Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mfz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N SER 5.A OG no hydrogen 3.172 N/A ALA 3.A N GLU 24.A OE2 no hydrogen 2.767 N/A SER 5.A N ASP 2.A OD1 no hydrogen 3.056 N/A SER 5.A OG ASP 2.A O no hydrogen 3.351 N/A SER 5.A OG ASP 2.A OD1 no hydrogen 3.089 N/A VAL 6.A N ASP 2.A O no hydrogen 2.976 N/A ARG 7.A N ALA 3.A O no hydrogen 2.967 N/A ARG 7.A NE LEU 12.A O no hydrogen 3.053 N/A ARG 8.A N GLU 4.A O no hydrogen 3.160 N/A ARG 8.A NH2 GLU 4.A OE1 no hydrogen 3.056 N/A GLN 9.A N SER 5.A O no hydrogen 2.895 N/A LEU 10.A N VAL 6.A O no hydrogen 3.107 N/A LEU 12.A N ARG 7.A O no hydrogen 3.090 N/A ALA 16.A N GLY 13.A O no hydrogen 3.108 N/A THR 17.A N GLU 14.A O no hydrogen 3.202 N/A THR 17.A OG1 GLU 14.A O no hydrogen 2.763 N/A TRP 19.A NE1 GLU 81.A OE1 no hydrogen 2.852 N/A LEU 20.A N ALA 16.A O no hydrogen 2.953 N/A SER 21.A N THR 17.A O no hydrogen 2.869 N/A ARG 22.A N ALA 18.A O no hydrogen 3.105 N/A LEU 23.A N TRP 19.A O no hydrogen 3.037 N/A GLU 24.A N LEU 20.A O no hydrogen 2.841 N/A GLU 25.A N SER 21.A O no hydrogen 3.127 N/A LEU 26.A N ARG 22.A O no hydrogen 3.027 N/A GLY 27.A N LEU 23.A O no hydrogen 3.141 N/A ARG 34.A NH1 GLU 40.A OE2 no hydrogen 2.992 N/A ARG 34.A NH2 GLU 40.A OE1 no hydrogen 2.708 N/A ARG 34.A NH2 GLU 40.A OE2 no hydrogen 3.320 N/A GLN 37.A NE2 LEU 35.A O no hydrogen 3.629 N/A ALA 41.A N GLN 37.A O no hydrogen 3.208 N/A ARG 42.A N GLY 38.A O no hydrogen 3.156 N/A ARG 42.A NE GLU 56.A OE1 no hydrogen 3.242 N/A ARG 42.A NE GLU 56.A OE2 no hydrogen 3.335 N/A ARG 42.A NH1 ASP 39.A OD1 no hydrogen 2.953 N/A ARG 42.A NH2 GLU 56.A OE1 no hydrogen 3.049 N/A ASP 43.A N ASP 39.A O no hydrogen 3.020 N/A LEU 44.A N GLU 40.A O no hydrogen 3.005 N/A LEU 45.A N ALA 41.A O no hydrogen 2.822 N/A HIS 46.A N ARG 42.A O no hydrogen 2.886 N/A ARG 47.A N ASP 43.A O no hydrogen 3.075 N/A LEU 48.A N LEU 44.A O no hydrogen 2.909 N/A GLU 49.A N HIS 46.A O no hydrogen 2.864 N/A VAL 50.A N LEU 45.A O no hydrogen 2.988 N/A ASP 54.A N PRO 51.A O no hydrogen 3.107 N/A VAL 55.A N PRO 51.A O no hydrogen 3.101 N/A GLU 56.A N ALA 52.A O no hydrogen 3.462 N/A GLU 57.A N PRO 53.A O no hydrogen 3.508 N/A ILE 58.A N ASP 54.A O no hydrogen 2.770 N/A VAL 59.A N VAL 55.A O no hydrogen 2.839 N/A ALA 60.A N GLU 56.A O no hydrogen 2.910 N/A ALA 61.A N GLU 57.A O no hydrogen 2.973 N/A THR 62.A N VAL 59.A O no hydrogen 3.331 N/A THR 62.A OG1 ILE 58.A O no hydrogen 3.206 N/A THR 62.A OG1 VAL 59.A O no hydrogen 2.883 N/A GLY 64.A N ASP 68.A OD1 no hydrogen 2.967 N/A ARG 67.A NH2 THR 62.A O no hydrogen 3.071 N/A ASP 68.A N GLY 64.A O no hydrogen 2.910 N/A TRP 72.A N ASP 68.A O no hydrogen 2.836 N/A TRP 72.A NE1 GLU 76.A OE2 no hydrogen 3.127 N/A TRP 73.A N PRO 