Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nnf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N ASN 2.A OD1 no hydrogen 2.551 N/A GLN 5.A N ASN 2.A OD1 no hydrogen 3.430 N/A GLU 7.A N ARG 3.A O no hydrogen 3.245 N/A GLN 8.A N GLU 4.A O no hydrogen 3.239 N/A GLN 8.A NE2 GLU 4.A O no hydrogen 3.563 N/A LEU 9.A N GLN 5.A O no hydrogen 2.858 N/A LYS 10.A N VAL 6.A O no hydrogen 3.134 N/A LYS 10.A NZ GLU 14.A OE2 no hydrogen 2.848 N/A GLN 11.A N GLU 7.A O no hydrogen 2.955 N/A GLU 12.A N GLN 8.A O no hydrogen 2.765 N/A TYR 13.A N LEU 9.A O no hydrogen 2.987 N/A GLU 14.A N LYS 10.A O no hydrogen 3.113 N/A GLU 15.A N GLN 11.A O no hydrogen 3.178 N/A LYS 16.A N GLU 12.A O no hydrogen 2.819 N/A LYS 16.A NZ GLU 12.A OE2 no hydrogen 2.785 N/A LYS 16.A NZ GLU 210.A OE1 no hydrogen 2.835 N/A LYS 16.A NZ GLU 210.A OE2 no hydrogen 3.527 N/A GLY 17.A N TYR 13.A O no hydrogen 2.726 N/A TYR 18.A OH GLU 210.A OE1 no hydrogen 2.534 N/A CYS 19.A N PHE 221.A O no hydrogen 2.877 N/A GLN 20.A NE2 GLU 213.A O no hydrogen 2.783 N/A ILE 21.A N ALA 219.A O no hydrogen 2.854 N/A LYS 22.A NZ ASP 218.A OD2 no hydrogen 2.671 N/A LYS 23.A N ASP 218.A OD1 no hydrogen 2.687 N/A PHE 25.A N GLY 217.A O no hydrogen 2.924 N/A ALA 29.A N ASP 26.A OD1 no hydrogen 2.937 N/A ILE 30.A N ASP 26.A O no hydrogen 3.139 N/A LYS 31.A N PHE 27.A O no hydrogen 2.928 N/A THR 32.A N SER 28.A O no hydrogen 3.084 N/A THR 32.A OG1 SER 28.A O no hydrogen 3.010 N/A ILE 33.A N ALA 29.A O no hydrogen 2.965 N/A GLN 34.A N ILE 30.A O no hydrogen 2.828 N/A GLN 34.A NE2 LEU 137.A O no hydrogen 2.910 N/A LYS 35.A N LYS 31.A O no hydrogen 2.986 N/A THR 36.A N THR 32.A O no hydrogen 2.893 N/A THR 36.A OG1 THR 32.A O no hydrogen 2.621 N/A LEU 37.A N ILE 33.A O no hydrogen 2.831 N/A ASP 38.A N GLN 34.A O no hydrogen 2.849 N/A GLN 39.A N LYS 35.A O no hydrogen 2.939 N/A ALA 40.A N THR 36.A O no hydrogen 3.019 N/A LYS 41.A N LEU 37.A O no hydrogen 2.846 N/A LYS 41.A NZ ASP 65.A OD2 no hydrogen 2.660 N/A GLN 42.A N ASP 38.A O no hydrogen 3.163 N/A GLU 43.A N GLN 39.A O no hydrogen 3.346 N/A LYS 48.A NZ ILE 61.A O no hydrogen 3.094 N/A GLU 49.A N SER 47.A OG no hydrogen 3.364 N/A THR 52.A N LYS 48.A O no hydrogen 3.116 N/A THR 52.A OG1 LYS 48.A O no hydrogen 2.902 N/A LEU 53.A N GLU 49.A O no hydrogen 2.882 N/A LYS 54.A N LYS 50.A O no hydrogen 3.131 N/A LEU 55.A N VAL 51.A O no hydrogen 3.186 N/A LEU 55.A N THR 52.A O no hydrogen 3.243 N/A GLY 56.A N LEU 53.A O no hydrogen 2.800 N/A GLY 57.A N THR 52.A O no hydrogen 2.882 N/A ASP 62.A N GLY 111.A O no hydrogen 2.882 N/A ASN 64.A N SER 104.A O no hydrogen 2.667 N/A ASN 64.A ND2 ASP 65.A OD2 no hydrogen 3.506 N/A ASP 65.A N SER 104.A O no hydrogen 3.462 N/A ALA 67.A N LEU 