Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pl5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N GLU 82.A O no hydrogen 2.760 N/A LYS 3.A NZ SER 76.A OG no hydrogen 2.855 N/A LEU 5.A N LEU 84.A O no hydrogen 2.739 N/A THR 6.A N GLN 23.A O no hydrogen 2.843 N/A THR 6.A OG1 ILE 86.A O no hydrogen 2.795 N/A ASP 7.A N THR 6.A OG1 no hydrogen 2.765 N/A SER 8.A N LEU 25.A O no hydrogen 2.960 N/A SER 8.A OG THR 38.A OG1 no hydrogen 2.581 N/A THR 9.A OG1 ASP 7.A OD1 no hydrogen 2.759 N/A THR 9.A OG1 GLU 127.A OE1 no hydrogen 3.554 N/A ALA 10.A N ASP 7.A O no hydrogen 3.166 N/A ASP 11.A N SER 8.A O no hydrogen 3.244 N/A THR 17.A N PRO 13.A O no hydrogen 3.152 N/A THR 17.A OG1 PRO 13.A O no hydrogen 3.537 N/A THR 17.A OG1 GLU 14.A O.A no hydrogen 2.960 N/A THR 17.A OG1 GLU 14.A O.B no hydrogen 2.958 N/A GLN 18.A N GLU 14.A O.A no hydrogen 2.950 N/A GLN 18.A N GLU 14.A O.B no hydrogen 2.902 N/A GLU 19.A N SER 15.A O no hydrogen 3.138 N/A ASN 20.A N TRP 16.A O no hydrogen 2.901 N/A ASP 21.A N GLN 18.A O no hydrogen 3.487 N/A VAL 22.A N THR 17.A O no hydrogen 3.116 N/A GLN 23.A N ILE 4.A O no hydrogen 3.027 N/A GLN 23.A NE2 ASP 21.A OD1 no hydrogen 2.816 N/A LEU 25.A N THR 6.A O no hydrogen 3.033 N/A LEU 27.A N SER 8.A OG no hydrogen 3.197 N/A THR 28.A N SER 62.A O no hydrogen 3.223 N/A VAL 29.A N TYR 36.A O no hydrogen 3.345 N/A GLN 30.A N THR 60.A O no hydrogen 2.734 N/A GLN 30.A NE2 THR 28.A OG1 no hydrogen 3.017 N/A GLN 30.A NE2 THR 35.A OG1 no hydrogen 3.048 N/A LEU 31.A N ILE 34.A O no hydrogen 2.865 N/A ILE 34.A N LEU 31.A O no hydrogen 3.252 N/A TYR 36.A N VAL 29.A O no hydrogen 2.808 N/A THR 38.A OG1 SER 8.A OG no hydrogen 2.581 N/A THR 38.A OG1 LEU 27.A O no hydrogen 2.669 N/A ARG 43.A N GLY 40.A O no hydrogen 3.258 N/A LEU 44.A N GLU 37.A O no hydrogen 2.774 N/A SER 46.A OG LEU 254.A O no hydrogen 2.617 N/A SER 46.A OG SER 259.A OG no hydrogen 3.236 N/A VAL 48.A N THR 45.A OG1 no hydrogen 3.373 N/A LEU 49.A N THR 45.A O no hydrogen 2.928 N/A LEU 50.A N SER 46.A O no hydrogen 2.792 N/A GLU 51.A N ARG 47.A O no hydrogen 3.142 N/A LYS 52.A N VAL 48.A O no hydrogen 3.034 N/A ILE 53.A N LEU 49.A O no hydrogen 2.913 N/A ALA 54.A N LEU 50.A O no hydrogen 2.886 N/A ALA 55.A N GLU 51.A O no hydrogen 3.381 N/A ALA 55.A N LYS 52.A O no hydrogen 3.213 N/A GLY 56.A N ILE 53.A O no hydrogen 3.140 N/A SER 57.A N LYS 52.A O no hydrogen 3.030 N/A SER 57.A OG ASP 32.A OD1 no hydrogen 3.438 N/A SER 57.A OG ASP 32.A OD2 no hydrogen 2.967 N/A LYS 58.A NZ TYR 168.A OH no hydrogen 3.234 N/A THR 60.A N