Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pct_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASN 1.A OD1 no hydrogen 3.016 N/A VAL 5.A N ASN 1.A O no hydrogen 2.980 N/A GLU 6.A N GLN 2.A O no hydrogen 2.839 N/A GLN 7.A N GLN 3.A O no hydrogen 2.979 N/A ALA 8.A N ALA 4.A O no hydrogen 2.869 N/A ASN 9.A N VAL 5.A O no hydrogen 3.074 N/A ASN 9.A ND2 GLN 230.A OE1 no hydrogen 3.603 N/A GLN 10.A N GLU 6.A O no hydrogen 2.751 N/A ALA 11.A N GLN 7.A O no hydrogen 2.949 N/A LYS 12.A N ALA 8.A O no hydrogen 2.898 N/A LEU 13.A N ASN 9.A O no hydrogen 2.892 N/A GLN 14.A N GLN 10.A O no hydrogen 3.079 N/A GLN 14.A N ALA 11.A O no hydrogen 3.075 N/A GLN 14.A NE2 GLN 10.A OE1 no hydrogen 3.207 N/A GLN 15.A N ALA 11.A O no hydrogen 2.928 N/A GLN 16.A N LYS 12.A O no hydrogen 3.297 N/A VAL 17.A N GLN 14.A O no hydrogen 3.077 N/A ALA 18.A N GLN 15.A O no hydrogen 3.213 N/A LEU 21.A N VAL 17.A O no hydrogen 2.937 N/A ILE 22.A N ALA 18.A O no hydrogen 2.826 N/A TRP 23.A N MET 19.A O no hydrogen 2.842 N/A THR 24.A N GLY 20.A O no hydrogen 2.901 N/A THR 24.A OG1 GLY 20.A O no hydrogen 2.768 N/A GLN 25.A N LEU 21.A O no hydrogen 2.795 N/A GLN 25.A NE2 SER 65.A OG no hydrogen 3.248 N/A GLN 26.A N ILE 22.A O no hydrogen 2.873 N/A SER 27.A N TRP 23.A O no hydrogen 2.964 N/A SER 27.A OG TRP 23.A O no hydrogen 2.537 N/A GLU 29.A N GLU 29.A OE1 no hydrogen 2.749 N/A TYR 30.A N SER 27.A OG no hydrogen 2.902 N/A ALA 32.A N GLY 28.A O no hydrogen 2.930 N/A LEU 33.A N GLU 29.A O no hydrogen 3.031 N/A ALA 34.A N TYR 30.A O no hydrogen 3.082 N/A HIS 35.A N ALA 31.A O no hydrogen 3.110 N/A GLN 36.A N ALA 32.A O no hydrogen 2.828 N/A ALA 37.A N LEU 33.A O no hydrogen 2.954 N/A PHE 38.A N ALA 34.A O no hydrogen 2.968 N/A ASN 39.A N HIS 35.A O no hydrogen 2.826 N/A SER 40.A N GLN 36.A O no hydrogen 3.029 N/A SER 40.A OG.B GLN 36.A O no hydrogen 2.909 N/A ALA 41.A N ALA 37.A O no hydrogen 2.905 N/A LYS 42.A N PHE 38.A O no hydrogen 2.958 N/A LYS 42.A NZ.B ASP 46.A OD2 no hydrogen 2.782 N/A MET 43.A N ASN 39.A O no hydrogen 3.172 N/A ALA 44.A N SER 40.A O no hydrogen 3.015 N/A PHE 45.A N ALA 41.A O no hydrogen 2.860 N/A ASP 46.A N LYS 42.A O no hydrogen 2.889 N/A HIS 47.A N MET 43.A O no hydrogen 3.145 N/A ALA 48.A N ALA 44.A O no hydrogen 2.990 N/A LYS 50.A NZ GLY 164.A O no hydrogen 2.976 N/A LYS 51.A NZ PHE 45.A O no hydrogen 2.740 N/A LYS 51.A NZ ALA 48.A O no hydrogen 2.781 N/A ALA 52.A N ASP 166.A O no hydrogen 2.956 N/A VAL 53.A N