Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n6a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N ASP 2.A OD2 no hydrogen 2.867 N/A TRP 6.A N ASP 2.A O no hydrogen 2.824 N/A VAL 7.A N GLU 3.A O no hydrogen 3.052 N/A TRP 8.A N GLU 4.A O no hydrogen 2.859 N/A GLY 9.A N GLY 5.A O no hydrogen 2.980 N/A GLN 10.A N TRP 6.A O no hydrogen 2.939 N/A ILE 11.A N VAL 7.A O no hydrogen 2.942 N/A LYS 12.A N TRP 8.A O no hydrogen 2.939 N/A LYS 12.A NZ LEU 34.A O no hydrogen 3.161 N/A LYS 12.A NZ HIS 36.A O no hydrogen 3.010 N/A ALA 13.A N GLY 9.A O no hydrogen 3.092 N/A GLU 14.A N GLN 10.A O no hydrogen 2.953 N/A ALA 15.A N ILE 11.A O no hydrogen 2.908 N/A ARG 16.A N LYS 12.A O no hydrogen 2.907 N/A ARG 17.A N ALA 13.A O no hydrogen 3.095 N/A ASP 18.A N GLU 14.A O no hydrogen 2.993 N/A ALA 19.A N ALA 15.A O no hydrogen 2.784 N/A GLU 20.A N ARG 16.A O no hydrogen 3.016 N/A SER 21.A N ARG 17.A O no hydrogen 3.038 N/A SER 21.A N ASP 18.A O no hydrogen 3.258 N/A SER 21.A OG ARG 17.A O no hydrogen 3.436 N/A SER 21.A OG ASP 18.A O no hydrogen 3.220 N/A GLU 22.A N ASP 18.A O no hydrogen 2.911 N/A ALA 24.A N GLU 22.A OE2 no hydrogen 2.970 N/A LEU 25.A N GLU 22.A O no hydrogen 2.966 N/A LEU 29.A N LEU 25.A O no hydrogen 2.935 N/A TYR 30.A N ALA 26.A O no hydrogen 2.895 N/A SER 31.A N.A SER 27.A O no hydrogen 2.817 N/A SER 31.A N.B SER 27.A O no hydrogen 2.790 N/A SER 31.A OG.A SER 27.A O no hydrogen 3.285 N/A SER 31.A OG.A TYR 28.A O no hydrogen 3.221 N/A SER 31.A OG.B SER 27.A O no hydrogen 2.829 N/A THR 32.A N TYR 28.A O no hydrogen 2.943 N/A THR 32.A OG1 TYR 28.A O no hydrogen 2.862 N/A ILE 33.A N LEU 29.A O no hydrogen 2.908 N/A LEU 34.A N LEU 29.A O no hydrogen 3.075 N/A SER 35.A N TYR 30.A O no hydrogen 2.822 N/A SER 35.A OG TYR 30.A O no hydrogen 2.932 N/A SER 35.A OG SER 31.A O.A no hydrogen 3.222 N/A SER 35.A OG SER 31.A O.B no hydrogen 2.914 N/A HIS 36.A N ILE 33.A O no hydrogen 3.033 N/A HIS 36.A ND1 THR 32.A O no hydrogen 2.742 N/A GLU 40.A N GLU 40.A OE1 no hydrogen 2.789 N/A ARG 41.A N SER 38.A OG no hydrogen 3.068 N/A SER 42.A N.A SER 38.A O no hydrogen 3.251 N/A SER 42.A N.B SER 38.A O no hydrogen 3.226 N/A SER 42.A OG.A THR 32.A O no hydrogen 3.095 N/A SER 42.A OG.A HIS 36.A ND1 no hydrogen 3.296 N/A SER 42.A OG.A SER 38.A O no hydrogen 3.087 N/A SER 42.A OG.B THR 