GLN 30.A O no hydrogen 2.941 N/A SER 62.A N THR 28.A O no hydrogen 2.936 N/A SER 62.A OG GLN 30.A OE1 no hydrogen 2.503 N/A GLN 63.A NE2 VAL 64.A O no hydrogen 2.797 N/A GLN 63.A NE2 SER 98.A OG no hydrogen 2.710 N/A VAL 64.A N THR 95.A OG1 no hydrogen 3.099 N/A GLN 68.A N ASN 65.A O no hydrogen 2.994 N/A GLN 68.A NE2 ASN 65.A OD1 no hydrogen 2.720 N/A GLU 70.A N VAL 66.A O no hydrogen 2.957 N/A SER 71.A N GLY 67.A O no hydrogen 3.036 N/A SER 71.A OG GLY 67.A O no hydrogen 3.047 N/A TYR 72.A N GLN 68.A O no hydrogen 3.236 N/A TYR 72.A OH GLN 23.A OE1 no hydrogen 2.862 N/A PHE 73.A N PHE 69.A O no hydrogen 2.722 N/A ARG 74.A N GLU 70.A O no hydrogen 2.647 N/A ARG 74.A NE GLU 109.A OE1 no hydrogen 2.696 N/A ARG 74.A NH2 GLU 70.A OE2 no hydrogen 2.567 N/A ARG 74.A NH2 GLU 109.A OE1 no hydrogen 3.380 N/A ARG 74.A NH2 GLU 109.A OE2 no hydrogen 2.787 N/A GLN 75.A N SER 71.A O no hydrogen 2.926 N/A SER 76.A N TYR 72.A O no hydrogen 3.036 N/A SER 76.A OG TYR 72.A O no hydrogen 3.024 N/A ALA 77.A N PHE 73.A O no hydrogen 2.955 N/A GLU 78.A N ARG 74.A O no hydrogen 2.914 N/A ASN 79.A N SER 76.A O no hydrogen 3.116 N/A ASN 79.A ND2 GLN 75.A O no hydrogen 2.833 N/A GLY 80.A N ALA 77.A O no hydrogen 2.895 N/A GLN 81.A N SER 76.A O no hydrogen 2.898 N/A VAL 83.A N SER 114.A O no hydrogen 2.945 N/A LEU 84.A N LYS 3.A O no hydrogen 2.842 N/A TYR 85.A N GLU 116.A O no hydrogen 2.773 N/A TYR 85.A OH ASP 7.A OD2 no hydrogen 2.405 N/A ILE 86.A N LEU 5.A O no hydrogen 2.945 N/A ALA 87.A N VAL 118.A O no hydrogen 2.887 N/A PHE 88.A N ASP 7.A OD2 no hydrogen 2.957 N/A SER 89.A N ALA 122.A O no hydrogen 3.123 N/A SER 90.A N ASP 119.A OD1 no hydrogen 2.888 N/A SER 90.A OG ASP 119.A OD2 no hydrogen 2.403 N/A VAL 91.A N SER 89.A OG no hydrogen 3.086 N/A LEU 92.A N SER 89.A O no hydrogen 3.277 N/A SER 93.A OG THR 95.A OG1 no hydrogen 2.934 N/A THR 95.A N SER 93.A OG no hydrogen 3.321 N/A THR 95.A OG1 SER 93.A OG no hydrogen 2.934 N/A SER 98.A N GLY 94.A O no hydrogen 2.889 N/A SER 98.A OG GLY 94.A O no hydrogen 3.390 N/A ALA 99.A N THR 95.A O no hydrogen 3.016 N/A VAL 100.A N TYR 96.A O no hydrogen 2.900 N/A MET 101.A N GLN 97.A O no hydrogen 3.004 N/A ALA 102.A N SER 98.A O no hydrogen 2.890 N/A ARG 103.A N ALA 99.A O no hydrogen 2.842 N/A ARG 103.A NH1 ILE 115.A O no hydrogen 2.963 N/A ASP 104.A N VAL 100.A O no hydrogen 3.059 N/A ILE 105.A N MET 101.A O no hydrogen 3.186 N/A VAL 106.A N ALA 102.A O no hydrogen 3.112 N/A LEU 107.A N ARG 103.A O no hydrogen 2.883 N/A GLU 108.A N ASP 104.A O no hydrogen 3.267 N/A TYR 