Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kpd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH THR 51.A OG1 no hydrogen 2.747 N/A GLU 5.A N VAL 1.A O no hydrogen 3.234 N/A LYS 6.A N.A TYR 2.A O no hydrogen 2.996 N/A LYS 6.A NZ.B LYS 45.A O no hydrogen 2.740 N/A PHE 9.A N GLU 5.A O no hydrogen 2.968 N/A VAL 10.A N LYS 6.A O.A no hydrogen 3.001 N/A VAL 10.A N LYS 6.A O.B no hydrogen 3.003 N/A GLN 11.A N GLN 7.A O no hydrogen 3.015 N/A HIS 12.A N PHE 9.A O no hydrogen 3.275 N/A HIS 12.A ND1 GLN 15.A OE1.A no hydrogen 3.031 N/A PHE 13.A N VAL 10.A O no hydrogen 3.030 N/A GLN 15.A N HIS 12.A O no hydrogen 3.243 N/A GLN 15.A NE2.B TYR 134.A OH no hydrogen 2.671 N/A ILE 16.A N HIS 12.A O no hydrogen 3.262 N/A VAL 17.A N PHE 13.A O no hydrogen 2.893 N/A ARG 18.A N SER 14.A O no hydrogen 2.983 N/A VAL 19.A N.A GLN 15.A O no hydrogen 2.861 N/A VAL 19.A N.B GLN 15.A O no hydrogen 2.864 N/A LEU 20.A N ILE 16.A O no hydrogen 3.095 N/A THR 21.A N VAL 17.A O no hydrogen 2.858 N/A THR 21.A OG1 VAL 17.A O no hydrogen 2.651 N/A GLY 27.A N PRO 24.A O no hydrogen 3.169 N/A ILE 30.A N ILE 26.A O no hydrogen 2.900 N/A ALA 31.A N GLY 27.A O no hydrogen 2.948 N/A ARG 32.A N ASP 28.A O no hydrogen 3.027 N/A ARG 32.A NE ASP 119.A OD1 no hydrogen 3.243 N/A ARG 32.A NH1 ASP 119.A OD2 no hydrogen 2.852 N/A LEU 33.A N ALA 29.A O no hydrogen 2.945 N/A LYS 34.A N ILE 30.A O no hydrogen 3.075 N/A GLU 35.A N ALA 31.A O no hydrogen 3.194 N/A VAL 36.A N ARG 32.A O no hydrogen 2.900 N/A LEU 37.A N LEU 33.A O no hydrogen 2.865 N/A GLU 38.A N.A LYS 34.A O no hydrogen 2.858 N/A GLU 38.A N.B LYS 34.A O no hydrogen 2.851 N/A TYR 39.A N GLU 35.A O no hydrogen 3.051 N/A TYR 39.A OH ILE 104.A O no hydrogen 2.536 N/A ASN 40.A N VAL 36.A O no hydrogen 2.924 N/A ASN 40.A ND2 VAL 36.A O no hydrogen 3.002 N/A ALA 41.A N LEU 37.A O no hydrogen 3.004 N/A GLY 43.A N TYR 46.A OH no hydrogen 2.891 N/A ARG 48.A NE SER 193.A OG no hydrogen 2.941 N/A ARG 48.A NH2 SER 193.A OG no hydrogen 2.745 N/A GLY 49.A N GLU 81.A OE2 no hydrogen 2.899 N/A LEU 50.A N TYR 46.A O no hydrogen 2.935 N/A THR 51.A N ASN 47.A O no hydrogen 2.917 N/A THR 51.A OG1 TYR 2.A OH no hydrogen 2.747 N/A THR 51.A OG1 ASN 47.A O no hydrogen 2.612 N/A VAL 52.A N ARG 48.A O no hydrogen 3.268 N/A VAL 53.A N GLY 49.A O no hydrogen 3.238 N/A VAL 54.A N LEU 50.A O no hydrogen 2.784 N/A ALA 55.A N THR 51.A O no hydrogen 2.838 N/A PHE 56.A N VAL 52.A O no hydrogen 2.932 N/A ARG 57.A N VAL 53.A O no hydrogen 3.155 N/A ARG 