Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pnn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH GLU 18.A O no hydrogen 2.578 N/A ARG 5.A NH1 ASP 9.A OD1 no hydrogen 2.803 N/A SER 6.A N ASP 3.A OD1 no hydrogen 2.793 N/A PHE 8.A N ARG 4.A O no hydrogen 3.162 N/A ASP 9.A N ARG 5.A O no hydrogen 3.093 N/A ALA 10.A N SER 6.A O no hydrogen 3.270 N/A VAL 11.A N ILE 7.A O no hydrogen 2.846 N/A ALA 12.A N PHE 8.A O no hydrogen 3.144 N/A GLN 13.A N ALA 10.A O no hydrogen 3.287 N/A GLN 13.A NE2 ASP 9.A O no hydrogen 3.532 N/A SER 14.A N VAL 11.A O no hydrogen 3.065 N/A SER 14.A OG ASN 59.A OD1 no hydrogen 2.664 N/A ASN 15.A N ALA 10.A O no hydrogen 3.169 N/A CYS 16.A SG ASP 60.A O no hydrogen 3.399 N/A CYS 16.A SG ASP 60.A OD1 no hydrogen 3.656 N/A GLU 20.A N GLN 17.A O no hydrogen 2.534 N/A LEU 22.A N LEU 19.A O no hydrogen 3.390 N/A PHE 25.A N LEU 22.A O no hydrogen 2.814 N/A ARG 28.A N PRO 24.A O no hydrogen 3.396 N/A ARG 28.A N PHE 25.A O no hydrogen 3.197 N/A ARG 28.A NE ARG 28.A O no hydrogen 3.360 N/A SER 29.A N PHE 25.A O no hydrogen 3.144 N/A SER 29.A OG PHE 25.A O no hydrogen 2.950 N/A ARG 32.A N ASP 35.A OD2 no hydrogen 3.142 N/A ASP 35.A N ARG 32.A O no hydrogen 2.803 N/A PHE 38.A N ASP 35.A O no hydrogen 2.884 N/A LYS 39.A N SER 36.A O no hydrogen 3.315 N/A LYS 39.A NZ THR 34.A O no hydrogen 3.448 N/A ASP 40.A N LYS 45.A O no hydrogen 3.032 N/A THR 43.A N ASP 40.A O no hydrogen 3.276 N/A THR 43.A OG1 ASP 40.A OD2 no hydrogen 2.966 N/A GLY 44.A N ASP 40.A O no hydrogen 2.771 N/A LYS 45.A N THR 43.A OG1 no hydrogen 3.360 N/A LEU 49.A N THR 46.A OG1 no hydrogen 3.340 N/A LYS 50.A N THR 46.A O no hydrogen 2.816 N/A ALA 51.A N CYS 47.A O no hydrogen 2.724 N/A ASN 53.A N LYS 50.A O no hydrogen 2.772 N/A ASN 53.A ND2 LYS 50.A O no hydrogen 2.505 N/A HIS 55.A N GLN 58.A O no hydrogen 3.256 N/A HIS 55.A ND1 GLN 58.A O no hydrogen 3.057 N/A GLN 58.A N HIS 55.A O no hydrogen 3.029 N/A ASN 59.A ND2 VAL 11.A O no hydrogen 3.648 N/A ASN 59.A ND2 ALA 51.A O no hydrogen 3.447 N/A ASN 59.A ND2 ASN 53.A O no hydrogen 2.977 N/A THR 61.A N ASN 59.A OD1 no hydrogen 3.221 N/A LEU 64.A N ASP 60.A O no hydrogen 2.993 N/A LEU 65.A N THR 61.A O no hydrogen 2.603 N/A LEU 66.A N ILE 62.A O no hydrogen 2.780 N/A ASP 67.A N ALA 63.A O no hydrogen 3.139 N/A VAL 68.A N LEU 64.A O no hydrogen 2.982 N/A ALA 69.A N LEU 65.A O no hydrogen 3.200 N/A ALA 69.A N LEU 