Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kyc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N GLU 7.A OE1 no hydrogen 2.885 N/A GLU 7.A N SER 4.A OG no hydrogen 3.115 N/A ALA 8.A N SER 4.A O no hydrogen 2.958 N/A ALA 9.A N GLU 5.A O no hydrogen 3.214 N/A GLN 10.A N GLU 6.A O no hydrogen 3.227 N/A TYR 11.A N GLU 7.A O no hydrogen 2.778 N/A ARG 13.A NH1 ASP 12.A OD1 no hydrogen 2.634 N/A GLN 14.A N TYR 11.A O no hydrogen 3.016 N/A GLN 14.A NE2 GLN 23.A OE1 no hydrogen 2.917 N/A GLN 14.A NE2 ALA 50.A O no hydrogen 3.056 N/A ILE 15.A N TYR 11.A O no hydrogen 2.795 N/A ARG 16.A N ASP 12.A O no hydrogen 3.042 N/A ARG 16.A NE ASP 12.A OD1 no hydrogen 2.884 N/A ARG 16.A NE ASP 12.A OD2 no hydrogen 3.313 N/A ARG 16.A NH2 ASP 12.A OD2 no hydrogen 2.966 N/A LEU 17.A N GLN 14.A O no hydrogen 2.724 N/A TRP 18.A N GLN 14.A O no hydrogen 2.823 N/A TRP 18.A NE1 GLN 23.A OE1 no hydrogen 3.095 N/A GLY 19.A N ILE 15.A O no hydrogen 2.713 N/A GLN 23.A N GLY 19.A O no hydrogen 3.345 N/A GLN 23.A NE2 ALA 50.A O no hydrogen 2.868 N/A LYS 24.A N LEU 20.A O no hydrogen 2.742 N/A ARG 25.A N GLU 21.A O no hydrogen 2.985 N/A ARG 25.A NH1 SER 287.A O no hydrogen 3.298 N/A LEU 26.A N ALA 22.A O no hydrogen 2.970 N/A ARG 27.A N GLN 23.A O no hydrogen 3.071 N/A ARG 27.A NE GLU 7.A OE2 no hydrogen 2.903 N/A ARG 27.A NH1 GLY 2.A O no hydrogen 3.181 N/A ALA 28.A N LYS 24.A O no hydrogen 3.127 N/A ALA 28.A N ARG 25.A O no hydrogen 3.002 N/A SER 29.A N LEU 26.A O no hydrogen 2.804 N/A SER 29.A OG ARG 25.A O no hydrogen 3.008 N/A ARG 30.A N ASP 119.A OD2 no hydrogen 2.785 N/A VAL 31.A N GLY 54.A O no hydrogen 2.831 N/A LEU 32.A N ALA 120.A O no hydrogen 3.174 N/A LEU 33.A N THR 56.A O no hydrogen 3.025 N/A VAL 34.A N CYS 122.A O no hydrogen 2.924 N/A GLY 35.A N LEU 58.A O no hydrogen 2.689 N/A LEU 36.A N ASP 59.A OD2 no hydrogen 3.345 N/A GLY 38.A N GLU 266.A OE2 no hydrogen 3.359 N/A ALA 41.A N LYS 37.A O no hydrogen 2.953 N/A GLU 42.A N GLY 38.A O no hydrogen 3.267 N/A ILE 43.A N LEU 39.A O no hydrogen 3.238 N/A ALA 44.A N GLY 40.A O no hydrogen 3.049 N/A LYS 45.A N ALA 41.A O no hydrogen 3.011 N/A LYS 45.A NZ GLU 42.A OE1 no hydrogen 2.837 N/A LYS 45.A NZ ASN 46.A OD1 no hydrogen 3.044 N/A ASN 46.A N GLU 42.A O no hydrogen 2.866 N/A ASN 46.A ND2 GLY 275.A O no hydrogen 3.203 N/A LEU 47.A N ILE 43.A O no hydrogen 2.705 N/A ILE 48.A N ALA 44.A O no hydrogen 2.978 N/A LEU 49.A N LYS 45.A O no hydrogen 3.058 N/A ALA 50.A N ASN 46.A O no hydrogen 3.105 N/A ALA 50.A N LEU 47.A O no hydrogen 3.142 N/A GLY 51.A N LEU 47.A O no