THR 111.A O no hydrogen 2.986 N/A VAL 54.A N LEU 169.A O no hydrogen 2.938 N/A VAL 55.A N PHE 113.A O no hydrogen 2.963 N/A ASP 56.A N VAL 171.A O no hydrogen 3.129 N/A LEU 57.A N ASP 56.A OD1 no hydrogen 2.765 N/A GLU 59.A N ILE 62.A O no hydrogen 2.702 N/A THR 60.A N LEU 57.A O no hydrogen 2.869 N/A THR 60.A OG1 ASP 173.A OD1 no hydrogen 3.123 N/A MET 61.A N LEU 57.A O no hydrogen 2.808 N/A ILE 62.A N LEU 57.A O no hydrogen 3.069 N/A ASP 63.A N ALA 93.A O no hydrogen 2.609 N/A ASN 64.A N GLU 59.A OE1 no hydrogen 2.699 N/A ASN 64.A ND2 ASP 58.A OD1 no hydrogen 2.717 N/A ASN 64.A ND2 GLU 59.A OE2 no hydrogen 2.949 N/A SER 65.A N ASP 63.A OD1 no hydrogen 2.869 N/A SER 65.A OG ASP 63.A OD1 no hydrogen 2.728 N/A TYR 67.A N ASN 64.A O no hydrogen 2.955 N/A TYR 67.A OH THR 82.A OG1 no hydrogen 2.916 N/A GLY 69.A N SER 65.A O no hydrogen 2.904 N/A TRP 70.A N ALA 66.A O no hydrogen 2.944 N/A GLN 71.A N TYR 67.A O no hydrogen 2.985 N/A GLN 71.A NE2 GLN 76.A O no hydrogen 3.448 N/A VAL 72.A N ALA 68.A O no hydrogen 3.014 N/A GLN 73.A N GLY 69.A O no hydrogen 3.040 N/A SER 74.A N TRP 70.A O no hydrogen 2.976 N/A SER 74.A N GLN 71.A O no hydrogen 3.254 N/A SER 74.A OG TRP 70.A O no hydrogen 2.742 N/A SER 79.A OG THR 82.A OG1 no hydrogen 3.063 N/A THR 82.A N SER 79.A OG no hydrogen 3.375 N/A THR 82.A OG1 TYR 67.A OH no hydrogen 2.916 N/A THR 82.A OG1 SER 79.A O no hydrogen 3.372 N/A THR 82.A OG1 SER 79.A OG no hydrogen 3.063 N/A TRP 83.A N SER 79.A O no hydrogen 2.985 N/A THR 84.A N PRO 80.A O no hydrogen 3.066 N/A THR 84.A OG1 PRO 80.A O no hydrogen 3.014 N/A THR 84.A OG1 GLU 123.A OE2 no hydrogen 2.501 N/A LYS 85.A N LYS 81.A O no hydrogen 3.236 N/A TRP 86.A N THR 82.A O no hydrogen 2.888 N/A TRP 86.A NE1 ASN 64.A OD1 no hydrogen 2.858 N/A VAL 87.A N TRP 83.A O no hydrogen 2.836 N/A ASP 88.A N THR 84.A O no hydrogen 2.887 N/A ALA 89.A N TRP 86.A O no hydrogen 3.051 N/A ARG 90.A N VAL 87.A O no hydrogen 3.178 N/A ARG 90.A NE ASP 129.A OD2 no hydrogen 2.856 N/A ARG 90.A NH1 ASP 88.A O no hydrogen 2.647 N/A SER 92.A N ASP 130.A OD2 no hydrogen 3.026 N/A SER 92.A OG ASN 64.A OD1 no hydrogen 3.428 N/A SER 92.A OG ASP 130.A OD2 no hydrogen 3.019 N/A ALA 93.A N ASP 63.A O no hydrogen 3.286 N/A ILE 95.A N MET 61.A O no hydrogen 3.139 N/A ALA 98.A N ILE 95.A O no hydrogen 3.122 N/A PHE 101.A N GLY 97.A O no hydrogen 3.053 N/A SER 102.A N ALA 98.A O no hydrogen 3.051 N/A ASN 103.A N VAL 99.A O no hydrogen 3.015 N/A ASN 103.A ND2 GLY 