66.A O no hydrogen 2.693 N/A ARG 70.A N LEU 66.A O no hydrogen 3.170 N/A LYS 71.A N ASP 67.A O no hydrogen 3.306 N/A THR 72.A N VAL 68.A O no hydrogen 3.330 N/A SER 74.A OG ALA 69.A O no hydrogen 3.535 N/A PHE 78.A N SER 74.A O no hydrogen 2.965 N/A VAL 79.A N LEU 75.A O no hydrogen 3.171 N/A ASN 80.A ND2 GLY 112.A O no hydrogen 3.369 N/A ALA 81.A N PHE 78.A O no hydrogen 3.422 N/A TYR 83.A N GLN 91.A O no hydrogen 2.965 N/A THR 84.A N THR 43.A O no hydrogen 2.679 N/A THR 84.A OG1 THR 43.A O no hydrogen 3.427 N/A TYR 87.A OH ARG 130.A O no hydrogen 3.378 N/A TYR 87.A OH PRO 131.A O no hydrogen 3.072 N/A TYR 88.A N ASP 85.A OD1 no hydrogen 3.373 N/A TYR 88.A N ASP 85.A OD2 no hydrogen 3.414 N/A GLY 90.A N TYR 83.A O no hydrogen 2.786 N/A GLN 91.A N TYR 88.A O no hydrogen 2.899 N/A GLN 91.A NE2 GLU 99.A OE1 no hydrogen 2.719 N/A THR 92.A N HIS 95.A ND1 no hydrogen 2.844 N/A THR 92.A OG1 HIS 95.A ND1 no hydrogen 2.686 N/A HIS 95.A N THR 92.A O no hydrogen 3.084 N/A HIS 95.A N THR 92.A OG1 no hydrogen 3.332 N/A HIS 95.A NE2 ALA 117.A O no hydrogen 2.757 N/A ILE 96.A N THR 92.A O no hydrogen 3.426 N/A ALA 97.A N ALA 93.A O no hydrogen 3.065 N/A ILE 98.A N LEU 94.A O no hydrogen 3.258 N/A GLU 99.A N HIS 95.A O no hydrogen 2.859 N/A ARG 100.A N ILE 96.A O no hydrogen 2.849 N/A ARG 101.A N ILE 98.A O no hydrogen 2.587 N/A ARG 101.A NH2 THR 146.A O no hydrogen 2.870 N/A ASN 102.A N ALA 97.A O no hydrogen 2.953 N/A ASN 102.A ND2 GLY 57.A O no hydrogen 2.910 N/A LEU 104.A N ASN 102.A OD1 no hydrogen 3.392 N/A VAL 105.A N ASN 102.A O no hydrogen 2.926 N/A LEU 107.A N THR 103.A O no hydrogen 2.916 N/A LEU 108.A N LEU 104.A O no hydrogen 3.009 N/A VAL 109.A N VAL 105.A O no hydrogen 2.975 N/A GLU 110.A N THR 106.A O no hydrogen 3.092 N/A ASN 111.A N LEU 107.A O no hydrogen 3.059 N/A ASN 111.A ND2 LEU 107.A O no hydrogen 2.688 N/A GLY 112.A N VAL 109.A O no hydrogen 3.118 N/A ALA 113.A N LEU 108.A O no hydrogen 2.778 N/A ASP 114.A N ASN 80.A OD1 no hydrogen 2.690 N/A GLN 116.A N ASP 114.A OD1 no hydrogen 3.183 N/A ALA 119.A N GLU 137.A O no hydrogen 2.683 N/A ASN 120.A N LYS 89.A O no hydrogen 2.981 N/A GLY 121.A N LYS 89.A O no hydrogen 2.988 N/A ASP 122.A N SER 86.A O no hydrogen 2.877 N/A PHE 123.A N TYR 87.A O no hydrogen 2.791 N/A PHE 124.A N GLY 121.A O no hydrogen 2.817 N/A LYS 125.A N ASP 122.A O no hydrogen 3.469 N/A ARG 130.A N THR 127.A OG1 no hydrogen 