Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pk9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N LYS 17.A O no hydrogen 2.549 N/A LEU 7.A N VAL 15.A O no hydrogen 2.984 N/A ASN 9.A ND2 GLY 8.A O no hydrogen 3.638 N/A THR 14.A N GLU 31.A O no hydrogen 2.906 N/A THR 14.A OG1 GLU 31.A OE1 no hydrogen 3.066 N/A TYR 16.A N LEU 29.A O no hydrogen 2.741 N/A LYS 17.A N GLU 5.A O no hydrogen 2.726 N/A GLY 18.A N VAL 27.A O no hydrogen 2.728 N/A ASN 20.A N VAL 25.A O no hydrogen 2.964 N/A THR 22.A N ASN 20.A OD1 no hydrogen 2.732 N/A THR 23.A N ASN 20.A OD1 no hydrogen 3.220 N/A VAL 27.A N GLY 18.A O no hydrogen 2.937 N/A ALA 28.A N PHE 73.A O no hydrogen 2.750 N/A LEU 29.A N TYR 16.A O no hydrogen 2.795 N/A LYS 30.A N LEU 71.A O no hydrogen 2.759 N/A LYS 30.A NZ GLU 46.A OE1 no hydrogen 2.998 N/A LYS 30.A NZ GLU 46.A OE2 no hydrogen 3.371 N/A GLU 31.A N THR 14.A O no hydrogen 2.932 N/A VAL 32.A N LEU 69.A O no hydrogen 2.797 N/A LYS 33.A N TYR 12.A O no hydrogen 3.493 N/A GLU 37.A N SER 35.A OG no hydrogen 3.299 N/A GLY 38.A N SER 35.A O no hydrogen 2.810 N/A ALA 43.A N PRO 40.A O no hydrogen 2.703 N/A ILE 44.A N PRO 40.A O no hydrogen 3.295 N/A ARG 45.A N SER 41.A O no hydrogen 3.027 N/A ARG 45.A NH1 ALA 141.A O no hydrogen 3.510 N/A GLU 46.A N THR 42.A O no hydrogen 3.056 N/A ILE 47.A N ALA 43.A O no hydrogen 2.756 N/A SER 48.A N ILE 44.A O no hydrogen 3.209 N/A LEU 49.A N ARG 45.A O no hydrogen 3.118 N/A MET 50.A N GLU 46.A O no hydrogen 2.855 N/A LYS 51.A N ILE 47.A O no hydrogen 3.375 N/A GLU 52.A N LEU 49.A O no hydrogen 2.939 N/A LEU 53.A N MET 50.A O no hydrogen 2.764 N/A LYS 54.A NZ LYS 51.A O no hydrogen 2.798 N/A ASN 57.A N HIS 55.A ND1 no hydrogen 2.941 N/A ASN 57.A ND2 LEU 133.A O no hydrogen 2.551 N/A ILE 58.A N HIS 55.A O no hydrogen 3.339 N/A VAL 59.A N LEU 135.A O no hydrogen 3.043 N/A ARG 60.A N GLU 74.A OE1 no hydrogen 2.948 N/A TYR 62.A N VAL 72.A O no hydrogen 2.696 N/A VAL 64.A N ASP 63.A OD1 no hydrogen 2.964 N/A ILE 65.A N THR 70.A O no hydrogen 2.921 N/A LYS 68.A NZ GLU 31.A OE2 no hydrogen 2.707 N/A THR 70.A N ILE 65.A O no hydrogen 2.801 N/A LEU 71.A N LYS 30.A O no hydrogen 2.747 N/A VAL 72.A N ASP 63.A O no hydrogen 3.060 N/A PHE 73.A N ALA 28.A O no hydrogen 2.888 N/A GLU 74.A N ARG 60.A O no hydrogen 2.783 N/A ASN 78.A N ILE 127.A O no hydrogen 3.162 N/A ASN 78.A ND2 ILE 127.A O no hydrogen 2.905 N/A LEU 80.A N LEU 125.A O no hydrogen 2.925 N/A LYS 82.A