32.A O no hydrogen 2.953 N/A LEU 43.A N LEU 39.A O no hydrogen 2.841 N/A SER 44.A N GLU 40.A O no hydrogen 2.945 N/A SER 44.A OG GLU 40.A O no hydrogen 2.745 N/A PHE 45.A N ARG 41.A O no hydrogen 2.891 N/A HIS 46.A N SER 42.A O.A no hydrogen 2.931 N/A HIS 46.A N SER 42.A O.B no hydrogen 2.941 N/A HIS 46.A NE2 LEU 101.A O no hydrogen 2.833 N/A LEU 47.A N LEU 43.A O no hydrogen 2.833 N/A GLY 48.A N SER 44.A O no hydrogen 2.866 N/A ASN 49.A N PHE 45.A O no hydrogen 3.128 N/A ASN 49.A ND2 PHE 45.A O no hydrogen 3.014 N/A LYS 50.A N HIS 46.A O no hydrogen 2.868 N/A LEU 51.A N LEU 47.A O no hydrogen 2.991 N/A CYS 52.A SG ASN 49.A O no hydrogen 3.402 N/A SER 53.A N LEU 56.A O no hydrogen 2.925 N/A THR 55.A N SER 53.A OG no hydrogen 3.087 N/A LEU 56.A N SER 53.A O no hydrogen 3.264 N/A LEU 56.A N SER 53.A OG no hydrogen 3.144 N/A LEU 61.A N LEU 57.A O no hydrogen 3.005 N/A TYR 62.A N SER 58.A O no hydrogen 2.828 N/A ASP 63.A N THR 59.A O no hydrogen 3.063 N/A LEU 64.A N LEU 60.A O no hydrogen 2.903 N/A PHE 65.A N LEU 61.A O no hydrogen 2.845 N/A LEU 66.A N TYR 62.A O no hydrogen 2.891 N/A ASN 67.A N ASP 63.A O no hydrogen 2.838 N/A ALA 68.A N LEU 64.A O no hydrogen 3.085 N/A PHE 69.A N PHE 65.A O no hydrogen 2.969 N/A SER 70.A N.A LEU 66.A O no hydrogen 2.923 N/A SER 70.A N.B LEU 66.A O no hydrogen 2.912 N/A SER 70.A OG.A LEU 66.A O no hydrogen 3.147 N/A SER 70.A OG.A ASN 67.A O no hydrogen 2.985 N/A SER 70.A OG.B LEU 66.A O no hydrogen 2.832 N/A SER 71.A N ASN 67.A O no hydrogen 2.924 N/A SER 71.A N ALA 68.A O no hydrogen 3.214 N/A SER 71.A OG ASN 67.A O no hydrogen 3.072 N/A SER 74.A N ASP 72.A OD1 no hydrogen 3.278 N/A SER 74.A OG ASP 72.A OD1 no hydrogen 2.573 N/A LEU 75.A N ASP 72.A O no hydrogen 2.956 N/A ARG 76.A NH1 PHE 69.A O no hydrogen 2.827 N/A ARG 76.A NH1 SER 70.A O.A no hydrogen 3.430 N/A ARG 76.A NH1 SER 70.A O.B no hydrogen 3.442 N/A SER 77.A N PRO 73.A O no hydrogen 3.039 N/A SER 77.A OG PRO 73.A O no hydrogen 3.205 N/A ALA 78.A N SER 74.A O no hydrogen 2.937 N/A ALA 79.A N LEU 75.A O no hydrogen 3.023 N/A VAL 80.A N ARG 76.A O no hydrogen 3.174 N/A ALA 81.A N SER 77.A O no hydrogen 2.948 N/A ASP 82.A N ALA 78.A O no hydrogen 2.850 N/A LEU 83.A N ALA 79.A O no hydrogen 2.937 N/A ARG 84.A N VAL 80.A O no hydrogen 2.908 N/A ARG 84.A NH1 GLU 3.A OE2 no hydrogen 3.207 