Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pwn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N LYS 13.A O no hydrogen 2.772 N/A GLY 4.A N LYS 13.A O no hydrogen 3.314 N/A SER 6.A N PHE 11.A O no hydrogen 2.842 N/A SER 6.A OG ASP 8.A O no hydrogen 3.107 N/A SER 6.A OG ASP 8.A OD1 no hydrogen 2.906 N/A ARG 10.A N ASP 8.A OD1 no hydrogen 2.916 N/A ARG 10.A NE ASP 31.A OD1 no hydrogen 2.939 N/A ARG 10.A NE ASP 31.A OD2 no hydrogen 3.406 N/A ARG 10.A NH2 ASP 31.A OD2 no hydrogen 2.782 N/A PHE 11.A N SER 6.A OG no hydrogen 2.970 N/A LEU 12.A N LEU 30.A O no hydrogen 2.813 N/A LYS 13.A N GLY 4.A O no hydrogen 2.619 N/A LYS 13.A NZ GLU 42.A OE1 no hydrogen 2.710 N/A PHE 14.A N LYS 28.A O no hydrogen 2.899 N/A ASP 15.A N LYS 1.A O no hydrogen 2.703 N/A ILE 18.A N VAL 26.A O no hydrogen 2.791 N/A THR 25.A N GLU 42.A O no hydrogen 2.924 N/A VAL 26.A N GLY 19.A O no hydrogen 2.767 N/A TYR 27.A N TRP 40.A O no hydrogen 2.686 N/A LYS 28.A N ILE 16.A O no hydrogen 3.060 N/A GLY 29.A N VAL 38.A O no hydrogen 2.948 N/A LEU 30.A N LEU 12.A O no hydrogen 2.809 N/A ASP 31.A N VAL 36.A O no hydrogen 3.001 N/A THR 32.A N ARG 10.A O no hydrogen 2.948 N/A THR 32.A OG1 GLY 9.A O no hydrogen 3.196 N/A THR 32.A OG1 ARG 10.A O no hydrogen 2.783 N/A GLU 33.A N ASP 31.A OD1 no hydrogen 2.912 N/A THR 34.A N ASP 31.A O no hydrogen 3.112 N/A THR 34.A OG1 ASP 31.A OD2 no hydrogen 2.924 N/A THR 35.A N ASP 31.A O no hydrogen 2.756 N/A THR 35.A OG1 THR 34.A O no hydrogen 2.560 N/A VAL 38.A N GLY 29.A O no hydrogen 3.029 N/A ALA 39.A N THR 77.A O no hydrogen 2.831 N/A TRP 40.A N TYR 27.A O no hydrogen 2.846 N/A TRP 40.A NE1 GLU 42.A OE1 no hydrogen 2.982 N/A CYS 41.A N LEU 75.A O no hydrogen 2.782 N/A GLU 42.A N THR 25.A O no hydrogen 2.728 N/A LEU 43.A N ILE 73.A O no hydrogen 2.741 N/A GLN 44.A N PHE 23.A O no hydrogen 3.213 N/A GLU 51.A N LYS 47.A O no hydrogen 3.512 N/A MET 52.A N GLU 48.A O no hydrogen 3.254 N/A LEU 53.A N GLU 49.A O no hydrogen 2.759 N/A LYS 54.A N ALA 50.A O no hydrogen 2.770 N/A LYS 54.A NZ ASP 66.A OD1 no hydrogen 3.370 N/A LYS 54.A NZ ASP 66.A OD2 no hydrogen 2.964 N/A LEU 56.A N LEU 53.A O no hydrogen 3.074 N/A ASN 60.A N HIS 58.A ND1 no hydrogen 3.030 N/A ILE 61.A N HIS 58.A O no hydrogen 3.332 N/A VAL 62.A N ILE 142.A O no hydrogen 2.894 N/A ARG 63.A N GLU 78.A OE1 no hydrogen 2.919 N/A TYR 65.A N VAL 76.A O no hydrogen 2.851 N/A ASP 66.A N VAL 76.A O no hydrogen 3.474 N/A SER 67.A N ASP 66.A OD1 no hydrogen 2.767 N/A SER 67.A OG VAL 74.A O no hydrogen 2.783 N/A TRP 68.A N VAL 74.A O