Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3by9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N ARG 1.A O no hydrogen 3.145 N/A TYR 4.A OH GLU 222.A OE2 no hydrogen 2.611 N/A GLN 5.A NE2 ASN 9.A OD1 no hydrogen 3.079 N/A LEU 7.A N GLN 3.A O no hydrogen 3.033 N/A LEU 8.A N TYR 4.A O no hydrogen 2.943 N/A ASN 9.A N GLN 5.A O no hydrogen 2.877 N/A GLU 10.A N ALA 6.A O no hydrogen 2.960 N/A HIS 11.A N LEU 7.A O no hydrogen 2.827 N/A GLN 12.A N LEU 8.A O no hydrogen 3.132 N/A SER 13.A N.A ASN 9.A O no hydrogen 3.313 N/A SER 13.A N.B ASN 9.A O no hydrogen 3.297 N/A SER 13.A N.B GLU 10.A O no hydrogen 2.987 N/A GLN 14.A N GLU 10.A O no hydrogen 2.869 N/A LEU 15.A N HIS 11.A O no hydrogen 2.831 N/A ASP 16.A N GLN 12.A O no hydrogen 2.972 N/A ARG 17.A N SER 13.A O.A no hydrogen 2.964 N/A ARG 17.A N SER 13.A O.B no hydrogen 2.961 N/A ARG 17.A NH2 GLU 10.A OE2 no hydrogen 3.115 N/A PHE 18.A N GLN 14.A O no hydrogen 2.885 N/A SER 19.A N.A LEU 15.A O no hydrogen 2.828 N/A SER 19.A N.B LEU 15.A O no hydrogen 2.853 N/A SER 19.A OG.B LEU 15.A O no hydrogen 2.583 N/A SER 20.A N.A ASP 16.A O no hydrogen 2.994 N/A SER 20.A N.B ASP 16.A O no hydrogen 3.000 N/A SER 20.A OG.A ASP 16.A O no hydrogen 2.957 N/A HIS 21.A N ARG 17.A O no hydrogen 3.024 N/A HIS 21.A NE2 ALA 152.A O no hydrogen 2.888 N/A ILE 22.A N PHE 18.A O no hydrogen 2.861 N/A VAL 23.A N SER 19.A O.A no hydrogen 2.927 N/A VAL 23.A N SER 19.A O.B no hydrogen 2.877 N/A ALA 24.A N SER 20.A O.A no hydrogen 2.903 N/A ALA 24.A N SER 20.A O.B no hydrogen 3.011 N/A THR 25.A N HIS 21.A O no hydrogen 2.960 N/A THR 25.A OG1 HIS 21.A O no hydrogen 2.710 N/A LEU 26.A N ILE 22.A O no hydrogen 2.876 N/A ASP 27.A N VAL 23.A O no hydrogen 2.923 N/A LYS 28.A N THR 25.A O no hydrogen 3.202 N/A TYR 29.A N LEU 26.A O no hydrogen 2.888 N/A TYR 29.A OH ILE 69.A O no hydrogen 3.181 N/A TYR 29.A OH GLN 70.A O no hydrogen 2.905 N/A ALA 30.A N LEU 26.A O no hydrogen 2.965 N/A HIS 31.A N HIS 31.A ND1 no hydrogen 2.835 N/A ILE 32.A N TYR 29.A O no hydrogen 3.036 N/A LEU 35.A N HIS 31.A O no hydrogen 3.067 N/A ILE 36.A N ILE 32.A O no hydrogen 3.082 N/A SER 37.A N HIS 34.A O no hydrogen 3.178 N/A SER 37.A OG HIS 34.A O no hydrogen 2.890 N/A LYS 38.A NZ ILE 136.A O no hydrogen 2.776 N/A ASP 39.A N ILE 36.A O no hydrogen 2.947 N/A LYS 40.A NZ ASP 44.A OD1 no hydrogen 2.846 N/A GLU 41.A N GLU 41.A OE1 no hydrogen 2.686 N/A LEU 42.A N ASP 39.A O no hydrogen 2.909 N/A VAL 43.A N ASP 39.A O no hydrogen 3.109 N/A ASP 44.A N LYS 40.A O no hydrogen 2.806 N/A ALA 45.A N GLU 41.A O no hydrogen 3.325 N/A LEU 46.A N LEU 42.A O no hydrogen 3.138 