Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4tro_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 2.A N ASP 5.A OD1.B no hydrogen 3.250 N/A GLY 2.A N ASP 5.A OD2.A no hydrogen 3.045 N/A GLY 2.A N ASP 5.A OD2.B no hydrogen 3.072 N/A LEU 3.A N GLN 31.A OE1 no hydrogen 2.871 N/A LEU 4.A N GLN 31.A O no hydrogen 2.910 N/A ASP 5.A N.A GLY 2.A O no hydrogen 3.234 N/A ASP 5.A N.B GLY 2.A O no hydrogen 3.232 N/A LYS 7.A N LEU 4.A O no hydrogen 3.079 N/A LYS 7.A NZ ASP 247.A OD1 no hydrogen 2.703 N/A LYS 7.A NZ ASP 247.A OD2 no hydrogen 3.555 N/A ARG 8.A N ASP 88.A OD2 no hydrogen 2.902 N/A ILE 9.A N GLN 34.A O.A no hydrogen 2.921 N/A ILE 9.A N GLN 34.A O.B no hydrogen 2.902 N/A LEU 10.A N GLY 89.A O no hydrogen 2.894 N/A VAL 11.A N VAL 36.A O no hydrogen 2.881 N/A SER 12.A N VAL 91.A O no hydrogen 3.051 N/A SER 12.A OG VAL 91.A O no hydrogen 2.778 N/A ILE 15.A N SER 19.A OG no hydrogen 3.000 N/A THR 16.A N SER 19.A OG no hydrogen 3.082 N/A THR 16.A OG1 SER 18.A OG no hydrogen 2.854 N/A SER 18.A N THR 16.A OG1 no hydrogen 3.068 N/A SER 18.A OG THR 16.A OG1 no hydrogen 2.854 N/A SER 19.A N THR 16.A O no hydrogen 3.130 N/A SER 19.A OG THR 16.A O no hydrogen 3.288 N/A PHE 22.A N SER 19.A O no hydrogen 2.945 N/A HIS 23.A ND1 SER 19.A O no hydrogen 3.327 N/A ILE 24.A N ILE 20.A O no hydrogen 3.004 N/A ALA 25.A N ALA 21.A O no hydrogen 2.960 N/A ARG 26.A N.A PHE 22.A O no hydrogen 2.921 N/A ARG 26.A N.B PHE 22.A O no hydrogen 2.917 N/A ARG 26.A NE.B GLU 30.A OE2 no hydrogen 3.048 N/A ARG 26.A NH1.A GLU 30.A OE2 no hydrogen 3.259 N/A ARG 26.A NH2.A THR 235.A OG1 no hydrogen 3.048 N/A VAL 27.A N HIS 23.A O no hydrogen 3.013 N/A ALA 28.A N ILE 24.A O no hydrogen 2.946 N/A GLN 29.A N ALA 25.A O no hydrogen 3.022 N/A GLN 29.A NE2 ALA 55.A O no hydrogen 2.964 N/A GLU 30.A N ARG 26.A O.A no hydrogen 2.907 N/A GLU 30.A N ARG 26.A O.B no hydrogen 2.895 N/A GLN 31.A N VAL 27.A O no hydrogen 3.000 N/A GLN 31.A N ALA 28.A O no hydrogen 3.093 N/A GLY 32.A N GLN 29.A O no hydrogen 3.033 N/A ALA 33.A N ALA 28.A O no hydrogen 2.994 N/A GLN 34.A N.A LYS 7.A O no hydrogen 2.836 N/A GLN 34.A N.B LYS 7.A O no hydrogen 2.852 N/A VAL 36.A N ILE 9.A O no hydrogen 3.016 N/A LEU 37.A N PRO 58.A O no hydrogen 2.832 N/A THR 38.A N VAL 11.A O no hydrogen 3.035 N/A GLY 39.A N LEU 60.A O no hydrogen 2.990 N/A ARG 42.A N PHE 40.A O no hydrogen 2.793 N/A ILE 46.A N ARG 42.A O no hydrogen 2.958 N/A GLN 47.A N LEU 43.A