Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nek_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ ASN 10.A OD1 no hydrogen 3.473 N/A THR 4.A OG1 TYR 111.A O no hydrogen 2.657 N/A THR 4.A OG1 ASP 112.A O no hydrogen 2.997 N/A THR 4.A OG1 SER 114.A O no hydrogen 3.022 N/A ALA 5.A N SER 114.A O no hydrogen 2.750 N/A LEU 6.A N TYR 111.A O no hydrogen 3.274 N/A SER 7.A OG THR 4.A O no hydrogen 2.980 N/A LYS 8.A N THR 4.A O no hydrogen 3.101 N/A ASN 10.A N SER 7.A O no hydrogen 3.156 N/A ALA 11.A N LYS 8.A O no hydrogen 3.126 N/A LYS 13.A N ALA 11.A O no hydrogen 3.279 N/A THR 15.A N ASP 24.A O no hydrogen 3.010 N/A ASP 17.A N ASP 22.A O no hydrogen 2.766 N/A ASP 19.A N ASP 17.A OD1 no hydrogen 2.897 N/A ALA 21.A N ILE 18.A O no hydrogen 3.112 N/A ASP 22.A N ASP 17.A O no hydrogen 3.286 N/A GLY 23.A N ASP 22.A OD1 no hydrogen 2.789 N/A VAL 25.A N VAL 206.A O no hydrogen 2.738 N/A ILE 26.A N THR 76.A OG1 no hydrogen 2.988 N/A VAL 27.A N GLU 204.A O no hydrogen 2.932 N/A ASN 28.A N THR 71.A O no hydrogen 2.668 N/A ASN 28.A ND2 THR 71.A O no hydrogen 3.311 N/A THR 29.A OG1 GLU 204.A OE1 no hydrogen 2.905 N/A ALA 30.A N ILE 69.A O no hydrogen 2.924 N/A PHE 31.A N GLU 199.A O no hydrogen 3.129 N/A ILE 32.A N ILE 67.A O no hydrogen 3.194 N/A LYS 34.A NZ GLU 63.A O no hydrogen 2.652 N/A LYS 34.A NZ ASN 64.A O no hydrogen 3.366 N/A TYR 36.A N ASP 33.A O no hydrogen 3.237 N/A LEU 37.A N LYS 34.A O no hydrogen 3.263 N/A GLU 39.A N GLU 39.A OE2 no hydrogen 2.856 N/A ALA 40.A N TYR 36.A O no hydrogen 3.075 N/A PHE 41.A N LEU 37.A O no hydrogen 3.369 N/A ILE 43.A N GLU 39.A O no hydrogen 3.087 N/A LEU 44.A N ALA 40.A O no hydrogen 2.890 N/A LYS 45.A N PHE 41.A O no hydrogen 2.950 N/A GLU 46.A N ASP 42.A O no hydrogen 3.058 N/A ALA 47.A N ILE 43.A O no hydrogen 2.792 N/A TYR 48.A N LEU 44.A O no hydrogen 3.022 N/A LYS 49.A N LYS 45.A O no hydrogen 3.053 N/A LYS 50.A N GLU 46.A O no hydrogen 3.043 N/A LYS 50.A N ALA 47.A O no hydrogen 3.278 N/A GLY 51.A N TYR 48.A O no hydrogen 3.443 N/A LEU 52.A N ALA 47.A O no hydrogen 3.038 N/A SER 55.A N ASN 157.A O no hydrogen 2.891 N/A SER 55.A OG ILE 54.A O no hydrogen 2.768 N/A ARG 57.A N SER 55.A OG no hydrogen 3.063 N/A ARG 57.A NE LEU 211.A O no hydrogen 3.000 N/A PHE 58.A N LYS 212.A O no hydrogen 2.851 N/A GLY 59.A N GLN 70.A O no hydrogen 2.795 N/A VAL 61.A N LYS 68.A O no hydrogen 2.953 N/A ARG 66.A NE GLU 63.A OE1 no hydrogen 2.713 N/A ARG 66.A NH2 GLU 63.A OE1 no hydrogen 3.338 N/A ILE 67.A N ILE 32.A O no hydrogen 2.806 N/A LYS 68.A N VAL 61.A O no hydrogen 3.342 N/A LYS 68.A NZ GLU 204.A OE1 no hydrogen 2.905 N/A LYS 68.A NZ GLU 204.A OE2 no hydrogen 2.948 N/A ILE 69.A N ALA 30.A O no hydrogen 