102.A O no hydrogen 3.101 N/A ASP 69.A N ASN 100.A O no hydrogen 2.937 N/A PHE 75.A N ASP 74.A OD1 no hydrogen 2.589 N/A VAL 76.A N LYS 72.A O no hydrogen 3.199 N/A SER 77.A N TYR 73.A O no hydrogen 2.812 N/A SER 77.A OG ALA 314.A O no hydrogen 2.698 N/A SER 78.A N ASP 74.A O no hydrogen 3.096 N/A PHE 79.A N VAL 76.A O no hydrogen 3.028 N/A ILE 80.A N VAL 76.A O no hydrogen 2.839 N/A ILE 80.A N SER 77.A O no hydrogen 3.102 N/A GLN 81.A N SER 77.A O no hydrogen 2.800 N/A GLN 81.A NE2 MET 316.A O no hydrogen 2.758 N/A LYS 83.A N ILE 80.A O no hydrogen 2.691 N/A LYS 83.A NZ ILE 24.A O no hydrogen 2.884 N/A LYS 83.A NZ GLU 82.A OE1 no hydrogen 3.348 N/A LEU 84.A N GLN 81.A O no hydrogen 3.171 N/A LEU 87.A N LYS 83.A O no hydrogen 3.276 N/A ASN 88.A N LEU 84.A O no hydrogen 2.686 N/A TYR 89.A N ALA 85.A O no hydrogen 3.012 N/A TYR 89.A OH GLU 7.A OE1 no hydrogen 2.358 N/A ILE 90.A N LEU 86.A O no hydrogen 2.930 N/A THR 91.A N LEU 87.A O no hydrogen 2.950 N/A THR 91.A OG1 LEU 87.A O no hydrogen 3.050 N/A GLY 92.A N TYR 89.A O no hydrogen 3.397 N/A LYS 93.A N ASN 88.A O no hydrogen 3.170 N/A ASN 94.A N ASP 250.A OD1 no hydrogen 2.999 N/A LEU 95.A N ASN 88.A OD1 no hydrogen 2.731 N/A MET 96.A N VAL 249.A O no hydrogen 2.753 N/A ILE 97.A N ARG 315.A O no hydrogen 2.856 N/A MET 98.A N ARG 247.A O no hydrogen 2.985 N/A HIS 99.A NE2 SER 120.A O no hydrogen 2.826 N/A ASN 100.A N ASP 69.A OD1 no hydrogen 3.008 N/A ASN 100.A ND2 VAL 71.A O no hydrogen 3.293 N/A ALA 101.A N VAL 245.A O no hydrogen 2.922 N/A LEU 102.A N ALA 67.A O no hydrogen 2.809 N/A PHE 103.A N ALA 243.A O no hydrogen 3.055 N/A SER 104.A N ASP 65.A O no hydrogen 3.137 N/A SER 104.A OG ASP 65.A OD2 no hydrogen 2.709 N/A VAL 105.A N ARG 241.A O no hydrogen 3.019 N/A ASN 108.A N LEU 233.A O no hydrogen 2.760 N/A HIS 109.A ND1 PRO 107.A O no hydrogen 2.978 N/A LYS 110.A N ASP 62.A OD2 no hydrogen 3.163 N/A LEU 112.A N SER 230.A OG no hydrogen 2.851 N/A HIS 115.A N HIS 228.A O no hydrogen 2.785 N/A HIS 115.A ND1 PRO 113.A O no hydrogen 2.859 N/A GLY 117.A N LYS 224.A O no hydrogen 3.164 N/A VAL 118.A N VAL 116.A O no hydrogen 2.673 N/A PHE 121.A N GLY 117.A O no hydrogen 3.200 N/A SER 122.A OG GLY 119.A O no hydrogen 3.394 N/A THR 124.A N PHE 121.A O no hydrogen 3.244 N/A THR 124.A OG1 PHE 121.A O no hydrogen 3.041 N/A LYS 125.A N ARG 254.A O no hydrogen 2.995 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.736 N/A ASP 128.A N LYS 125.A O no hydrogen 3.093 N/A ALA 131.A N LEU 248.A O no hydrogen 2.957 N/A SER 132.A N PHE 222.A O no hydrogen 2.789 N/A ILE 133.A N ILE 246.A O no hydrogen 2.929 N/A TRP 134.A N PHE 220.A O no hydrogen 2.784 N/A ILE 135.A N PHE 244.A O no hydrogen 2.691 N/A LEU 137.A N ARG 242.A