Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1r5k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N LEU 1.A O no hydrogen 3.094 N/A SER 4.A OG LEU 1.A O no hydrogen 2.894 N/A THR 6.A N GLN 9.A OE1 no hydrogen 2.826 N/A GLN 9.A N THR 6.A OG1 no hydrogen 3.263 N/A MET 10.A N THR 6.A O no hydrogen 2.782 N/A VAL 11.A N ALA 7.A O no hydrogen 3.087 N/A SER 12.A N ASP 8.A O no hydrogen 3.056 N/A ALA 13.A N GLN 9.A O no hydrogen 3.103 N/A LEU 14.A N MET 10.A O no hydrogen 3.082 N/A LEU 15.A N VAL 11.A O no hydrogen 2.909 N/A ASP 16.A N SER 12.A O no hydrogen 2.919 N/A ALA 17.A N LEU 14.A O no hydrogen 3.026 N/A SER 24.A N ASN 98.A OD1 no hydrogen 2.890 N/A SER 24.A OG TYR 26.A O no hydrogen 2.737 N/A TYR 26.A N SER 24.A OG no hydrogen 3.326 N/A SER 32.A OG SER 29.A O no hydrogen 3.358 N/A MET 33.A N SER 29.A O no hydrogen 3.287 N/A MET 34.A N GLU 30.A O no hydrogen 3.294 N/A GLY 35.A N ALA 31.A O no hydrogen 2.966 N/A LEU 36.A N SER 32.A O no hydrogen 3.236 N/A LEU 37.A N MET 33.A O no hydrogen 3.131 N/A THR 38.A N MET 34.A O no hydrogen 2.823 N/A THR 38.A OG1 MET 34.A O no hydrogen 2.379 N/A ASN 39.A N GLY 35.A O no hydrogen 3.154 N/A LEU 40.A N LEU 36.A O no hydrogen 2.904 N/A ALA 41.A N LEU 37.A O no hydrogen 2.803 N/A ASP 42.A N THR 38.A O no hydrogen 2.937 N/A ARG 43.A N ASN 39.A O no hydrogen 2.942 N/A ARG 43.A NH1 TYR 23.A O no hydrogen 2.830 N/A ARG 43.A NH2 TYR 23.A O no hydrogen 3.102 N/A GLU 44.A N LEU 40.A O no hydrogen 2.858 N/A LEU 45.A N ALA 41.A O no hydrogen 2.803 N/A VAL 46.A N ASP 42.A O no hydrogen 3.148 N/A HIS 47.A N ARG 43.A O no hydrogen 3.332 N/A MET 48.A N GLU 44.A O no hydrogen 2.766 N/A ILE 49.A N LEU 45.A O no hydrogen 3.181 N/A ILE 49.A N VAL 46.A O no hydrogen 3.071 N/A TRP 51.A N HIS 47.A O no hydrogen 3.082 N/A ALA 52.A N MET 48.A O no hydrogen 2.908 N/A LYS 53.A N ILE 49.A O no hydrogen 3.289 N/A LYS 53.A NZ GLN 66.A OE1 no hydrogen 3.507 N/A ARG 54.A N TRP 51.A O no hydrogen 2.854 N/A VAL 55.A N ALA 52.A O no hydrogen 3.146 N/A PHE 58.A N VAL 55.A O no hydrogen 3.128 N/A ASP 60.A N GLY 57.A O no hydrogen 2.890 N/A LEU 61.A N PHE 58.A O no hydrogen 3.190 N/A THR 62.A N GLU 162.A OE2 no hydrogen 2.628 N/A THR 62.A OG1 GLU 162.A OE2 no hydrogen 3.245 N/A ASP 65.A N THR 62.A OG1 no hydrogen 3.194 N/A GLN 66.A N THR 62.A O no hydrogen 3.014 N/A GLN 66.A NE2 LEU 61.A O no hydrogen 2.935 N/A VAL 67.A N LEU 63.A O no hydrogen 2.931 N/A HIS 68.A N HIS 64.A O no hydrogen 3.093 N/A LEU 69.A N ASP 65.A O no hydrogen 3.047 N/A LEU 70.A N GLN 66.A O no hydrogen 3.121 N/A GLU 71.A N VAL 67.A O no hydrogen 2.913 N/A CYS 72.A N HIS 68.A O no hydrogen 