69.A O no hydrogen 3.116 N/A LEU 74.A N ALA 70.A O no hydrogen 3.144 N/A LEU 75.A N LEU 71.A O.A no hydrogen 2.817 N/A LEU 75.A N LEU 71.A O.B no hydrogen 2.809 N/A GLU 76.A N TRP 72.A O no hydrogen 3.011 N/A ARG 77.A N TRP 73.A O no hydrogen 3.220 N/A ARG 77.A NH1 TRP 73.A O no hydrogen 3.080 N/A ARG 77.A NH1 GLU 76.A OE1 no hydrogen 2.953 N/A ALA 78.A N LEU 74.A O no hydrogen 2.807 N/A HIS 79.A N LEU 75.A O no hydrogen 2.856 N/A HIS 79.A ND1 THR 118.A OG1 no hydrogen 2.806 N/A HIS 80.A N GLU 76.A O no hydrogen 3.067 N/A HIS 80.A ND1 GLY 27.A O no hydrogen 2.882 N/A GLU 81.A N ARG 77.A O no hydrogen 2.982 N/A LEU 82.A N ALA 78.A O no hydrogen 3.314 N/A VAL 83.A N HIS 79.A O no hydrogen 3.102 N/A ARG 84.A N HIS 80.A O no hydrogen 3.062 N/A MET 86.A N VAL 83.A O no hydrogen 3.368 N/A GLY 87.A N ARG 170.A O no hydrogen 2.729 N/A ASP 88.A N HIS 85.A O no hydrogen 3.136 N/A LYS 90.A N ASP 88.A OD1 no hydrogen 2.932 N/A VAL 91.A N ASP 88.A O no hydrogen 3.442 N/A TYR 101.A OH HIS 150.A NE2 no hydrogen 2.985 N/A GLU 102.A N GLU 102.A OE2 no hydrogen 2.674 N/A THR 103.A OG1 GLN 9.A O no hydrogen 3.452 N/A GLY 104.A N TYR 101.A O no hydrogen 3.064 N/A ALA 107.A N GLY 104.A O no hydrogen 3.228 N/A ARG 108.A N GLY 104.A O no hydrogen 3.273 N/A ARG 108.A NH1 GLU 156.A OE1 no hydrogen 3.044 N/A ARG 108.A NH1 GLY 157.A O no hydrogen 2.906 N/A TYR 109.A N ALA 105.A O no hydrogen 2.914 N/A TYR 109.A OH ASP 54.A OD1 no hydrogen 2.735 N/A TYR 109.A OH GLU 57.A OE1 no hydrogen 2.616 N/A PHE 110.A N ALA 107.A O no hydrogen 3.118 N/A HIS 111.A NE2 PRO 97.A O no hydrogen 2.976 N/A VAL 112.A N TYR 109.A O no hydrogen 2.878 N/A TYR 113.A N TYR 109.A O no hydrogen 3.291 N/A TYR 113.A OH ILE 58.A O no hydrogen 2.631 N/A VAL 114.A N PHE 110.A O no hydrogen 2.980 N/A PHE 115.A N HIS 111.A O no hydrogen 2.858 N/A LEU 116.A N VAL 112.A O no hydrogen 2.856 N/A ALA 117.A N TYR 113.A O no hydrogen 2.920 N/A THR 118.A N VAL 114.A O no hydrogen 3.110 N/A THR 118.A N PHE 115.A O no hydrogen 3.105 N/A THR 118.A OG1 HIS 79.A ND1 no hydrogen 2.806 N/A THR 118.A OG1 VAL 114.A O no hydrogen 2.741 N/A LEU 119.A N LEU 116.A O no hydrogen 3.291 N/A LEU 122.A N THR 118.A O no hydrogen 2.877 N/A ARG 123.A N LEU 119.A O no hydrogen 2.856 N/A ARG 123.A NH1 GLU 133.A OE2 no hydrogen 3.289 N/A ARG 123.A NH2 GLU 133.A OE2 no hydrogen 2.791 N/A ARG 124.A N PRO 120.A O no hydrogen 2.832 N/A PHE 125.A N ALA 121.A O no hydrogen 2.914 N/A HIS 126.A N LEU 122.A O no hydrogen 2.897 N/A HIS 126.A ND1 THR 136.A OG1 no hydrogen 2.687 N/A ALA 127.A N ARG 123.A O no hydrogen 2.964 N/A THR 128.A N ARG 124.A O no hydrogen 3.118 N/A THR 128.A OG1 PHE 125.A O no hydrogen 2.871 N/A ARG 129.A N PHE 125.A O no hydrogen 3.224 N/A ARG 129.A N HIS 126.A O no hydrogen 