Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2z50_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N ASN 1.A O no hydrogen 3.050 N/A LYS 6.A N LYS 2.A O no hydrogen 3.089 N/A ILE 7.A N MET 3.A O no hydrogen 2.674 N/A ASP 8.A N GLU 4.A O no hydrogen 2.970 N/A GLU 9.A N ALA 5.A O no hydrogen 3.096 N/A LEU 10.A N LYS 6.A O no hydrogen 3.072 N/A ILE 11.A N ILE 7.A O no hydrogen 3.158 N/A ASN 12.A N ASP 8.A O no hydrogen 3.269 N/A ASN 12.A ND2 ASP 8.A O no hydrogen 2.877 N/A ASN 13.A N LEU 10.A O no hydrogen 3.426 N/A ASN 13.A ND2 GLU 9.A O no hydrogen 2.476 N/A TRP 17.A NE1 GLU 22.A OE1 no hydrogen 2.794 N/A SER 19.A OG GLN 20.A OE1 no hydrogen 3.531 N/A GLN 20.A N GLN 20.A OE1 no hydrogen 2.967 N/A ASN 21.A N SER 18.A OG no hydrogen 3.084 N/A GLU 22.A N SER 18.A O no hydrogen 3.040 N/A SER 23.A N SER 19.A O no hydrogen 3.067 N/A SER 23.A OG SER 19.A O no hydrogen 3.308 N/A LEU 24.A N GLN 20.A O no hydrogen 3.173 N/A ILE 25.A N ASN 21.A O no hydrogen 3.293 N/A SER 26.A N SER 23.A O no hydrogen 3.235 N/A SER 26.A OG GLU 22.A O no hydrogen 2.890 N/A LYS 27.A N LEU 24.A O no hydrogen 3.493 N/A ASN 30.A N SER 26.A O no hydrogen 2.910 N/A HIS 31.A N LYS 27.A O no hydrogen 3.209 N/A HIS 31.A NE2 THR 81.A O no hydrogen 2.876 N/A LEU 33.A N TYR 29.A O no hydrogen 3.364 N/A ILE 39.A N LEU 35.A O no hydrogen 3.043 N/A ASN 40.A N ILE 36.A O no hydrogen 3.004 N/A ARG 41.A N GLN 38.A O no hydrogen 2.895 N/A ASN 44.A N ASN 40.A O no hydrogen 2.592 N/A LEU 50.A N PRO 46.A O no hydrogen 3.022 N/A ALA 51.A N LYS 47.A O no hydrogen 3.131 N/A ILE 52.A N GLN 49.A O no hydrogen 2.976 N/A VAL 53.A N GLN 49.A O no hydrogen 3.077 N/A SER 54.A N LEU 50.A O no hydrogen 3.103 N/A GLN 55.A N ALA 51.A O no hydrogen 3.213 N/A ILE 56.A N ILE 52.A O no hydrogen 3.087 N/A VAL 57.A N VAL 53.A O no hydrogen 2.972 N/A GLU 58.A N SER 54.A O no hydrogen 3.015 N/A LEU 59.A N GLN 55.A O no hydrogen 2.980 N/A LEU 60.A N ILE 56.A O no hydrogen 3.110 N/A HIS 61.A N VAL 57.A O no hydrogen 2.908 N/A ASN 62.A N GLU 58.A O no hydrogen 3.013 N/A ASN 62.A ND2 TYR 29.A OH no hydrogen 3.471 N/A SER 63.A N LEU 59.A O no hydrogen 3.099 N/A SER 63.A OG LEU 59.A O no hydrogen 2.936 N/A SER 64.A N LEU 60.A O no hydrogen 3.034 N/A SER 64.A OG LEU 60.A O no hydrogen 3.226 N/A LEU 65.A N HIS 61.A O no hydrogen 3.058 N/A LEU 66.A N ASN 62.A O no hydrogen 3.216 N/A ILE 67.A N SER 63.A O no hydrogen 3.409 N/A ASP 68.A N SER 64.A O no hydrogen 2.856 N/A ASP 69.A N LEU 65.A O no hydrogen 3.061 N/A GLU 71.A N ILE 67.A O no hydrogen 2.884 N/A ASP 72.A N ASP 68.A O no hydrogen 2.900 N/A ASN 73.A N ILE 70.A O no hydrogen 3.195 N/A ALA 74.A N ASP 69.A O no hydrogen 3.040 N/A ARG 77.A N GLN 80.A O no hydrogen 2.966 N/A ARG 77.A NE ASP 69.A OD2 no hydrogen 