Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6vni_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A NE2 TYR 77.A OH no hydrogen 2.893 N/A PHE 3.A N VAL 75.A O no hydrogen 2.983 N/A GLU 4.A N TYR 27.A OH no hydrogen 3.058 N/A HIS 7.A N GLU 4.A O no hydrogen 2.927 N/A LEU 8.A N GLU 5.A O no hydrogen 3.132 N/A LYS 9.A N ARG 26.A O no hydrogen 2.895 N/A LYS 9.A NZ ARG 6.A O no hydrogen 2.597 N/A LEU 11.A N MET 24.A O no hydrogen 2.902 N/A GLN 12.A N MET 24.A O no hydrogen 3.037 N/A GLN 12.A NE2 GLN 13.A O no hydrogen 3.181 N/A GLN 13.A NE2 GLU 23.A OE1 no hydrogen 3.471 N/A LEU 14.A N VAL 22.A O no hydrogen 2.926 N/A GLY 15.A N VAL 22.A O no hydrogen 3.230 N/A GLY 17.A N GLY 20.A O no hydrogen 2.856 N/A ASN 18.A N ASN 18.A OD1 no hydrogen 2.298 N/A SER 21.A N LYS 42.A O no hydrogen 2.902 N/A VAL 22.A N GLY 15.A O no hydrogen 3.276 N/A GLU 23.A N VAL 40.A O no hydrogen 2.813 N/A MET 24.A N GLN 12.A O no hydrogen 2.806 N/A CYS 25.A N VAL 38.A O no hydrogen 2.980 N/A ARG 26.A N LYS 9.A O no hydrogen 2.933 N/A ARG 26.A NH1 GLY 35.A O no hydrogen 2.922 N/A TYR 27.A N GLU 36.A O no hydrogen 2.857 N/A ASP 28.A N HIS 7.A O no hydrogen 2.992 N/A GLN 31.A N ASP 28.A O no hydrogen 2.996 N/A ASN 33.A N ASP 28.A OD2 no hydrogen 2.703 N/A THR 34.A N ASP 32.A OD1 no hydrogen 3.409 N/A THR 34.A OG1 ASP 32.A OD1 no hydrogen 2.859 N/A THR 34.A OG1 ASP 32.A OD2 no hydrogen 3.458 N/A GLY 35.A N ASP 28.A OD1 no hydrogen 2.632 N/A GLU 36.A N TYR 27.A O no hydrogen 2.995 N/A VAL 38.A N CYS 25.A O no hydrogen 2.836 N/A ALA 39.A N MET 88.A O no hydrogen 2.878 N/A VAL 40.A N GLU 23.A O no hydrogen 2.842 N/A LYS 41.A N LEU 86.A O no hydrogen 2.870 N/A LYS 41.A NZ GLU 57.A OE2 no hydrogen 3.115 N/A LYS 42.A N SER 21.A O no hydrogen 2.931 N/A LYS 42.A NZ GLU 23.A OE1 no hydrogen 2.282 N/A GLN 44.A N PHE 19.A O no hydrogen 2.314 N/A THR 47.A N HIS 45.A O no hydrogen 2.998 N/A HIS 50.A N THR 47.A OG1 no hydrogen 3.222 N/A HIS 50.A ND1 HIS 45.A O no hydrogen 2.861 N/A LEU 51.A N THR 47.A O no hydrogen 2.933 N/A ARG 52.A N GLU 48.A O no hydrogen 2.967 N/A ASP 53.A N GLU 49.A O no hydrogen 2.907 N/A PHE 54.A N HIS 50.A O no hydrogen 2.881 N/A GLU 55.A N LEU 51.A O no hydrogen 2.972 N/A ARG 56.A N ARG 52.A O no hydrogen 2.952 N/A GLU 57.A N ASP 53.A O no hydrogen 2.874 N/A ILE 58.A N PHE 54.A O no hydrogen 2.915 N/A GLU 59.A N GLU 55.A O no hydrogen 2.971 N/A ILE 60.A N ARG 56.A O no hydrogen 2.875 N/A LEU 61.A N GLU 57.A O no hydrogen 2.914 N/A LYS 62.A N ILE 58.A O no hydrogen 2.926 N/A SER 63.A N GLU 59.A O no hydrogen 3.206 N/A SER 63.A N ILE 60.A O no hydrogen 3.114 N/A SER 63.A OG ILE 60.A O no