O no hydrogen 2.921 N/A ARG 48.A N ARG 44.A O no hydrogen 3.114 N/A ILE 49.A N LEU 45.A O no hydrogen 3.006 N/A THR 50.A N ILE 46.A O no hydrogen 2.830 N/A THR 50.A OG1 ILE 46.A O no hydrogen 3.022 N/A THR 50.A OG1 GLN 47.A O no hydrogen 3.287 N/A THR 50.A OG1 GLN 47.A OE1 no hydrogen 3.490 N/A ASP 51.A N GLN 47.A O no hydrogen 2.983 N/A ARG 52.A N ILE 49.A O no hydrogen 3.179 N/A ARG 52.A NH1 ARG 48.A O no hydrogen 2.947 N/A LEU 53.A N THR 50.A O no hydrogen 2.979 N/A ALA 55.A N GLN 29.A OE1 no hydrogen 2.950 N/A LEU 60.A N LEU 37.A O no hydrogen 2.828 N/A LEU 62.A N GLY 39.A O no hydrogen 2.844 N/A ASP 63.A N HIS 69.A ND1 no hydrogen 2.975 N/A GLN 65.A N ASP 63.A OD1 no hydrogen 2.948 N/A GLN 65.A NE2 HIS 120.A ND1 no hydrogen 3.188 N/A ASN 66.A N ASP 63.A O no hydrogen 2.894 N/A HIS 69.A N ASN 66.A OD1 no hydrogen 3.062 N/A LEU 70.A N ASN 66.A O no hydrogen 3.144 N/A ALA 71.A N GLU 67.A O no hydrogen 2.865 N/A SER 72.A N GLU 68.A O no hydrogen 3.063 N/A SER 72.A OG GLU 68.A O no hydrogen 3.191 N/A SER 72.A OG HIS 69.A O no hydrogen 3.237 N/A LEU 73.A N LEU 70.A O no hydrogen 3.324 N/A ARG 76.A N SER 72.A O no hydrogen 3.036 N/A ARG 76.A NE SER 72.A OG no hydrogen 2.907 N/A ARG 76.A NH1 GLU 61.A O no hydrogen 2.765 N/A ARG 76.A NH2 GLU 61.A O no hydrogen 3.059 N/A ARG 76.A NH2 HIS 69.A O no hydrogen 2.978 N/A ARG 76.A NH2 SER 72.A OG no hydrogen 3.389 N/A VAL 77.A N LEU 73.A O no hydrogen 2.861 N/A THR 78.A N ALA 74.A O no hydrogen 2.885 N/A THR 78.A OG1 ALA 74.A O no hydrogen 2.956 N/A GLU 79.A N GLY 75.A O no hydrogen 3.055 N/A ALA 80.A N ARG 76.A O no hydrogen 3.089 N/A ILE 81.A N VAL 77.A O no hydrogen 2.914 N/A GLY 82.A N THR 78.A O no hydrogen 2.665 N/A ASN 85.A N GLY 82.A O no hydrogen 2.965 N/A ASN 85.A ND2 ILE 81.A O no hydrogen 2.904 N/A LYS 86.A NZ PRO 135.A O no hydrogen 3.225 N/A LEU 87.A N ILE 136.A O no hydrogen 2.779 N/A ASP 88.A N ARG 8.A O no hydrogen 2.719 N/A GLY 89.A N ARG 8.A O no hydrogen 3.138 N/A VAL 90.A N SER 142.A O no hydrogen 2.927 N/A VAL 91.A N LEU 10.A O no hydrogen 2.791 N/A HIS 92.A N VAL 144.A O no hydrogen 2.784 N/A HIS 92.A NE2 SER 125.A OG no hydrogen 2.802 N/A SER 93.A N SER 12.A OG no hydrogen 3.151 N/A PHE 96.A N SER 122.A OG no hydrogen 2.966 N/A THR 100.A OG1 ASP 114.A OD2 no hydrogen 2.570 N/A GLY 101.A N PRO 98.A O no hydrogen 2.782 N/A MET 102.A N GLN 99.A O no hydrogen 3.135 N/A GLY 103.A N ALA 156.A O no hydrogen 2.795 N/A ILE 104.A