Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6p96_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N GLY 32.A O no hydrogen 2.968 N/A ASN 6.A N THR 34.A O no hydrogen 2.832 N/A LYS 7.A NZ ASN 35.A O no hydrogen 2.576 N/A SER 8.A N ASN 6.A OD1 no hydrogen 3.105 N/A SER 8.A OG ASN 6.A OD1 no hydrogen 2.605 N/A TRP 9.A N ASN 6.A O no hydrogen 3.357 N/A TRP 9.A NE1 GLU 239.A OE2 no hydrogen 2.924 N/A ASN 10.A N LYS 7.A O no hydrogen 2.935 N/A ALA 11.A N SER 8.A O no hydrogen 3.296 N/A HIS 12.A N TRP 9.A O no hydrogen 3.042 N/A HIS 12.A NE2 GLN 238.A OE1 no hydrogen 2.735 N/A THR 14.A N ASN 10.A O no hydrogen 2.856 N/A THR 14.A OG1.A ASN 10.A O no hydrogen 3.128 N/A THR 14.A OG1.A ALA 11.A O no hydrogen 3.041 N/A THR 14.A OG1.B ASN 10.A O no hydrogen 3.111 N/A GLU 15.A N ALA 11.A O no hydrogen 2.969 N/A HIS 16.A N PHE 13.A O no hydrogen 3.087 N/A LYS 17.A N THR 14.A O no hydrogen 2.945 N/A SER 18.A N PHE 13.A O no hydrogen 2.903 N/A SER 18.A OG HIS 16.A O no hydrogen 2.794 N/A VAL 21.A N ASN 216.A O no hydrogen 2.824 N/A VAL 22.A N ASN 35.A OD1 no hydrogen 2.826 N/A VAL 23.A N ALA 214.A O no hydrogen 2.847 N/A LEU 24.A N PHE 33.A O no hydrogen 2.776 N/A TRP 25.A N PHE 212.A O no hydrogen 2.848 N/A ASN 26.A N GLN 31.A O no hydrogen 2.844 N/A GLU 27.A N VAL 210.A O no hydrogen 3.065 N/A ASN 28.A N ASN 209.A OD1 no hydrogen 2.979 N/A ASN 28.A ND2 ASP 208.A O no hydrogen 2.769 N/A LYS 29.A N ASN 26.A OD1 no hydrogen 3.055 N/A GLN 30.A N GLU 27.A O no hydrogen 3.408 N/A GLN 30.A NE2 GLU 27.A O no hydrogen 2.894 N/A GLN 30.A NE2 GLU 27.A OE2 no hydrogen 3.389 N/A GLN 31.A N ASN 26.A O no hydrogen 3.396 N/A GLN 31.A NE2 GLU 2.A OE2 no hydrogen 3.231 N/A GLY 32.A N GLU 2.A O no hydrogen 3.205 N/A PHE 33.A N LEU 24.A O no hydrogen 2.807 N/A THR 34.A N GLN 4.A O no hydrogen 3.021 N/A THR 34.A OG1 VAL 22.A O no hydrogen 2.920 N/A THR 34.A OG1 ASN 36.A O no hydrogen 3.420 N/A ASN 35.A ND2 ASN 10.A OD1 no hydrogen 2.796 N/A ASN 35.A ND2 GLY 20.A O no hydrogen 3.099 N/A ASN 36.A N THR 34.A OG1 no hydrogen 3.269 N/A LEU 37.A N GLU 5.A OE1 no hydrogen 2.864 N/A ARG 39.A N ASN 36.A OD1 no hydrogen 2.862 N/A ARG 39.A NE ASN 216.A OD1 no hydrogen 2.891 N/A ARG 39.A NH1 ASN 216.A OD1 no hydrogen 3.028 N/A ARG 39.A NH1 ASP 218.A OD1 no hydrogen 3.109 N/A ARG 39.A NH2 ASP 218.A OD1 no hydrogen 3.039 N/A ALA 40.A N ASN 36.A O no hydrogen 2.965 N/A ASN 41.A N LYS 38.A O no hydrogen 3.087 N/A GLN 42.A N ARG 39.A O no hydrogen 3.004 N/A PHE 44.A N ILE 142.A