Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4q1d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N ASP 144.A OD2 no hydrogen 2.982 N/A LYS 4.A NZ GLU 142.A O no hydrogen 2.670 N/A LYS 4.A NZ ASP 144.A OD2 no hydrogen 3.294 N/A ILE 5.A N LEU 95.A O no hydrogen 2.774 N/A SER 6.A N GLY 145.A O no hydrogen 3.179 N/A SER 6.A OG GLU 8.A OE1 no hydrogen 2.356 N/A ILE 7.A N PHE 97.A O no hydrogen 2.620 N/A GLU 8.A N ILE 147.A O no hydrogen 3.076 N/A ASN 10.A ND2 LEU 176.A O no hydrogen 2.905 N/A ILE 11.A N ASN 10.A OD1 no hydrogen 2.588 N/A ALA 13.A N ASN 10.A O no hydrogen 3.224 N/A LYS 15.A NZ ASN 10.A O no hydrogen 3.268 N/A PHE 18.A N GLY 14.A O no hydrogen 2.958 N/A VAL 19.A N LYS 15.A O no hydrogen 2.742 N/A ASN 20.A N SER 16.A O no hydrogen 3.050 N/A ILE 21.A N THR 17.A O no hydrogen 2.888 N/A LEU 22.A N PHE 18.A O no hydrogen 2.907 N/A LYS 23.A N VAL 19.A O no hydrogen 2.918 N/A LEU 25.A N LEU 22.A O no hydrogen 2.993 N/A ASP 28.A N SER 26.A OG no hydrogen 3.122 N/A TRP 29.A N SER 26.A O no hydrogen 3.301 N/A GLU 30.A N VAL 94.A O no hydrogen 3.015 N/A VAL 32.A N PHE 96.A O no hydrogen 3.074 N/A GLU 34.A N GLU 98.A OE2 no hydrogen 3.160 N/A ALA 37.A N GLU 34.A O no hydrogen 3.065 N/A ARG 38.A N GLU 34.A O no hydrogen 3.311 N/A TRP 39.A N PRO 35.A O no hydrogen 3.057 N/A SER 40.A N VAL 36.A O no hydrogen 2.788 N/A SER 40.A OG VAL 36.A O no hydrogen 2.777 N/A GLU 45.A N THR 43.A OG1 no hydrogen 3.023 N/A GLN 46.A N THR 43.A OG1 no hydrogen 3.085 N/A LYS 47.A N THR 43.A O no hydrogen 2.681 N/A ASN 48.A N MET 44.A O no hydrogen 3.211 N/A ASN 48.A ND2 TYR 70.A OH no hydrogen 3.116 N/A GLY 49.A N GLU 45.A O no hydrogen 2.650 N/A GLY 50.A N GLN 46.A O no hydrogen 2.682 N/A ASN 51.A N LYS 47.A O no hydrogen 3.371 N/A VAL 52.A N ASN 48.A O no hydrogen 2.937 N/A LEU 53.A N GLY 49.A O no hydrogen 2.505 N/A GLN 54.A N GLY 50.A O no hydrogen 2.916 N/A MET 55.A N ASN 51.A O no hydrogen 2.928 N/A MET 56.A N VAL 52.A O no hydrogen 2.751 N/A TYR 57.A N LEU 53.A O no hydrogen 3.149 N/A GLU 58.A N GLN 54.A O no hydrogen 3.143 N/A LYS 59.A N MET 55.A O no hydrogen 2.741 N/A GLU 61.A N GLU 61.A OE1 no hydrogen 2.652 N/A ARG 62.A N LYS 59.A O no hydrogen 3.199 N/A ARG 62.A NH1 ARG 62.A O no hydrogen 2.997 N/A TRP 63.A N LYS 59.A O no hydrogen 3.385 N/A SER 64.A N PRO 60.A O no hydrogen 2.985 N/A SER 64.A OG PRO 60.A O no hydrogen 2.712 N/A PHE 67.A N TRP 63.A O no hydrogen 2.769 N/A GLN 68.A N SER 64.A O no hydrogen 2.865 N/A THR 69.A N PHE 65.A O no hydrogen 3.129 N/A THR 69.A OG1 PHE 65.A O no hydrogen 