O no hydrogen 2.887 N/A ILE 140.A N TYR 214.A O no hydrogen 2.856 N/A LYS 142.A N GLU 213.A OE2 no hydrogen 3.007 N/A HIS 144.A N THR 141.A OG1 no hydrogen 3.004 N/A HIS 144.A ND1 LYS 234.A O no hydrogen 3.072 N/A ARG 145.A N THR 141.A O no hydrogen 2.725 N/A ARG 145.A NE GLU 211.A OE2 no hydrogen 2.785 N/A ARG 145.A NH2 GLU 211.A OE2 no hydrogen 3.283 N/A GLN 149.A N GLN 229.A O no hydrogen 2.954 N/A GLN 149.A NE2 GLU 211.A OE1 no hydrogen 3.164 N/A TYR 150.A N GLU 210.A O no hydrogen 3.237 N/A TYR 150.A OH ASP 212.A OD2 no hydrogen 2.874 N/A TYR 150.A OH TYR 214.A OH no hydrogen 2.699 N/A VAL 151.A N LEU 227.A O no hydrogen 2.955 N/A THR 153.A N LYS 16.A O no hydrogen 2.920 N/A THR 153.A OG1 LYS 16.A O no hydrogen 3.204 N/A LYS 154.A N SER 152.A OG no hydrogen 2.926 N/A ILE 155.A N SER 152.A O no hydrogen 2.888 N/A PHE 156.A N SER 152.A O no hydrogen 3.001 N/A TYR 161.A N GLY 158.A O no hydrogen 2.971 N/A TYR 162.A N GLN 159.A O no hydrogen 3.333 N/A TYR 162.A OH LYS 224.A O no hydrogen 2.698 N/A VAL 164.A N PHE 160.A O no hydrogen 3.464 N/A PHE 165.A N TYR 161.A O no hydrogen 2.809 N/A ASP 166.A N TYR 162.A O no hydrogen 2.847 N/A LEU 167.A N SER 163.A O no hydrogen 2.831 N/A HIS 168.A N VAL 164.A O no hydrogen 3.173 N/A HIS 168.A ND1 THR 191.A OG1 no hydrogen 2.804 N/A HIS 168.A NE2 GLY 56.A O no hydrogen 2.982 N/A LEU 169.A N PHE 165.A O no hydrogen 2.873 N/A LYS 170.A N ASP 166.A O no hydrogen 3.015 N/A ASN 171.A N LEU 167.A O no hydrogen 3.168 N/A ASN 172.A N HIS 168.A O no hydrogen 2.925 N/A ASN 172.A ND2 GLY 56.A O no hydrogen 3.431 N/A ILE 173.A N LEU 169.A O no hydrogen 3.185 N/A LYS 174.A N ASN 171.A O no hydrogen 2.965 N/A TRP 175.A N ASN 172.A O no hydrogen 3.153 N/A TRP 175.A NE1 GLY 180.A O no hydrogen 2.702 N/A GLN 179.A N ASP 176.A O no hydrogen 2.573 N/A GLY 180.A N GLU 177.A O no hydrogen 3.088 N/A ASN 183.A N TYR 274.A OH no hydrogen 2.850 N/A GLU 184.A N ASP 181.A OD2 no hydrogen 3.224 N/A TYR 185.A N ASP 181.A O no hydrogen 2.949 N/A TYR 185.A OH ASN 171.A O no hydrogen 2.871 N/A VAL 186.A N LEU 182.A O no hydrogen 2.947 N/A ALA 187.A N ASN 183.A O no hydrogen 3.081 N/A ASN 188.A N GLU 184.A O no hydrogen 3.006 N/A THR 191.A OG1 HIS 168.A ND1 no hydrogen 2.804 N/A TYR 193.A OH LEU 55.A O no hydrogen 2.882 N/A ASN 194.A N THR 191.A OG1 no hydrogen 3.182 N/A LYS 195.A N THR 191.A O no hydrogen 3.199 N/A LYS 195.A N ILE 192.A O no hydrogen 2.850 N/A LYS 195.A NZ ASN 190.A OD1 no hydrogen 2.501 N/A ILE 196.A N ILE 192.A O no hydrogen 3.313 N/A ILE 196.A N TYR 193.A O no hydrogen 3.184 N/A THR 197.A N LYS 195.A O no hydrogen 2.960 N/A ILE 201.A N THR 197.A O no hydrogen 3.001 N/A ASP 202.A N GLU 198.A O no hydrogen 2.734 N/A TYR 203.A N ASP 