hydrogen 3.060 N/A GLY 51.A N ILE 48.A O no hydrogen 3.034 N/A LYS 53.A N LEU 26.A O no hydrogen 3.286 N/A GLY 54.A N SER 29.A O no hydrogen 3.193 N/A LEU 55.A N ASP 99.A O no hydrogen 2.950 N/A THR 56.A N VAL 31.A O no hydrogen 2.694 N/A MET 57.A N LYS 101.A O no hydrogen 2.795 N/A LEU 58.A N LEU 33.A O no hydrogen 2.967 N/A ASP 59.A N ASP 103.A O no hydrogen 3.126 N/A VAL 63.A N ARG 81.A O no hydrogen 2.837 N/A THR 64.A N ASP 67.A OD2 no hydrogen 2.924 N/A ILE 74.A N GLN 71.A O no hydrogen 2.959 N/A SER 78.A OG ARG 75.A O no hydrogen 3.109 N/A GLY 80.A N VAL 63.A O no hydrogen 2.757 N/A ASN 82.A ND2 ASP 59.A O no hydrogen 3.066 N/A ARG 83.A N GLU 61.A O no hydrogen 3.203 N/A ARG 83.A NE ASP 59.A OD2 no hydrogen 2.931 N/A GLU 85.A N ASN 82.A OD1 no hydrogen 2.998 N/A ALA 86.A N ASN 82.A O no hydrogen 2.710 N/A SER 87.A N ARG 83.A O no hydrogen 3.096 N/A SER 87.A OG ARG 83.A O no hydrogen 3.317 N/A LEU 88.A N ALA 84.A O no hydrogen 3.224 N/A ALA 91.A N SER 87.A O no hydrogen 3.247 N/A GLN 92.A N LEU 88.A O no hydrogen 2.926 N/A GLN 92.A NE2 GLN 92.A O no hydrogen 2.447 N/A GLN 92.A NE2 ASN 95.A O no hydrogen 3.132 N/A GLN 92.A NE2 VAL 98.A O no hydrogen 3.103 N/A ASN 93.A N GLU 89.A O no hydrogen 3.141 N/A LEU 94.A N ALA 91.A O no hydrogen 3.182 N/A ASN 95.A N GLN 92.A O no hydrogen 3.121 N/A ASN 95.A ND2 TYR 11.A OH no hydrogen 2.804 N/A ASN 95.A ND2 ILE 48.A O no hydrogen 2.854 N/A MET 97.A N ASN 95.A OD1 no hydrogen 3.006 N/A VAL 98.A N ASN 95.A O no hydrogen 2.690 N/A ASP 99.A N LYS 53.A O no hydrogen 3.132 N/A VAL 100.A N GLN 92.A OE1 no hydrogen 3.300 N/A LYS 101.A N LEU 55.A O no hydrogen 2.774 N/A ASP 103.A N MET 57.A O no hydrogen 3.124 N/A GLU 105.A N ASP 103.A OD1 no hydrogen 2.897 N/A GLU 108.A N ASP 106.A OD2 no hydrogen 3.005 N/A LYS 109.A N ASP 106.A O no hydrogen 2.954 N/A LYS 110.A NZ ASP 103.A OD2 no hydrogen 2.673 N/A LYS 110.A NZ GLU 105.A OE1 no hydrogen 3.087 N/A PHE 114.A N PRO 111.A O no hydrogen 3.170 N/A PHE 115.A N GLU 112.A O no hydrogen 2.966 N/A THR 116.A N SER 113.A O no hydrogen 3.181 N/A THR 116.A OG1 SER 113.A O no hydrogen 2.783 N/A GLN 117.A NE2 PHE 114.A O no hydrogen 2.551 N/A PHE 118.A N PHE 115.A O no hydrogen 3.190 N/A ASP 119.A N ARG 30.A O no hydrogen 2.922 N/A VAL 121.A N LYS 144.A O no hydrogen 2.902 N/A CYS 122.A N LEU 32.A O no hydrogen 2.785 N/A LEU 123.A N PHE 146.A O no hydrogen 2.831 N/A THR 124.A N VAL 34.A O no hydrogen 2.940 N/A CYS 125.A N ASP 149.A OD1 no hydrogen 2.928 N/A CYS 126.A SG THR 124.A O no hydrogen 3.342 N/A ASP 129.A N SER 127.A OG no