57.A NE GLU 5.A OE2 no hydrogen 2.715 N/A GLU 58.A N VAL 54.A O no hydrogen 3.172 N/A GLU 58.A N ALA 55.A O no hydrogen 3.174 N/A LEU 59.A N ALA 55.A O no hydrogen 2.942 N/A LEU 59.A N PHE 56.A O no hydrogen 3.350 N/A VAL 60.A N PHE 56.A O no hydrogen 3.033 N/A ARG 63.A NH1 GLU 61.A OE2 no hydrogen 2.805 N/A LYS 64.A N GLU 61.A O no hydrogen 2.799 N/A GLN 65.A N PRO 62.A O no hydrogen 2.928 N/A GLN 65.A NE2 ARG 57.A O no hydrogen 2.971 N/A GLN 65.A NE2 VAL 60.A O no hydrogen 2.728 N/A SER 69.A N ASP 66.A OD2 no hydrogen 2.933 N/A LEU 70.A N ASP 66.A O no hydrogen 2.884 N/A GLN 71.A N ALA 67.A O no hydrogen 2.979 N/A GLN 71.A NE2 GLN 15.A OE1.B no hydrogen 3.342 N/A ARG 72.A N ASP 68.A O no hydrogen 3.021 N/A ALA 73.A N SER 69.A O no hydrogen 3.143 N/A TRP 74.A N LEU 70.A O no hydrogen 3.092 N/A THR 75.A N GLN 71.A O no hydrogen 2.981 N/A THR 75.A OG1 GLN 71.A O no hydrogen 2.830 N/A VAL 76.A N ARG 72.A O no hydrogen 2.927 N/A GLY 77.A N ALA 73.A O no hydrogen 2.970 N/A TRP 78.A N TRP 74.A O no hydrogen 2.936 N/A TRP 78.A NE1 PHE 9.A O no hydrogen 2.915 N/A CYS 79.A N THR 75.A O no hydrogen 2.895 N/A CYS 79.A SG THR 75.A O no hydrogen 3.456 N/A CYS 79.A SG ILE 127.A O no hydrogen 3.586 N/A VAL 80.A N VAL 76.A O no hydrogen 3.094 N/A GLU 81.A N GLY 77.A O no hydrogen 3.132 N/A LEU 82.A N TRP 78.A O no hydrogen 2.910 N/A LEU 83.A N CYS 79.A O no hydrogen 3.030 N/A GLN 84.A N VAL 80.A O no hydrogen 3.015 N/A ALA 85.A N GLU 81.A O no hydrogen 2.961 N/A PHE 86.A N LEU 82.A O no hydrogen 2.893 N/A PHE 87.A N LEU 83.A O no hydrogen 3.140 N/A LEU 88.A N GLN 84.A O no hydrogen 2.924 N/A VAL 89.A N ALA 85.A O no hydrogen 3.048 N/A ALA 90.A N PHE 86.A O no hydrogen 3.373 N/A ASP 91.A N PHE 87.A O no hydrogen 2.803 N/A ASP 92.A N LEU 88.A O no hydrogen 2.964 N/A MET 94.A N ALA 90.A O no hydrogen 3.102 N/A ASP 95.A N ASP 91.A O no hydrogen 2.779 N/A SER 96.A N ILE 93.A O no hydrogen 3.103 N/A SER 97.A N ASP 92.A O no hydrogen 2.888 N/A ARG 100.A N GLN 103.A O no hydrogen 2.883 N/A ARG 100.A NE ASP 92.A OD2 no hydrogen 3.108 N/A ARG 100.A NH2 ASP 92.A OD1 no hydrogen 2.752 N/A ARG 101.A NH1 ASN 40.A O no hydrogen 2.763 N/A GLY 102.A N GLY 244.A O no hydrogen 2.820 N/A GLN 103.A N ARG 100.A O no hydrogen 3.210 N/A GLN 103.A NE2 TYR 39.A O no hydrogen 2.989 N/A CYS 105.A N LEU 98.A O no hydrogen 2.885 N/A TRP 106.A NE1 ASP 119.A OD2 no hydrogen 2.709 N/A TYR 107.A OH SER 97.A O no hydrogen 2.763 N/A GLN 108.A N CYS 105.A O no hydrogen 2.919 N/A GLN 108.A