3.016 N/A ARG 129.A NH1 HIS 223.A O no hydrogen 2.887 N/A ARG 129.A NH1 GLU 226.A OE2 no hydrogen 2.552 N/A ASP 130.A N ALA 127.A O no hydrogen 2.936 N/A ILE 131.A N HIS 126.A O no hydrogen 3.065 N/A THR 136.A N PRO 132.A O no hydrogen 3.232 N/A THR 136.A OG1 HIS 126.A ND1 no hydrogen 2.687 N/A TRP 137.A N GLU 133.A O no hydrogen 3.051 N/A TRP 137.A NE1 GLU 133.A OE2 no hydrogen 3.191 N/A GLU 138.A N ALA 134.A O no hydrogen 2.986 N/A THR 139.A N THR 135.A O no hydrogen 2.889 N/A THR 139.A OG1 THR 135.A O no hydrogen 2.629 N/A LEU 140.A N THR 136.A O no hydrogen 2.897 N/A THR 141.A N TRP 137.A O no hydrogen 3.348 N/A THR 141.A OG1 GLU 138.A O no hydrogen 2.927 N/A GLN 142.A N THR 139.A O no hydrogen 3.221 N/A GLN 142.A NE2 SER 146.A OG no hydrogen 3.241 N/A LEU 143.A N LEU 140.A O no hydrogen 3.050 N/A GLY 144.A N LEU 48.A O no hydrogen 3.044 N/A GLU 145.A N THR 141.A O no hydrogen 3.436 N/A SER 146.A N GLN 142.A O no hydrogen 2.919 N/A SER 146.A OG GLN 142.A O no hydrogen 3.167 N/A VAL 147.A N LEU 143.A O no hydrogen 3.130 N/A ALA 148.A N GLY 144.A O no hydrogen 2.827 N/A ILE 149.A N GLU 145.A O no hydrogen 2.822 N/A HIS 150.A N SER 146.A O no hydrogen 3.249 N/A HIS 150.A ND1 GLU 156.A O no hydrogen 2.868 N/A ARG 151.A N VAL 147.A O no hydrogen 3.140 N/A ARG 151.A NE ASP 54.A OD1 no hydrogen 3.267 N/A ARG 151.A NE ASP 54.A OD2 no hydrogen 2.880 N/A ARG 151.A NH2 ASP 54.A OD1 no hydrogen 2.995 N/A ARG 152.A N ALA 148.A O no hydrogen 2.925 N/A LYS 153.A N ILE 149.A O no hydrogen 2.811 N/A LYS 153.A NZ GLU 276.A OE1 no hydrogen 2.854 N/A TYR 154.A N HIS 150.A O no hydrogen 2.903 N/A GLY 155.A N ARG 151.A O no hydrogen 2.877 N/A ASN 160.A N SER 146.A O no hydrogen 3.013 N/A TRP 164.A N MET 161.A O no hydrogen 3.034 N/A THR 166.A N PRO 162.A O no hydrogen 2.877 N/A THR 166.A OG1 PRO 162.A O no hydrogen 3.000 N/A LEU 167.A N TRP 163.A O no hydrogen 3.059 N/A LEU 168.A N TRP 164.A O no hydrogen 2.946 N/A VAL 169.A N LEU 165.A O no hydrogen 2.843 N/A ARG 170.A N THR 166.A O no hydrogen 3.017 N/A ARG 170.A NE HIS 85.A O no hydrogen 3.427 N/A ARG 170.A NH2 HIS 85.A O no hydrogen 2.920 N/A ARG 170.A NH2 ASP 88.A O no hydrogen 2.826 N/A ARG 170.A NH2 VAL 91.A O no hydrogen 3.519 N/A GLY 171.A N LEU 168.A O no hydrogen 2.979 N/A LEU 172.A N LEU 167.A O no hydrogen 3.225 N/A TYR 174.A N TYR 181.A O no hydrogen 2.938 N/A TYR 174.A OH HIS 126.A NE2 no hydrogen 3.278 N/A TYR 174.A OH GLY 171.A O no hydrogen 2.685 N/A ARG 175.A N THR 139.A OG1 no hydrogen 2.990 N/A ARG 175.A NE GLY 177.A O no hydrogen 2.803 N/A ARG 175.A NH1 VAL 200.A O no hydrogen 3.257 N/A ARG 175.A NH2 VAL 200.A O no hydrogen 2.918 N/A LEU 176.A N LEU 179.A O no hydrogen 2.794 N/A ARG 178.A NE GLY 202.A O no hydrogen 2.961 N/A ARG 178.A NH1 ARG 178.A