O no hydrogen 2.880 N/A ALA 47.A N TRP 135.A O no hydrogen 3.057 N/A SER 48.A OG SER 96.A OG.B no hydrogen 2.923 N/A THR 49.A N PRO 46.A O no hydrogen 3.132 N/A THR 49.A OG1 PRO 46.A O no hydrogen 2.716 N/A PHE 50.A N ALA 47.A O no hydrogen 2.901 N/A LYS 51.A N SER 48.A O no hydrogen 2.954 N/A LYS 51.A NZ SER 96.A OG.B no hydrogen 3.132 N/A ILE 52.A N THR 49.A O no hydrogen 3.191 N/A ASN 54.A N PHE 50.A O no hydrogen 2.953 N/A ASN 54.A ND2 TYR 101.A O no hydrogen 3.406 N/A SER 55.A N LYS 51.A O no hydrogen 2.897 N/A SER 55.A OG LYS 51.A O no hydrogen 2.628 N/A SER 55.A OG TYR 101.A OH no hydrogen 2.674 N/A LEU 56.A N ILE 52.A O no hydrogen 3.129 N/A ILE 57.A N PRO 53.A O no hydrogen 2.988 N/A ALA 58.A N ASN 54.A O no hydrogen 2.949 N/A LEU 59.A N SER 55.A O no hydrogen 2.982 N/A ASP 60.A N LEU 56.A O no hydrogen 2.911 N/A LEU 61.A N ILE 57.A O no hydrogen 2.993 N/A GLY 62.A N LEU 59.A O no hydrogen 3.024 N/A VAL 64.A N ALA 58.A O no hydrogen 3.078 N/A LYS 65.A N GLN 69.A OE1 no hydrogen 2.704 N/A GLU 67.A N GLU 67.A OE2 no hydrogen 2.703 N/A HIS 68.A N ASP 66.A OD1 no hydrogen 2.886 N/A GLN 69.A N ASP 66.A O no hydrogen 3.433 N/A GLN 69.A N ASP 66.A OD1 no hydrogen 3.066 N/A PHE 71.A N HIS 87.A O no hydrogen 2.671 N/A LYS 72.A NZ ASP 86.A OD2 no hydrogen 2.772 N/A TRP 73.A N ASP 86.A OD1 no hydrogen 2.909 N/A TRP 73.A NE1 GLN 76.A O no hydrogen 2.779 N/A GLN 76.A N ASP 74.A OD1 no hydrogen 3.097 N/A ARG 78.A N ASN 84.A OD1 no hydrogen 2.859 N/A ARG 78.A NH1 ASP 74.A OD1 no hydrogen 3.569 N/A ARG 78.A NH1 ASP 74.A OD2 no hydrogen 2.780 N/A ARG 78.A NH2 ASP 74.A OD1 no hydrogen 2.958 N/A TRP 83.A N ILE 80.A O no hydrogen 3.013 N/A TRP 83.A NE1 TYR 95.A O no hydrogen 3.108 N/A ASN 84.A N ALA 81.A O no hydrogen 2.966 N/A ASN 84.A ND2 ARG 78.A O no hydrogen 3.042 N/A HIS 87.A N PHE 71.A O no hydrogen 3.156 N/A HIS 87.A ND1 THR 91.A OG1 no hydrogen 2.850 N/A HIS 87.A NE2 THR 82.A O no hydrogen 2.777 N/A ASN 88.A N THR 91.A OG1 no hydrogen 2.996 N/A THR 91.A N ASN 88.A OD1 no hydrogen 2.929 N/A THR 91.A OG1 HIS 87.A ND1 no hydrogen 2.850 N/A THR 91.A OG1 ASN 88.A O no hydrogen 3.375 N/A THR 91.A OG1 ASN 88.A OD1 no hydrogen 3.369 N/A ALA 92.A N ASN 88.A O no hydrogen 2.816 N/A MET 93.A N LEU 89.A O no hydrogen 3.033 N/A LYS 94.A N ILE 90.A O no hydrogen 2.943 N/A LYS 94.A NZ TYR 95.A OH no hydrogen 3.510 N/A TYR 95.A N THR 91.A O no hydrogen 2.891 N/A SER 96.A N MET 93.A O no hydrogen 3.151 N/A SER 96.A OG.B SER 48.A OG no hydrogen 2.923 N/A