Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yv1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N LEU 17.A O no hydrogen 2.696 N/A ARG 4.A NH2 GLU 6.A OE2 no hydrogen 2.160 N/A GLU 5.A N MET 15.A O no hydrogen 2.802 N/A TRP 10.A N ASN 7.A O no hydrogen 3.118 N/A MET 15.A N GLU 5.A O no hydrogen 2.933 N/A LEU 17.A N PHE 3.A O no hydrogen 2.982 N/A VAL 19.A N GLY 1.A O no hydrogen 2.957 N/A GLU 20.A N GLU 37.A O no hydrogen 2.643 N/A LYS 21.A N GLU 37.A O no hydrogen 3.270 N/A LEU 23.A N ILE 35.A O no hydrogen 2.862 N/A TYR 24.A N ILE 35.A O no hydrogen 3.056 N/A ALA 26.A N LEU 33.A O no hydrogen 3.162 N/A THR 28.A N GLN 31.A O no hydrogen 2.817 N/A THR 28.A OG1 ASP 111.A OD1 no hydrogen 3.080 N/A THR 28.A OG1 ASP 111.A OD2 no hydrogen 3.205 N/A GLN 31.A NE2 ASP 111.A OD2 no hydrogen 2.851 N/A HIS 32.A N ASP 51.A OD1 no hydrogen 2.707 N/A HIS 32.A NE2 ASP 25.A OD1 no hydrogen 2.564 N/A LEU 33.A N ALA 26.A O no hydrogen 3.126 N/A THR 34.A N ALA 49.A O no hydrogen 2.886 N/A THR 34.A OG1 ASP 25.A OD1 no hydrogen 3.048 N/A ILE 35.A N TYR 24.A O no hydrogen 2.869 N/A PHE 36.A N VAL 47.A O no hydrogen 2.823 N/A GLU 37.A N LYS 21.A O no hydrogen 2.751 N/A SER 38.A N GLY 45.A O no hydrogen 3.099 N/A SER 38.A OG GLY 45.A O no hydrogen 2.777 N/A LYS 41.A N ASP 39.A OD1 no hydrogen 2.781 N/A GLY 42.A N ASP 39.A O no hydrogen 3.051 N/A THR 46.A N ASP 58.A OD2 no hydrogen 2.803 N/A THR 46.A OG1 GLU 37.A OE1 no hydrogen 2.738 N/A THR 46.A OG1 ASP 58.A OD2 no hydrogen 3.018 N/A VAL 47.A N PHE 36.A O no hydrogen 2.740 N/A MET 48.A N VAL 56.A O no hydrogen 2.984 N/A ALA 49.A N THR 34.A O no hydrogen 2.703 N/A LEU 50.A N CYS 53.A O no hydrogen 3.027 N/A ASP 51.A N HIS 32.A O no hydrogen 2.726 N/A CYS 53.A N LEU 50.A O no hydrogen 2.984 N/A CYS 53.A SG ASP 51.A O no hydrogen 3.925 N/A ILE 54.A N GLU 5.A OE1 no hydrogen 3.346 N/A ILE 54.A N GLU 5.A OE2 no hydrogen 3.353 N/A GLN 55.A N MET 48.A O no hydrogen 2.803 N/A GLN 55.A NE2 CYS 53.A O no hydrogen 3.544 N/A VAL 56.A N MET 48.A O no hydrogen 3.313 N/A THR 57.A OG1 ASP 60.A OD1 no hydrogen 2.684 N/A ASP 58.A N THR 46.A O no hydrogen 2.977 N/A TYR 59.A N TRP 44.A O no hydrogen 3.312 N/A TYR 59.A N THR 57.A OG1 no hydrogen 3.272 N/A ASP 60.A N THR 57.A OG1 no hydrogen 3.252 N/A GLU 61.A N THR 57.A O no hydrogen 3.174 N/A VAL 63.A N ASP 60.A O no hydrogen 3.097 N/A TYR 64.A OH ASP 159.A OD1 no hydrogen 2.641 N/A HIS 65.A N GLU 61.A O no hydrogen 3.304 N/A HIS 65.A ND1 GLU 61.A OE2 no hydrogen 2.719 N/A GLU 66.A N PHE 62.A O no hydrogen 2.955 N/A VAL 67.A N VAL 63.A O no hydrogen 