3.033 N/A GLN 70.A N GLY 59.A O no hydrogen 2.846 N/A THR 71.A N ASN 28.A O no hydrogen 3.140 N/A THR 71.A OG1 GLY 184.A O no hydrogen 3.408 N/A CYS 73.A N ILE 26.A O no hydrogen 2.785 N/A THR 76.A N CYS 73.A O no hydrogen 2.993 N/A THR 76.A OG1 ILE 26.A O no hydrogen 3.109 N/A THR 76.A OG1 CYS 73.A O no hydrogen 3.123 N/A ASP 78.A N ALA 74.A O no hydrogen 3.139 N/A GLY 79.A N VAL 75.A O no hydrogen 2.975 N/A ILE 80.A N THR 76.A O no hydrogen 2.835 N/A PHE 81.A N LEU 77.A O no hydrogen 2.942 N/A LEU 82.A N ASP 78.A O no hydrogen 3.274 N/A ARG 83.A N GLY 79.A O no hydrogen 3.189 N/A ASN 84.A N ILE 80.A O no hydrogen 3.157 N/A ASN 84.A N PHE 81.A O no hydrogen 3.091 N/A ASN 84.A ND2 ILE 80.A O no hydrogen 2.709 N/A SER 85.A N LEU 82.A O no hydrogen 3.138 N/A VAL 86.A N PHE 81.A O no hydrogen 2.803 N/A ILE 89.A N GLU 138.A O no hydrogen 2.856 N/A LYS 91.A N PHE 136.A O no hydrogen 2.752 N/A TYR 92.A N PHE 136.A O no hydrogen 3.195 N/A GLY 93.A N ILE 109.A O no hydrogen 2.890 N/A GLY 94.A N ALA 134.A O no hydrogen 2.878 N/A ILE 95.A N ASP 107.A O no hydrogen 2.924 N/A LEU 96.A N PHE 132.A O no hydrogen 2.628 N/A GLU 97.A N ARG 104.A O no hydrogen 2.791 N/A ILE 98.A N LYS 130.A O no hydrogen 2.852 N/A THR 99.A N LYS 102.A O no hydrogen 3.349 N/A ARG 104.A N GLU 97.A O no hydrogen 3.079 N/A PHE 105.A N TYR 170.A O no hydrogen 2.841 N/A ILE 106.A N ILE 95.A O no hydrogen 2.987 N/A ILE 109.A N GLY 93.A O no hydrogen 2.756 N/A TYR 111.A N LYS 91.A O no hydrogen 3.035 N/A SER 114.A N TYR 111.A O no hydrogen 3.510 N/A SER 114.A OG GLY 110.A O no hydrogen 2.787 N/A HIS 119.A N ASP 117.A OD1 no hydrogen 2.962 N/A HIS 119.A NE2 ALA 134.A O no hydrogen 3.057 N/A GLU 120.A N ASP 117.A O no hydrogen 3.013 N/A VAL 121.A N ASP 117.A O no hydrogen 3.422 N/A PHE 122.A N PRO 118.A O no hydrogen 3.022 N/A PHE 125.A N PHE 122.A O no hydrogen 3.224 N/A ASP 127.A N THR 131.A OG1 no hydrogen 3.321 N/A CYS 128.A N THR 131.A O no hydrogen 2.933 N/A CYS 128.A SG ASN 186.A O no hydrogen 3.535 N/A CYS 128.A SG ASN 186.A OD1 no hydrogen 3.281 N/A GLU 129.A N ASP 127.A OD1 no hydrogen 3.257 N/A LYS 130.A N ASP 127.A OD1 no hydrogen 3.139 N/A THR 131.A N ASP 127.A OD1 no hydrogen 2.987 N/A THR 131.A OG1 ASP 127.A OD1 no hydrogen 2.989 N/A PHE 132.A N LEU 96.A O no hydrogen 2.764 N/A LEU 133.A N ASN 186.A OD1 no hydrogen 3.037 N/A ALA 134.A N GLY 94.A O no hydrogen 2.913 N/A GLY 135.A N THR 182.A O no hydrogen 2.911 N/A PHE 136.A N TYR 92.A O no hydrogen 2.677 N/A ARG 137.A N VAL 180.A O no hydrogen 2.674 N/A ARG 137.A NE ASP 78.A OD1 no hydrogen 3.071 N/A ARG 137.A NE ASP 78.A OD2 no hydrogen 3.265 N/A ARG 137.A NH2 ASP 78.A OD2 no hydrogen 2.814 N/A GLU 138.A N ILE 