NE2 SER 97.A O no hydrogen 3.143 N/A LYS 109.A N TRP 106.A O no hydrogen 3.016 N/A VAL 112.A N LYS 109.A O no hydrogen 3.122 N/A ASP 115.A N VAL 112.A O no hydrogen 3.209 N/A ALA 116.A N GLY 113.A O no hydrogen 3.174 N/A ILE 117.A N LEU 114.A O no hydrogen 3.120 N/A ASN 118.A N ASP 115.A O no hydrogen 3.021 N/A ASP 119.A N ASP 115.A O no hydrogen 3.312 N/A ALA 120.A N ALA 116.A O no hydrogen 2.832 N/A ASN 121.A N ILE 117.A O no hydrogen 3.293 N/A LEU 122.A N ASN 118.A O no hydrogen 2.961 N/A LEU 123.A N ASP 119.A O no hydrogen 3.143 N/A GLU 124.A N ALA 120.A O no hydrogen 3.235 N/A ALA 125.A N ASN 121.A O no hydrogen 2.865 N/A CYS 126.A N LEU 122.A O no hydrogen 3.035 N/A CYS 126.A SG LEU 122.A O no hydrogen 3.351 N/A ILE 127.A N GLU 124.A O no hydrogen 3.160 N/A ARG 129.A N.A ALA 125.A O no hydrogen 3.362 N/A ARG 129.A N.B ALA 125.A O no hydrogen 3.372 N/A ARG 129.A NH1.A LEU 20.A O no hydrogen 2.943 N/A LEU 130.A N CYS 126.A O no hydrogen 3.053 N/A LEU 131.A N ILE 127.A O no hydrogen 2.985 N/A LYS 132.A N TYR 128.A O no hydrogen 3.054 N/A LEU 133.A N ARG 129.A O.A no hydrogen 2.991 N/A LEU 133.A N ARG 129.A O.B no hydrogen 2.985 N/A TYR 134.A N LEU 130.A O no hydrogen 3.039 N/A CYS 135.A N LEU 131.A O no hydrogen 2.831 N/A GLN 138.A N CYS 135.A O no hydrogen 3.074 N/A TYR 141.A N GLN 138.A O no hydrogen 3.208 N/A LEU 144.A N TYR 140.A O no hydrogen 3.006 N/A ILE 145.A N TYR 141.A O no hydrogen 3.062 N/A GLU 146.A N LEU 142.A O no hydrogen 2.972 N/A LEU 147.A N ASN 143.A O no hydrogen 2.885 N/A PHE 148.A N LEU 144.A O no hydrogen 2.900 N/A LEU 149.A N ILE 145.A O no hydrogen 2.901 N/A GLN 150.A N GLU 146.A O no hydrogen 2.783 N/A SER 151.A N LEU 147.A O no hydrogen 2.948 N/A SER 151.A OG LEU 147.A O no hydrogen 2.704 N/A SER 152.A N PHE 148.A O no hydrogen 3.150 N/A SER 152.A OG PHE 148.A O no hydrogen 2.712 N/A TYR 153.A N LEU 149.A O no hydrogen 3.120 N/A GLN 154.A N GLN 150.A O no hydrogen 2.955 N/A THR 155.A N SER 151.A O no hydrogen 3.183 N/A THR 155.A OG1 SER 151.A O no hydrogen 2.650 N/A GLU 156.A N SER 152.A O no hydrogen 2.997 N/A ILE 157.A N TYR 153.A O no hydrogen 2.939 N/A GLY 158.A N GLN 154.A O no hydrogen 3.007 N/A GLN 159.A N THR 155.A O no hydrogen 2.712 N/A GLN 159.A NE2 ASP 91.A OD1 no hydrogen 3.016 N/A THR 160.A N GLU 156.A O no hydrogen 2.888 N/A THR 160.A OG1 GLU 156.A O no hydrogen 2.858 N/A LEU 161.A N ILE 157.A O no hydrogen 3.025 N/A ASP 162.A N GLY 158.A O no hydrogen 2.829 N/A LEU 163.A N GLN 159.A O no hydrogen 