OH SER 238.A OG no hydrogen 3.236 N/A ILE 95.A N VAL 219.A O no hydrogen 2.895 N/A ALA 96.A N ASN 83.A O no hydrogen 2.876 N/A THR 97.A N VAL 221.A O no hydrogen 3.047 N/A THR 97.A OG1 ASN 81.A O no hydrogen 2.545 N/A GLN 98.A NE2 LYS 53.A O no hydrogen 2.813 N/A GLY 99.A N SER 224.A O no hydrogen 2.853 N/A LEU 101.A N THR 104.A OG1 no hydrogen 2.941 N/A LYS 102.A N ASP 135.A OD2 no hydrogen 3.159 N/A THR 104.A N LEU 101.A O no hydrogen 2.870 N/A THR 104.A OG1 LEU 101.A O no hydrogen 3.208 N/A PHE 105.A N LYS 102.A O no hydrogen 3.266 N/A PHE 108.A N THR 104.A O no hydrogen 2.821 N/A TRP 109.A N PHE 105.A O no hydrogen 3.093 N/A TRP 109.A NE1 TYR 137.A O no hydrogen 2.814 N/A ARG 110.A N GLU 106.A O no hydrogen 2.814 N/A ARG 110.A NH1 ARG 70.A O no hydrogen 2.516 N/A ARG 110.A NH1 GLU 114.A OE2 no hydrogen 2.683 N/A ARG 110.A NH2 ARG 70.A O no hydrogen 3.181 N/A ARG 110.A NH2 SER 77.A O no hydrogen 3.111 N/A MET 111.A N ASP 107.A O no hydrogen 2.833 N/A ILE 112.A N PHE 108.A O no hydrogen 3.160 N/A TRP 113.A N TRP 109.A O no hydrogen 2.966 N/A GLU 114.A N ARG 110.A O no hydrogen 2.733 N/A GLN 115.A N MET 111.A O no hydrogen 2.751 N/A ASN 116.A N TRP 113.A O no hydrogen 3.038 N/A THR 117.A N ILE 112.A O no hydrogen 3.064 N/A THR 117.A OG1 PRO 218.A O no hydrogen 3.090 N/A ILE 120.A N ILE 182.A O no hydrogen 2.870 N/A VAL 121.A N LEU 220.A O no hydrogen 2.631 N/A MET 122.A N TYR 184.A O no hydrogen 2.702 N/A ILE 123.A N HIS 222.A O no hydrogen 2.821 N/A THR 124.A OG1 ASN 125.A O no hydrogen 2.862 N/A THR 124.A OG1 GLU 128.A OE1 no hydrogen 3.059 N/A ASN 125.A N GLU 128.A OE1 no hydrogen 2.837 N/A ASN 125.A ND2 THR 187.A O no hydrogen 2.955 N/A GLU 128.A N ARG 131.A O no hydrogen 2.857 N/A LYS 129.A NZ GLY 193.A O no hydrogen 2.982 N/A ARG 131.A N GLU 128.A O no hydrogen 2.895 N/A ARG 132.A NE CYS 134.A O no hydrogen 3.205 N/A ARG 132.A NH2 CYS 134.A O no hydrogen 2.888 N/A LYS 133.A N LEU 126.A O no hydrogen 2.773 N/A CYS 134.A N LEU 126.A O no hydrogen 3.092 N/A CYS 134.A SG ASP 135.A O no hydrogen 3.385 N/A TYR 137.A OH HIS 222.A NE2 no hydrogen 2.897 N/A THR 140.A OG1 GLN 136.A OE1 no hydrogen 2.938 N/A SER 143.A OG THR 152.A OG1 no hydrogen 2.637 N/A GLU 144.A N VAL 151.A O no hydrogen 2.990 N/A TYR 146.A N ILE 149.A O no hydrogen 2.741 N/A ILE 149.A N TYR 146.A O no hydrogen 2.935 N/A ILE 150.A N ARG 170.A O no hydrogen 2.856 N/A VAL 151.A N GLU 144.A O no hydrogen 2.877 N/A THR 152.A N SER 168.A O no hydrogen 2.859 N/A THR 152.A OG1 SER 143.A OG no hydrogen 2.637 N/A LEU 153.A N ASN 142.A O no hydrogen 2.898 N/A LYS 154.A N ARG 166.A O no hydrogen 2.740 N/A SER 155.A N ARG 166.A O no hydrogen 3.392 N/A LYS 157.A N VAL 164.A O no hydrogen 2.838 N/A HIS 159.A N TYR 162.A O no hydrogen 2.775 N/A THR 163.A N HIS 185.A O no hydrogen 2.712 N/A VAL 164.A N LYS 157.A O no hydrogen 2.836 N/A ARG 165.A N GLN 183.A O no hydrogen 3.036 