Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nx8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N VAL 1.A O no hydrogen 3.029 N/A ALA 6.A N LYS 2.A O no hydrogen 2.497 N/A LYS 7.A N GLU 3.A O no hydrogen 3.035 N/A ALA 8.A N PHE 4.A O no hydrogen 2.811 N/A LYS 9.A N LEU 5.A O no hydrogen 2.813 N/A LYS 9.A NZ SER 145.A O no hydrogen 3.456 N/A LYS 9.A NZ ASP 147.A OD2 no hydrogen 3.391 N/A GLU 10.A N ALA 6.A O no hydrogen 3.212 N/A ASP 11.A N LYS 7.A O no hydrogen 3.218 N/A PHE 12.A N ALA 8.A O no hydrogen 2.960 N/A LEU 13.A N LYS 9.A O no hydrogen 2.851 N/A LYS 14.A N GLU 10.A O no hydrogen 3.160 N/A LYS 15.A N ASP 11.A O no hydrogen 3.209 N/A LYS 15.A NZ ASP 11.A OD1 no hydrogen 3.052 N/A LYS 15.A NZ ASP 11.A OD2 no hydrogen 2.612 N/A TRP 16.A N PHE 12.A O no hydrogen 2.665 N/A GLU 17.A N LEU 13.A O no hydrogen 2.850 N/A SER 18.A N LYS 14.A O no hydrogen 2.980 N/A ALA 20.A N GLN 82.A OE1 no hydrogen 3.039 N/A GLN 21.A NE2 SER 331.A O no hydrogen 2.990 N/A GLN 21.A NE2 PHE 333.A OXT no hydrogen 2.910 N/A THR 23.A N SER 95.A O no hydrogen 2.906 N/A HIS 25.A N GLN 28.A OE1 no hydrogen 2.788 N/A ASP 27.A N HIS 25.A ND1 no hydrogen 2.693 N/A GLN 28.A N HIS 25.A O no hydrogen 3.237 N/A PHE 29.A N LEU 26.A O no hydrogen 3.349 N/A GLU 30.A N LYS 47.A O no hydrogen 2.704 N/A ARG 31.A NH1 GLU 316.A OE1 no hydrogen 2.842 N/A ARG 31.A NH1 GLU 317.A O no hydrogen 3.074 N/A ARG 31.A NH2 GLU 317.A O no hydrogen 3.035 N/A ILE 32.A N LEU 45.A O no hydrogen 3.025 N/A LYS 33.A N LEU 45.A O no hydrogen 3.395 N/A LYS 33.A NZ ASP 313.A OD1 no hydrogen 2.811 N/A THR 34.A N GLU 316.A OE2 no hydrogen 2.754 N/A THR 34.A OG1 GLU 316.A OE1 no hydrogen 2.705 N/A LEU 35.A N VAL 43.A O no hydrogen 2.762 N/A GLY 36.A N VAL 43.A O no hydrogen 3.432 N/A SER 39.A N ASP 170.A OD1 no hydrogen 2.671 N/A SER 39.A OG ASP 170.A OD1 no hydrogen 2.830 N/A SER 39.A OG ASP 170.A OD2 no hydrogen 2.601 N/A ARG 42.A N ILE 59.A O no hydrogen 3.103 N/A VAL 43.A N GLY 36.A O no hydrogen 3.132 N/A MET 44.A N MET 57.A O no hydrogen 2.777 N/A LEU 45.A N LYS 33.A O no hydrogen 2.636 N/A VAL 46.A N TYR 55.A O no hydrogen 2.658 N/A LYS 47.A N GLU 30.A O no hydrogen 2.768 N/A HIS 48.A N ASN 53.A O no hydrogen 2.688 N/A HIS 48.A ND1 GLN 28.A O no hydrogen 3.210 N/A LYS 49.A N GLN 28.A O no hydrogen 3.265 N/A LYS 49.A NZ ASP 27.A O no hydrogen 2.776 N/A THR 51.A N HIS 48.A O no hydrogen 3.133 N/A THR 51.A OG1 HIS 48.A O no hydrogen 3.442 N/A GLY 52.A N HIS 48.A O no hydrogen 2.500 N/A GLY 52.A N LYS 49.A O no hydrogen 2.903 N/A ASN 53.A N THR 51.A OG1 no hydrogen 3.116 N/A TYR 55.A N VAL 46.A O no hydrogen 2.771 N/A ALA 56.A N MET 106.A O no hydrogen 2.878 