Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1x42_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASN 223.A OD1 no hydrogen 2.520 N/A ARG 2.A N GLU 168.A O no hydrogen 2.861 N/A ARG 2.A NE GLU 168.A OE2 no hydrogen 2.800 N/A ARG 2.A NH2 GLY 163.A O no hydrogen 3.080 N/A ARG 2.A NH2 GLU 168.A OE1 no hydrogen 2.877 N/A ARG 2.A NH2 GLU 168.A OE2 no hydrogen 3.403 N/A ALA 3.A N GLU 168.A O no hydrogen 3.249 N/A VAL 4.A N HIS 113.A O no hydrogen 2.889 N/A PHE 5.A N VAL 170.A O no hydrogen 2.787 N/A PHE 6.A N GLY 115.A O no hydrogen 2.740 N/A ASP 7.A N VAL 172.A O no hydrogen 2.933 N/A PHE 8.A N ASP 7.A OD2 no hydrogen 2.778 N/A GLY 10.A N LEU 13.A O no hydrogen 2.949 N/A THR 11.A N PHE 8.A O no hydrogen 3.205 N/A LEU 12.A N PHE 8.A O no hydrogen 2.840 N/A LEU 13.A N PHE 8.A O no hydrogen 3.015 N/A SER 14.A N GLU 96.A O no hydrogen 2.952 N/A SER 14.A OG GLU 16.A OE2 no hydrogen 3.255 N/A VAL 15.A N TYR 98.A OH no hydrogen 3.063 N/A GLU 16.A N GLU 16.A OE2 no hydrogen 2.501 N/A GLY 17.A N SER 14.A OG no hydrogen 2.945 N/A GLU 18.A N SER 14.A O no hydrogen 2.932 N/A ALA 19.A N VAL 15.A O no hydrogen 3.149 N/A LYS 20.A N GLU 16.A O no hydrogen 3.294 N/A THR 21.A N GLY 17.A O no hydrogen 2.887 N/A THR 21.A OG1 GLY 17.A O no hydrogen 3.127 N/A HIS 22.A N GLU 18.A O no hydrogen 2.631 N/A HIS 22.A NE2 GLU 18.A OE1 no hydrogen 2.433 N/A LEU 23.A N ALA 19.A O no hydrogen 2.829 N/A LYS 24.A N LYS 20.A O no hydrogen 2.952 N/A ILE 25.A N THR 21.A O no hydrogen 3.014 N/A GLU 27.A N LYS 24.A O no hydrogen 2.958 N/A VAL 28.A N ILE 25.A O no hydrogen 2.801 N/A GLY 30.A N GLU 26.A O no hydrogen 2.904 N/A TYR 32.A N LEU 29.A O no hydrogen 3.152 N/A TYR 32.A OH TYR 76.A O no hydrogen 2.465 N/A LEU 34.A N TYR 32.A O no hydrogen 2.817 N/A LYS 37.A N ASN 35.A OD1 no hydrogen 3.123 N/A THR 38.A N ASN 35.A O no hydrogen 2.781 N/A LEU 39.A N ASN 35.A O no hydrogen 3.067 N/A LEU 40.A N PRO 36.A O no hydrogen 2.756 N/A ASP 41.A N LYS 37.A O no hydrogen 2.980 N/A GLU 42.A N THR 38.A O no hydrogen 3.129 N/A TYR 43.A N LEU 39.A O no hydrogen 2.891 N/A TYR 43.A OH GLU 66.A OE1 no hydrogen 2.518 N/A GLU 44.A N LEU 40.A O no hydrogen 2.899 N/A LYS 45.A N ASP 41.A O no hydrogen 3.143 N/A LYS 45.A NZ GLU 42.A OE2 no hydrogen 2.508 N/A LEU 46.A N GLU 42.A O no hydrogen 2.917 N/A THR 47.A N TYR 43.A O no hydrogen 2.819 N/A THR 47.A OG1 TYR 43.A O no hydrogen 2.884 N/A THR 47.A OG1 GLU 44.A O no hydrogen 2.998 N/A ARG 48.A N GLU 44.A O no hydrogen 2.766 N/A GLU 49.A N LYS 45.A O no hydrogen 3.011 N/A ALA 50.A N LEU 46.A O no hydrogen 2.957 N/A PHE 51.A N THR 47.A O no hydrogen 2.903 N/A SER 52.A N ARG 48.A O no hydrogen 3.015 N/A ASN 53.A N GLU 49.A O no