hydrogen 2.712 N/A SER 63.A OG TYR 131.A OH no hydrogen 2.501 N/A LEU 64.A N LEU 61.A O no hydrogen 3.162 N/A GLN 65.A N TYR 125.A OH no hydrogen 3.010 N/A ASN 68.A N HIS 66.A ND1 no hydrogen 2.953 N/A ASN 68.A ND2 VAL 149.A O no hydrogen 3.094 N/A ILE 69.A N HIS 66.A O no hydrogen 3.080 N/A VAL 70.A N ILE 151.A O no hydrogen 3.047 N/A LYS 71.A N GLU 89.A OE2 no hydrogen 3.044 N/A LYS 73.A N ILE 87.A O no hydrogen 2.882 N/A LYS 73.A NZ GLU 36.A OE2 no hydrogen 3.045 N/A GLY 74.A N ILE 87.A O no hydrogen 3.141 N/A VAL 75.A N THR 1.A O no hydrogen 3.219 N/A CYS 76.A N LYS 85.A O no hydrogen 2.804 N/A CYS 76.A SG PHE 3.A O no hydrogen 3.198 N/A CYS 76.A SG GLU 5.A OE2 no hydrogen 3.838 N/A ARG 81.A NE GLU 55.A OE2 no hydrogen 2.869 N/A ARG 81.A NH1 GLU 48.A OE2 no hydrogen 2.745 N/A ARG 81.A NH2 GLU 55.A OE1 no hydrogen 2.868 N/A ARG 82.A N SER 78.A O no hydrogen 3.212 N/A LYS 85.A N CYS 76.A O no hydrogen 2.694 N/A LYS 85.A NZ ASN 83.A O no hydrogen 3.251 N/A LEU 86.A N LYS 41.A O no hydrogen 2.900 N/A ILE 87.A N GLY 74.A O no hydrogen 2.731 N/A MET 88.A N ALA 39.A O no hydrogen 2.862 N/A GLU 89.A N LYS 71.A O no hydrogen 3.049 N/A TYR 93.A N VAL 143.A O no hydrogen 3.288 N/A LEU 96.A N ILE 141.A O no hydrogen 2.687 N/A ASP 98.A N SER 95.A OG no hydrogen 3.236 N/A TYR 99.A N SER 95.A O no hydrogen 2.948 N/A LEU 100.A N LEU 96.A O no hydrogen 2.829 N/A GLN 101.A N ARG 97.A O no hydrogen 3.043 N/A LYS 102.A N ASP 98.A O no hydrogen 2.930 N/A LYS 102.A N TYR 99.A O no hydrogen 3.057 N/A HIS 103.A N TYR 99.A O no hydrogen 3.027 N/A HIS 103.A N LEU 100.A O no hydrogen 3.382 N/A HIS 103.A ND1 TYR 99.A O no hydrogen 3.170 N/A ARG 106.A N HIS 103.A O no hydrogen 3.046 N/A ARG 106.A NH2 GLU 146.A OE1 no hydrogen 3.045 N/A ILE 107.A N HIS 103.A O no hydrogen 3.282 N/A LYS 111.A N ASP 108.A OD1 no hydrogen 3.331 N/A LYS 111.A NZ GLN 114.A OE1 no hydrogen 3.414 N/A LYS 111.A NZ GLU 146.A O no hydrogen 3.149 N/A LEU 112.A N ASP 108.A O no hydrogen 2.960 N/A LEU 113.A N HIS 109.A O no hydrogen 2.924 N/A GLN 114.A N ILE 110.A O no hydrogen 2.925 N/A GLN 114.A NE2 ASN 147.A O no hydrogen 2.948 N/A GLN 114.A NE2 ASN 147.A OD1 no hydrogen 3.385 N/A TYR 115.A N LYS 111.A O no hydrogen 3.067 N/A TYR 115.A OH GLU 146.A O no hydrogen 2.856 N/A THR 116.A N LEU 112.A O no hydrogen 2.896 N/A THR 116.A OG1 LEU 112.A O no hydrogen 2.802 N/A SER 117.A N LEU 113.A O no hydrogen 2.872 N/A SER 117.A OG GLN 114.A O no hydrogen 3.518 N/A SER 117.A OG ASP 282.A OD1 no hydrogen 3.396 N/A GLN 118.A N GLN 114.A O no hydrogen 3.088 N/A GLN 118.A NE2 ASN 147.A O no hydrogen 2.702 N/A ILE 119.A N TYR 115.A O no