no hydrogen 3.077 N/A SER 70.A N CYS 72.A O no hydrogen 2.761 N/A CYS 72.A N ASP 45.A OD2 no hydrogen 2.617 N/A ILE 73.A N LEU 43.A O no hydrogen 3.032 N/A VAL 74.A N TRP 68.A O no hydrogen 2.860 N/A LEU 75.A N CYS 41.A O no hydrogen 2.889 N/A VAL 76.A N ASP 66.A O no hydrogen 2.954 N/A THR 77.A N ALA 39.A O no hydrogen 3.005 N/A THR 77.A OG1 GLU 78.A O no hydrogen 3.350 N/A GLU 78.A N ARG 63.A O no hydrogen 2.911 N/A SER 82.A OG THR 134.A O no hydrogen 3.458 N/A THR 84.A N THR 87.A OG1 no hydrogen 3.189 N/A LEU 85.A N ILE 131.A O no hydrogen 2.855 N/A LYS 86.A N CYS 128.A O no hydrogen 3.279 N/A THR 87.A N THR 84.A OG1 no hydrogen 3.224 N/A THR 87.A OG1 THR 84.A O no hydrogen 2.968 N/A TYR 88.A N THR 84.A O no hydrogen 2.918 N/A LEU 89.A N LEU 85.A O no hydrogen 2.806 N/A LYS 90.A N LYS 86.A O no hydrogen 3.334 N/A ARG 91.A N THR 87.A O no hydrogen 2.950 N/A PHE 92.A N TYR 88.A O no hydrogen 3.164 N/A VAL 94.A N PHE 92.A O no hydrogen 2.686 N/A LEU 100.A N LYS 96.A O no hydrogen 2.971 N/A ARG 101.A N ILE 97.A O no hydrogen 2.885 N/A ARG 101.A NE PHE 241.A O no hydrogen 2.840 N/A SER 102.A N LYS 98.A O no hydrogen 3.142 N/A TRP 103.A N VAL 99.A O no hydrogen 2.928 N/A TRP 103.A NE1 GLY 138.A O no hydrogen 2.884 N/A CYS 104.A N LEU 100.A O no hydrogen 2.901 N/A ARG 105.A N ARG 101.A O no hydrogen 2.955 N/A ARG 105.A NE PHE 242.A O no hydrogen 3.262 N/A ARG 105.A NH2 PHE 242.A O no hydrogen 2.827 N/A GLN 106.A N SER 102.A O no hydrogen 3.063 N/A ILE 107.A N TRP 103.A O no hydrogen 2.913 N/A LEU 108.A N CYS 104.A O no hydrogen 3.049 N/A LYS 109.A N ARG 105.A O no hydrogen 2.890 N/A LYS 109.A NZ GLN 112.A OE1 no hydrogen 2.965 N/A GLY 110.A N GLN 106.A O no hydrogen 3.093 N/A GLY 110.A N ILE 107.A O no hydrogen 3.087 N/A LEU 111.A N ILE 107.A O no hydrogen 2.807 N/A GLN 112.A N LEU 108.A O no hydrogen 2.794 N/A PHE 113.A N LYS 109.A O no hydrogen 3.034 N/A LEU 114.A N GLY 110.A O no hydrogen 3.034 N/A HIS 115.A N LEU 111.A O no hydrogen 2.942 N/A HIS 115.A NE2 ASP 167.A OD2 no hydrogen 2.560 N/A THR 116.A N GLN 112.A O no hydrogen 2.979 N/A THR 116.A N PHE 113.A O no hydrogen 3.240 N/A THR 116.A OG1 GLN 112.A O no hydrogen 2.970 N/A THR 116.A OG1 PHE 113.A O no hydrogen 3.191 N/A ARG 117.A N LEU 114.A O no hydrogen 3.287 N/A ARG 117.A NE PHE 113.A O no hydrogen 2.771 N/A ARG 117.A NH2 THR 116.A OG1 no hydrogen 2.806 N/A ILE 121.A N LEU 114.A O no hydrogen 2.832 N/A HIS 123.A N ASP 167.A OD2 no hydrogen 2.990 N/A HIS 123.A NE2 GLY 143.A O no hydrogen 2.899 N/A ARG 124.A N ASP 167.A OD1 no hydrogen 