Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6knw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N GLU 8.A OE1 no hydrogen 2.907 N/A THR 5.A OG1 GLU 7.A OE2 no hydrogen 3.484 N/A GLU 7.A N GLU 7.A OE2 no hydrogen 2.814 N/A GLU 8.A N THR 5.A OG1 no hydrogen 3.197 N/A TRP 9.A N THR 5.A O no hydrogen 2.808 N/A GLU 10.A N ASP 6.A O no hydrogen 3.007 N/A LEU 11.A N GLU 7.A O no hydrogen 2.964 N/A ILE 12.A N GLU 8.A O no hydrogen 2.827 N/A LYS 13.A N TRP 9.A O no hydrogen 2.818 N/A LYS 13.A NZ GLU 17.A OE2 no hydrogen 3.555 N/A THR 14.A N GLU 10.A O no hydrogen 3.070 N/A THR 14.A OG1 GLU 10.A O no hydrogen 3.258 N/A VAL 15.A N LEU 11.A O no hydrogen 3.054 N/A THR 16.A N ILE 12.A O no hydrogen 2.996 N/A THR 16.A OG1 ILE 12.A O no hydrogen 2.826 N/A THR 16.A OG1 THR 151.A OG1 no hydrogen 2.866 N/A GLU 17.A N LYS 13.A O no hydrogen 2.971 N/A ALA 18.A N THR 14.A O no hydrogen 2.887 N/A HIS 19.A N VAL 15.A O no hydrogen 2.827 N/A VAL 20.A N THR 16.A O no hydrogen 2.848 N/A ALA 21.A N GLU 17.A O no hydrogen 3.005 N/A THR 22.A N HIS 19.A O no hydrogen 3.182 N/A THR 22.A OG1 ALA 18.A O no hydrogen 2.801 N/A THR 22.A OG1 HIS 19.A O no hydrogen 3.388 N/A ASN 23.A N VAL 20.A O no hydrogen 3.507 N/A GLY 26.A N ASN 23.A O no hydrogen 3.102 N/A HIS 28.A N GLN 25.A O no hydrogen 2.885 N/A GLN 31.A N HIS 28.A O no hydrogen 3.022 N/A LYS 32.A N HIS 28.A O no hydrogen 3.055 N/A ARG 33.A NE LYS 30.A O no hydrogen 3.424 N/A ARG 33.A NH2 ASP 105.A OD2 no hydrogen 3.352 N/A LYS 34.A N GLU 116.A O no hydrogen 2.599 N/A LEU 36.A N ALA 118.A O no hydrogen 2.899 N/A ILE 40.A N PRO 37.A O no hydrogen 3.209 N/A LYS 46.A NZ HIS 224.A O no hydrogen 2.965 N/A ASP 48.A N ASN 126.A O no hydrogen 3.001 N/A ALA 51.A N ASP 48.A OD2 no hydrogen 3.164 N/A PHE 52.A N ASP 48.A O no hydrogen 3.030 N/A SER 53.A N LEU 49.A O no hydrogen 3.050 N/A SER 53.A OG LEU 49.A O no hydrogen 3.172 N/A HIS 54.A N GLU 50.A O no hydrogen 3.191 N/A PHE 55.A N ALA 51.A O no hydrogen 2.930 N/A THR 56.A N PHE 52.A O no hydrogen 2.663 N/A THR 56.A OG1 PHE 52.A O no hydrogen 2.964 N/A LYS 57.A N SER 53.A O no hydrogen 3.048 N/A LYS 57.A N HIS 54.A O no hydrogen 3.230 N/A ILE 58.A N PHE 55.A O no hydrogen 3.342 N/A ILE 59.A N PHE 55.A O no hydrogen 3.222 N/A ALA 62.A N ILE 58.A O no hydrogen 3.382 N/A ILE 63.A N ILE 59.A O no hydrogen 2.772 N/A THR 64.A N THR 60.A O no hydrogen 3.044 N/A THR 64.A OG1 THR 60.A O no hydrogen 2.720 N/A ARG 65.A N PRO 61.A O no hydrogen 2.969 N/A ARG 65.A NH1 ASN 114.A OD1 no hydrogen 2.496 N/A ARG 65.A NH2 ASN 114.A OD1 no hydrogen 3.080 N/A VAL 66.A N ALA 62.A O no hydrogen 3.326 N/A VAL 67.A N ILE 63.A O no hydrogen 3.045 N/A ASP 68.A N THR 64.A O no hydrogen 2.841 N/A PHE 