N/A ALA 85.A N ALA 81.A O no hydrogen 2.845 N/A ALA 86.A N ASP 82.A O no hydrogen 3.086 N/A ARG 87.A N LEU 83.A O no hydrogen 3.018 N/A ARG 87.A NH1 ARG 87.A O no hydrogen 3.435 N/A GLU 88.A N ARG 84.A O no hydrogen 2.846 N/A ARG 89.A N ALA 85.A O no hydrogen 2.814 N/A ARG 89.A NH1 GLY 151.A O no hydrogen 3.154 N/A ARG 89.A NH1 SER 173.A OG no hydrogen 3.317 N/A ARG 89.A NH2 GLY 151.A O no hydrogen 2.582 N/A ASP 90.A N ALA 86.A O no hydrogen 2.986 N/A CYS 93.A N ASP 90.A O no hydrogen 2.863 N/A CYS 93.A SG PRO 91.A O no hydrogen 3.567 N/A SER 97.A N.A GLU 14.A OE1 no hydrogen 2.886 N/A SER 97.A N.B GLU 14.A OE1 no hydrogen 2.904 N/A SER 97.A OG.B GLU 14.A OE1 no hydrogen 3.226 N/A HIS 98.A N SER 95.A OG no hydrogen 3.179 N/A HIS 98.A NE2 ASP 18.A OD2 no hydrogen 2.744 N/A CYS 99.A N SER 95.A O no hydrogen 3.152 N/A LEU 100.A N TYR 96.A O no hydrogen 2.957 N/A LEU 101.A N SER 97.A O.A no hydrogen 2.994 N/A LEU 101.A N SER 97.A O.B no hydrogen 2.909 N/A ASN 102.A N HIS 98.A O no hydrogen 2.743 N/A TYR 103.A N CYS 99.A O no hydrogen 3.108 N/A TYR 103.A OH ASP 90.A OD2 no hydrogen 2.869 N/A LEU 107.A N TYR 103.A O no hydrogen 3.021 N/A ALA 108.A N LYS 104.A O no hydrogen 2.873 N/A CYS 109.A N GLY 105.A O no hydrogen 2.913 N/A CYS 109.A SG ASP 82.A OD2 no hydrogen 3.628 N/A GLN 110.A N PHE 106.A O no hydrogen 3.080 N/A GLN 110.A NE2 ASP 82.A OD2 no hydrogen 2.872 N/A GLN 110.A NE2 PHE 106.A O no hydrogen 2.954 N/A ALA 111.A N LEU 107.A O no hydrogen 3.001 N/A HIS 112.A N ALA 108.A O no hydrogen 2.784 N/A HIS 112.A NE2 HIS 143.A O no hydrogen 3.065 N/A ARG 113.A N CYS 109.A O no hydrogen 3.022 N/A ARG 113.A NE GLN 110.A OE1 no hydrogen 3.240 N/A ARG 113.A NH1 GLY 149.A O no hydrogen 2.864 N/A ARG 113.A NH2 ASP 82.A OD2 no hydrogen 2.624 N/A ARG 113.A NH2 GLY 149.A O no hydrogen 2.889 N/A VAL 114.A N GLN 110.A O no hydrogen 3.332 N/A ALA 115.A N ALA 111.A O no hydrogen 2.986 N/A HIS 116.A N HIS 112.A O no hydrogen 2.708 N/A HIS 116.A ND1 PRO 144.A O no hydrogen 2.641 N/A LEU 117.A N ARG 113.A O no hydrogen 3.055 N/A LEU 118.A N VAL 114.A O no hydrogen 2.943 N/A TRP 119.A N ALA 115.A O no hydrogen 2.962 N/A ARG 120.A N HIS 116.A O no hydrogen 3.048 N/A GLN 121.A N LEU 117.A O no hydrogen 2.884 N/A SER 122.A N TRP 119.A O no hydrogen 3.366 N/A ARG 123.A N LEU 118.A O no hydrogen 2.837 