Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ne8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N HIS 46.A O no hydrogen 2.830 N/A ARG 4.A N ASP 74.A OD2 no hydrogen 2.848 N/A ARG 4.A NE PHE 71.A O no hydrogen 2.824 N/A ARG 4.A NH2 PHE 71.A O no hydrogen 2.971 N/A VAL 5.A N ILE 48.A O no hydrogen 2.879 N/A VAL 6.A N LEU 75.A O no hydrogen 2.980 N/A LEU 7.A N ALA 50.A O no hydrogen 2.873 N/A ASP 8.A N ILE 77.A O no hydrogen 2.786 N/A GLY 10.A N ILE 79.A O no hydrogen 2.837 N/A HIS 11.A ND1 ASP 15.A OD2 no hydrogen 2.704 N/A GLY 12.A N ASP 15.A O no hydrogen 2.876 N/A GLY 13.A N ASP 56.A OD1 no hydrogen 2.867 N/A ASP 15.A N GLY 12.A O no hydrogen 3.088 N/A GLY 17.A N ASP 15.A OD1 no hydrogen 2.951 N/A ALA 18.A N GLU 26.A OE1 no hydrogen 2.859 N/A GLY 20.A N ILE 24.A O no hydrogen 2.812 N/A VAL 21.A N GLU 192.A OE1 no hydrogen 2.847 N/A THR 22.A N GLU 192.A OE2 no hydrogen 2.862 N/A THR 22.A OG1 GLU 192.A OE2 no hydrogen 2.696 N/A GLY 23.A N GLY 20.A O no hydrogen 2.962 N/A GLU 26.A N ALA 18.A O no hydrogen 2.789 N/A LYS 27.A N GLY 16.A O no hydrogen 2.973 N/A LYS 27.A NZ GLY 13.A O no hydrogen 2.827 N/A LYS 27.A NZ ASP 56.A OD1 no hydrogen 3.068 N/A LYS 27.A NZ ASP 56.A OD2 no hydrogen 2.988 N/A ASP 28.A N LEU 25.A O no hydrogen 2.945 N/A VAL 29.A N LEU 25.A O no hydrogen 3.094 N/A THR 30.A N GLU 26.A O no hydrogen 2.847 N/A THR 30.A OG1 GLY 10.A O no hydrogen 2.857 N/A THR 30.A OG1 GLU 26.A O no hydrogen 3.306 N/A THR 30.A OG1 LYS 27.A O no hydrogen 3.280 N/A LEU 31.A N LYS 27.A O no hydrogen 3.480 N/A ALA 32.A N ASP 28.A O no hydrogen 3.029 N/A PHE 33.A N VAL 29.A O no hydrogen 2.847 N/A ALA 34.A N THR 30.A O no hydrogen 2.862 N/A ARG 35.A N LEU 31.A O no hydrogen 2.927 N/A ARG 35.A NE ASP 54.A OD2 no hydrogen 2.787 N/A ARG 35.A NH2 ASP 54.A O no hydrogen 3.037 N/A ARG 35.A NH2 ASP 54.A OD2 no hydrogen 3.124 N/A ALA 36.A N ALA 32.A O no hydrogen 3.015 N/A LEU 37.A N PHE 33.A O no hydrogen 2.871 N/A ARG 38.A N ALA 34.A O no hydrogen 2.829 N/A ARG 38.A NH1 ASP 54.A OD1 no hydrogen 2.788 N/A ASP 39.A N ARG 35.A O no hydrogen 2.954 N/A GLU 40.A N ALA 36.A O no hydrogen 2.933 N/A LEU 41.A N LEU 37.A O no hydrogen 2.897 N/A GLN 42.A N ARG 38.A O no hydrogen 2.875 N/A LYS 43.A N ASP 39.A O no hydrogen 3.096 N/A LYS 43.A N GLU 40.A O no hydrogen 3.236 N/A LYS 43.A NZ GLU 40.A OE2 no hydrogen 3.335 N/A GLY 44.A N LEU 41.A O no hydrogen 3.102 N/A SER 45.A OG HIS 46.A ND1 no hydrogen 3.009 N/A ILE 48.A N PHE 3.A O no hydrogen 2.786 N/A ALA 50.A N VAL 5.A O no hydrogen 2.979 N/A THR 52.A N LEU 7.A O no hydrogen 2.921 N/A THR 52.A OG1 ASP 8.A OD1 no hydrogen 2.690 N/A ARG 53.A NE PRO 9.A O no hydrogen 3.036 N/A ARG 53.A NH1 SER 55.A O no hydrogen 2.986 N/A ARG 53.A NH2 PRO 9.A O no hydrogen 3.542 N/A ARG 53.A NH2 GLY 10.A O no hydrogen 3.029 N/A ARG 53.A NH2 LYS 27.A