2.757 N/A GLY 132.A N LYS 125.A O no hydrogen 3.213 N/A PHE 133.A N PHE 123.A O no hydrogen 2.896 N/A TYR 134.A OH ASP 169.A OD1 no hydrogen 2.564 N/A LEU 138.A N GLY 136.A O no hydrogen 2.783 N/A LEU 142.A N LEU 138.A O no hydrogen 2.928 N/A ALA 143.A N PRO 139.A O no hydrogen 2.746 N/A ALA 144.A N LEU 140.A O no hydrogen 2.891 N/A CYS 145.A N SER 141.A O no hydrogen 2.856 N/A CYS 145.A SG SER 141.A O no hydrogen 3.357 N/A THR 146.A N LEU 142.A O no hydrogen 2.984 N/A THR 146.A OG1 LEU 142.A O no hydrogen 3.143 N/A ASN 147.A N ALA 144.A O no hydrogen 2.562 N/A GLN 148.A N ALA 143.A O no hydrogen 2.817 N/A GLN 148.A NE2 ILE 98.A O no hydrogen 3.161 N/A GLN 148.A NE2 THR 146.A OG1 no hydrogen 2.649 N/A VAL 152.A N GLN 148.A O no hydrogen 3.088 N/A LYS 153.A N LEU 149.A O no hydrogen 2.832 N/A PHE 154.A N ALA 150.A O no hydrogen 2.806 N/A LEU 155.A N ILE 151.A O no hydrogen 2.782 N/A LEU 156.A N VAL 152.A O no hydrogen 3.168 N/A GLN 157.A N LYS 153.A O no hydrogen 2.734 N/A ASN 158.A N PHE 154.A O no hydrogen 3.123 N/A ASN 158.A ND2 PHE 154.A O no hydrogen 2.674 N/A ASN 158.A ND2 GLN 161.A O no hydrogen 2.944 N/A GLN 161.A N ASN 158.A OD1 no hydrogen 2.569 N/A ALA 163.A N LEU 155.A O no hydrogen 2.900 N/A ASP 164.A N GLN 116.A OE1 no hydrogen 2.738 N/A SER 166.A N ASP 164.A OD1 no hydrogen 2.662 N/A SER 166.A OG ASP 164.A OD1 no hydrogen 2.875 N/A ALA 167.A N ASP 164.A O no hydrogen 3.275 N/A ASP 169.A N ASN 173.A O no hydrogen 2.757 N/A SER 170.A N GLU 137.A OE2 no hydrogen 3.228 N/A SER 170.A OG GLU 137.A OE1 no hydrogen 3.148 N/A VAL 171.A N ASP 169.A OD2 no hydrogen 2.790 N/A GLY 172.A N ASP 169.A O no hydrogen 2.738 N/A ASN 173.A N ASP 169.A OD2 no hydrogen 2.928 N/A ASN 173.A ND2 TYR 134.A OH no hydrogen 3.066 N/A HIS 177.A N THR 174.A OG1 no hydrogen 3.351 N/A ALA 178.A N THR 174.A O no hydrogen 2.705 N/A LEU 179.A N VAL 175.A O no hydrogen 3.020 N/A VAL 180.A N LEU 176.A O no hydrogen 3.196 N/A GLU 181.A N HIS 177.A O no hydrogen 2.990 N/A VAL 182.A N ALA 178.A O no hydrogen 2.876 N/A VAL 182.A N LEU 179.A O no hydrogen 3.047 N/A ALA 183.A N LEU 179.A O no hydrogen 3.159 N/A ASP 184.A N ASN 189.A OD1 no hydrogen 2.677 N/A ASN 185.A ND2 GLY 231.A O no hydrogen 3.153 N/A THR 186.A N ASP 184.A OD2 no hydrogen 3.106 N/A THR 186.A OG1 ASP 184.A OD2 no hydrogen 2.820 N/A ASN 189.A N THR 186.A O no hydrogen 3.004 N/A ASN 189.A ND2 VAL 182.A O no