Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4q5i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N GLN 49.A O no hydrogen 3.202 N/A THR 3.A OG1 ASP 83.A O no hydrogen 3.259 N/A THR 3.A OG1 ASP 85.A OD2 no hydrogen 3.473 N/A ILE 4.A N THR 51.A O no hydrogen 2.946 N/A GLY 5.A N LEU 86.A O no hydrogen 3.099 N/A LEU 6.A N VAL 53.A O no hydrogen 2.781 N/A ILE 7.A N ILE 88.A O no hydrogen 3.123 N/A SER 12.A N ASN 9.A O no hydrogen 3.410 N/A SER 12.A OG ASN 9.A O no hydrogen 2.831 N/A LYS 14.A NZ ASP 54.A OD1 no hydrogen 2.764 N/A LYS 14.A NZ LEU 55.A O no hydrogen 2.745 N/A LEU 17.A N GLY 13.A O no hydrogen 3.352 N/A PHE 18.A N LYS 14.A O no hydrogen 3.046 N/A ASN 19.A N THR 15.A O no hydrogen 3.218 N/A GLN 20.A N THR 16.A O no hydrogen 3.136 N/A LEU 21.A N LEU 17.A O no hydrogen 3.088 N/A THR 22.A N PHE 18.A O no hydrogen 3.021 N/A THR 22.A OG1 PHE 18.A O no hydrogen 2.736 N/A GLY 23.A N ASN 19.A O no hydrogen 2.828 N/A GLN 26.A N SER 24.A O no hydrogen 2.756 N/A GLN 26.A NE2 ASN 19.A OD1 no hydrogen 3.335 N/A GLN 26.A NE2 THR 22.A OG1 no hydrogen 2.646 N/A ARG 27.A N GLU 40.A O no hydrogen 2.742 N/A GLY 29.A N ARG 38.A O no hydrogen 3.207 N/A ASN 30.A ND2 VAL 34.A O no hydrogen 2.892 N/A TRP 31.A N VAL 36.A O no hydrogen 3.044 N/A VAL 34.A N TRP 31.A O no hydrogen 3.259 N/A ARG 38.A N GLY 29.A O no hydrogen 3.440 N/A ARG 38.A NE GLU 40.A OE2 no hydrogen 3.114 N/A ARG 38.A NH2 GLU 40.A OE2 no hydrogen 2.784 N/A GLU 40.A N ARG 27.A O no hydrogen 2.884 N/A GLY 41.A N LEU 52.A O no hydrogen 3.093 N/A GLN 42.A N ARG 25.A O no hydrogen 3.135 N/A GLN 42.A NE2 THR 51.A OG1 no hydrogen 3.305 N/A PHE 43.A N VAL 50.A O no hydrogen 3.246 N/A THR 45.A N HIS 48.A O no hydrogen 2.949 N/A THR 45.A OG1 HIS 48.A O no hydrogen 3.213 N/A THR 45.A OG1 ASP 162.A OD1 no hydrogen 2.672 N/A HIS 48.A N THR 45.A OG1 no hydrogen 2.793 N/A HIS 48.A ND1 ASP 162.A OD1 no hydrogen 3.206 N/A VAL 50.A N PHE 43.A O no hydrogen 2.855 N/A THR 51.A N LEU 2.A O no hydrogen 2.961 N/A THR 51.A OG1 LEU 2.A O no hydrogen 3.514 N/A LEU 52.A N GLY 41.A O no hydrogen 2.799 N/A VAL 53.A N ILE 4.A O no hydrogen 2.693 N/A ASP 54.A N LYS 39.A O no hydrogen 3.282 N/A LEU 55.A N LEU 6.A O no hydrogen 3.079 N/A THR 58.A N GLY 8.A O no hydrogen 3.075 N/A SER 60.A OG THR 62.A O no hydrogen 3.052 N/A SER 60.A OG THR 62.A OG1 no hydrogen 3.279 N/A SER 60.A OG GLN 105.A OE1 no hydrogen 3.424 N/A LEU 61.A N GLN 105.A OE1 no hydrogen 2.905 N/A THR 62.A N SER 60.A OG no hydrogen 3.144 N/A THR 62.A OG1 SER 60.A OG no hydrogen 3.279 N/A THR 63.A N ASP 210.A OD1 no hydrogen 2.912 N/A THR 63.A OG1 ILE 