Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pzt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 3.A N ILE 46.A O no hydrogen 3.032 N/A SER 7.A OG ARG 77.A O no hydrogen 2.656 N/A LEU 9.A N SER 7.A OG no hydrogen 3.098 N/A VAL 11.A N ASP 129.A OD1 no hydrogen 2.741 N/A GLY 12.A N ASP 129.A OD2 no hydrogen 2.685 N/A MET 14.A N MET 127.A O no hydrogen 2.856 N/A GLU 17.A N TYR 70.A OH no hydrogen 3.040 N/A LEU 26.A N ASP 23.A OD1 no hydrogen 2.869 N/A VAL 27.A N ASP 23.A O no hydrogen 3.312 N/A GLU 28.A N LEU 24.A O no hydrogen 2.931 N/A GLN 29.A N LYS 25.A O no hydrogen 3.197 N/A GLN 30.A N LEU 26.A O no hydrogen 3.165 N/A ASN 31.A N VAL 27.A O no hydrogen 3.145 N/A ASN 31.A ND2 VAL 27.A O no hydrogen 2.912 N/A VAL 34.A N ASN 31.A O no hydrogen 3.332 N/A LYS 35.A N ARG 39.A O no hydrogen 2.769 N/A LYS 35.A NZ THR 41.A OG1 no hydrogen 3.419 N/A GLY 37.A N TYR 257.A O no hydrogen 2.722 N/A GLY 38.A N LYS 35.A O no hydrogen 2.933 N/A ARG 39.A N LYS 35.A O no hydrogen 3.091 N/A ARG 39.A NH1 ASP 81.A OD1 no hydrogen 3.020 N/A ARG 39.A NH1 TYR 82.A O no hydrogen 2.798 N/A ARG 39.A NH2 ASP 81.A OD1 no hydrogen 3.353 N/A TYR 40.A N TYR 82.A O no hydrogen 3.025 N/A THR 41.A OG1 ASP 81.A OD1 no hydrogen 2.945 N/A CYS 45.A SG GLN 79.A OE1 no hydrogen 3.851 N/A ILE 46.A N THR 1.A O no hydrogen 2.601 N/A SER 47.A OG HIS 49.A O no hydrogen 3.451 N/A SER 47.A OG GLN 79.A O no hydrogen 3.100 N/A HIS 49.A N SER 47.A OG no hydrogen 3.255 N/A LYS 50.A N ASN 115.A OD1 no hydrogen 3.196 N/A LYS 50.A NZ ASP 113.A O no hydrogen 3.000 N/A LYS 50.A NZ ASP 113.A OD2 no hydrogen 2.897 N/A VAL 51.A N ASP 81.A O no hydrogen 2.845 N/A ALA 52.A N CYS 116.A O no hydrogen 3.049 N/A ILE 53.A N GLY 83.A O no hydrogen 3.054 N/A ILE 54.A N VAL 118.A O no hydrogen 2.685 N/A ILE 55.A N TYR 85.A O no hydrogen 2.927 N/A PHE 57.A N ILE 87.A O no hydrogen 2.918 N/A ARG 58.A NH1 SER 93.A O no hydrogen 3.023 N/A ARG 58.A NH2 SER 93.A O no hydrogen 2.800 N/A ARG 60.A NH1 ASN 59.A O no hydrogen 2.976 N/A LEU 64.A N ARG 60.A O no hydrogen 3.151 N/A LYS 65.A N GLN 61.A O no hydrogen 3.206 N/A TYR 66.A OH ILE 20.A O no hydrogen 2.536 N/A TRP 67.A N HIS 63.A O no hydrogen 3.062 N/A LEU 68.A N LEU 64.A O no hydrogen 2.982 N/A TYR 69.A N LYS 65.A O no hydrogen 2.991 N/A TYR 70.A N TYR 66.A O no hydrogen 3.147 N/A TYR 70.A OH GLU 17.A O no hydrogen 2.516 N/A LEU 71.A N TRP 67.A O no hydrogen 2.879 N/A HIS 72.A N LEU 68.A O no hydrogen 3.216 N/A HIS 72.A ND1 TYR 82.A OH no hydrogen 2.947 N/A HIS 72.A NE2 LEU 259.A O no hydrogen 3.141 N/A LEU 75.A N LEU 71.A O no hydrogen 2.851 N/A GLN 76.A N HIS 72.A O no hydrogen 3.217 N/A ARG 77.A N PRO 73.A O no hydrogen 3.041 N/A ARG 77.A NE ASP 129.A OD1 no hydrogen 3.141 N/A ARG 77.A NH1 ASP 129.A OD1 no hydrogen 3.288 N/A GLN 78.A N ILE 74.A O no hydrogen 2.912 N/A GLN 78.A NE2 ASP 129.A O no