Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2q61_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 GLN 199.A OE1 no hydrogen 2.841 N/A ARG 4.A NH2 GLN 199.A OE1 no hydrogen 3.185 N/A ALA 5.A N ASP 2.A OD2 no hydrogen 3.336 N/A LEU 6.A N ASP 2.A O no hydrogen 3.150 N/A ALA 7.A N LEU 3.A O no hydrogen 2.967 N/A LYS 8.A N ARG 4.A O no hydrogen 3.010 N/A HIS 9.A N ALA 5.A O no hydrogen 2.836 N/A HIS 9.A NE2 SER 81.A O no hydrogen 2.552 N/A LEU 10.A N LEU 6.A O no hydrogen 2.988 N/A TYR 11.A N ALA 7.A O no hydrogen 3.057 N/A ASP 12.A N LYS 8.A O no hydrogen 2.823 N/A SER 13.A N HIS 9.A O no hydrogen 3.036 N/A SER 13.A OG HIS 9.A O no hydrogen 2.777 N/A TYR 14.A N LEU 10.A O no hydrogen 2.892 N/A TYR 14.A OH ASP 160.A OD2 no hydrogen 2.668 N/A ILE 15.A N TYR 11.A O no hydrogen 2.926 N/A LYS 16.A N ASP 12.A O no hydrogen 2.898 N/A LYS 16.A NZ GLU 77.A OE2 no hydrogen 3.347 N/A SER 17.A N SER 13.A O no hydrogen 2.950 N/A SER 17.A N TYR 14.A O no hydrogen 3.234 N/A SER 17.A OG SER 13.A O no hydrogen 2.707 N/A PHE 18.A N TYR 14.A O no hydrogen 3.051 N/A LYS 22.A N ASP 160.A OD2 no hydrogen 2.885 N/A LYS 22.A NZ LEU 158.A O no hydrogen 2.727 N/A ALA 23.A N ASP 160.A OD1 no hydrogen 2.997 N/A LYS 24.A N THR 21.A OG1 no hydrogen 3.190 N/A ALA 25.A N THR 21.A O no hydrogen 2.926 N/A ARG 26.A N LYS 22.A O no hydrogen 2.781 N/A ARG 26.A NH1 MET 113.A O no hydrogen 3.465 N/A ARG 26.A NH2 SER 111.A O no hydrogen 2.946 N/A ARG 26.A NH2 MET 113.A O no hydrogen 3.002 N/A ALA 27.A N ALA 23.A O no hydrogen 3.011 N/A ILE 28.A N LYS 24.A O no hydrogen 2.892 N/A LEU 29.A N ALA 25.A O no hydrogen 2.946 N/A THR 30.A N ARG 26.A O no hydrogen 2.984 N/A THR 30.A OG1 ARG 26.A O no hydrogen 2.787 N/A GLY 31.A N ILE 28.A O no hydrogen 3.404 N/A LYS 32.A N ALA 27.A O no hydrogen 2.997 N/A THR 34.A OG1 ASP 35.A OD2 no hydrogen 2.616 N/A ASP 35.A N LYS 32.A O no hydrogen 3.301 N/A PHE 39.A N GLN 124.A O no hydrogen 3.095 N/A ILE 41.A N PHE 126.A O no hydrogen 2.830 N/A TYR 42.A N SER 46.A OG no hydrogen 2.838 N/A ASP 43.A N SER 46.A OG no hydrogen 3.030 N/A SER 46.A N ASP 43.A OD1 no hydrogen 2.891 N/A SER 46.A OG ASP 43.A O no hydrogen 3.065 N/A SER 46.A OG ASP 43.A OD1 no hydrogen 3.075 N/A LEU 47.A N ASP 43.A O no hydrogen 2.794 N/A MET 48.A N MET 44.A O no hydrogen 3.167 N/A MET 49.A N ASN 45.A O no hydrogen 3.209 N/A GLY 50.A N SER 46.A O no hydrogen 2.638 N/A GLU 51.A N LEU 47.A O no hydrogen 2.826 N/A LYS 53.A N GLY 50.A O no hydrogen 3.246 N/A ARG 59.A N GLU 55.A O no hydrogen 3.000 N/A ILE 60.A N VAL 56.A O no hydrogen 2.918 N/A PHE 61.A N ALA 57.A O no hydrogen 3.124 N/A GLN 62.A N ILE 58.A O no hydrogen 2.818 N/A GLY 63.A N ARG 59.A O no hydrogen 2.944 N/A CYS 64.A N ILE 60.A O no hydrogen 2.957 N/A GLN 65.A N PHE 61.A O no hydrogen 3.169 N/A PHE 66.A N GLN 62.A O no hydrogen 3.057 N/A ARG 67.A N GLY 63.A O no hydrogen 3.035 N/A ARG 