N/A MET 57.A N MET 44.A O no hydrogen 2.716 N/A LYS 58.A N MET 104.A O no hydrogen 2.711 N/A LYS 58.A NZ GLU 77.A OE1 no hydrogen 3.107 N/A LYS 58.A NZ GLU 77.A OE2 no hydrogen 3.095 N/A ILE 59.A N ARG 42.A O no hydrogen 2.706 N/A LEU 60.A N LEU 102.A O no hydrogen 3.047 N/A LYS 62.A N SER 100.A O no hydrogen 2.965 N/A LYS 62.A NZ ASP 98.A O no hydrogen 2.502 N/A LYS 62.A NZ ASN 99.A O no hydrogen 2.979 N/A LYS 62.A NZ LYS 325.A O no hydrogen 2.836 N/A LYS 64.A N ASP 61.A OD1 no hydrogen 3.422 N/A VAL 65.A N ASP 61.A O no hydrogen 2.881 N/A VAL 66.A N LYS 62.A O no hydrogen 3.064 N/A LYS 67.A N GLN 63.A O no hydrogen 3.013 N/A LEU 68.A N LYS 64.A O no hydrogen 3.020 N/A LEU 68.A N VAL 65.A O no hydrogen 3.120 N/A LYS 69.A N VAL 66.A O no hydrogen 3.004 N/A GLN 70.A N VAL 65.A O no hydrogen 3.068 N/A GLN 70.A NE2 LEU 68.A O no hydrogen 2.917 N/A HIS 73.A ND1 GLN 70.A OE1 no hydrogen 2.864 N/A THR 74.A N GLN 70.A O no hydrogen 2.979 N/A THR 74.A OG1 GLN 70.A O no hydrogen 2.919 N/A LEU 75.A N ILE 71.A O no hydrogen 2.926 N/A ASN 76.A N GLU 72.A O no hydrogen 2.811 N/A GLU 77.A N HIS 73.A O no hydrogen 2.918 N/A LYS 78.A N THR 74.A O no hydrogen 3.251 N/A LYS 78.A NZ ALA 20.A O no hydrogen 2.739 N/A LYS 78.A NZ PHE 333.A O no hydrogen 2.855 N/A ARG 79.A N LEU 75.A O no hydrogen 2.981 N/A ARG 79.A NE TRP 16.A O no hydrogen 3.004 N/A ARG 79.A NH2 TRP 16.A O no hydrogen 3.032 N/A ILE 80.A N ASN 76.A O no hydrogen 2.833 N/A LEU 81.A N GLU 77.A O no hydrogen 2.988 N/A GLN 82.A N LYS 78.A O no hydrogen 2.919 N/A GLN 82.A NE2 LYS 15.A O no hydrogen 2.958 N/A GLN 82.A NE2 ARG 79.A O no hydrogen 2.860 N/A ALA 83.A N ILE 80.A O no hydrogen 2.995 N/A VAL 84.A N ILE 80.A O no hydrogen 3.125 N/A ASN 85.A N TYR 142.A OH no hydrogen 2.677 N/A LEU 89.A N PHE 86.A O no hydrogen 3.017 N/A VAL 90.A N VAL 168.A O no hydrogen 3.056 N/A GLU 93.A N VAL 105.A O no hydrogen 2.510 N/A PHE 94.A N VAL 105.A O no hydrogen 3.134 N/A SER 95.A N THR 23.A OG1 no hydrogen 3.089 N/A PHE 96.A N TYR 103.A O no hydrogen 3.180 N/A LYS 97.A NZ PHE 330.A O no hydrogen 2.852 N/A LYS 97.A NZ PHE 333.A OXT no hydrogen 2.968 N/A ASP 98.A N ASN 101.A O no hydrogen 2.915 N/A SER 100.A N ASP 98.A OD1 no hydrogen 2.943 N/A SER 100.A OG ARG 320.A O no hydrogen 3.189 N/A ASN 101.A N ASP 98.A OD1 no hydrogen 2.670 N/A ASN 101.A ND2 TYR 103.A OH no hydrogen 2.686 N/A LEU 102.A N LEU 60.A O no hydrogen 2.813 N/A TYR 103.A N PHE 96.A O no hydrogen 2.627 N/A TYR 103.A OH ASP 98.A OD2 no hydrogen 2.438 N/A MET 104.A N LYS 58.A O no hydrogen 2.848 N/A VAL 105.A N PHE 94.A O no hydrogen 2.951 N/A MET 106.A N ALA 56.A O no hydrogen 2.805 N/A GLU 107.A N LYS 91.A O no hydrogen 