hydrogen 2.998 N/A VAL 130.A N SER 127.A OG no hydrogen 3.295 N/A ILE 131.A N SER 127.A O no hydrogen 2.977 N/A VAL 132.A N ARG 128.A O no hydrogen 2.987 N/A LYS 133.A N ASP 129.A O no hydrogen 2.835 N/A VAL 134.A N VAL 130.A O no hydrogen 2.899 N/A ASP 135.A N ILE 131.A O no hydrogen 2.923 N/A GLN 136.A N VAL 132.A O no hydrogen 3.014 N/A ILE 137.A N LYS 133.A O no hydrogen 2.995 N/A CYS 138.A N VAL 134.A O no hydrogen 2.937 N/A CYS 138.A SG VAL 134.A O no hydrogen 3.438 N/A HIS 139.A N ASP 135.A O no hydrogen 2.808 N/A LYS 140.A N GLN 136.A O no hydrogen 3.000 N/A ASN 141.A N CYS 138.A O no hydrogen 3.275 N/A ASN 141.A ND2 GLU 112.A OE2 no hydrogen 3.012 N/A ASN 141.A ND2 ILE 137.A O no hydrogen 2.855 N/A SER 142.A N HIS 139.A O no hydrogen 3.510 N/A ILE 143.A N CYS 138.A O no hydrogen 2.793 N/A PHE 145.A N ASN 160.A O no hydrogen 3.115 N/A PHE 146.A N VAL 121.A O no hydrogen 2.964 N/A THR 147.A N PHE 158.A O no hydrogen 3.142 N/A THR 147.A OG1 LEU 123.A O no hydrogen 3.051 N/A THR 147.A OG1 TYR 156.A OH no hydrogen 3.419 N/A GLY 148.A N LEU 123.A O no hydrogen 2.956 N/A ASP 149.A N TYR 156.A O no hydrogen 3.108 N/A PHE 151.A N HIS 154.A O no hydrogen 2.757 N/A GLY 152.A N SER 265.A O no hydrogen 2.816 N/A HIS 154.A N PHE 151.A O no hydrogen 2.770 N/A HIS 154.A ND1 TYR 262.A O no hydrogen 3.065 N/A GLY 155.A N PHE 299.A O no hydrogen 3.117 N/A TYR 156.A N ASP 149.A O no hydrogen 3.115 N/A TYR 156.A OH THR 147.A OG1 no hydrogen 3.419 N/A TYR 156.A OH ASP 149.A OD2 no hydrogen 3.143 N/A THR 157.A N PHE 297.A O no hydrogen 2.846 N/A PHE 158.A N THR 147.A O no hydrogen 2.769 N/A ALA 159.A N ASN 295.A O no hydrogen 2.959 N/A ASN 160.A N PHE 145.A O no hydrogen 2.819 N/A ASN 160.A ND2 ASP 135.A OD2 no hydrogen 2.926 N/A GLY 162.A N ASN 160.A OD1 no hydrogen 3.011 N/A HIS 164.A N VAL 179.A O no hydrogen 3.012 N/A PHE 166.A N LYS 177.A O no hydrogen 3.073 N/A VAL 167.A N GLN 288.A O no hydrogen 2.850 N/A GLU 168.A N VAL 175.A O no hydrogen 2.961 N/A LYS 170.A N THR 173.A O no hydrogen 2.618 N/A LYS 172.A N LYS 170.A O no hydrogen 2.612 N/A VAL 175.A N GLU 168.A O no hydrogen 3.079 N/A LYS 177.A N PHE 166.A O no hydrogen 2.959 N/A LYS 177.A NZ GLU 168.A OE1 no hydrogen 2.905 N/A VAL 179.A N HIS 164.A O no hydrogen 3.052 N/A PHE 181.A N GLY 162.A O no hydrogen 2.808 N/A CYS 182.A SG PRO 183.A O no hydrogen 3.670 N/A VAL 184.A N ASP 135.A OD1 no hydrogen 2.753 N/A ALA 187.A N PRO 183.A O no hydrogen 3.140 N/A LEU 188.A N VAL 184.A O no hydrogen 2.726 N/A LYS 198.A NZ GLY 249.A O no hydrogen 3.190 N/A ALA 199.A N