3.012 N/A CYS 72.A SG HIS 68.A NE2 no hydrogen 3.405 N/A CYS 72.A SG HIS 68.A O no hydrogen 3.317 N/A ALA 73.A N LEU 70.A O no hydrogen 3.198 N/A ILE 77.A N ALA 73.A O no hydrogen 2.895 N/A LEU 78.A N TRP 74.A O no hydrogen 2.992 N/A MET 79.A N LEU 75.A O no hydrogen 2.945 N/A ILE 80.A N GLU 76.A O no hydrogen 2.825 N/A GLY 81.A N ILE 77.A O no hydrogen 3.317 N/A LEU 82.A N LEU 78.A O no hydrogen 3.002 N/A VAL 83.A N MET 79.A O no hydrogen 2.963 N/A TRP 84.A N ILE 80.A O no hydrogen 2.833 N/A ARG 85.A N GLY 81.A O no hydrogen 2.920 N/A ARG 85.A NE LEU 94.A O no hydrogen 3.273 N/A ARG 85.A NH2 LEU 94.A O no hydrogen 3.541 N/A SER 86.A N LEU 82.A O no hydrogen 2.919 N/A SER 86.A N VAL 83.A O no hydrogen 3.283 N/A SER 86.A OG LEU 82.A O no hydrogen 2.517 N/A MET 87.A N TRP 84.A O no hydrogen 3.380 N/A HIS 89.A N SER 86.A O no hydrogen 2.925 N/A LYS 92.A N HIS 89.A O no hydrogen 2.944 N/A LEU 93.A N LEU 101.A O no hydrogen 2.953 N/A LEU 94.A N SER 86.A OG no hydrogen 2.790 N/A PHE 95.A N LEU 93.A O no hydrogen 3.228 N/A ALA 96.A N LEU 99.A O no hydrogen 3.301 N/A ASN 98.A ND2 SER 24.A O no hydrogen 3.083 N/A LEU 99.A N ALA 96.A O no hydrogen 2.972 N/A LEU 101.A N LEU 93.A O no hydrogen 3.014 N/A ASP 102.A N GLN 105.A OE1 no hydrogen 2.917 N/A ARG 103.A N GLY 91.A O no hydrogen 3.183 N/A ARG 103.A NE ASP 117.A OD1 no hydrogen 3.321 N/A ARG 103.A NE ASP 117.A OD2 no hydrogen 2.902 N/A ARG 103.A NH2 ASP 117.A OD1 no hydrogen 2.687 N/A GLN 105.A N ASP 102.A O no hydrogen 2.692 N/A GLY 106.A N ARG 103.A O no hydrogen 3.136 N/A LYS 107.A N ASN 104.A O no hydrogen 3.398 N/A CYS 108.A N GLN 105.A O no hydrogen 3.068 N/A VAL 109.A N GLY 106.A O no hydrogen 3.327 N/A MET 112.A N VAL 109.A O no hydrogen 3.335 N/A GLU 114.A N GLY 111.A O no hydrogen 3.351 N/A GLU 114.A N GLU 114.A OE1 no hydrogen 2.769 N/A PHE 116.A N MET 112.A O no hydrogen 2.852 N/A ASP 117.A N VAL 113.A O no hydrogen 2.920 N/A MET 118.A N GLU 114.A O no hydrogen 3.249 N/A LEU 119.A N ILE 115.A O no hydrogen 2.967 N/A LEU 120.A N PHE 116.A O no hydrogen 2.779 N/A ALA 121.A N ASP 117.A O no hydrogen 3.016 N/A THR 122.A N MET 118.A O no hydrogen 2.926 N/A THR 122.A OG1 MET 118.A O no hydrogen 2.883 N/A SER 123.A N LEU 119.A O no hydrogen 2.819 N/A SER 123.A OG LEU 120.A O no hydrogen 3.478 N/A SER 124.A N LEU 120.A O no hydrogen 2.759 N/A ARG 125.A N ALA 121.A O no hydrogen 2.791 N/A PHE 126.A N THR 122.A O no hydrogen 3.010 N/A ARG 127.A N SER 123.A O no hydrogen 3.064 N/A ARG 127.A N SER 124.A O no hydrogen 3.243 N/A ARG 127.A NH2 MET 87.A O no hydrogen 2.799 N/A MET 128.A N SER 124.A O no hydrogen 3.343 N/A MET 129.A N ARG 