Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zq6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ ASP 4.A OD1 no hydrogen 3.113 N/A ASP 4.A N ALA 1.A O no hydrogen 2.927 N/A LEU 5.A N PHE 2.A O no hydrogen 2.898 N/A PHE 6.A N LYS 3.A O no hydrogen 3.461 N/A LYS 7.A NZ PRO 198.A O no hydrogen 3.429 N/A LYS 7.A NZ GLU 199.A OE2 no hydrogen 3.520 N/A ASN 9.A ND2 GLU 199.A O no hydrogen 3.157 N/A LYS 12.A N ASN 9.A O no hydrogen 2.716 N/A LYS 12.A NZ ASP 115.A OD2 no hydrogen 3.256 N/A THR 13.A N ASP 115.A OD1 no hydrogen 3.068 N/A THR 13.A OG1 ASP 115.A OD1 no hydrogen 3.507 N/A THR 13.A OG1 TYR 117.A O no hydrogen 2.816 N/A THR 14.A N ASP 118.A O no hydrogen 2.944 N/A THR 14.A OG1 LYS 7.A O no hydrogen 2.505 N/A PHE 15.A N ARG 200.A O no hydrogen 2.797 N/A VAL 16.A N VAL 120.A O no hydrogen 2.962 N/A PHE 17.A N SER 202.A O no hydrogen 2.891 N/A ILE 18.A N PHE 122.A O no hydrogen 3.001 N/A GLY 19.A N LYS 204.A O no hydrogen 3.092 N/A LYS 26.A NZ GLY 20.A O no hydrogen 3.524 N/A LYS 26.A NZ LYS 21.A O no hydrogen 2.814 N/A THR 27.A OG1 ASP 123.A OD1 no hydrogen 3.160 N/A THR 27.A OG1 ASP 123.A OD2 no hydrogen 2.595 N/A ILE 29.A N GLY 25.A O no hydrogen 2.818 N/A SER 30.A N LYS 26.A O no hydrogen 2.854 N/A SER 30.A OG LYS 26.A O no hydrogen 2.697 N/A SER 30.A OG ASP 123.A OD1 no hydrogen 3.199 N/A ALA 31.A N THR 27.A O no hydrogen 2.907 N/A ALA 32.A N THR 28.A O no hydrogen 3.008 N/A THR 33.A N ILE 29.A O no hydrogen 2.860 N/A THR 33.A OG1 ILE 29.A O no hydrogen 2.555 N/A THR 33.A OG1 TYR 296.A OH no hydrogen 2.744 N/A ALA 34.A N SER 30.A O no hydrogen 2.926 N/A LEU 35.A N ALA 31.A O no hydrogen 2.986 N/A TRP 36.A N ALA 32.A O no hydrogen 2.997 N/A TRP 36.A NE1 GLY 297.A O no hydrogen 2.877 N/A MET 37.A N THR 33.A O no hydrogen 2.930 N/A ALA 38.A N ALA 34.A O no hydrogen 2.894 N/A ARG 39.A N LEU 35.A O no hydrogen 2.979 N/A ARG 39.A NE GLU 289.A OE2 no hydrogen 3.326 N/A SER 40.A N TRP 36.A O no hydrogen 3.031 N/A SER 40.A N MET 37.A O no hydrogen 2.986 N/A SER 40.A OG TRP 36.A O no hydrogen 3.049 N/A GLY 41.A N ALA 38.A O no hydrogen 2.896 N/A LYS 42.A N MET 37.A O no hydrogen 3.031 N/A LYS 43.A N ASP 118.A OD2 no hydrogen 2.726 N/A THR 44.A N ASN 73.A O no hydrogen 2.684 N/A THR 44.A OG1 LYS 42.A O no hydrogen 2.907 N/A LEU 45.A N ILE 119.A O no hydrogen 3.070 N/A VAL 46.A N TYR 75.A O no hydrogen 2.955 N/A ILE 47.A N ILE 121.A O no hydrogen 2.739 N/A SER 48.A N VAL 77.A O no hydrogen 2.939 N/A SER 48.A OG HIS 53.A ND1 no hydrogen 2.651 N/A THR 49.A N ASP 123.A O no hydrogen 2.998 N/A THR 49.A OG1 ASP 123.A O no hydrogen 3.553 N/A ALA 52.A N ASP 50.A OD1 no hydrogen 3.153 