69.A N ARG 65.A O no hydrogen 2.879 N/A ALA 70.A N VAL 66.A O no hydrogen 3.089 N/A LYS 71.A N VAL 67.A O no hydrogen 3.074 N/A LYS 72.A N ASP 68.A O no hydrogen 3.297 N/A LYS 72.A N PHE 69.A O no hydrogen 3.047 N/A LEU 73.A N ALA 70.A O no hydrogen 3.040 N/A CYS 77.A N LEU 73.A O no hydrogen 3.287 N/A CYS 77.A N PRO 74.A O no hydrogen 3.084 N/A CYS 77.A SG LYS 71.A O no hydrogen 3.199 N/A CYS 77.A SG LEU 73.A O no hydrogen 3.384 N/A LEU 79.A N PHE 76.A O no hydrogen 3.082 N/A GLN 84.A N PRO 80.A O no hydrogen 3.026 N/A GLN 84.A NE2 PHE 76.A O no hydrogen 3.231 N/A ILE 85.A N CYS 81.A O no hydrogen 2.936 N/A ILE 86.A N GLU 82.A O no hydrogen 2.901 N/A LEU 87.A N ASP 83.A O no hydrogen 2.733 N/A LEU 88.A N GLN 84.A O no hydrogen 2.804 N/A LYS 89.A N ILE 85.A O no hydrogen 2.945 N/A GLY 90.A N ILE 86.A O no hydrogen 2.959 N/A CYS 91.A N LEU 87.A O no hydrogen 3.316 N/A CYS 91.A N LEU 88.A O no hydrogen 3.292 N/A CYS 91.A SG LEU 87.A O no hydrogen 3.227 N/A CYS 91.A SG LEU 88.A O no hydrogen 3.957 N/A CYS 92.A N LEU 88.A O no hydrogen 3.090 N/A ILE 95.A N CYS 91.A O no hydrogen 2.830 N/A MET 96.A N CYS 92.A O no hydrogen 3.075 N/A SER 97.A N MET 93.A O no hydrogen 3.034 N/A SER 97.A OG MET 93.A O no hydrogen 2.710 N/A LEU 98.A N GLU 94.A O no hydrogen 3.030 N/A ARG 99.A N ILE 95.A O no hydrogen 2.786 N/A ARG 99.A NE GLN 157.A OE1 no hydrogen 2.856 N/A ARG 99.A NH1 THR 22.A O no hydrogen 2.914 N/A ARG 99.A NH2 HIS 19.A ND1 no hydrogen 3.154 N/A ARG 99.A NH2 THR 22.A OG1 no hydrogen 2.969 N/A ALA 100.A N MET 96.A O no hydrogen 2.835 N/A ALA 101.A N SER 97.A O no hydrogen 2.641 N/A VAL 102.A N LEU 98.A O no hydrogen 2.939 N/A ARG 103.A N ALA 100.A O no hydrogen 2.937 N/A ARG 103.A NH1 ALA 24.A O no hydrogen 2.890 N/A ARG 103.A NH2 ALA 24.A O no hydrogen 3.100 N/A TYR 104.A N ALA 101.A O no hydrogen 3.056 N/A ASP 105.A N THR 110.A O no hydrogen 2.911 N/A GLU 107.A N ASP 105.A OD1 no hydrogen 3.212 N/A SER 108.A OG ASP 105.A OD2 no hydrogen 2.991 N/A SER 108.A OG THR 110.A OG1 no hydrogen 2.506 N/A GLU 109.A N ASP 105.A O no hydrogen 2.568 N/A THR 110.A OG1 SER 108.A OG no hydrogen 2.506 N/A LEU 111.A N VAL 119.A O no hydrogen 3.099 N/A LEU 113.A N MET 117.A O no hydrogen 2.814 N/A ASN 114.A ND2 GLU 116.A OE1 no hydrogen 2.677 N/A GLU 116.A N LEU 113.A O no hydrogen 3.166 N/A MET 117.A N LEU 113.A O no hydrogen 3.000 N/A ALA 118.A N LYS 34.A O no hydrogen 2.774 N/A VAL 119.A N LEU 111.A O no hydrogen 2.959 N/A THR 120.A N GLN 123.A OE1 no hydrogen 2.750 N/A ARG 121.A NH1 ASP 134.A OD1 no hydrogen 2.475 N/A ARG 121.A NH2 ASP 138.A OD1 no hydrogen 3.100 N/A GLN 123.A N THR 120.A OG1 no hydrogen 3.174 N/A GLN 123.A NE2 LEU 36.A O no hydrogen 3.235 N/A GLN 123.A