110.A N VAL 106.A O no hydrogen 2.762 N/A ALA 113.A N TYR 110.A O no hydrogen 3.058 N/A SER 114.A OG GLU 82.A OE2 no hydrogen 3.557 N/A GLU 116.A N VAL 83.A O no hydrogen 2.849 N/A VAL 118.A N TYR 85.A O no hydrogen 2.757 N/A THR 120.A N ALA 87.A O no hydrogen 3.217 N/A THR 120.A OG1 ALA 87.A O no hydrogen 2.542 N/A LEU 121.A N ASP 119.A OD1 no hydrogen 3.223 N/A ALA 122.A N THR 120.A OG1 no hydrogen 2.932 N/A THR 124.A OG1 ASP 11.A OD2 no hydrogen 2.593 N/A GLU 127.A N ALA 123.A O no hydrogen 3.423 N/A GLY 128.A N THR 124.A O no hydrogen 2.790 N/A TYR 129.A N GLY 125.A O no hydrogen 2.884 N/A TYR 129.A OH HIS 219.A NE2 no hydrogen 2.618 N/A LEU 130.A N GLY 126.A O no hydrogen 3.100 N/A ALA 131.A N GLU 127.A O no hydrogen 3.042 N/A MET 132.A N GLY 128.A O no hydrogen 2.901 N/A LEU 133.A N TYR 129.A O no hydrogen 2.787 N/A ALA 134.A N LEU 130.A O no hydrogen 2.788 N/A ALA 135.A N ALA 131.A O no hydrogen 2.792 N/A GLN 136.A N MET 132.A O no hydrogen 2.999 N/A ALA 137.A N LEU 133.A O no hydrogen 3.043 N/A ARG 138.A N ALA 134.A O no hydrogen 3.168 N/A ARG 138.A NH1 PHE 2.A O no hydrogen 3.050 N/A ARG 138.A NH1 ASP 21.A O no hydrogen 3.363 N/A ARG 138.A NH2 ASP 21.A O no hydrogen 2.862 N/A GLU 139.A N ALA 135.A O no hydrogen 3.170 N/A GLU 140.A N GLN 136.A O no hydrogen 3.167 N/A GLY 141.A N ARG 138.A O no hydrogen 3.039 N/A LYS 142.A N ALA 137.A O no hydrogen 3.094 N/A LYS 142.A NZ GLU 140.A OE1 no hydrogen 2.905 N/A SER 143.A N GLU 146.A OE1 no hydrogen 3.083 N/A GLU 146.A N SER 143.A OG no hydrogen 2.949 N/A THR 147.A N SER 143.A O no hydrogen 2.888 N/A THR 147.A OG1 SER 143.A O no hydrogen 2.648 N/A LYS 148.A N LEU 144.A O no hydrogen 2.820 N/A LYS 148.A NZ GLU 116.A OE1 no hydrogen 2.759 N/A GLU 149.A N LYS 145.A O no hydrogen 2.871 N/A LEU 150.A N GLU 146.A O no hydrogen 2.960 N/A ILE 151.A N THR 147.A O no hydrogen 2.990 N/A LEU 152.A N LYS 148.A O no hydrogen 2.994 N/A ASP 153.A N GLU 149.A O no hydrogen 2.999 N/A VAL 154.A N LEU 150.A O no hydrogen 2.893 N/A GLY 155.A N ILE 151.A O no hydrogen 2.838 N/A ARG 157.A N VAL 154.A O no hydrogen 2.978 N/A ARG 157.A NE ASP 153.A O no hydrogen 3.255 N/A ARG 157.A NE ASP 153.A OD2 no hydrogen 3.369 N/A ARG 157.A NH1 GLY 273.A O no hydrogen 2.953 N/A ARG 157.A NH2 ASP 153.A OD2 no hydrogen 3.006 N/A LEU 158.A N GLY 155.A O no hydrogen 3.190 N/A ARG 159.A N THR 271.A O no hydrogen 2.662 N/A ARG 159.A NH1 ARG 157.A O no hydrogen 3.054 N/A ARG 159.A NH1 GLU 275.A O no hydrogen 2.569 N/A ARG 159.A NH2 GLU 275.A O no hydrogen 3.386 N/A PHE 161.A N VAL 269.A