199.A O no hydrogen 2.815 N/A THR 204.A N VAL 200.A O no hydrogen 2.752 N/A THR 204.A OG1 VAL 200.A O no hydrogen 3.018 N/A ILE 205.A N ILE 201.A O no hydrogen 2.704 N/A LYS 206.A N ASP 202.A O no hydrogen 2.769 N/A GLY 208.A N ILE 205.A O no hydrogen 3.193 N/A GLU 210.A N TYR 150.A O no hydrogen 2.822 N/A TYR 214.A N ILE 140.A O no hydrogen 2.811 N/A TYR 214.A OH TYR 150.A OH no hydrogen 2.699 N/A ASN 215.A N ASP 218.A OD2 no hydrogen 3.025 N/A ASP 218.A N ASN 215.A O no hydrogen 2.898 N/A ALA 219.A N ILE 21.A O no hydrogen 3.014 N/A PHE 220.A N TRP 134.A O no hydrogen 2.950 N/A PHE 221.A N CYS 19.A O no hydrogen 3.005 N/A PHE 222.A N SER 132.A O no hydrogen 3.033 N/A ASN 223.A N GLY 17.A O no hydrogen 2.945 N/A ASN 223.A ND2 TYR 13.A OH no hydrogen 3.327 N/A LYS 224.A N GLY 130.A O no hydrogen 2.989 N/A LYS 224.A NZ LYS 125.A O no hydrogen 3.070 N/A LYS 224.A NZ THR 126.A O no hydrogen 3.308 N/A LYS 224.A NZ ASP 128.A O no hydrogen 3.189 N/A TYR 225.A N ASN 223.A OD1 no hydrogen 2.873 N/A TYR 225.A OH THR 126.A O no hydrogen 2.597 N/A VAL 226.A N ASN 223.A O no hydrogen 3.252 N/A HIS 228.A N HIS 115.A O no hydrogen 2.879 N/A HIS 228.A ND1 VAL 226.A O no hydrogen 2.992 N/A GLN 229.A N GLN 149.A O no hydrogen 3.023 N/A GLN 229.A NE2 GLN 149.A OE1 no hydrogen 2.933 N/A SER 230.A N LEU 112.A O no hydrogen 2.976 N/A VAL 231.A N GLY 147.A O no hydrogen 2.968 N/A LYS 234.A N HIS 144.A O no hydrogen 2.945 N/A HIS 238.A NE2 LYS 139.A O no hydrogen 2.917 N/A ARG 241.A N VAL 105.A O no hydrogen 3.035 N/A ARG 241.A NE GLY 146.A O no hydrogen 2.418 N/A ARG 241.A NH2 GLY 146.A O no hydrogen 3.194 N/A ARG 241.A NH2 GLY 147.A O no hydrogen 3.247 N/A ARG 242.A N ASP 138.A OD2 no hydrogen 2.863 N/A ARG 242.A NE ASP 138.A OD2 no hydrogen 2.818 N/A ARG 242.A NH2 ASP 138.A OD1 no hydrogen 3.012 N/A ARG 242.A NH2 ASP 138.A OD2 no hydrogen 3.365 N/A ALA 243.A N PHE 103.A O no hydrogen 2.828 N/A PHE 244.A N ILE 135.A O no hydrogen 2.820 N/A VAL 245.A N ALA 101.A O no hydrogen 2.818 N/A ILE 246.A N ILE 133.A O no hydrogen 2.867 N/A ARG 247.A N HIS 99.A O no hydrogen 2.646 N/A ARG 247.A NH1 SER 132.A OG no hydrogen 2.642 N/A LEU 248.A N ALA 131.A O no hydrogen 2.806 N/A VAL 249.A N MET 96.A O no hydrogen 3.063 N/A ASP 250.A N THR 253.A OG1 no hydrogen 2.932 N/A TYR 251.A N ASN 94.A O no hydrogen 2.854 N/A ASP 252.A N ASP 250.A OD2 no hydrogen 2.758 N/A THR 253.A N ASP 250.A O no hydrogen 2.988 N/A THR 253.A OG1 PHE 129.A O no hydrogen 3.125 N/A THR 253.A OG1 ASP 250.A O no hydrogen 3.276 N/A ARG 254.A N ASP 128.A OD2 no hydrogen 2.647 N/A VAL 255.A N PRO 300.A O no hydrogen 2.915 N/A ASP 256.A N PHE 123.A O no hydrogen 2.882 N/A ARG 259.A N ASP 256.A OD1 no hydrogen 2.963 N/A ARG 259.A