N/A ARG 165.A NH1 GLN 183.A OE1 no hydrogen 2.822 N/A ARG 166.A N SER 155.A O no hydrogen 2.837 N/A PHE 167.A N VAL 181.A O no hydrogen 2.835 N/A SER 168.A N THR 152.A O no hydrogen 2.867 N/A ILE 169.A N ARG 179.A O no hydrogen 2.886 N/A ARG 170.A N ILE 150.A O no hydrogen 2.948 N/A ASN 171.A N ASN 177.A O no hydrogen 3.198 N/A THR 172.A N ASN 148.A O no hydrogen 2.797 N/A THR 172.A OG1 ASN 148.A O no hydrogen 3.408 N/A LYS 173.A N ASN 171.A OD1 no hydrogen 2.882 N/A VAL 174.A N ASN 171.A O no hydrogen 3.158 N/A ARG 179.A N ILE 169.A O no hydrogen 2.943 N/A ARG 179.A NH1 TRP 113.A O no hydrogen 2.613 N/A VAL 181.A N PHE 167.A O no hydrogen 3.052 N/A ILE 182.A N GLY 118.A O no hydrogen 3.040 N/A GLN 183.A N ARG 165.A O no hydrogen 2.881 N/A GLN 183.A NE2 TYR 137.A OH no hydrogen 2.961 N/A TYR 184.A N ILE 120.A O no hydrogen 2.695 N/A HIS 185.A N THR 163.A O no hydrogen 2.863 N/A TYR 186.A N MET 122.A O no hydrogen 2.925 N/A THR 187.A N CYS 161.A O no hydrogen 2.908 N/A TRP 189.A NE1 TYR 186.A O no hydrogen 2.890 N/A LEU 202.A N ALA 198.A O no hydrogen 2.813 N/A THR 203.A N LEU 199.A O no hydrogen 2.982 N/A THR 203.A OG1 LEU 199.A O no hydrogen 3.226 N/A PHE 204.A N PRO 200.A O no hydrogen 3.069 N/A VAL 205.A N VAL 201.A O no hydrogen 2.735 N/A ARG 206.A N LEU 202.A O no hydrogen 2.865 N/A ARG 207.A N THR 203.A O no hydrogen 3.033 N/A ARG 207.A NH2 TYR 162.A OH no hydrogen 3.078 N/A SER 208.A N PHE 204.A O no hydrogen 3.039 N/A SER 208.A OG PHE 204.A O no hydrogen 2.692 N/A SER 208.A OG VAL 205.A O no hydrogen 3.197 N/A SER 208.A OG TYR 233.A OH no hydrogen 2.652 N/A SER 209.A N VAL 205.A O no hydrogen 2.924 N/A SER 209.A OG ASP 237.A OD1 no hydrogen 2.798 N/A ALA 210.A N ARG 206.A O no hydrogen 3.032 N/A ARG 212.A N SER 209.A O no hydrogen 2.989 N/A ARG 212.A NH1 ALA 93.A O no hydrogen 3.116 N/A ARG 212.A NH2 ALA 93.A O no hydrogen 3.194 N/A THR 216.A OG1 MET 213.A O no hydrogen 2.465 N/A THR 216.A OG1 GLY 217.A O no hydrogen 3.492 N/A GLY 217.A N ASN 116.A O no hydrogen 2.855 N/A VAL 219.A N ALA 93.A O no hydrogen 3.130 N/A LEU 220.A N ILE 119.A O no hydrogen 2.978 N/A VAL 221.A N ILE 95.A O no hydrogen 2.785 N/A HIS 222.A N VAL 121.A O no hydrogen 2.884 N/A HIS 222.A ND1 CYS 223.A O no hydrogen 2.919 N/A HIS 222.A NE2 TYR 137.A OH no hydrogen 2.897 N/A CYS 223.A SG THR 230.A OG1 no hydrogen 3.212 N/A SER 224.A OG TYR 56.A OH no hydrogen 2.641 N/A SER 224.A OG LYS 133.A O no hydrogen 2.799 N/A ARG 229.A NH1 ILE 123.A O no hydrogen 3.355 N/A ARG 229.A NH1 GLU 128.A OE1 no hydrogen 2.777 N/A ARG 229.A NH1 GLU 128.A OE2 no hydrogen 3.283 N/A ARG 229.A NH2 GLU 128.A OE2 no hydrogen 2.891 N/A GLY 231.A N VAL 227.A O no hydrogen 2.871 N/A THR 232.A N GLY 228.A O no hydrogen 3.073 N/A THR 232.A OG1 GLY 228.A O no hydrogen 2.998 N/A TYR 233.A N ARG 229.A O no hydrogen 2.956 N/A TYR 233.A OH SER 208.A OG no hydrogen 2.652 N/A ILE 234.A N