N/A LEU 47.A N VAL 43.A O no hydrogen 2.941 N/A SER 48.A N ASP 44.A O no hydrogen 3.042 N/A SER 48.A N ALA 45.A O no hydrogen 3.196 N/A ASN 51.A N SER 48.A O no hydrogen 3.032 N/A GLN 54.A N ASN 51.A OD1 no hydrogen 3.023 N/A GLN 54.A NE2 GLN 54.A O no hydrogen 3.242 N/A GLN 54.A NE2 THR 58.A OG1 no hydrogen 3.152 N/A ILE 55.A N ASN 51.A O no hydrogen 3.008 N/A ASP 56.A N.A SER 52.A O no hydrogen 2.950 N/A ASP 56.A N.B SER 52.A O no hydrogen 2.953 N/A ILE 57.A N ALA 53.A O no hydrogen 3.121 N/A THR 58.A N GLN 54.A O no hydrogen 2.887 N/A THR 58.A OG1 GLU 41.A O no hydrogen 2.674 N/A THR 58.A OG1 GLN 54.A O no hydrogen 3.117 N/A ASN 59.A N ILE 55.A O no hydrogen 2.780 N/A ARG 60.A N ASP 56.A O.A no hydrogen 3.128 N/A ARG 60.A N ASP 56.A O.B no hydrogen 3.121 N/A ARG 60.A NE ASP 56.A OD1.B no hydrogen 3.031 N/A TYR 61.A N ILE 57.A O no hydrogen 2.982 N/A TYR 61.A OH ASP 39.A OD2 no hydrogen 2.532 N/A LEU 62.A N THR 58.A O no hydrogen 2.903 N/A GLU 63.A N ASN 59.A O no hydrogen 2.946 N/A GLN 64.A N ARG 60.A O no hydrogen 3.081 N/A VAL 65.A N TYR 61.A O no hydrogen 2.882 N/A ASN 66.A N LEU 62.A O no hydrogen 2.854 N/A ASN 66.A ND2 THR 74.A OG1 no hydrogen 2.840 N/A GLU 67.A N GLU 63.A O no hydrogen 3.088 N/A VAL 68.A N GLN 64.A O no hydrogen 3.030 N/A ILE 69.A N VAL 65.A O no hydrogen 3.034 N/A GLN 70.A N GLU 67.A O no hydrogen 3.367 N/A ALA 71.A N ASN 66.A O no hydrogen 3.167 N/A ALA 72.A N LYS 148.A O no hydrogen 2.839 N/A ASP 73.A N LYS 148.A O no hydrogen 3.238 N/A THR 74.A N SER 87.A OG no hydrogen 2.861 N/A TYR 75.A N VAL 146.A O no hydrogen 2.942 N/A TYR 75.A OH TYR 105.A OH no hydrogen 2.783 N/A LEU 76.A N ALA 85.A O no hydrogen 2.887 N/A ILE 77.A N VAL 144.A O no hydrogen 2.800 N/A ASP 78.A N ASN 82.A O no hydrogen 2.812 N/A PHE 80.A N ASP 78.A OD1 no hydrogen 2.915 N/A GLY 81.A N ASP 78.A O no hydrogen 3.104 N/A ASN 82.A N ASP 78.A OD1 no hydrogen 2.801 N/A ASN 82.A ND2 ASP 78.A OD2 no hydrogen 3.058 N/A THR 83.A N ARG 98.A O no hydrogen 2.909 N/A THR 83.A OG1 ARG 98.A O no hydrogen 3.074 N/A ILE 84.A N LEU 76.A O no hydrogen 2.905 N/A ALA 85.A N LEU 76.A O no hydrogen 3.508 N/A SER 86.A N ASN 59.A OD1 no hydrogen 2.829 N/A SER 86.A OG ASN 88.A OD1 no hydrogen 2.634 N/A SER 87.A N THR 74.A O no hydrogen 2.837 N/A SER 87.A OG THR 74.A O no hydrogen 3.309 N/A ASN 88.A N SER 86.A OG no hydrogen 3.254 N/A ASN 88.A ND2 ASP 73.A OD1 no hydrogen 2.735 N/A TRP 89.A N SER 86.A O no hydrogen 3.199 N/A TRP 89.A NE1 GLU 63.A OE1 no hydrogen 3.090 N/A ASN 90.A ND2.A GLU 63.A OE2 no hydrogen 2.943 N/A LEU 91.A N ASN 88.A O no hydrogen 2.911 N/A ARG 93.A NE ASP 73.A OD1 