GLU 195.A O no hydrogen 3.247 N/A ALA 200.A N LYS 196.A O no hydrogen 2.997 N/A LEU 201.A N ALA 197.A O no hydrogen 2.853 N/A ARG 203.A N ALA 200.A O no hydrogen 2.982 N/A THR 204.A N LEU 201.A O no hydrogen 3.373 N/A THR 204.A OG1 ALA 200.A O no hydrogen 3.005 N/A THR 205.A N GLU 309.A OE2 no hydrogen 3.173 N/A ASP 207.A N THR 205.A OG1 no hydrogen 3.241 N/A TYR 208.A N THR 205.A O no hydrogen 3.235 N/A TYR 208.A OH ALA 187.A O no hydrogen 2.467 N/A PHE 209.A N SER 206.A O no hydrogen 2.678 N/A LEU 210.A N SER 206.A O no hydrogen 2.851 N/A LEU 211.A N ASP 207.A O no hydrogen 2.739 N/A VAL 213.A N PHE 209.A O no hydrogen 3.156 N/A LEU 214.A N LEU 210.A O no hydrogen 3.075 N/A LEU 215.A N LEU 211.A O no hydrogen 2.734 N/A LYS 216.A N GLN 212.A O no hydrogen 2.992 N/A LYS 216.A NZ ASP 220.A OD1 no hydrogen 3.010 N/A LYS 216.A NZ ASP 220.A OD2 no hydrogen 3.290 N/A PHE 217.A N VAL 213.A O no hydrogen 3.062 N/A ARG 218.A N LEU 215.A O no hydrogen 3.079 N/A ARG 218.A NE ASP 224.A OD1 no hydrogen 2.620 N/A ARG 218.A NH1 CYS 126.A O no hydrogen 2.628 N/A ARG 218.A NH1 ASP 149.A OD1 no hydrogen 3.498 N/A ARG 218.A NH1 ASP 149.A OD2 no hydrogen 3.169 N/A ARG 218.A NH2 ASP 149.A OD1 no hydrogen 2.991 N/A ARG 218.A NH2 ASP 224.A OD1 no hydrogen 3.238 N/A ARG 218.A NH2 ASP 224.A OD2 no hydrogen 2.768 N/A THR 219.A N LEU 215.A O no hydrogen 2.946 N/A THR 219.A OG1 LEU 215.A O no hydrogen 3.275 N/A ASP 220.A N LYS 216.A O no hydrogen 2.812 N/A GLY 222.A N ARG 218.A O no hydrogen 2.805 N/A ARG 223.A NH1 THR 229.A OG1 no hydrogen 3.362 N/A SER 226.A N ASP 233.A OD2 no hydrogen 3.108 N/A SER 226.A OG ASP 228.A OD1 no hydrogen 2.966 N/A THR 229.A OG1 THR 229.A O no hydrogen 2.273 N/A THR 229.A OG1 ASP 233.A OD2 no hydrogen 2.912 N/A ASP 233.A N THR 229.A O no hydrogen 3.144 N/A SER 234.A N TYR 230.A O no hydrogen 2.758 N/A SER 234.A OG TYR 230.A O no hydrogen 2.457 N/A LEU 236.A N GLU 232.A O no hydrogen 3.505 N/A LEU 237.A N ASP 233.A O no hydrogen 3.008 N/A LEU 238.A N SER 234.A O no hydrogen 2.969 N/A GLN 239.A N GLU 235.A O no hydrogen 2.826 N/A ILE 240.A N LEU 236.A O no hydrogen 2.991 N/A ARG 241.A N LEU 237.A O no hydrogen 3.006 N/A ARG 241.A NE LEU 238.A O no hydrogen 3.297 N/A ARG 241.A NH1 PRO 252.A O no hydrogen 3.165 N/A ARG 241.A NH1 GLU 257.A OE2 no hydrogen 2.901 N/A ARG 241.A NH2 LEU 238.A O no hydrogen 3.469 N/A ARG 241.A NH2 GLU 257.A OE2 no hydrogen 3.461 N/A ASN 242.A N GLN 239.A O no hydrogen 2.814 N/A VAL 244.A N ILE 240.A O no hydrogen 3.293 N/A VAL 244.A N ARG 241.A O no hydrogen 3.208 N/A LEU 