64.A O no hydrogen 3.062 N/A THR 63.A OG1 GLN 67.A O no hydrogen 2.886 N/A SER 65.A OG ILE 64.A O no hydrogen 2.406 N/A SER 69.A N TYR 212.A OH no hydrogen 2.798 N/A GLU 72.A N SER 69.A O no hydrogen 3.114 N/A GLN 73.A N SER 69.A O no hydrogen 3.199 N/A ILE 74.A N LEU 70.A O no hydrogen 3.044 N/A ALA 75.A N ASP 71.A O no hydrogen 3.133 N/A CYS 76.A N GLU 72.A O no hydrogen 2.889 N/A CYS 76.A SG LEU 61.A O no hydrogen 3.850 N/A HIS 77.A N GLN 73.A O no hydrogen 2.838 N/A HIS 77.A ND1 TYR 216.A OH no hydrogen 2.919 N/A TYR 78.A N ILE 74.A O no hydrogen 3.215 N/A TYR 78.A OH ASP 83.A OD2 no hydrogen 2.891 N/A ILE 79.A N ALA 75.A O no hydrogen 3.119 N/A LEU 80.A N CYS 76.A O no hydrogen 3.061 N/A SER 81.A N HIS 77.A O no hydrogen 2.952 N/A SER 81.A OG TYR 78.A O no hydrogen 2.688 N/A GLY 82.A N ILE 79.A O no hydrogen 3.432 N/A ASP 85.A N THR 3.A O no hydrogen 2.877 N/A LEU 87.A N PRO 112.A O no hydrogen 3.158 N/A ILE 88.A N GLY 5.A O no hydrogen 3.028 N/A ASN 89.A N ILE 114.A O no hydrogen 3.042 N/A ASN 89.A ND2 ILE 7.A O no hydrogen 3.183 N/A VAL 90.A N ILE 7.A O no hydrogen 2.831 N/A VAL 91.A N ALA 116.A O no hydrogen 2.985 N/A ASP 92.A N ASN 99.A OD1 no hydrogen 2.898 N/A ALA 93.A N ASN 118.A O no hydrogen 3.044 N/A SER 94.A N ASP 92.A OD1 no hydrogen 3.145 N/A SER 94.A OG ASP 92.A OD1 no hydrogen 2.751 N/A SER 94.A OG ASP 92.A OD2 no hydrogen 3.055 N/A ASN 95.A N ASP 92.A O no hydrogen 3.397 N/A ASN 95.A ND2 ASP 92.A OD2 no hydrogen 3.280 N/A ASN 99.A N ASN 95.A O no hydrogen 3.162 N/A LEU 100.A N LEU 96.A O no hydrogen 2.964 N/A THR 103.A OG1 ASN 89.A OD1 no hydrogen 2.626 N/A THR 103.A OG1 ASN 99.A O no hydrogen 3.243 N/A LEU 104.A N LEU 100.A O no hydrogen 2.769 N/A GLN 105.A N TYR 101.A O no hydrogen 3.457 N/A GLN 105.A NE2 SER 60.A OG no hydrogen 3.107 N/A LEU 106.A N LEU 102.A O no hydrogen 3.212 N/A LEU 107.A N THR 103.A O no hydrogen 3.243 N/A GLU 108.A N LEU 104.A O no hydrogen 2.851 N/A LEU 109.A N GLN 105.A O no hydrogen 3.140 N/A GLY 110.A N LEU 107.A O no hydrogen 3.184 N/A ILE 111.A N LEU 106.A O no hydrogen 3.355 N/A CYS 113.A N ASN 167.A OD1 no hydrogen 3.327 N/A CYS 113.A SG LEU 87.A O no hydrogen 3.927 N/A ILE 114.A N LEU 87.A O no hydrogen 2.930 N/A VAL 115.A N PRO 142.A O no hydrogen 3.087 N/A ALA 116.A N ASN 89.A O no hydrogen 2.841 N/A LEU 117.A N ILE 144.A O no hydrogen 2.930 N/A ASN 118.A N VAL 91.A O no hydrogen 2.761 N/A ASN 118.A ND2 SER 12.A O no hydrogen 2.812 N/A MET 119.A N ASN 118.A OD1 no hydrogen 2.874 N/A ILE 122.A N ASP 121.A OD1 no hydrogen 2.816 N/A ALA 123.A N MET 119.A O no hydrogen 3.292 N/A GLU 124.A N LEU 