hydrogen 3.052 N/A GLN 78.A NE2 ASN 131.A O no hydrogen 3.259 N/A GLN 79.A N GLN 76.A O no hydrogen 3.009 N/A ASP 81.A N HIS 49.A O no hydrogen 3.158 N/A TYR 82.A N TYR 40.A O no hydrogen 3.017 N/A TYR 82.A OH HIS 72.A ND1 no hydrogen 2.947 N/A GLY 83.A N VAL 51.A O no hydrogen 3.067 N/A ILE 84.A N GLY 38.A O no hydrogen 3.317 N/A TYR 85.A N ILE 53.A O no hydrogen 2.973 N/A TYR 85.A OH ASP 111.A OD2 no hydrogen 2.939 N/A TYR 85.A OH TYR 114.A OH no hydrogen 2.662 N/A VAL 86.A N THR 261.A O no hydrogen 2.829 N/A ILE 87.A N ILE 55.A O no hydrogen 2.941 N/A ASN 88.A N ILE 263.A O no hydrogen 2.894 N/A ASN 88.A ND2 THR 264.A OG1 no hydrogen 3.222 N/A GLN 89.A N PHE 57.A O no hydrogen 3.099 N/A GLN 89.A NE2 MET 94.A O no hydrogen 3.158 N/A ALA 90.A N VAL 265.A O no hydrogen 3.008 N/A ASN 96.A N GLN 89.A OE1 no hydrogen 3.105 N/A ASN 96.A ND2 ASN 178.A O no hydrogen 2.951 N/A ARG 97.A NE ASP 121.A OD1 no hydrogen 2.823 N/A ARG 97.A NH1 GLU 186.A OE1 no hydrogen 3.233 N/A ARG 97.A NH2 ASP 121.A OD1 no hydrogen 3.393 N/A ARG 97.A NH2 GLY 161.A O no hydrogen 3.420 N/A LYS 99.A N ASN 96.A OD1 no hydrogen 3.133 N/A LYS 99.A NZ ILE 267.A O no hydrogen 3.005 N/A LYS 99.A NZ SER 271.A OG no hydrogen 2.948 N/A LEU 100.A N ASN 96.A O no hydrogen 3.266 N/A LEU 101.A N ARG 97.A O no hydrogen 3.073 N/A ASN 102.A N ALA 98.A O no hydrogen 3.108 N/A ASN 102.A ND2 PHE 176.A O no hydrogen 2.820 N/A ASN 102.A ND2 ASN 178.A OD1 no hydrogen 2.906 N/A VAL 103.A N LYS 99.A O no hydrogen 3.142 N/A GLY 104.A N LEU 100.A O no hydrogen 2.995 N/A PHE 105.A N LEU 101.A O no hydrogen 3.216 N/A LYS 106.A N ASN 102.A O no hydrogen 3.187 N/A GLU 107.A N VAL 103.A O no hydrogen 2.868 N/A ALA 108.A N GLY 104.A O no hydrogen 2.926 N/A LEU 109.A N PHE 105.A O no hydrogen 3.297 N/A LYS 110.A N GLU 107.A O no hydrogen 3.069 N/A LYS 110.A NZ GLU 107.A OE2 no hydrogen 2.744 N/A ASP 111.A N ALA 108.A O no hydrogen 2.972 N/A TYR 112.A N ALA 108.A O no hydrogen 3.324 N/A TYR 112.A OH ASP 81.A OD2 no hydrogen 2.701 N/A TYR 114.A N TYR 112.A O no hydrogen 2.951 N/A TYR 114.A OH TYR 85.A OH no hydrogen 2.662 N/A ASN 115.A N LYS 50.A O no hydrogen 3.063 N/A ASN 115.A ND2 PRO 48.A O no hydrogen 3.117 N/A CYS 116.A N LYS 50.A O no hydrogen 3.297 N/A PHE 117.A N LEU 165.A O no hydrogen 2.993 N/A VAL 118.A N ALA 52.A O no hydrogen 2.940 N/A PHE 119.A N SER 163.A O no hydrogen 2.966 N/A SER 120.A N ILE 54.A O no hydrogen 2.976 N/A SER 120.A OG ASP 121.A O no hydrogen 2.934 N/A ASP 121.A N GLY 161.A O no hydrogen 3.244 N/A ILE 125.A N ARG 212.A O no hydrogen 2.842 N/A MET 127.A N LYS 210.A O no hydrogen 2.909 N/A ASP 129.A N GLY 12.A O no hydrogen 3.170 N/A ASN 131.A N ASN 128.A O no hydrogen 3.160 N/A ASN 131.A ND2 ILE 142.A O no hydrogen 3.121 N/A THR 132.A OG1 HIS 130.A O no hydrogen 3.367 N/A TYR 133.A N GLN 78.A OE1 no hydrogen 3.013 N/A ARG 140.A N