O no hydrogen 2.972 N/A PHE 162.A N LEU 185.A O no hydrogen 3.098 N/A LEU 163.A N LEU 267.A O no hydrogen 2.589 N/A VAL 164.A N PRO 183.A O no hydrogen 3.062 N/A TYR 168.A N ASN 166.A OD1 no hydrogen 3.067 N/A MET 171.A N LEU 167.A O no hydrogen 2.872 N/A ARG 172.A N TYR 168.A O no hydrogen 2.823 N/A ARG 172.A NE HIS 169.A ND1 no hydrogen 3.031 N/A ARG 172.A NH1 PRO 59.A O no hydrogen 3.154 N/A ARG 172.A NH2 PRO 59.A O no hydrogen 3.142 N/A ARG 172.A NH2 HIS 169.A ND1 no hydrogen 3.206 N/A GLY 173.A N HIS 169.A O no hydrogen 2.765 N/A GLY 174.A N MET 171.A O no hydrogen 3.381 N/A ARG 175.A NE LEU 92.A O no hydrogen 2.845 N/A ARG 175.A NH1 GLY 173.A O no hydrogen 2.828 N/A ARG 175.A NH2 LEU 92.A O no hydrogen 2.987 N/A VAL 179.A N SER 177.A OG no hydrogen 3.347 N/A ILE 181.A N LEU 178.A O no hydrogen 3.059 N/A LYS 182.A N LEU 199.A O no hydrogen 2.563 N/A LYS 182.A NZ ASP 165.A OD1 no hydrogen 3.505 N/A LEU 184.A N ALA 197.A O no hydrogen 2.708 N/A LEU 185.A N PHE 162.A O no hydrogen 2.945 N/A TRP 186.A N VAL 194.A O no hydrogen 2.913 N/A ASP 188.A N LYS 192.A O no hydrogen 2.973 N/A SER 190.A N ASP 188.A OD1 no hydrogen 2.795 N/A SER 190.A OG ASP 188.A OD1 no hydrogen 2.554 N/A SER 190.A OG ASP 188.A OD2 no hydrogen 3.370 N/A GLY 191.A N ASP 188.A O no hydrogen 2.890 N/A LYS 192.A N ASP 188.A OD1 no hydrogen 3.172 N/A VAL 194.A N TRP 186.A O no hydrogen 2.985 N/A ILE 196.A N LEU 184.A O no hydrogen 2.752 N/A ALA 197.A N LEU 184.A O no hydrogen 3.455 N/A LEU 199.A N LYS 182.A O no hydrogen 3.017 N/A ARG 200.A NH2 VAL 179.A O no hydrogen 3.561 N/A GLY 201.A N ASN 180.A O no hydrogen 2.598 N/A GLY 205.A N GLY 201.A O no hydrogen 2.990 N/A MET 206.A N ARG 202.A O no hydrogen 3.006 N/A LYS 207.A N LYS 203.A O no hydrogen 3.146 N/A GLU 208.A N LYS 204.A O no hydrogen 2.937 N/A MET 209.A N GLY 205.A O no hydrogen 2.908 N/A LEU 210.A N MET 206.A O no hydrogen 2.712 N/A LYS 211.A N LYS 207.A O no hydrogen 2.874 N/A ARG 212.A N GLU 208.A O no hydrogen 2.929 N/A ARG 212.A NE GLU 208.A OE2 no hydrogen 2.862 N/A ARG 212.A NH2 GLU 208.A OE2 no hydrogen 3.073 N/A ALA 213.A N MET 209.A O no hydrogen 2.918 N/A THR 214.A N LEU 210.A O no hydrogen 3.057 N/A THR 214.A N LYS 211.A O no hydrogen 3.251 N/A THR 214.A OG1 LEU 210.A O no hydrogen 2.658 N/A THR 214.A OG1 LYS 211.A O no hydrogen 3.339 N/A ALA 215.A N ARG 212.A O no hydrogen 3.480 N/A ALA 218.A N ILE 272.A O no hydrogen 2.773 N/A HIS 219.A NE2 TYR 129.A OH no hydrogen 2.618 N/A THR 221.A OG1 TYR 129.A OH no hydrogen 3.307 N/A THR 221.A OG1 ASP 220.A OD1 