hydrogen 3.226 N/A TYR 54.A N PHE 51.A O no hydrogen 2.940 N/A ALA 55.A N SER 52.A O no hydrogen 3.245 N/A GLY 56.A N LYS 149.A O no hydrogen 2.931 N/A LYS 57.A N TYR 54.A O no hydrogen 2.964 N/A LYS 57.A NZ ASN 53.A O no hydrogen 2.936 N/A TYR 59.A N GLY 146.A O no hydrogen 2.915 N/A TYR 59.A OH ASP 120.A OD2 no hydrogen 2.593 N/A ARG 60.A NH1 TYR 54.A OH no hydrogen 2.592 N/A ARG 60.A NH1 GLU 68.A OE2 no hydrogen 3.174 N/A ARG 60.A NH2 GLU 68.A OE1 no hydrogen 3.098 N/A ILE 62.A N ASP 120.A OD2 no hydrogen 2.860 N/A ARG 63.A N ASP 120.A OD1 no hydrogen 2.833 N/A ARG 63.A NE GLU 67.A OE1 no hydrogen 2.768 N/A ARG 63.A NH2 GLU 67.A OE1 no hydrogen 3.382 N/A ILE 65.A N PRO 61.A O no hydrogen 3.198 N/A GLU 66.A N ILE 62.A O no hydrogen 2.971 N/A GLU 67.A N ARG 63.A O no hydrogen 2.932 N/A GLU 68.A N ASP 64.A O no hydrogen 3.108 N/A VAL 69.A N ILE 65.A O no hydrogen 3.330 N/A ARG 70.A NH1 GLU 82.A OE1 no hydrogen 3.480 N/A LYS 71.A N GLU 68.A O no hydrogen 2.953 N/A LEU 72.A N VAL 69.A O no hydrogen 2.922 N/A GLU 74.A N ARG 70.A O no hydrogen 3.187 N/A LYS 75.A N LYS 71.A O no hydrogen 2.945 N/A LYS 75.A NZ GLU 42.A OE1 no hydrogen 2.907 N/A TYR 76.A N LEU 72.A O no hydrogen 2.862 N/A TYR 76.A OH GLU 42.A OE1 no hydrogen 3.337 N/A GLY 77.A N ALA 73.A O no hydrogen 2.759 N/A LYS 79.A NZ TYR 80.A O no hydrogen 2.472 N/A ASN 83.A N ASN 83.A OD1 no hydrogen 2.435 N/A PHE 84.A N PRO 81.A O no hydrogen 3.058 N/A GLU 86.A N ASN 83.A O no hydrogen 3.025 N/A ILE 87.A N ASN 83.A O no hydrogen 3.058 N/A HIS 88.A N PHE 84.A O no hydrogen 2.850 N/A HIS 88.A ND1 TYR 123.A OH no hydrogen 2.593 N/A HIS 88.A NE2 GLU 66.A OE1 no hydrogen 3.129 N/A LEU 89.A N TRP 85.A O no hydrogen 3.119 N/A ARG 90.A N GLU 86.A O no hydrogen 3.064 N/A ARG 90.A NH1 GLU 27.A OE1 no hydrogen 3.495 N/A ARG 90.A NH2 GLU 27.A OE1 no hydrogen 3.185 N/A ARG 90.A NH2 GLU 27.A OE2 no hydrogen 3.449 N/A HIS 91.A ND1 HIS 88.A O no hydrogen 2.608 N/A HIS 91.A NE2 GLU 18.A OE1 no hydrogen 2.450 N/A GLN 92.A N LEU 89.A O no hydrogen 3.093 N/A GLN 92.A NE2 ALA 125.A O no hydrogen 3.489 N/A ARG 93.A N ARG 90.A O no hydrogen 3.259 N/A GLY 95.A N HIS 91.A O no hydrogen 3.100 N/A TYR 98.A N LEU 12.A O no hydrogen 2.976 N/A TYR 98.A OH GLU 16.A OE2 no hydrogen 3.279 N/A GLU 100.A N GLU 100.A OE2 no hydrogen 2.704 N/A VAL 101.A N TYR 98.A O no hydrogen 3.156 N/A VAL 104.A N GLU 100.A O no hydrogen 3.028 N/A LEU 105.A N VAL 101.A O no hydrogen 2.861 N/A LYS 106.A N VAL 102.A O no hydrogen 2.847 N/A SER 107.A N GLU 103.A O no hydrogen 2.899 N/A SER 107.A OG VAL 104.A O no hydrogen 2.940 N/A LEU 108.A N VAL 104.A O no hydrogen 3.113 N/A LYS 109.A N LEU 105.A O no hydrogen 3.001 N/A LYS 