120.A O no hydrogen 3.102 N/A LYS 125.A N ILE 122.A O no hydrogen 3.251 N/A GLN 126.A N ILE 122.A O no hydrogen 3.308 N/A GLN 126.A N ALA 123.A O no hydrogen 3.093 N/A ASN 127.A N GLU 124.A O no hydrogen 3.267 N/A ASN 127.A ND2 THR 262.A O no hydrogen 3.207 N/A ILE 128.A N ALA 123.A O no hydrogen 2.954 N/A ARG 129.A N ASN 259.A O no hydrogen 2.779 N/A ARG 129.A NH1 GLU 131.A OE1 no hydrogen 2.648 N/A GLU 131.A N VAL 257.A O no hydrogen 3.155 N/A LEU 135.A N GLU 131.A O no hydrogen 3.239 N/A SER 136.A N ILE 132.A O no hydrogen 2.909 N/A SER 136.A OG CYS 141.A O no hydrogen 2.718 N/A ALA 137.A N ASP 133.A O no hydrogen 2.913 N/A ARG 138.A N ALA 134.A O no hydrogen 3.399 N/A ARG 138.A NH1 ALA 134.A O no hydrogen 2.812 N/A LEU 139.A N LEU 135.A O no hydrogen 3.001 N/A GLY 140.A N SER 136.A O no hydrogen 2.929 N/A CYS 141.A SG PRO 142.A O no hydrogen 3.926 N/A ILE 144.A N VAL 115.A O no hydrogen 2.911 N/A LEU 146.A N LEU 117.A O no hydrogen 2.812 N/A VAL 147.A N PRO 145.A O no hydrogen 2.856 N/A GLY 151.A N SER 148.A O no hydrogen 3.134 N/A ARG 152.A N ALA 149.A O no hydrogen 3.250 N/A GLY 153.A N VAL 147.A O no hydrogen 3.090 N/A ALA 156.A N ARG 152.A O no hydrogen 3.279 N/A LEU 157.A N GLY 153.A O no hydrogen 3.077 N/A LYS 158.A N ILE 154.A O no hydrogen 2.924 N/A LYS 158.A NZ SER 44.A O no hydrogen 3.537 N/A LEU 159.A N GLU 155.A O no hydrogen 2.973 N/A ALA 160.A N ALA 156.A O no hydrogen 3.059 N/A ILE 161.A N LEU 157.A O no hydrogen 3.053 N/A ASP 162.A N LYS 158.A O no hydrogen 3.255 N/A ARG 163.A N ALA 160.A O no hydrogen 3.220 N/A TYR 164.A N ILE 161.A O no hydrogen 3.312 N/A GLU 168.A N GLY 140.A O no hydrogen 2.956 N/A TYR 175.A OH GLU 108.A OE2 no hydrogen 2.761 N/A LEU 180.A N ALA 176.A O no hydrogen 3.254 N/A ASN 181.A N GLN 177.A O no hydrogen 3.019 N/A GLU 182.A N PRO 178.A O no hydrogen 2.855 N/A ALA 183.A N LEU 179.A O no hydrogen 2.911 N/A ASP 184.A N LEU 180.A O no hydrogen 3.027 N/A SER 185.A N ASN 181.A O no hydrogen 3.334 N/A SER 185.A OG ASN 181.A O no hydrogen 3.270 N/A LEU 186.A N GLU 182.A O no hydrogen 3.307 N/A ALA 187.A N ALA 183.A O no hydrogen 3.145 N/A LYS 188.A N ASP 184.A O no hydrogen 3.201 N/A LYS 188.A NZ ASP 184.A O no hydrogen 3.541 N/A ILE 194.A N PRO 191.A O no hydrogen 3.431 N/A GLN 198.A NE2 LEU 109.A O no hydrogen 3.318 N/A ARG 199.A N PRO 195.A O no hydrogen 2.910 N/A ARG 199.A NE ILE 194.A O no hydrogen 2.769 N/A ARG 199.A NH1 ALA 187.A O no hydrogen 2.747 N/A ARG 200.A N LEU 196.A O no hydrogen 3.060 N/A ARG 200.A NE ASP 184.A OD1 no hydrogen 3.394 N/A ARG 200.A NH2 ASP 184.A OD2 no hydrogen 3.460 N/A TRP 201.A