Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nka_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 8.A N ASP 5.A O no hydrogen 3.323 N/A GLU 9.A N ASP 5.A O no hydrogen 3.009 N/A LEU 10.A N ALA 83.A O no hydrogen 2.882 N/A ARG 12.A NE GLN 86.A O no hydrogen 2.755 N/A ARG 12.A NH1 PRO 89.A O no hydrogen 2.916 N/A ARG 12.A NH2 GLN 86.A O no hydrogen 2.876 N/A ARG 12.A NH2 PRO 89.A O no hydrogen 2.785 N/A ARG 14.A N PRO 11.A O no hydrogen 3.067 N/A ARG 14.A NE ASP 13.A OD1 no hydrogen 3.261 N/A ARG 14.A NH1 ASP 13.A O no hydrogen 2.765 N/A LEU 15.A N ARG 12.A O no hydrogen 3.361 N/A VAL 16.A N GLU 29.A O no hydrogen 2.839 N/A GLY 18.A N LEU 27.A O no hydrogen 2.727 N/A LEU 21.A N VAL 25.A O no hydrogen 2.762 N/A GLN 24.A N MET 48.A O no hydrogen 3.309 N/A VAL 26.A N VAL 46.A O no hydrogen 2.982 N/A LEU 27.A N LYS 19.A O no hydrogen 2.807 N/A ALA 28.A N VAL 44.A O no hydrogen 2.918 N/A GLU 29.A N VAL 16.A O no hydrogen 3.028 N/A ALA 30.A N THR 42.A O no hydrogen 2.857 N/A ILE 31.A N ARG 14.A O no hydrogen 2.738 N/A GLY 32.A N ARG 40.A O no hydrogen 2.880 N/A ASP 36.A N ASP 34.A OD1 no hydrogen 2.945 N/A LYS 37.A N ASP 34.A O no hydrogen 3.273 N/A THR 42.A N ALA 30.A O no hydrogen 2.952 N/A VAL 44.A N ALA 28.A O no hydrogen 2.812 N/A ALA 45.A N VAL 94.A O no hydrogen 2.934 N/A VAL 46.A N VAL 26.A O no hydrogen 2.857 N/A LYS 47.A N VAL 92.A O no hydrogen 2.866 N/A MET 48.A N GLN 24.A O no hydrogen 3.129 N/A ALA 53.A N LYS 50.A O no hydrogen 3.110 N/A THR 54.A N ASP 57.A OD2 no hydrogen 2.935 N/A THR 54.A OG1 ASP 57.A OD2 no hydrogen 2.899 N/A LEU 58.A N THR 54.A O no hydrogen 3.175 N/A SER 59.A N GLU 55.A O no hydrogen 3.276 N/A SER 59.A OG LYS 56.A O no hydrogen 2.768 N/A ASP 60.A N LYS 56.A O no hydrogen 2.990 N/A LEU 61.A N ASP 57.A O no hydrogen 3.090 N/A ILE 62.A N LEU 58.A O no hydrogen 2.930 N/A SER 63.A N SER 59.A O no hydrogen 2.949 N/A GLU 64.A N ASP 60.A O no hydrogen 3.015 N/A MET 65.A N LEU 61.A O no hydrogen 3.169 N/A GLU 66.A N ILE 62.A O no hydrogen 2.943 N/A MET 67.A N SER 63.A O no hydrogen 2.906 N/A MET 68.A N GLU 64.A O no hydrogen 3.046 N/A LYS 69.A N MET 65.A O no hydrogen 2.989 N/A LYS 69.A NZ ASP 5.A OD2 no hydrogen 2.790 N/A LYS 69.A NZ GLU 66.A OE2 no hydrogen 3.063 N/A MET 70.A N GLU 66.A O no hydrogen 3.166 N/A ILE 71.A N MET 67.A O no hydrogen 2.960 N/A GLY 72.A N MET 68.A O no hydrogen 3.390 N/A