O no hydrogen 2.917 N/A ILE 57.A N SER 55.A O no hydrogen 3.110 N/A ARG 60.A NE ASP 120.A OD2 no hydrogen 2.855 N/A ARG 60.A NH1 PRO 123.A O no hydrogen 2.928 N/A ARG 60.A NH1 GLU 125.A OE2 no hydrogen 3.327 N/A ARG 60.A NH2 ASP 120.A OD1 no hydrogen 2.847 N/A ARG 60.A NH2 ASP 120.A OD2 no hydrogen 3.369 N/A ARG 60.A NH2 LEU 122.A O no hydrogen 3.050 N/A ARG 60.A NH2 PRO 123.A O no hydrogen 3.006 N/A LEU 61.A N ASP 117.A OD1 no hydrogen 2.903 N/A SER 62.A OG GLU 125.A OE1 no hydrogen 2.516 N/A SER 62.A OG GLU 125.A OE2 no hydrogen 3.187 N/A GLU 63.A N ARG 60.A O no hydrogen 2.998 N/A ARG 64.A N ARG 60.A O no hydrogen 3.230 N/A ARG 64.A NE LEU 59.A O no hydrogen 3.005 N/A ARG 64.A NH1 ASP 8.A OD1 no hydrogen 2.758 N/A ARG 64.A NH1 PRO 9.A O no hydrogen 2.881 N/A ARG 64.A NH2 HIS 11.A O no hydrogen 2.869 N/A ARG 64.A NH2 LEU 59.A O no hydrogen 3.117 N/A VAL 65.A N LEU 61.A O no hydrogen 3.107 N/A LYS 66.A N SER 62.A O no hydrogen 2.949 N/A LYS 66.A NZ.A GLU 70.A OE1.B no hydrogen 2.287 N/A LYS 67.A N GLU 63.A O no hydrogen 2.997 N/A ALA 68.A N ARG 64.A O no hydrogen 3.220 N/A GLN 69.A N VAL 65.A O no hydrogen 3.087 N/A GLN 69.A NE2 ASP 175.A OD2 no hydrogen 2.908 N/A GLU 70.A N LYS 66.A O no hydrogen 2.804 N/A PHE 71.A N LYS 67.A O no hydrogen 3.086 N/A ASP 72.A N GLN 69.A O no hydrogen 2.973 N/A ALA 73.A N ALA 68.A O no hydrogen 3.087 N/A ASP 74.A N ARG 4.A O no hydrogen 2.722 N/A PHE 76.A N PRO 177.A O no hydrogen 2.876 N/A ILE 77.A N VAL 6.A O no hydrogen 2.992 N/A SER 78.A N VAL 179.A O no hydrogen 2.905 N/A SER 78.A OG ASP 8.A OD2 no hydrogen 2.725 N/A SER 78.A OG HIS 80.A NE2 no hydrogen 2.956 N/A ILE 79.A N ASP 8.A O no hydrogen 2.818 N/A HIS 80.A N ILE 181.A O no hydrogen 2.923 N/A HIS 80.A NE2 SER 78.A OG no hydrogen 2.956 N/A ALA 81.A N GLU 26.A OE2 no hydrogen 2.897 N/A ASP 82.A N GLU 182.A OE1 no hydrogen 2.927 N/A ILE 84.A N SER 187.A OG no hydrogen 2.926 N/A LEU 89.A N VAL 86.A O no hydrogen 3.351 N/A ARG 90.A NE ASP 191.A OD1 no hydrogen 3.035 N/A GLY 91.A N ASP 191.A OD2 no hydrogen 2.889 N/A ALA 92.A N ASN 157.A O no hydrogen 2.976 N/A THR 93.A N GLU 182.A O no hydrogen 3.110 N/A THR 93.A OG1 GLY 91.A O no hydrogen 3.211 N/A THR 93.A OG1 TYR 185.A OH no hydrogen 2.695 N/A VAL 94.A N PRO 162.A O no hydrogen 2.826 N/A TYR 95.A N LEU 180.A O no hydrogen 2.773 N/A TYR 95.A OH TYR 185.A OH no hydrogen 2.853 N/A THR 96.A N ARG 164.A O no hydrogen 3.051 N/A THR 96.A OG1 HIS 163.A NE2 no hydrogen 2.825 N/A SER 98.A N ALA 166.A O no hydrogen 3.111 N/A SER 98.A OG GLU 100.A O no hydrogen 2.812 N/A GLU 100.A N SER 98.A OG no hydrogen 3.267 N/A SER 102.A N TYR 165.A O no hydrogen 2.843 N/A SER 102.A OG ASP 103.A OD1 no hydrogen 2.792 N/A SER 102.A OG TYR 165.A O no hydrogen 3.305 N/A ALA 106.A N ASP 103.A OD2 no hydrogen 2.887 N/A LYS 107.A N ASP 103.A O no