3.427 N/A THR 69.A OG1 THR 66.A O no hydrogen 3.011 N/A TYR 70.A N THR 66.A O no hydrogen 3.041 N/A ALA 71.A N PHE 67.A O no hydrogen 2.837 N/A CYS 72.A N GLN 68.A O no hydrogen 2.927 N/A CYS 72.A SG ASP 104.A OD2 no hydrogen 3.662 N/A LEU 73.A N THR 69.A O no hydrogen 2.901 N/A SER 74.A N TYR 70.A O no hydrogen 2.992 N/A SER 74.A OG TYR 70.A O no hydrogen 2.337 N/A ARG 75.A N ALA 71.A O no hydrogen 2.985 N/A ARG 75.A NE ASP 104.A OD1 no hydrogen 3.383 N/A ARG 75.A NE ASP 104.A OD2 no hydrogen 2.552 N/A ARG 75.A NH1 GLU 98.A O no hydrogen 2.911 N/A ARG 75.A NH2 GLU 34.A OE2 no hydrogen 2.749 N/A ARG 75.A NH2 ASP 104.A OD1 no hydrogen 2.783 N/A ILE 76.A N CYS 72.A O no hydrogen 3.126 N/A ARG 77.A N LEU 73.A O no hydrogen 3.333 N/A ARG 77.A NH2 GLU 45.A OE1 no hydrogen 3.367 N/A ALA 78.A N SER 74.A O no hydrogen 3.088 N/A GLN 79.A N ARG 75.A O no hydrogen 2.847 N/A GLN 79.A NE2 ARG 99.A O no hydrogen 3.597 N/A LEU 80.A N ILE 76.A O no hydrogen 2.863 N/A ALA 81.A N ARG 77.A O no hydrogen 3.005 N/A SER 82.A N ALA 78.A O no hydrogen 2.812 N/A LEU 83.A N GLN 79.A O no hydrogen 3.114 N/A ASN 84.A N ALA 81.A O no hydrogen 3.450 N/A ASN 84.A ND2 LEU 80.A O no hydrogen 3.065 N/A GLY 85.A N ALA 81.A O no hydrogen 2.883 N/A VAL 94.A N ASP 28.A O no hydrogen 2.663 N/A LEU 95.A N LYS 3.A O no hydrogen 2.864 N/A PHE 96.A N GLU 30.A O no hydrogen 2.965 N/A PHE 97.A N ILE 5.A O no hydrogen 2.504 N/A GLU 98.A N VAL 32.A O no hydrogen 3.134 N/A ARG 99.A N ILE 7.A O no hydrogen 2.967 N/A ARG 99.A NE GLY 9.A O no hydrogen 3.221 N/A ARG 99.A NH1 GLU 34.A OE2 no hydrogen 3.472 N/A ARG 99.A NH2 GLY 9.A O no hydrogen 3.296 N/A SER 100.A N SER 103.A OG no hydrogen 3.215 N/A SER 100.A OG GLU 8.A OE1 no hydrogen 2.640 N/A TYR 102.A N SER 100.A OG no hydrogen 3.078 N/A TYR 102.A OH TYR 198.A OH no hydrogen 2.430 N/A SER 103.A N SER 100.A OG no hydrogen 3.385 N/A SER 103.A OG GLU 8.A OE2 no hydrogen 2.630 N/A SER 103.A OG SER 100.A O no hydrogen 3.321 N/A ASP 104.A N SER 100.A O no hydrogen 3.205 N/A ARG 105.A NH1 HIS 130.A ND1 no hydrogen 3.044 N/A ARG 105.A NH1 ASP 131.A OD1 no hydrogen 3.196 N/A ARG 105.A NH2 GLN 127.A OE1 no hydrogen 3.331 N/A TYR 106.A N TYR 102.A O no hydrogen 2.952 N/A PHE 108.A N SER 103.A O no hydrogen 3.073 N/A ALA 109.A N ASP 104.A O no hydrogen 2.938 N/A SER 110.A N ARG 105.A O no hydrogen 2.843 N/A ASN 111.A N ILE 107.A O no hydrogen 3.238 N/A LEU 112.A N PHE 108.A O no hydrogen 2.913 N/A TYR 113.A N ALA 109.A O no hydrogen 2.851 N/A GLU 114.A N SER 110.A O no hydrogen 2.846 N/A SER 115.A N ASN 111.A