LYS 73.A NZ LEU 80.A O no hydrogen 2.795 N/A HIS 74.A N ASN 79.A OD1 no hydrogen 3.161 N/A ASN 76.A N HIS 74.A ND1 no hydrogen 2.886 N/A ASN 76.A ND2 GLN 127.A OE1 no hydrogen 3.697 N/A ASN 76.A ND2 MET 158.A O no hydrogen 2.914 N/A ILE 77.A N HIS 74.A O no hydrogen 3.436 N/A ILE 78.A N ILE 160.A O no hydrogen 2.963 N/A ASN 79.A N GLU 95.A OE1 no hydrogen 2.816 N/A ASN 79.A ND2 HIS 74.A O no hydrogen 2.836 N/A ASN 79.A ND2 GLU 95.A OE1 no hydrogen 3.008 N/A ASN 79.A ND2 GLU 95.A OE2 no hydrogen 3.486 N/A LEU 81.A N ILE 93.A O no hydrogen 2.805 N/A GLY 82.A N ILE 93.A O no hydrogen 3.231 N/A ALA 83.A N TRP 8.A O no hydrogen 2.966 N/A CYS 84.A N TYR 91.A O no hydrogen 3.014 N/A CYS 84.A SG LEU 10.A O no hydrogen 3.408 N/A THR 85.A N GLU 9.A OE2 no hydrogen 2.968 N/A THR 85.A OG1 GLU 9.A OE1 no hydrogen 2.688 N/A THR 85.A OG1 GLU 9.A OE2 no hydrogen 3.540 N/A GLN 86.A NE2 LEU 2.A O no hydrogen 2.771 N/A GLN 86.A NE2 THR 85.A OG1 no hydrogen 2.962 N/A TYR 91.A N CYS 84.A O no hydrogen 2.895 N/A VAL 92.A N LYS 47.A O no hydrogen 2.904 N/A ILE 93.A N GLY 82.A O no hydrogen 2.873 N/A VAL 94.A N ALA 45.A O no hydrogen 2.913 N/A GLU 95.A N ASN 79.A O no hydrogen 3.002 N/A SER 98.A OG GLU 154.A OE1 no hydrogen 2.892 N/A LYS 99.A N VAL 152.A O no hydrogen 2.915 N/A LYS 99.A NZ GLU 154.A O no hydrogen 3.304 N/A LYS 99.A NZ ASN 156.A OD1 no hydrogen 3.012 N/A LEU 102.A N VAL 150.A O no hydrogen 2.737 N/A ARG 103.A NH1 GLU 104.A OE2 no hydrogen 3.401 N/A GLU 104.A N ASN 101.A OD1 no hydrogen 2.904 N/A TYR 105.A N ASN 101.A O no hydrogen 3.027 N/A TYR 105.A OH ASN 156.A OD1 no hydrogen 3.204 N/A LEU 106.A N LEU 102.A O no hydrogen 3.011 N/A GLN 107.A N ARG 103.A O no hydrogen 3.017 N/A GLN 107.A NE2 GLY 211.A O no hydrogen 3.157 N/A ALA 108.A N GLU 104.A O no hydrogen 2.913 N/A ARG 109.A N LEU 106.A O no hydrogen 3.122 N/A ARG 109.A NH1 TYR 105.A O no hydrogen 2.969 N/A ARG 110.A N GLN 107.A O no hydrogen 3.126 N/A ARG 110.A NE LEU 210.A O no hydrogen 2.810 N/A ARG 110.A NH2 THR 209.A O no hydrogen 3.277 N/A ARG 110.A NH2 LEU 210.A O no hydrogen 3.418 N/A SER 117.A N ASP 120.A OD2 no hydrogen 2.809 N/A SER 118.A N GLU 279.A O no hydrogen 2.917 N/A LYS 119.A N SER 276.A O no hydrogen 3.292 N/A LYS 119.A NZ VAL 272.A O no hydrogen 3.087 N/A LYS 119.A NZ THR 275.A O no hydrogen 2.720 N/A ASP 120.A N SER 117.A OG no hydrogen 3.275 N/A LEU 121.A N SER 