Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7npc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 5.A N THR 1.A O no hydrogen 2.673 N/A HIS 5.A ND1 THR 1.A O no hydrogen 2.684 N/A LEU 6.A N GLU 2.A O no hydrogen 2.942 N/A VAL 7.A N ILE 3.A O no hydrogen 2.993 N/A GLN 8.A N GLU 4.A O no hydrogen 3.097 N/A SER 9.A N HIS 5.A O no hydrogen 2.841 N/A VAL 10.A N LEU 6.A O no hydrogen 2.906 N/A CYS 11.A N VAL 7.A O no hydrogen 2.951 N/A CYS 11.A SG VAL 7.A O no hydrogen 3.243 N/A CYS 11.A SG ASP 148.A OD1 no hydrogen 3.236 N/A LYS 12.A N GLN 8.A O no hydrogen 2.886 N/A LYS 12.A NZ GLU 16.A OE2 no hydrogen 2.553 N/A SER 13.A N SER 9.A O no hydrogen 2.984 N/A SER 13.A OG PHE 67.A O no hydrogen 2.852 N/A TYR 14.A N VAL 10.A O no hydrogen 2.984 N/A TYR 14.A OH GLU 147.A OE1 no hydrogen 3.109 N/A TYR 14.A OH GLU 147.A OE2 no hydrogen 3.315 N/A ARG 15.A N CYS 11.A O no hydrogen 2.853 N/A GLU 16.A N LYS 12.A O no hydrogen 2.943 N/A THR 17.A N TYR 14.A O no hydrogen 2.981 N/A THR 17.A OG1 SER 13.A O no hydrogen 2.773 N/A THR 17.A OG1 TYR 14.A O no hydrogen 3.339 N/A CYS 18.A SG ARG 15.A O no hydrogen 3.610 N/A CYS 18.A SG LEU 20.A O no hydrogen 3.511 N/A LEU 25.A N ARG 21.A O no hydrogen 3.057 N/A LEU 26.A N LEU 22.A O no hydrogen 2.792 N/A ARG 27.A N GLU 23.A O no hydrogen 2.785 N/A ARG 27.A NH1 ASP 24.A OD1 no hydrogen 2.730 N/A GLN 28.A N ASP 24.A O no hydrogen 3.061 N/A ARG 29.A N LEU 26.A O no hydrogen 3.172 N/A ASN 31.A N GLN 28.A O no hydrogen 2.711 N/A ASN 31.A ND2 GLN 28.A OE1 no hydrogen 2.799 N/A PHE 33.A N TYR 115.A O no hydrogen 2.861 N/A SER 34.A N GLU 37.A OE1 no hydrogen 2.794 N/A SER 34.A OG GLU 37.A OE1 no hydrogen 3.250 N/A ARG 35.A NE THR 39.A OG1 no hydrogen 3.273 N/A ARG 35.A NH2 THR 39.A OG1 no hydrogen 3.148 N/A ARG 35.A NH2 GLN 42.A OE1 no hydrogen 2.757 N/A GLU 37.A N SER 34.A OG no hydrogen 3.034 N/A VAL 38.A N SER 34.A O no hydrogen 2.905 N/A THR 39.A N ARG 35.A O no hydrogen 2.952 N/A THR 39.A OG1 ARG 35.A O no hydrogen 3.102 N/A GLY 40.A N GLU 36.A O no hydrogen 2.997 N/A TYR 41.A N GLU 37.A O no hydrogen 3.108 N/A TYR 41.A OH GLU 112.A OE1 no hydrogen 2.649 N/A GLN 42.A N VAL 38.A O no hydrogen 2.918 N/A GLN 42.A NE2 GLU 119.A O no hydrogen 2.921 N/A ARG 43.A N THR 39.A O no hydrogen 2.944 N/A LYS 44.A N TYR 41.A O no hydrogen 3.280 N/A LYS 44.A NZ GLU 48.A OE2 no hydrogen 3.190 N/A TRP 47.A N SER 45.A OG no hydrogen 3.070 N/A MET 49.A N SER 45.A O no hydrogen 2.949 N/A TRP 50.A N MET 46.A O no hydrogen 2.823 N/A TRP 50.A NE1 HIS 223.A O no hydrogen 2.782 N/A GLU 51.A N TRP 47.A O no hydrogen 2.976 N/A ARG 52.A N GLU 48.A O no hydrogen 2.996 N/A ARG 52.A NE GLU 48.A OE2 no hydrogen 2.948 N/A ARG 52.A NH1 GLU 112.A OE1 no hydrogen 2.826 N/A ARG 52.A NH2 GLU 48.A OE2 no hydrogen 2.835 N/A CYS 53.A N MET 49.A O no hydrogen 2.889 N/A CYS 53.A SG MET 49.A O no hydrogen 3.399 N/A ALA 54.A N TRP 