Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ckq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N GLN 2.A O no hydrogen 3.070 N/A GLY 6.A N GLY 3.A O no hydrogen 3.261 N/A PHE 8.A N VAL 4.A O no hydrogen 2.958 N/A GLY 9.A N ILE 5.A O no hydrogen 3.160 N/A ASP 10.A N GLY 6.A O no hydrogen 3.154 N/A TYR 11.A N ILE 7.A O no hydrogen 3.319 N/A ALA 12.A N PHE 8.A O no hydrogen 3.199 N/A LYS 13.A N GLY 9.A O no hydrogen 3.083 N/A ALA 14.A N ASP 10.A O no hydrogen 2.936 N/A LEU 17.A N ALA 12.A O no hydrogen 3.380 N/A VAL 22.A N ALA 18.A O no hydrogen 2.908 N/A VAL 22.A N VAL 19.A O no hydrogen 3.167 N/A SER 23.A N VAL 19.A O no hydrogen 2.977 N/A SER 23.A OG VAL 19.A O no hydrogen 3.070 N/A SER 23.A OG GLY 76.A O no hydrogen 2.634 N/A LYS 24.A N GLY 20.A O no hydrogen 3.409 N/A LEU 25.A N GLU 21.A O no hydrogen 3.330 N/A VAL 26.A N VAL 22.A O no hydrogen 3.010 N/A LYS 27.A N SER 23.A O no hydrogen 3.314 N/A LYS 28.A N LYS 24.A O no hydrogen 3.322 N/A ALA 29.A N LEU 25.A O no hydrogen 3.078 N/A LEU 30.A N VAL 26.A O no hydrogen 2.983 N/A SER 31.A N LYS 27.A O no hydrogen 2.948 N/A SER 31.A OG LYS 27.A O no hydrogen 2.836 N/A ASN 32.A N LYS 28.A O no hydrogen 3.023 N/A GLU 33.A N ALA 29.A O no hydrogen 3.003 N/A TYR 34.A N LEU 30.A O no hydrogen 2.910 N/A GLN 36.A N GLN 36.A OE1 no hydrogen 3.014 N/A LEU 37.A N TYR 34.A O no hydrogen 3.298 N/A ARG 40.A N GLU 80.A O no hydrogen 3.139 N/A ARG 40.A NE GLU 80.A OE1 no hydrogen 2.903 N/A ARG 40.A NH2 GLU 80.A OE1 no hydrogen 3.122 N/A ARG 40.A NH2 GLU 80.A OE2 no hydrogen 3.346 N/A TYR 41.A OH GLY 76.A O no hydrogen 3.212 N/A ARG 42.A N ILE 78.A O no hydrogen 2.814 N/A ARG 42.A NE GLU 80.A OE1 no hydrogen 2.970 N/A ARG 42.A NH1 GLU 49.A OE1 no hydrogen 2.867 N/A ARG 42.A NH1 GLU 49.A OE2 no hydrogen 2.884 N/A ARG 42.A NH2 GLU 80.A OE1 no hydrogen 3.425 N/A ARG 42.A NH2 GLU 80.A OE2 no hydrogen 3.112 N/A SER 44.A OG ILE 72.A O no hydrogen 3.321 N/A ILE 45.A N ILE 72.A O no hydrogen 3.291 N/A LYS 46.A N GLU 49.A OE2 no hydrogen 3.378 N/A LYS 47.A N SER 70.A O no hydrogen 2.847 N/A LYS 47.A NZ THR 64.A O no hydrogen 3.279 N/A GLU 49.A N LYS 46.A O no hydrogen 3.067 N/A ASN 51.A N LYS 47.A O no hydrogen 3.020 N/A ASN 51.A ND2 THR 64.A O no hydrogen 3.111 N/A GLU 52.A N THR 48.A O no hydrogen 3.124 N/A ALA 53.A N GLU 49.A O no hydrogen 3.125 N/A LEU 54.A N ILE 50.A O no hydrogen 2.983 N/A LYS 55.A N ASN 51.A O no hydrogen 2.985 N/A LYS 55.A NZ GLY 62.A O no hydrogen 2.786 N/A LYS 56.A