Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1rkc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A N GLU 181.A O no hydrogen 3.218 N/A THR 8.A N GLU 181.A OE2 no hydrogen 3.174 N/A THR 8.A OG1 GLU 181.A OE1 no hydrogen 3.268 N/A THR 8.A OG1 GLU 181.A OE2 no hydrogen 2.552 N/A GLU 10.A N THR 6.A O no hydrogen 3.283 N/A SER 11.A N ARG 7.A O no hydrogen 2.854 N/A ILE 12.A N ILE 9.A O no hydrogen 3.020 N/A LEU 13.A N ILE 9.A O no hydrogen 3.066 N/A GLU 14.A N GLU 10.A O no hydrogen 2.771 N/A ALA 17.A N GLU 14.A O no hydrogen 2.953 N/A GLN 18.A N GLU 14.A O no hydrogen 2.630 N/A HIS 22.A N GLN 18.A O no hydrogen 3.370 N/A LEU 23.A N GLN 19.A O no hydrogen 2.759 N/A ILE 25.A N SER 21.A O no hydrogen 3.036 N/A MET 26.A N HIS 22.A O no hydrogen 3.151 N/A HIS 27.A N VAL 24.A O no hydrogen 3.252 N/A HIS 27.A NE2 LEU 23.A O no hydrogen 2.869 N/A GLU 29.A N MET 26.A O no hydrogen 3.270 N/A LYS 35.A NZ LEU 95.A O no hydrogen 2.526 N/A LEU 40.A N ILE 37.A O no hydrogen 3.206 N/A THR 41.A N PRO 38.A O no hydrogen 2.920 N/A ALA 45.A N ALA 42.A O no hydrogen 2.391 N/A ALA 46.A N ALA 42.A O no hydrogen 3.278 N/A GLN 48.A N ALA 45.A O no hydrogen 3.232 N/A ALA 50.A N ALA 46.A O no hydrogen 2.935 N/A SER 52.A OG ALA 49.A O no hydrogen 2.426 N/A SER 52.A OG ASN 53.A OD1 no hydrogen 3.562 N/A ASN 53.A N ALA 50.A O no hydrogen 3.145 N/A LEU 54.A N ALA 50.A O no hydrogen 2.982 N/A ARG 56.A N SER 52.A O no hydrogen 3.014 N/A ARG 56.A NE SER 52.A O no hydrogen 2.990 N/A ARG 56.A NE SER 52.A OG no hydrogen 3.209 N/A ARG 56.A NH2 SER 52.A OG no hydrogen 2.494 N/A VAL 57.A N ASN 53.A O no hydrogen 2.691 N/A GLY 58.A N LEU 54.A O no hydrogen 2.851 N/A LYS 59.A N ARG 56.A O no hydrogen 2.681 N/A GLU 60.A N ARG 56.A O no hydrogen 3.263 N/A THR 61.A N VAL 57.A O no hydrogen 2.929 N/A THR 61.A OG1 VAL 57.A O no hydrogen 2.908 N/A VAL 62.A N LYS 59.A O no hydrogen 3.400 N/A GLN 63.A N LYS 59.A O no hydrogen 3.129 N/A THR 64.A N GLU 60.A O no hydrogen 2.701 N/A GLN 68.A NE2 GLU 66.A O no hydrogen 3.495 N/A ILE 69.A N ASP 67.A OD2 no hydrogen 3.120 N/A LYS 71.A NZ VAL 62.A O no hydrogen 3.176 N/A LYS 71.A NZ THR 65.A O no hydrogen 2.559 N/A ARG 72.A N GLN 68.A O no hydrogen 2.973 N/A ASP 73.A N LEU 70.A O no hydrogen 3.145 N/A MET 74.A N LEU 70.A O no hydrogen 2.635 N/A PHE 78.A N PRO 75.A O no hydrogen 2.978 N/A ILE 79.A N PRO 76.A O no hydrogen 2.611 N/A LYS 80.A NZ ASP 121.A OD2 no hydrogen 2.472 N/A GLU 82.A N PHE 78.A O no hydrogen 3.325 N/A ASN 83.A N ILE 79.A O no hydrogen 3.368 N/A ASN 83.A ND2 LYS 80.A O no hydrogen 3.043 