hydrogen 3.010 N/A SER 108.A N ALA 104.A O no hydrogen 3.058 N/A SER 108.A OG ASP 85.A OD2 no hydrogen 2.868 N/A LEU 109.A N ILE 105.A O no hydrogen 2.891 N/A ALA 110.A N ALA 106.A O no hydrogen 2.980 N/A GLU 111.A N LYS 107.A O no hydrogen 3.102 N/A SER 112.A N SER 108.A O no hydrogen 3.063 N/A SER 112.A OG SER 108.A O no hydrogen 3.394 N/A GLU 113.A N LEU 109.A O no hydrogen 2.849 N/A ASN 114.A N ALA 110.A O no hydrogen 2.917 N/A ASN 114.A ND2 ASP 167.A O no hydrogen 2.838 N/A LYS 115.A N SER 112.A O no hydrogen 3.190 N/A LYS 115.A NZ.A SER 112.A OG no hydrogen 3.294 N/A LEU 118.A N LYS 115.A O no hydrogen 3.026 N/A LEU 119.A N VAL 116.A O no hydrogen 2.985 N/A GLY 121.A N LEU 118.A O no hydrogen 2.864 N/A LEU 122.A N ASP 120.A OD1 no hydrogen 2.835 N/A LEU 129.A N ASP 126.A OD2 no hydrogen 2.855 N/A ASP 130.A N ASP 126.A O no hydrogen 2.960 N/A LEU 131.A N ILE 127.A O no hydrogen 2.911 N/A THR 132.A N LEU 128.A O no hydrogen 3.032 N/A THR 132.A OG1 LEU 128.A O no hydrogen 2.924 N/A ARG 133.A N LEU 129.A O no hydrogen 2.863 N/A ARG 133.A NH1 ASP 130.A OD1 no hydrogen 3.014 N/A ARG 134.A N ASP 130.A O no hydrogen 3.101 N/A GLU 135.A N LEU 131.A O no hydrogen 3.060 N/A THR 136.A N THR 132.A O no hydrogen 2.871 N/A THR 136.A OG1 THR 132.A O no hydrogen 3.042 N/A THR 136.A OG1 PRO 174.A O no hydrogen 2.734 N/A HIS 137.A N ARG 133.A O no hydrogen 2.918 N/A HIS 137.A NE2 ILE 97.A O no hydrogen 3.134 N/A ALA 138.A N ARG 134.A O no hydrogen 3.084 N/A PHE 139.A N GLU 135.A O no hydrogen 3.221 N/A SER 140.A N THR 136.A O no hydrogen 2.919 N/A SER 140.A OG THR 136.A O no hydrogen 3.145 N/A SER 140.A OG SER 178.A O no hydrogen 3.416 N/A ILE 141.A N HIS 137.A O no hydrogen 2.944 N/A ASN 142.A N ALA 138.A O no hydrogen 3.003 N/A PHE 143.A N PHE 139.A O no hydrogen 2.933 N/A ALA 144.A N SER 140.A O no hydrogen 2.923 N/A ASN 145.A N ILE 141.A O no hydrogen 2.912 N/A ASN 146.A N ASN 142.A O no hydrogen 3.021 N/A ASN 146.A ND2 SER 210.A O no hydrogen 3.575 N/A ASN 146.A ND2 GLN 213.A OE1 no hydrogen 2.647 N/A VAL 147.A N PHE 143.A O no hydrogen 2.886 N/A VAL 148.A N ALA 144.A O no hydrogen 3.078 N/A SER 149.A N ASN 145.A O no hydrogen 3.001 N/A ASN 150.A N ASN 146.A O no hydrogen 2.947 N/A ASN 150.A ND2 SER 210.A OG no hydrogen 2.920 N/A ASN 150.A ND2 GLN 213.A OE1 no hydrogen 2.840 N/A LEU 151.A N VAL 147.A O no hydrogen 2.889 N/A SER 152.A N VAL 148.A O no hydrogen 3.042 N/A SER 152.A OG.B VAL 148.A O no hydrogen 3.387 N/A SER 152.A OG.B SER 149.A O no hydrogen 2.467 N/A SER 152.A OG.C VAL 148.A O no hydrogen 2.998 N/A LYS 153.A N SER 149.A O no hydrogen 3.076 N/A SER 154.A N ASN 150.A O no hydrogen 2.983 N/A SER 154.A OG ASN 150.A O no hydrogen 3.139 N/A HIS 155.A N SER 152.A O no hydrogen 2.947 N/A ILE 156.A N LEU 151.A O no hydrogen 3.023 N/A ILE 159.A N ALA 92.A O no hydrogen 3.128 