N/A ALA 127.A N ARG 123.A O no hydrogen 2.911 N/A LEU 128.A N ARG 124.A O no hydrogen 2.841 N/A ALA 129.A N PRO 125.A O no hydrogen 2.929 N/A LEU 130.A N LEU 126.A O no hydrogen 2.906 N/A HIS 131.A N ALA 127.A O no hydrogen 2.909 N/A HIS 131.A NE2 ASP 141.A OD1 no hydrogen 2.774 N/A SER 132.A N LEU 128.A O no hydrogen 2.922 N/A SER 132.A OG.B LEU 128.A O no hydrogen 2.859 N/A ARG 133.A N ALA 129.A O no hydrogen 3.237 N/A ARG 133.A NE LEU 51.A O no hydrogen 2.910 N/A ARG 133.A NH1 ASN 136.A OD1 no hydrogen 2.966 N/A ARG 133.A NH2 LEU 51.A O no hydrogen 3.568 N/A ARG 133.A NH2 CYS 52.A O no hydrogen 2.793 N/A ILE 134.A N LEU 130.A O no hydrogen 2.961 N/A ALA 135.A N HIS 131.A O no hydrogen 3.039 N/A ASN 136.A N SER 132.A O no hydrogen 2.913 N/A VAL 137.A N ARG 133.A O no hydrogen 2.826 N/A PHE 138.A N ILE 134.A O no hydrogen 2.793 N/A ALA 139.A N ALA 135.A O no hydrogen 3.122 N/A ASP 141.A N VAL 160.A O no hydrogen 2.893 N/A HIS 143.A N VAL 162.A O no hydrogen 3.073 N/A ALA 145.A N HIS 143.A ND1 no hydrogen 2.959 N/A ALA 146.A N HIS 143.A O no hydrogen 2.858 N/A ARG 147.A N ALA 166.A O no hydrogen 3.222 N/A GLY 149.A N ILE 168.A O no hydrogen 2.851 N/A LYS 150.A N ASN 170.A OD1 no hydrogen 2.971 N/A GLY 151.A N ASP 82.A OD1 no hydrogen 2.700 N/A ILE 152.A N ASP 82.A OD1 no hydrogen 2.844 N/A LEU 153.A N VAL 172.A O no hydrogen 2.952 N/A ASP 155.A N ILE 174.A O no hydrogen 3.066 N/A HIS 156.A ND1 ASP 155.A OD2 no hydrogen 2.746 N/A GLY 159.A N ALA 139.A O no hydrogen 2.896 N/A VAL 160.A N ALA 157.A O no hydrogen 2.944 N/A VAL 161.A N VAL 178.A O no hydrogen 3.098 N/A VAL 162.A N ASP 141.A O no hydrogen 2.785 N/A GLY 163.A N LEU 180.A O no hydrogen 2.737 N/A THR 165.A N HIS 191.A ND1 no hydrogen 2.899 N/A THR 165.A OG1 ASP 189.A OD1 no hydrogen 3.305 N/A THR 165.A OG1 HIS 191.A ND1 no hydrogen 2.986 N/A ALA 166.A N GLY 163.A O no hydrogen 3.013 N/A VAL 167.A N PRO 192.A O no hydrogen 3.096 N/A ILE 168.A N ARG 147.A O no hydrogen 2.737 N/A GLY 169.A N ILE 194.A O no hydrogen 2.811 N/A ASN 170.A N ASP 196.A OD1 no hydrogen 2.809 N/A ASN 171.A N LYS 150.A O no hydrogen 2.847 N/A SER 173.A N VAL 198.A O no hydrogen 2.981 N/A ILE 174.A N LEU 153.A O no hydrogen 2.655 N/A LEU 175.A N ILE 200.A O no hydrogen 3.142 N/A HIS 176.A ND1 HIS 156.A O no hydrogen 2.781 N/A THR 179.A N ALA 