Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4di4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N ASP 1.A O no hydrogen 3.370 N/A THR 5.A OG1 ALA 2.A O no hydrogen 2.985 N/A PHE 8.A N THR 5.A O no hydrogen 3.266 N/A THR 9.A N THR 5.A O no hydrogen 2.961 N/A THR 9.A OG1 THR 5.A O no hydrogen 3.249 N/A THR 9.A OG1 GLU 10.A OE2 no hydrogen 2.825 N/A GLU 10.A N ARG 6.A O no hydrogen 2.972 N/A GLU 11.A N PHE 8.A O no hydrogen 3.215 N/A ASP 13.A N GLU 11.A OE2 no hydrogen 3.010 N/A LEU 16.A N ASP 13.A OD1 no hydrogen 2.954 N/A VAL 17.A N ASP 13.A O no hydrogen 3.230 N/A ALA 18.A N LEU 14.A O no hydrogen 2.965 N/A GLN 19.A N ASP 15.A O no hydrogen 2.813 N/A SER 20.A N LEU 16.A O no hydrogen 3.040 N/A SER 20.A OG LEU 16.A O no hydrogen 3.034 N/A SER 20.A OG VAL 17.A O no hydrogen 3.262 N/A LEU 21.A N VAL 17.A O no hydrogen 3.028 N/A LEU 25.A N LEU 21.A O no hydrogen 3.010 N/A LYS 26.A N PRO 22.A O no hydrogen 3.067 N/A LYS 26.A NZ GLU 29.A OE1 no hydrogen 2.932 N/A VAL 27.A N LEU 23.A O no hydrogen 2.893 N/A TYR 28.A N VAL 24.A O no hydrogen 3.058 N/A GLU 29.A N LEU 25.A O no hydrogen 2.875 N/A ALA 30.A N LYS 26.A O no hydrogen 2.986 N/A LEU 31.A N VAL 27.A O no hydrogen 2.837 N/A HIS 32.A N TYR 28.A O no hydrogen 3.016 N/A LEU 33.A N GLU 29.A O no hydrogen 3.020 N/A LEU 33.A N ALA 30.A O no hydrogen 3.117 N/A GLN 34.A N ALA 30.A O no hydrogen 3.143 N/A ASN 35.A N LEU 31.A O no hydrogen 2.983 N/A HIS 38.A N ASN 35.A O no hydrogen 3.156 N/A ARG 39.A NE SER 93.A O no hydrogen 3.236 N/A LEU 41.A N HIS 38.A ND1 no hydrogen 3.304 N/A SER 42.A N HIS 38.A O no hydrogen 3.103 N/A SER 42.A OG HIS 32.A NE2 no hydrogen 3.006 N/A SER 42.A OG HIS 38.A O no hydrogen 3.513 N/A LEU 43.A N ARG 39.A O no hydrogen 3.164 N/A ALA 44.A N GLY 40.A O no hydrogen 3.051 N/A VAL 45.A N LEU 41.A O no hydrogen 3.006 N/A GLY 46.A N SER 42.A O no hydrogen 3.283 N/A ARG 47.A N LEU 43.A O no hydrogen 2.815 N/A LEU 48.A N ALA 44.A O no hydrogen 3.190 N/A TYR 49.A N VAL 45.A O no hydrogen 2.980 N/A TYR 49.A OH GLU 29.A OE1 no hydrogen 2.836 N/A ILE 50.A N GLY 46.A O no hydrogen 3.107 N/A MET 51.A N ARG 47.A O no hydrogen 3.029 N/A TYR 52.A N LEU 48.A O no hydrogen 2.832 N/A ALA 53.A N TYR 49.A O no hydrogen 2.948 N/A ASN 54.A N ILE 50.A O no hydrogen 3.118 N/A ALA 55.A N MET 51.A O no hydrogen 3.100 N/A PHE 56.A N TYR 52.A O no hydrogen 2.852 N/A VAL 57.A N ALA 53.A O no hydrogen 2.941 N/A GLN 58.A N ALA 53.A O no hydrogen 2.741 N/A THR 59.A N ASN 