2.896 N/A ASP 125.A N HIS 123.A ND1 no hydrogen 3.140 N/A LYS 127.A N ASN 130.A OD1 no hydrogen 3.015 N/A LYS 127.A NZ ASP 125.A OD2 no hydrogen 3.522 N/A CYS 128.A SG CYS 174.A O no hydrogen 3.886 N/A CYS 128.A SG GLU 177.A OE1 no hydrogen 3.407 N/A ASN 130.A N LYS 127.A O no hydrogen 3.065 N/A ASN 130.A ND2 ASP 125.A O no hydrogen 2.839 N/A ILE 131.A N CYS 128.A O no hydrogen 3.433 N/A PHE 132.A N LYS 141.A O no hydrogen 2.762 N/A ILE 133.A N GLY 83.A O no hydrogen 3.086 N/A THR 134.A N SER 139.A O no hydrogen 2.826 N/A THR 134.A OG1 SER 139.A O no hydrogen 3.362 N/A GLY 138.A N GLY 135.A O no hydrogen 3.152 N/A SER 139.A N THR 134.A OG1 no hydrogen 2.854 N/A VAL 140.A N GLN 106.A OE1 no hydrogen 2.760 N/A LYS 141.A N PHE 132.A O no hydrogen 2.746 N/A LYS 141.A NZ PRO 59.A O no hydrogen 2.661 N/A ILE 142.A N ASN 60.A O no hydrogen 2.949 N/A GLY 143.A N ASN 130.A O no hydrogen 2.820 N/A LEU 147.A N ASP 144.A O no hydrogen 3.308 N/A PHE 152.A N GLU 151.A OE2 no hydrogen 2.897 N/A GLU 156.A N GLU 156.A OE1 no hydrogen 2.734 N/A MET 157.A N ALA 154.A O no hydrogen 2.968 N/A TYR 158.A N PRO 155.A O no hydrogen 3.366 N/A GLU 159.A N GLU 156.A O no hydrogen 3.272 N/A LYS 161.A N GLU 156.A O no hydrogen 3.385 N/A GLU 164.A N GLU 164.A OE1 no hydrogen 2.956 N/A SER 165.A N ASP 163.A OD1 no hydrogen 2.559 N/A SER 165.A OG ASP 163.A OD1 no hydrogen 2.501 N/A SER 165.A OG ASP 163.A OD2 no hydrogen 3.555 N/A VAL 166.A N ASP 163.A O no hydrogen 3.195 N/A ASP 167.A N GLU 164.A O no hydrogen 2.970 N/A TYR 169.A N SER 165.A O no hydrogen 2.940 N/A ALA 170.A N VAL 166.A O no hydrogen 3.179 N/A PHE 171.A N ASP 167.A O no hydrogen 2.806 N/A GLY 172.A N VAL 168.A O no hydrogen 2.889 N/A MET 173.A N TYR 169.A O no hydrogen 3.179 N/A CYS 174.A N ALA 170.A O no hydrogen 2.782 N/A CYS 174.A SG ALA 170.A O no hydrogen 3.351 N/A MET 175.A N PHE 171.A O no hydrogen 2.724 N/A LEU 176.A N GLY 172.A O no hydrogen 2.734 N/A GLU 177.A N MET 173.A O no hydrogen 2.744 N/A MET 178.A N CYS 174.A O no hydrogen 2.763 N/A ALA 179.A N MET 175.A O no hydrogen 2.809 N/A ALA 179.A N LEU 176.A O no hydrogen 3.131 N/A THR 180.A N GLU 177.A O no hydrogen 3.078 N/A THR 180.A OG1 LEU 176.A O no hydrogen 2.994 N/A THR 180.A OG1 GLU 177.A O no hydrogen 3.515 N/A THR 180.A OG1 GLU 182.A O no hydrogen 3.450 N/A SER 181.A N GLU 177.A O no hydrogen 2.702 N/A SER 181.A OG LYS 93.A O no hydrogen 2.642 N/A GLU 182.A N THR 180.A OG1 no hydrogen 3.340 N/A TYR 185.A OH VAL 202.A O no hydrogen 2.644 N/A SER 186.A N TYR 183.A O no hydrogen 3.110 N/A