135.A O no hydrogen 2.978 N/A TYR 104.A N GLU 100.A O no hydrogen 2.840 N/A TYR 104.A OH ASP 46.A OD1 no hydrogen 2.452 N/A TYR 104.A OH ASP 46.A OD2 no hydrogen 3.276 N/A VAL 105.A N PHE 101.A O no hydrogen 2.885 N/A ASN 106.A N SER 102.A O no hydrogen 3.151 N/A ALA 107.A N ASN 103.A O no hydrogen 3.086 N/A ASN 108.A N VAL 105.A O no hydrogen 3.070 N/A ASN 108.A ND2 TYR 104.A O no hydrogen 2.880 N/A GLY 110.A N VAL 105.A O no hydrogen 3.185 N/A THR 111.A N LYS 51.A O no hydrogen 2.907 N/A MET 112.A N ASN 106.A OD1 no hydrogen 3.010 N/A PHE 113.A N VAL 53.A O no hydrogen 2.868 N/A PHE 114.A N THR 143.A O no hydrogen 2.829 N/A VAL 115.A N VAL 55.A O no hydrogen 3.027 N/A SER 116.A N LEU 145.A O no hydrogen 3.127 N/A ASN 117.A ND2 SER 151.A O no hydrogen 2.925 N/A ARG 118.A N SER 116.A OG no hydrogen 3.106 N/A ARG 118.A NE ASP 58.A OD1 no hydrogen 2.831 N/A ARG 118.A NE ASP 58.A OD2 no hydrogen 3.332 N/A ARG 118.A NH1 THR 127.A OG1 no hydrogen 2.941 N/A ARG 118.A NH2 ASP 58.A OD1 no hydrogen 3.276 N/A ARG 118.A NH2 ASN 64.A OD1 no hydrogen 2.943 N/A ARG 118.A NH2 SER 92.A OG no hydrogen 3.073 N/A ARG 119.A N GLU 123.A OE1 no hydrogen 2.782 N/A ARG 119.A NE ASP 121.A OD1 no hydrogen 3.288 N/A ARG 119.A NH2 ASP 121.A OD2 no hydrogen 3.331 N/A ASP 120.A N LYS 147.A O no hydrogen 2.868 N/A GLU 123.A N ARG 119.A O no hydrogen 2.980 N/A LYS 124.A NZ ASP 120.A OD1 no hydrogen 2.968 N/A THR 127.A N GLU 123.A O no hydrogen 3.279 N/A THR 127.A OG1 GLU 123.A O no hydrogen 2.454 N/A VAL 128.A N LYS 124.A O no hydrogen 2.763 N/A ASP 129.A N ALA 125.A O no hydrogen 3.089 N/A ASP 130.A N GLY 126.A O no hydrogen 3.111 N/A MET 131.A N THR 127.A O no hydrogen 3.062 N/A LYS 132.A N VAL 128.A O no hydrogen 3.063 N/A ARG 133.A N ASP 129.A O no hydrogen 2.983 N/A ARG 133.A NH1 SER 92.A O no hydrogen 3.291 N/A ARG 133.A NH2 SER 92.A O no hydrogen 2.728 N/A ARG 133.A NH2 ASP 130.A OD1 no hydrogen 3.014 N/A LEU 134.A N ASP 130.A O no hydrogen 3.020 N/A GLY 135.A N MET 131.A O no hydrogen 3.265 N/A GLY 135.A N LYS 132.A O no hydrogen 3.319 N/A PHE 136.A N MET 131.A O no hydrogen 3.036 N/A THR 137.A N ASN 103.A OD1 no hydrogen 2.920 N/A THR 137.A OG1 ASN 103.A OD1 no hydrogen 3.328 N/A ASN 140.A N THR 143.A OG1 no hydrogen 2.944 N/A LYS 142.A N ASN 140.A OD1 no hydrogen 2.873 N/A LYS 142.A NZ TYR 165.A OH no hydrogen 3.024 N/A THR 143.A N ASN 140.A OD1 no hydrogen 3.113 N/A THR 143.A OG1 GLY 138.A O no hydrogen 2.573 N/A LEU 144.A N ASN 140.A O no