N LEU 206.A O no hydrogen 3.043 N/A ASN 105.A ND2.B THR 100.A O no hydrogen 2.709 N/A ASP 109.A N PRO 106.A O no hydrogen 2.894 N/A ASP 114.A N PRO 111.A O no hydrogen 3.010 N/A VAL 115.A N PRO 111.A O no hydrogen 3.196 N/A SER 116.A N TYR 112.A O no hydrogen 2.728 N/A LYS 117.A N ALA 113.A O no hydrogen 3.103 N/A GLY 118.A N ASP 114.A O no hydrogen 3.099 N/A ILE 119.A N VAL 115.A O no hydrogen 2.880 N/A HIS 120.A N SER 116.A O no hydrogen 2.889 N/A ILE 121.A N LYS 117.A O no hydrogen 3.068 N/A SER 122.A N GLY 118.A O no hydrogen 2.811 N/A SER 122.A OG PHE 96.A O no hydrogen 2.887 N/A SER 122.A OG GLY 118.A O no hydrogen 2.859 N/A ALA 123.A N ILE 119.A O no hydrogen 2.891 N/A TYR 124.A N ILE 119.A O no hydrogen 3.025 N/A SER 125.A N HIS 120.A O no hydrogen 3.042 N/A SER 125.A OG HIS 92.A NE2 no hydrogen 2.802 N/A SER 125.A OG ILE 121.A O no hydrogen 2.651 N/A TYR 126.A N ALA 123.A O no hydrogen 3.106 N/A TYR 126.A OH SER 185.A OG no hydrogen 2.789 N/A SER 128.A N TYR 124.A O no hydrogen 3.047 N/A MET 129.A N.A SER 125.A O no hydrogen 2.918 N/A MET 129.A N.B SER 125.A O no hydrogen 2.913 N/A ALA 130.A N TYR 126.A O no hydrogen 3.215 N/A LYS 131.A N ALA 127.A O no hydrogen 2.860 N/A ALA 132.A N SER 128.A O no hydrogen 3.102 N/A LEU 133.A N MET 129.A O.A no hydrogen 2.915 N/A LEU 133.A N MET 129.A O.B no hydrogen 2.945 N/A LEU 134.A N ALA 130.A O no hydrogen 2.877 N/A ILE 136.A N LEU 133.A O no hydrogen 2.878 N/A MET 137.A N LEU 134.A O no hydrogen 3.036 N/A ASN 138.A N LEU 87.A O no hydrogen 2.835 N/A GLY 140.A N GLY 182.A O no hydrogen 2.817 N/A GLY 141.A N ASN 138.A O no hydrogen 3.015 N/A SER 142.A N ASP 88.A O no hydrogen 2.989 N/A SER 142.A OG LEU 244.A O no hydrogen 2.686 N/A ILE 143.A N ARG 184.A O no hydrogen 2.789 N/A VAL 144.A N VAL 90.A O no hydrogen 2.855 N/A GLY 145.A N ASN 186.A O no hydrogen 3.018 N/A MET 146.A N HIS 92.A O no hydrogen 3.147 N/A ASP 147.A N VAL 188.A O no hydrogen 2.814 N/A SER 151.A N.A ASP 149.A OD2 no hydrogen 3.065 N/A SER 151.A N.B ASP 149.A OD2 no hydrogen 3.053 N/A SER 151.A OG.A ASP 149.A OD1 no hydrogen 3.539 N/A SER 151.A OG.A ASP 149.A OD2 no hydrogen 2.899 N/A SER 151.A OG.B ASP 149.A OD2 no hydrogen 2.716 N/A TYR 157.A N PRO 155.A O no hydrogen 2.798 N/A ASN 158.A ND2 GLY 103.A O no hydrogen 3.251 N/A TRP 159.A N GLY 101.A O no hydrogen 2.981 N/A TRP 159.A NE1 PHE 107.A O no hydrogen 2.899 N/A MET 160.A N TYR 157.A O no hydrogen 2.857 N/A