N/A HIS 53.A ND1 SER 48.A OG no hydrogen 2.651 N/A HIS 53.A NE2 ILE 79.A O no hydrogen 2.590 N/A SER 56.A N GLU 78.A OE2 no hydrogen 2.695 N/A SER 56.A OG ARG 61.A O no hydrogen 2.432 N/A SER 58.A N SER 54.A O no hydrogen 2.798 N/A LEU 59.A N LEU 55.A O no hydrogen 2.803 N/A GLU 60.A N ASP 57.A O no hydrogen 3.360 N/A ARG 61.A N SER 56.A O no hydrogen 3.072 N/A ARG 61.A NH1 ILE 70.A O no hydrogen 2.859 N/A GLY 64.A N THR 68.A OG1 no hydrogen 3.196 N/A HIS 65.A NE2 GLU 87.A OE1 no hydrogen 3.164 N/A THR 68.A N ALA 76.A O no hydrogen 2.864 N/A THR 68.A OG1 THR 66.A O no hydrogen 3.180 N/A THR 68.A OG1 ALA 76.A O no hydrogen 3.525 N/A ILE 70.A N LEU 74.A O no hydrogen 2.807 N/A THR 71.A N LEU 74.A O no hydrogen 3.401 N/A LEU 74.A N THR 71.A O no hydrogen 2.924 N/A TYR 75.A N THR 44.A O no hydrogen 2.889 N/A ALA 76.A N THR 68.A O no hydrogen 2.794 N/A VAL 77.A N VAL 46.A O no hydrogen 3.070 N/A GLU 78.A N GLY 64.A O no hydrogen 2.903 N/A ILE 79.A N SER 48.A O no hydrogen 3.505 N/A ASP 80.A N HIS 65.A ND1 no hydrogen 2.951 N/A ALA 84.A N ASP 80.A O no hydrogen 2.873 N/A MET 85.A N PRO 81.A O no hydrogen 2.885 N/A GLU 86.A N GLU 82.A O no hydrogen 3.368 N/A GLU 87.A N VAL 83.A O no hydrogen 2.992 N/A TYR 88.A N MET 85.A O no hydrogen 2.804 N/A GLN 89.A N MET 85.A O no hydrogen 2.991 N/A ALA 90.A N GLU 86.A O no hydrogen 3.042 N/A LEU 92.A N TYR 88.A O no hydrogen 3.293 N/A SER 96.A N ALA 93.A O no hydrogen 3.318 N/A SER 96.A OG ALA 93.A O no hydrogen 3.293 N/A ILE 99.A N SER 96.A O no hydrogen 3.053 N/A ALA 102.A N GLY 98.A O no hydrogen 3.153 N/A ALA 103.A N ILE 99.A O no hydrogen 2.856 N/A ALA 104.A N ASP 100.A O no hydrogen 3.048 N/A PHE 105.A N GLU 101.A O no hydrogen 2.951 N/A ASP 106.A N ALA 102.A O no hydrogen 3.016 N/A GLN 107.A N ALA 103.A O no hydrogen 3.197 N/A PHE 108.A N ALA 104.A O no hydrogen 3.167 N/A LEU 109.A N PHE 105.A O no hydrogen 3.015 N/A ARG 110.A N ASP 106.A O no hydrogen 2.984 N/A ARG 110.A NH2 GLU 87.A OE1 no hydrogen 2.510 N/A TYR 111.A N GLN 107.A O no hydrogen 3.166 N/A MET 112.A N PHE 108.A O no hydrogen 2.990 N/A THR 113.A N LEU 109.A O no hydrogen 2.814 N/A THR 113.A OG1 LEU 109.A O no hydrogen 2.738 N/A THR 114.A N ARG 110.A O no hydrogen 3.042 N/A ASP 115.A N TYR 111.A O no hydrogen 2.951 N/A GLU 116.A N THR 114.A OG1 no hydrogen 3.178 N/A ASP 118.A N LYS 43.A O no hydrogen 3.027 N/A ILE 119.A N LYS 43.A O no hydrogen 3.409 N/A VAL 120.A N THR 14.A O no hydrogen 2.773 N/A ILE 121.A N LEU 45.A O no hydrogen 2.761 N/A PHE 122.A N VAL 16.A O no hydrogen 2.789 N/A ASP 123.A N ILE 47.A O no hydrogen 2.762 N/A THR 124.A N ILE 18.A O no hydrogen 3.283 