Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3niw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N GLU 207.A O no hydrogen 2.830 N/A LYS 3.A NZ GLU 207.A OE2 no hydrogen 3.032 N/A ILE 5.A N ARG 37.A O no hydrogen 2.939 N/A VAL 6.A N ILE 209.A O no hydrogen 2.756 N/A LEU 7.A N VAL 39.A O no hydrogen 2.873 N/A ASP 8.A N ILE 211.A O no hydrogen 3.164 N/A LEU 9.A N ASP 8.A OD1 no hydrogen 2.762 N/A THR 12.A N LEU 9.A O no hydrogen 3.061 N/A THR 12.A OG1 ASP 213.A OD2 no hydrogen 3.117 N/A LEU 13.A N ASP 8.A O no hydrogen 3.268 N/A THR 14.A N LEU 9.A O no hydrogen 3.147 N/A THR 14.A OG1 LEU 9.A O no hydrogen 3.279 N/A ASN 15.A N GLU 19.A O no hydrogen 2.958 N/A SER 16.A N ASP 246.A OD1 no hydrogen 2.853 N/A SER 16.A OG ASP 246.A OD1 no hydrogen 3.532 N/A SER 16.A OG ASP 246.A OD2 no hydrogen 2.614 N/A LYS 17.A N ASN 15.A OD1 no hydrogen 2.995 N/A LYS 17.A NZ GLU 19.A OE1 no hydrogen 3.457 N/A LYS 18.A N ASN 15.A O no hydrogen 2.913 N/A LYS 18.A NZ ASP 10.A OD2 no hydrogen 3.108 N/A GLU 19.A N ASN 15.A OD1 no hydrogen 3.095 N/A SER 21.A OG ASP 248.A OD1 no hydrogen 2.584 N/A ARG 23.A NH1 GLU 252.A OE1 no hydrogen 3.280 N/A ARG 23.A NH2 GLU 252.A OE1 no hydrogen 2.893 N/A ARG 23.A NH2 GLU 255.A OE1 no hydrogen 2.658 N/A ASN 24.A N SER 21.A OG no hydrogen 2.968 N/A ASN 24.A ND2 LEU 13.A O no hydrogen 3.125 N/A ARG 25.A N SER 21.A O no hydrogen 2.974 N/A ARG 25.A NE GLU 26.A OE2 no hydrogen 3.431 N/A GLU 26.A N SER 22.A O no hydrogen 2.924 N/A THR 27.A N ARG 23.A O no hydrogen 2.970 N/A THR 27.A OG1 ARG 23.A O no hydrogen 2.833 N/A THR 27.A OG1 GLU 255.A OE2 no hydrogen 3.106 N/A LEU 28.A N ASN 24.A O no hydrogen 3.018 N/A ILE 29.A N ARG 25.A O no hydrogen 2.953 N/A ARG 30.A N GLU 26.A O no hydrogen 2.952 N/A ILE 31.A N THR 27.A O no hydrogen 2.951 N/A GLN 32.A N LEU 28.A O no hydrogen 3.117 N/A GLN 32.A NE2 LEU 28.A O no hydrogen 3.299 N/A GLN 32.A NE2 LEU 56.A O no hydrogen 2.761 N/A GLU 33.A N ILE 29.A O no hydrogen 2.833 N/A GLN 34.A N ARG 30.A O no hydrogen 2.912 N/A GLY 35.A N GLN 32.A O no hydrogen 2.786 N/A ILE 36.A N ILE 31.A O no hydrogen 3.170 N/A ARG 37.A N LYS 3.A O no hydrogen 3.092 N/A ARG 37.A NE GLY 61.A O no hydrogen 3.015 N/A ARG 37.A NH2 GLY 61.A O no hydrogen 2.820 N/A VAL 39.A N ILE 5.A O no hydrogen 2.802 N/A LEU 40.A N PHE 63.A O no hydrogen 2.917 N/A ALA 41.A N LEU 7.A O no hydrogen 2.886 N/A SER 