NE ASP 166.A OD1 no hydrogen 2.837 N/A ARG 259.A NE ASP 166.A OD2 no hydrogen 3.165 N/A ARG 259.A NH1 SER 122.A O no hydrogen 2.992 N/A ARG 259.A NH1 THR 124.A O no hydrogen 3.074 N/A ARG 259.A NH2 THR 126.A OG1 no hydrogen 2.784 N/A ARG 259.A NH2 ASP 166.A OD2 no hydrogen 3.248 N/A LEU 260.A N ASP 256.A O no hydrogen 3.173 N/A GLY 261.A N GLU 257.A O no hydrogen 2.972 N/A LEU 262.A N GLU 258.A O no hydrogen 3.085 N/A PHE 263.A N ARG 259.A O no hydrogen 2.926 N/A SER 264.A N LEU 260.A O no hydrogen 3.041 N/A SER 264.A OG LEU 260.A O no hydrogen 2.751 N/A LYS 265.A N GLY 261.A O no hydrogen 2.967 N/A TYR 266.A N LEU 262.A O no hydrogen 2.919 N/A SER 267.A N PHE 263.A O no hydrogen 2.759 N/A GLN 268.A N SER 264.A O no hydrogen 2.675 N/A LEU 269.A N LYS 265.A O no hydrogen 2.829 N/A HIS 270.A N TYR 266.A O no hydrogen 2.888 N/A SER 271.A N SER 267.A O no hydrogen 2.912 N/A SER 271.A OG SER 267.A O no hydrogen 3.232 N/A SER 271.A OG GLN 268.A O no hydrogen 2.842 N/A ARG 272.A N GLN 268.A O no hydrogen 2.935 N/A TYR 273.A N LEU 269.A O no hydrogen 3.090 N/A TYR 274.A N HIS 270.A O no hydrogen 2.957 N/A TYR 274.A OH ASP 181.A OD1 no hydrogen 2.391 N/A THR 276.A N SER 271.A O no hydrogen 3.098 N/A THR 276.A OG1 GLU 49.A OE1 no hydrogen 3.454 N/A THR 276.A OG1 GLU 49.A OE2 no hydrogen 3.394 N/A ASN 281.A ND2 TYR 68.A O no hydrogen 2.922 N/A VAL 285.A N ASP 69.A OD2 no hydrogen 2.921 N/A MET 288.A N SER 284.A O no hydrogen 3.147 N/A VAL 289.A N VAL 285.A O no hydrogen 2.995 N/A SER 290.A N LEU 286.A O no hydrogen 2.963 N/A ARG 291.A N VAL 287.A O no hydrogen 3.135 N/A ALA 292.A N MET 288.A O no hydrogen 3.319 N/A VAL 293.A N VAL 289.A O no hydrogen 2.938 N/A GLN 294.A N SER 290.A O no hydrogen 2.768 N/A LYS 295.A N ARG 291.A O no hydrogen 2.765 N/A GLY 296.A N VAL 293.A O no hydrogen 2.929 N/A SER 299.A OG ASP 304.A OD2 no hydrogen 2.686 N/A TYR 301.A N SER 299.A OG no hydrogen 3.203 N/A LEU 302.A N THR 253.A O no hydrogen 2.975 N/A ARG 303.A NH1 TYR 251.A O no hydrogen 3.023 N/A ARG 303.A NH1 ASP 252.A OD1 no hydrogen 2.631 N/A ASP 304.A N TYR 301.A O no hydrogen 3.126 N/A ILE 305.A N LEU 302.A O no hydrogen 2.956 N/A GLN 309.A N ILE 305.A O no hydrogen 2.760 N/A GLN 310.A N PRO 306.A O no hydrogen 3.095 N/A THR 311.A N HIS 307.A O no hydrogen 3.198 N/A THR 311.A N VAL 308.A O no hydrogen 2.917 N/A THR 311.A OG1 HIS 307.A O no hydrogen 2.762 N/A THR 311.A OG1 VAL 308.A O no hydrogen 3.350 N/A LEU 312.A N GLN 309.A O no hydrogen 3.464 N/A ARG 315.A N LEU 312.A O no hydrogen 2.972 N/A ARG 315.A NE THR 311.A OG1 no hydrogen 2.877 N/A ARG 315.A NH1 ILE 97.A O no hydrogen 3.003 N/A ARG 315.A NH2 THR 311.A OG1 no hydrogen 3.165 N/A MET 316.A N ALA 313.A O no hydrogen 3.379 N/A