VAL 97.A N ALA 92.A O no hydrogen 2.916 N/A VAL 100.A N VAL 97.A O no hydrogen 3.163 N/A TYR 101.A OH SER 55.A OG no hydrogen 2.674 N/A GLN 102.A N VAL 98.A O no hydrogen 2.838 N/A GLN 102.A NE2 ASP 132.A O no hydrogen 2.820 N/A GLU 103.A N PRO 99.A O no hydrogen 3.144 N/A PHE 104.A N VAL 100.A O no hydrogen 3.171 N/A ALA 105.A N TYR 101.A O no hydrogen 3.044 N/A ARG 106.A N GLN 102.A O no hydrogen 3.061 N/A ARG 106.A NE GLU 103.A OE1 no hydrogen 3.285 N/A ARG 106.A NH1 ASP 132.A OD2 no hydrogen 2.923 N/A ARG 106.A NH2 GLU 103.A OE1 no hydrogen 2.798 N/A GLN 107.A N GLU 103.A O no hydrogen 3.217 N/A ILE 108.A N PHE 104.A O no hydrogen 2.810 N/A GLY 109.A N ALA 105.A O no hydrogen 2.888 N/A ARG 112.A NE ILE 108.A O no hydrogen 2.941 N/A ARG 112.A NH1 GLN 107.A O no hydrogen 2.956 N/A ARG 112.A NH1 ILE 108.A O no hydrogen 3.318 N/A MET 113.A N GLY 109.A O no hydrogen 2.909 N/A SER 114.A N GLU 110.A O no hydrogen 2.815 N/A LYS 115.A N ALA 111.A O no hydrogen 3.046 N/A MET 116.A N ARG 112.A O no hydrogen 2.964 N/A LEU 117.A N MET 113.A O no hydrogen 3.036 N/A HIS 118.A N SER 114.A O no hydrogen 2.973 N/A ALA 119.A N LYS 115.A O no hydrogen 2.970 N/A PHE 120.A N MET 116.A O no hydrogen 2.850 N/A ASP 121.A N HIS 118.A O no hydrogen 3.122 N/A TYR 122.A N LEU 117.A O no hydrogen 3.052 N/A ASN 124.A N ARG 141.A O no hydrogen 2.945 N/A ASN 124.A ND2 GLY 139.A O no hydrogen 3.009 N/A GLU 125.A N TYR 122.A O no hydrogen 2.916 N/A ASP 126.A N ASN 124.A OD1 no hydrogen 3.229 N/A SER 128.A N ASP 126.A OD1 no hydrogen 2.888 N/A ASN 130.A ND2 SER 133.A OG no hydrogen 3.357 N/A SER 133.A N ASN 130.A O no hydrogen 3.077 N/A SER 133.A OG ASP 137.A OD1 no hydrogen 2.817 N/A LEU 136.A N SER 133.A O no hydrogen 2.733 N/A ASP 137.A N SER 133.A O no hydrogen 2.958 N/A GLY 138.A N PHE 134.A O no hydrogen 2.934 N/A GLY 139.A N SER 128.A O no hydrogen 2.875 N/A ARG 141.A N ASN 124.A OD1 no hydrogen 3.004 N/A ARG 141.A NH1 GLY 138.A O no hydrogen 2.845 N/A ARG 141.A NH1 ILE 140.A O no hydrogen 2.789 N/A ARG 141.A NH2 GLY 138.A O no hydrogen 3.547 N/A ILE 142.A N PHE 44.A O no hydrogen 2.838 N/A SER 143.A N GLU 146.A OE1 no hydrogen 2.972 N/A SER 143.A OG THR 145.A OG1 no hydrogen 3.215 N/A THR 145.A N ALA 40.A O no hydrogen 3.091 N/A THR 145.A OG1 ASN 41.A OD1 no hydrogen 2.871 N/A THR 145.A OG1 SER 143.A OG no hydrogen 3.215 N/A GLU 146.A N SER 143.A OG no hydrogen 3.076 N/A GLN 147.A N SER 143.A O no hydrogen 2.854 N/A GLN 147.A NE2 THR 49.A OG1 no hydrogen 3.023 