2.870 N/A LEU 68.A N TYR 64.A O no hydrogen 3.001 N/A GLY 69.A N HIS 65.A O no hydrogen 3.015 N/A HIS 70.A N GLU 66.A O no hydrogen 2.822 N/A HIS 70.A ND1 HIS 99.A NE2 no hydrogen 2.857 N/A HIS 70.A NE2 GLU 95.A OE1 no hydrogen 2.812 N/A THR 71.A N VAL 67.A O no hydrogen 2.914 N/A THR 71.A OG1 VAL 67.A O no hydrogen 2.546 N/A SER 72.A OG LEU 68.A O no hydrogen 2.816 N/A SER 72.A OG GLY 69.A O no hydrogen 3.310 N/A LEU 73.A N GLY 69.A O no hydrogen 3.262 N/A CYS 74.A N HIS 70.A O no hydrogen 2.856 N/A CYS 74.A SG ARG 239.A O no hydrogen 3.360 N/A SER 75.A N SER 72.A O no hydrogen 3.019 N/A SER 75.A OG THR 71.A O no hydrogen 2.670 N/A SER 75.A OG VAL 234.A O no hydrogen 3.524 N/A HIS 76.A N LEU 73.A O no hydrogen 3.240 N/A LYS 78.A N HIS 76.A ND1 no hydrogen 3.035 N/A GLU 80.A N ASP 154.A OD2 no hydrogen 2.761 N/A ARG 81.A N ASP 154.A OD2 no hydrogen 2.969 N/A ARG 81.A NE THR 152.A O no hydrogen 3.157 N/A VAL 82.A N HIS 104.A O no hydrogen 3.052 N/A LEU 83.A N VAL 155.A O no hydrogen 2.916 N/A ILE 84.A N ASP 106.A O no hydrogen 2.762 N/A ILE 85.A N ILE 157.A O no hydrogen 2.856 N/A GLY 86.A N VAL 108.A O no hydrogen 2.809 N/A GLY 87.A N ASP 159.A O no hydrogen 3.131 N/A GLY 88.A N ASP 109.A OD2 no hydrogen 2.804 N/A GLY 90.A N GLY 87.A O no hydrogen 2.977 N/A GLY 91.A N ASP 89.A OD1 no hydrogen 2.833 N/A ARG 94.A N GLY 90.A O no hydrogen 2.952 N/A ARG 94.A NE GLU 95.A OE2 no hydrogen 2.891 N/A ARG 94.A NH1 GLU 61.A OE1 no hydrogen 3.074 N/A ARG 94.A NH1 GLU 61.A OE2 no hydrogen 3.389 N/A ARG 94.A NH1 GLN 124.A O no hydrogen 3.125 N/A ARG 94.A NH2 GLU 61.A OE1 no hydrogen 3.443 N/A ARG 94.A NH2 GLU 61.A OE2 no hydrogen 2.707 N/A ARG 94.A NH2 GLU 95.A OE2 no hydrogen 2.954 N/A GLU 95.A N GLY 91.A O no hydrogen 3.269 N/A VAL 96.A N VAL 92.A O no hydrogen 2.896 N/A LEU 97.A N LEU 93.A O no hydrogen 2.964 N/A ARG 98.A N GLU 95.A O no hydrogen 2.992 N/A ARG 98.A NE GLU 95.A OE1 no hydrogen 2.759 N/A ARG 98.A NH2 GLU 95.A OE2 no hydrogen 3.299 N/A HIS 99.A N VAL 96.A O no hydrogen 3.060 N/A HIS 99.A NE2 HIS 70.A ND1 no hydrogen 2.857 N/A THR 101.A OG1 PRO 79.A O no hydrogen 2.824 N/A VAL 102.A N HIS 99.A O no hydrogen 3.225 N/A GLU 103.A N GLU 80.A O no hydrogen 2.827 N/A HIS 104.A N GLU 80.A O no hydrogen 3.192 N/A HIS 104.A NE2 ASP 106.A OD1 no hydrogen 2.695 N/A CYS 105.A N ARG 133.A O no hydrogen 2.925 N/A CYS 105.A SG VAL 82.A O no hydrogen 3.591 N/A CYS 105.A SG ASP 106.A O no hydrogen 3.601 N/A ASP 106.A N VAL 82.A O no hydrogen 2.930 N/A LEU 107.A N THR 135.A O no hydrogen 2.895 N/A VAL 108.A N ILE 84.A O no hydrogen 