N ASP 79.A OD1 no hydrogen 2.745 N/A TYR 83.A N ASP 79.A O no hydrogen 2.570 N/A MET 84.A N LEU 80.A O no hydrogen 3.114 N/A ASP 85.A N LYS 81.A O no hydrogen 3.257 N/A SER 86.A OG LYS 82.A O no hydrogen 2.756 N/A SER 86.A OG TYR 83.A O no hydrogen 3.319 N/A ARG 87.A N MET 84.A O no hydrogen 3.018 N/A LEU 91.A N MET 188.A O no hydrogen 2.835 N/A LEU 93.A N GLU 250.A OE1 no hydrogen 3.255 N/A LEU 93.A N GLU 250.A OE2 no hydrogen 3.245 N/A LEU 95.A N GLU 92.A O no hydrogen 2.868 N/A LEU 95.A N GLU 92.A OE2 no hydrogen 3.091 N/A VAL 96.A N GLU 92.A O no hydrogen 2.939 N/A LYS 97.A N LEU 93.A O no hydrogen 2.985 N/A LYS 97.A NZ GLU 285.A OE1 no hydrogen 2.827 N/A TYR 98.A N ASN 94.A O no hydrogen 3.309 N/A PHE 99.A N LEU 95.A O no hydrogen 3.238 N/A GLN 100.A N VAL 96.A O no hydrogen 3.233 N/A GLN 100.A NE2 CYS 181.A O no hydrogen 3.371 N/A TRP 101.A N LYS 97.A O no hydrogen 2.808 N/A GLN 102.A N TYR 98.A O no hydrogen 2.944 N/A LEU 103.A N PHE 99.A O no hydrogen 3.096 N/A LEU 104.A N GLN 100.A O no hydrogen 3.323 N/A GLN 105.A N TRP 101.A O no hydrogen 2.956 N/A GLY 106.A N GLN 102.A O no hydrogen 3.156 N/A LEU 107.A N LEU 103.A O no hydrogen 3.045 N/A ALA 108.A N LEU 104.A O no hydrogen 2.875 N/A PHE 109.A N GLY 106.A O no hydrogen 3.228 N/A CYS 110.A N GLY 106.A O no hydrogen 3.193 N/A CYS 110.A SG GLY 106.A O no hydrogen 3.351 N/A HIS 111.A N LEU 107.A O no hydrogen 2.811 N/A HIS 111.A NE2 ASP 177.A OD2 no hydrogen 2.784 N/A GLU 112.A N ALA 108.A O no hydrogen 3.160 N/A ASN 113.A N PHE 109.A O no hydrogen 3.043 N/A ASN 113.A ND2 PHE 109.A O no hydrogen 3.225 N/A LYS 114.A N HIS 111.A O no hydrogen 3.135 N/A ILE 115.A N CYS 110.A O no hydrogen 2.956 N/A LEU 116.A N ARG 142.A O no hydrogen 2.983 N/A HIS 117.A N ASP 177.A OD2 no hydrogen 2.857 N/A HIS 117.A NE2 GLY 136.A O no hydrogen 2.959 N/A ARG 118.A N ASP 177.A OD1 no hydrogen 2.934 N/A ARG 118.A NH1 LEU 140.A O no hydrogen 3.020 N/A ASP 119.A N HIS 117.A ND1 no hydrogen 3.181 N/A ASN 124.A ND2 ASP 119.A O no hydrogen 2.575 N/A LEU 125.A N PRO 122.A O no hydrogen 3.026 N/A LEU 126.A N LYS 134.A O no hydrogen 3.197 N/A ILE 127.A N ASN 78.A O no hydrogen 2.781 N/A ASN 128.A N GLN 132.A O no hydrogen 3.186 N/A LYS 129.A N ASP 77.A OD1 no hydrogen 2.814 N/A LYS 129.A NZ ASP 77.A OD2 no hydrogen 2.565 N/A ARG 130.A N ASN 128.A OD1 no hydrogen 3.073 N/A ARG 130.A NE GLN 132.A OE1 no hydrogen 3.516 N/A GLY 131.A N ASN 128.A O no hydrogen 3.069 