3.043 N/A ARG 77.A NH2 ASP 69.A OD1 no hydrogen 3.022 N/A ARG 78.A NH1 ILE 32.A O no hydrogen 3.040 N/A ARG 78.A NH1 ASN 62.A OD1 no hydrogen 3.494 N/A ARG 78.A NH2 ASN 62.A OD1 no hydrogen 3.081 N/A GLN 80.A N ARG 77.A O no hydrogen 3.028 N/A GLN 80.A NE2 HIS 31.A O no hydrogen 3.029 N/A THR 82.A N PRO 75.A O no hydrogen 3.264 N/A THR 82.A OG1 ALA 74.A O no hydrogen 2.816 N/A THR 82.A OG1 HIS 84.A NE2 no hydrogen 3.399 N/A SER 83.A OG PRO 28.A O no hydrogen 2.990 N/A LEU 85.A N THR 82.A O no hydrogen 3.099 N/A ILE 86.A N SER 83.A O no hydrogen 3.045 N/A PHE 87.A N SER 83.A O no hydrogen 2.894 N/A GLY 88.A N HIS 84.A O no hydrogen 3.074 N/A THR 92.A N GLY 88.A O no hydrogen 3.301 N/A THR 92.A OG1 GLY 88.A O no hydrogen 2.943 N/A ILE 93.A N VAL 89.A O no hydrogen 2.899 N/A ASN 94.A N PRO 90.A O no hydrogen 3.170 N/A THR 95.A N SER 91.A O no hydrogen 2.948 N/A THR 95.A OG1 ILE 25.A O no hydrogen 2.721 N/A THR 95.A OG1 SER 91.A O no hydrogen 2.994 N/A ALA 96.A N THR 92.A O no hydrogen 3.128 N/A ASN 97.A N ILE 93.A O no hydrogen 3.153 N/A TYR 98.A N ASN 94.A O no hydrogen 2.906 N/A TYR 98.A OH GLU 22.A OE1 no hydrogen 2.825 N/A TYR 98.A OH GLU 22.A OE2 no hydrogen 2.995 N/A MET 99.A N THR 95.A O no hydrogen 3.090 N/A TYR 100.A N ALA 96.A O no hydrogen 3.148 N/A TYR 100.A N ASN 97.A O no hydrogen 3.013 N/A PHE 101.A N ASN 97.A O no hydrogen 3.425 N/A ARG 102.A N TYR 98.A O no hydrogen 3.081 N/A ALA 103.A N MET 99.A O no hydrogen 3.005 N/A MET 104.A N TYR 100.A O no hydrogen 3.179 N/A GLN 105.A N PHE 101.A O no hydrogen 3.146 N/A LEU 106.A N ARG 102.A O no hydrogen 3.290 N/A VAL 107.A N MET 104.A O no hydrogen 3.157 N/A SER 108.A N GLN 105.A O no hydrogen 3.364 N/A SER 108.A OG GLN 105.A O no hydrogen 3.209 N/A GLN 109.A N LEU 106.A O no hydrogen 2.931 N/A LEU 110.A N VAL 107.A O no hydrogen 3.088 N/A TYR 117.A N LYS 113.A O no hydrogen 3.070 N/A HIS 118.A N GLU 114.A O no hydrogen 3.214 N/A HIS 118.A ND1 HIS 118.A O no hydrogen 2.729 N/A ASN 119.A N PRO 115.A O no hydrogen 3.352 N/A LEU 120.A N LEU 116.A O no hydrogen 3.121 N/A ILE 121.A N TYR 117.A O no hydrogen 3.101 N/A THR 122.A N HIS 118.A O no hydrogen 3.278 N/A THR 122.A OG1 HIS 118.A O no hydrogen 2.863 N/A ILE 123.A N ASN 119.A O no hydrogen 3.023 N/A PHE 124.A N LEU 120.A O no hydrogen 3.025 N/A ASN 125.A N ILE 121.A O no hydrogen 2.987 N/A GLU 126.A N THR 122.A O no hydrogen 2.928 N/A GLU 127.A N ILE 123.A O no hydrogen 3.109 N/A LEU 128.A N PHE 124.A O no hydrogen 3.105 N/A ILE 129.A N ASN 125.A O no hydrogen 3.104 N/A ASN 130.A N GLU 126.A O no hydrogen 2.999 N/A ASN 130.A ND2 GLU 127.A OE2 no hydrogen 3.054 N/A LEU 131.A N GLU 127.A O no hydrogen 2.910 N/A HIS 132.A N LEU 128.A O no hydrogen 3.172 N/A ARG 133.A N ILE 129.A O no