NE2 ILE 40.A O no hydrogen 3.148 N/A LEU 124.A N THR 120.A O no hydrogen 3.117 N/A LYS 125.A N ARG 121.A O no hydrogen 3.034 N/A LYS 125.A NZ ASP 134.A OD1 no hydrogen 3.176 N/A LYS 125.A NZ ASP 134.A OD2 no hydrogen 2.415 N/A ASN 126.A N GLY 122.A O no hydrogen 2.893 N/A ASN 126.A ND2 GLY 41.A O no hydrogen 3.311 N/A GLY 127.A N GLN 123.A O no hydrogen 2.854 N/A GLY 128.A N LYS 125.A O no hydrogen 3.240 N/A LEU 129.A N LEU 124.A O no hydrogen 3.324 N/A GLY 130.A N LYS 125.A O no hydrogen 3.197 N/A VAL 132.A N LEU 129.A O no hydrogen 3.187 N/A SER 133.A N GLY 130.A O no hydrogen 2.825 N/A SER 133.A OG ARG 121.A O no hydrogen 3.023 N/A ALA 135.A N VAL 131.A O no hydrogen 3.100 N/A ILE 136.A N VAL 132.A O no hydrogen 2.946 N/A PHE 137.A N SER 133.A O no hydrogen 2.904 N/A ASP 138.A N ASP 134.A O no hydrogen 2.734 N/A LEU 139.A N ALA 135.A O no hydrogen 2.947 N/A GLY 140.A N ILE 136.A O no hydrogen 2.967 N/A MET 141.A N PHE 137.A O no hydrogen 2.944 N/A SER 142.A N ASP 138.A O no hydrogen 3.070 N/A SER 142.A OG ASP 138.A O no hydrogen 3.425 N/A SER 142.A OG LEU 139.A O no hydrogen 3.088 N/A LEU 143.A N LEU 139.A O no hydrogen 2.849 N/A SER 144.A N GLY 140.A O no hydrogen 3.280 N/A PHE 146.A N LEU 143.A O no hydrogen 2.750 N/A ASP 149.A N GLU 152.A OE1 no hydrogen 2.755 N/A THR 151.A OG1 THR 16.A OG1 no hydrogen 2.866 N/A GLU 152.A N ASP 149.A OD1 no hydrogen 2.797 N/A VAL 153.A N ASP 149.A O no hydrogen 3.032 N/A ALA 154.A N ASP 150.A O no hydrogen 2.889 N/A LEU 155.A N THR 151.A O no hydrogen 2.907 N/A LEU 156.A N GLU 152.A O no hydrogen 3.039 N/A GLN 157.A N VAL 153.A O no hydrogen 2.977 N/A GLN 157.A NE2 HIS 19.A ND1 no hydrogen 3.285 N/A ALA 158.A N ALA 154.A O no hydrogen 2.928 N/A VAL 159.A N LEU 155.A O no hydrogen 2.811 N/A LEU 160.A N LEU 156.A O no hydrogen 3.043 N/A LEU 161.A N GLN 157.A O no hydrogen 2.822 N/A MET 162.A N ALA 158.A O no hydrogen 3.019 N/A SER 163.A OG LEU 160.A O no hydrogen 2.698 N/A ARG 166.A NH1 GLU 94.A OE2 no hydrogen 3.233 N/A ARG 166.A NH2 GLU 94.A OE1 no hydrogen 2.823 N/A ARG 166.A NH2 GLU 94.A OE2 no hydrogen 3.552 N/A ARG 166.A NH2 LEU 160.A O no hydrogen 2.997 N/A ALA 170.A N ASP 83.A OD1 no hydrogen 2.920 N/A CYS 171.A N ASP 83.A OD2 no hydrogen 2.966 N/A CYS 171.A SG ASP 83.A OD2 no hydrogen 3.270 N/A VAL 172.A N ALA 170.A O no hydrogen 2.857 N/A ILE 175.A N CYS 171.A O no hydrogen 2.801 N/A GLU 176.A N VAL 172.A O no hydrogen 2.987 N/A LYS 177.A N GLU 173.A O no hydrogen 2.923 N/A TYR 178.A N ARG 174.A O no hydrogen 3.046 N/A GLN 179.A N ILE 175.A O no hydrogen 2.929 N/A GLN 179.A NE2 VAL 159.A O no hydrogen 2.853 N/A ASP 180.A N GLU 176.A O no hydrogen 2.973 N/A SER 181.A N LYS 177.A O no hydrogen 3.176 N/A SER 