Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2nmx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N ASN 9.A O no hydrogen 2.876 N/A ASP 6.A N ASN 9.A OD1 no hydrogen 2.975 N/A GLN 13.A N GLY 10.A O no hydrogen 2.840 N/A TRP 14.A N PRO 11.A O no hydrogen 3.331 N/A TRP 14.A NE1 GLY 4.A O no hydrogen 3.076 N/A TRP 14.A NE1 ASN 9.A O no hydrogen 2.990 N/A LYS 16.A N GLN 13.A O no hydrogen 3.215 N/A LEU 17.A N TRP 14.A O no hydrogen 3.121 N/A TYR 18.A N TRP 14.A O no hydrogen 2.783 N/A TYR 18.A OH ASP 2.A OD1 no hydrogen 2.878 N/A TYR 18.A OH ASP 2.A OD2 no hydrogen 3.246 N/A ALA 21.A N TYR 18.A O no hydrogen 2.917 N/A ASN 22.A N PRO 19.A O no hydrogen 3.178 N/A GLY 23.A N ILE 20.A O no hydrogen 2.718 N/A ASN 25.A N GLU 203.A OE2 no hydrogen 2.880 N/A GLN 26.A NE2 LEU 201.A O no hydrogen 3.366 N/A GLN 26.A NE2 GLU 203.A OE2 no hydrogen 3.141 N/A SER 27.A N SER 195.A OG no hydrogen 3.026 N/A SER 27.A OG TYR 192.A OH no hydrogen 2.872 N/A SER 27.A OG SER 195.A O no hydrogen 3.502 N/A ILE 31.A N THR 106.A O no hydrogen 2.820 N/A LYS 32.A NZ ASP 30.A OD2 no hydrogen 3.008 N/A THR 33.A N ASP 108.A OD1 no hydrogen 3.075 N/A THR 33.A OG1 ASP 108.A OD1 no hydrogen 3.242 N/A THR 33.A OG1 ASP 108.A OD2 no hydrogen 2.766 N/A GLU 35.A N LYS 32.A O no hydrogen 2.884 N/A THR 36.A OG1 THR 33.A O no hydrogen 2.972 N/A LYS 37.A N VAL 254.A O no hydrogen 2.936 N/A ASP 39.A N ALA 256.A O no hydrogen 3.185 N/A SER 41.A N ASP 39.A OD1 no hydrogen 2.719 N/A SER 41.A OG ASP 39.A OD1 no hydrogen 2.564 N/A LEU 42.A N ASP 39.A O no hydrogen 3.435 N/A LYS 43.A N GLY 80.A O no hydrogen 3.228 N/A SER 46.A N LYS 78.A O no hydrogen 2.815 N/A SER 48.A N VAL 76.A O no hydrogen 2.995 N/A TYR 49.A OH HIS 120.A NE2 no hydrogen 2.709 N/A ASN 50.A N SER 75.A OG no hydrogen 2.876 N/A ALA 52.A N ASN 50.A OD1 no hydrogen 2.831 N/A THR 53.A N ASN 50.A O no hydrogen 2.951 N/A THR 53.A OG1 ASN 50.A O no hydrogen 2.604 N/A THR 53.A OG1 SER 75.A OG no hydrogen 2.830 N/A ALA 54.A N PRO 51.A O no hydrogen 3.247 N/A LYS 55.A N ASN 67.A O no hydrogen 2.917 N/A GLU 56.A N ASN 67.A O no hydrogen 3.383 N/A ILE 57.A N ALA 172.A O no hydrogen 2.868 N/A ILE 58.A N HIS 65.A O no hydrogen 2.772 N/A ASN 59.A N LYS 170.A O no hydrogen 2.970 N/A ASN 59.A ND2 ILE 165.A O no hydrogen 3.047 N/A ASN 59.A ND2 LEU 228.A O no hydrogen 3.091 N/A VAL 60.A N SER 63.A O no hydrogen 2.863 N/A GLY 