54.A O no hydrogen 2.880 N/A THR 59.A OG1 ASN 54.A O no hydrogen 2.991 N/A THR 59.A OG1 ASN 54.A OD1 no hydrogen 3.534 N/A ALA 61.A N GLN 58.A O no hydrogen 2.967 N/A GLN 62.A N GLN 58.A O no hydrogen 3.043 N/A GLN 62.A N THR 59.A O no hydrogen 2.913 N/A TYR 63.A N PRO 60.A O no hydrogen 3.184 N/A LEU 64.A N ALA 61.A O no hydrogen 2.970 N/A GLU 68.A N PRO 65.A O no hydrogen 2.697 N/A GLN 72.A N GLU 68.A O no hydrogen 2.809 N/A GLN 72.A NE2 ALA 61.A O no hydrogen 2.827 N/A ASN 73.A N PHE 69.A O no hydrogen 2.854 N/A GLU 74.A N GLU 70.A O no hydrogen 3.061 N/A ALA 75.A N ALA 71.A O no hydrogen 3.138 N/A TYR 76.A N GLN 72.A O no hydrogen 2.952 N/A SER 77.A N ASN 73.A O no hydrogen 2.930 N/A ARG 78.A N GLU 74.A O no hydrogen 2.709 N/A ARG 78.A NH2 TYR 52.A OH no hydrogen 3.541 N/A ALA 79.A N ALA 75.A O no hydrogen 2.876 N/A ARG 80.A N TYR 76.A O no hydrogen 2.875 N/A LYS 81.A N SER 77.A O no hydrogen 3.060 N/A LEU 82.A N ARG 78.A O no hydrogen 3.044 N/A TYR 83.A N ALA 79.A O no hydrogen 2.997 N/A TYR 83.A OH GLN 58.A OE1 no hydrogen 3.320 N/A LEU 84.A N ARG 80.A O no hydrogen 3.186 N/A ARG 85.A N LYS 81.A O no hydrogen 3.135 N/A ARG 85.A NH1 GLU 29.A OE2 no hydrogen 3.506 N/A GLY 86.A N LEU 82.A O no hydrogen 2.962 N/A ALA 87.A N TYR 83.A O no hydrogen 3.004 N/A ARG 88.A N LEU 84.A O no hydrogen 2.973 N/A TYR 89.A N ARG 85.A O no hydrogen 3.076 N/A TYR 89.A OH GLU 29.A OE2 no hydrogen 2.323 N/A ALA 90.A N GLY 86.A O no hydrogen 3.236 N/A LEU 91.A N ALA 87.A O no hydrogen 3.043 N/A SER 92.A N ARG 88.A O no hydrogen 2.944 N/A SER 92.A OG ARG 88.A O no hydrogen 3.341 N/A SER 92.A OG TYR 89.A O no hydrogen 2.579 N/A SER 93.A N ALA 90.A O no hydrogen 3.095 N/A GLU 95.A N LEU 91.A O no hydrogen 2.942 N/A THR 96.A N SER 92.A O no hydrogen 3.079 N/A THR 96.A N SER 93.A O no hydrogen 3.210 N/A THR 96.A OG1 SER 92.A O no hydrogen 3.280 N/A ALA 97.A N SER 93.A O no hydrogen 3.140 N/A TYR 98.A N LEU 94.A O no hydrogen 2.731 N/A TYR 98.A OH ASP 124.A OD2 no hydrogen 2.876 N/A GLY 100.A N GLU 95.A OE2 no hydrogen 3.048 N/A PHE 101.A N TYR 98.A O no hydrogen 2.918 N/A THR 102.A N GLU 95.A OE1 no hydrogen 2.678 N/A THR 102.A OG1 GLU 95.A OE1 no hydrogen 3.158 N/A GLU 104.A N GLY 100.A O no hydrogen 3.240 N/A GLU 104.A N PHE 101.A O no hydrogen 3.012 N/A VAL 105.A N PHE 101.A O no hydrogen 2.939 N/A PHE 106.A N THR 102.A O no hydrogen 3.107 N/A SER 107.A N GLU 104.A O no hydrogen 2.891 N/A SER 107.A OG GLU 104.A O no hydrogen 2.569 N/A SER 