N LYS 197.A O no hydrogen 3.264 N/A TRP 201.A NE1 GLU 108.A OE1 no hydrogen 3.046 N/A LEU 202.A N GLN 198.A O no hydrogen 3.015 N/A GLY 203.A N ARG 199.A O no hydrogen 3.062 N/A LEU 204.A N ARG 200.A O no hydrogen 3.192 N/A GLN 205.A N TRP 201.A O no hydrogen 3.031 N/A MET 206.A N LEU 202.A O no hydrogen 3.000 N/A LEU 207.A N GLY 203.A O no hydrogen 3.312 N/A GLU 208.A N LEU 204.A O no hydrogen 3.388 N/A GLY 209.A N GLN 205.A O no hydrogen 3.121 N/A GLY 209.A N MET 206.A O no hydrogen 3.205 N/A ASP 210.A N GLN 205.A O no hydrogen 3.023 N/A TYR 212.A OH GLU 72.A OE2 no hydrogen 2.989 N/A SER 213.A N ASP 210.A OD2 no hydrogen 3.076 N/A SER 213.A OG ASP 210.A OD2 no hydrogen 3.107 N/A ALA 215.A N TYR 212.A O no hydrogen 3.372 N/A TYR 216.A N SER 213.A O no hydrogen 3.229 N/A TYR 216.A OH HIS 77.A ND1 no hydrogen 2.919 N/A ALA 217.A N ARG 214.A O no hydrogen 3.442 N/A GLN 222.A N GLU 219.A O no hydrogen 3.208 N/A HIS 223.A N ALA 220.A O no hydrogen 3.247 N/A HIS 223.A ND1 GLU 219.A O no hydrogen 3.056 N/A ALA 227.A N HIS 223.A O no hydrogen 3.058 N/A LEU 228.A N LEU 224.A O no hydrogen 2.741 N/A ALA 229.A N ASP 225.A O no hydrogen 3.145 N/A ARG 230.A N ALA 226.A O no hydrogen 3.072 N/A LEU 231.A N ALA 227.A O no hydrogen 3.268 N/A ARG 232.A N ALA 229.A O no hydrogen 3.349 N/A GLU 234.A N LEU 231.A O no hydrogen 3.381 N/A GLU 234.A N GLU 234.A OE1 no hydrogen 2.675 N/A MET 235.A N LEU 231.A O no hydrogen 3.225 N/A HIS 241.A N ASP 237.A O no hydrogen 3.207 N/A ILE 242.A N PRO 238.A O no hydrogen 3.149 N/A ALA 243.A N ALA 239.A O no hydrogen 3.438 N/A ASP 244.A N LEU 240.A O no hydrogen 3.042 N/A ALA 245.A N HIS 241.A O no hydrogen 2.765 N/A ARG 246.A N ILE 242.A O no hydrogen 3.169 N/A ARG 246.A NH2 GLN 205.A OE1 no hydrogen 3.544 N/A ARG 246.A NH2 GLU 208.A OE1 no hydrogen 3.093 N/A TYR 247.A N ALA 243.A O no hydrogen 2.886 N/A GLN 248.A N ASP 244.A O no hydrogen 2.718 N/A CYS 249.A N ALA 245.A O no hydrogen 3.263 N/A CYS 249.A SG LEU 172.A O no hydrogen 3.002 N/A ILE 250.A N ARG 246.A O no hydrogen 3.241 N/A ALA 251.A N TYR 247.A O no hydrogen 2.786 N/A ALA 252.A N GLN 248.A O no hydrogen 2.943 N/A ILE 253.A N CYS 249.A O no hydrogen 3.198 N/A CYS 254.A N ILE 250.A O no hydrogen 2.919 N/A CYS 254.A SG ILE 250.A O no hydrogen 3.229 N/A ASP 255.A N ALA 251.A O no hydrogen 3.211 N/A VAL 257.A N ILE 253.A O no hydrogen 2.909 N/A SER 258.A N CYS 254.A O no hydrogen 2.973 N/A ASN 259.A N ARG 129.A O no hydrogen 2.908 N/A ASN 259.A ND2 VAL 256.A O no hydrogen 3.578 N/A LEU 261.A N ASN 127.A O no hydrogen 3.418 N/A THR 262.A N ASN 127.A OD1 no hydrogen 3.054 N/A