61.A N ASN 59.A OD1 no hydrogen 2.771 N/A SER 63.A OG PHE 64.A O no hydrogen 3.540 N/A SER 63.A OG PHE 93.A O no hydrogen 3.389 N/A PHE 64.A N SER 63.A OG no hydrogen 2.671 N/A HIS 65.A N ILE 58.A O no hydrogen 2.816 N/A VAL 66.A N PHE 91.A O no hydrogen 3.141 N/A ASN 67.A N GLU 56.A O no hydrogen 2.767 N/A PHE 68.A N PHE 89.A O no hydrogen 3.026 N/A GLU 69.A N THR 53.A O no hydrogen 2.746 N/A ARG 74.A N ASP 72.A OD1 no hydrogen 3.111 N/A ARG 74.A NE ASP 72.A OD1 no hydrogen 2.791 N/A ARG 74.A NH1 GLU 69.A OE1 no hydrogen 3.562 N/A ARG 74.A NH2 GLU 69.A OE1 no hydrogen 2.738 N/A SER 75.A OG THR 53.A OG1 no hydrogen 2.830 N/A VAL 76.A N SER 48.A O no hydrogen 2.959 N/A LEU 77.A N TYR 86.A O no hydrogen 2.782 N/A LYS 78.A N SER 46.A O no hydrogen 2.728 N/A GLY 80.A N PRO 44.A O no hydrogen 3.101 N/A PHE 82.A N GLY 79.A O no hydrogen 3.041 N/A TYR 86.A N LEU 77.A O no hydrogen 3.043 N/A TYR 86.A OH ASP 137.A O no hydrogen 2.903 N/A ARG 87.A N TRP 121.A O no hydrogen 2.849 N/A ARG 87.A NE ASN 73.A OD1 no hydrogen 2.971 N/A ARG 87.A NH1 ASP 70.A O no hydrogen 3.005 N/A ARG 87.A NH2 ASN 73.A OD1 no hydrogen 3.073 N/A LEU 88.A N SER 75.A O no hydrogen 3.037 N/A PHE 89.A N ALA 119.A O no hydrogen 3.069 N/A GLN 90.A NE2 ASN 67.A OD1 no hydrogen 2.899 N/A PHE 91.A N VAL 66.A O no hydrogen 3.172 N/A HIS 92.A N HIS 117.A O no hydrogen 2.957 N/A HIS 92.A ND1 GLN 90.A OE1 no hydrogen 2.823 N/A HIS 94.A N GLU 115.A O no hydrogen 3.040 N/A HIS 94.A ND1 ASN 242.A O no hydrogen 2.790 N/A TRP 95.A N ASN 242.A OD1 no hydrogen 2.785 N/A TRP 95.A NE1 MET 239.A O no hydrogen 2.848 N/A SER 97.A N.A HIS 101.A NE2 no hydrogen 3.166 N/A SER 97.A N.B HIS 101.A NE2 no hydrogen 3.152 N/A THR 98.A OG1 HIS 101.A ND1 no hydrogen 3.391 N/A ASN 99.A ND2 SER 218.A OG.A no hydrogen 3.068 N/A ASN 99.A ND2 SER 218.A OG.B no hydrogen 3.283 N/A HIS 101.A N THR 98.A O no hydrogen 3.369 N/A SER 103.A N TYR 112.A O no hydrogen 2.928 N/A SER 103.A OG HIS 105.A O no hydrogen 2.927 N/A SER 103.A OG TYR 112.A O no hydrogen 3.544 N/A GLU 104.A N GLU 115.A OE1 no hydrogen 2.785 N/A HIS 105.A N GLU 115.A OE1 no hydrogen 2.739 N/A HIS 105.A ND1 GLU 115.A OE2 no hydrogen 2.836 N/A HIS 105.A NE2 TYR 192.A OH no hydrogen 2.634 N/A THR 106.A N VAL 29.A O no hydrogen 3.452 N/A THR 106.A OG1 ASP 30.A OD1 no hydrogen 2.566 N/A VAL 107.A N VAL 110.A O no hydrogen 3.289 N/A ASP 108.A N ILE 