67.A NE.A ARG 67.A O no hydrogen 2.776 N/A ARG 67.A NH2.A GLU 74.A OE1 no hydrogen 2.555 N/A ARG 67.A NH2.A GLU 74.A OE2 no hydrogen 3.104 N/A SER 68.A N CYS 64.A O no hydrogen 2.978 N/A SER 68.A OG CYS 64.A O no hydrogen 2.908 N/A VAL 69.A N GLN 65.A O no hydrogen 3.091 N/A VAL 69.A N PHE 66.A O no hydrogen 3.232 N/A GLU 70.A N PHE 66.A O no hydrogen 3.397 N/A ALA 71.A N ARG 67.A O no hydrogen 2.854 N/A VAL 72.A N SER 68.A O no hydrogen 2.929 N/A GLN 73.A N VAL 69.A O no hydrogen 3.143 N/A GLU 74.A N GLU 70.A O no hydrogen 2.984 N/A ILE 75.A N ALA 71.A O no hydrogen 2.918 N/A THR 76.A N VAL 72.A O no hydrogen 2.931 N/A THR 76.A OG1 VAL 72.A O no hydrogen 2.804 N/A GLU 77.A N GLN 73.A O no hydrogen 3.029 N/A TYR 78.A N GLU 74.A O no hydrogen 2.916 N/A TYR 78.A OH ALA 164.A O no hydrogen 2.397 N/A ALA 79.A N ILE 75.A O no hydrogen 2.839 N/A LYS 80.A N THR 76.A O no hydrogen 3.271 N/A SER 81.A N TYR 78.A O no hydrogen 2.982 N/A SER 81.A OG.A TYR 78.A O no hydrogen 2.519 N/A ILE 82.A N ALA 79.A O no hydrogen 3.077 N/A PHE 85.A N ILE 82.A O no hydrogen 2.855 N/A ASN 87.A N GLY 84.A O no hydrogen 3.157 N/A LEU 88.A N PHE 85.A O no hydrogen 3.201 N/A ASN 91.A N ASP 89.A OD2 no hydrogen 2.886 N/A ASN 91.A ND2 ASP 89.A OD2 no hydrogen 2.885 N/A GLN 93.A N ASP 89.A O no hydrogen 2.983 N/A GLN 93.A NE2 VAL 86.A O no hydrogen 2.964 N/A GLN 93.A NE2 LEU 88.A O no hydrogen 2.603 N/A VAL 94.A N LEU 90.A O no hydrogen 3.172 N/A THR 95.A N ASN 91.A O no hydrogen 2.970 N/A THR 95.A OG1 ASN 91.A O no hydrogen 3.136 N/A LEU 96.A N ASP 92.A O no hydrogen 2.892 N/A LEU 97.A N GLN 93.A O no hydrogen 3.214 N/A LYS 98.A N VAL 94.A O no hydrogen 2.845 N/A LYS 98.A NZ ILE 251.A O no hydrogen 3.092 N/A LYS 98.A NZ LYS 253.A O no hydrogen 2.587 N/A TYR 99.A N THR 95.A O no hydrogen 3.119 N/A GLY 100.A N LEU 96.A O no hydrogen 2.933 N/A GLY 100.A N LEU 97.A O no hydrogen 3.298 N/A VAL 101.A N LEU 97.A O no hydrogen 3.138 N/A ILE 104.A N GLY 100.A O no hydrogen 3.040 N/A ILE 105.A N VAL 101.A O no hydrogen 2.866 N/A TYR 106.A N HIS 102.A O no hydrogen 2.958 N/A THR 107.A N GLU 103.A O no hydrogen 3.064 N/A THR 107.A OG1 GLU 103.A O no hydrogen 2.771 N/A MET 108.A N ILE 104.A O no hydrogen 2.953 N/A LEU 109.A N ILE 105.A O no hydrogen 2.753 N/A ALA 110.A N TYR 106.A O no hydrogen 3.290 N/A SER 111.A N MET 108.A O no hydrogen 3.141 N/A LEU 112.A N LEU 109.A O no hydrogen 2.844 N/A MET 113.A N ALA 110.A O no hydrogen 3.085 N/A ASN 114.A N GLY 117.A O no hydrogen 3.129 N/A ASP 116.A N ASN 114.A OD1 no hydrogen 2.868 N/A GLY 117.A N ASN 114.A OD1 no hydrogen 3.106 N/A VAL 118.A N MET 127.A O no hydrogen 2.934 N/A LEU 119.A N LEU 112.A O no hydrogen 2.802 N/A ILE 120.A N GLY 125.A O no hydrogen 2.849 N/A SER 121.A OG.B GLN 124.A OE1 no hydrogen 2.721 N/A GLN 124.A N SER 121.A O no hydrogen 2.982 N/A GLY 125.A N ILE 120.A O no hydrogen 3.125 N/A PHE 126.A