no hydrogen 2.736 N/A ARG 93.A NH2 ALA 72.A O no hydrogen 2.968 N/A ARG 93.A NH2 ASP 73.A OD1 no hydrogen 3.324 N/A SER 94.A N LEU 91.A O no hydrogen 3.102 N/A PHE 95.A N ASN 88.A OD1 no hydrogen 2.891 N/A ILE 96.A N SER 94.A OG no hydrogen 3.122 N/A GLY 97.A N THR 83.A O no hydrogen 2.955 N/A ARG 98.A N PHE 95.A O no hydrogen 3.025 N/A ASN 99.A ND2 PHE 80.A O no hydrogen 3.046 N/A ASN 99.A ND2 ASN 82.A OD1 no hydrogen 2.875 N/A PHE 100.A N GLY 81.A O no hydrogen 2.805 N/A ALA 101.A N ASN 99.A OD1 no hydrogen 2.950 N/A TRP 102.A NE1 ASN 99.A O no hydrogen 3.007 N/A ARG 103.A N PHE 100.A O no hydrogen 2.907 N/A ARG 103.A NH1 GLN 200.A O no hydrogen 3.016 N/A ARG 103.A NH2 LEU 120.A O no hydrogen 2.812 N/A PHE 106.A N ARG 103.A O no hydrogen 2.987 N/A TYR 107.A N ARG 103.A O no hydrogen 3.045 N/A LEU 108.A N PRO 104.A O no hydrogen 2.822 N/A SER 109.A N TYR 105.A O no hydrogen 3.197 N/A SER 109.A OG TYR 105.A O no hydrogen 3.327 N/A SER 109.A OG GLN 113.A O.A no hydrogen 2.881 N/A SER 109.A OG GLN 113.A O.B no hydrogen 2.787 N/A SER 109.A OG SER 115.A OG no hydrogen 2.754 N/A ILE 110.A N PHE 106.A O no hydrogen 2.835 N/A ALA 111.A N LEU 108.A O no hydrogen 3.264 N/A GLY 112.A N SER 109.A O no hydrogen 2.903 N/A GLN 113.A NE2.A ALA 111.A O no hydrogen 3.285 N/A SER 115.A N ALA 132.A O no hydrogen 3.040 N/A SER 115.A OG TYR 105.A O no hydrogen 3.073 N/A SER 115.A OG SER 109.A OG no hydrogen 2.754 N/A GLN 116.A NE2 TYR 129.A OH no hydrogen 2.496 N/A TYR 117.A N TYR 130.A O no hydrogen 2.875 N/A ALA 119.A N GLY 128.A O no hydrogen 3.178 N/A LEU 120.A N GLN 201.A O no hydrogen 2.952 N/A GLY 121.A N GLN 126.A O no hydrogen 2.869 N/A GLY 125.A N GLY 121.A O no hydrogen 2.842 N/A GLN 126.A N SER 124.A OG no hydrogen 3.061 N/A ARG 127.A NH1 GLU 154.A OE2 no hydrogen 2.914 N/A ARG 127.A NH1 PHE 174.A O no hydrogen 2.911 N/A ARG 127.A NH2 GLU 154.A OE1 no hydrogen 3.018 N/A GLY 128.A N ALA 119.A O no hydrogen 2.971 N/A TYR 130.A N TYR 117.A O no hydrogen 2.697 N/A TYR 131.A N VAL 147.A O no hydrogen 2.907 N/A ALA 132.A N SER 115.A O no hydrogen 2.944 N/A TYR 133.A N ILE 145.A O no hydrogen 2.950 N/A VAL 135.A N GLY 143.A O no hydrogen 2.829 N/A TYR 137.A N GLU 140.A O no hydrogen 3.016 N/A GLU 140.A N TYR 137.A O no hydrogen 3.028 N/A LEU 142.A N VAL 135.A O no hydrogen 2.846 N/A VAL 144.A N ILE 77.A O no hydrogen 2.900 N/A ILE 145.A N TYR 133.A O no hydrogen 2.960 N/A VAL 146.A N TYR 75.A O no hydrogen 2.949 N/A VAL 147.A N TYR 131.A O no hydrogen 2.868 N/A LYS 148.A N ASP 73.A O no hydrogen 2.838 N/A LYS 148.A NZ GLN 126.A O no hydrogen 2.980 N/A LYS 148.A NZ TYR 130.A OH