181.A OG LYS 177.A O no hydrogen 3.078 N/A PHE 182.A N TYR 178.A O no hydrogen 3.192 N/A LEU 183.A N GLN 179.A O no hydrogen 2.843 N/A LEU 184.A N ASP 180.A O no hydrogen 3.002 N/A ALA 185.A N SER 181.A O no hydrogen 2.995 N/A PHE 186.A N PHE 182.A O no hydrogen 2.737 N/A GLU 187.A N LEU 183.A O no hydrogen 2.915 N/A HIS 188.A N LEU 184.A O no hydrogen 2.958 N/A HIS 188.A ND1 GLU 8.A OE1 no hydrogen 2.853 N/A HIS 188.A ND1 GLU 8.A OE2 no hydrogen 3.124 N/A TYR 189.A N ALA 185.A O no hydrogen 2.796 N/A TYR 189.A OH ASP 149.A OD2 no hydrogen 2.825 N/A ILE 190.A N PHE 186.A O no hydrogen 2.935 N/A ASN 191.A N GLU 187.A O no hydrogen 2.807 N/A ASN 191.A ND2 PRO 2.A O no hydrogen 2.751 N/A TYR 192.A N HIS 188.A O no hydrogen 2.977 N/A ARG 193.A N TYR 189.A O no hydrogen 2.739 N/A ARG 193.A NE GLU 152.A OE2 no hydrogen 2.936 N/A ARG 193.A NH2 GLU 152.A OE1 no hydrogen 2.997 N/A LYS 194.A N ILE 190.A O no hydrogen 3.231 N/A HIS 195.A NE2 GLU 152.A OE2 no hydrogen 2.646 N/A LYS 203.A N HIS 199.A O no hydrogen 3.052 N/A LYS 203.A NZ THR 198.A O no hydrogen 2.336 N/A LEU 204.A N PHE 200.A O no hydrogen 2.786 N/A LEU 205.A N TRP 201.A O no hydrogen 3.034 N/A MET 206.A N PRO 202.A O no hydrogen 3.240 N/A LYS 207.A N LYS 203.A O no hydrogen 3.117 N/A LYS 207.A NZ SER 142.A OG no hydrogen 2.894 N/A VAL 208.A N LEU 204.A O no hydrogen 3.034 N/A THR 209.A N LEU 205.A O no hydrogen 3.160 N/A THR 209.A OG1 LEU 205.A O no hydrogen 3.548 N/A ASP 210.A N MET 206.A O no hydrogen 2.875 N/A LEU 211.A N LYS 207.A O no hydrogen 2.870 N/A ARG 212.A N VAL 208.A O no hydrogen 2.889 N/A ARG 212.A NH1 SER 163.A OG no hydrogen 2.855 N/A ARG 212.A NH2 SER 163.A OG no hydrogen 2.800 N/A MET 213.A N THR 209.A O no hydrogen 2.903 N/A ILE 214.A N ASP 210.A O no hydrogen 3.118 N/A GLY 215.A N LEU 211.A O no hydrogen 2.952 N/A ALA 216.A N ARG 212.A O no hydrogen 2.931 N/A CYS 217.A N MET 213.A O no hydrogen 2.930 N/A CYS 217.A SG MET 213.A O no hydrogen 3.380 N/A SER 220.A N CYS 217.A O no hydrogen 2.833 N/A SER 220.A OG HIS 221.A ND1 no hydrogen 3.061 N/A HIS 221.A N CYS 217.A O no hydrogen 3.311 N/A LEU 223.A N ALA 219.A O no hydrogen 3.081 N/A MET 225.A N PHE 222.A O no hydrogen 3.334 N/A LYS 226.A N PHE 222.A O no hydrogen 3.193 N/A GLU 228.A N MET 225.A O no hydrogen 3.333 N/A CYS 229.A N MET 225.A O no hydrogen 3.131 N/A CYS 229.A SG MET 225.A O no hydrogen 3.403 N/A LEU 233.A N PRO 230.A O no hydrogen 2.849 N/A PHE 234.A N THR 231.A O no hydrogen 3.227 N/A LEU 239.A N PRO 235.A O no hydrogen 3.249 N/A GLU 240.A N PRO 236.A O no hydrogen 3.028 N/A VAL 241.A N LEU 237.A O no hydrogen 3.226 N/A PHE 242.A N PHE 238.A O no hydrogen 2.954 N/A GLU 243.A N LEU 239.A O no hydrogen 2.989 N/A