Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nk5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N ALA 32.A O no hydrogen 2.904 N/A LYS 6.A N ASN 3.A O no hydrogen 3.093 N/A LYS 8.A N LEU 5.A O no hydrogen 2.991 N/A ARG 9.A N ASP 87.A OD2 no hydrogen 2.663 N/A ARG 9.A NH1 THR 85.A O no hydrogen 3.337 N/A GLY 10.A N GLN 35.A O no hydrogen 2.962 N/A LEU 11.A N PHE 88.A O no hydrogen 2.915 N/A ILE 12.A N ALA 37.A O no hydrogen 2.895 N/A MET 13.A N VAL 90.A O no hydrogen 2.919 N/A ALA 16.A N SER 20.A OG no hydrogen 2.919 N/A ASN 17.A N SER 20.A OG no hydrogen 3.076 N/A HIS 19.A N ASN 17.A OD1 no hydrogen 2.674 N/A HIS 19.A ND1 ASP 18.A OD1 no hydrogen 2.768 N/A SER 20.A N ASN 17.A O no hydrogen 3.380 N/A SER 20.A OG ASN 17.A O no hydrogen 3.314 N/A SER 20.A OG ASN 17.A OD1 no hydrogen 3.564 N/A TRP 23.A N SER 20.A O no hydrogen 2.972 N/A GLY 24.A N SER 20.A O no hydrogen 3.160 N/A ILE 25.A N ILE 21.A O no hydrogen 2.954 N/A ALA 26.A N ALA 22.A O no hydrogen 2.902 N/A LYS 27.A N TRP 23.A O no hydrogen 2.885 N/A VAL 28.A N GLY 24.A O no hydrogen 3.090 N/A LEU 29.A N ILE 25.A O no hydrogen 2.974 N/A HIS 30.A N ALA 26.A O no hydrogen 2.883 N/A SER 31.A N LYS 27.A O no hydrogen 2.982 N/A SER 31.A OG VAL 28.A O no hydrogen 3.197 N/A ALA 32.A N LEU 29.A O no hydrogen 3.047 N/A GLY 33.A N HIS 30.A O no hydrogen 2.828 N/A ALA 34.A N LEU 29.A O no hydrogen 3.330 N/A GLN 35.A N LYS 8.A O no hydrogen 2.956 N/A ALA 37.A N GLY 10.A O no hydrogen 2.867 N/A PHE 38.A N PHE 60.A O no hydrogen 2.883 N/A SER 39.A N ILE 12.A O no hydrogen 3.032 N/A TYR 40.A N ILE 62.A O no hydrogen 3.032 N/A GLN 41.A NE2 GLN 41.A O no hydrogen 2.601 N/A GLY 46.A N GLY 42.A O no hydrogen 2.967 N/A LYS 47.A N GLU 43.A O no hydrogen 2.950 N/A LYS 47.A NZ GLU 43.A OE2 no hydrogen 3.567 N/A ARG 48.A N SER 44.A O no hydrogen 2.983 N/A ARG 48.A NE ALA 16.A O no hydrogen 3.343 N/A ARG 48.A NH2 ALA 16.A O no hydrogen 3.327 N/A LEU 49.A N ILE 45.A O no hydrogen 2.847 N/A LEU 49.A N GLY 46.A O no hydrogen 3.083 N/A LYS 50.A N GLY 46.A O no hydrogen 2.997 N/A ALA 53.A N LEU 49.A O no hydrogen 2.797 N/A LEU 54.A N LYS 50.A O no hydrogen 3.124 N/A THR 55.A N LEU 52.A O no hydrogen 2.662 N/A THR 55.A OG1 LEU 52.A O no hydrogen 2.661 N/A VAL 56.A N ALA 53.A O no hydrogen 3.103 N/A ASP 57.A N LEU 54.A O no hydrogen 3.069 N/A SER 58.A N ALA 53.A O no hydrogen 2.864 N/A SER 58.A OG LEU 36.A O no hydrogen 2.669 N/A PHE 60.A N SER 58.A OG no hydrogen 3.189 N/A ILE 62.A N PHE 38.A O no hydrogen 2.808 N/A CYS 64.A N TYR 40.A O no hydrogen 2.922 N/A CYS 64.A SG SER 71.A O no hydrogen 3.951 N/A ASN 65.A N SER 71.A OG no hydrogen 2.853 N/A GLU 67.A N ASN 65.A OD1 no hydrogen 3.119 N/A ASP 68.A N ASN 65.A O no hydrogen 2.992 N/A SER 71.A N ASP 68.A O no hydrogen 2.897 N/A SER 71.A N ASP 68.A OD2 no hydrogen 3.326 N/A MET 72.A N ASP 68.A O no hydrogen 3.285 N/A ASP 73.A N PRO 69.A O no hydrogen 3.020 N/A