N/A ALA 84.A N VAL 81.A O no hydrogen 2.534 N/A CYS 85.A N VAL 81.A O no hydrogen 2.935 N/A CYS 85.A SG GLN 48.A OE1 no hydrogen 2.766 N/A CYS 85.A SG GLU 82.A O no hydrogen 3.591 N/A CYS 85.A SG GLU 82.A OE1 no hydrogen 3.526 N/A THR 86.A N ASN 83.A O no hydrogen 3.226 N/A THR 86.A OG1 GLU 82.A O no hydrogen 3.257 N/A LYS 87.A N ASN 83.A O no hydrogen 2.707 N/A GLN 93.A N GLN 90.A O no hydrogen 2.638 N/A MET 94.A N ALA 91.A O no hydrogen 3.325 N/A TYR 100.A N ASP 98.A OD1 no hydrogen 3.129 N/A SER 101.A N ASP 98.A O no hydrogen 2.941 N/A ALA 104.A N SER 101.A OG no hydrogen 3.038 N/A ARG 105.A N SER 101.A O no hydrogen 3.151 N/A ASP 106.A N PRO 103.A O no hydrogen 3.089 N/A TYR 107.A N ALA 104.A O no hydrogen 2.879 N/A GLY 111.A N TYR 107.A O no hydrogen 3.216 N/A SER 112.A N LEU 108.A O no hydrogen 3.430 N/A SER 112.A OG LEU 108.A O no hydrogen 2.935 N/A ARG 113.A NE ILE 109.A O no hydrogen 3.221 N/A GLY 114.A N GLY 111.A O no hydrogen 3.054 N/A ILE 115.A N SER 112.A O no hydrogen 2.491 N/A LEU 116.A N SER 112.A O no hydrogen 2.931 N/A SER 117.A OG GLY 114.A O no hydrogen 3.443 N/A GLY 118.A N GLY 114.A O no hydrogen 3.455 N/A THR 119.A N LEU 116.A O no hydrogen 2.295 N/A THR 119.A OG1 ILE 115.A O no hydrogen 3.262 N/A SER 120.A N LEU 116.A O no hydrogen 2.702 N/A SER 120.A OG ASP 121.A OD1 no hydrogen 2.791 N/A ASP 121.A N SER 117.A O no hydrogen 2.821 N/A LEU 122.A N GLY 118.A O no hydrogen 3.155 N/A LEU 123.A N THR 119.A O no hydrogen 3.028 N/A THR 125.A N ASP 121.A O no hydrogen 3.217 N/A THR 125.A OG1 ASP 121.A O no hydrogen 3.169 N/A ASP 127.A N LEU 123.A O no hydrogen 2.774 N/A GLU 128.A N LEU 124.A O no hydrogen 2.837 N/A ALA 129.A N THR 125.A O no hydrogen 3.275 N/A ALA 129.A N PHE 126.A O no hydrogen 3.172 N/A GLU 130.A N PHE 126.A O no hydrogen 3.161 N/A VAL 131.A N ASP 127.A O no hydrogen 3.037 N/A ARG 132.A N GLU 128.A O no hydrogen 3.103 N/A ARG 132.A NE ASP 67.A OD1 no hydrogen 2.707 N/A ARG 132.A NE ASP 67.A OD2 no hydrogen 3.230 N/A LYS 133.A N ALA 129.A O no hydrogen 3.058 N/A ILE 134.A N GLU 130.A O no hydrogen 2.951 N/A ILE 135.A N VAL 131.A O no hydrogen 2.993 N/A ARG 136.A N ARG 132.A O no hydrogen 2.805 N/A VAL 137.A N LYS 133.A O no hydrogen 3.196 N/A CYS 138.A N ILE 134.A O no hydrogen 3.034 N/A CYS 138.A SG ILE 134.A O no hydrogen 3.208 N/A LYS 139.A N ILE 135.A O no hydrogen 2.961 N/A LYS 139.A N ARG 136.A O no hydrogen 3.168 N/A GLY 140.A N ARG 136.A O no hydrogen 2.985 N/A ILE 141.A N VAL 137.A O no hydrogen 3.113 N/A LEU 142.A N CYS 138.A O no hydrogen 3.157 N/A GLU 143.A