N GLU 52.A O no hydrogen 3.389 N/A ASP 58.A N LEU 54.A O no hydrogen 3.319 N/A ASP 60.A N ASP 58.A OD1 no hydrogen 2.980 N/A LEU 61.A N ASP 58.A O no hydrogen 3.145 N/A SER 70.A N VAL 67.A O no hydrogen 3.010 N/A SER 70.A OG VAL 67.A O no hydrogen 2.758 N/A ILE 72.A N ILE 45.A O no hydrogen 3.117 N/A ASP 75.A N GLU 95.A OE2 no hydrogen 3.291 N/A GLY 77.A N PRO 74.A O no hydrogen 2.913 N/A ILE 78.A N ARG 42.A O no hydrogen 2.672 N/A VAL 79.A N LEU 92.A O no hydrogen 2.879 N/A GLU 80.A N ARG 40.A O no hydrogen 2.989 N/A VAL 81.A N ARG 89.A O no hydrogen 3.018 N/A LYS 82.A N SER 38.A O no hydrogen 3.161 N/A ASP 83.A N GLU 87.A O no hydrogen 3.007 N/A ASP 84.A N ASP 253.A O no hydrogen 2.888 N/A TYR 85.A N ASP 83.A OD1 no hydrogen 3.150 N/A GLY 86.A N ASP 83.A O no hydrogen 3.177 N/A GLU 87.A N ASP 83.A OD1 no hydrogen 2.854 N/A ARG 89.A N VAL 81.A O no hydrogen 2.837 N/A ARG 89.A NE GLU 144.A OE2 no hydrogen 2.999 N/A ARG 89.A NH1 ASP 83.A OD2 no hydrogen 2.992 N/A ARG 89.A NH1 ASP 253.A OD2 no hydrogen 2.974 N/A ARG 89.A NH2 GLU 144.A OE1 no hydrogen 2.939 N/A ARG 89.A NH2 GLU 144.A OE2 no hydrogen 3.561 N/A VAL 91.A N VAL 79.A O no hydrogen 2.844 N/A LEU 92.A N VAL 79.A O no hydrogen 3.311 N/A VAL 93.A N PRO 148.A O no hydrogen 3.125 N/A GLU 95.A N VAL 150.A O no hydrogen 2.939 N/A ALA 96.A N ASP 75.A OD1 no hydrogen 3.131 N/A LYS 97.A N PHE 152.A O no hydrogen 2.902 N/A GLN 99.A N GLU 154.A O no hydrogen 3.089 N/A GLN 99.A NE2 GLY 124.A O no hydrogen 3.146 N/A GLN 99.A NE2 ASN 157.A OD1 no hydrogen 3.107 N/A ASP 102.A N SER 156.A OG no hydrogen 3.305 N/A ASN 105.A N LYS 101.A O no hydrogen 3.153 N/A ILE 106.A N ASP 102.A O no hydrogen 2.954 N/A ARG 107.A N ILE 103.A O no hydrogen 3.127 N/A ARG 107.A NH2 THR 166.A O no hydrogen 2.890 N/A ASN 108.A N ASN 105.A O no hydrogen 3.191 N/A VAL 112.A N GLN 118.A O no hydrogen 2.881 N/A LYS 114.A NZ GLN 118.A OE1 no hydrogen 3.447 N/A GLY 116.A N GLY 113.A O no hydrogen 3.080 N/A GLN 118.A N VAL 112.A O no hydrogen 2.941 N/A GLN 118.A NE2 LEU 120.A O no hydrogen 3.144 N/A MET 121.A N ASP 102.A OD1 no hydrogen 3.000 N/A ALA 123.A N ILE 181.A O no hydrogen 3.188 N/A GLU 128.A N ASN 125.A O no hydrogen 2.987 N/A ARG 129.A N ALA 126.A O no hydrogen 3.312 N/A SER 130.A N ILE 127.A O no hydrogen 3.220 N/A SER 130.A OG ILE 127.A O no hydrogen 2.798 N/A HIS 131.A N GLU 128.A O no hydrogen 3.301 N/A HIS 131.A NE2 ARG 187.A O no hydrogen 2.946 N/A LYS 132.A N ARG 129.A O no hydrogen 2.983 N/A ASN 