LEU 74.A N SER 70.A O no hydrogen 2.913 N/A LEU 75.A N SER 71.A O no hydrogen 2.892 N/A PHE 76.A N MET 72.A O no hydrogen 3.107 N/A GLU 77.A N ASP 73.A O no hydrogen 2.910 N/A ARG 78.A N LEU 74.A O no hydrogen 2.873 N/A ILE 79.A N LEU 75.A O no hydrogen 2.956 N/A LYS 80.A N PHE 76.A O no hydrogen 2.942 N/A GLU 81.A N GLU 77.A O no hydrogen 3.045 N/A ARG 82.A N ILE 79.A O no hydrogen 3.058 N/A ARG 82.A NH2 ASP 59.A OD2 no hydrogen 2.513 N/A TRP 83.A N ILE 79.A O no hydrogen 2.891 N/A THR 85.A OG1 LEU 134.A O no hydrogen 3.361 N/A LEU 86.A N LEU 134.A O no hydrogen 2.929 N/A ASP 87.A N ARG 9.A O no hydrogen 2.734 N/A PHE 88.A N ARG 9.A O no hydrogen 3.265 N/A VAL 89.A N ALA 140.A O no hydrogen 3.042 N/A VAL 90.A N LEU 11.A O no hydrogen 2.853 N/A HIS 91.A N ILE 142.A O no hydrogen 2.852 N/A HIS 91.A ND1 THR 143.A OG1 no hydrogen 2.745 N/A HIS 91.A NE2 SER 123.A OG no hydrogen 2.969 N/A SER 92.A N MET 13.A O no hydrogen 3.004 N/A PHE 95.A N SER 120.A OG no hydrogen 3.169 N/A SER 96.A OG ASN 112.A OD1 no hydrogen 3.195 N/A SER 96.A OG THR 116.A OG1 no hydrogen 2.497 N/A ASP 97.A N ASN 112.A OD1 no hydrogen 3.072 N/A ASN 99.A N ASP 97.A OD1 no hydrogen 2.922 N/A GLU 100.A N ASP 97.A O no hydrogen 2.812 N/A LEU 101.A N LYS 98.A O no hydrogen 3.066 N/A ASN 107.A N PRO 104.A O no hydrogen 3.205 N/A THR 108.A N TYR 105.A O no hydrogen 2.898 N/A THR 108.A OG1 TYR 105.A O no hydrogen 2.829 N/A SER 109.A N GLU 100.A OE2 no hydrogen 2.690 N/A SER 109.A OG GLU 100.A OE1 no hydrogen 2.628 N/A ASN 112.A N SER 109.A OG no hydrogen 3.364 N/A ASN 112.A ND2 SER 96.A OG no hydrogen 3.392 N/A ASN 112.A ND2 GLU 100.A OE2 no hydrogen 3.047 N/A PHE 113.A N SER 109.A O no hydrogen 3.036 N/A ILE 114.A N ARG 110.A O no hydrogen 2.916 N/A GLN 115.A N ASP 111.A O no hydrogen 2.941 N/A GLN 115.A NE2 GLU 67.A OE1 no hydrogen 3.290 N/A GLN 115.A NE2 GLU 67.A OE2 no hydrogen 3.478 N/A THR 116.A N ASN 112.A O no hydrogen 2.856 N/A THR 116.A OG1 SER 96.A OG no hydrogen 2.497 N/A THR 116.A OG1 ASN 112.A O no hydrogen 2.625 N/A THR 116.A OG1 ASN 112.A OD1 no hydrogen 2.971 N/A MET 117.A N PHE 113.A O no hydrogen 2.975 N/A LEU 118.A N ILE 114.A O no hydrogen 2.945 N/A VAL 119.A N GLN 115.A O no hydrogen 2.894 N/A SER 120.A N THR 116.A O no hydrogen 2.834 N/A SER 120.A OG PHE 95.A O no hydrogen 3.167 N/A CYS 121.A N MET 117.A O no hydrogen 2.859 N/A PHE 122.A N MET 117.A O no hydrogen 2.974 N/A SER 123.A OG HIS 91.A NE2 no hydrogen 2.969 N/A SER 123.A OG VAL 119.A O no hydrogen 2.597 N/A PHE 124.A N CYS 121.A O no hydrogen 3.185 N/A GLU 126.A N PHE 122.A O no hydrogen 2.954 N/A ILE 127.A N SER 123.A O no hydrogen 2.864 N/A VAL 128.A N PHE 124.A O no hydrogen 2.796 N/A ARG 129.A N THR 125.A O no hydrogen 3.011 N/A ARG 129.A NH2 GLU 126.A OE1 no hydrogen 2.833 N/A ARG 130.A N GLU 126.A O no hydrogen 3.486 N/A ARG 130.A NE ASP 73.A OD1 no hydrogen 2.902 N/A ARG 130.A NH1 GLU 126.A O no