ALA 164.A O no hydrogen 2.978 N/A ARG 140.A NH2 SER 202.A OG no hydrogen 2.921 N/A HIS 141.A N SER 202.A O no hydrogen 2.968 N/A HIS 141.A NE2 GLY 160.A O no hydrogen 3.031 N/A ILE 142.A N VAL 162.A O no hydrogen 3.003 N/A SER 143.A N VAL 162.A O no hydrogen 3.387 N/A VAL 144.A N ILE 142.A O no hydrogen 2.922 N/A ALA 145.A N GLY 209.A O no hydrogen 3.241 N/A ASP 147.A N THR 211.A O no hydrogen 3.043 N/A PHE 149.A N MET 146.A O no hydrogen 2.991 N/A GLY 150.A N ASP 147.A O no hydrogen 3.032 N/A PHE 151.A N MET 146.A O no hydrogen 2.907 N/A SER 152.A OG GLY 150.A O no hydrogen 3.479 N/A TYR 155.A OH ASP 188.A OD1 no hydrogen 2.755 N/A GLN 157.A N GLN 157.A OE1 no hydrogen 2.890 N/A TYR 158.A N TYR 155.A O no hydrogen 3.042 N/A VAL 162.A N SER 143.A OG no hydrogen 2.953 N/A SER 163.A N PHE 119.A O no hydrogen 3.186 N/A ALA 164.A N ARG 140.A O no hydrogen 2.820 N/A LEU 165.A N PHE 117.A O no hydrogen 3.003 N/A SER 166.A N GLN 169.A OE1 no hydrogen 2.948 N/A LYS 167.A N ASN 115.A O no hydrogen 3.115 N/A GLN 169.A N SER 166.A OG no hydrogen 3.051 N/A GLN 169.A NE2 PHE 136.A O no hydrogen 3.036 N/A PHE 170.A N SER 166.A O no hydrogen 2.986 N/A LEU 171.A N LYS 167.A O no hydrogen 3.010 N/A SER 172.A N GLN 168.A O no hydrogen 3.022 N/A ILE 173.A N PHE 170.A O no hydrogen 3.342 N/A ASN 174.A N LEU 171.A O no hydrogen 3.166 N/A ASN 174.A ND2 MET 239.A O no hydrogen 2.974 N/A ASN 174.A ND2 ASN 245.A OD1 no hydrogen 3.126 N/A GLY 175.A N PHE 170.A O no hydrogen 3.088 N/A PHE 176.A N ASN 102.A OD1 no hydrogen 2.991 N/A ASN 178.A N ASP 242.A OD1 no hydrogen 3.128 N/A ASN 178.A ND2 ASP 242.A OD1 no hydrogen 3.478 N/A ASN 178.A ND2 GLY 243.A O no hydrogen 2.945 N/A TYR 180.A OH ASP 189.A OD1 no hydrogen 3.049 N/A GLY 182.A N PHE 95.A O no hydrogen 3.015 N/A GLU 186.A N GLU 186.A OE2 no hydrogen 2.973 N/A ASP 189.A N GLY 185.A O no hydrogen 3.221 N/A ILE 190.A N GLU 186.A O no hydrogen 3.211 N/A TYR 191.A N ASP 187.A O no hydrogen 3.256 N/A ASN 192.A N ASP 188.A O no hydrogen 3.055 N/A ASN 192.A ND2 THR 235.A OG1 no hydrogen 3.406 N/A ARG 193.A N ASP 189.A O no hydrogen 2.933 N/A ARG 193.A NE ASP 189.A OD2 no hydrogen 2.959 N/A ARG 193.A NH1 ILE 173.A O no hydrogen 3.315 N/A ARG 193.A NH1 GLY 175.A O no hydrogen 3.093 N/A ARG 193.A NH1 ASP 242.A O no hydrogen 3.148 N/A ARG 193.A NH2 ASP 242.A O no hydrogen 2.809 N/A LEU 194.A N ILE 190.A O no hydrogen 3.108 N/A ALA 195.A N TYR 191.A O no hydrogen 3.167 N/A PHE 196.A N ASN 192.A O no hydrogen 2.955 N/A ARG 197.A N ARG 193.A O no hydrogen 3.154 N/A ARG 197.A N LEU 194.A O no hydrogen 3.163 N/A ARG 197.A NH1 SER 172.A O no hydrogen 2.353 N/A GLY 198.A N ALA 195.A O no hydrogen 3.121 N/A MET 199.A N LEU 194.A O no hydrogen 2.939 N/A SER 200.A N GLN 138.A OE1 no hydrogen 2.940 N/A SER 202.A N PRO 139.A O no hydrogen 2.888 N/A ARG 203.A NE HIS 141.A ND1 no hydrogen 