N/A THR 124.A OG1 ILE 18.A O no hydrogen 2.526 N/A THR 124.A OG1 ALA 125.A O no hydrogen 3.345 N/A THR 127.A N GLY 20.A O no hydrogen 2.948 N/A THR 127.A OG1 GLU 216.A OE2 no hydrogen 2.423 N/A HIS 129.A N PRO 126.A O no hydrogen 3.211 N/A THR 130.A OG1 ALA 125.A O no hydrogen 2.612 N/A LEU 131.A N THR 127.A O no hydrogen 2.966 N/A LEU 133.A N HIS 129.A O no hydrogen 3.018 N/A LEU 134.A N THR 130.A O no hydrogen 2.995 N/A SER 135.A N LEU 131.A O no hydrogen 3.044 N/A SER 135.A OG LEU 131.A O no hydrogen 3.082 N/A SER 135.A OG ARG 132.A O no hydrogen 3.264 N/A PHE 136.A N LEU 133.A O no hydrogen 3.108 N/A MET 140.A N PHE 136.A O no hydrogen 2.800 N/A ASP 141.A N PRO 137.A O no hydrogen 2.787 N/A SER 142.A N GLU 138.A O no hydrogen 3.036 N/A SER 142.A OG GLU 138.A O no hydrogen 3.293 N/A TRP 143.A N ILE 139.A O no hydrogen 3.013 N/A VAL 144.A N MET 140.A O no hydrogen 2.951 N/A GLY 145.A N ASP 141.A O no hydrogen 2.993 N/A LYS 146.A N SER 142.A O no hydrogen 2.852 N/A MET 147.A N TRP 143.A O no hydrogen 2.963 N/A ILE 148.A N VAL 144.A O no hydrogen 2.993 N/A LYS 149.A N GLY 145.A O no hydrogen 3.144 N/A LYS 149.A NZ GLN 153.A OE1 no hydrogen 3.280 N/A ILE 150.A N LYS 146.A O no hydrogen 2.995 N/A ARG 151.A N MET 147.A O no hydrogen 2.884 N/A ARG 151.A NE GLU 174.A OE2 no hydrogen 2.830 N/A ARG 151.A NH2 GLU 174.A OE1 no hydrogen 2.739 N/A ARG 151.A NH2 GLU 174.A OE2 no hydrogen 3.549 N/A ARG 152.A N ILE 148.A O no hydrogen 2.886 N/A ARG 152.A NH2 GLU 182.A OE2 no hydrogen 2.824 N/A GLN 153.A N LYS 149.A O no hydrogen 3.043 N/A ILE 154.A N ILE 150.A O no hydrogen 2.995 N/A GLY 155.A N ARG 151.A O no hydrogen 3.065 N/A SER 156.A N ARG 152.A O no hydrogen 2.860 N/A SER 156.A OG ARG 152.A O no hydrogen 3.246 N/A MET 157.A N GLN 153.A O no hydrogen 3.048 N/A ALA 158.A N ILE 154.A O no hydrogen 2.901 N/A LYS 159.A N GLY 155.A O no hydrogen 3.125 N/A LYS 159.A N SER 156.A O no hydrogen 3.327 N/A ALA 160.A N MET 157.A O no hydrogen 2.975 N/A LYS 162.A N LYS 159.A O no hydrogen 3.398 N/A LYS 162.A NZ GLU 171.A OE2 no hydrogen 2.420 N/A ILE 164.A N PHE 161.A O no hydrogen 2.833 N/A LEU 165.A N PHE 161.A O no hydrogen 2.710 N/A GLU 173.A N ASP 170.A OD1 no hydrogen 3.472 N/A GLU 174.A N ASP 170.A O no hydrogen 3.091 N/A ASP 175.A N GLU 171.A O no hydrogen 2.813 N/A ARG 176.A N GLU 172.A O no hydrogen 3.064 N/A ALA 177.A N GLU 173.A O no hydrogen 3.067 N/A LEU 178.A N GLU 174.A O no hydrogen 2.967 N/A GLN 179.A N ASP 175.A O no hydrogen 2.924 N/A ASP 180.A N ARG 176.A O no hydrogen 2.865 N/A MET 181.A N ALA 177.A O no hydrogen 2.933 N/A GLU 182.A N LEU 178.A O no hydrogen 2.929 N/A ALA 183.A N