N/A GLN 132.A N ASN 128.A OD1 no hydrogen 2.966 N/A LYS 134.A N LEU 126.A O no hydrogen 2.893 N/A LYS 134.A NZ GLU 74.A OE2 no hydrogen 2.709 N/A LEU 135.A N ASN 57.A O no hydrogen 3.168 N/A GLY 136.A N ASN 124.A O no hydrogen 3.053 N/A ARG 142.A N LEU 116.A O no hydrogen 3.073 N/A GLY 145.A N LYS 114.A O no hydrogen 3.285 N/A ILE 146.A N ALA 143.A O no hydrogen 3.124 N/A VAL 148.A N ILE 146.A O no hydrogen 2.619 N/A SER 152.A OG TYR 172.A OH no hydrogen 3.383 N/A TRP 159.A NE1 GLY 197.A O no hydrogen 2.850 N/A TYR 160.A OH GLU 187.A OE1 no hydrogen 2.558 N/A TYR 160.A OH GLU 187.A OE2 no hydrogen 3.140 N/A ARG 161.A N LEU 158.A O no hydrogen 2.939 N/A LEU 166.A N ALA 162.A O no hydrogen 3.045 N/A MET 167.A N ASP 164.A O no hydrogen 2.874 N/A GLY 168.A N VAL 165.A O no hydrogen 2.941 N/A SER 169.A N ASP 164.A O no hydrogen 3.294 N/A ARG 170.A NH1 THR 150.A O no hydrogen 2.804 N/A TYR 172.A OH SER 152.A OG no hydrogen 3.383 N/A THR 174.A N SER 173.A OG no hydrogen 2.439 N/A ILE 176.A N SER 173.A O no hydrogen 3.387 N/A SER 180.A OG TYR 160.A O no hydrogen 2.559 N/A CYS 181.A N ASP 177.A O no hydrogen 3.275 N/A CYS 181.A SG ASP 177.A O no hydrogen 3.317 N/A GLY 182.A N ILE 178.A O no hydrogen 3.192 N/A CYS 183.A N TRP 179.A O no hydrogen 3.171 N/A CYS 183.A N SER 180.A O no hydrogen 3.244 N/A CYS 183.A SG TRP 159.A O no hydrogen 3.940 N/A CYS 183.A SG TRP 179.A O no hydrogen 3.521 N/A ILE 184.A N SER 180.A O no hydrogen 2.784 N/A LEU 185.A N CYS 181.A O no hydrogen 2.968 N/A ALA 186.A N GLY 182.A O no hydrogen 3.245 N/A GLU 187.A N CYS 183.A O no hydrogen 3.058 N/A MET 188.A N ILE 184.A O no hydrogen 3.039 N/A ILE 189.A N LEU 185.A O no hydrogen 3.004 N/A THR 190.A N ALA 186.A O no hydrogen 2.805 N/A THR 190.A OG1 ALA 186.A O no hydrogen 2.889 N/A THR 190.A OG1 LYS 192.A O no hydrogen 2.875 N/A GLY 191.A N GLU 187.A O no hydrogen 2.639 N/A GLY 197.A N PHE 195.A O no hydrogen 2.708 N/A GLY 197.A N GLN 203.A OE1 no hydrogen 3.078 N/A THR 198.A OG1 GLU 202.A OE1 no hydrogen 3.427 N/A THR 198.A OG1 GLU 202.A OE2 no hydrogen 3.425 N/A GLU 202.A N ASN 199.A OD1 no hydrogen 2.988 N/A GLN 203.A N ASN 199.A O no hydrogen 2.907 N/A GLN 203.A NE2 PHE 195.A O no hydrogen 2.779 N/A LYS 205.A N GLU 201.A O no hydrogen 3.228 N/A LYS 205.A NZ ASP 209.A OD2 no hydrogen 2.869 N/A LEU 206.A N GLU 202.A O no hydrogen 2.823 N/A ILE 207.A N GLN 203.A O no hydrogen 2.982 N/A PHE 208.A N LEU 204.A O no hydrogen 2.918 