2.844 N/A TYR 108.A OH ASP 307.A O no hydrogen 2.606 N/A MET 114.A N LEU 158.A O no hydrogen 2.737 N/A PHE 115.A N PRO 155.A O no hydrogen 3.289 N/A SER 116.A N GLU 113.A O no hydrogen 3.157 N/A HIS 117.A NE2.A GLY 111.A O no hydrogen 2.875 N/A LEU 118.A N MET 114.A O no hydrogen 2.887 N/A ARG 119.A N PHE 115.A O no hydrogen 3.018 N/A ARG 119.A NH1 GLU 215.A OE2 no hydrogen 2.598 N/A ARG 119.A NH2 GLU 215.A OE2 no hydrogen 2.657 N/A ARG 120.A N SER 116.A O no hydrogen 3.038 N/A ILE 121.A N HIS 117.A O.A no hydrogen 2.817 N/A ILE 121.A N HIS 117.A O.B no hydrogen 3.099 N/A GLY 122.A N LEU 118.A O no hydrogen 2.682 N/A PHE 124.A N MET 216.A O no hydrogen 2.618 N/A HIS 128.A N SER 125.A OG no hydrogen 3.040 N/A HIS 128.A NE2 TYR 132.A OH no hydrogen 3.170 N/A ALA 129.A N SER 125.A O no hydrogen 2.783 N/A ARG 130.A N GLU 126.A O no hydrogen 2.772 N/A ARG 130.A NH2 TRP 280.A O no hydrogen 2.496 N/A PHE 131.A N PRO 127.A O no hydrogen 3.125 N/A TYR 132.A N HIS 128.A O no hydrogen 3.437 N/A TYR 132.A OH HIS 128.A NE2 no hydrogen 3.170 N/A ALA 133.A N ALA 129.A O no hydrogen 2.885 N/A ALA 134.A N ARG 130.A O no hydrogen 2.945 N/A GLN 135.A N TYR 132.A O no hydrogen 3.082 N/A GLN 135.A NE2 PHE 131.A O no hydrogen 3.014 N/A ILE 136.A N TYR 132.A O no hydrogen 3.254 N/A VAL 137.A N ALA 133.A O no hydrogen 2.976 N/A LEU 138.A N ALA 134.A O no hydrogen 2.929 N/A THR 139.A N GLN 135.A O no hydrogen 2.933 N/A THR 139.A OG1 GLN 135.A O no hydrogen 2.521 N/A PHE 140.A N ILE 136.A O no hydrogen 2.689 N/A GLU 141.A N VAL 137.A O no hydrogen 2.948 N/A TYR 142.A N LEU 138.A O no hydrogen 2.927 N/A LEU 143.A N THR 139.A O no hydrogen 2.859 N/A HIS 144.A N PHE 140.A O no hydrogen 2.697 N/A HIS 144.A ND1 LEU 148.A O no hydrogen 3.078 N/A SER 145.A N GLU 141.A O no hydrogen 2.980 N/A SER 145.A OG GLU 141.A O no hydrogen 3.419 N/A SER 145.A OG TYR 142.A O no hydrogen 2.734 N/A LEU 146.A N LEU 143.A O no hydrogen 2.851 N/A ASP 147.A N HIS 144.A O no hydrogen 2.994 N/A LEU 148.A N LEU 143.A O no hydrogen 3.242 N/A ILE 149.A N LYS 175.A O no hydrogen 3.022 N/A TYR 150.A N ASP 205.A OD2 no hydrogen 2.764 N/A TYR 150.A OH THR 169.A O no hydrogen 2.769 N/A TYR 150.A OH ASP 170.A O no hydrogen 3.205 N/A ARG 151.A N ASP 205.A OD1 no hydrogen 2.886 N/A ARG 151.A NE PHE 173.A O no hydrogen 2.771 N/A ARG 151.A NH1 TYR 200.A OH no hydrogen 2.768 N/A ARG 151.A NH2 PHE 173.A O no hydrogen 3.061 N/A LYS 154.A NZ THR 186.A OG1 no hydrogen 2.793 N/A GLU 156.A N GLU 156.A OE1 no hydrogen 2.648 N/A ASN 157.A N LYS 154.A O no hydrogen 3.082 N/A ASN 157.A ND2 ASP 152.A O no hydrogen 2.840 N/A ASN 157.A ND2 ASP 152.A OD2 no hydrogen 3.091 N/A LEU 158.A N