42.A N LEU 65.A O no hydrogen 3.100 N/A ARG 44.A N SER 42.A OG no hydrogen 3.027 N/A ARG 44.A NE ASP 10.A OD1 no hydrogen 3.072 N/A ARG 44.A NH1 GLY 48.A O no hydrogen 3.008 N/A ARG 44.A NH2 ASP 10.A OD1 no hydrogen 3.330 N/A ARG 44.A NH2 ASP 10.A OD2 no hydrogen 2.644 N/A THR 46.A OG1 SER 66.A OG no hydrogen 2.708 N/A THR 46.A OG1 GLU 71.A OE1 no hydrogen 3.364 N/A GLY 48.A N PRO 45.A O no hydrogen 2.923 N/A ILE 49.A N THR 46.A O no hydrogen 2.901 N/A VAL 50.A N THR 46.A O no hydrogen 2.983 N/A ALA 53.A N ILE 49.A O no hydrogen 3.061 N/A ASN 54.A N VAL 50.A O no hydrogen 2.903 N/A GLU 55.A N PRO 51.A O no hydrogen 2.972 N/A LEU 56.A N LEU 52.A O no hydrogen 3.020 N/A ARG 57.A N ASN 54.A O no hydrogen 3.029 N/A ARG 57.A NE GLU 59.A OE1 no hydrogen 3.199 N/A ARG 57.A NE GLU 59.A OE2 no hydrogen 3.081 N/A ARG 57.A NH1 GLU 33.A OE2 no hydrogen 3.291 N/A ARG 57.A NH2 GLU 59.A OE1 no hydrogen 2.646 N/A GLU 59.A N ARG 57.A O no hydrogen 2.817 N/A GLY 61.A N GLU 76.A OE1 no hydrogen 2.783 N/A PHE 63.A N LEU 38.A O no hydrogen 2.956 N/A ILE 64.A N ILE 73.A O no hydrogen 2.885 N/A LEU 65.A N LEU 40.A O no hydrogen 2.725 N/A SER 66.A OG THR 46.A OG1 no hydrogen 2.708 N/A TYR 67.A N ARG 44.A O no hydrogen 2.935 N/A ASN 68.A N SER 42.A O no hydrogen 2.766 N/A GLY 70.A N TYR 67.A O no hydrogen 2.990 N/A GLU 71.A N SER 66.A O no hydrogen 3.198 N/A ILE 72.A N TYR 80.A O no hydrogen 3.149 N/A ILE 73.A N ILE 64.A O no hydrogen 2.949 N/A ASN 74.A N GLU 79.A O no hydrogen 2.972 N/A TRP 75.A N GLY 62.A O no hydrogen 2.736 N/A TRP 75.A NE1 ASN 54.A OD1 no hydrogen 2.890 N/A GLU 76.A N ASN 74.A OD1 no hydrogen 3.030 N/A SER 77.A N ASN 74.A OD1 no hydrogen 3.162 N/A LYS 78.A N ASN 74.A O no hydrogen 2.703 N/A LYS 78.A NZ TRP 75.A O no hydrogen 2.705 N/A LYS 78.A NZ GLU 76.A O no hydrogen 3.497 N/A GLU 79.A N SER 77.A OG no hydrogen 3.344 N/A ASN 82.A N GLY 70.A O no hydrogen 2.724 N/A ASN 82.A ND2 GLN 187.A O no hydrogen 3.083 N/A LEU 84.A N VAL 145.A O no hydrogen 3.011 N/A GLU 87.A N GLU 87.A OE1 no hydrogen 2.863 N/A VAL 88.A N PRO 85.A O no hydrogen 3.082 N/A VAL 89.A N ASN 86.A O no hydrogen 3.151 N/A LEU 92.A N VAL 88.A O no hydrogen 3.014 N/A TYR 93.A N VAL 89.A O no hydrogen 2.994 N/A TYR 93.A OH GLU 114.A OE1 no hydrogen 2.963 N/A TYR 93.A OH GLU 114.A OE2 no hydrogen 3.237 N/A GLU 94.A N PRO 90.A O no hydrogen 3.011 N/A CYS 95.A N VAL 