2.906 N/A ASP 109.A N ARG 137.A O no hydrogen 3.023 N/A ASP 111.A N ASP 109.A OD1 no hydrogen 2.769 N/A GLU 113.A N ASP 111.A OD1 no hydrogen 2.851 N/A VAL 114.A N ASP 111.A O no hydrogen 3.095 N/A GLU 116.A N GLY 112.A O no hydrogen 3.148 N/A GLN 117.A N GLU 113.A O no hydrogen 2.809 N/A GLN 117.A NE2 GLU 113.A OE2 no hydrogen 2.595 N/A GLN 117.A NE2 GLN 120.A OE1 no hydrogen 3.685 N/A SER 118.A N VAL 114.A O no hydrogen 2.858 N/A SER 118.A OG VAL 114.A O no hydrogen 2.361 N/A LYS 119.A N MET 115.A O no hydrogen 2.909 N/A LYS 119.A NZ GLU 116.A OE2 no hydrogen 3.201 N/A GLN 120.A N GLU 116.A O no hydrogen 3.187 N/A HIS 121.A N GLN 117.A O no hydrogen 2.796 N/A PHE 122.A N SER 118.A O no hydrogen 2.852 N/A ILE 125.A N PHE 122.A O no hydrogen 2.804 N/A SER 126.A N PHE 122.A O no hydrogen 2.835 N/A SER 126.A OG SER 118.A O no hydrogen 2.808 N/A SER 126.A OG PHE 122.A O no hydrogen 3.115 N/A SER 128.A OG GLY 90.A O no hydrogen 2.742 N/A SER 128.A OG ILE 125.A O no hydrogen 3.267 N/A LEU 129.A N SER 126.A O no hydrogen 2.998 N/A ALA 130.A N ARG 127.A O no hydrogen 3.083 N/A ASP 131.A N SER 128.A O no hydrogen 3.033 N/A ARG 133.A N ASP 131.A OD1 no hydrogen 2.808 N/A ARG 133.A NH1 HIS 99.A O no hydrogen 3.239 N/A ARG 133.A NH1 VAL 102.A O no hydrogen 2.868 N/A ARG 133.A NH2 LEU 97.A O no hydrogen 2.621 N/A ALA 134.A N ASP 131.A O no hydrogen 2.929 N/A THR 135.A N CYS 105.A O no hydrogen 2.956 N/A ARG 137.A N LEU 107.A O no hydrogen 2.742 N/A GLY 139.A N ASP 109.A O no hydrogen 3.034 N/A LEU 142.A N ASP 140.A OD1 no hydrogen 2.840 N/A PHE 144.A N ASP 140.A O no hydrogen 2.978 N/A VAL 145.A N GLY 141.A O no hydrogen 2.977 N/A ARG 146.A N LEU 142.A O no hydrogen 3.359 N/A GLN 147.A N ALA 143.A O no hydrogen 3.199 N/A THR 148.A N VAL 145.A O no hydrogen 3.279 N/A THR 148.A OG1 PHE 144.A O no hydrogen 2.679 N/A ASN 151.A N ARG 169.A O no hydrogen 3.050 N/A THR 152.A N ILE 170.A O no hydrogen 2.738 N/A THR 152.A OG1 PRO 149.A O no hydrogen 2.438 N/A TYR 153.A N ILE 170.A O no hydrogen 2.861 N/A TYR 153.A OH ASP 106.A OD2 no hydrogen 2.474 N/A ASP 154.A N ARG 81.A O no hydrogen 2.752 N/A VAL 155.A N ARG 81.A O no hydrogen 3.390 N/A VAL 156.A N ILE 176.A O no hydrogen 2.988 N/A ILE 157.A N LEU 83.A O no hydrogen 2.682 N/A ILE 158.A N CYS 178.A O no hydrogen 2.689 N/A ASP 159.A N ILE 85.A O no hydrogen 2.921 N/A ASP 166.A N ALA 162.A O no hydrogen 2.838 N/A VAL 167.A N PHE 163.A O no hydrogen 2.841 N/A LEU 168.A N TYR 164.A O no hydrogen 2.881 N/A ARG 169.A N LYS 165.A O no hydrogen 2.935 N/A ARG 169.A NE ASP 166.A OD1 no hydrogen 