107.A OG ASP 109.A O no hydrogen 3.272 N/A ASP 109.A N SER 107.A OG no hydrogen 2.982 N/A GLN 111.A N ASP 109.A OD1 no hydrogen 2.891 N/A ARG 112.A N ASP 109.A OD1 no hydrogen 3.320 N/A ARG 112.A NE GLU 104.A OE1 no hydrogen 3.263 N/A ARG 112.A NE GLU 104.A OE2 no hydrogen 3.058 N/A ARG 112.A NH2 GLU 104.A OE2 no hydrogen 2.848 N/A LEU 113.A N ASP 109.A O no hydrogen 2.860 N/A HIS 114.A N GLU 110.A O no hydrogen 2.888 N/A HIS 114.A ND1 GLU 110.A O no hydrogen 3.205 N/A LYS 115.A N GLN 111.A O no hydrogen 2.703 N/A VAL 116.A N ARG 112.A O no hydrogen 3.108 N/A LEU 117.A N LEU 113.A O no hydrogen 3.115 N/A SER 118.A N HIS 114.A O no hydrogen 2.758 N/A SER 118.A OG LYS 115.A O no hydrogen 2.260 N/A CYS 120.A N LEU 117.A O no hydrogen 3.197 N/A CYS 120.A SG VAL 116.A O no hydrogen 4.012 N/A THR 121.A N ASP 124.A OD2 no hydrogen 2.814 N/A VAL 123.A N THR 121.A OG1 no hydrogen 3.397 N/A ASP 124.A N THR 121.A O no hydrogen 2.781 N/A LEU 128.A N ASP 124.A O no hydrogen 2.833 N/A TYR 129.A N VAL 125.A O no hydrogen 2.847 N/A TRP 130.A N GLY 126.A O no hydrogen 3.156 N/A VAL 131.A N THR 127.A O no hydrogen 3.071 N/A GLY 132.A N LEU 128.A O no hydrogen 2.833 N/A THR 133.A N TYR 129.A O no hydrogen 2.729 N/A THR 133.A OG1 TYR 129.A O no hydrogen 2.874 N/A GLY 134.A N TRP 130.A O no hydrogen 2.839 N/A TYR 135.A N VAL 131.A O no hydrogen 3.134 N/A VAL 136.A N GLY 132.A O no hydrogen 3.129 N/A ALA 137.A N THR 133.A O no hydrogen 2.952 N/A ALA 138.A N GLY 134.A O no hydrogen 3.098 N/A PHE 139.A N TYR 135.A O no hydrogen 2.774 N/A ALA 140.A N VAL 136.A O no hydrogen 3.142 N/A ALA 140.A N ALA 137.A O no hydrogen 3.153 N/A LEU 141.A N ALA 138.A O no hydrogen 2.936 N/A THR 142.A N PHE 139.A O no hydrogen 3.127 N/A THR 142.A OG1 ALA 138.A O no hydrogen 2.625 N/A SER 146.A N PRO 143.A O no hydrogen 2.793 N/A THR 151.A N LEU 148.A O no hydrogen 2.913 N/A VAL 152.A N LEU 148.A O no hydrogen 3.273 N/A HIS 153.A N PRO 149.A O no hydrogen 2.999 N/A ALA 154.A N ASP 150.A O no hydrogen 2.868 N/A ALA 155.A N THR 151.A O no hydrogen 2.997 N/A VAL 156.A N VAL 152.A O no hydrogen 2.875 N/A MET 157.A N HIS 153.A O no hydrogen 2.849 N/A MET 158.A N ALA 154.A O no hydrogen 2.948 N/A LEU 159.A N ALA 155.A O no hydrogen 3.248 N/A GLU 160.A N VAL 156.A O no hydrogen 2.917 N/A ARG 161.A N MET 157.A O no hydrogen 2.849 N/A ARG 161.A NH2 CYS 120.A O no hydrogen 3.442 N/A ALA 162.A N MET 158.A O no hydrogen 2.985 N/A CYS 163.A N LEU 159.A O no hydrogen 3.026 N/A