89.A O no hydrogen 2.815 N/A VAL 139.A N CYS 178.A O no hydrogen 3.019 N/A ARG 141.A N ASP 177.A O no hydrogen 3.232 N/A VAL 142.A N HIS 140.A ND1 no hydrogen 3.509 N/A ARG 144.A N ARG 141.A O no hydrogen 3.383 N/A ARG 144.A NE GLU 148.A OE2 no hydrogen 2.871 N/A ARG 144.A NH2 GLU 164.A OE2 no hydrogen 3.217 N/A LEU 147.A N ALA 143.A O no hydrogen 2.956 N/A GLU 148.A N ARG 144.A O no hydrogen 3.248 N/A GLU 149.A N GLU 145.A O no hydrogen 3.180 N/A VAL 150.A N LYS 146.A O no hydrogen 2.903 N/A LEU 151.A N LEU 147.A O no hydrogen 2.915 N/A LYS 152.A N GLU 148.A O no hydrogen 3.050 N/A LYS 153.A N GLU 149.A O no hydrogen 3.185 N/A LEU 154.A N VAL 150.A O no hydrogen 2.896 N/A ASN 155.A N LEU 151.A O no hydrogen 2.992 N/A ASN 157.A ND2 GLY 51.A O no hydrogen 2.774 N/A ASN 157.A ND2 GLY 53.A O no hydrogen 3.232 N/A LYS 160.A N VAL 181.A O no hydrogen 2.805 N/A LYS 160.A NZ GLU 103.A OE2 no hydrogen 3.283 N/A LYS 160.A NZ TYR 170.A OH no hydrogen 3.481 N/A ALA 161.A N VAL 181.A O no hydrogen 3.481 N/A GLY 163.A N GLY 179.A O no hydrogen 2.852 N/A ASN 167.A N GLU 164.A O no hydrogen 3.148 N/A LEU 169.A N ILE 172.A O no hydrogen 2.978 N/A ILE 172.A N LEU 169.A O no hydrogen 3.036 N/A ASN 175.A N GLU 138.A OE2 no hydrogen 2.781 N/A ASP 177.A N ASN 166.A OD1 no hydrogen 2.801 N/A VAL 180.A N ARG 137.A O no hydrogen 2.787 N/A VAL 181.A N ALA 161.A O no hydrogen 3.027 N/A THR 182.A N GLY 135.A O no hydrogen 2.991 N/A THR 182.A OG1 GLY 135.A O no hydrogen 3.569 N/A ASN 186.A N GLY 183.A O no hydrogen 3.418 N/A ASN 186.A ND2 LEU 133.A O no hydrogen 2.961 N/A LEU 188.A N ILE 185.A O no hydrogen 3.167 N/A VAL 189.A N ASN 186.A O no hydrogen 3.023 N/A LEU 191.A N LEU 188.A O no hydrogen 3.205 N/A LYS 192.A N LEU 188.A O no hydrogen 3.332 N/A LYS 192.A NZ PHE 123.A O no hydrogen 2.759 N/A LYS 192.A NZ VAL 126.A O no hydrogen 3.280 N/A GLU 193.A N VAL 189.A O no hydrogen 2.889 N/A ASN 194.A N LEU 190.A O no hydrogen 3.059 N/A ASN 194.A N LEU 191.A O no hydrogen 3.070 N/A ASN 194.A ND2 LEU 190.A O no hydrogen 2.915 N/A GLU 195.A N LYS 192.A O no hydrogen 2.961 N/A ILE 196.A N LEU 191.A O no hydrogen 2.780 N/A GLU 199.A N PHE 31.A O no hydrogen 3.223 N/A GLU 204.A N VAL 27.A O no hydrogen 3.081 N/A VAL 206.A N VAL 25.A O no hydrogen 3.089 N/A ARG 207.A NE ASP 24.A OD1 no hydrogen 2.731 N/A ARG 207.A NH2 ASP 24.A OD1 no hydrogen 3.126 N/A PHE 208.A N GLY 23.A O no hydrogen 2.866 N/A SER 209.A OG ASP 22.A OD2 no hydrogen 2.712 N/A ASP 210.A N ARG 207.A O no hydrogen 2.964 N/A LEU 211.A N PHE 208.A O no hydrogen 3.302 N/A LYS 212.A N PHE 58.A O no hydrogen 2.679 N/A SER 213.A OG ASP 56.A OD2 no hydrogen 2.607 N/A TYR 214.A N ASP 56.A O no hydrogen 3.025 N/A