N/A ILE 148.A N ALA 144.A O no hydrogen 3.125 N/A SER 149.A N THR 145.A O no hydrogen 3.047 N/A SER 149.A OG THR 145.A O no hydrogen 3.269 N/A PHE 150.A N GLU 146.A O no hydrogen 3.072 N/A LEU 151.A N GLN 147.A O no hydrogen 2.842 N/A ARG 152.A N ILE 148.A O no hydrogen 2.871 N/A ARG 152.A NE GLU 27.A OE2 no hydrogen 2.741 N/A ARG 152.A NH1 GLU 27.A OE1 no hydrogen 3.182 N/A LYS 153.A N SER 149.A O no hydrogen 3.328 N/A LEU 154.A N PHE 150.A O no hydrogen 3.091 N/A TYR 155.A N LEU 151.A O no hydrogen 2.836 N/A HIS 156.A N ARG 152.A O no hydrogen 3.089 N/A HIS 156.A NE2 GLU 27.A OE1 no hydrogen 2.798 N/A ASN 157.A N LEU 154.A O no hydrogen 3.016 N/A LYS 158.A N LYS 153.A O no hydrogen 2.817 N/A LEU 159.A N GLN 166.A OE1 no hydrogen 3.080 N/A VAL 161.A N LEU 159.A O no hydrogen 2.814 N/A SER 162.A N ASP 60.A OD1 no hydrogen 2.878 N/A SER 162.A OG SER 165.A OG no hydrogen 2.773 N/A ARG 164.A NH1 LYS 65.A O no hydrogen 2.791 N/A SER 165.A N SER 162.A OG no hydrogen 2.966 N/A SER 165.A OG SER 162.A OG no hydrogen 2.773 N/A GLN 166.A N SER 162.A O no hydrogen 3.282 N/A GLN 166.A NE2 LEU 159.A O no hydrogen 3.323 N/A GLN 166.A NE2 SER 162.A O no hydrogen 3.273 N/A ARG 167.A N GLU 163.A O no hydrogen 2.921 N/A ARG 167.A NE GLU 163.A OE2 no hydrogen 2.833 N/A ARG 167.A NH2 GLU 163.A OE2 no hydrogen 3.208 N/A ILE 168.A N ARG 164.A O no hydrogen 2.959 N/A VAL 169.A N SER 165.A O no hydrogen 3.060 N/A LYS 170.A N GLN 166.A O no hydrogen 2.988 N/A LYS 170.A NZ LEU 154.A O no hydrogen 3.000 N/A LYS 170.A NZ TYR 155.A O no hydrogen 3.023 N/A LYS 170.A NZ ASN 157.A OD1 no hydrogen 2.705 N/A GLN 171.A N ARG 167.A O no hydrogen 2.981 N/A ALA 172.A N ILE 168.A O no hydrogen 2.937 N/A MET 173.A N VAL 169.A O no hydrogen 2.860 N/A LEU 174.A N GLN 171.A O no hydrogen 3.044 N/A THR 175.A N ILE 183.A O no hydrogen 2.932 N/A THR 175.A OG1 MET 173.A O no hydrogen 3.029 N/A THR 175.A OG1 ALA 185.A O no hydrogen 3.389 N/A GLU 176.A N ILE 183.A O no hydrogen 3.244 N/A ASN 178.A N TYR 181.A O no hydrogen 2.967 N/A ASP 180.A N ASN 178.A OD1 no hydrogen 2.647 N/A TYR 181.A N ASN 178.A OD1 no hydrogen 2.930 N/A TYR 181.A OH GLU 176.A OE2 no hydrogen 2.914 N/A ILE 182.A N GLU 205.A O no hydrogen 3.123 N/A ILE 183.A N GLU 176.A O no hydrogen 2.742 N/A ARG 184.A N TRP 203.A O no hydrogen 3.090 N/A ARG 184.A NE GLU 205.A OE1 no hydrogen 2.837 N/A ARG 184.A NH1 LYS 170.A O no hydrogen 2.958 N/A ALA 185.A N MET 173.A O no hydrogen 2.920 N/A LYS 186.A N VAL 201.A O no hydrogen 