no hydrogen 3.492 N/A SER 151.A N ASP 149.A OD2 no hydrogen 3.010 N/A SER 151.A OG ASP 149.A OD2 no hydrogen 2.684 N/A GLU 154.A N LEU 150.A O no hydrogen 3.045 N/A GLN 155.A N SER 151.A O no hydrogen 2.754 N/A GLY 156.A N ILE 153.A O no hydrogen 2.934 N/A TRP 157.A N GLU 154.A O no hydrogen 3.224 N/A TRP 157.A NE1 SER 162.A O no hydrogen 3.111 N/A GLN 158.A NE2 GLN 155.A O no hydrogen 3.090 N/A GLN 158.A NE2 TRP 157.A O no hydrogen 3.208 N/A ASN 159.A ND2 SER 161.A OG no hydrogen 2.826 N/A LYS 160.A NZ GLN 158.A O no hydrogen 3.538 N/A SER 162.A OG GLN 14.A OE1 no hydrogen 2.883 N/A SER 162.A OG ASN 159.A OD1 no hydrogen 2.393 N/A TYR 163.A N LEU 252.A O no hydrogen 2.889 N/A PHE 164.A N SER 176.A OG no hydrogen 3.043 N/A VAL 165.A N ARG 250.A O no hydrogen 2.965 N/A THR 167.A N THR 248.A O no hydrogen 2.900 N/A THR 167.A OG1 THR 248.A O no hydrogen 3.472 N/A ASP 168.A N VAL 172.A O no hydrogen 2.968 N/A HIS 170.A N ASP 168.A OD1 no hydrogen 2.797 N/A GLN 171.A N ASP 168.A O no hydrogen 2.957 N/A VAL 172.A N ASP 168.A OD1 no hydrogen 2.859 N/A VAL 173.A N HIS 183.A O no hydrogen 2.880 N/A PHE 174.A N ALA 166.A O no hydrogen 2.901 N/A SER 175.A N GLU 154.A OE2 no hydrogen 2.945 N/A SER 175.A OG PHE 164.A O no hydrogen 3.188 N/A SER 175.A OG GLN 177.A O no hydrogen 3.122 N/A SER 176.A N PHE 164.A O no hydrogen 3.107 N/A GLN 177.A N SER 175.A OG no hydrogen 2.894 N/A ALA 179.A N GLN 177.A OE1 no hydrogen 2.815 N/A TRP 180.A N GLN 177.A O no hydrogen 3.015 N/A LEU 181.A N PRO 178.A O no hydrogen 3.121 N/A PHE 182.A N VAL 173.A O no hydrogen 2.829 N/A HIS 183.A N TRP 180.A O no hydrogen 3.115 N/A HIS 183.A ND1 LEU 181.A O no hydrogen 2.991 N/A SER 184.A N PRO 208.A O no hydrogen 2.867 N/A SER 184.A OG ALA 186.A O no hydrogen 2.777 N/A VAL 185.A N GLN 171.A O no hydrogen 2.908 N/A SER 189.A N GLN 192.A OE1 no hydrogen 2.782 N/A SER 189.A OG GLN 192.A OE1 no hydrogen 3.359 N/A GLN 192.A N SER 189.A OG no hydrogen 3.121 N/A LEU 193.A N SER 189.A O no hydrogen 2.901 N/A ASN 194.A N PRO 190.A O no hydrogen 2.856 N/A ASP 195.A N ALA 191.A O no hydrogen 3.044 N/A ILE 196.A N GLN 192.A O no hydrogen 3.077 N/A ARG 197.A N LEU 193.A O no hydrogen 2.984 N/A ARG 197.A NH2 SER 205.A O no hydrogen 3.136 N/A GLN 198.A N ASN 194.A O no hydrogen 2.841 N/A SER 199.A N ASP 195.A O no hydrogen 3.059 N/A SER 199.A OG ILE 196.A O no hydrogen 2.711 N/A GLN 200.A N ARG 197.A O no hydrogen 3.120 N/A GLN 200.A NE2 ARG 197.A O no hydrogen 3.053 N/A GLN 200.A NE2 ASP 204.A OD1 no hydrogen 3.016 N/A GLN 201.A N SER 199.A OG no hydrogen 3.150 N/A GLN 201.A NE2 PHE 118.A O no hydrogen 2.900 N/A