31.A O no hydrogen 2.768 N/A GLY 109.A N ASP 30.A OD1 no hydrogen 2.834 N/A VAL 110.A N VAL 107.A O no hydrogen 2.971 N/A TYR 112.A N SER 103.A OG no hydrogen 3.063 N/A SER 113.A OG ASN 99.A O no hydrogen 2.715 N/A ALA 114.A N MET 146.A O no hydrogen 3.275 N/A GLU 115.A N HIS 94.A O no hydrogen 3.030 N/A LEU 116.A N VAL 144.A O no hydrogen 2.855 N/A HIS 117.A N HIS 92.A O no hydrogen 2.888 N/A HIS 117.A NE2 GLU 115.A OE2 no hydrogen 2.589 N/A VAL 118.A N ILE 142.A O no hydrogen 2.968 N/A ALA 119.A N GLN 90.A O no hydrogen 2.698 N/A HIS 120.A N ALA 140.A O no hydrogen 2.796 N/A HIS 120.A ND1 ALA 140.A O no hydrogen 2.950 N/A HIS 120.A NE2 TYR 49.A OH no hydrogen 2.709 N/A TRP 121.A N ARG 87.A O no hydrogen 2.883 N/A TRP 121.A NE1 ASP 70.A OD2 no hydrogen 2.792 N/A ASN 122.A N GLY 138.A O no hydrogen 2.754 N/A ASN 122.A ND2 ASP 84.A OD2 no hydrogen 3.214 N/A ASN 122.A ND2 ASP 137.A O no hydrogen 3.157 N/A SER 123.A OG ASN 73.A OD1 no hydrogen 3.227 N/A ALA 124.A N ASN 122.A OD1 no hydrogen 3.013 N/A LYS 125.A N ASN 122.A OD1 no hydrogen 3.059 N/A LYS 125.A NZ ASP 84.A OD1 no hydrogen 3.209 N/A LYS 125.A NZ ASP 84.A OD2 no hydrogen 3.225 N/A TYR 126.A N ASN 122.A O no hydrogen 3.061 N/A TYR 126.A OH ASP 137.A OD1 no hydrogen 2.682 N/A SER 127.A N GLU 131.A OE1 no hydrogen 2.840 N/A GLU 131.A N SER 128.A OG no hydrogen 3.262 N/A ALA 132.A N SER 128.A O no hydrogen 2.994 N/A ALA 133.A N LEU 129.A O no hydrogen 2.751 N/A LYS 135.A N ALA 132.A O no hydrogen 2.940 N/A LYS 135.A NZ GLU 131.A O no hydrogen 2.887 N/A GLY 138.A N LYS 135.A O no hydrogen 2.860 N/A LEU 139.A N SER 204.A O no hydrogen 2.878 N/A ALA 140.A N HIS 120.A O no hydrogen 2.962 N/A VAL 141.A N THR 206.A O no hydrogen 3.296 N/A ILE 142.A N VAL 118.A O no hydrogen 2.935 N/A GLY 143.A N ILE 208.A O no hydrogen 2.713 N/A VAL 144.A N LEU 116.A O no hydrogen 2.870 N/A MET 146.A N ALA 114.A O no hydrogen 2.876 N/A LYS 147.A N ILE 214.A O no hydrogen 2.958 N/A GLY 149.A N VAL 216.A O no hydrogen 2.814 N/A ASN 152.A N GLN 220.A OE1 no hydrogen 2.862 N/A ASN 152.A ND2 SER 215.A O.A no hydrogen 2.937 N/A ASN 152.A ND2 SER 215.A O.B no hydrogen 2.889 N/A LYS 154.A N ASN 152.A OD1 no hydrogen 3.127 N/A LEU 155.A N ASN 152.A O no hydrogen 3.170 N/A GLN 156.A N PRO 153.A O no hydrogen 3.092 N/A GLN 156.A NE2 ASP 160.A OD1 no hydrogen 2.841 N/A GLN 156.A NE2 ASP 160.A OD2 no hydrogen 