hydrogen 3.022 N/A GLY 134.A N ASN 130.A O no hydrogen 3.139 N/A GLN 135.A N LEU 131.A O no hydrogen 3.069 N/A GLN 135.A NE2 ASP 68.A OD1 no hydrogen 3.397 N/A GLN 135.A NE2 GLU 71.A OE2 no hydrogen 2.972 N/A GLY 136.A N HIS 132.A O no hydrogen 2.866 N/A LEU 137.A N ARG 133.A O no hydrogen 3.261 N/A ASP 138.A N GLY 134.A O no hydrogen 3.053 N/A ILE 139.A N GLN 135.A O no hydrogen 2.973 N/A TYR 140.A N GLY 136.A O no hydrogen 3.040 N/A TYR 140.A OH GLU 147.A OE1 no hydrogen 3.017 N/A TYR 140.A OH GLU 147.A OE2 no hydrogen 3.034 N/A TRP 141.A N LEU 137.A O no hydrogen 3.017 N/A ARG 142.A N ASP 138.A O no hydrogen 3.337 N/A ARG 142.A NE ASP 143.A OD1 no hydrogen 2.847 N/A ARG 142.A NH1 GLU 71.A O no hydrogen 3.287 N/A ARG 142.A NH1 ASP 72.A OD1 no hydrogen 2.815 N/A ARG 142.A NH1 GLU 212.A OE1 no hydrogen 3.406 N/A ARG 142.A NH2 GLU 71.A O no hydrogen 2.718 N/A ARG 142.A NH2 ASP 143.A OD1 no hydrogen 3.130 N/A ARG 142.A NH2 ASP 143.A OD2 no hydrogen 3.415 N/A ASP 143.A N ILE 139.A O no hydrogen 2.932 N/A PHE 144.A N TYR 140.A O no hydrogen 2.994 N/A GLU 147.A N PHE 144.A O no hydrogen 2.930 N/A GLN 152.A NE2 TYR 268.A OH no hydrogen 2.531 N/A MET 154.A N THR 151.A OG1 no hydrogen 3.228 N/A TYR 155.A N THR 151.A O no hydrogen 3.100 N/A TYR 155.A OH ASP 197.A OD1 no hydrogen 2.840 N/A LEU 156.A N GLN 152.A O no hydrogen 3.066 N/A ASN 157.A N GLU 153.A O no hydrogen 3.168 N/A MET 158.A N MET 154.A O no hydrogen 3.112 N/A VAL 159.A N TYR 155.A O no hydrogen 2.951 N/A MET 160.A N LEU 156.A O no hydrogen 3.022 N/A ASN 161.A N ASN 157.A O no hydrogen 3.402 N/A ASN 161.A N MET 158.A O no hydrogen 3.242 N/A ASN 161.A ND2 ASN 157.A O no hydrogen 2.891 N/A LYS 162.A N MET 158.A O no hydrogen 2.931 N/A LYS 162.A NZ ASP 138.A OD2 no hydrogen 2.866 N/A THR 163.A OG1 GLN 193.A OE1 no hydrogen 2.779 N/A GLY 164.A N VAL 159.A O no hydrogen 2.971 N/A GLY 165.A N ASN 161.A O no hydrogen 3.198 N/A ARG 168.A N GLY 164.A O no hydrogen 2.850 N/A ARG 168.A NE GLU 127.A OE1 no hydrogen 3.151 N/A ARG 168.A NE GLU 127.A OE2 no hydrogen 3.278 N/A ARG 168.A NH1 MET 160.A O no hydrogen 2.943 N/A ARG 168.A NH2 GLU 127.A OE2 no hydrogen 3.079 N/A ARG 168.A NH2 MET 160.A O no hydrogen 3.029 N/A LEU 169.A N GLY 165.A O no hydrogen 2.981 N/A THR 170.A N LEU 166.A O no hydrogen 3.263 N/A THR 170.A OG1 LEU 166.A O no hydrogen 3.234 N/A LEU 171.A N PHE 167.A O no hydrogen 3.333 N/A ARG 172.A N ARG 168.A O no hydrogen 2.838 N/A ARG 172.A NH1 GLU 126.A OE2 no hydrogen 3.086 N/A ARG 172.A NH1 GLU 127.A OE1 no hydrogen 2.820 N/A ARG 172.A NH2 GLU 126.A OE2 no hydrogen 2.855 N/A LEU 173.A N LEU 169.A O no hydrogen 3.214 N/A MET 174.A N THR 170.A O no hydrogen 3.224 N/A GLU 175.A N LEU 171.A O no hydrogen 2.879 N/A ALA 176.A N ARG 172.A O no