THR 161.A N ASN 158.A O no hydrogen 3.117 N/A ALA 163.A N TRP 159.A O no hydrogen 2.909 N/A LYS 164.A N MET 160.A O no hydrogen 2.967 N/A LYS 164.A NZ MET 146.A O no hydrogen 2.963 N/A SER 165.A N THR 161.A O no hydrogen 2.976 N/A SER 165.A OG THR 161.A O no hydrogen 3.423 N/A ALA 166.A N VAL 162.A O no hydrogen 3.027 N/A LEU 167.A N ALA 163.A O no hydrogen 2.909 N/A GLU 168.A N LYS 164.A O no hydrogen 2.951 N/A SER 169.A N SER 165.A O no hydrogen 3.320 N/A VAL 170.A N ALA 166.A O no hydrogen 2.877 N/A ASN 171.A N LEU 167.A O no hydrogen 2.906 N/A ASN 171.A ND2 ASP 255.A O no hydrogen 3.156 N/A ARG 172.A N GLU 168.A O no hydrogen 3.399 N/A PHE 173.A N SER 169.A O no hydrogen 3.372 N/A VAL 174.A N VAL 170.A O no hydrogen 2.852 N/A ALA 175.A N ASN 171.A O no hydrogen 2.957 N/A GLU 177.A N PHE 173.A O no hydrogen 3.371 N/A ALA 178.A N VAL 174.A O no hydrogen 2.777 N/A GLY 179.A N ALA 175.A O no hydrogen 2.991 N/A LYS 180.A N GLU 177.A O no hydrogen 3.218 N/A LYS 180.A NZ GLU 177.A OE1 no hydrogen 2.686 N/A TYR 181.A N ALA 178.A O no hydrogen 2.912 N/A GLY 182.A N GLY 179.A O no hydrogen 3.002 N/A VAL 183.A N ALA 178.A O no hydrogen 3.005 N/A ARG 184.A N GLY 141.A O no hydrogen 2.939 N/A ARG 184.A NH1 LEU 244.A O no hydrogen 3.033 N/A ARG 184.A NH2 GLY 140.A O no hydrogen 3.388 N/A ARG 184.A NH2 SER 246.A O no hydrogen 3.173 N/A SER 185.A N THR 253.A OG1 no hydrogen 2.955 N/A SER 185.A OG TYR 126.A OH no hydrogen 2.789 N/A SER 185.A OG ASN 171.A OD1 no hydrogen 2.686 N/A ASN 186.A N ILE 143.A O no hydrogen 2.961 N/A ASN 186.A ND2 THR 252.A O no hydrogen 2.960 N/A LEU 187.A N ASP 255.A O no hydrogen 2.924 N/A VAL 188.A N GLY 145.A O no hydrogen 2.848 N/A ALA 189.A N ILE 257.A O no hydrogen 2.829 N/A ALA 190.A N ASP 147.A O no hydrogen 3.109 N/A GLY 191.A N ALA 259.A O no hydrogen 3.149 N/A ARG 194.A N MET 231.A O no hydrogen 2.874 N/A ARG 194.A NE GLU 218.A OE1 no hydrogen 2.752 N/A ARG 194.A NH2 GLU 218.A OE2 no hydrogen 2.923 N/A THR 195.A N ILE 193.A O no hydrogen 2.897 N/A LEU 196.A N SER 18.A OG no hydrogen 3.156 N/A MET 198.A N THR 195.A OG1 no hydrogen 3.172 N/A SER 199.A N THR 195.A O no hydrogen 2.902 N/A SER 199.A OG THR 195.A O no hydrogen 2.864 N/A ALA 200.A N LEU 196.A O no hydrogen 2.938 N/A ILE 201.A N ALA 197.A O no hydrogen 2.977 N/A VAL 202.A N MET 198.A O no hydrogen 2.886 N/A GLY 203.A N SER 199.A O no hydrogen 2.922 N/A GLY 204.A N ILE 201.A O no hydrogen 2.943 N/A