111.A N LEU 108.A O no hydrogen 3.148 N/A TYR 112.A N LEU 108.A O no hydrogen 2.864 N/A HIS 113.A N ARG 2.A O no hydrogen 2.896 N/A HIS 113.A NE2 SER 138.A OG no hydrogen 2.671 N/A VAL 114.A N ASP 137.A OD1 no hydrogen 2.874 N/A GLY 115.A N VAL 4.A O no hydrogen 2.918 N/A THR 117.A N THR 140.A O no hydrogen 3.069 N/A THR 117.A OG1 ASP 118.A O no hydrogen 3.379 N/A THR 117.A OG1 SER 119.A OG no hydrogen 2.808 N/A SER 119.A N SER 142.A OG no hydrogen 2.944 N/A SER 119.A OG THR 117.A OG1 no hydrogen 2.808 N/A SER 119.A OG ASP 118.A O no hydrogen 2.810 N/A THR 121.A N GLU 143.A OE2 no hydrogen 2.747 N/A THR 121.A OG1 THR 141.A OG1 no hydrogen 2.719 N/A THR 121.A OG1 GLU 143.A OE2 no hydrogen 3.317 N/A TYR 123.A OH HIS 88.A ND1 no hydrogen 2.593 N/A TYR 123.A OH HIS 88.A O no hydrogen 3.207 N/A LEU 124.A N ASP 120.A O no hydrogen 2.942 N/A HIS 126.A N TYR 123.A O no hydrogen 2.841 N/A LEU 127.A N LEU 124.A O no hydrogen 2.798 N/A ALA 129.A N ALA 125.A O no hydrogen 3.094 N/A LEU 130.A N HIS 126.A O no hydrogen 3.112 N/A GLY 131.A N ASP 128.A O no hydrogen 2.868 N/A ILE 132.A N LEU 127.A O no hydrogen 3.040 N/A LYS 133.A N LEU 127.A O no hydrogen 3.393 N/A LEU 135.A N ILE 132.A O no hydrogen 2.740 N/A ASP 137.A N VAL 114.A O no hydrogen 2.710 N/A SER 138.A OG HIS 113.A NE2 no hydrogen 2.671 N/A THR 141.A N GLU 144.A OE2 no hydrogen 3.229 N/A THR 141.A OG1 THR 121.A OG1 no hydrogen 2.719 N/A SER 142.A N THR 117.A O no hydrogen 3.171 N/A SER 142.A OG SER 119.A O no hydrogen 3.344 N/A GLU 144.A N THR 141.A OG1 no hydrogen 3.212 N/A ALA 145.A N THR 141.A O no hydrogen 3.100 N/A GLY 146.A N SER 142.A O no hydrogen 2.676 N/A PHE 148.A N LYS 57.A O no hydrogen 3.045 N/A LYS 149.A N ASP 118.A OD2 no hydrogen 2.805 N/A LYS 149.A NZ ASP 7.A OD1 no hydrogen 2.756 N/A LYS 149.A NZ TYR 171.A OH no hydrogen 2.790 N/A LYS 149.A NZ ASP 179.A OD2 no hydrogen 2.829 N/A HIS 151.A N PHE 148.A O no hydrogen 3.020 N/A ARG 153.A N HIS 151.A ND1 no hydrogen 3.128 N/A GLU 156.A N PRO 152.A O no hydrogen 2.847 N/A LEU 157.A N ARG 153.A O no hydrogen 2.961 N/A ALA 158.A N ILE 154.A O no hydrogen 3.242 N/A LEU 159.A N PHE 155.A O no hydrogen 2.914 N/A LYS 160.A N GLU 156.A O no hydrogen 2.945 N/A LYS 161.A N LEU 157.A O no hydrogen 2.883 N/A LYS 161.A NZ ILE 139.A O no hydrogen 2.534 N/A LYS 161.A NZ THR 140.A OG1 no hydrogen 3.298 N/A LYS 161.A NZ GLU 144.A OE2 no hydrogen 2.796 N/A ALA 162.A N ALA 158.A O no hydrogen 3.114 N/A GLY 163.A N LYS 160.A O no hydrogen 3.104 N/A VAL 164.A N LEU 159.A O no hydrogen 3.093 N/A LYS 165.A N GLU 168.A OE1 no hydrogen 3.036 N/A GLU 168.A N LYS 165.A O no hydrogen 2.889 N/A ALA 169.A N GLY 166.A O no hydrogen 2.876 N/A