2.993 N/A LYS 157.A NZ THR 175.A O no hydrogen 3.026 N/A LEU 159.A N LEU 155.A O no hydrogen 2.976 N/A ASP 160.A N GLN 156.A O no hydrogen 2.897 N/A ALA 161.A N VAL 158.A O no hydrogen 3.128 N/A LEU 162.A N LEU 159.A O no hydrogen 3.275 N/A GLN 163.A NE2 ASP 160.A O no hydrogen 2.924 N/A ALA 164.A N ALA 161.A O no hydrogen 3.021 N/A ILE 165.A N LEU 162.A O no hydrogen 3.026 N/A LYS 166.A NZ SER 226.A O no hydrogen 2.989 N/A LYS 168.A N ASN 230.A O no hydrogen 2.894 N/A GLY 169.A N ASN 59.A O no hydrogen 2.915 N/A LYS 170.A N THR 167.A O no hydrogen 3.138 N/A LYS 170.A NZ ALA 164.A O no hydrogen 3.337 N/A ARG 171.A NE GLY 169.A O no hydrogen 3.042 N/A ARG 171.A NH1 GLY 169.A O no hydrogen 3.188 N/A ALA 172.A N ILE 57.A O no hydrogen 2.968 N/A PHE 174.A N LYS 55.A O no hydrogen 3.104 N/A PHE 177.A N PRO 51.A O no hydrogen 3.197 N/A SER 180.A N ASP 178.A OD1 no hydrogen 2.798 N/A SER 180.A OG ASP 178.A OD1 no hydrogen 2.576 N/A SER 180.A OG ASP 178.A OD2 no hydrogen 3.029 N/A THR 181.A N ASP 178.A O no hydrogen 3.153 N/A THR 181.A OG1 ASP 178.A O no hydrogen 2.719 N/A LEU 182.A N PRO 179.A O no hydrogen 2.998 N/A LEU 183.A N SER 180.A O no hydrogen 3.211 N/A SER 185.A OG GLU 212.A OE1 no hydrogen 2.893 N/A SER 185.A OG GLU 212.A OE2 no hydrogen 3.027 N/A SER 186.A N GLU 212.A OE1 no hydrogen 3.071 N/A ASP 188.A N SER 186.A OG no hydrogen 3.377 N/A PHE 189.A N SER 257.A OG no hydrogen 2.890 N/A TRP 190.A N ILE 209.A O no hydrogen 2.815 N/A THR 191.A N ARG 255.A O no hydrogen 2.840 N/A THR 191.A OG1 TRP 207.A O no hydrogen 2.750 N/A TYR 192.A N TRP 207.A O no hydrogen 3.431 N/A TYR 192.A OH SER 27.A OG no hydrogen 2.872 N/A TYR 192.A OH HIS 105.A NE2 no hydrogen 2.634 N/A GLY 194.A N VAL 205.A O no hydrogen 2.655 N/A SER 195.A N SER 27.A OG no hydrogen 2.903 N/A SER 195.A OG LEU 196.A O no hydrogen 3.011 N/A LEU 196.A N TYR 202.A O no hydrogen 2.987 N/A THR 197.A OG1 GLU 104.A OE1 no hydrogen 2.654 N/A THR 197.A OG1 GLU 104.A OE2 no hydrogen 3.540 N/A HIS 198.A ND1 PRO 199.A O no hydrogen 2.888 N/A LEU 201.A N HIS 198.A O no hydrogen 2.879 N/A SER 204.A OG ALA 133.A O no hydrogen 2.568 N/A VAL 205.A N GLY 194.A O no hydrogen 3.276 N/A THR 206.A N LEU 139.A O no hydrogen 2.948 N/A TRP 207.A N TYR 192.A O no hydrogen 3.026 N/A TRP 207.A NE1 SER 195.A O no hydrogen 2.984 N/A ILE 208.A N VAL 141.A O no hydrogen 2.958 N/A ILE 209.A N TRP 190.A