N/A ASN 160.A ND2.A ASN 161.A OD1 no hydrogen 3.079 N/A HIS 163.A NE2 THR 96.A OG1 no hydrogen 2.825 N/A ARG 164.A N VAL 94.A O no hydrogen 2.918 N/A ARG 164.A NE ASN 161.A O no hydrogen 2.917 N/A ARG 164.A NH2 ASN 160.A O no hydrogen 2.626 N/A TYR 165.A N SER 102.A OG no hydrogen 3.078 N/A ALA 166.A N THR 96.A O no hydrogen 3.266 N/A PHE 168.A N ALA 166.A O no hydrogen 2.943 N/A GLN 169.A N ASN 114.A OD1 no hydrogen 2.850 N/A GLN 169.A NE2.B ASP 167.A O no hydrogen 3.244 N/A GLN 169.A NE2.B ASP 167.A OD1 no hydrogen 3.359 N/A LEU 171.A N PHE 168.A O no hydrogen 3.010 N/A LYS 172.A N GLN 169.A O no hydrogen 3.307 N/A LYS 172.A NZ ASP 167.A OD1 no hydrogen 2.887 N/A SER 178.A N SER 140.A OG no hydrogen 2.938 N/A SER 178.A OG VAL 176.A O no hydrogen 2.807 N/A VAL 179.A N PHE 76.A O no hydrogen 3.049 N/A LEU 180.A N TYR 95.A O no hydrogen 2.913 N/A ILE 181.A N SER 78.A O no hydrogen 2.785 N/A GLU 182.A N THR 93.A O no hydrogen 2.890 N/A ILE 183.A N HIS 80.A O no hydrogen 2.935 N/A TYR 185.A N ASP 191.A OD2 no hydrogen 2.881 N/A TYR 185.A OH THR 93.A OG1 no hydrogen 2.695 N/A TYR 185.A OH TYR 95.A OH no hydrogen 2.853 N/A ASN 188.A N TYR 185.A O no hydrogen 2.957 N/A ASN 188.A ND2 HIS 87.A O no hydrogen 3.011 N/A ASP 191.A N ASN 188.A OD1 no hydrogen 2.924 N/A GLU 192.A N ASN 188.A O no hydrogen 2.983 N/A LYS 193.A N LYS 189.A O no hydrogen 3.289 N/A LEU 194.A N GLU 190.A O no hydrogen 3.234 N/A LEU 195.A N ASP 191.A O no hydrogen 2.784 N/A ASN 196.A N GLU 192.A O no hydrogen 3.097 N/A ASN 197.A N LEU 194.A O no hydrogen 2.954 N/A GLN 199.A N ASN 197.A OD1 no hydrogen 2.908 N/A TRP 200.A N ASN 197.A OD1 no hydrogen 3.257 N/A ARG 201.A N ASN 197.A O no hydrogen 2.971 N/A ARG 201.A NH1 LEU 195.A O no hydrogen 2.730 N/A LYS 202.A N PRO 198.A O no hydrogen 2.904 N/A GLN 203.A N GLN 199.A O no hydrogen 3.023 N/A GLN 203.A NE2 GLN 199.A OE1.B no hydrogen 3.328 N/A ALA 205.A N LYS 202.A O no hydrogen 2.831 N/A SER 206.A N GLN 203.A O no hydrogen 3.195 N/A ALA 208.A N ALA 204.A O no hydrogen 2.846 N/A TYR 209.A N ALA 205.A O no hydrogen 3.043 N/A SER 210.A N SER 206.A O no hydrogen 2.993 N/A SER 210.A OG ASN 146.A O no hydrogen 3.543 N/A SER 210.A OG SER 206.A O no hydrogen 3.351 N/A ILE 211.A N ILE 207.A O no hydrogen 2.854 N/A ARG 212.A N ALA 208.A O no hydrogen 2.968 N/A GLN 213.A N TYR 209.A O no hydrogen 3.018 N/A PHE 214.A N SER 210.A O no hydrogen 2.926 N/A ALA 215.A N ILE 211.A O no hydrogen 2.803 N/A GLU 216.A N ARG 212.A O no hydrogen 3.008 N/A TYR 217.A N GLN 213.A O no hydrogen 3.064 N/A ARG 218.A N PHE 214.A O no hydrogen 2.849 N/A ARG 218.A NH1.A ASP 74.A O no hydrogen 2.842 N/A ARG 218.A NH1.B ASP 74.A O no hydrogen 2.948 N/A GLN 219.A N ALA 215.A O no hydrogen 2.992 N/A LYS 220.A N TYR 217.A O no hydrogen 3.006 N/A ILE 221.A N ARG 218.A O no hydrogen 3.246 N/A