3.268 N/A ARG 169.A NH1 THR 148.A O no hydrogen 3.109 N/A ARG 169.A NH1 ASP 166.A OD1 no hydrogen 2.940 N/A ARG 169.A NH2 THR 148.A O no hydrogen 2.759 N/A ARG 169.A NH2 ASP 150.A OD1 no hydrogen 2.830 N/A ILE 170.A N ASP 166.A O no hydrogen 2.814 N/A LEU 171.A N VAL 167.A O no hydrogen 3.242 N/A LYS 172.A N TYR 153.A O no hydrogen 2.862 N/A GLY 175.A N LYS 172.A O no hydrogen 2.844 N/A ILE 176.A N ASP 154.A O no hydrogen 2.950 N/A CYS 177.A N CYS 226.A O no hydrogen 2.946 N/A CYS 177.A SG VAL 156.A O no hydrogen 3.803 N/A CYS 178.A N VAL 156.A O no hydrogen 2.934 N/A CYS 178.A SG LEU 68.A O no hydrogen 3.609 N/A CYS 178.A SG THR 223.A OG1 no hydrogen 3.555 N/A ASN 179.A N LEU 224.A O no hydrogen 3.164 N/A ASN 179.A ND2 TYR 164.A OH no hydrogen 3.145 N/A GLN 180.A NE2 GLU 182.A OE2 no hydrogen 3.237 N/A GLY 181.A N GLY 222.A O no hydrogen 2.686 N/A SER 183.A N ASP 187.A OD2 no hydrogen 2.928 N/A TRP 185.A N SER 183.A OG no hydrogen 3.168 N/A LEU 186.A N SER 183.A OG no hydrogen 3.273 N/A ASP 187.A N SER 183.A O no hydrogen 2.790 N/A ILE 191.A N ASP 187.A O no hydrogen 3.063 N/A GLU 192.A N LEU 188.A O no hydrogen 3.118 N/A LYS 193.A N GLU 189.A O no hydrogen 3.147 N/A MET 194.A N LEU 190.A O no hydrogen 2.809 N/A SER 195.A N ILE 191.A O no hydrogen 2.814 N/A ARG 196.A N GLU 192.A O no hydrogen 2.936 N/A PHE 197.A N LYS 193.A O no hydrogen 2.848 N/A ILE 198.A N MET 194.A O no hydrogen 2.924 N/A ARG 199.A N SER 195.A O no hydrogen 3.259 N/A ARG 199.A NH1 SER 195.A OG no hydrogen 3.081 N/A GLU 200.A N ARG 196.A O no hydrogen 2.883 N/A THR 201.A N PHE 197.A O no hydrogen 2.866 N/A THR 201.A OG1 ILE 198.A O no hydrogen 3.178 N/A GLY 202.A N ILE 198.A O no hydrogen 3.318 N/A PHE 203.A N ILE 198.A O no hydrogen 3.265 N/A ALA 204.A N SER 227.A O no hydrogen 2.818 N/A SER 205.A N SER 227.A O no hydrogen 3.345 N/A SER 205.A OG VAL 232.A O no hydrogen 3.369 N/A GLN 207.A N VAL 225.A O no hydrogen 2.944 N/A GLN 207.A NE2 VAL 206.A O no hydrogen 3.411 N/A GLN 207.A NE2 ASN 272.A O no hydrogen 2.957 N/A TYR 208.A N ASN 272.A OD1 no hydrogen 2.724 N/A TYR 208.A OH GLU 182.A O no hydrogen 2.744 N/A ALA 209.A N THR 223.A O no hydrogen 2.884 N/A LEU 210.A N SER 261.A O no hydrogen 2.835 N/A MET 211.A N ILE 221.A O no hydrogen 2.958 N/A HIS 212.A N TYR 252.A OH no hydrogen 3.065 N/A VAL 213.A N GLY 219.A O no hydrogen 2.955 N/A THR 215.A N ASP 60.A OD2 no hydrogen 3.172 N/A THR 215.A OG1 ASP 60.A OD1 no hydrogen 3.381 N/A THR 215.A OG1 ASP 60.A OD2 no hydrogen 2.563 N/A TYR 216.A N VAL 213.A O no hydrogen 3.077 N/A TYR 216.A OH GLN 55.A O