117.A O no hydrogen 3.274 N/A VAL 122.A N SER 118.A O no hydrogen 3.177 N/A SER 123.A N LYS 119.A O no hydrogen 2.935 N/A CYS 124.A N ASP 120.A O no hydrogen 3.086 N/A CYS 124.A SG ASP 120.A O no hydrogen 3.242 N/A ALA 125.A N LEU 121.A O no hydrogen 3.212 N/A TYR 126.A N VAL 122.A O no hydrogen 2.875 N/A GLN 127.A N SER 123.A O no hydrogen 2.953 N/A GLN 127.A NE2 SER 123.A O no hydrogen 3.334 N/A GLN 127.A NE2 SER 123.A OG no hydrogen 3.042 N/A VAL 128.A N CYS 124.A O no hydrogen 3.028 N/A ALA 129.A N ALA 125.A O no hydrogen 2.967 N/A ARG 130.A N TYR 126.A O no hydrogen 2.880 N/A ARG 130.A NE ASN 76.A OD1 no hydrogen 3.228 N/A ARG 130.A NH1 ASN 76.A OD1 no hydrogen 3.564 N/A GLY 131.A N GLN 127.A O no hydrogen 3.060 N/A MET 132.A N VAL 128.A O no hydrogen 2.963 N/A GLU 133.A N ALA 129.A O no hydrogen 2.769 N/A TYR 134.A N ARG 130.A O no hydrogen 3.157 N/A TYR 134.A OH ILE 71.A O no hydrogen 2.723 N/A LEU 135.A N GLY 131.A O no hydrogen 2.978 N/A ALA 136.A N MET 132.A O no hydrogen 2.841 N/A SER 137.A N GLU 133.A O no hydrogen 2.964 N/A SER 137.A OG TYR 134.A O no hydrogen 2.671 N/A LYS 138.A N TYR 134.A O no hydrogen 3.165 N/A LYS 138.A N LEU 135.A O no hydrogen 3.010 N/A LYS 139.A N ALA 136.A O no hydrogen 2.939 N/A CYS 140.A N LEU 135.A O no hydrogen 3.063 N/A CYS 140.A SG PHE 163.A O no hydrogen 3.329 N/A HIS 142.A N ASP 196.A OD2 no hydrogen 2.923 N/A HIS 142.A NE2 ALA 161.A O no hydrogen 2.759 N/A ARG 143.A N ASP 196.A OD1 no hydrogen 3.105 N/A ASP 144.A N HIS 142.A ND1 no hydrogen 3.182 N/A ALA 147.A N GLU 206.A OE2 no hydrogen 3.028 N/A ARG 148.A NH2 ASP 144.A OD1 no hydrogen 2.759 N/A ASN 149.A N ALA 146.A O no hydrogen 3.076 N/A ASN 149.A ND2 ASP 144.A O no hydrogen 2.806 N/A ASN 149.A ND2 ASP 144.A OD2 no hydrogen 2.819 N/A VAL 150.A N ALA 147.A O no hydrogen 3.175 N/A LEU 151.A N LYS 159.A O no hydrogen 2.716 N/A VAL 152.A N GLY 100.A O no hydrogen 2.841 N/A THR 153.A N VAL 157.A O no hydrogen 3.112 N/A ASN 156.A N THR 153.A O no hydrogen 3.019 N/A VAL 157.A N THR 153.A OG1 no hydrogen 3.102 N/A MET 158.A N GLN 127.A OE1 no hydrogen 3.020 N/A LYS 159.A N LEU 151.A O no hydrogen 2.758 N/A LYS 159.A NZ LYS 75.A O no hydrogen 2.788 N/A LYS 159.A NZ ILE 77.A O no hydrogen 3.084 N/A LYS 159.A NZ GLU 95.A OE1 no hydrogen 2.770 N/A LYS 159.A NZ GLU 95.A OE2 no hydrogen 3.507 N/A ILE 160.A N ASN 76.A O no hydrogen 3.012 N/A