hydrogen 2.900 N/A ARG 130.A NH1 GLU 126.A OE1 no hydrogen 2.616 N/A ARG 130.A NH2 ASP 73.A OD1 no hydrogen 3.186 N/A ARG 130.A NH2 GLU 126.A OE1 no hydrogen 3.384 N/A ALA 131.A N ILE 127.A O no hydrogen 2.929 N/A ALA 132.A N VAL 128.A O no hydrogen 2.885 N/A GLN 133.A N ARG 130.A O no hydrogen 3.106 N/A LEU 134.A N ALA 131.A O no hydrogen 2.661 N/A MET 135.A N ALA 132.A O no hydrogen 2.904 N/A GLY 138.A N MET 135.A O no hydrogen 2.828 N/A GLY 139.A N ASN 181.A O no hydrogen 3.090 N/A ALA 140.A N ASP 87.A O no hydrogen 3.175 N/A MET 141.A N ARG 183.A O no hydrogen 2.854 N/A ILE 142.A N VAL 89.A O no hydrogen 2.958 N/A THR 143.A N ASN 185.A O no hydrogen 3.137 N/A THR 143.A OG1 HIS 91.A ND1 no hydrogen 2.745 N/A THR 143.A OG1 HIS 91.A O no hydrogen 3.278 N/A LEU 144.A N HIS 91.A O no hydrogen 3.075 N/A THR 145.A N ILE 187.A O no hydrogen 2.759 N/A THR 145.A OG1 GLU 167.A OE2 no hydrogen 2.728 N/A TYR 146.A N THR 145.A OG1 no hydrogen 2.667 N/A SER 149.A N TYR 146.A O no hydrogen 2.991 N/A SER 149.A OG TYR 146.A O no hydrogen 3.344 N/A SER 149.A OG GLU 167.A OE1 no hydrogen 3.451 N/A SER 149.A OG GLU 167.A OE2 no hydrogen 2.755 N/A MET 150.A N GLY 147.A O no hydrogen 3.170 N/A ARG 151.A N GLY 147.A O no hydrogen 3.176 N/A ARG 151.A NH1 ASN 252.A O no hydrogen 3.466 N/A ARG 151.A NH2 ASN 252.A O no hydrogen 3.161 N/A ASN 155.A ND2 SER 201.A O no hydrogen 3.036 N/A TYR 156.A N VAL 153.A O no hydrogen 3.257 N/A ASN 157.A ND2 GLU 100.A O no hydrogen 3.052 N/A ASN 157.A ND2 GLY 103.A O no hydrogen 2.846 N/A MET 159.A N TYR 156.A O no hydrogen 2.975 N/A ALA 160.A N ASN 157.A O no hydrogen 2.913 N/A ALA 162.A N ALA 158.A O no hydrogen 3.469 N/A LYS 163.A N MET 159.A O no hydrogen 2.842 N/A LYS 163.A NZ LEU 144.A O no hydrogen 2.763 N/A SER 164.A N ALA 160.A O no hydrogen 3.030 N/A ALA 165.A N PRO 161.A O no hydrogen 2.928 N/A LEU 166.A N ALA 162.A O no hydrogen 2.915 N/A GLU 167.A N LYS 163.A O no hydrogen 2.816 N/A SER 168.A N SER 164.A O no hydrogen 2.894 N/A SER 169.A N ALA 165.A O no hydrogen 2.854 N/A SER 169.A OG ALA 165.A O no hydrogen 3.328 N/A SER 169.A OG LEU 166.A O no hydrogen 3.180 N/A THR 170.A N LEU 166.A O no hydrogen 3.009 N/A THR 170.A OG1 LEU 166.A O no hydrogen 2.701 N/A LYS 171.A N GLU 167.A O no hydrogen 3.389 N/A LYS 171.A N SER 168.A O no hydrogen 2.949 N/A TYR 172.A N SER 168.A O no hydrogen 3.072 N/A LEU 173.A N SER 169.A O no hydrogen 2.657 N/A ALA 174.A N THR 170.A O no hydrogen 2.940 N/A CYS 175.A N LYS 171.A O no hydrogen 3.137 N/A CYS 175.A N TYR 172.A O no hydrogen 3.094 N/A CYS 175.A SG LYS 171.A O no hydrogen 3.844 N/A ASP 176.A N TYR 172.A O no hydrogen 3.046 N/A TYR 177.A N LEU 173.A O no hydrogen 3.057 N/A MET 180.A N TYR 177.A O no hydrogen 3.030 N/A ASN 181.A N GLY 178.A O no hydrogen 2.992 N/A ILE 182.A N TYR 177.A O no hydrogen 3.180 N/A ARG 183.A N GLY 139.A O no hydrogen 2.906 N/A ARG 183.A NH1 SER 237.A OG no