245.A N ARG 241.A O no hydrogen 2.980 N/A ASP 246.A N ASN 242.A O no hydrogen 2.858 N/A SER 247.A OG ASP 243.A O no hydrogen 2.608 N/A SER 247.A OG VAL 244.A O no hydrogen 3.447 N/A GLY 249.A N LEU 245.A O no hydrogen 2.958 N/A ILE 250.A N LEU 245.A O no hydrogen 2.908 N/A SER 251.A OG ASP 253.A OD1 no hydrogen 3.405 N/A ASP 253.A N SER 251.A O no hydrogen 2.402 N/A LEU 254.A N SER 251.A O no hydrogen 2.785 N/A ARG 261.A N ASP 258.A O no hydrogen 3.268 N/A TYR 262.A N PHE 259.A O no hydrogen 2.941 N/A CYS 263.A SG PHE 259.A O no hydrogen 4.018 N/A SER 265.A N PRO 225.A O no hydrogen 3.242 N/A MET 267.A N GLY 152.A O no hydrogen 3.326 N/A VAL 270.A N MET 267.A O no hydrogen 2.760 N/A CYS 271.A N MET 267.A O no hydrogen 3.221 N/A CYS 271.A SG MET 267.A O no hydrogen 3.953 N/A ALA 272.A N ALA 268.A O no hydrogen 3.080 N/A VAL 273.A N PRO 269.A O no hydrogen 3.072 N/A VAL 274.A N VAL 270.A O no hydrogen 2.959 N/A GLY 275.A N CYS 271.A O no hydrogen 2.730 N/A GLY 276.A N ALA 272.A O no hydrogen 2.771 N/A ILE 277.A N VAL 273.A O no hydrogen 2.989 N/A LEU 278.A N VAL 274.A O no hydrogen 2.827 N/A ALA 279.A N GLY 275.A O no hydrogen 2.986 N/A GLN 280.A N GLY 276.A O no hydrogen 3.146 N/A GLU 281.A N ILE 277.A O no hydrogen 2.785 N/A ILE 282.A N LEU 278.A O no hydrogen 2.895 N/A VAL 283.A N ALA 279.A O no hydrogen 2.937 N/A LYS 284.A N GLN 280.A O no hydrogen 2.942 N/A LYS 284.A NZ GLU 281.A OE1 no hydrogen 2.889 N/A LYS 284.A NZ GLU 281.A OE2 no hydrogen 3.424 N/A LYS 284.A NZ PRO 291.A O no hydrogen 2.995 N/A ALA 285.A N GLU 281.A O no hydrogen 2.943 N/A LEU 286.A N ILE 282.A O no hydrogen 2.972 N/A SER 287.A N VAL 283.A O no hydrogen 3.104 N/A SER 287.A OG VAL 283.A O no hydrogen 2.886 N/A SER 287.A OG LYS 284.A O no hydrogen 3.272 N/A GLN 288.A NE2 GLU 165.A O no hydrogen 3.137 N/A ARG 289.A NE TRP 18.A O no hydrogen 2.896 N/A ASP 290.A N VAL 167.A O no hydrogen 2.608 N/A HIS 293.A N GLU 281.A OE2 no hydrogen 3.222 N/A ASN 295.A ND2 LEU 311.A O no hydrogen 3.015 N/A PHE 296.A N GLU 309.A O no hydrogen 3.004 N/A PHE 297.A N THR 157.A O no hydrogen 2.926 N/A PHE 298.A N ILE 307.A O no hydrogen 2.751 N/A PHE 299.A N GLY 155.A O no hydrogen 2.758 N/A ASP 300.A N ASN 305.A O no hydrogen 2.730 N/A GLY 301.A N TYR 153.A O no hydrogen 2.848 N/A MET 302.A N ASP 300.A OD1 no hydrogen 2.900 N/A GLY 304.A N ASP 300.A O no hydrogen 2.777 N/A ASN 305.A N ASP 300.A O no hydrogen 3.231 N/A ILE 307.A N PHE 298.A O no hydrogen 2.905 N/A GLU 309.A N PHE 296.A O no hydrogen 3.005 N/A LEU 311.A N ASN 295.A OD1 no hydrogen 3.002 N/A