ALA 161.A N ASN 149.A O no hydrogen 2.823 N/A LYS 169.A N ASP 166.A O no hydrogen 3.338 N/A THR 171.A N ARG 175.A O no hydrogen 2.825 N/A THR 171.A OG1 ARG 175.A O no hydrogen 3.150 N/A ARG 175.A N THR 171.A OG1 no hydrogen 2.923 N/A LYS 179.A N LEU 176.A O no hydrogen 3.067 N/A LYS 179.A NZ TYR 215.A O no hydrogen 2.824 N/A LYS 179.A NZ VAL 218.A O no hydrogen 2.777 N/A TRP 180.A N PRO 177.A O no hydrogen 3.108 N/A TRP 180.A NE1 GLU 206.A OE2 no hydrogen 2.738 N/A MET 181.A N VAL 178.A O no hydrogen 3.049 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.809 N/A LEU 186.A N ALA 182.A O no hydrogen 2.870 N/A PHE 187.A N PRO 183.A O no hydrogen 2.741 N/A ASP 188.A N GLU 184.A O no hydrogen 2.916 N/A ILE 190.A N GLU 184.A O no hydrogen 3.131 N/A THR 192.A N SER 195.A OG no hydrogen 2.855 N/A THR 192.A OG1 GLN 194.A OE1 no hydrogen 3.179 N/A GLN 194.A N THR 192.A OG1 no hydrogen 3.047 N/A SER 195.A N THR 192.A O no hydrogen 3.218 N/A SER 195.A N THR 192.A OG1 no hydrogen 3.284 N/A SER 195.A OG THR 192.A O no hydrogen 2.714 N/A ASP 196.A N THR 192.A O no hydrogen 3.343 N/A VAL 197.A N HIS 193.A O no hydrogen 3.045 N/A TRP 198.A N GLN 194.A O no hydrogen 3.279 N/A SER 199.A N SER 195.A O no hydrogen 3.277 N/A SER 199.A OG TRP 180.A O no hydrogen 2.709 N/A SER 199.A OG SER 195.A O no hydrogen 3.468 N/A PHE 200.A N ASP 196.A O no hydrogen 2.881 N/A GLY 201.A N VAL 197.A O no hydrogen 3.044 N/A VAL 202.A N TRP 198.A O no hydrogen 3.237 N/A LEU 203.A N SER 199.A O no hydrogen 2.889 N/A LEU 204.A N PHE 200.A O no hydrogen 2.764 N/A TRP 205.A N GLY 201.A O no hydrogen 3.221 N/A TRP 205.A NE1 ASP 234.A O no hydrogen 3.260 N/A GLU 206.A N VAL 202.A O no hydrogen 3.046 N/A ILE 207.A N LEU 203.A O no hydrogen 2.985 N/A PHE 208.A N LEU 204.A O no hydrogen 3.038 N/A THR 209.A N TRP 205.A O no hydrogen 3.047 N/A THR 209.A OG1 TRP 205.A O no hydrogen 2.836 N/A THR 209.A OG1 GLU 206.A O no hydrogen 3.295 N/A LEU 210.A N ILE 207.A O no hydrogen 3.020 N/A GLY 211.A N GLU 206.A O no hydrogen 2.780 N/A GLY 212.A N THR 209.A OG1 no hydrogen 3.092 N/A VAL 218.A N TYR 215.A O no hydrogen 3.251 N/A LEU 223.A N PRO 219.A O no hydrogen 3.029 N/A PHE 224.A N VAL 220.A O no hydrogen 3.045 N/A LYS 225.A N GLU 221.A O no hydrogen 3.378 N/A LEU 226.A N GLU 222.A O no hydrogen 2.958 N/A LEU 227.A N LEU 223.A O no hydrogen 2.884 N/A LYS 228.A N PHE 224.A O no hydrogen 