50.A O no hydrogen 2.748 N/A HIS 55.A N.A GLU 51.A O no hydrogen 3.031 N/A HIS 55.A N.B GLU 51.A O no hydrogen 3.068 N/A HIS 56.A N ARG 52.A O no hydrogen 3.023 N/A HIS 56.A NE2 GLU 112.A OE2 no hydrogen 2.728 N/A LEU 57.A N CYS 53.A O no hydrogen 2.872 N/A THR 58.A N ALA 54.A O no hydrogen 2.867 N/A THR 58.A OG1 ALA 54.A O no hydrogen 2.784 N/A GLU 59.A N HIS 55.A O.A no hydrogen 2.980 N/A GLU 59.A N HIS 55.A O.B no hydrogen 3.074 N/A ALA 60.A N HIS 56.A O no hydrogen 2.938 N/A ILE 61.A N LEU 57.A O no hydrogen 2.918 N/A GLN 62.A N THR 58.A O no hydrogen 2.977 N/A GLN 62.A NE2 GLN 228.A O no hydrogen 2.789 N/A TYR 63.A N GLU 59.A O no hydrogen 3.006 N/A VAL 64.A N ALA 60.A O no hydrogen 3.079 N/A VAL 65.A N ILE 61.A O no hydrogen 2.872 N/A GLU 66.A N GLN 62.A O no hydrogen 2.988 N/A PHE 67.A N TYR 63.A O no hydrogen 2.864 N/A ALA 68.A N VAL 64.A O no hydrogen 2.928 N/A LYS 69.A N VAL 65.A O no hydrogen 2.926 N/A ARG 70.A N GLU 66.A O no hydrogen 3.287 N/A ARG 70.A N PHE 67.A O no hydrogen 3.171 N/A ARG 70.A NH1 GLU 16.A OE1 no hydrogen 2.702 N/A LEU 71.A N ALA 68.A O no hydrogen 2.947 N/A PHE 74.A N LEU 71.A O no hydrogen 2.934 N/A GLU 76.A N GLY 73.A O no hydrogen 3.159 N/A LEU 77.A N PHE 74.A O no hydrogen 3.119 N/A ASN 80.A ND2 ASP 81.A OD1 no hydrogen 2.917 N/A ASN 80.A ND2 GLY 165.A O no hydrogen 3.082 N/A GLN 82.A N CYS 78.A O no hydrogen 2.989 N/A GLN 82.A NE2 LEU 77.A O no hydrogen 2.943 N/A ILE 83.A N GLN 79.A O no hydrogen 2.924 N/A VAL 84.A N ASN 80.A O no hydrogen 2.918 N/A LEU 85.A N ASP 81.A O no hydrogen 2.932 N/A LEU 86.A N GLN 82.A O no hydrogen 2.943 N/A LYS 87.A N ILE 83.A O no hydrogen 2.777 N/A LYS 87.A NZ GLU 237.A OE1 no hydrogen 3.394 N/A ALA 88.A N VAL 84.A O no hydrogen 3.084 N/A GLY 89.A N LEU 85.A O no hydrogen 2.875 N/A ALA 90.A N LEU 86.A O no hydrogen 2.911 N/A VAL 93.A N GLY 89.A O no hydrogen 3.007 N/A VAL 94.A N ALA 90.A O no hydrogen 3.051 N/A LEU 95.A N MET 91.A O no hydrogen 2.981 N/A VAL 96.A N GLU 92.A O no hydrogen 3.026 N/A ARG 97.A N VAL 93.A O no hydrogen 2.841 N/A ARG 97.A NH1 THR 17.A O no hydrogen 2.821 N/A ARG 97.A NH2 THR 17.A OG1 no hydrogen 3.081 N/A MET 98.A N VAL 94.A O no hydrogen 3.108 N/A MET 98.A N LEU 95.A O no hydrogen 3.304 N/A CYS 99.A N VAL 96.A O no hydrogen 3.096 N/A CYS 99.A SG VAL 96.A O no hydrogen 3.240 N/A ARG 100.A N ARG 97.A O no hydrogen 3.268 N/A ARG 100.A NE GLU 147.A OE1 no hydrogen 3.354 N/A ARG 100.A NE GLU 147.A OE2 no hydrogen 2.849 N/A ARG 100.A NH1 LEU 20.A O no hydrogen 3.155 N/A ARG 100.A NH2 LEU 20.A O no hydrogen 2.811 N/A ARG 100.A NH2 GLU 147.A OE1 no hydrogen 2.873 N/A ALA 101.A N MET 98.A O no hydrogen 2.984 N/A TYR 102.A N CYS 99.A O no hydrogen 3.239 N/A ASN 103.A N THR 108.A O no hydrogen 2.770 N/A ASP 105.A N ASN 103.A OD1 no hydrogen 3.046 N/A ASN 106.A ND2 ASN 103.A O no hydrogen 3.320 N/A ASN 106.A ND2 THR 108.A OG1 no hydrogen 