O no hydrogen 2.829 N/A CYS 210.A N GLY 143.A O no hydrogen 2.992 N/A LYS 211.A N ASP 188.A O no hydrogen 3.043 N/A LYS 211.A NZ ASP 188.A OD2 no hydrogen 2.810 N/A ILE 214.A N LEU 145.A O no hydrogen 3.048 N/A SER 215.A OG.A GLU 150.A O no hydrogen 2.888 N/A SER 215.A OG.B GLU 150.A O no hydrogen 2.655 N/A SER 217.A N GLN 220.A OE1 no hydrogen 3.026 N/A GLN 220.A N SER 217.A OG no hydrogen 3.134 N/A GLN 220.A NE2 ASN 152.A O no hydrogen 3.002 N/A LEU 221.A N SER 217.A O no hydrogen 3.131 N/A ALA 222.A N SER 218.A O.A no hydrogen 3.098 N/A ALA 222.A N SER 218.A O.B no hydrogen 3.099 N/A GLN 223.A N GLU 219.A O no hydrogen 3.198 N/A GLN 223.A N GLN 220.A O no hydrogen 3.098 N/A PHE 224.A N GLN 220.A O no hydrogen 3.428 N/A ARG 225.A N LEU 221.A O no hydrogen 3.111 N/A ARG 225.A NE GLY 96.A O no hydrogen 2.652 N/A ARG 225.A NH2 ASN 99.A OD1 no hydrogen 3.148 N/A SER 226.A N GLN 223.A O no hydrogen 3.124 N/A SER 226.A OG GLN 223.A O no hydrogen 2.540 N/A LEU 227.A N PHE 224.A O no hydrogen 3.213 N/A LEU 228.A N LYS 166.A O no hydrogen 2.820 N/A SER 229.A N VAL 237.A O no hydrogen 2.768 N/A SER 229.A OG VAL 237.A O no hydrogen 3.043 N/A ASN 230.A ND2 VAL 231.A O no hydrogen 3.013 N/A ASP 234.A N VAL 231.A O no hydrogen 3.175 N/A VAL 237.A N ASN 230.A OD1 no hydrogen 2.710 N/A MET 239.A N LEU 227.A O no hydrogen 2.758 N/A GLN 240.A N PRO 238.A O no hydrogen 2.956 N/A ASN 242.A N TRP 95.A O no hydrogen 3.089 N/A ASN 242.A ND2 HIS 62.A O no hydrogen 3.057 N/A ARG 244.A N GLU 104.A OE2 no hydrogen 2.827 N/A ARG 244.A NH1 GLN 26.A OE1 no hydrogen 2.803 N/A ARG 244.A NH1 SER 27.A O no hydrogen 2.852 N/A ARG 244.A NH2 ALA 21.A O no hydrogen 3.215 N/A ARG 244.A NH2 GLN 26.A OE1 no hydrogen 3.352 N/A GLN 247.A N PRO 28.A O no hydrogen 2.689 N/A GLN 247.A NE2 PRO 245.A O no hydrogen 2.789 N/A LYS 250.A NZ GLY 23.A O no hydrogen 3.395 N/A ARG 252.A N LEU 249.A O no hydrogen 3.000 N/A ARG 252.A NE LEU 249.A O no hydrogen 2.893 N/A ARG 252.A NH1 GLN 26.A O no hydrogen 3.054 N/A ARG 252.A NH1 PRO 193.A O no hydrogen 2.914 N/A ARG 252.A NH2 GLN 26.A O no hydrogen 2.861 N/A ARG 252.A NH2 PRO 248.A O no hydrogen 2.916 N/A ARG 255.A N THR 191.A O no hydrogen 2.914 N/A ARG 255.A NH1 ASP 39.A OD2 no hydrogen 3.112 N/A ALA 256.A N LYS 37.A O no hydrogen 3.009 N/A SER 257.A N PHE 189.A O no hydrogen 2.919 N/A SER 257.A OG PHE 189.A O no hydrogen 3.237 N/A