no hydrogen 2.939 N/A ALA 222.A N ASN 248.A O no hydrogen 3.070 N/A VAL 223.A N PHE 270.A O no hydrogen 3.000 N/A VAL 224.A N VAL 250.A O no hydrogen 2.853 N/A ALA 225.A N ALA 268.A O no hydrogen 2.994 N/A TYR 226.A N LEU 252.A O no hydrogen 3.326 N/A ALA 227.A N THR 266.A O no hydrogen 2.971 N/A ALA 232.A N ASP 229.A OD1 no hydrogen 3.014 N/A ALA 233.A N ASP 229.A O no hydrogen 3.297 N/A GLU 234.A N SER 230.A O no hydrogen 3.078 N/A ASN 235.A N GLU 231.A O no hydrogen 3.009 N/A LEU 236.A N ALA 232.A O no hydrogen 3.179 N/A LYS 237.A N ALA 233.A O no hydrogen 2.784 N/A GLU 238.A N GLU 234.A O no hydrogen 2.868 N/A GLN 239.A N ASN 235.A O no hydrogen 3.251 N/A LEU 240.A N LEU 236.A O no hydrogen 2.864 N/A LEU 241.A N LYS 237.A O no hydrogen 2.903 N/A ALA 242.A N GLU 238.A O no hydrogen 3.085 N/A ALA 242.A N GLN 239.A O no hydrogen 3.100 N/A ASN 243.A N LEU 240.A O no hydrogen 2.790 N/A LYS 245.A N ASN 243.A OD1 no hydrogen 3.012 N/A ILE 246.A N ASN 243.A O no hydrogen 3.011 N/A LYS 247.A N ASP 220.A O no hydrogen 2.753 N/A LYS 247.A NZ GLU 244.A O no hydrogen 2.768 N/A ASN 248.A N ASP 220.A O no hydrogen 3.099 N/A VAL 250.A N ALA 222.A O no hydrogen 2.916 N/A LEU 252.A N VAL 224.A O no hydrogen 2.993 N/A LEU 254.A N TYR 226.A O no hydrogen 2.666 N/A GLY 255.A N ASP 11.A OD2 no hydrogen 2.909 N/A SER 259.A N GLY 255.A O no hydrogen 2.951 N/A SER 259.A OG SER 46.A OG no hydrogen 3.236 N/A SER 259.A OG GLY 255.A O no hydrogen 2.863 N/A THR 260.A N PRO 256.A O no hydrogen 2.873 N/A THR 260.A OG1 PRO 256.A O no hydrogen 2.800 N/A HIS 261.A N ILE 258.A O no hydrogen 2.856 N/A HIS 261.A ND1 VAL 257.A O no hydrogen 3.376 N/A VAL 262.A N ILE 258.A O no hydrogen 2.988 N/A GLY 263.A N SER 259.A O no hydrogen 3.139 N/A ASN 265.A N ASN 228.A OD1 no hydrogen 2.680 N/A THR 266.A OG1 VAL 262.A O no hydrogen 3.514 N/A THR 266.A OG1 GLY 263.A O no hydrogen 2.554 N/A LEU 267.A N LEU 163.A O no hydrogen 2.997 N/A ALA 268.A N ALA 225.A O no hydrogen 2.924 N/A VAL 269.A N PHE 161.A O no hydrogen 2.837 N/A PHE 270.A N VAL 223.A O no hydrogen 2.864 N/A THR 271.A N ARG 159.A O no hydrogen 3.052 N/A THR 271.A OG1 ALA 213.A O no hydrogen 2.697 N/A GLY 273.A N ARG 157.A O no hydrogen 2.952 N/A LYS 274.A N ASP 216.A OD1 no hydrogen 2.839 N/A ARG 277.A N PRO 156.A O no hydrogen 2.851 N/A ARG 277.A NE LEU 187.A O no hydrogen 2.770 N/A ARG 277.A NE ASP 188.A O no hydrogen 3.189 N/A ARG 277.A NH1 GLY 155.A O no hydrogen 3.235 N/A ARG 277.A NH1 LEU 158.A O no hydrogen 2.970 N/A ARG 277.A NH2 ASP 188.A O no hydrogen 2.832 N/A