PRO 155.A O no hydrogen 3.173 N/A LEU 159.A N GLN 167.A O no hydrogen 2.720 N/A ILE 160.A N GLY 112.A O no hydrogen 2.802 N/A ASP 161.A N TYR 165.A O no hydrogen 2.499 N/A GLN 163.A N ASP 161.A OD1 no hydrogen 2.895 N/A GLY 164.A N ASP 161.A O no hydrogen 2.664 N/A TYR 165.A N ASP 161.A OD1 no hydrogen 2.956 N/A TYR 165.A OH VAL 294.A O no hydrogen 2.549 N/A ILE 166.A N GLN 135.A OE1 no hydrogen 3.019 N/A GLN 167.A N LEU 159.A O no hydrogen 2.878 N/A GLN 167.A NE2 GLU 107.A OE2 no hydrogen 3.465 N/A GLN 167.A NE2 ASP 161.A OD2 no hydrogen 3.055 N/A VAL 168.A N PHE 88.A O no hydrogen 2.947 N/A THR 169.A N ASN 157.A O no hydrogen 2.863 N/A PHE 171.A N GLU 77.A OE2 no hydrogen 3.066 N/A GLY 172.A N ASP 170.A OD2 no hydrogen 2.988 N/A ALA 174.A N PHE 171.A O no hydrogen 3.081 N/A LYS 175.A N ILE 149.A O no hydrogen 3.134 N/A ARG 176.A NE LEU 146.A O no hydrogen 3.218 N/A ARG 176.A NH2 ASP 147.A OD2 no hydrogen 3.550 N/A VAL 177.A N ASP 147.A O no hydrogen 2.582 N/A LYS 178.A NZ ASP 147.A OD2 no hydrogen 3.109 N/A THR 181.A N TYR 200.A O no hydrogen 2.913 N/A THR 186.A OG1 ASP 152.A OD1 no hydrogen 3.287 N/A GLU 188.A N GLU 188.A OE1 no hydrogen 2.728 N/A TYR 189.A N THR 186.A O no hydrogen 2.852 N/A TYR 189.A OH GLU 215.A OE1 no hydrogen 2.715 N/A LEU 190.A N PRO 187.A O no hydrogen 3.184 N/A GLU 193.A N GLU 193.A OE1 no hydrogen 2.763 N/A ILE 194.A N ALA 191.A O no hydrogen 3.061 N/A ILE 195.A N ALA 191.A O no hydrogen 3.304 N/A LEU 196.A N PRO 192.A O no hydrogen 2.905 N/A SER 197.A N ILE 194.A O no hydrogen 3.141 N/A LYS 198.A N GLU 193.A O no hydrogen 3.225 N/A TYR 200.A N THR 181.A O no hydrogen 3.009 N/A ALA 203.A N ASN 201.A OD1 no hydrogen 2.922 N/A VAL 204.A N ASN 201.A O no hydrogen 3.079 N/A ASP 205.A N LYS 202.A O no hydrogen 3.009 N/A TRP 207.A N ALA 203.A O no hydrogen 3.178 N/A ALA 208.A N VAL 204.A O no hydrogen 3.099 N/A LEU 209.A N ASP 205.A O no hydrogen 2.949 N/A GLY 210.A N TRP 206.A O no hydrogen 3.164 N/A VAL 211.A N TRP 207.A O no hydrogen 2.989 N/A LEU 212.A N ALA 208.A O no hydrogen 2.898 N/A ILE 213.A N LEU 209.A O no hydrogen 2.818 N/A TYR 214.A N GLY 210.A O no hydrogen 3.041 N/A TYR 214.A OH ARG 241.A O no hydrogen 2.329 N/A GLU 215.A N VAL 211.A O no hydrogen 2.846 N/A MET 216.A N LEU 212.A O no hydrogen 2.983 N/A ALA 217.A N ILE 213.A O no hydrogen 2.935 N/A ALA 218.A N TYR 214.A O no hydrogen 2.710 N/A GLY 219.A N GLU 215.A O no hydrogen 2.681 N/A ILE 231.A N GLN 227.A O no hydrogen 2.972 N/A TYR 232.A N PRO 228.A O no hydrogen 2.677 N/A GLU 233.A N ILE 229.A O no hydrogen 3.273 N/A LYS 234.A N GLN 230.A O no hydrogen 3.347 N/A LYS 234.A N ILE 231.A O no hydrogen 3.071 N/A ILE 235.A