133.A ND2 GLU 95.A OE1 no hydrogen 3.194 N/A SER 135.A N HIS 131.A O no hydrogen 2.994 N/A GLU 136.A N LYS 132.A O no hydrogen 2.967 N/A ILE 137.A N ASN 133.A O no hydrogen 2.987 N/A ALA 138.A N ILE 134.A O no hydrogen 3.095 N/A ASN 139.A N SER 135.A O no hydrogen 3.079 N/A PHE 140.A N GLU 136.A O no hydrogen 3.018 N/A MET 141.A N ILE 137.A O no hydrogen 2.894 N/A GLU 144.A N MET 141.A O no hydrogen 2.981 N/A HIS 146.A NE2 VAL 90.A O no hydrogen 2.992 N/A PHE 147.A N CYS 202.A O no hydrogen 2.961 N/A VAL 150.A N VAL 93.A O no hydrogen 2.908 N/A LEU 151.A N SER 220.A O no hydrogen 2.954 N/A PHE 152.A N GLU 95.A O no hydrogen 2.870 N/A LEU 153.A N TYR 222.A O no hydrogen 2.874 N/A SER 156.A N GLY 100.A O no hydrogen 3.202 N/A SER 156.A OG ASP 102.A OD2 no hydrogen 2.762 N/A ASN 157.A N GLN 99.A O no hydrogen 3.343 N/A THR 160.A N GLY 225.A O no hydrogen 3.401 N/A ILE 163.A N LEU 175.A O no hydrogen 3.167 N/A SER 164.A OG ASN 174.A OD1 no hydrogen 2.919 N/A ILE 165.A N VAL 173.A O no hydrogen 2.898 N/A ARG 167.A N ARG 171.A O no hydrogen 3.215 N/A ARG 167.A NE ASP 169.A OD1 no hydrogen 3.141 N/A GLY 170.A N ARG 167.A O no hydrogen 2.960 N/A ARG 171.A NH1 ASP 119.A OD2 no hydrogen 3.367 N/A VAL 173.A N ILE 165.A O no hydrogen 2.820 N/A LEU 175.A N ILE 163.A O no hydrogen 2.920 N/A TYR 177.A N ASN 162.A OD1 no hydrogen 3.268 N/A SER 179.A N GLU 176.A O no hydrogen 3.147 N/A ILE 181.A N SER 179.A OG no hydrogen 3.394 N/A LEU 182.A N SER 179.A O no hydrogen 3.126 N/A ASN 183.A N SER 179.A O no hydrogen 3.062 N/A ARG 184.A N ASN 157.A O no hydrogen 2.888 N/A ARG 184.A NE ASN 183.A O no hydrogen 2.944 N/A ARG 184.A NH2 GLY 180.A O no hydrogen 2.582 N/A ARG 184.A NH2 ASN 183.A O no hydrogen 3.212 N/A LEU 185.A N ASN 183.A OD1 no hydrogen 3.151 N/A ARG 187.A N ARG 184.A O no hydrogen 2.948 N/A ARG 187.A NH1 GLU 128.A OE2 no hydrogen 3.118 N/A LEU 188.A N LEU 185.A O no hydrogen 3.371 N/A THR 189.A OG1 ASP 186.A O no hydrogen 2.902 N/A ALA 191.A N LEU 188.A O no hydrogen 2.918 N/A ASN 192.A N THR 189.A O no hydrogen 3.378 N/A ASN 192.A ND2 THR 189.A O no hydrogen 2.848 N/A TYR 193.A N ALA 190.A O no hydrogen 3.401 N/A GLY 194.A N THR 189.A O no hydrogen 3.105 N/A MET 195.A N ASN 192.A O no hydrogen 3.009 N/A ASN 198.A N ILE 221.A O no hydrogen 2.884 N/A SER 199.A OG ILE 197.A O no hydrogen 3.066 N/A ASN 200.A ND2 ASP 241.A OD2 no hydrogen 3.060 N/A ASN 200.A ND2 THR 245.A OG1 no hydrogen 3.044 N/A LEU 201.A N SER 220.A OG no hydrogen 3.053 