125.A O no hydrogen 3.103 N/A ASN 130.A N ARG 127.A O no hydrogen 3.284 N/A LEU 131.A N PHE 126.A O no hydrogen 3.047 N/A GLN 132.A N GLU 135.A OE2 no hydrogen 2.901 N/A GLN 132.A NE2 ASN 130.A O no hydrogen 3.028 N/A GLU 134.A N GLU 134.A OE1 no hydrogen 2.905 N/A PHE 136.A N GLN 132.A O no hydrogen 2.806 N/A VAL 137.A N GLY 133.A O no hydrogen 2.988 N/A CYS 138.A N GLU 134.A O no hydrogen 3.407 N/A CYS 138.A SG GLU 134.A O no hydrogen 3.292 N/A LEU 139.A N GLU 135.A O no hydrogen 2.999 N/A LYS 140.A N PHE 136.A O no hydrogen 2.933 N/A LYS 140.A NZ GLU 18.A OE1 no hydrogen 3.306 N/A LYS 140.A NZ GLU 18.A OE2 no hydrogen 2.543 N/A SER 141.A N VAL 137.A O no hydrogen 3.274 N/A ILE 142.A N CYS 138.A O no hydrogen 2.933 N/A ILE 143.A N LEU 139.A O no hydrogen 2.963 N/A LEU 144.A N LYS 140.A O no hydrogen 3.246 N/A LEU 145.A N SER 141.A O no hydrogen 3.256 N/A ASN 146.A N ILE 142.A O no hydrogen 2.898 N/A ASN 146.A ND2 TYR 150.A OH no hydrogen 3.342 N/A SER 147.A N ILE 143.A O no hydrogen 3.089 N/A SER 147.A OG GLU 76.A OE1 no hydrogen 2.825 N/A SER 147.A OG GLU 76.A OE2 no hydrogen 3.208 N/A SER 147.A OG ILE 143.A O no hydrogen 2.949 N/A VAL 149.A N ASN 146.A O no hydrogen 3.282 N/A THR 151.A N GLY 148.A O no hydrogen 3.428 N/A THR 151.A OG1 THR 151.A O no hydrogen 2.582 N/A SER 154.A OG SER 159.A OG no hydrogen 2.960 N/A SER 159.A N THR 156.A OG1 no hydrogen 3.273 N/A SER 159.A OG SER 154.A O no hydrogen 3.132 N/A SER 159.A OG SER 154.A OG no hydrogen 2.960 N/A GLU 161.A N LEU 157.A O no hydrogen 3.383 N/A GLU 162.A N LYS 158.A O no hydrogen 2.825 N/A LYS 163.A N SER 159.A O no hydrogen 3.091 N/A ASP 164.A N LEU 160.A O no hydrogen 2.835 N/A HIS 165.A N GLU 161.A O no hydrogen 3.206 N/A ILE 166.A N GLU 162.A O no hydrogen 3.219 N/A HIS 167.A N LYS 163.A O no hydrogen 2.964 N/A ARG 168.A N ASP 164.A O no hydrogen 3.030 N/A ARG 168.A NH2 ASP 164.A O no hydrogen 3.495 N/A VAL 169.A N HIS 165.A O no hydrogen 3.149 N/A LEU 170.A N ILE 166.A O no hydrogen 2.911 N/A ASP 171.A N HIS 167.A O no hydrogen 2.836 N/A LYS 172.A N ARG 168.A O no hydrogen 3.051 N/A LYS 172.A NZ LEU 5.A O no hydrogen 3.216 N/A ILE 173.A N VAL 169.A O no hydrogen 3.019 N/A THR 174.A N LEU 170.A O no hydrogen 2.938 N/A THR 174.A OG1 LEU 170.A O no hydrogen 3.329 N/A ASP 175.A N ASP 171.A O no hydrogen 3.043 N/A THR 176.A N LYS 172.A O no hydrogen 2.911 N/A THR 176.A OG1 LYS 172.A O no hydrogen 2.923 N/A LEU 177.A N ILE 173.A O no hydrogen 2.980 N/A ILE 178.A N THR 174.A O no hydrogen 3.112 N/A HIS 179.A N ASP 175.A O no hydrogen 2.882 N/A LEU 180.A N THR 176.A O no hydrogen 2.935 N/A MET 181.A N LEU 177.A O no