2.647 N/A THR 108.A N ASN 103.A O no hydrogen 3.156 N/A VAL 109.A N GLY 116.A O no hydrogen 2.806 N/A PHE 110.A N ALA 101.A O no hydrogen 2.822 N/A PHE 111.A N LYS 114.A O no hydrogen 2.837 N/A LYS 114.A N PHE 111.A O no hydrogen 3.484 N/A LYS 114.A NZ GLU 37.A OE1 no hydrogen 3.362 N/A LYS 114.A NZ GLU 37.A OE2 no hydrogen 2.950 N/A TYR 115.A N ASN 31.A O no hydrogen 2.888 N/A TYR 115.A OH LEU 25.A O no hydrogen 2.610 N/A GLY 116.A N VAL 109.A O no hydrogen 2.934 N/A LEU 120.A N GLY 117.A O no hydrogen 3.066 N/A PHE 121.A N MET 118.A O no hydrogen 3.021 N/A ARG 122.A N GLU 119.A O no hydrogen 3.284 N/A LEU 124.A N PHE 121.A O no hydrogen 3.022 N/A GLY 125.A N ARG 122.A O no hydrogen 3.115 N/A CYS 126.A SG LEU 124.A O no hydrogen 3.670 N/A LEU 129.A N GLU 128.A OE2 no hydrogen 2.980 N/A ILE 130.A N CYS 126.A O no hydrogen 3.069 N/A SER 131.A N SER 127.A O no hydrogen 2.798 N/A SER 132.A N GLU 128.A O no hydrogen 2.933 N/A SER 132.A OG GLU 128.A O no hydrogen 3.095 N/A ILE 133.A N LEU 129.A O no hydrogen 2.927 N/A PHE 134.A N ILE 130.A O no hydrogen 2.929 N/A ASP 135.A N SER 131.A O no hydrogen 2.847 N/A PHE 136.A N SER 132.A O no hydrogen 2.950 N/A SER 137.A N ILE 133.A O no hydrogen 2.993 N/A SER 137.A OG ILE 133.A O no hydrogen 3.224 N/A HIS 138.A N PHE 134.A O no hydrogen 2.762 N/A SER 139.A N ASP 135.A O no hydrogen 2.980 N/A SER 139.A OG ASP 135.A O no hydrogen 3.449 N/A LEU 140.A N PHE 136.A O no hydrogen 3.158 N/A SER 141.A N SER 137.A O no hydrogen 2.817 N/A SER 141.A OG SER 137.A O no hydrogen 3.423 N/A SER 141.A OG HIS 138.A O no hydrogen 2.807 N/A ALA 142.A N HIS 138.A O no hydrogen 3.230 N/A LEU 143.A N LEU 140.A O no hydrogen 2.985 N/A HIS 144.A N SER 141.A O no hydrogen 2.996 N/A SER 146.A N GLU 149.A OE1 no hydrogen 2.854 N/A GLU 149.A N SER 146.A OG no hydrogen 3.108 N/A ILE 150.A N SER 146.A O no hydrogen 2.981 N/A ALA 151.A N GLU 147.A O no hydrogen 3.045 N/A LEU 152.A N ASP 148.A O no hydrogen 2.972 N/A TYR 153.A N GLU 149.A O no hydrogen 2.885 N/A THR 154.A N ILE 150.A O no hydrogen 2.884 N/A THR 154.A OG1 ILE 150.A O no hydrogen 2.671 N/A THR 154.A OG1 ALA 151.A O no hydrogen 3.236 N/A ALA 155.A N ALA 151.A O no hydrogen 3.039 N/A LEU 156.A N LEU 152.A O no hydrogen 3.187 N/A VAL 157.A N TYR 153.A O no hydrogen 2.903 N/A LEU 158.A N THR 154.A O no hydrogen 3.163 N/A ILE 159.A N ALA 155.A O no hydrogen 2.860 N/A ALA 161.A N GLN 176.A OE1 no hydrogen 2.896 N/A HIS 162.A N ASN 160.A OD1 no hydrogen 2.874 N/A ARG 163.A N ASN 160.A O no hydrogen 3.322 N/A ARG 163.A NH2 GLU 92.A OE1 no hydrogen 2.864 N/A ARG 163.A NH2 VAL 157.A O no hydrogen 3.198 N/A GLN 167.A N ASP 81.A OD1 no hydrogen 2.760 N/A GLU 168.A N ASP 81.A OD2 no hydrogen 2.893 N/A VAL 172.A N GLU 168.A O no hydrogen 3.279 N/A GLU 173.A N LYS 169.A O no hydrogen 2.828 N/A GLN 174.A N ARG 170.A O no hydrogen 2.962 N/A GLN 174.A NE2 GLN 174.A