hydrogen 3.074 N/A LEU 145.A N PHE 114.A O no hydrogen 2.874 N/A LYS 147.A N ARG 118.A O no hydrogen 2.937 N/A LYS 147.A NZ ASN 117.A O no hydrogen 2.908 N/A ASN 152.A ND2 ASP 180.A OD2 no hydrogen 3.148 N/A LYS 153.A NZ VAL 115.A O no hydrogen 3.072 N/A LYS 153.A NZ ASP 177.A OD1 no hydrogen 2.792 N/A SER 154.A N ASP 180.A OD1 no hydrogen 3.302 N/A SER 154.A OG ASP 180.A OD2 no hydrogen 2.401 N/A ARG 156.A NH1 SER 116.A O no hydrogen 2.783 N/A ARG 156.A NH1 ASN 117.A OD1 no hydrogen 3.281 N/A ARG 156.A NH1 LEU 145.A O no hydrogen 3.317 N/A ARG 156.A NH2 ASN 117.A OD1 no hydrogen 2.768 N/A ARG 156.A NH2 ASN 152.A O no hydrogen 3.392 N/A PHE 157.A N LYS 153.A O no hydrogen 2.790 N/A LYS 158.A N SER 154.A O no hydrogen 3.007 N/A GLN 159.A N VAL 155.A O no hydrogen 3.055 N/A VAL 160.A N ARG 156.A O no hydrogen 3.062 N/A GLU 161.A N PHE 157.A O no hydrogen 3.179 N/A ASP 162.A N LYS 158.A O no hydrogen 2.866 N/A MET 163.A N VAL 160.A O no hydrogen 3.165 N/A GLY 164.A N GLU 161.A O no hydrogen 2.936 N/A TYR 165.A N GLU 161.A O no hydrogen 3.369 N/A ASP 166.A N LYS 50.A O no hydrogen 2.792 N/A VAL 168.A N ALA 52.A O no hydrogen 2.897 N/A PHE 170.A N LYS 204.A O no hydrogen 2.882 N/A VAL 171.A N VAL 54.A O no hydrogen 2.849 N/A GLY 172.A N ILE 206.A O no hydrogen 2.882 N/A ASP 173.A N ASP 177.A OD2 no hydrogen 3.221 N/A ASN 174.A N ASP 177.A OD2 no hydrogen 3.187 N/A ASN 174.A ND2 ASP 215.A OD2 no hydrogen 2.860 N/A ASN 176.A N ASN 174.A OD1 no hydrogen 2.865 N/A ASP 177.A N ASN 174.A O no hydrogen 2.791 N/A PHE 178.A N LEU 175.A O no hydrogen 2.971 N/A GLY 179.A N ASN 176.A O no hydrogen 3.190 N/A THR 182.A OG1 ASN 176.A OD1 no hydrogen 2.911 N/A TYR 183.A N ASP 180.A O no hydrogen 2.923 N/A LYS 185.A N THR 182.A O no hydrogen 3.156 N/A LYS 185.A NZ TYR 183.A O no hydrogen 3.285 N/A SER 186.A N GLU 189.A OE1 no hydrogen 3.129 N/A SER 186.A OG GLU 189.A OE1 no hydrogen 3.000 N/A ASN 187.A N GLY 219.A O no hydrogen 2.910 N/A ASN 187.A ND2 TRP 216.A O no hydrogen 3.078 N/A GLU 189.A N SER 186.A OG no hydrogen 3.192 N/A ARG 190.A N SER 186.A O no hydrogen 2.926 N/A ARG 190.A NH1 ASN 176.A OD1 no hydrogen 2.970 N/A ARG 190.A NH1 THR 182.A O no hydrogen 2.957 N/A ARG 190.A NH2 ASN 174.A OD1 no hydrogen 2.993 N/A ARG 191.A N ASN 187.A O no hydrogen 2.715 N/A ASP 192.A N ALA 188.A O no hydrogen 3.097 N/A ASP 192.A N GLU 189.A O no hydrogen 3.051 N/A PHE 193.A N GLU 189.A O no hydrogen 3.025 N/A VAL 194.A N ARG 190.A O no hydrogen 