O no hydrogen 2.787 N/A SER 115.A OG.A LEU 112.A O no hydrogen 3.338 N/A SER 115.A OG.B ASN 111.A O no hydrogen 3.015 N/A GLU 116.A N TYR 113.A O no hydrogen 2.631 N/A SER 117.A N LEU 112.A O no hydrogen 2.771 N/A SER 117.A OG SER 115.A OG.A no hydrogen 3.087 N/A ASN 119.A N GLU 122.A OE1 no hydrogen 3.223 N/A GLU 122.A N ASN 119.A OD1 no hydrogen 2.909 N/A TRP 123.A N ASN 119.A O no hydrogen 3.024 N/A THR 124.A N GLU 120.A O no hydrogen 2.758 N/A THR 124.A OG1 GLU 120.A O no hydrogen 2.074 N/A THR 124.A OG1 THR 121.A O no hydrogen 3.544 N/A ILE 125.A N THR 121.A O no hydrogen 2.932 N/A TYR 126.A N GLU 122.A O no hydrogen 2.819 N/A GLN 127.A N TRP 123.A O no hydrogen 3.103 N/A GLN 127.A NE2 TRP 123.A O no hydrogen 3.044 N/A ASP 128.A N THR 124.A O no hydrogen 2.899 N/A TRP 129.A N ILE 125.A O no hydrogen 2.752 N/A HIS 130.A N TYR 126.A O no hydrogen 2.712 N/A HIS 130.A NE2 VAL 101.A O no hydrogen 3.213 N/A ASP 131.A N GLN 127.A O no hydrogen 3.069 N/A TRP 132.A N ASP 128.A O no hydrogen 3.276 N/A TRP 132.A N TRP 129.A O no hydrogen 2.968 N/A MET 133.A N TRP 129.A O no hydrogen 2.727 N/A ASN 134.A N HIS 130.A O no hydrogen 3.029 N/A ASN 134.A ND2 HIS 130.A O no hydrogen 2.895 N/A ASN 135.A N ASP 131.A O no hydrogen 2.910 N/A GLN 136.A N TRP 132.A O no hydrogen 2.927 N/A PHE 137.A N MET 133.A O no hydrogen 3.062 N/A GLN 139.A NE2 GLN 139.A O no hydrogen 3.334 N/A LEU 143.A N TYR 198.A OH no hydrogen 2.883 N/A ASP 144.A N LYS 4.A O no hydrogen 3.174 N/A ILE 146.A N PRO 203.A O no hydrogen 3.398 N/A ILE 147.A N SER 6.A O no hydrogen 2.864 N/A TYR 148.A N LEU 205.A O no hydrogen 2.680 N/A TYR 148.A OH GLU 184.A OE2 no hydrogen 2.508 N/A LEU 149.A N GLU 8.A O no hydrogen 2.981 N/A GLN 150.A N LEU 207.A O no hydrogen 2.837 N/A GLN 150.A NE2 GLU 184.A OE1 no hydrogen 3.072 N/A GLN 150.A NE2 GLU 184.A OE2 no hydrogen 3.164 N/A THR 152.A N ASN 210.A OD1 no hydrogen 2.833 N/A THR 152.A OG1 THR 155.A OG1 no hydrogen 2.789 N/A THR 155.A N THR 152.A OG1 no hydrogen 3.021 N/A THR 155.A OG1 THR 152.A OG1 no hydrogen 2.789 N/A THR 155.A OG1 ASN 210.A OD1 no hydrogen 2.836 N/A CYS 156.A N THR 152.A O no hydrogen 3.046 N/A CYS 156.A SG THR 152.A O no hydrogen 3.747 N/A LEU 157.A N PRO 153.A O no hydrogen 3.156 N/A HIS 158.A N GLU 154.A O no hydrogen 3.010 N/A ARG 159.A N THR 155.A O no hydrogen 2.985 N/A ARG 159.A NH1 VAL 209.A O no hydrogen 2.855 N/A ARG 159.A NH2 VAL 209.A O no hydrogen 3.104 N/A ILE 160.A N CYS 156.A O no hydrogen 2.885 N/A GLY 164.A N ILE 160.A O no hydrogen 3.480 N/A ARG 165.A NH1 GLU 168.A OE2 