CYS 163.A SG LEU 159.A O no hydrogen 3.557 N/A ASP 164.A N GLU 160.A O no hydrogen 3.146 N/A LEU 165.A N ARG 161.A O no hydrogen 3.002 N/A TRP 166.A N ALA 162.A O no hydrogen 2.833 N/A TYR 169.A N TRP 166.A O no hydrogen 2.842 N/A GLY 172.A N TYR 169.A O no hydrogen 2.844 N/A ALA 173.A N GLN 170.A O no hydrogen 2.947 N/A TRP 175.A N GLY 172.A O no hydrogen 2.794 N/A TRP 175.A NE1 PRO 167.A O no hydrogen 2.956 N/A VAL 177.A N ALA 173.A O no hydrogen 3.450 N/A LEU 178.A N VAL 174.A O no hydrogen 3.074 N/A THR 179.A N TRP 175.A O no hydrogen 2.698 N/A THR 179.A OG1 TRP 175.A O no hydrogen 2.931 N/A LYS 180.A N ASN 176.A O no hydrogen 3.185 N/A PHE 181.A N VAL 177.A O no hydrogen 3.048 N/A TYR 182.A N LEU 178.A O no hydrogen 3.009 N/A TYR 182.A OH GLU 160.A OE2 no hydrogen 2.578 N/A ALA 183.A N THR 179.A O no hydrogen 3.264 N/A ALA 184.A N LYS 180.A O no hydrogen 3.303 N/A ALA 184.A N PHE 181.A O no hydrogen 3.281 N/A PHE 189.A N PRO 186.A O no hydrogen 2.747 N/A GLY 191.A N PRO 186.A O no hydrogen 3.137 N/A GLY 192.A N TYR 182.A O no hydrogen 2.640 N/A LYS 195.A NZ GLY 190.A O no hydrogen 3.299 N/A ALA 196.A N GLY 192.A O no hydrogen 3.234 N/A HIS 197.A N MET 193.A O no hydrogen 2.894 N/A HIS 197.A ND1 MET 193.A O no hydrogen 2.695 N/A THR 198.A N GLU 194.A O no hydrogen 3.032 N/A THR 198.A OG1 GLU 194.A O no hydrogen 3.403 N/A ALA 199.A N LYS 195.A O no hydrogen 2.923 N/A PHE 200.A N ALA 196.A O no hydrogen 3.046 N/A GLU 201.A N HIS 197.A O no hydrogen 2.914 N/A HIS 202.A N THR 198.A O no hydrogen 3.276 N/A LEU 203.A N ALA 199.A O no hydrogen 2.960 N/A THR 204.A N PHE 200.A O no hydrogen 2.909 N/A THR 204.A OG1 PHE 200.A O no hydrogen 3.298 N/A THR 204.A OG1 GLU 201.A O no hydrogen 2.831 N/A ARG 205.A N GLU 201.A O no hydrogen 3.281 N/A ARG 205.A N HIS 202.A O no hydrogen 2.750 N/A ARG 205.A NH2 GLU 201.A OE1 no hydrogen 2.859 N/A TYR 206.A N HIS 202.A O no hydrogen 3.343 N/A TYR 206.A N LEU 203.A O no hydrogen 3.115 N/A CYS 207.A N LEU 203.A O no hydrogen 2.926 N/A CYS 207.A SG SER 208.A O no hydrogen 3.980 N/A HIS 210.A N SER 208.A OG no hydrogen 2.890 N/A ASP 211.A N SER 208.A O no hydrogen 3.396 N/A ASP 213.A N ASP 211.A OD1 no hydrogen 2.683 N/A ILE 216.A N PRO 212.A O no hydrogen 3.113 N/A THR 217.A N ASP 213.A O no hydrogen 2.689 N/A THR 217.A OG1 ASN 176.A OD1 no hydrogen 2.722 N/A THR 217.A OG1 ASP 213.A O no hydrogen 3.079 N/A TYR 218.A N HIS 214.A O no hydrogen 3.019 N/A ALA 219.A N HIS 215.A O no hydrogen 2.895 