N/A ASP 209.A N LYS 205.A O no hydrogen 2.855 N/A ILE 210.A N ILE 207.A O no hydrogen 3.046 N/A MET 211.A N ILE 207.A O no hydrogen 2.698 N/A THR 213.A N ARG 235.A O no hydrogen 3.319 N/A THR 213.A OG1 ARG 235.A O no hydrogen 3.472 N/A SER 217.A N ASN 215.A OD1 no hydrogen 3.130 N/A VAL 222.A N TRP 219.A O no hydrogen 3.462 N/A THR 223.A OG1 PRO 220.A O no hydrogen 3.400 N/A LYS 224.A N SER 221.A O no hydrogen 3.062 N/A LEU 225.A N VAL 222.A O no hydrogen 3.190 N/A LYS 227.A N MET 167.A O no hydrogen 2.855 N/A TYR 228.A N LEU 225.A O no hydrogen 2.962 N/A ASN 231.A N ASN 229.A OD1 no hydrogen 3.236 N/A ASN 231.A ND2 ASN 229.A OD1 no hydrogen 3.348 N/A ARG 235.A N THR 213.A OG1 no hydrogen 2.935 N/A ARG 235.A NE GLN 233.A O no hydrogen 3.432 N/A ARG 235.A NH1 ASP 209.A OD1 no hydrogen 2.457 N/A ARG 238.A N ILE 210.A O no hydrogen 2.763 N/A GLN 242.A N ASP 239.A O no hydrogen 3.215 N/A GLN 242.A NE2 GLN 242.A O no hydrogen 2.938 N/A VAL 243.A N LEU 240.A O no hydrogen 3.047 N/A LEU 244.A N LEU 240.A O no hydrogen 3.064 N/A GLN 245.A N ARG 241.A O no hydrogen 3.011 N/A HIS 247.A N LEU 244.A O no hydrogen 2.729 N/A THR 248.A N GLN 245.A O no hydrogen 3.095 N/A MET 257.A N ASP 253.A O no hydrogen 3.308 N/A ASP 258.A N GLY 254.A O no hydrogen 2.814 N/A PHE 259.A N ASN 255.A O no hydrogen 2.918 N/A LEU 260.A N LEU 256.A O no hydrogen 3.054 N/A HIS 261.A N MET 257.A O no hydrogen 3.034 N/A GLY 262.A N ASP 258.A O no hydrogen 2.965 N/A LEU 263.A N PHE 259.A O no hydrogen 3.240 N/A LEU 263.A N LEU 260.A O no hydrogen 3.250 N/A LEU 264.A N LEU 260.A O no hydrogen 3.076 N/A ASN 267.A ND2 LEU 218.A O no hydrogen 3.430 N/A ASP 269.A N ASN 267.A OD1 no hydrogen 3.046 N/A MET 270.A N ASN 267.A O no hydrogen 2.839 N/A ARG 271.A N PRO 268.A O no hydrogen 2.774 N/A ARG 271.A NH2 ASP 164.A OD1 no hydrogen 3.520 N/A LEU 272.A N GLY 262.A O no hydrogen 2.874 N/A GLN 276.A N SER 273.A OG no hydrogen 3.118 N/A ALA 277.A N SER 273.A O no hydrogen 2.601 N/A LEU 278.A N ALA 274.A O no hydrogen 3.157 N/A HIS 279.A N GLN 276.A O no hydrogen 3.127 N/A HIS 280.A N ALA 277.A O no hydrogen 3.341 N/A HIS 280.A NE2 ASP 258.A OD1 no hydrogen 3.009 N/A TRP 282.A N HIS 280.A ND1 no hydrogen 2.944 N/A PHE 283.A N HIS 280.A O no hydrogen 2.920 N/A ALA 284.A N PRO 281.A O no hydrogen 3.134 N/A TYR 286.A N PHE 283.A O no hydrogen 3.272 N/A TYR 287.A N ALA 284.A O no hydrogen 2.931 N/A TYR 287.A OH LEU 278.A O no hydrogen 2.536 N/A