hydrogen 3.005 N/A LEU 177.A N LEU 173.A O no hydrogen 3.189 N/A LEU 177.A N MET 174.A O no hydrogen 3.069 N/A SER 178.A N MET 174.A O no hydrogen 2.990 N/A SER 178.A N GLU 175.A O no hydrogen 3.399 N/A SER 178.A OG MET 43.A O no hydrogen 2.511 N/A SER 180.A OG GLU 175.A OE2 no hydrogen 3.364 N/A LEU 181.A N GLU 175.A OE1 no hydrogen 3.094 N/A VAL 182.A N SER 180.A OG no hydrogen 3.246 N/A ILE 185.A N LEU 181.A O no hydrogen 2.976 N/A ASN 186.A N VAL 182.A O no hydrogen 2.855 N/A LEU 187.A N PRO 183.A O no hydrogen 3.102 N/A LEU 188.A N PHE 184.A O no hydrogen 2.957 N/A GLY 189.A N ILE 185.A O no hydrogen 3.018 N/A ILE 190.A N ASN 186.A O no hydrogen 3.118 N/A ILE 191.A N LEU 187.A O no hydrogen 3.029 N/A TYR 192.A N LEU 188.A O no hydrogen 2.947 N/A GLN 193.A N GLY 189.A O no hydrogen 3.206 N/A GLN 193.A NE2 GLN 193.A O no hydrogen 3.268 N/A GLN 193.A NE2 ASP 197.A OD2 no hydrogen 3.038 N/A ILE 194.A N ILE 190.A O no hydrogen 3.028 N/A ARG 195.A N ILE 191.A O no hydrogen 3.024 N/A ASP 196.A N TYR 192.A O no hydrogen 3.106 N/A ASP 197.A N GLN 193.A O no hydrogen 3.130 N/A TYR 198.A N ILE 194.A O no hydrogen 2.989 N/A LEU 199.A N ARG 195.A O no hydrogen 2.931 N/A ASN 200.A N ASP 196.A O no hydrogen 3.156 N/A LEU 201.A N TYR 198.A O no hydrogen 3.149 N/A LYS 202.A N TYR 198.A O no hydrogen 3.044 N/A LYS 202.A NZ GLN 205.A OE1 no hydrogen 2.862 N/A ASP 203.A N LEU 199.A O no hydrogen 3.011 N/A GLN 205.A N LEU 201.A O no hydrogen 2.931 N/A GLN 205.A NE2 GLU 260.A OE1 no hydrogen 3.064 N/A ASP 209.A N ASN 200.A OD1 no hydrogen 3.091 N/A ILE 210.A N ALA 207.A O no hydrogen 3.052 N/A THR 211.A OG1 THR 246.A O no hydrogen 2.725 N/A GLU 212.A N GLU 208.A O no hydrogen 3.000 N/A GLY 213.A N ILE 210.A O no hydrogen 2.933 N/A LYS 214.A N ASP 209.A O no hydrogen 3.305 N/A PHE 217.A N ASP 197.A OD1 no hydrogen 3.018 N/A ILE 219.A N SER 216.A OG no hydrogen 3.344 N/A VAL 220.A N SER 216.A O no hydrogen 2.933 N/A HIS 221.A N PHE 217.A O no hydrogen 3.064 N/A HIS 221.A ND1 SER 265.A OG no hydrogen 2.798 N/A ALA 222.A N PRO 218.A O no hydrogen 2.984 N/A LEU 223.A N ILE 219.A O no hydrogen 2.935 N/A ASN 224.A N VAL 220.A O no hydrogen 3.209 N/A ASN 224.A ND2 PRO 150.A O no hydrogen 3.067 N/A ASN 224.A ND2 VAL 220.A O no hydrogen 2.803 N/A PHE 225.A N HIS 221.A O no hydrogen 2.952 N/A THR 226.A N ALA 222.A O no hydrogen 2.989 N/A THR 226.A OG1 ALA 222.A O no hydrogen 2.993 N/A THR 226.A OG1 LEU 223.A O no hydrogen 3.242 N/A THR 226.A OG1 HIS 235.A ND1 no hydrogen 3.219 N/A LYS 227.A N LEU 223.A O no hydrogen 3.205 N/A THR 228.A N ASN 224.A O no hydrogen 2.952 N/A THR 228.A OG1 ASN 224.A O no hydrogen 3.025 N/A LYS 229.A N PHE 225.A O no hydrogen 2.950 N/A GLY 230.A N LYS 227.A O no hydrogen 3.185 N/A GLN 231.A N