91.A O no hydrogen 3.037 N/A ALA 96.A N LEU 92.A O no hydrogen 3.045 N/A ARG 97.A N TYR 93.A O no hydrogen 2.930 N/A ARG 97.A NE GLU 94.A OE1 no hydrogen 2.882 N/A ARG 97.A NH2 GLU 94.A OE1 no hydrogen 2.934 N/A THR 98.A N GLU 94.A O no hydrogen 2.936 N/A THR 98.A OG1 GLU 94.A O no hydrogen 2.735 N/A ASN 99.A N CYS 95.A O no hydrogen 3.016 N/A ASN 99.A ND2 CYS 95.A O no hydrogen 2.606 N/A HIS 100.A N ARG 97.A O no hydrogen 3.141 N/A LEU 101.A N ALA 96.A O no hydrogen 2.890 N/A SER 102.A OG ASP 118.A OD2 no hydrogen 2.581 N/A LEU 104.A N LEU 149.A O no hydrogen 2.911 N/A THR 105.A N VAL 112.A O no hydrogen 3.099 N/A THR 105.A OG1 LYS 147.A O no hydrogen 2.576 N/A TYR 106.A OH GLU 124.A OE2 no hydrogen 2.598 N/A ASP 107.A N GLU 110.A O no hydrogen 2.769 N/A GLU 110.A N ASP 107.A O no hydrogen 3.044 N/A ILE 111.A N ALA 130.A O no hydrogen 2.897 N/A VAL 112.A N THR 105.A O no hydrogen 2.899 N/A THR 113.A N ARG 132.A O no hydrogen 3.418 N/A THR 113.A OG1 ILE 103.A O no hydrogen 2.845 N/A ASN 115.A N THR 113.A OG1 no hydrogen 3.130 N/A SER 116.A N GLU 133.A OE2 no hydrogen 2.910 N/A SER 116.A OG GLU 133.A OE2 no hydrogen 2.729 N/A LEU 117.A N ASN 115.A OD1.B no hydrogen 3.146 N/A ASP 118.A N ASN 115.A O no hydrogen 3.185 N/A TYR 120.A N ASP 118.A OD1 no hydrogen 2.944 N/A TYR 120.A OH ASP 153.A OD1.A no hydrogen 2.619 N/A GLN 122.A N ASP 118.A O no hydrogen 3.095 N/A GLN 122.A NE2 SER 116.A O no hydrogen 2.808 N/A LYS 123.A N PRO 119.A O no hydrogen 2.987 N/A GLU 124.A N TYR 120.A O no hydrogen 3.408 N/A ALA 125.A N VAL 121.A O no hydrogen 3.054 N/A PHE 126.A N GLN 122.A O no hydrogen 2.807 N/A LEU 127.A N LYS 123.A O no hydrogen 2.961 N/A ASN 128.A N GLU 124.A O no hydrogen 3.101 N/A ASN 128.A ND2 GLU 124.A O no hydrogen 2.928 N/A LYS 129.A N PHE 126.A O no hydrogen 3.188 N/A ARG 132.A N ILE 111.A O no hydrogen 2.705 N/A ARG 132.A NE ASP 140.A OD1.A no hydrogen 3.001 N/A ARG 132.A NH1 ASP 107.A OD2 no hydrogen 3.336 N/A ARG 132.A NH1 GLU 110.A OE1 no hydrogen 2.762 N/A ARG 132.A NH2 ASP 107.A OD2 no hydrogen 2.956 N/A ARG 132.A NH2 ASP 140.A O no hydrogen 2.919 N/A ARG 132.A NH2 ASP 140.A OD1.A no hydrogen 3.449 N/A THR 134.A N THR 113.A O no hydrogen 3.012 N/A THR 134.A OG1 ASP 140.A OD2.B no hydrogen 2.567 N/A ASN 135.A ND2.A ASP 136.A OD2 no hydrogen 2.784 N/A ASP 136.A N THR 134.A OG1 no hydrogen 2.941 N/A PHE 137.A N GLU 114.A