204.A O no hydrogen 2.977 N/A LEU 180.A N VAL 161.A O no hydrogen 2.773 N/A GLY 181.A N ILE 206.A O no hydrogen 3.101 N/A LYS 185.A N THR 183.A OG1 no hydrogen 3.222 N/A LYS 185.A NZ VAL 186.A O no hydrogen 3.150 N/A LYS 185.A NZ GLY 187.A O no hydrogen 2.757 N/A ARG 190.A N THR 165.A OG1 no hydrogen 3.056 N/A ARG 190.A NH1 GLY 188.A O no hydrogen 2.920 N/A ARG 190.A NH2 GLU 164.A OE2 no hydrogen 3.059 N/A LYS 193.A N ILE 210.A O no hydrogen 2.850 N/A LYS 193.A NZ THR 165.A O no hydrogen 3.102 N/A LYS 193.A NZ ASP 189.A OD1 no hydrogen 2.674 N/A LYS 193.A NZ HIS 191.A O no hydrogen 2.466 N/A LYS 193.A NZ ASN 209.A OD1 no hydrogen 2.506 N/A ILE 194.A N VAL 167.A O no hydrogen 2.665 N/A GLY 195.A N ILE 212.A O no hydrogen 2.756 N/A GLY 197.A N ASN 170.A O no hydrogen 2.828 N/A LEU 199.A N ALA 216.A O no hydrogen 3.121 N/A ILE 200.A N SER 173.A O no hydrogen 2.933 N/A GLY 201.A N VAL 218.A O no hydrogen 2.811 N/A GLY 203.A N HIS 176.A O no hydrogen 2.660 N/A ALA 204.A N GLY 201.A O no hydrogen 3.171 N/A THR 205.A N SER 222.A O no hydrogen 2.705 N/A THR 205.A OG1.A SER 222.A O no hydrogen 3.461 N/A ILE 206.A N THR 179.A O no hydrogen 2.777 N/A LEU 207.A N VAL 224.A O no hydrogen 3.224 N/A GLY 208.A N GLY 181.A O no hydrogen 3.132 N/A ILE 210.A N GLY 208.A O no hydrogen 3.007 N/A LYS 211.A N ASP 227.A OD1 no hydrogen 2.796 N/A ILE 212.A N LYS 193.A O no hydrogen 2.806 N/A GLY 213.A N VAL 228.A O no hydrogen 2.669 N/A GLY 215.A N ASP 196.A O no hydrogen 2.944 N/A ALA 216.A N GLY 213.A O no hydrogen 3.078 N/A LYS 217.A N THR 232.A O no hydrogen 2.856 N/A VAL 218.A N LEU 199.A O no hydrogen 2.797 N/A GLY 219.A N ALA 234.A O no hydrogen 2.847 N/A GLY 221.A N ALA 202.A O no hydrogen 2.884 N/A SER 222.A N GLY 219.A O no hydrogen 3.314 N/A SER 222.A OG GLY 219.A O no hydrogen 2.753 N/A VAL 223.A N GLY 236.A O no hydrogen 3.053 N/A VAL 224.A N THR 205.A O no hydrogen 2.770 N/A VAL 228.A N LYS 211.A O no hydrogen 2.803 N/A ARG 231.A N GLU 214.A O no hydrogen 2.746 N/A THR 232.A OG1 PRO 229.A O no hydrogen 2.597 N/A ALA 234.A N LYS 217.A O no hydrogen 2.912 N/A VAL 235.A N ARG 240.A O no hydrogen 2.971 N/A GLY 236.A N SER 222.A OG no hydrogen 3.235 N/A ALA 239.A N VAL 223.A O no hydrogen 2.929 N/A ARG 240.A N VAL 235.A O no hydrogen 2.871 N/A VAL 242.A N THR 233.A O no hydrogen 2.792 N/A