SER 186.A OG TYR 183.A O no hydrogen 2.987 N/A GLU 187.A N GLU 187.A OE1 no hydrogen 3.212 N/A CYS 188.A N TYR 185.A O no hydrogen 2.953 N/A GLN 189.A NE2 GLN 193.A OE1 no hydrogen 3.390 N/A GLN 193.A N ASN 190.A OD1 no hydrogen 3.288 N/A TYR 195.A N ALA 191.A O no hydrogen 2.753 N/A ARG 196.A N ALA 192.A O no hydrogen 3.097 N/A ARG 197.A N GLN 193.A O no hydrogen 2.833 N/A VAL 198.A N ILE 194.A O no hydrogen 2.826 N/A THR 199.A N TYR 195.A O no hydrogen 2.977 N/A THR 199.A OG1 TYR 195.A O no hydrogen 2.681 N/A SER 200.A N ARG 197.A O no hydrogen 3.290 N/A SER 200.A OG ARG 196.A O no hydrogen 3.240 N/A GLY 201.A N VAL 198.A O no hydrogen 2.929 N/A VAL 202.A N ARG 197.A O no hydrogen 2.772 N/A ALA 205.A N GLU 187.A OE1 no hydrogen 3.199 N/A ALA 205.A N GLU 187.A OE2 no hydrogen 3.247 N/A PHE 207.A N PRO 204.A O no hydrogen 3.330 N/A ASP 208.A N ALA 205.A O no hydrogen 3.052 N/A LYS 209.A N SER 206.A O no hydrogen 2.839 N/A LYS 216.A N ILE 212.A O no hydrogen 2.992 N/A LYS 216.A NZ ASP 208.A OD1 no hydrogen 3.536 N/A GLU 217.A N PRO 213.A O no hydrogen 2.781 N/A ILE 218.A N GLU 214.A O no hydrogen 2.960 N/A ILE 219.A N VAL 215.A O no hydrogen 2.945 N/A GLU 220.A N LYS 216.A O no hydrogen 3.015 N/A GLY 221.A N GLU 217.A O no hydrogen 3.257 N/A CYS 222.A N ILE 218.A O no hydrogen 3.181 N/A CYS 222.A N ILE 219.A O no hydrogen 3.241 N/A CYS 222.A SG ILE 218.A O no hydrogen 3.384 N/A ILE 223.A N ILE 219.A O no hydrogen 3.232 N/A ARG 224.A NH1 GLU 229.A O no hydrogen 2.679 N/A ARG 224.A NH2 GLU 220.A OE1 no hydrogen 3.505 N/A ASP 228.A N ASN 226.A OD1 no hydrogen 3.159 N/A ARG 230.A N LYS 227.A O no hydrogen 3.081 N/A ARG 230.A NE ARG 224.A O no hydrogen 2.682 N/A ARG 230.A NH1 GLU 156.A OE2 no hydrogen 2.723 N/A ARG 230.A NH1 SER 165.A O no hydrogen 3.546 N/A ARG 230.A NH2 GLU 156.A OE1 no hydrogen 2.791 N/A ARG 230.A NH2 GLU 156.A OE2 no hydrogen 3.460 N/A ARG 230.A NH2 ARG 224.A O no hydrogen 3.106 N/A ARG 230.A NH2 GLN 225.A O no hydrogen 2.761 N/A TYR 231.A N GLY 221.A O no hydrogen 3.015 N/A SER 232.A N ASP 235.A OD2 no hydrogen 3.212 N/A ASP 235.A N SER 232.A OG no hydrogen 2.817 N/A LEU 236.A N SER 232.A O no hydrogen 2.974 N/A LEU 237.A N ILE 233.A O no hydrogen 2.974 N/A ASN 238.A N LYS 234.A O no hydrogen 3.182 N/A ASN 238.A N ASP 235.A O no hydrogen 3.096 N/A HIS 239.A N LEU 236.A O no hydrogen 2.994 N/A PHE 242.A N HIS 239.A O no hydrogen 3.041 N/A GLN 243.A N HIS 239.A O no hydrogen 2.911 N/A GLN 243.A NE2 LEU 237.A O no hydrogen 2.779 N/A GLU 244.A N ALA 240.A O no hydrogen 2.754 N/A