N PHE 39.A O no hydrogen 2.853 N/A MET 127.A N VAL 118.A O no hydrogen 2.887 N/A THR 128.A N ILE 41.A O no hydrogen 3.007 N/A ARG 129.A N ASP 116.A O no hydrogen 2.773 N/A ARG 129.A NE GLU 144.A OE1 no hydrogen 2.967 N/A ARG 129.A NE GLU 144.A OE2 no hydrogen 3.317 N/A ARG 129.A NH1 LYS 115.A O no hydrogen 3.040 N/A ARG 129.A NH2 GLU 144.A OE2 no hydrogen 2.989 N/A PHE 131.A N THR 128.A OG1 no hydrogen 3.253 N/A LEU 132.A N THR 128.A O no hydrogen 3.324 N/A LYS 133.A N ARG 129.A O no hydrogen 3.032 N/A SER 134.A N PHE 131.A O no hydrogen 3.029 N/A SER 134.A OG PHE 131.A O no hydrogen 2.522 N/A LEU 135.A N LEU 132.A O no hydrogen 3.382 N/A ARG 136.A NH1 GLU 55.A OE1 no hydrogen 3.034 N/A ARG 136.A NH2 GLU 239.A OE1 no hydrogen 2.755 N/A ARG 136.A NH2 GLU 239.A OE2 no hydrogen 3.103 N/A PHE 139.A N ARG 136.A O no hydrogen 2.724 N/A LYS 146.A N MET 143.A O no hydrogen 2.874 N/A LYS 146.A NZ PHE 142.A O no hydrogen 2.874 N/A PHE 147.A N MET 143.A O no hydrogen 3.050 N/A GLU 148.A N GLU 144.A O no hydrogen 2.977 N/A PHE 149.A N PRO 145.A O no hydrogen 3.098 N/A ALA 150.A N LYS 146.A O no hydrogen 2.843 N/A VAL 151.A N PHE 147.A O no hydrogen 3.036 N/A LYS 152.A N GLU 148.A O no hydrogen 3.522 N/A PHE 153.A N PHE 149.A O no hydrogen 2.783 N/A ASN 154.A N ALA 150.A O no hydrogen 2.740 N/A ASN 154.A ND2 ALA 110.A O no hydrogen 2.981 N/A ALA 155.A N LYS 152.A O no hydrogen 3.142 N/A LEU 156.A N PHE 153.A O no hydrogen 3.091 N/A GLU 157.A N ASN 154.A O no hydrogen 3.049 N/A ASP 159.A N ASP 162.A OD2 no hydrogen 3.000 N/A SER 161.A OG ASP 159.A OD1 no hydrogen 2.652 N/A ASP 162.A N ASP 159.A OD1 no hydrogen 3.132 N/A LEU 163.A N ASP 159.A O no hydrogen 2.882 N/A ALA 164.A N ASP 160.A O no hydrogen 2.906 N/A PHE 166.A N ASP 162.A O no hydrogen 3.130 N/A ILE 167.A N LEU 163.A O no hydrogen 2.900 N/A ALA 168.A N ALA 164.A O no hydrogen 3.420 N/A VAL 169.A N ILE 165.A O no hydrogen 2.978 N/A ILE 170.A N PHE 166.A O no hydrogen 3.035 N/A ILE 171.A N ILE 167.A O no hydrogen 3.169 N/A LEU 172.A N ALA 168.A O no hydrogen 3.074 N/A SER 173.A OG ILE 170.A O no hydrogen 2.795 N/A ARG 176.A N SER 173.A O no hydrogen 3.480 N/A ARG 176.A NH1 GLU 103.A OE1 no hydrogen 3.566 N/A ARG 176.A NH1 GLU 103.A OE2 no hydrogen 2.987 N/A ARG 176.A NH2 GLU 103.A OE1 no hydrogen 2.796 N/A ARG 176.A NH2 ILE 170.A O no hydrogen 3.331 N/A LEU 180.A N ASP 92.A OD1 no hydrogen 2.917 N/A ASN 181.A N ASP 92.A OD2 no hydrogen 2.938 N/A GLU 186.A N VAL 182.A O no hydrogen 3.049 N/A ASP 187.A N LYS 183.A O no hydrogen 2.878 N/A ILE 188.A N PRO 184.A O no hydrogen 3.173 N/A GLN 189.A N ILE 185.A O no hydrogen 2.894 N/A GLN 189.A NE2 VAL 169.A O no hydrogen 2.785 N/A ASP 190.A N GLU 186.A O no hydrogen 2.883 N/A ASN 191.A N ASP 187.A O no hydrogen 3.493 N/A LEU 192.A N ILE 188.A O no hydrogen 3.067 N/A LEU 193.A N GLN 189.A O no hydrogen 2.675 N/A GLN 194.A N ASP 190.A O