TYR 202.A OH ASP 168.A OD2 no hydrogen 2.585 N/A LEU 203.A N GLN 200.A O no hydrogen 2.940 N/A SER 205.A N TYR 202.A O no hydrogen 2.965 N/A SER 205.A OG TYR 202.A O no hydrogen 2.661 N/A SER 209.A OG ASP 187.A OD1 no hydrogen 2.727 N/A LEU 210.A N SER 184.A O no hydrogen 2.822 N/A GLY 211.A N SER 209.A OG no hydrogen 2.934 N/A TRP 212.A N VAL 185.A O no hydrogen 3.027 N/A TRP 212.A NE1 ASP 233.A O no hydrogen 3.034 N/A GLN 213.A N ARG 224.A O no hydrogen 2.748 N/A GLN 217.A N.A ASP 215.A OD1 no hydrogen 2.847 N/A GLN 217.A N.B ASP 215.A OD1 no hydrogen 2.892 N/A ALA 218.A N ASP 215.A O no hydrogen 3.370 N/A SER 221.A N VAL 237.A O no hydrogen 2.868 N/A SER 221.A OG ASP 215.A O no hydrogen 3.393 N/A TRP 223.A N TYR 235.A O no hydrogen 2.968 N/A ARG 224.A N GLN 213.A O no hydrogen 2.858 N/A ARG 224.A NH2 GLU 222.A OE1 no hydrogen 2.769 N/A LYS 225.A N GLN 232.A OE1 no hydrogen 2.858 N/A LYS 225.A NZ ASP 233.A OD1 no hydrogen 2.695 N/A LYS 225.A NZ ASP 233.A OD2 no hydrogen 3.550 N/A HIS 229.A N.A PRO 226.A O no hydrogen 2.966 N/A HIS 229.A N.B PRO 226.A O no hydrogen 2.965 N/A GLN 232.A NE2 LYS 225.A O no hydrogen 3.053 N/A ASP 233.A N ASP 233.A OD1 no hydrogen 2.633 N/A TYR 235.A N TRP 223.A O no hydrogen 2.908 N/A ILE 236.A N SER 253.A O no hydrogen 2.750 N/A VAL 237.A N SER 221.A O no hydrogen 2.986 N/A SER 238.A N VAL 251.A O no hydrogen 3.013 N/A SER 239.A N GLU 219.A O.A no hydrogen 2.746 N/A SER 239.A N GLU 219.A O.B no hydrogen 2.804 N/A ARG 240.A N ILE 249.A O.A no hydrogen 2.801 N/A ARG 240.A N ILE 249.A O.B no hydrogen 2.836 N/A ARG 240.A NH1 ASP 16.A OD1 no hydrogen 2.938 N/A ARG 240.A NH2 GLN 12.A O no hydrogen 3.434 N/A ARG 240.A NH2 GLN 12.A OE1 no hydrogen 2.857 N/A ARG 240.A NH2 ASP 16.A OD1 no hydrogen 2.979 N/A LEU 242.A N LEU 247.A O.A no hydrogen 2.917 N/A LEU 242.A N LEU 247.A O.B no hydrogen 2.934 N/A LEU 245.A N LEU 242.A O no hydrogen 2.838 N/A ALA 246.A N PRO 243.A O no hydrogen 3.108 N/A THR 248.A N THR 167.A O no hydrogen 2.985 N/A ILE 249.A N.A ARG 240.A O no hydrogen 2.925 N/A ILE 249.A N.B ARG 240.A O no hydrogen 2.975 N/A ARG 250.A N VAL 165.A O no hydrogen 2.862 N/A ARG 250.A NE THR 167.A OG1 no hydrogen 2.960 N/A ARG 250.A NH1 LEU 216.A O no hydrogen 3.063 N/A ARG 250.A NH1 SER 239.A OG no hydrogen 2.830 N/A ARG 250.A NH2 LEU 216.A O no hydrogen 2.961 N/A VAL 251.A N SER 238.A O no hydrogen 2.896 N/A LEU 252.A N TYR 163.A O no hydrogen 2.748 N/A SER 253.A N ILE 236.A O no hydrogen 3.000 N/A LYS 255.A N ASP 234.A O no hydrogen 2.916 N/A LYS 255.A NZ GLU 222.A OE1 no hydrogen 2.855 N/A LYS 255.A NZ GLU 222.A OE2 no hydrogen 3.417 N/A