2.941 N/A GLU 229.A N LYS 225.A O no hydrogen 3.029 N/A GLY 230.A N LEU 227.A O no hydrogen 3.016 N/A HIS 231.A N LEU 226.A O no hydrogen 2.864 N/A ARG 232.A NE TRP 251.A O no hydrogen 2.906 N/A ARG 232.A NH1 HIS 231.A O no hydrogen 2.974 N/A ARG 232.A NH2 TRP 251.A O no hydrogen 2.800 N/A LYS 235.A NZ ASN 241.A OD1 no hydrogen 2.740 N/A CYS 239.A SG THR 240.A O no hydrogen 3.583 N/A LEU 243.A N THR 240.A OG1 no hydrogen 3.019 N/A TYR 244.A N THR 240.A O no hydrogen 3.116 N/A TYR 244.A OH MET 233.A O no hydrogen 2.684 N/A MET 245.A N ASN 241.A O no hydrogen 2.945 N/A MET 246.A N GLU 242.A O no hydrogen 3.047 N/A MET 247.A N LEU 243.A O no hydrogen 3.096 N/A ARG 248.A N TYR 244.A O no hydrogen 2.933 N/A ARG 248.A NH1 TYR 244.A OH no hydrogen 2.925 N/A ASP 249.A N MET 245.A O no hydrogen 2.803 N/A CYS 250.A N MET 246.A O no hydrogen 2.993 N/A CYS 250.A SG MET 246.A O no hydrogen 3.277 N/A TRP 251.A N MET 247.A O no hydrogen 3.008 N/A HIS 252.A N ASP 249.A O no hydrogen 3.110 N/A VAL 254.A N HIS 252.A ND1 no hydrogen 3.276 N/A GLN 257.A N VAL 254.A O no hydrogen 3.056 N/A GLN 257.A NE2 SER 256.A OG no hydrogen 3.208 N/A ARG 258.A N PRO 255.A O no hydrogen 3.246 N/A ARG 258.A NE HIS 252.A O no hydrogen 2.788 N/A ARG 258.A NH1 GLU 184.A OE1 no hydrogen 3.530 N/A ARG 258.A NH1 GLU 184.A OE2 no hydrogen 2.758 N/A ARG 258.A NH1 GLN 194.A O no hydrogen 2.935 N/A ARG 258.A NH2 GLU 184.A OE1 no hydrogen 2.869 N/A ARG 258.A NH2 HIS 252.A O no hydrogen 3.055 N/A THR 260.A N GLN 263.A OE1 no hydrogen 3.091 N/A GLN 263.A N THR 260.A OG1 no hydrogen 3.266 N/A LEU 264.A N THR 260.A O no hydrogen 2.967 N/A VAL 265.A N PHE 261.A O no hydrogen 2.910 N/A GLU 266.A N LYS 262.A O no hydrogen 3.168 N/A ASP 267.A N GLN 263.A O no hydrogen 2.853 N/A LEU 268.A N LEU 264.A O no hydrogen 2.797 N/A ASP 269.A N VAL 265.A O no hydrogen 2.923 N/A ARG 270.A N GLU 266.A O no hydrogen 3.257 N/A ARG 270.A NH1 GLU 242.A OE2 no hydrogen 2.807 N/A ARG 270.A NH2 GLU 242.A OE2 no hydrogen 3.529 N/A ARG 270.A NH2 ASP 267.A OD1 no hydrogen 3.548 N/A ILE 271.A N ASP 267.A O no hydrogen 2.976 N/A VAL 272.A N LEU 268.A O no hydrogen 2.879 N/A ALA 273.A N ASP 269.A O no hydrogen 3.489 N/A LEU 274.A N ILE 271.A O no hydrogen 2.945 N/A THR 275.A N VAL 272.A O no hydrogen 3.000 N/A THR 275.A OG1 ILE 271.A O no hydrogen 2.761 N/A GLN 278.A NE2 ASN 277.A OD1 no hydrogen 3.058 N/A