2.926 N/A LEU 164.A N THR 160.A O no hydrogen 2.898 N/A THR 165.A N LEU 161.A O no hydrogen 3.208 N/A THR 165.A OG1 LEU 161.A O no hydrogen 2.649 N/A ALA 166.A N LEU 163.A O no hydrogen 3.313 N/A ASN 170.A ND2 GLN 168.A O no hydrogen 3.527 N/A ARG 175.A N ASP 172.A O no hydrogen 3.319 N/A PHE 176.A N LEU 173.A O no hydrogen 3.164 N/A THR 177.A N ARG 175.A O no hydrogen 2.953 N/A ARG 180.A N THR 177.A OG1 no hydrogen 3.101 N/A ARG 180.A NH2 THR 165.A OG1 no hydrogen 2.970 N/A TYR 181.A N THR 177.A O no hydrogen 3.024 N/A TYR 181.A OH ASP 232.A OD2 no hydrogen 2.651 N/A LYS 182.A N GLU 178.A O no hydrogen 3.001 N/A LYS 182.A NZ GLU 178.A OE2 no hydrogen 3.504 N/A LYS 182.A NZ GLU 225.A OE1 no hydrogen 3.473 N/A SER 183.A N LYS 179.A O no hydrogen 3.435 N/A SER 183.A OG LYS 179.A O no hydrogen 2.913 N/A ILE 184.A N ARG 180.A O no hydrogen 3.091 N/A VAL 185.A N TYR 181.A O no hydrogen 3.197 N/A LYS 186.A N LYS 182.A O no hydrogen 3.025 N/A TYR 187.A N SER 183.A O no hydrogen 3.376 N/A LYS 188.A N ILE 184.A O no hydrogen 2.715 N/A LYS 188.A NZ ASP 162.A OD2 no hydrogen 2.917 N/A THR 189.A N VAL 185.A O no hydrogen 3.054 N/A THR 189.A OG1 GLN 228.A OE1 no hydrogen 2.599 N/A ALA 190.A N VAL 185.A O no hydrogen 3.161 N/A SER 193.A N THR 189.A O no hydrogen 3.042 N/A SER 193.A OG THR 189.A O no hydrogen 3.273 N/A PHE 194.A N ALA 190.A O no hydrogen 3.319 N/A TYR 195.A N ALA 190.A O no hydrogen 3.322 N/A LEU 196.A N PHE 191.A O no hydrogen 2.901 N/A ALA 199.A N TYR 195.A O no hydrogen 2.830 N/A ALA 200.A N LEU 196.A O no hydrogen 2.963 N/A ALA 201.A N PRO 197.A O no hydrogen 3.245 N/A MET 202.A N ILE 198.A O no hydrogen 2.877 N/A TYR 203.A N ALA 199.A O no hydrogen 2.984 N/A MET 204.A N ALA 200.A O no hydrogen 2.981 N/A ALA 205.A N ALA 201.A O no hydrogen 2.905 N/A ALA 205.A N MET 202.A O no hydrogen 3.188 N/A GLY 206.A N TYR 203.A O no hydrogen 3.060 N/A ILE 207.A N MET 202.A O no hydrogen 2.778 N/A GLU 212.A N.A GLU 212.A OE1.A no hydrogen 3.005 N/A HIS 213.A N GLY 209.A O no hydrogen 3.171 N/A HIS 213.A ND1 GLY 209.A O no hydrogen 3.082 N/A ALA 214.A N GLU 210.A O no hydrogen 2.910 N/A ASN 215.A N LYS 211.A O no hydrogen 2.875 N/A ALA 216.A N GLU 212.A O.A no hydrogen 3.022 N/A ALA 216.A N GLU 212.A O.B no hydrogen 3.006 N/A LYS 217.A N HIS 213.A O no hydrogen 2.906 N/A LYS 218.A N ALA 214.A O no hydrogen 3.061 N/A LEU 220.A N ALA 216.A O no hydrogen 3.020 N/A LEU 221.A N LYS 217.A O no hydrogen 2.858 N/A MET 223.A N.A ILE 219.A O no hydrogen 