N/A CYS 202.A N ASN 200.A OD1 no hydrogen 3.007 N/A CYS 202.A SG ILE 242.A O no hydrogen 3.960 N/A CYS 202.A SG SER 246.A OG no hydrogen 3.501 N/A ASN 204.A N SER 145.A O no hydrogen 3.252 N/A LYS 210.A NZ HIS 209.A O no hydrogen 3.095 N/A ILE 214.A N VAL 207.A O no hydrogen 3.002 N/A LEU 216.A N LYS 205.A O no hydrogen 2.851 N/A GLN 217.A NE2 ALA 138.A O no hydrogen 2.970 N/A ALA 219.A N ALA 191.A O no hydrogen 3.343 N/A SER 220.A N TYR 149.A O no hydrogen 2.917 N/A SER 220.A OG SER 199.A O no hydrogen 3.250 N/A TYR 222.A N LEU 151.A O no hydrogen 2.916 N/A THR 223.A N ASN 198.A OD1 no hydrogen 2.899 N/A THR 223.A OG1 PHE 158.A O no hydrogen 3.062 N/A GLN 224.A N LEU 153.A O no hydrogen 3.362 N/A GLY 227.A N GLN 224.A O no hydrogen 3.431 N/A TRP 230.A N GLU 154.A OE1 no hydrogen 3.134 N/A TRP 230.A NE1 LEU 153.A O no hydrogen 2.770 N/A SER 232.A OG LEU 17.A O no hydrogen 2.799 N/A MET 235.A N ASP 231.A O no hydrogen 3.047 N/A PHE 236.A N SER 232.A O no hydrogen 3.046 N/A GLU 237.A N LYS 233.A O no hydrogen 3.187 N/A ILE 238.A N ILE 234.A O no hydrogen 3.292 N/A MET 239.A N MET 235.A O no hydrogen 3.020 N/A PHE 240.A N PHE 236.A O no hydrogen 2.865 N/A ASP 241.A N GLU 237.A O no hydrogen 2.984 N/A ILE 242.A N ILE 238.A O no hydrogen 3.126 N/A SER 243.A N MET 239.A O no hydrogen 3.113 N/A SER 243.A OG MET 239.A O no hydrogen 3.035 N/A THR 244.A N PHE 240.A O no hydrogen 3.026 N/A THR 244.A OG1 PHE 240.A O no hydrogen 3.055 N/A THR 245.A N ASP 241.A O no hydrogen 3.219 N/A THR 245.A OG1 ASP 241.A O no hydrogen 3.054 N/A SER 246.A N ILE 242.A O no hydrogen 3.164 N/A SER 246.A OG VAL 91.A O no hydrogen 2.840 N/A SER 246.A OG ILE 242.A O no hydrogen 3.185 N/A LEU 247.A N SER 243.A O no hydrogen 3.219 N/A ARG 248.A N THR 244.A O no hydrogen 3.141 N/A VAL 249.A N THR 245.A O no hydrogen 3.212 N/A LEU 250.A N SER 246.A O no hydrogen 3.105 N/A GLY 251.A N ARG 248.A O no hydrogen 3.189 N/A ASP 253.A N LEU 250.A O no hydrogen 2.981 N/A LEU 254.A N GLY 251.A O no hydrogen 3.168 N/A GLU 256.A N ASP 84.A OD2 no hydrogen 3.167 N/A GLN 257.A N LEU 254.A O no hydrogen 3.154 N/A GLN 257.A NE2 LYS 82.A O no hydrogen 3.015 N/A GLN 257.A NE2 ASP 84.A OD1 no hydrogen 2.924 N/A LEU 258.A N PHE 255.A O no hydrogen 3.076 N/A THR 259.A N PHE 255.A O no hydrogen 3.184 N/A THR 259.A OG1 PHE 255.A O no hydrogen 3.306 N/A SER 260.A N GLU 256.A O no hydrogen 2.843 N/A SER 260.A OG GLU 256.A OE1 no hydrogen 3.201 N/A LYS 261.A NZ GLN 36.A O no hydrogen 3.025 N/A