no hydrogen 2.765 N/A GLY 219.A N TYR 216.A O no hydrogen 2.808 N/A ILE 221.A N MET 211.A O no hydrogen 3.286 N/A THR 223.A N ALA 209.A O no hydrogen 3.060 N/A THR 223.A OG1 ASN 179.A O no hydrogen 2.465 N/A LEU 224.A N ASN 179.A OD1 no hydrogen 2.898 N/A VAL 225.A N GLN 207.A O no hydrogen 2.785 N/A CYS 226.A N CYS 177.A O no hydrogen 2.894 N/A CYS 226.A SG LEU 224.A O no hydrogen 3.639 N/A SER 227.A N SER 205.A O no hydrogen 2.985 N/A SER 227.A OG LYS 229.A O no hydrogen 2.589 N/A LYS 228.A N GLY 175.A O no hydrogen 3.097 N/A LYS 228.A NZ LEU 168.A O no hydrogen 2.746 N/A LYS 228.A NZ LEU 171.A O no hydrogen 2.819 N/A LYS 229.A NZ ASP 174.A OD1 no hydrogen 3.272 N/A THR 235.A N ASP 233.A OD1 no hydrogen 3.125 N/A THR 235.A OG1 ASP 233.A OD1 no hydrogen 2.877 N/A THR 235.A OG1 ASP 233.A OD2 no hydrogen 3.524 N/A LEU 238.A N CYS 74.A O no hydrogen 2.816 N/A ARG 239.A N CYS 74.A O no hydrogen 2.855 N/A ARG 239.A NE HIS 76.A O no hydrogen 2.781 N/A ARG 239.A NH2 LEU 73.A O no hydrogen 2.956 N/A ARG 239.A NH2 HIS 99.A ND1 no hydrogen 3.516 N/A ASP 243.A N PRO 240.A O no hydrogen 3.206 N/A MET 244.A N VAL 241.A O no hydrogen 2.912 N/A ASP 249.A N PHE 246.A O no hydrogen 2.889 N/A LEU 250.A N ALA 247.A O no hydrogen 3.312 N/A LYS 251.A N GLU 66.A OE2 no hydrogen 2.856 N/A TYR 252.A N GLU 66.A OE1 no hydrogen 2.782 N/A TYR 253.A N GLU 66.A OE1 no hydrogen 2.819 N/A TYR 253.A OH HIS 258.A ND1 no hydrogen 2.737 N/A SER 255.A N GLU 242.A OE2 no hydrogen 2.872 N/A SER 255.A OG GLU 242.A OE1 no hydrogen 2.564 N/A SER 255.A OG GLU 242.A OE2 no hydrogen 3.535 N/A MET 257.A N ASP 254.A OD1 no hydrogen 2.958 N/A HIS 258.A N ASP 254.A O no hydrogen 2.895 N/A HIS 258.A ND1 TYR 253.A OH no hydrogen 2.737 N/A HIS 258.A NE2 VAL 234.A O no hydrogen 2.886 N/A LYS 259.A N SER 255.A O no hydrogen 3.131 N/A LYS 259.A NZ GLU 256.A OE2 no hydrogen 2.467 N/A ALA 260.A N GLU 256.A O no hydrogen 2.835 N/A SER 261.A N MET 257.A O no hydrogen 2.853 N/A SER 261.A N HIS 258.A O no hydrogen 3.177 N/A SER 261.A OG HIS 258.A O no hydrogen 2.643 N/A PHE 262.A N LYS 259.A O no hydrogen 3.212 N/A ALA 263.A N ALA 260.A O no hydrogen 2.992 N/A ALA 268.A N PRO 265.A O no hydrogen 2.862 N/A ARG 269.A N ARG 266.A O no hydrogen 3.102 N/A ARG 269.A NH1 ARG 266.A O no hydrogen 3.324 N/A HIS 270.A NE2 GLU 192.A OE2 no hydrogen 2.635 N/A ILE 271.A N ALA 268.A O no hydrogen 2.968 N/A ASN 272.A N ARG 269.A O no hydrogen 2.871 N/A ASN 272.A ND2 TYR 208.A O no hydrogen 2.885 N/A ASN 272.A ND2 PHE 262.A O no hydrogen 3.258 N/A ASN 273.A ND2 HIS 270.A O no hydrogen 3.611 N/A