N LYS 139.A O no hydrogen 3.034 N/A TYR 144.A N GLY 140.A O no hydrogen 3.006 N/A LEU 145.A N ILE 141.A O no hydrogen 2.774 N/A THR 146.A N GLU 143.A O no hydrogen 2.866 N/A ALA 148.A N LEU 145.A O no hydrogen 3.319 N/A GLU 149.A N THR 146.A O no hydrogen 3.172 N/A VAL 150.A N VAL 147.A O no hydrogen 2.699 N/A VAL 151.A N ALA 148.A O no hydrogen 3.379 N/A GLU 152.A N ASP 156.A OD2 no hydrogen 3.298 N/A LEU 157.A N THR 153.A O no hydrogen 2.736 N/A VAL 158.A N MET 154.A O no hydrogen 3.091 N/A THR 159.A N GLU 155.A O no hydrogen 3.142 N/A THR 159.A OG1 GLU 155.A O no hydrogen 2.463 N/A THR 159.A OG1 ASP 156.A O no hydrogen 3.511 N/A TYR 160.A N ASP 156.A O no hydrogen 2.864 N/A TYR 160.A OH TYR 144.A O no hydrogen 2.908 N/A THR 161.A N LEU 157.A O no hydrogen 3.112 N/A THR 161.A OG1 LEU 157.A O no hydrogen 2.718 N/A LYS 162.A N VAL 158.A O no hydrogen 2.977 N/A ASN 163.A N THR 159.A O no hydrogen 3.006 N/A ASN 163.A ND2 TYR 144.A OH no hydrogen 3.511 N/A ASN 163.A ND2 THR 159.A O no hydrogen 3.177 N/A LEU 164.A N TYR 160.A O no hydrogen 2.755 N/A GLY 165.A N THR 161.A O no hydrogen 3.274 N/A GLY 167.A N LEU 164.A O no hydrogen 2.706 N/A MET 168.A N LEU 164.A O no hydrogen 3.100 N/A THR 169.A N GLY 165.A O no hydrogen 3.089 N/A THR 169.A OG1 GLY 165.A O no hydrogen 3.176 N/A LYS 170.A N PRO 166.A O no hydrogen 3.189 N/A MET 171.A N GLY 167.A O no hydrogen 2.734 N/A ALA 172.A N MET 168.A O no hydrogen 2.757 N/A LYS 173.A N THR 169.A O no hydrogen 3.064 N/A LYS 173.A NZ GLU 177.A OE2 no hydrogen 3.348 N/A MET 174.A N LYS 170.A O no hydrogen 3.123 N/A ILE 175.A N MET 171.A O no hydrogen 2.578 N/A ASP 176.A N ALA 172.A O no hydrogen 2.665 N/A GLU 177.A N LYS 173.A O no hydrogen 2.940 N/A ARG 178.A N MET 174.A O no hydrogen 3.059 N/A ARG 178.A NH2 ASP 127.A OD2 no hydrogen 2.789 N/A GLN 179.A N ILE 175.A O no hydrogen 3.201 N/A GLN 180.A N ASP 176.A O no hydrogen 3.064 N/A GLU 181.A N GLN 179.A O no hydrogen 2.519 N/A LEU 182.A N GLN 179.A O no hydrogen 2.905 N/A VAL 189.A N GLN 185.A O no hydrogen 3.044 N/A MET 190.A N GLU 186.A O no hydrogen 3.239 N/A LEU 191.A N HIS 187.A O no hydrogen 3.003 N/A VAL 192.A N ARG 188.A O no hydrogen 3.047 N/A ASN 193.A N VAL 189.A O no hydrogen 2.870 N/A SER 194.A N MET 190.A O no hydrogen 2.963 N/A SER 194.A OG MET 190.A O no hydrogen 3.067 N/A SER 194.A OG GLU 240.A OE1 no hydrogen 3.098 N/A SER 194.A OG GLU 243.A OE2 no hydrogen 3.455 N/A MET 195.A N LEU 191.A O no hydrogen 2.863 N/A ASN 196.A N VAL 192.A O no hydrogen 2.847 N/A THR 197.A N ASN 193.A O no hydrogen 3.039 N/A THR 