2.851 N/A ARG 203.A NH1 VAL 156.A O no hydrogen 3.156 N/A ARG 203.A NH2 HIS 141.A ND1 no hydrogen 3.550 N/A ARG 203.A NH2 VAL 156.A O no hydrogen 3.031 N/A ARG 203.A NH2 TYR 158.A O no hydrogen 2.805 N/A GLY 209.A N ASN 205.A O no hydrogen 2.893 N/A LYS 210.A N VAL 207.A O no hydrogen 3.437 N/A THR 211.A N ALA 145.A O no hydrogen 2.907 N/A THR 211.A OG1 GLY 209.A O no hydrogen 3.089 N/A ARG 212.A N ILE 125.A O no hydrogen 2.830 N/A ARG 212.A NE ILE 16.A O no hydrogen 3.065 N/A MET 213.A N ASP 147.A OD1 no hydrogen 3.213 N/A MET 213.A N ASP 147.A OD2 no hydrogen 3.417 N/A ILE 214.A N ASP 123.A O no hydrogen 2.924 N/A ASN 225.A ND2 PHE 149.A O no hydrogen 3.263 N/A ARG 228.A NH2 ASN 192.A OD1 no hydrogen 3.222 N/A PHE 229.A N ASP 188.A OD2 no hydrogen 3.158 N/A THR 235.A N ARG 231.A O no hydrogen 3.000 N/A THR 235.A OG1 ASP 189.A OD1 no hydrogen 2.839 N/A THR 235.A OG1 ARG 231.A O no hydrogen 3.245 N/A LYS 236.A N ILE 232.A O no hydrogen 3.151 N/A GLU 237.A N ALA 233.A O no hydrogen 3.197 N/A THR 238.A N HIS 234.A O no hydrogen 3.215 N/A THR 238.A N THR 235.A O no hydrogen 3.185 N/A THR 238.A OG1 HIS 234.A O no hydrogen 2.966 N/A MET 239.A N THR 235.A O no hydrogen 2.876 N/A SER 241.A N THR 238.A O no hydrogen 3.147 N/A SER 241.A OG THR 238.A O no hydrogen 3.450 N/A GLY 243.A N SER 246.A OG no hydrogen 3.170 N/A LEU 244.A N ASN 174.A O no hydrogen 2.830 N/A ASN 245.A N ASN 174.A OD1 no hydrogen 2.980 N/A ASN 245.A ND2 LEU 240.A O no hydrogen 3.101 N/A SER 246.A N GLY 243.A O no hydrogen 3.002 N/A SER 246.A OG GLY 243.A O no hydrogen 3.359 N/A SER 246.A OG SER 271.A O no hydrogen 2.885 N/A LEU 247.A N LEU 244.A O no hydrogen 3.386 N/A THR 248.A N SER 271.A OG no hydrogen 3.308 N/A THR 248.A OG1 THR 269.A OG1 no hydrogen 3.009 N/A THR 248.A OG1 PRO 270.A O no hydrogen 2.851 N/A THR 248.A OG1 SER 271.A OG no hydrogen 3.421 N/A TYR 249.A OH GLU 107.A OE2 no hydrogen 2.790 N/A MET 250.A N ASP 266.A O no hydrogen 3.185 N/A LEU 252.A N THR 264.A O no hydrogen 2.859 N/A GLU 253.A N THR 264.A O no hydrogen 3.335 N/A GLN 255.A N LYS 262.A O no hydrogen 2.871 N/A ARG 256.A NH1 ASP 111.A OD2 no hydrogen 3.010 N/A ARG 256.A NH1 THR 261.A OG1 no hydrogen 3.215 N/A ARG 256.A NH2 ASP 111.A OD1 no hydrogen 3.013 N/A TYR 257.A N TYR 260.A O no hydrogen 2.873 N/A THR 261.A N ILE 84.A O no hydrogen 3.078 N/A THR 261.A OG1 GLY 37.A O no hydrogen 3.295 N/A LYS 262.A N GLN 255.A O no hydrogen 2.904 N/A ILE 263.A N VAL 86.A O no hydrogen 2.907 N/A THR 264.A N GLU 253.A O no hydrogen 2.967 N/A VAL 265.A N ASN 88.A O no hydrogen 2.856 N/A ASP 266.A N MET 250.A O no hydrogen 2.942 N/A GLY 268.A N ASP 266.A OD1 no hydrogen 2.772 N/A THR 269.A OG1 THR 248.A O no hydrogen 2.490 N/A THR 269.A OG1 THR 248.A OG1 no hydrogen 3.009 N/A SER 271.A OG SER 246.A O no hydrogen 3.225 N/A SER 271.A OG THR 248.A OG1 no hydrogen 3.421 N/A