hydrogen 2.916 N/A CYS 120.A N THR 116.A O no hydrogen 2.921 N/A CYS 120.A SG THR 116.A O no hydrogen 3.353 N/A LYS 121.A N SER 117.A O no hydrogen 2.934 N/A LYS 121.A NZ SER 117.A OG no hydrogen 3.415 N/A LYS 121.A NZ ASP 282.A OD2 no hydrogen 2.929 N/A GLY 122.A N GLN 118.A O no hydrogen 2.950 N/A MET 123.A N ILE 119.A O no hydrogen 2.927 N/A GLU 124.A N CYS 120.A O no hydrogen 2.876 N/A TYR 125.A N LYS 121.A O no hydrogen 3.018 N/A LEU 126.A N GLY 122.A O no hydrogen 2.937 N/A GLY 127.A N MET 123.A O no hydrogen 2.880 N/A THR 128.A N GLU 124.A O no hydrogen 3.038 N/A THR 128.A OG1 TYR 125.A O no hydrogen 2.648 N/A LYS 129.A N LEU 126.A O no hydrogen 2.988 N/A ARG 130.A N GLY 127.A O no hydrogen 2.913 N/A ARG 130.A NH1 GLU 165.A OE1 no hydrogen 2.762 N/A ARG 130.A NH1 GLU 165.A OE2 no hydrogen 3.515 N/A ARG 130.A NH2 PRO 161.A O no hydrogen 3.101 N/A ARG 130.A NH2 GLU 165.A OE1 no hydrogen 2.722 N/A TYR 131.A N LEU 126.A O no hydrogen 3.327 N/A TYR 131.A OH SER 63.A OG no hydrogen 2.501 N/A ILE 132.A N LYS 158.A O no hydrogen 2.801 N/A HIS 133.A N ASP 194.A OD2 no hydrogen 2.829 N/A ARG 134.A N ASP 194.A OD1 no hydrogen 3.118 N/A ARG 134.A NH1 LEU 156.A O no hydrogen 3.218 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 3.176 N/A THR 138.A N GLU 204.A OE2 no hydrogen 3.255 N/A THR 138.A OG1 GLU 204.A OE1 no hydrogen 2.556 N/A ARG 139.A NH2 ASP 135.A OD1 no hydrogen 3.323 N/A ASN 140.A N ALA 137.A O no hydrogen 2.864 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.735 N/A ILE 141.A N THR 138.A O no hydrogen 3.192 N/A LEU 142.A N LYS 150.A O no hydrogen 2.850 N/A VAL 143.A N GLY 94.A O no hydrogen 2.830 N/A GLU 144.A N ARG 148.A O no hydrogen 2.894 N/A ASN 145.A N ARG 148.A O no hydrogen 3.455 N/A ASN 147.A N ASN 145.A OD1 no hydrogen 2.900 N/A ARG 148.A N ASN 145.A O no hydrogen 3.153 N/A ARG 148.A NH1 ASP 67.A O no hydrogen 3.131 N/A VAL 149.A N GLN 118.A OE1 no hydrogen 2.921 N/A LYS 150.A N LEU 142.A O no hydrogen 2.852 N/A LYS 150.A NZ GLU 89.A OE1 no hydrogen 3.482 N/A LYS 150.A NZ GLU 89.A OE2 no hydrogen 2.580 N/A ILE 151.A N ASN 68.A O no hydrogen 2.794 N/A GLY 152.A N ASN 140.A O no hydrogen 3.075 N/A GLY 155.A N ASP 153.A OD2 no hydrogen 3.333 N/A THR 157.A N PHE 154.A O no hydrogen 3.245 N/A THR 157.A OG1 HIS 133.A O no hydrogen 3.343 N/A LYS 158.A N ILE 132.A O no hydrogen 3.001 N/A LEU 160.A N ARG 130.A O no hydrogen 2.934 N/A LYS 164.A N PRO 161.A O no hydrogen 3.213 N/A VAL 168.A N SER 187.A O no hydrogen 2.940 N/A TRP 178.A N PRO 175.A O no hydrogen 2.879 N/A TRP 178.A NE1 GLU 204.A OE2 no hydrogen 2.713 N/A TYR 179.A N ILE 176.A O no hydrogen 3.200 