ALA 205.A N ALA 200.A O no hydrogen 2.993 N/A GLY 207.A N GLY 204.A O no hydrogen 2.950 N/A GLY 211.A N GLY 207.A O no hydrogen 3.123 N/A ALA 212.A N GLU 208.A O no hydrogen 2.865 N/A GLN 213.A N GLU 209.A O no hydrogen 2.960 N/A ILE 214.A N ALA 210.A O no hydrogen 3.029 N/A GLN 215.A N GLY 211.A O no hydrogen 3.001 N/A LEU 216.A N ALA 212.A O no hydrogen 3.070 N/A LEU 217.A N GLN 213.A O no hydrogen 2.915 N/A GLU 218.A N ILE 214.A O no hydrogen 2.986 N/A GLU 219.A N GLN 215.A O no hydrogen 3.113 N/A GLY 220.A N LEU 216.A O no hydrogen 3.011 N/A TRP 221.A N LEU 217.A O no hydrogen 3.016 N/A TRP 221.A NE1 ASP 260.A O no hydrogen 2.934 N/A ASP 222.A N GLU 218.A O no hydrogen 3.333 N/A GLN 223.A N GLU 219.A O no hydrogen 3.160 N/A ARG 224.A N GLY 220.A O no hydrogen 2.914 N/A ARG 224.A NE ALA 263.A O no hydrogen 3.277 N/A ALA 225.A N TRP 221.A O no hydrogen 2.933 N/A GLY 228.A N ALA 225.A O no hydrogen 2.983 N/A TRP 229.A N ASP 222.A OD1 no hydrogen 2.905 N/A TRP 229.A NE1 PRO 192.A O no hydrogen 2.796 N/A LYS 232.A N ASN 230.A OD1 no hydrogen 2.963 N/A ASP 233.A N ASN 230.A O no hydrogen 3.029 N/A THR 235.A N ASP 233.A OD1 no hydrogen 3.067 N/A THR 235.A OG1 ASP 233.A OD1 no hydrogen 3.322 N/A ALA 238.A N ALA 234.A O no hydrogen 2.981 N/A LYS 239.A N THR 235.A O no hydrogen 2.830 N/A THR 240.A N PRO 236.A O no hydrogen 3.212 N/A THR 240.A OG1 PRO 236.A O no hydrogen 2.838 N/A VAL 241.A N VAL 237.A O no hydrogen 3.068 N/A CYS 242.A N ALA 238.A O no hydrogen 3.007 N/A CYS 242.A SG ALA 238.A O no hydrogen 3.474 N/A ALA 243.A N LYS 239.A O no hydrogen 2.892 N/A LEU 244.A N THR 240.A O no hydrogen 3.168 N/A LEU 245.A N VAL 241.A O no hydrogen 2.940 N/A SER 246.A N ALA 243.A O no hydrogen 3.223 N/A SER 246.A OG ALA 243.A O no hydrogen 2.667 N/A TRP 248.A N SER 246.A OG no hydrogen 3.041 N/A THR 253.A OG1 SER 185.A O no hydrogen 3.443 N/A GLY 254.A N SER 185.A O no hydrogen 2.716 N/A ASP 255.A N ASN 186.A OD1 no hydrogen 3.041 N/A ILE 256.A N ASP 255.A OD1 no hydrogen 2.880 N/A ILE 257.A N LEU 187.A O no hydrogen 2.885 N/A ALA 259.A N ALA 189.A O no hydrogen 2.881 N/A GLY 262.A N ASP 260.A OD1 no hydrogen 2.867 N/A ALA 263.A N ASP 260.A O no hydrogen 3.302 N/A HIS 264.A N ASP 260.A OD2 no hydrogen 2.959 N/A THR 265.A N GLY 262.A O no hydrogen 3.007 N/A THR 265.A OG1 GLY 262.A O no hydrogen 2.734 N/A GLN 266.A N ALA 263.A O no hydrogen 3.233 N/A GLN 266.A NE2 THR 265.A OG1 no hydrogen 2.980 N/A