no hydrogen 2.970 N/A GLN 194.A NE2 ASP 190.A O no hydrogen 3.692 N/A GLN 194.A NE2 ASP 190.A OD1 no hydrogen 2.580 N/A ALA 195.A N ASN 191.A O no hydrogen 2.965 N/A LEU 196.A N LEU 192.A O no hydrogen 2.867 N/A GLU 197.A N LEU 193.A O no hydrogen 2.880 N/A LEU 198.A N GLN 194.A O no hydrogen 3.070 N/A GLN 199.A N ALA 195.A O no hydrogen 2.888 N/A GLN 199.A NE2 ASP 162.A OD1 no hydrogen 2.974 N/A LEU 200.A N LEU 196.A O no hydrogen 2.996 N/A LYS 201.A N GLU 197.A O no hydrogen 3.023 N/A LYS 201.A NZ GLU 197.A OE2 no hydrogen 3.424 N/A LEU 202.A N LEU 198.A O no hydrogen 3.010 N/A ASN 203.A N GLN 199.A O no hydrogen 2.841 N/A ASN 203.A ND2 ASP 159.A OD1 no hydrogen 3.364 N/A ASN 203.A ND2 ASP 159.A OD2 no hydrogen 2.868 N/A ASN 203.A ND2 ASP 162.A OD1 no hydrogen 2.685 N/A ASN 203.A ND2 ASP 162.A OD2 no hydrogen 3.120 N/A HIS 204.A N LEU 200.A O no hydrogen 2.747 N/A HIS 204.A NE2 ASP 162.A OD2 no hydrogen 2.585 N/A SER 207.A N HIS 204.A O no hydrogen 3.079 N/A LEU 210.A N SER 207.A O no hydrogen 3.386 N/A LYS 213.A N GLN 209.A O no hydrogen 2.815 N/A LEU 214.A N LEU 210.A O no hydrogen 2.820 N/A LEU 215.A N PHE 211.A O no hydrogen 3.063 N/A GLN 216.A N ALA 212.A O no hydrogen 2.975 N/A LYS 217.A N LEU 214.A O no hydrogen 2.991 N/A MET 218.A N LEU 215.A O no hydrogen 3.065 N/A THR 219.A N GLN 216.A O no hydrogen 3.095 N/A LEU 221.A N LYS 217.A O no hydrogen 3.038 N/A ARG 222.A N MET 218.A O no hydrogen 3.138 N/A ARG 222.A NE GLU 103.A OE2 no hydrogen 2.737 N/A GLN 223.A N THR 219.A O no hydrogen 3.192 N/A ILE 224.A N ASP 220.A O no hydrogen 2.984 N/A VAL 225.A N LEU 221.A O no hydrogen 3.283 N/A THR 226.A N ARG 222.A O no hydrogen 3.013 N/A THR 226.A OG1 ARG 222.A O no hydrogen 3.176 N/A GLU 227.A N GLN 223.A O no hydrogen 2.855 N/A HIS 228.A N ILE 224.A O no hydrogen 2.826 N/A VAL 229.A N VAL 225.A O no hydrogen 2.938 N/A GLN 230.A N THR 226.A O no hydrogen 3.164 N/A LEU 231.A N GLU 227.A O no hydrogen 2.903 N/A LEU 232.A N HIS 228.A O no hydrogen 2.884 N/A GLN 233.A N VAL 229.A O no hydrogen 3.161 N/A VAL 234.A N GLN 230.A O no hydrogen 3.073 N/A ILE 235.A N LEU 231.A O no hydrogen 2.874 N/A LYS 236.A N LEU 232.A O no hydrogen 2.813 N/A LYS 237.A N GLN 233.A O no hydrogen 2.805 N/A LYS 237.A NZ GLN 233.A O no hydrogen 3.151 N/A THR 238.A N VAL 234.A O no hydrogen 3.014 N/A THR 238.A N ILE 235.A O no hydrogen 3.311 N/A THR 238.A OG1 VAL 234.A O no hydrogen 2.918 N/A GLU 239.A N ILE 235.A O no hydrogen 2.805 N/A MET 242.A N THR 240.A O no hydrogen 2.680 N/A LEU 247.A N HIS 245.A ND1 no hydrogen 2.979 N/A GLN 249.A N HIS 245.A O no hydrogen 2.859 N/A GLN 249.A NE2 LEU 244.A O no hydrogen 2.719 N/A GLU 250.A N PRO 246.A O no hydrogen 3.094 N/A ILE 251.A N LEU 247.A O no hydrogen 3.212 N/A TYR 252.A N LEU 248.A O no hydrogen 2.946 N/A LYS 253.A N GLN 249.A O no hydrogen 3.087 N/A LEU 255.A N TYR 252.A O no hydrogen 2.824 N/A