N/A GLU 182.A N GLU 182.A OE1 no hydrogen 2.750 N/A SER 183.A OG LYS 188.A O no hydrogen 2.830 N/A LEU 184.A N ALA 180.A O no hydrogen 3.071 N/A THR 185.A N PRO 181.A O no hydrogen 2.891 N/A THR 185.A OG1 PRO 181.A O no hydrogen 3.009 N/A GLU 186.A N GLU 182.A O no hydrogen 2.912 N/A SER 187.A OG VAL 168.A O no hydrogen 2.835 N/A LYS 188.A N GLU 182.A O no hydrogen 3.240 N/A PHE 189.A N TYR 166.A O no hydrogen 2.926 N/A SER 190.A N SER 193.A OG no hydrogen 2.904 N/A SER 193.A N SER 190.A OG no hydrogen 3.414 N/A SER 193.A OG SER 190.A O no hydrogen 2.937 N/A ASP 194.A N SER 190.A O no hydrogen 3.042 N/A VAL 195.A N VAL 191.A O no hydrogen 2.923 N/A TRP 196.A N ALA 192.A O no hydrogen 2.957 N/A SER 197.A N SER 193.A O no hydrogen 2.931 N/A SER 197.A OG TRP 178.A O no hydrogen 2.932 N/A SER 197.A OG SER 193.A O no hydrogen 3.261 N/A PHE 198.A N ASP 194.A O no hydrogen 2.843 N/A GLY 199.A N VAL 195.A O no hydrogen 2.945 N/A VAL 200.A N TRP 196.A O no hydrogen 3.098 N/A VAL 201.A N SER 197.A O no hydrogen 2.883 N/A LEU 202.A N PHE 198.A O no hydrogen 2.855 N/A TYR 203.A N GLY 199.A O no hydrogen 2.950 N/A TYR 203.A OH LYS 213.A O no hydrogen 2.460 N/A GLU 204.A N VAL 200.A O no hydrogen 2.849 N/A LEU 205.A N VAL 201.A O no hydrogen 2.926 N/A PHE 206.A N LEU 202.A O no hydrogen 3.067 N/A THR 207.A N TYR 203.A O no hydrogen 2.962 N/A THR 207.A N GLU 204.A O no hydrogen 3.050 N/A THR 207.A OG1 GLU 204.A O no hydrogen 2.863 N/A TYR 208.A N LEU 205.A O no hydrogen 3.046 N/A TYR 208.A OH ILE 107.A O no hydrogen 2.745 N/A ILE 209.A N THR 207.A OG1 no hydrogen 3.304 N/A GLU 210.A N THR 207.A O no hydrogen 3.179 N/A LYS 213.A N GLU 210.A O no hydrogen 3.064 N/A SER 214.A N LYS 211.A O no hydrogen 3.521 N/A ALA 217.A N SER 214.A OG no hydrogen 3.164 N/A GLU 218.A N SER 214.A O no hydrogen 2.843 N/A PHE 219.A N PRO 215.A O no hydrogen 2.895 N/A MET 220.A N PRO 216.A O no hydrogen 2.850 N/A ARG 221.A N ALA 217.A O no hydrogen 2.910 N/A ARG 221.A NH2 GLU 218.A OE1 no hydrogen 2.837 N/A MET 222.A N GLU 218.A O no hydrogen 2.959 N/A ILE 223.A N PHE 219.A O no hydrogen 2.883 N/A LYS 227.A N GLY 224.A O no hydrogen 3.256 N/A LYS 227.A NZ ILE 223.A O no hydrogen 3.086 N/A LYS 227.A NZ ASP 226.A OD1 no hydrogen 3.379 N/A LYS 227.A NZ ASP 226.A OD2 no hydrogen 2.954 N/A ILE 232.A N GLY 229.A O no hydrogen 2.937 N/A PHE 234.A N GLN 230.A O no hydrogen 3.282 N/A HIS 235.A N MET 231.A O no hydrogen 2.831 N/A LEU 236.A N ILE 232.A O no hydrogen 2.688 N/A ILE 237.A N VAL 233.A O no hydrogen 2.713 N/A GLU 238.A N PHE 234.A O no hydrogen 2.986 N/A LEU 239.A N HIS 235.A O no hydrogen 2.680 N/A LEU 240.A