3.020 N/A ALA 195.A N ARG 191.A O no hydrogen 3.130 N/A LYS 196.A N ASP 192.A O no hydrogen 2.885 N/A ASN 197.A N PHE 193.A O no hydrogen 2.998 N/A ASN 197.A N VAL 194.A O no hydrogen 2.942 N/A ASN 197.A ND2 PHE 193.A O no hydrogen 2.937 N/A SER 198.A N ALA 195.A O no hydrogen 3.258 N/A SER 198.A OG ALA 195.A O no hydrogen 3.548 N/A ALA 200.A N ASN 197.A O no hydrogen 2.755 N/A GLY 202.A N PHE 205.A O no hydrogen 2.755 N/A LYS 203.A N ALA 200.A O no hydrogen 2.940 N/A LYS 204.A N ALA 200.A O no hydrogen 2.970 N/A PHE 205.A N ALA 200.A O no hydrogen 3.299 N/A ILE 206.A N PHE 170.A O no hydrogen 2.778 N/A LEU 208.A N GLY 172.A O no hydrogen 2.821 N/A ASN 210.A ND2 ASP 173.A OD2 no hydrogen 2.690 N/A GLN 212.A N ASN 210.A OD1 no hydrogen 3.066 N/A TYR 213.A N ASN 210.A OD1 no hydrogen 3.329 N/A TYR 213.A OH GLU 59.A OE2 no hydrogen 2.618 N/A GLY 214.A N GLU 217.A OE1.A no hydrogen 3.140 N/A TRP 216.A NE1 TYR 213.A O no hydrogen 3.068 N/A GLU 217.A N GLY 214.A O no hydrogen 2.937 N/A GLY 219.A N ASP 215.A O no hydrogen 2.980 N/A LEU 220.A N GLU 217.A O no hydrogen 3.122 N/A ASP 221.A N GLY 218.A O no hydrogen 3.338 N/A ASN 223.A N ASP 221.A OD2 no hydrogen 2.819 N/A TYR 224.A N ASP 221.A O no hydrogen 3.056 N/A TYR 224.A OH GLU 217.A OE1.B no hydrogen 2.805 N/A LYS 226.A N ASN 223.A O no hydrogen 3.255 N/A SER 229.A N GLU 6.A OE1 no hydrogen 2.793 N/A SER 229.A OG GLU 6.A OE2 no hydrogen 2.890 N/A GLN 230.A NE2 GLN 230.A O no hydrogen 2.877 N/A GLN 230.A NE2 ASP 234.A OD1 no hydrogen 3.011 N/A SER 231.A N ASP 228.A OD1 no hydrogen 2.918 N/A SER 231.A OG ASP 228.A O no hydrogen 2.548 N/A SER 231.A OG ASP 228.A OD1 no hydrogen 3.438 N/A LYS 232.A N ASP 228.A O no hydrogen 3.132 N/A LYS 232.A NZ GLY 227.A O no hydrogen 3.069 N/A LEU 233.A N SER 229.A O no hydrogen 2.956 N/A ASP 234.A N GLN 230.A O no hydrogen 3.057 N/A VAL 235.A N SER 231.A O no hydrogen 2.969 N/A ARG 236.A N LYS 232.A O no hydrogen 2.806 N/A ARG 236.A NE TYR 224.A OH no hydrogen 2.949 N/A ARG 236.A NH1 LEU 13.A O no hydrogen 2.928 N/A ARG 236.A NH1 GLN 16.A OE1 no hydrogen 2.796 N/A ARG 236.A NH2 GLU 217.A OE1.B no hydrogen 3.109 N/A ARG 236.A NH2 TYR 224.A OH no hydrogen 3.545 N/A ALA 237.A N LEU 233.A O no hydrogen 2.834 N/A LYS 238.A N ASP 234.A O no hydrogen 2.936 N/A ALA 239.A N VAL 235.A O no hydrogen 2.978 N/A ALA 239.A N ARG 236.A O no hydrogen 3.096 N/A ILE 240.A N ALA 237.A O no hydrogen 3.326 N/A LYS 246.A N ASP 244.A OD2 no hydrogen 2.785 N/A