hydrogen 3.136 N/A ALA 182.A N ILE 178.A O no hydrogen 2.753 N/A LYS 183.A N HIS 179.A O no hydrogen 2.962 N/A ALA 184.A N LEU 180.A O no hydrogen 3.041 N/A GLY 185.A N ALA 182.A O no hydrogen 2.921 N/A LEU 186.A N MET 181.A O no hydrogen 3.201 N/A THR 187.A N GLN 190.A OE1 no hydrogen 3.127 N/A GLN 190.A N THR 187.A OG1 no hydrogen 3.026 N/A GLN 191.A N THR 187.A O no hydrogen 2.751 N/A GLN 191.A NE2 LEU 186.A O no hydrogen 3.004 N/A HIS 192.A N LEU 188.A O no hydrogen 3.015 N/A GLN 193.A N GLN 189.A O no hydrogen 2.912 N/A ARG 194.A N GLN 190.A O no hydrogen 3.003 N/A ARG 194.A N GLN 191.A O no hydrogen 3.069 N/A ARG 194.A NE GLU 135.A OE1 no hydrogen 2.595 N/A ARG 194.A NH1 MET 129.A O no hydrogen 3.136 N/A ARG 194.A NH1 ASN 130.A O no hydrogen 3.550 N/A ARG 194.A NH1 GLU 135.A OE1 no hydrogen 3.225 N/A ARG 194.A NH1 GLU 135.A OE2 no hydrogen 2.774 N/A ARG 194.A NH2 MET 129.A O no hydrogen 2.956 N/A LEU 195.A N GLN 191.A O no hydrogen 3.046 N/A ALA 196.A N HIS 192.A O no hydrogen 3.074 N/A GLN 197.A N GLN 193.A O no hydrogen 3.003 N/A LEU 198.A N ARG 194.A O no hydrogen 2.866 N/A LEU 199.A N LEU 195.A O no hydrogen 3.032 N/A LEU 200.A N ALA 196.A O no hydrogen 2.848 N/A ILE 201.A N GLN 197.A O no hydrogen 3.251 N/A LEU 202.A N LEU 198.A O no hydrogen 3.253 N/A SER 203.A N LEU 200.A O no hydrogen 3.049 N/A ILE 205.A N ILE 201.A O no hydrogen 2.938 N/A ARG 206.A N LEU 202.A O no hydrogen 3.015 N/A HIS 207.A N SER 203.A O no hydrogen 3.121 N/A MET 208.A N HIS 204.A O no hydrogen 2.876 N/A SER 209.A N ILE 205.A O no hydrogen 3.022 N/A ASN 210.A N ARG 206.A O no hydrogen 2.931 N/A LYS 211.A N HIS 207.A O no hydrogen 3.025 N/A GLY 212.A N MET 208.A O no hydrogen 2.912 N/A MET 213.A N SER 209.A O no hydrogen 2.901 N/A GLU 214.A N ASN 210.A O no hydrogen 3.252 N/A HIS 215.A N LYS 211.A O no hydrogen 3.058 N/A HIS 215.A ND1 LYS 211.A O no hydrogen 2.851 N/A LEU 216.A N GLY 212.A O no hydrogen 3.015 N/A TYR 217.A N MET 213.A O no hydrogen 2.832 N/A SER 218.A N GLU 214.A O no hydrogen 3.051 N/A SER 218.A OG HIS 215.A O no hydrogen 3.234 N/A MET 219.A N HIS 215.A O no hydrogen 3.070 N/A LYS 220.A NZ CYS 221.A O no hydrogen 3.384 N/A LYS 220.A NZ VAL 224.A O no hydrogen 3.028 N/A VAL 224.A N CYS 221.A O no hydrogen 3.269 N/A LEU 230.A N PRO 226.A O no hydrogen 3.058 N/A LEU 231.A N LEU 227.A O no hydrogen 2.862 N/A LEU 232.A N TYR 228.A O no hydrogen 2.946 N/A GLU 233.A N ASP 229.A O no hydrogen 2.953 N/A MET 234.A N LEU 230.A O no hydrogen 3.308 N/A LEU 235.A N LEU 231.A O no hydrogen 3.015 N/A ASP 236.A N LEU 232.A O no hydrogen 3.161 N/A ASP 236.A N GLU 233.A O no hydrogen 3.330 N/A