197.A OG1 ASN 193.A O no hydrogen 2.535 N/A VAL 198.A N SER 194.A O no hydrogen 3.107 N/A LYS 199.A N MET 195.A O no hydrogen 3.133 N/A GLU 200.A N ASN 196.A O no hydrogen 3.136 N/A LEU 201.A N THR 197.A O no hydrogen 3.129 N/A LEU 202.A N VAL 198.A O no hydrogen 3.180 N/A LEU 205.A N LEU 201.A O no hydrogen 2.848 N/A LEU 205.A N LEU 202.A O no hydrogen 3.190 N/A ILE 206.A N LEU 202.A O no hydrogen 3.202 N/A SER 207.A N PRO 203.A O no hydrogen 3.196 N/A SER 207.A OG VAL 204.A O no hydrogen 2.666 N/A ALA 208.A N VAL 204.A O no hydrogen 3.483 N/A MET 209.A N LEU 205.A O no hydrogen 3.152 N/A LYS 210.A N ILE 206.A O no hydrogen 2.999 N/A ILE 211.A N SER 207.A O no hydrogen 3.022 N/A PHE 212.A N ALA 208.A O no hydrogen 3.070 N/A VAL 213.A N MET 209.A O no hydrogen 2.510 N/A THR 214.A OG1 LYS 210.A O no hydrogen 2.293 N/A THR 215.A N ILE 211.A O no hydrogen 3.039 N/A LYS 219.A NZ LYS 219.A O no hydrogen 3.055 N/A GLN 221.A NE2 SER 218.A O no hydrogen 2.284 N/A ALA 226.A N ILE 223.A O no hydrogen 2.501 N/A LEU 227.A N ILE 223.A O no hydrogen 3.370 N/A LYS 228.A N GLU 224.A O no hydrogen 2.988 N/A LYS 228.A NZ GLU 224.A OE2 no hydrogen 3.486 N/A ASN 229.A N GLU 225.A O no hydrogen 3.255 N/A ARG 230.A N ALA 226.A O no hydrogen 2.919 N/A ARG 230.A NE ASN 231.A OD1 no hydrogen 3.460 N/A ARG 230.A NH2 ASN 231.A OD1 no hydrogen 3.312 N/A ASN 231.A N LEU 227.A O no hydrogen 2.746 N/A PHE 232.A N LYS 228.A O no hydrogen 2.998 N/A THR 233.A N ASN 229.A O no hydrogen 3.170 N/A THR 233.A OG1 ASN 229.A O no hydrogen 3.183 N/A VAL 234.A N ARG 230.A O no hydrogen 3.275 N/A GLU 235.A N ASN 231.A O no hydrogen 3.026 N/A LYS 236.A N PHE 232.A O no hydrogen 2.905 N/A MET 237.A N THR 233.A O no hydrogen 2.811 N/A SER 238.A N VAL 234.A O no hydrogen 2.859 N/A SER 238.A OG VAL 234.A O no hydrogen 2.680 N/A ALA 239.A N GLU 235.A O no hydrogen 2.944 N/A GLU 240.A N LYS 236.A O no hydrogen 3.111 N/A ILE 241.A N MET 237.A O no hydrogen 3.009 N/A ASN 242.A N SER 238.A O no hydrogen 2.934 N/A ASN 242.A ND2 SER 238.A O no hydrogen 2.999 N/A GLU 243.A N ALA 239.A O no hydrogen 2.896 N/A ILE 244.A N GLU 240.A O no hydrogen 2.978 N/A ILE 245.A N ILE 241.A O no hydrogen 2.987 N/A ARG 246.A N ASN 242.A O no hydrogen 2.764 N/A VAL 247.A N GLU 243.A O no hydrogen 3.040 N/A LEU 248.A N ILE 244.A O no hydrogen 3.072 N/A GLN 249.A N ILE 245.A O no hydrogen 2.936 N/A LEU 250.A N ARG 246.A O no hydrogen 2.747 N/A THR 251.A N VAL 247.A O no hydrogen 3.014 N/A THR 251.A OG1 VAL 247.A O no hydrogen 2.697 N/A SER 252.A N LEU 248.A O no hydrogen 2.916 N/A