GLN 179.A O no hydrogen 3.013 N/A THR 184.A N ASP 180.A O no hydrogen 3.043 N/A THR 184.A OG1 ASP 180.A O no hydrogen 3.324 N/A LYS 185.A N MET 181.A O no hydrogen 2.987 N/A LYS 185.A NZ ASP 141.A OD1 no hydrogen 2.994 N/A LYS 186.A N GLU 182.A O no hydrogen 2.882 N/A GLN 187.A N ALA 183.A O no hydrogen 3.070 N/A GLN 187.A NE2 THR 113.A OG1 no hydrogen 3.125 N/A ILE 188.A N THR 184.A O no hydrogen 3.011 N/A ASN 189.A N LYS 185.A O no hydrogen 2.848 N/A ALA 190.A N LYS 186.A O no hydrogen 2.739 N/A ALA 191.A N GLN 187.A O no hydrogen 3.051 N/A ARG 192.A N ILE 188.A O no hydrogen 3.076 N/A GLU 193.A N ASN 189.A O no hydrogen 3.126 N/A VAL 194.A N ALA 190.A O no hydrogen 2.921 N/A MET 195.A N ALA 191.A O no hydrogen 2.917 N/A SER 196.A N ARG 192.A O no hydrogen 3.332 N/A SER 196.A OG ARG 192.A O no hydrogen 3.392 N/A ASP 197.A N VAL 194.A O no hydrogen 3.187 N/A GLU 199.A N ASP 197.A OD1 no hydrogen 2.982 N/A ARG 200.A N ASP 197.A O no hydrogen 2.775 N/A ARG 200.A NE THR 13.A O no hydrogen 2.969 N/A ARG 200.A NH2 THR 13.A O no hydrogen 2.954 N/A THR 201.A N ASP 197.A O no hydrogen 2.944 N/A THR 201.A OG1 VAL 194.A O no hydrogen 2.796 N/A SER 202.A N PHE 15.A O no hydrogen 3.012 N/A PHE 203.A N HIS 230.A O no hydrogen 2.874 N/A LYS 204.A N PHE 17.A O no hydrogen 2.871 N/A LYS 204.A NZ LEU 5.A O no hydrogen 2.869 N/A LYS 204.A NZ SER 202.A OG no hydrogen 2.739 N/A LYS 204.A NZ ASP 232.A OD1 no hydrogen 2.856 N/A LYS 204.A NZ ASP 232.A OD2 no hydrogen 3.400 N/A MET 205.A N GLY 233.A O no hydrogen 2.889 N/A VAL 206.A N GLY 19.A O no hydrogen 2.760 N/A VAL 207.A N ILE 235.A O no hydrogen 2.815 N/A ILE 208.A N SER 213.A OG no hydrogen 3.210 N/A GLU 210.A N ILE 208.A O no hydrogen 2.726 N/A ILE 214.A N GLU 210.A O no hydrogen 2.972 N/A TYR 215.A N GLU 211.A O no hydrogen 2.866 N/A GLU 216.A N MET 212.A O no hydrogen 3.302 N/A SER 217.A N SER 213.A O no hydrogen 3.010 N/A SER 217.A OG SER 213.A O no hydrogen 3.382 N/A GLU 218.A N ILE 214.A O no hydrogen 2.905 N/A ARG 219.A N TYR 215.A O no hydrogen 3.065 N/A ALA 220.A N GLU 216.A O no hydrogen 2.828 N/A MET 221.A N SER 217.A O no hydrogen 2.813 N/A LYS 222.A N GLU 218.A O no hydrogen 3.324 N/A ALA 223.A N ARG 219.A O no hydrogen 3.066 N/A LEU 224.A N ALA 220.A O no hydrogen 2.841 N/A GLU 225.A N MET 221.A O no hydrogen 2.995 N/A LYS 226.A N LYS 222.A O no hydrogen 3.114 N/A TYR 227.A N ALA 223.A O no hydrogen 3.348 N/A ILE 229.A N LEU 224.A O no hydrogen 3.082 N/A VAL 234.A N VAL 271.A O no hydrogen 2.842 N/A ILE 235.A N MET 205.A O no hydrogen 2.802 N/A VAL 236.A N ALA 273.A O no hydrogen 2.722 N/A ASN 237.A N VAL 207.A O no hydrogen 2.755 