VAL 170.A N ALA 3.A O no hydrogen 2.980 N/A TYR 171.A N THR 188.A O no hydrogen 2.867 N/A TYR 171.A OH ILE 116.A O no hydrogen 2.731 N/A VAL 172.A N PHE 5.A O no hydrogen 2.788 N/A GLY 173.A N ILE 190.A O no hydrogen 3.127 N/A ASN 175.A N ASP 179.A OD1 no hydrogen 3.065 N/A LYS 178.A N ASN 175.A OD1 no hydrogen 3.089 N/A ASP 179.A N ASN 175.A O no hydrogen 2.803 N/A GLY 181.A N PRO 176.A O no hydrogen 2.838 N/A SER 183.A N ASP 179.A O no hydrogen 2.899 N/A SER 183.A OG ASP 179.A O no hydrogen 2.926 N/A SER 183.A OG CYS 180.A O no hydrogen 3.247 N/A LYS 184.A N CYS 180.A O no hydrogen 3.072 N/A LYS 184.A NZ LYS 184.A O no hydrogen 3.127 N/A ASN 185.A N GLY 182.A O no hydrogen 3.368 N/A LEU 186.A N SER 183.A O no hydrogen 3.050 N/A GLY 187.A N LYS 184.A O no hydrogen 2.866 N/A THR 188.A N ALA 169.A O no hydrogen 2.967 N/A SER 189.A N ASP 206.A OD1 no hydrogen 2.823 N/A ILE 190.A N TYR 171.A O no hydrogen 2.927 N/A LEU 191.A N PHE 207.A O no hydrogen 2.712 N/A LEU 192.A N GLY 173.A O no hydrogen 2.853 N/A ASP 193.A N VAL 209.A O no hydrogen 2.895 N/A ARG 194.A NH1 GLU 100.A OE1 no hydrogen 2.745 N/A ARG 194.A NH1 GLU 100.A OE2 no hydrogen 3.562 N/A ARG 194.A NH2 GLU 100.A OE2 no hydrogen 3.181 N/A GLY 196.A N ASP 193.A O no hydrogen 3.327 N/A GLU 197.A N ASP 193.A OD1 no hydrogen 2.803 N/A LYS 198.A N ASP 193.A OD2 no hydrogen 2.955 N/A LYS 198.A NZ ASP 174.A O no hydrogen 2.752 N/A LYS 198.A NZ LEU 192.A O no hydrogen 2.940 N/A PHE 201.A N LYS 198.A O no hydrogen 2.822 N/A TRP 202.A N ARG 199.A O no hydrogen 3.249 N/A TRP 202.A NE1 ASP 193.A OD2 no hydrogen 2.800 N/A LYS 204.A N PHE 201.A O no hydrogen 2.980 N/A CYS 205.A N TRP 202.A O no hydrogen 3.044 N/A ASP 206.A N SER 189.A OG no hydrogen 2.984 N/A PHE 207.A N SER 189.A O no hydrogen 3.028 N/A VAL 209.A N LEU 191.A O no hydrogen 2.818 N/A SER 210.A N GLU 214.A OE1 no hydrogen 2.967 N/A SER 210.A OG GLU 214.A OE1 no hydrogen 3.424 N/A ASP 211.A N GLU 214.A OE1 no hydrogen 3.289 N/A LEU 212.A N GLU 100.A OE1 no hydrogen 2.799 N/A ARG 213.A N ASP 211.A OD2 no hydrogen 2.843 N/A ARG 213.A NE ASP 211.A OD2 no hydrogen 2.864 N/A ARG 213.A NH2 ASP 211.A OD1 no hydrogen 3.069 N/A GLU 214.A N ASP 211.A O no hydrogen 3.014 N/A VAL 215.A N LEU 212.A O no hydrogen 3.025 N/A LYS 217.A NZ ARG 213.A O no hydrogen 3.479 N/A ILE 218.A N GLU 214.A O no hydrogen 3.152 N/A VAL 219.A N VAL 215.A O no hydrogen 3.072 N/A ASP 220.A N ILE 216.A O no hydrogen 2.977 N/A GLU 221.A N LYS 217.A O no hydrogen 2.934 N/A LEU 222.A N ILE 218.A O no hydrogen 2.854 N/A ASN 223.A N VAL 219.A O no hydrogen 2.899 N/A ASN 223.A ND2 ILE 1.A O no hydrogen 3.226 N/A ASN 223.A ND2 TYR 112.A OH no hydrogen 3.460 N/A