OE2 no hydrogen 2.816 N/A THR 139.A N ASP 136.A O no hydrogen 3.057 N/A ASP 140.A N ASP 136.A O no hydrogen 3.006 N/A ASP 140.A N PHE 137.A O no hydrogen 3.207 N/A ILE 141.A N PHE 137.A O no hydrogen 3.135 N/A THR 142.A OG1 ASP 107.A OD2 no hydrogen 3.147 N/A LYS 147.A NZ GLY 43.A O no hydrogen 2.823 N/A LYS 147.A NZ GLU 183.A OE2 no hydrogen 2.879 N/A CYS 148.A N LEU 184.A O no hydrogen 3.192 N/A LEU 149.A N LEU 104.A O no hydrogen 2.944 N/A ILE 150.A N LEU 182.A O no hydrogen 2.949 N/A VAL 151.A N SER 102.A O no hydrogen 3.036 N/A GLY 152.A N TYR 180.A O no hydrogen 3.063 N/A GLY 155.A N ASP 153.A OD2.B no hydrogen 2.923 N/A LYS 156.A N ASP 153.A O no hydrogen 2.893 N/A LEU 157.A N ASP 153.A O no hydrogen 3.147 N/A LEU 157.A N ALA 154.A O no hydrogen 3.031 N/A ILE 158.A N ALA 154.A O no hydrogen 3.080 N/A GLU 161.A N LEU 157.A O no hydrogen 2.810 N/A SER 162.A N ILE 158.A O no hydrogen 2.950 N/A SER 162.A OG ILE 158.A O no hydrogen 2.705 N/A GLU 163.A N PRO 159.A O no hydrogen 2.922 N/A LEU 164.A N VAL 160.A O no hydrogen 2.915 N/A CYS 165.A N GLU 161.A O no hydrogen 2.874 N/A ARG 167.A N GLU 163.A O no hydrogen 2.946 N/A LEU 168.A N LEU 164.A O no hydrogen 2.930 N/A GLN 169.A N ILE 166.A O no hydrogen 3.169 N/A LYS 171.A N LEU 168.A O no hydrogen 2.892 N/A LYS 171.A NZ GLU 87.A OE2 no hydrogen 2.932 N/A ILE 172.A N LEU 168.A O no hydrogen 3.121 N/A ASN 173.A N VAL 185.A O no hydrogen 2.895 N/A PHE 175.A N GLU 183.A O no hydrogen 3.214 N/A ARG 176.A NE GLU 161.A OE2 no hydrogen 3.335 N/A ARG 176.A NH2 PRO 179.A O no hydrogen 3.097 N/A SER 177.A N PHE 181.A O no hydrogen 3.203 N/A SER 177.A OG GLU 183.A OE1 no hydrogen 2.530 N/A PHE 181.A N GLU 178.A O no hydrogen 3.162 N/A LEU 182.A N ILE 150.A O no hydrogen 2.817 N/A GLU 183.A N PHE 175.A O no hydrogen 2.756 N/A LEU 184.A N CYS 148.A O no hydrogen 2.939 N/A VAL 185.A N ASN 173.A O no hydrogen 3.061 N/A LYS 191.A NZ ALA 41.A O no hydrogen 2.998 N/A LYS 191.A NZ ASP 217.A OD1 no hydrogen 2.794 N/A LEU 193.A N ASP 190.A OD1 no hydrogen 2.898 N/A SER 194.A N ASP 190.A O no hydrogen 3.134 N/A SER 194.A OG GLY 69.A O no hydrogen 2.588 N/A LEU 195.A N LYS 191.A O no hydrogen 2.806 N/A SER 196.A N ALA 192.A O no hydrogen 2.931 N/A SER 196.A OG.A LEU 193.A O no hydrogen 2.680 N/A VAL 197.A N LEU 193.A O no hydrogen 3.089 N/A LEU 198.A N SER 194.A O no hydrogen 2.977 N/A LEU 199.A