hydrogen 2.831 N/A ARG 183.A NH1 VAL 240.A O no hydrogen 2.861 N/A ILE 184.A N THR 241.A OG1 no hydrogen 3.174 N/A ASN 185.A N MET 141.A O no hydrogen 3.098 N/A ASN 185.A ND2 VAL 240.A O no hydrogen 2.937 N/A ALA 186.A N GLU 243.A O no hydrogen 2.978 N/A ILE 187.A N THR 143.A O no hydrogen 3.056 N/A SER 188.A N HIS 245.A O no hydrogen 2.767 N/A ALA 189.A N THR 145.A O no hydrogen 3.034 N/A GLY 190.A N VAL 247.A O no hydrogen 3.124 N/A GLY 197.A N THR 194.A OG1 no hydrogen 2.859 N/A ALA 198.A N THR 194.A O no hydrogen 3.259 N/A SER 199.A N ALA 196.A O no hydrogen 3.173 N/A ILE 200.A N GLY 197.A O no hydrogen 3.458 N/A SER 201.A OG LEU 101.A O no hydrogen 2.750 N/A ILE 206.A N ASN 202.A O no hydrogen 2.926 N/A ALA 207.A N GLY 203.A O no hydrogen 2.871 N/A ALA 208.A N ARG 204.A O no hydrogen 2.958 N/A TRP 209.A N ASP 205.A O no hydrogen 2.890 N/A SER 210.A N ILE 206.A O no hydrogen 2.939 N/A SER 210.A OG ILE 206.A O no hydrogen 3.164 N/A LYS 211.A N ALA 207.A O no hydrogen 2.952 N/A GLU 212.A N ALA 208.A O no hydrogen 2.990 N/A ASN 213.A N TRP 209.A O no hydrogen 3.101 N/A ASN 213.A ND2 TRP 209.A O no hydrogen 2.965 N/A SER 214.A N LYS 211.A O no hydrogen 3.459 N/A SER 214.A OG SER 210.A O no hydrogen 3.158 N/A SER 214.A OG LYS 211.A O no hydrogen 2.870 N/A LYS 217.A N SER 214.A O no hydrogen 3.138 N/A LYS 217.A N SER 214.A OG no hydrogen 3.168 N/A LYS 217.A NZ GLU 212.A O no hydrogen 3.381 N/A LYS 217.A NZ SER 214.A O no hydrogen 3.191 N/A SER 221.A N ASP 224.A OD2 no hydrogen 2.914 N/A ASP 224.A N SER 221.A O no hydrogen 2.898 N/A ASP 224.A N SER 221.A OG no hydrogen 2.969 N/A ILE 225.A N SER 221.A O no hydrogen 3.200 N/A GLY 226.A N LEU 222.A O no hydrogen 2.915 N/A ASN 227.A N GLU 223.A O no hydrogen 2.841 N/A SER 228.A N ASP 224.A O no hydrogen 2.917 N/A SER 228.A OG ASP 224.A O no hydrogen 3.296 N/A ALA 229.A N ILE 225.A O no hydrogen 2.858 N/A LEU 230.A N GLY 226.A O no hydrogen 2.888 N/A TYR 231.A N ASN 227.A O no hydrogen 2.983 N/A LEU 232.A N SER 228.A O no hydrogen 2.937 N/A LEU 233.A N LEU 230.A O no hydrogen 3.360 N/A SER 234.A N TYR 231.A O no hydrogen 3.428 N/A SER 234.A OG LEU 230.A O no hydrogen 2.870 N/A SER 234.A OG TYR 231.A O no hydrogen 3.511 N/A LEU 236.A N SER 234.A OG no hydrogen 3.419 N/A SER 237.A N SER 234.A O no hydrogen 3.385 N/A SER 237.A OG TYR 231.A O no hydrogen 2.764 N/A ASN 238.A N TYR 235.A O no hydrogen 3.280 N/A VAL 240.A N SER 237.A O no hydrogen 2.880 N/A GLY 242.A N ILE 184.A O no hydrogen 2.839 N/A GLU 243.A N ASN 185.A OD1 no hydrogen 2.925 N/A HIS 245.A N ALA 186.A O no hydrogen 2.865 N/A VAL 247.A N SER 188.A O no hydrogen 2.852 N/A CYS 249.A SG ARG 218.A O no hydrogen 3.529 N/A GLY 250.A N ASP 248.A OD1 no hydrogen 2.803 N/A TYR 251.A N ASP 248.A O no hydrogen 3.103 N/A ASN 252.A N ASP 248.A OD2 no hydrogen 2.975 N/A ILE 253.A N GLY 250.A O no hydrogen 3.068 N/A VAL 254.A N TYR 251.A O no hydrogen 2.995 N/A