N ILE 231.A O no hydrogen 3.063 N/A VAL 236.A N TYR 232.A O no hydrogen 3.087 N/A SER 237.A N GLU 233.A O no hydrogen 3.093 N/A SER 237.A OG LYS 234.A O no hydrogen 3.538 N/A LYS 239.A N SER 237.A O no hydrogen 2.879 N/A PHE 246.A N PRO 243.A O no hydrogen 2.996 N/A SER 247.A N GLU 126.A OE2 no hydrogen 2.667 N/A SER 247.A OG GLU 126.A OE1 no hydrogen 2.896 N/A LEU 250.A N SER 247.A OG no hydrogen 3.179 N/A LYS 251.A N SER 247.A O no hydrogen 3.014 N/A LYS 251.A NZ PHE 246.A O no hydrogen 3.202 N/A ASP 252.A N SER 248.A O no hydrogen 2.938 N/A LEU 253.A N ASP 249.A O no hydrogen 2.832 N/A LEU 254.A N LEU 250.A O no hydrogen 2.872 N/A ARG 255.A N LYS 251.A O no hydrogen 2.922 N/A ASN 256.A N ASP 252.A O no hydrogen 3.157 N/A ASN 256.A N LEU 253.A O no hydrogen 2.641 N/A LEU 257.A N LEU 253.A O no hydrogen 2.902 N/A LEU 258.A N LEU 254.A O no hydrogen 2.793 N/A ASP 261.A N GLN 259.A OE1 no hydrogen 2.663 N/A LYS 264.A N ASP 261.A O no hydrogen 2.837 N/A ARG 265.A N LEU 262.A O no hydrogen 3.438 N/A ARG 265.A NE GLN 259.A O no hydrogen 2.643 N/A ARG 265.A NH1 GLU 193.A OE2 no hydrogen 2.708 N/A ARG 265.A NH1 ALA 203.A O no hydrogen 2.842 N/A ARG 265.A NH2 GLU 193.A OE1 no hydrogen 2.569 N/A ARG 265.A NH2 GLU 193.A OE2 no hydrogen 3.064 N/A ARG 265.A NH2 GLN 259.A O no hydrogen 3.279 N/A PHE 266.A N ASN 256.A O no hydrogen 2.798 N/A ASN 268.A N ARG 265.A O no hydrogen 2.964 N/A ASN 268.A ND2 LEU 262.A O no hydrogen 3.017 N/A GLY 272.A N LEU 269.A O no hydrogen 2.912 N/A ASP 275.A N GLY 272.A O no hydrogen 3.217 N/A ILE 276.A N VAL 273.A O no hydrogen 2.729 N/A HIS 278.A N ILE 276.A O no hydrogen 2.999 N/A HIS 278.A NE2 ASP 252.A OD2 no hydrogen 2.498 N/A TRP 280.A N HIS 278.A ND1 no hydrogen 3.150 N/A TRP 280.A NE1 GLU 126.A OE1 no hydrogen 2.791 N/A PHE 281.A N HIS 278.A O no hydrogen 2.964 N/A ALA 282.A N LYS 279.A O no hydrogen 2.557 N/A THR 284.A N PHE 281.A O no hydrogen 2.960 N/A ILE 289.A N ASP 285.A O no hydrogen 2.904 N/A TYR 290.A N TRP 286.A O no hydrogen 3.066 N/A GLN 291.A N ILE 287.A O no hydrogen 2.881 N/A GLN 291.A N ALA 288.A O no hydrogen 3.146 N/A ARG 292.A N ILE 289.A O no hydrogen 2.917 N/A ARG 292.A NH2 PRO 87.A O no hydrogen 2.882 N/A LYS 293.A N ALA 288.A O no hydrogen 2.937 N/A SER 309.A N ASP 307.A OD1 no hydrogen 3.187 N/A ASN 310.A ND2 PRO 110.A O no hydrogen 3.360 N/A ASN 310.A ND2 LYS 301.A O no hydrogen 2.642 N/A PHE 311.A N THR 308.A O no hydrogen 2.856 N/A LYS 325.A N ASN 99.A O no hydrogen 2.582 N/A GLU 329.A N GLU 329.A OE1 no hydrogen 2.632 N/A PHE 330.A N CYS 326.A O no hydrogen 3.235 N/A SER 331.A N LYS 328.A O no hydrogen 3.417 N/A PHE 333.A N PHE 330.A O no hydrogen 2.864 N/A