O no hydrogen 3.026 N/A GLN 174.A NE2 ASN 178.A OD1 no hydrogen 3.413 N/A LEU 175.A N LYS 171.A O no hydrogen 3.347 N/A GLN 176.A N VAL 172.A O no hydrogen 2.860 N/A GLN 176.A NE2 GLU 180.A OE2 no hydrogen 2.955 N/A TYR 177.A N GLU 173.A O no hydrogen 2.825 N/A ASN 178.A N GLN 174.A O no hydrogen 3.249 N/A LEU 179.A N LEU 175.A O no hydrogen 2.984 N/A GLU 180.A N GLN 176.A O no hydrogen 2.809 N/A LEU 181.A N TYR 177.A O no hydrogen 2.959 N/A ALA 182.A N ASN 178.A O no hydrogen 2.899 N/A PHE 183.A N LEU 179.A O no hydrogen 2.924 N/A HIS 184.A N GLU 180.A O no hydrogen 2.895 N/A HIS 185.A N LEU 181.A O no hydrogen 2.839 N/A HIS 186.A N ALA 182.A O no hydrogen 2.967 N/A LEU 187.A N PHE 183.A O no hydrogen 2.921 N/A HIS 188.A N HIS 184.A O no hydrogen 3.034 N/A LYS 189.A N HIS 185.A O no hydrogen 3.000 N/A THR 190.A N HIS 186.A O no hydrogen 3.099 N/A THR 190.A OG1 HIS 186.A O no hydrogen 2.808 N/A THR 190.A OG1 LEU 187.A O no hydrogen 3.397 N/A HIS 191.A N HIS 188.A O no hydrogen 3.243 N/A ARG 192.A N LEU 187.A O no hydrogen 2.834 N/A ARG 192.A NE GLU 149.A OE2 no hydrogen 2.761 N/A ARG 192.A NH1 LEU 143.A O no hydrogen 3.561 N/A ARG 192.A NH2 LEU 143.A O no hydrogen 2.878 N/A ARG 192.A NH2 GLU 149.A OE1 no hydrogen 2.883 N/A ARG 192.A NH2 GLU 149.A OE2 no hydrogen 3.565 N/A ILE 195.A N ARG 192.A O no hydrogen 3.168 N/A LEU 196.A N GLN 193.A O no hydrogen 3.024 N/A LYS 198.A N ILE 195.A O no hydrogen 2.847 N/A LYS 204.A N PRO 201.A O no hydrogen 3.241 N/A SER 207.A N GLY 203.A O no hydrogen 2.947 N/A SER 207.A OG GLY 203.A O no hydrogen 2.966 N/A SER 207.A OG LYS 204.A O no hydrogen 3.264 N/A LEU 208.A N LYS 204.A O no hydrogen 3.045 N/A CYS 209.A N LEU 205.A O no hydrogen 2.918 N/A SER 210.A N ARG 206.A O no hydrogen 2.942 N/A SER 210.A OG ARG 206.A O no hydrogen 3.093 N/A GLN 211.A N SER 207.A O no hydrogen 3.056 N/A HIS 212.A N LEU 208.A O no hydrogen 2.946 N/A VAL 213.A N CYS 209.A O no hydrogen 2.828 N/A GLU 214.A N SER 210.A O no hydrogen 2.951 N/A ARG 215.A N GLN 211.A O no hydrogen 3.138 N/A LEU 216.A N HIS 212.A O no hydrogen 2.977 N/A GLN 217.A N VAL 213.A O no hydrogen 2.852 N/A GLN 217.A NE2 LEU 238.A O no hydrogen 3.061 N/A ILE 218.A N GLU 214.A O no hydrogen 3.025 N/A PHE 219.A N ARG 215.A O no hydrogen 2.960 N/A GLN 220.A N LEU 216.A O no hydrogen 2.870 N/A GLN 220.A NE2 ILE 225.A O no hydrogen 3.213 N/A HIS 221.A N GLN 217.A O no hydrogen 2.949 N/A LEU 222.A N ILE 218.A O no hydrogen 3.068 N/A HIS 223.A N PHE 219.A O no hydrogen 2.762 N/A HIS 223.A NE2 GLU 51.A OE2 no hydrogen 2.712 N/A ILE 225.A N GLN 220.A OE1 no hydrogen 3.015 N/A LEU 234.A N PHE 231.A O no hydrogen 2.869 N/A TYR 235.A N PHE 231.A O no hydrogen 2.906 N/A LYS 236.A N PRO 232.A O no hydrogen 2.989 N/A GLU 237.A N LEU 234.A O no hydrogen 2.973 N/A LEU 238.A N TYR 235.A O no hydrogen 3.075 N/A PHE 239.A N TYR 235.A O no hydrogen 2.921 N/A