THR 230.A O no hydrogen 3.156 N/A VAL 235.A N GLY 231.A O no hydrogen 3.003 N/A ILE 236.A N THR 232.A O no hydrogen 3.090 N/A ASP 237.A N TYR 233.A O no hydrogen 2.908 N/A SER 238.A N ILE 234.A O no hydrogen 2.920 N/A SER 238.A OG TYR 94.A OH no hydrogen 3.236 N/A SER 238.A OG ILE 234.A O no hydrogen 2.817 N/A MET 239.A N VAL 235.A O no hydrogen 2.812 N/A LEU 240.A N ILE 236.A O no hydrogen 2.931 N/A GLN 241.A N ASP 237.A O no hydrogen 3.090 N/A GLN 242.A N SER 238.A O no hydrogen 2.961 N/A ILE 243.A N MET 239.A O no hydrogen 2.810 N/A LYS 244.A N LEU 240.A O no hydrogen 2.978 N/A ASP 245.A N GLN 241.A O no hydrogen 2.894 N/A LYS 246.A N GLN 242.A O no hydrogen 2.737 N/A SER 247.A N ILE 243.A O no hydrogen 2.811 N/A THR 248.A OG1 GLN 242.A OE1 no hydrogen 3.086 N/A VAL 249.A N ILE 4.A O no hydrogen 2.711 N/A GLY 253.A N ASN 250.A OD1 no hydrogen 3.115 N/A PHE 254.A N ASN 250.A O no hydrogen 3.013 N/A LEU 255.A N VAL 251.A O no hydrogen 2.958 N/A LYS 256.A N LEU 252.A O no hydrogen 3.129 N/A LYS 256.A NZ GLU 30.A OE1 no hydrogen 2.803 N/A HIS 257.A N GLY 253.A O no hydrogen 3.146 N/A HIS 257.A NE2 ASP 86.A OD2 no hydrogen 2.597 N/A ILE 258.A N PHE 254.A O no hydrogen 3.019 N/A ARG 259.A N LEU 255.A O no hydrogen 3.020 N/A ARG 259.A NE LEU 265.A O no hydrogen 2.740 N/A ARG 259.A NH2 VAL 266.A O no hydrogen 2.880 N/A THR 260.A N HIS 257.A O no hydrogen 3.072 N/A THR 260.A OG1 HIS 257.A O no hydrogen 2.637 N/A GLN 261.A N ILE 258.A O no hydrogen 2.770 N/A GLN 261.A NE2 ASP 86.A OD2 no hydrogen 2.684 N/A ARG 262.A N ILE 258.A O no hydrogen 3.271 N/A ARG 262.A NE GLY 226.A O no hydrogen 2.907 N/A ARG 262.A NH1 ASN 81.A OD1 no hydrogen 2.858 N/A ARG 262.A NH1 ASN 83.A OD1 no hydrogen 2.814 N/A ARG 262.A NH2 ASN 81.A OD1 no hydrogen 2.826 N/A ARG 262.A NH2 ALA 225.A O no hydrogen 3.038 N/A ASN 263.A ND2 LEU 60.A O no hydrogen 3.163 N/A ASN 263.A ND2 ASN 263.A O no hydrogen 2.659 N/A VAL 266.A N VAL 227.A O no hydrogen 2.965 N/A GLN 267.A N GLN 271.A OE1 no hydrogen 2.810 N/A THR 268.A N GLN 271.A OE1 no hydrogen 3.145 N/A GLN 271.A N THR 268.A OG1 no hydrogen 3.074 N/A TYR 272.A N THR 268.A O no hydrogen 3.001 N/A TYR 272.A OH ASP 27.A OD2 no hydrogen 2.705 N/A ILE 273.A N GLU 269.A O no hydrogen 2.817 N/A PHE 274.A N GLU 270.A O no hydrogen 2.874 N/A ILE 275.A N GLN 271.A O no hydrogen 2.954 N/A HIS 276.A ND1 TYR 272.A O no hydrogen 2.884 N/A ASP 277.A N ILE 273.A O no hydrogen 3.033 N/A ALA 278.A N PHE 274.A O no hydrogen 2.958 N/A LEU 279.A N ILE 275.A O no hydrogen 3.110 N/A LEU 280.A N HIS 276.A O no hydrogen 2.804 N/A GLU 281.A N ASP 277.A O no hydrogen 2.903 N/A ALA 282.A N ALA 278.A O no hydrogen 3.044 N/A ILE 283.A N LEU 279.A O no hydrogen 2.863 N/A LEU 284.A N LEU 280.A O no hydrogen 2.815 N/A GLY 285.A N GLU 281.A O no hydrogen 2.853 N/A LYS 286.A N ALA 282.A O no hydrogen 3.287 N/A LYS 286.A N ILE 283.A O no hydrogen 3.310 N/A