no hydrogen 2.694 N/A GLU 168.A N ARG 165.A O no hydrogen 3.155 N/A GLN 169.A N ASN 166.A O no hydrogen 3.234 N/A GLN 169.A NE2 ARG 165.A O no hydrogen 2.478 N/A ILE 171.A N GLU 168.A O no hydrogen 3.020 N/A LYS 178.A N GLU 174.A O no hydrogen 3.173 N/A LEU 179.A N TYR 175.A O no hydrogen 3.015 N/A HIS 180.A N LEU 176.A O no hydrogen 2.687 N/A TYR 181.A N GLU 177.A O no hydrogen 3.091 N/A LYS 182.A N LYS 178.A O no hydrogen 2.953 N/A LYS 182.A NZ SER 110.A OG no hydrogen 3.305 N/A LYS 182.A NZ GLU 114.A OE1 no hydrogen 3.165 N/A LYS 182.A NZ GLU 114.A OE2 no hydrogen 3.058 N/A HIS 183.A N LEU 179.A O no hydrogen 2.543 N/A HIS 183.A ND1 LEU 179.A O no hydrogen 3.121 N/A GLU 184.A N HIS 180.A O no hydrogen 2.420 N/A SER 185.A N TYR 181.A O no hydrogen 2.597 N/A SER 185.A OG TYR 181.A O no hydrogen 2.807 N/A TRP 186.A N LYS 182.A O no hydrogen 2.695 N/A LEU 187.A N HIS 183.A O no hydrogen 2.815 N/A LEU 188.A N GLU 184.A O no hydrogen 3.181 N/A HIS 189.A N GLU 184.A O no hydrogen 3.435 N/A ARG 190.A NH1 VAL 202.A O no hydrogen 3.565 N/A ARG 190.A NH2 LEU 199.A O no hydrogen 3.164 N/A ARG 190.A NH2 VAL 202.A O no hydrogen 2.885 N/A THR 191.A OG1 SER 185.A O no hydrogen 3.292 N/A THR 194.A OG1 PHE 196.A O no hydrogen 3.297 N/A ASN 195.A N TYR 106.A OH no hydrogen 3.085 N/A TYR 198.A OH TYR 102.A OH no hydrogen 2.430 N/A LEU 199.A N PHE 196.A O no hydrogen 3.084 N/A GLN 200.A N ASP 197.A O no hydrogen 3.360 N/A GLU 201.A N TYR 198.A O no hydrogen 3.302 N/A VAL 202.A N TYR 198.A O no hydrogen 3.444 N/A LEU 205.A N ILE 146.A O no hydrogen 2.884 N/A LEU 207.A N TYR 148.A O no hydrogen 2.670 N/A VAL 209.A N GLN 150.A O no hydrogen 3.254 N/A ASN 210.A N ASP 208.A OD1 no hydrogen 2.899 N/A ASN 210.A ND2 ASP 208.A OD1 no hydrogen 2.738 N/A LYS 214.A N ASP 212.A OD1 no hydrogen 3.038 N/A LYS 216.A N PHE 213.A O no hydrogen 3.405 N/A LYS 216.A NZ GLU 211.A OE2 no hydrogen 2.475 N/A VAL 221.A N TYR 217.A O no hydrogen 2.990 N/A GLU 222.A N GLU 218.A O no hydrogen 2.940 N/A LYS 223.A N SER 219.A O no hydrogen 2.991 N/A VAL 224.A N LEU 220.A O no hydrogen 3.107 N/A LYS 225.A N VAL 221.A O no hydrogen 2.771 N/A GLU 226.A N GLU 222.A O no hydrogen 3.343 N/A GLU 226.A N LYS 223.A O no hydrogen 3.339 N/A PHE 227.A N LYS 223.A O no hydrogen 3.035 N/A LEU 228.A N VAL 224.A O no hydrogen 2.611 N/A SER 229.A N LYS 225.A O no hydrogen 3.143 N/A SER 229.A OG GLU 226.A O no hydrogen 2.930 N/A THR 230.A N GLU 226.A O no hydrogen 2.999 N/A THR 230.A OG1 PHE 227.A O no hydrogen 2.515 N/A LEU 231.A N LEU 228.A O no hydrogen 3.132 N/A