hydrogen 3.378 N/A THR 190.A N THR 186.A O no hydrogen 2.998 N/A LYS 191.A N VAL 187.A O no hydrogen 3.120 N/A PHE 192.A N ASP 188.A O no hydrogen 3.196 N/A VAL 193.A N ASN 189.A O no hydrogen 2.980 N/A THR 194.A N THR 190.A O no hydrogen 2.682 N/A TYR 196.A OH GLU 213.A OE2 no hydrogen 3.338 N/A ASN 197.A N THR 194.A O no hydrogen 3.127 N/A GLU 198.A N SER 195.A O no hydrogen 2.728 N/A LEU 200.A N TYR 196.A O no hydrogen 3.062 N/A ILE 201.A N ASN 197.A O no hydrogen 2.945 N/A LEU 202.A N GLU 198.A O no hydrogen 3.088 N/A GLY 203.A N ILE 199.A O no hydrogen 2.797 N/A ALA 204.A N LEU 200.A O no hydrogen 2.877 N/A LYS 205.A N ILE 201.A O no hydrogen 3.045 N/A LEU 206.A N LEU 202.A O no hydrogen 2.925 N/A HIS 207.A N GLY 203.A O no hydrogen 2.622 N/A LEU 210.A N HIS 207.A O no hydrogen 3.376 N/A GLU 214.A N LYS 211.A O no hydrogen 3.326 N/A ILE 215.A N LEU 212.A O no hydrogen 3.357 N/A ASN 217.A N LEU 221.A O no hydrogen 2.811 N/A ASN 217.A ND2 ASN 173.A OD1 no hydrogen 3.171 N/A ARG 218.A N VAL 171.A O no hydrogen 2.798 N/A LYS 219.A N ASN 217.A OD1 no hydrogen 2.892 N/A GLY 220.A N ASN 217.A O no hydrogen 2.804 N/A LEU 221.A N ASN 217.A OD1 no hydrogen 3.065 N/A ALA 225.A N THR 222.A OG1 no hydrogen 3.076 N/A LEU 226.A N THR 222.A O no hydrogen 2.908 N/A ALA 227.A N PRO 223.A O no hydrogen 2.873 N/A ALA 228.A N LEU 224.A O no hydrogen 3.078 N/A SER 229.A N ALA 225.A O no hydrogen 2.885 N/A SER 229.A OG ALA 225.A O no hydrogen 3.347 N/A SER 229.A OG LEU 226.A O no hydrogen 2.802 N/A SER 230.A N LEU 226.A O no hydrogen 2.873 N/A SER 230.A OG LEU 226.A O no hydrogen 3.137 N/A LYS 232.A N ALA 227.A O no hydrogen 2.919 N/A LYS 232.A NZ VAL 180.A O no hydrogen 3.475 N/A LYS 232.A NZ GLU 181.A O no hydrogen 3.275 N/A LYS 232.A NZ ALA 183.A O no hydrogen 3.218 N/A ILE 233.A N ASN 185.A OD1 no hydrogen 3.123 N/A LEU 236.A N LYS 232.A O no hydrogen 3.022 N/A ALA 237.A N ILE 233.A O no hydrogen 2.773 N/A TYR 238.A N GLY 234.A O no hydrogen 2.966 N/A ILE 239.A N VAL 235.A O no hydrogen 2.744 N/A LEU 240.A N LEU 236.A O no hydrogen 3.107 N/A GLN 241.A N ALA 237.A O no hydrogen 3.113 N/A ARG 242.A N TYR 238.A O no hydrogen 3.028 N/A ARG 242.A NH1 ASN 197.A OD1 no hydrogen 2.558 N/A GLU 243.A N ILE 239.A O no hydrogen 3.366 N/A ILE 244.A N LEU 240.A O no hydrogen 3.210 N/A ILE 244.A N GLN 241.A O no hydrogen 3.129 N/A HIS 245.A N ARG 242.A O no hydrogen 3.015 N/A