2.859 N/A LYS 186.A NZ SER 96.A OG.A no hydrogen 2.769 N/A LYS 186.A NZ SER 96.A OG.B no hydrogen 2.941 N/A LYS 186.A NZ THR 187.A O no hydrogen 2.915 N/A GLY 188.A N TRP 199.A O no hydrogen 3.059 N/A SER 190.A N ILE 197.A O no hydrogen 2.876 N/A ARG 192.A NH1 ASP 137.A OD2 no hydrogen 2.881 N/A ILE 197.A N SER 190.A O no hydrogen 3.080 N/A GLY 198.A N MET 217.A O no hydrogen 2.850 N/A TRP 199.A N GLY 188.A O no hydrogen 2.751 N/A TRP 199.A NE1 LEU 45.A O no hydrogen 2.758 N/A TRP 200.A N MET 215.A O no hydrogen 3.009 N/A VAL 201.A N LYS 186.A O no hydrogen 3.128 N/A GLY 202.A N PHE 213.A O no hydrogen 2.936 N/A TRP 203.A N ARG 184.A O no hydrogen 2.824 N/A TRP 203.A NE1 GLU 205.A OE1 no hydrogen 2.993 N/A VAL 204.A N TRP 211.A O no hydrogen 2.776 N/A GLU 205.A N ILE 182.A O no hydrogen 2.730 N/A LEU 206.A N ASN 209.A O no hydrogen 2.927 N/A ASN 209.A ND2 ASN 26.A OD1 no hydrogen 2.872 N/A VAL 210.A N ASN 209.A OD1 no hydrogen 2.844 N/A TRP 211.A N VAL 204.A O no hydrogen 2.944 N/A PHE 212.A N TRP 25.A O no hydrogen 2.921 N/A PHE 213.A N GLY 202.A O no hydrogen 2.838 N/A ALA 214.A N VAL 23.A O no hydrogen 2.973 N/A MET 215.A N TRP 200.A O no hydrogen 2.846 N/A ASN 216.A N VAL 21.A O no hydrogen 3.058 N/A MET 217.A N GLY 198.A O no hydrogen 2.940 N/A ASP 218.A N GLN 19.A O no hydrogen 2.873 N/A MET 219.A N LYS 196.A O no hydrogen 3.012 N/A ASP 223.A N THR 221.A OG1 no hydrogen 3.153 N/A LEU 225.A N SER 222.A O no hydrogen 3.434 N/A LEU 227.A N GLY 224.A O no hydrogen 2.893 N/A ARG 228.A N LEU 225.A O no hydrogen 3.109 N/A ARG 228.A NE LEU 225.A O no hydrogen 2.815 N/A ARG 228.A NH2 GLY 188.A O no hydrogen 2.912 N/A GLN 229.A N GLN 229.A OE1 no hydrogen 2.804 N/A ALA 230.A N GLY 226.A O no hydrogen 3.121 N/A ILE 231.A N LEU 227.A O no hydrogen 2.910 N/A THR 232.A N ARG 228.A O no hydrogen 3.398 N/A THR 232.A OG1 ARG 228.A O no hydrogen 2.705 N/A LYS 233.A N GLN 229.A O no hydrogen 2.849 N/A LYS 233.A NZ GLU 176.A OE1 no hydrogen 2.478 N/A LYS 233.A NZ GLU 176.A OE2 no hydrogen 3.519 N/A GLU 234.A N ALA 230.A O no hydrogen 2.958 N/A VAL 235.A N ILE 231.A O no hydrogen 2.995 N/A LEU 236.A N THR 232.A O no hydrogen 2.872 N/A LYS 237.A N LYS 233.A O no hydrogen 2.927 N/A LYS 237.A NZ PRO 243.A O no hydrogen 3.429 N/A GLN 238.A N GLU 234.A O no hydrogen 2.924 N/A GLN 238.A NE2 SER 8.A OG no hydrogen 2.759 N/A GLU 239.A N VAL 235.A O no hydrogen 2.981 N/A LYS 240.A N LYS 237.A O no hydrogen 3.013 N/A ILE 241.A N LEU 236.A O no hydrogen 2.847 N/A