O no hydrogen 2.968 N/A ARG 178.A NH1 PRO 198.A O no hydrogen 2.744 N/A ARG 178.A NH2 PRO 198.A O no hydrogen 2.840 N/A ARG 178.A NH2 GLY 202.A O no hydrogen 2.958 N/A LEU 179.A N LEU 176.A O no hydrogen 3.400 N/A GLN 180.A N HIS 196.A O no hydrogen 2.951 N/A GLN 180.A NE2 GLN 142.A OE1 no hydrogen 2.809 N/A TYR 181.A N TYR 174.A O no hydrogen 2.895 N/A TYR 181.A OH SER 212.A OG no hydrogen 2.809 N/A ASN 182.A N GLY 194.A O no hydrogen 2.794 N/A LEU 183.A N LEU 172.A O no hydrogen 3.097 N/A ALA 184.A N VAL 192.A O no hydrogen 2.890 N/A ALA 186.A N THR 190.A O no hydrogen 3.017 N/A GLY 189.A N ALA 186.A O no hydrogen 3.017 N/A THR 190.A N ASP 188.A OD1 no hydrogen 3.059 N/A THR 190.A OG1 ASP 188.A OD1 no hydrogen 2.603 N/A VAL 192.A N ALA 184.A O no hydrogen 3.061 N/A LEU 193.A N ALA 231.A O no hydrogen 3.102 N/A GLY 194.A N ASN 182.A O no hydrogen 2.829 N/A LEU 195.A N THR 233.A O no hydrogen 2.965 N/A HIS 196.A N GLN 180.A O no hydrogen 2.942 N/A GLU 199.A N GLU 145.A OE2 no hydrogen 2.964 N/A VAL 200.A N GLU 145.A OE1 no hydrogen 2.930 N/A ILE 205.A N PRO 203.A O no hydrogen 2.933 N/A ILE 208.A N ILE 205.A O no hydrogen 3.058 N/A TYR 209.A N ILE 205.A O no hydrogen 3.090 N/A TYR 210.A N PRO 206.A O no hydrogen 2.862 N/A ASP 211.A N ASP 207.A O no hydrogen 3.083 N/A SER 212.A N ILE 208.A O no hydrogen 3.332 N/A SER 212.A OG LEU 176.A O no hydrogen 2.591 N/A SER 212.A OG TYR 181.A OH no hydrogen 2.809 N/A LEU 213.A N TYR 209.A O no hydrogen 2.981 N/A ARG 214.A N TYR 210.A O no hydrogen 2.909 N/A ARG 215.A N SER 212.A O no hydrogen 2.995 N/A ALA 216.A N LEU 213.A O no hydrogen 3.349 N/A ARG 217.A NH1 LEU 318.A O no hydrogen 2.732 N/A PHE 219.A N ARG 215.A O no hydrogen 2.981 N/A PHE 220.A N ALA 216.A O no hydrogen 3.039 N/A GLU 221.A N ARG 217.A O no hydrogen 3.083 N/A ARG 222.A N PRO 218.A O no hydrogen 2.937 N/A HIS 223.A N PHE 219.A O no hydrogen 2.945 N/A HIS 223.A ND1 ARG 129.A O no hydrogen 2.715 N/A PHE 224.A N PHE 220.A O no hydrogen 2.744 N/A HIS 227.A N PHE 224.A O no hydrogen 2.913 N/A HIS 227.A NE2 VAL 192.A O no hydrogen 3.253 N/A ALA 232.A N ILE 316.A O no hydrogen 3.026 N/A THR 233.A N LEU 193.A O no hydrogen 2.922 N/A GLY 234.A N GLY 314.A O no hydrogen 3.242 N/A THR 235.A OG1 SER 313.A OG no hydrogen 2.572 N/A SER 236.A N ARG 312.A O no hydrogen 2.838 N/A LEU 238.A N SER 236.A OG no hydrogen 3.141 N/A LEU 239.A N SER 236.A O no hydrogen 3.282 N/A ASP 240.A N TRP 237.A O no hydrogen 3.180 N/A GLN 242.A N ASP 240.A OD1 no hydrogen 2.988 N/A LEU 243.A N ASP 240.A O no hydrogen 3.167 N/A ALA 244.A N PRO 241.A O no hydrogen 3.044 N/A GLU 245.A N GLN 242.A O no hydrogen 2.970 N/A TYR 246.A N LEU 243.A O no hydrogen 3.036 N/A LEU 247.A N LEU 243.A O no hydrogen 2.986 N/A SER 251.A N ALA 