N LEU 195.A O no hydrogen 2.811 N/A GLU 200.A N SER 196.A O no hydrogen 2.996 N/A ASN 201.A N VAL 197.A O no hydrogen 3.018 N/A ILE 202.A N LEU 198.A O no hydrogen 3.008 N/A THR 204.A OG1 GLU 206.A OE1 no hydrogen 2.580 N/A GLU 207.A N THR 204.A O no hydrogen 3.014 N/A VAL 208.A N ARG 205.A O no hydrogen 3.045 N/A ILE 209.A N LEU 4.A O no hydrogen 3.015 N/A ILE 211.A N VAL 6.A O no hydrogen 2.757 N/A GLY 212.A N VAL 226.A O no hydrogen 3.045 N/A ASP 213.A N ASP 217.A OD2 no hydrogen 3.042 N/A GLY 214.A N ASP 217.A OD2 no hydrogen 3.474 N/A ASP 217.A N GLY 214.A O no hydrogen 3.013 N/A LEU 218.A N TYR 215.A O no hydrogen 3.035 N/A SER 219.A OG ASP 190.A OD1 no hydrogen 3.559 N/A SER 219.A OG ASP 190.A OD2 no hydrogen 2.444 N/A LYS 221.A N LEU 218.A O no hydrogen 3.074 N/A PHE 222.A N SER 219.A O no hydrogen 2.960 N/A GLY 224.A N ARG 205.A O no hydrogen 2.882 N/A VAL 226.A N ALA 210.A O no hydrogen 2.715 N/A ALA 227.A N TYR 240.A O no hydrogen 2.895 N/A GLY 228.A N LEU 243.A O no hydrogen 2.944 N/A ASN 229.A ND2 GLY 11.A O no hydrogen 2.898 N/A GLN 231.A N ASP 213.A O no hydrogen 3.001 N/A VAL 234.A N GLN 231.A O no hydrogen 2.960 N/A LYS 235.A N GLN 231.A O no hydrogen 3.094 N/A LYS 235.A NZ GLY 228.A O no hydrogen 2.820 N/A LYS 236.A N GLU 232.A O no hydrogen 2.921 N/A ALA 237.A N PRO 233.A O no hydrogen 3.111 N/A ALA 237.A N VAL 234.A O no hydrogen 3.174 N/A ALA 238.A N LYS 235.A O no hydrogen 3.287 N/A ASP 239.A N GLY 225.A O no hydrogen 2.689 N/A TYR 240.A N GLY 225.A O no hydrogen 3.221 N/A THR 242.A N ALA 227.A O no hydrogen 2.978 N/A THR 242.A OG1 GLY 249.A O no hydrogen 2.738 N/A LEU 243.A N THR 242.A OG1 no hydrogen 2.707 N/A THR 244.A N GLU 247.A OE1 no hydrogen 2.949 N/A ASN 245.A N ASN 229.A OD1 no hydrogen 2.886 N/A ASN 245.A ND2 THR 14.A O no hydrogen 2.908 N/A GLU 247.A N THR 244.A O no hydrogen 2.909 N/A GLY 249.A N THR 244.A O no hydrogen 2.973 N/A ALA 251.A N ASN 24.A OD1 no hydrogen 2.909 N/A GLU 252.A N ASP 248.A O no hydrogen 2.895 N/A ALA 253.A N GLY 249.A O no hydrogen 3.048 N/A ILE 254.A N VAL 250.A O no hydrogen 3.068 N/A GLU 255.A N ALA 251.A O no hydrogen 2.999 N/A ARG 256.A N GLU 252.A O no hydrogen 3.045 N/A ARG 256.A NE GLU 252.A OE2 no hydrogen 2.754 N/A ARG 256.A NH1 GLU 252.A OE2 no hydrogen 2.873 N/A ILE 257.A N ALA 253.A O no hydrogen 2.873 N/A PHE 258.A N ILE 254.A O no hydrogen 2.965 N/A