N/A ASP 220.A N ILE 216.A O no hydrogen 3.022 N/A ALA 221.A N THR 217.A O no hydrogen 2.892 N/A LEU 222.A N TYR 218.A O no hydrogen 3.351 N/A CYS 223.A N TYR 218.A O no hydrogen 3.158 N/A CYS 223.A SG TYR 218.A O no hydrogen 3.619 N/A ILE 224.A N ALA 219.A O no hydrogen 3.108 N/A LEU 226.A N LEU 222.A O no hydrogen 3.181 N/A ASN 227.A N ILE 224.A O no hydrogen 2.593 N/A ASN 227.A ND2 ASN 227.A O no hydrogen 2.305 N/A ASN 228.A N CYS 223.A O no hydrogen 2.582 N/A GLY 231.A N ASN 228.A OD1 no hydrogen 2.835 N/A PHE 232.A N ASN 228.A O no hydrogen 3.081 N/A ASP 233.A N ARG 229.A O no hydrogen 2.559 N/A GLU 234.A N ALA 230.A O no hydrogen 2.811 N/A ALA 235.A N GLY 231.A O no hydrogen 2.965 N/A LEU 236.A N PHE 232.A O no hydrogen 3.366 N/A ASP 237.A N ASP 233.A O no hydrogen 3.126 N/A ARG 238.A N GLU 234.A O no hydrogen 3.038 N/A ARG 238.A NE HIS 215.A ND1 no hydrogen 3.485 N/A ALA 239.A N ALA 235.A O no hydrogen 2.893 N/A LEU 240.A N LEU 236.A O no hydrogen 2.820 N/A ALA 241.A N ARG 238.A O no hydrogen 3.147 N/A GLU 245.A N ASP 243.A OD1 no hydrogen 2.707 N/A SER 246.A N ASP 243.A O no hydrogen 2.973 N/A VAL 247.A N PRO 244.A O no hydrogen 3.392 N/A ASN 250.A N GLU 10.A OE2 no hydrogen 2.414 N/A LYS 251.A N GLU 10.A OE1 no hydrogen 3.432 N/A LEU 252.A N THR 9.A O no hydrogen 2.932 N/A VAL 254.A N ASN 250.A O no hydrogen 3.188 N/A ILE 255.A N LYS 251.A O no hydrogen 2.854 N/A LEU 256.A N LEU 252.A O no hydrogen 2.847 N/A SER 257.A N LEU 253.A O no hydrogen 2.930 N/A SER 257.A OG ASP 213.A OD2 no hydrogen 2.772 N/A SER 257.A OG LEU 253.A O no hydrogen 3.335 N/A GLN 258.A N VAL 254.A O no hydrogen 2.836 N/A GLN 258.A NE2 ALA 239.A O no hydrogen 3.163 N/A GLN 258.A NE2 ILE 242.A O no hydrogen 2.722 N/A LYS 259.A N ILE 255.A O no hydrogen 3.055 N/A ARG 260.A N LEU 256.A O no hydrogen 3.212 N/A ALA 261.A N SER 257.A O no hydrogen 3.023 N/A ARG 262.A N GLN 258.A O no hydrogen 2.913 N/A TRP 263.A N LYS 259.A O no hydrogen 3.174 N/A LEU 264.A N ARG 260.A O no hydrogen 2.754 N/A LYS 265.A N ALA 261.A O no hydrogen 2.921 N/A LYS 265.A NZ ASP 233.A O no hydrogen 3.308 N/A LYS 265.A NZ ASP 237.A OD1 no hydrogen 2.907 N/A ALA 266.A N ARG 262.A O no hydrogen 3.005 N/A HIS 267.A N TRP 263.A O no hydrogen 3.103 N/A HIS 267.A ND1 TRP 263.A O no hydrogen 3.085 N/A VAL 268.A N LYS 265.A O no hydrogen 3.403 N/A ASP 270.A N HIS 267.A O no hydrogen 2.577 N/A PHE 271.A N VAL 268.A O no hydrogen 3.047 N/A PHE 272.A N VAL 268.A O no hydrogen 3.106 N/A