N LEU 236.A O no hydrogen 2.783 N/A LYS 241.A N ILE 237.A O no hydrogen 2.947 N/A LYS 241.A N GLU 238.A O no hydrogen 3.063 N/A ASN 242.A N GLU 238.A O no hydrogen 3.107 N/A ASN 243.A N LEU 240.A O no hydrogen 3.192 N/A GLY 244.A N LEU 239.A O no hydrogen 2.906 N/A ARG 245.A NE TRP 264.A O no hydrogen 2.981 N/A ARG 245.A NH1 LEU 240.A O no hydrogen 3.122 N/A ARG 245.A NH1 GLY 244.A O no hydrogen 2.922 N/A ARG 245.A NH2 TRP 264.A O no hydrogen 2.619 N/A ARG 245.A NH2 ASN 266.A OD1 no hydrogen 2.915 N/A ARG 248.A NH1 CYS 252.A O no hydrogen 2.661 N/A CYS 252.A N PRO 249.A O no hydrogen 2.951 N/A CYS 252.A SG PRO 253.A O no hydrogen 3.417 N/A TYR 257.A N PRO 253.A O no hydrogen 3.197 N/A TYR 257.A OH LEU 246.A O no hydrogen 2.782 N/A MET 258.A N ASP 254.A O no hydrogen 2.850 N/A ILE 259.A N GLU 255.A O no hydrogen 2.984 N/A MET 260.A N ILE 256.A O no hydrogen 3.007 N/A THR 261.A N TYR 257.A O no hydrogen 2.927 N/A THR 261.A OG1 TYR 257.A O no hydrogen 3.166 N/A THR 261.A OG1 MET 258.A O no hydrogen 3.030 N/A GLU 262.A N MET 258.A O no hydrogen 2.957 N/A CYS 263.A N ILE 259.A O no hydrogen 2.994 N/A CYS 263.A SG ILE 259.A O no hydrogen 3.537 N/A TRP 264.A N MET 260.A O no hydrogen 3.107 N/A TRP 264.A N THR 261.A O no hydrogen 3.239 N/A ASN 266.A ND2 LEU 240.A O no hydrogen 3.300 N/A ASN 267.A N ASN 265.A OD1 no hydrogen 3.122 N/A ASN 267.A ND2 GLN 270.A OE1 no hydrogen 2.786 N/A ASN 269.A N ASN 267.A OD1 no hydrogen 3.047 N/A ASN 269.A ND2 ASN 267.A OD1 no hydrogen 3.578 N/A GLN 270.A N ASN 267.A O no hydrogen 3.074 N/A ARG 271.A N VAL 268.A O no hydrogen 3.273 N/A ARG 271.A NE ASN 265.A O no hydrogen 2.670 N/A ARG 271.A NH1 GLU 182.A OE2 no hydrogen 3.043 N/A ARG 271.A NH1 ALA 192.A O no hydrogen 3.072 N/A ARG 271.A NH2 GLU 182.A OE1 no hydrogen 2.988 N/A ARG 271.A NH2 ASN 265.A O no hydrogen 2.952 N/A ASP 276.A N SER 273.A OG no hydrogen 3.171 N/A LEU 277.A N SER 273.A O no hydrogen 2.858 N/A ALA 278.A N PHE 274.A O no hydrogen 2.902 N/A LEU 279.A N ARG 275.A O no hydrogen 3.009 N/A ARG 280.A N ASP 276.A O no hydrogen 2.897 N/A VAL 281.A N LEU 277.A O no hydrogen 2.878 N/A ASP 282.A N ALA 278.A O no hydrogen 2.916 N/A GLN 283.A N LEU 279.A O no hydrogen 2.929 N/A GLN 283.A NE2 ASN 287.A OD1 no hydrogen 2.618 N/A ILE 284.A N ARG 280.A O no hydrogen 2.963 N/A ARG 285.A N VAL 281.A O no hydrogen 2.897 N/A ARG 285.A NH1 ASP 282.A OD1 no hydrogen 2.935 N/A ASP 286.A N ASP 282.A O no hydrogen 2.915 N/A ASN 287.A N GLN 283.A O no hydrogen 2.912 N/A MET 288.A N ILE 284.A O no hydrogen 2.923 N/A ALA 289.A N ARG 285.A O no hydrogen 2.902 N/A GLY 290.A N ASP 286.A O no hydrogen 2.984 N/A