248.A O no hydrogen 2.964 N/A LEU 254.A N SER 251.A OG no hydrogen 3.004 N/A GLN 255.A N SER 251.A O no hydrogen 3.011 N/A LEU 256.A N HIS 252.A O no hydrogen 2.861 N/A ARG 257.A N ILE 253.A O no hydrogen 3.040 N/A ARG 257.A NH1 LEU 238.A O no hydrogen 3.049 N/A ARG 257.A NH1 ASP 240.A O no hydrogen 2.772 N/A ARG 257.A NH2 ASP 240.A O no hydrogen 3.358 N/A ARG 257.A NH2 PRO 241.A O no hydrogen 3.363 N/A ARG 258.A N GLN 255.A O no hydrogen 3.340 N/A GLY 259.A N LEU 256.A O no hydrogen 3.272 N/A TRP 260.A N ARG 257.A O no hydrogen 2.858 N/A TRP 260.A NE1 TYR 209.A OH no hydrogen 2.911 N/A THR 261.A N ARG 315.A O no hydrogen 2.883 N/A LEU 263.A N SER 313.A O no hydrogen 2.952 N/A GLY 270.A N TRP 309.A O no hydrogen 2.726 N/A ILE 274.A N GLY 270.A O no hydrogen 2.932 N/A LEU 275.A N ASP 271.A O no hydrogen 3.088 N/A GLU 276.A N ASP 272.A O no hydrogen 2.807 N/A PHE 277.A N ALA 273.A O no hydrogen 2.953 N/A VAL 278.A N ILE 274.A O no hydrogen 2.821 N/A PHE 279.A N LEU 275.A O no hydrogen 3.017 N/A ARG 280.A N GLU 276.A O no hydrogen 2.737 N/A ARG 280.A NH1 GLU 276.A OE2 no hydrogen 2.801 N/A ARG 280.A NH2 GLU 199.A OE1 no hydrogen 2.665 N/A TYR 281.A N LEU 275.A O no hydrogen 3.190 N/A TYR 281.A OH GLN 284.A O no hydrogen 2.571 N/A ASN 282.A N GLN 284.A OE1 no hydrogen 2.754 N/A GLU 287.A N GLU 287.A OE1 no hydrogen 2.653 N/A GLU 288.A N PRO 285.A O no hydrogen 2.910 N/A LEU 289.A N LEU 286.A O no hydrogen 3.156 N/A SER 293.A N GLU 296.A OE1 no hydrogen 2.866 N/A GLU 296.A N SER 293.A OG no hydrogen 3.080 N/A LYS 297.A N SER 293.A O no hydrogen 3.114 N/A ALA 298.A N THR 294.A O no hydrogen 2.977 N/A VAL 299.A N LEU 295.A O no hydrogen 2.811 N/A VAL 300.A N GLU 296.A O no hydrogen 3.279 N/A THR 301.A N LYS 297.A O no hydrogen 2.839 N/A THR 301.A OG1 ALA 298.A O no hydrogen 3.527 N/A HIS 302.A N ALA 298.A O no hydrogen 2.997 N/A LEU 303.A N VAL 299.A O no hydrogen 3.117 N/A LEU 304.A N VAL 300.A O no hydrogen 2.779 N/A ALA 305.A N THR 301.A O no hydrogen 2.930 N/A GLY 306.A N LEU 303.A O no hydrogen 2.990 N/A ARG 307.A N HIS 302.A O no hydrogen 3.086 N/A ARG 307.A NH1 GLU 245.A OE1 no hydrogen 3.274 N/A ARG 307.A NH1 GLU 245.A OE2 no hydrogen 3.491 N/A ARG 307.A NH2 GLU 245.A OE1 no hydrogen 2.734 N/A TRP 309.A N ASP 271.A OD1 no hydrogen 2.763 N/A TYR 310.A N ASP 240.A OD2 no hydrogen 2.777 N/A GLN 311.A N GLN 268.A O no hydrogen 2.983 N/A ARG 312.A N SER 236.A O no hydrogen 3.021 N/A ARG 312.A NH1 LEU 263.A O no hydrogen 3.191 N/A SER 313.A OG THR 235.A OG1 no hydrogen 2.572 N/A SER 313.A OG GLN 268.A OE1 no hydrogen 3.202 N/A GLY 314.A N GLY 234.A O no hydrogen 2.789 N/A ARG 315.A N THR 261.A O no hydrogen 3.029 N/A ILE 316.A N ALA 232.A O no hydrogen 2.909 N/A LEU 318.A N ARG 230.A O no hydrogen 2.736 N/A