N/A ASN 237.A ND2 VAL 24.A O no hydrogen 2.843 N/A GLN 238.A N ASN 237.A OD1 no hydrogen 2.851 N/A GLN 238.A NE2 GLY 23.A O no hydrogen 3.303 N/A GLN 238.A NE2 VAL 24.A O no hydrogen 3.219 N/A VAL 239.A N VAL 275.A O no hydrogen 3.237 N/A LEU 240.A N GLN 256.A OE1 no hydrogen 2.826 N/A SER 244.A OG PRO 241.A O no hydrogen 2.930 N/A CYS 249.A SG SER 244.A OG no hydrogen 3.559 N/A ASN 250.A N CYS 246.A O no hydrogen 2.991 N/A ALA 251.A N GLU 247.A O no hydrogen 3.204 N/A ARG 252.A N PHE 248.A O no hydrogen 3.259 N/A ARG 252.A NH2 GLU 210.A OE2 no hydrogen 3.521 N/A ARG 253.A N CYS 249.A O no hydrogen 2.767 N/A ARG 253.A NE LEU 240.A O no hydrogen 2.795 N/A LYS 254.A N ASN 250.A O no hydrogen 2.911 N/A LEU 255.A N ALA 251.A O no hydrogen 3.101 N/A GLN 256.A N ARG 252.A O no hydrogen 2.769 N/A GLN 256.A NE2 GLN 238.A O no hydrogen 3.520 N/A GLN 257.A N ARG 253.A O no hydrogen 2.880 N/A GLU 258.A N LYS 254.A O no hydrogen 3.322 N/A ARG 259.A N LEU 255.A O no hydrogen 3.065 N/A ARG 259.A NH1 GLU 258.A OE1 no hydrogen 3.055 N/A LEU 260.A N GLN 256.A O no hydrogen 2.751 N/A LYS 261.A N GLN 257.A O no hydrogen 3.216 N/A GLN 262.A N GLU 258.A O no hydrogen 3.118 N/A GLN 262.A NE2 GLU 211.A OE2 no hydrogen 3.516 N/A GLN 262.A NE2 GLU 258.A OE1 no hydrogen 2.831 N/A ILE 263.A N ARG 259.A O no hydrogen 2.818 N/A ARG 264.A N LEU 260.A O no hydrogen 2.903 N/A GLU 265.A N LYS 261.A O no hydrogen 2.983 N/A LYS 266.A N GLN 262.A O no hydrogen 2.678 N/A LYS 266.A NZ GLU 218.A OE1 no hydrogen 3.484 N/A LYS 266.A NZ GLU 218.A OE2 no hydrogen 3.404 N/A PHE 267.A N ILE 263.A O no hydrogen 2.886 N/A SER 268.A OG GLU 265.A O no hydrogen 3.486 N/A ASP 269.A N ASP 269.A OD1 no hydrogen 2.478 N/A LYS 270.A N PHE 267.A O no hydrogen 2.862 N/A LYS 270.A NZ GLU 225.A OE1 no hydrogen 3.523 N/A VAL 271.A N ASP 232.A O no hydrogen 3.321 N/A ALA 273.A N VAL 234.A O no hydrogen 2.920 N/A VAL 275.A N VAL 236.A O no hydrogen 2.740 N/A LEU 277.A N VAL 239.A O no hydrogen 2.961 N/A LYS 283.A NZ ASP 57.A O no hydrogen 3.286 N/A GLY 284.A N SER 58.A O no hydrogen 2.860 N/A THR 287.A OG1 LYS 283.A O no hydrogen 3.493 N/A LEU 288.A N GLY 284.A O no hydrogen 2.923 N/A GLU 289.A N ILE 285.A O no hydrogen 2.831 N/A LYS 290.A N GLU 286.A O no hydrogen 3.243 N/A ILE 291.A N THR 287.A O no hydrogen 3.219 N/A ALA 292.A N LEU 288.A O no hydrogen 2.980 N/A GLU 293.A N GLU 289.A O no hydrogen 2.825 N/A GLN 294.A N LYS 290.A O no hydrogen 3.228 N/A LEU 295.A N ILE 291.A O no hydrogen 3.079 N/A TYR 296.A N ALA 292.A O no hydrogen 2.795 N/A TYR 296.A OH THR 33.A OG1 no hydrogen 2.744 N/A GLY 297.A N GLU 293.A O no hydrogen 2.875 N/A