THR 226.A O no hydrogen 2.946 N/A GLN 231.A NE2 ASP 262.A OD2 no hydrogen 2.632 N/A THR 232.A N GLY 230.A O no hydrogen 2.910 N/A HIS 235.A N GLN 231.A O no hydrogen 3.047 N/A HIS 235.A ND1 LEU 223.A O no hydrogen 3.170 N/A HIS 235.A ND1 THR 226.A OG1 no hydrogen 3.219 N/A ASN 236.A N THR 232.A O no hydrogen 3.110 N/A GLU 237.A N GLU 233.A O no hydrogen 2.919 N/A ILE 238.A N GLN 234.A O no hydrogen 3.013 N/A LEU 239.A N HIS 235.A O no hydrogen 3.313 N/A ARG 240.A N ASN 236.A O no hydrogen 3.002 N/A ARG 240.A NE GLU 237.A OE1 no hydrogen 2.935 N/A ARG 240.A NH2 GLU 237.A OE2 no hydrogen 2.980 N/A ILE 241.A N GLU 237.A O no hydrogen 3.045 N/A LEU 242.A N ILE 238.A O no hydrogen 3.187 N/A LEU 243.A N LEU 239.A O no hydrogen 2.988 N/A LEU 244.A N ARG 240.A O no hydrogen 3.135 N/A LEU 244.A N ILE 241.A O no hydrogen 3.079 N/A ARG 245.A N LEU 242.A O no hydrogen 3.383 N/A ARG 245.A NH1 LEU 242.A O no hydrogen 2.983 N/A ARG 245.A NH2 ARG 142.A O no hydrogen 3.131 N/A ASP 248.A N THR 246.A OG1 no hydrogen 2.927 N/A ILE 251.A N ASP 248.A OD1 no hydrogen 3.027 N/A LYS 252.A N ASP 248.A O no hydrogen 3.172 N/A LYS 252.A NZ PHE 206.A O no hydrogen 2.535 N/A LEU 253.A N LYS 249.A O no hydrogen 3.055 N/A LYS 254.A N ASP 250.A O no hydrogen 2.890 N/A LYS 254.A NZ GLU 237.A OE2 no hydrogen 2.796 N/A LEU 255.A N ILE 251.A O no hydrogen 3.173 N/A ILE 256.A N LYS 252.A O no hydrogen 3.166 N/A GLN 257.A N LEU 253.A O no hydrogen 2.971 N/A ILE 258.A N LYS 254.A O no hydrogen 3.033 N/A LEU 259.A N LEU 255.A O no hydrogen 3.099 N/A GLU 260.A N ILE 256.A O no hydrogen 2.942 N/A PHE 261.A N GLN 257.A O no hydrogen 2.990 N/A ASP 262.A N ILE 258.A O no hydrogen 2.974 N/A THR 263.A N ILE 258.A O no hydrogen 3.236 N/A THR 263.A OG1 LEU 259.A O no hydrogen 3.530 N/A THR 263.A OG1 SER 265.A OG no hydrogen 2.745 N/A SER 265.A N LEU 259.A O no hydrogen 2.898 N/A SER 265.A OG HIS 221.A ND1 no hydrogen 2.798 N/A SER 265.A OG THR 263.A OG1 no hydrogen 2.745 N/A TYR 268.A N ASN 264.A O no hydrogen 3.151 N/A THR 269.A N SER 265.A O no hydrogen 3.008 N/A THR 269.A OG1 SER 265.A O no hydrogen 2.792 N/A LYS 270.A N LEU 266.A O no hydrogen 3.089 N/A ASN 271.A N ALA 267.A O no hydrogen 3.199 N/A PHE 272.A N TYR 268.A O no hydrogen 3.000 N/A ILE 273.A N THR 269.A O no hydrogen 2.995 N/A ASN 274.A N LYS 270.A O no hydrogen 3.073 N/A GLN 275.A N ASN 271.A O no hydrogen 2.949 N/A LEU 276.A N PHE 272.A O no hydrogen 3.257 N/A LEU 276.A N ILE 273.A O no hydrogen 3.093 N/A VAL 277.A N ILE 273.A O no hydrogen 3.099 N/A ASN 278.A N ASN 274.A O no hydrogen 3.046 N/A MET 279.A N GLN 275.A O no hydrogen 3.350 N/A ILE 280.A N VAL 277.A O no hydrogen 3.186 N/A LYS 281.A N VAL 277.A O no hydrogen 2.840 N/A ASN 282.A N ASN 278.A O no hydrogen 2.707 N/A