3.050 N/A MET 223.A N.B ILE 219.A O no hydrogen 3.054 N/A GLY 224.A N LEU 220.A O no hydrogen 2.932 N/A GLU 225.A N LEU 221.A O no hydrogen 3.032 N/A PHE 226.A N GLU 222.A O no hydrogen 3.090 N/A PHE 227.A N MET 223.A O.A no hydrogen 2.967 N/A PHE 227.A N MET 223.A O.B no hydrogen 2.976 N/A GLN 228.A N GLY 224.A O no hydrogen 3.021 N/A GLN 228.A NE2 ASP 232.A OD1 no hydrogen 3.135 N/A ILE 229.A N GLU 225.A O no hydrogen 3.209 N/A GLN 230.A N PHE 226.A O no hydrogen 3.119 N/A ASP 231.A N PHE 227.A O no hydrogen 3.096 N/A ASP 232.A N GLN 228.A O no hydrogen 2.825 N/A TYR 233.A N ILE 229.A O no hydrogen 2.932 N/A LEU 234.A N GLN 230.A O no hydrogen 2.892 N/A ASP 235.A N ASP 231.A O no hydrogen 2.991 N/A PHE 237.A N TYR 233.A O no hydrogen 2.903 N/A GLY 238.A N LEU 234.A O no hydrogen 3.002 N/A SER 241.A N ASP 239.A OD1 no hydrogen 3.147 N/A SER 241.A OG ASP 239.A OD1 no hydrogen 2.937 N/A VAL 242.A N ASP 239.A O no hydrogen 2.872 N/A THR 243.A N ASP 239.A O no hydrogen 2.843 N/A THR 243.A OG1 ASP 239.A O no hydrogen 3.414 N/A THR 243.A OG1 LYS 245.A O no hydrogen 3.140 N/A GLY 244.A N PRO 240.A O no hydrogen 2.966 N/A LYS 245.A NZ ASP 231.A OD1 no hydrogen 2.779 N/A THR 248.A N ASP 235.A OD1 no hydrogen 3.442 N/A THR 248.A OG1 ASP 252.A OD2 no hydrogen 3.178 N/A ASP 249.A N ASP 235.A OD2 no hydrogen 2.920 N/A GLN 251.A N GLN 251.A OE1 no hydrogen 2.927 N/A ASP 252.A N THR 248.A O no hydrogen 2.808 N/A ASN 253.A N ILE 250.A O no hydrogen 3.190 N/A ASN 253.A ND2 PRO 167.A O no hydrogen 2.994 N/A LYS 254.A N ASP 249.A O no hydrogen 2.978 N/A LYS 254.A NZ ASP 95.A OD1 no hydrogen 2.974 N/A TRP 257.A N ASP 232.A OD2 no hydrogen 3.018 N/A VAL 260.A N SER 256.A O no hydrogen 3.184 N/A GLN 261.A N TRP 257.A O no hydrogen 3.000 N/A CYS 262.A N LEU 258.A O no hydrogen 2.832 N/A LEU 263.A N VAL 259.A O no hydrogen 3.000 N/A GLN 264.A N VAL 260.A O no hydrogen 3.255 N/A ARG 265.A N GLN 261.A O no hydrogen 3.235 N/A ARG 265.A N CYS 262.A O no hydrogen 3.233 N/A ALA 266.A N CYS 262.A O no hydrogen 2.832 N/A THR 267.A N GLN 270.A OE1 no hydrogen 2.946 N/A THR 267.A OG1 GLU 269.A OE1 no hydrogen 3.437 N/A GLU 269.A N GLU 269.A OE1 no hydrogen 2.982 N/A GLN 270.A N THR 267.A OG1 no hydrogen 3.330 N/A TYR 271.A N THR 267.A O no hydrogen 2.862 N/A GLN 272.A N PRO 268.A O no hydrogen 3.291 N/A ILE 273.A N GLU 269.A O no hydrogen 3.384 N/A LEU 274.A N GLN 270.A O no hydrogen 3.115 N/A LYS 275.A N TYR 271.A O no hydrogen 2.802 N/A GLU 276.A N GLN 272.A O no hydrogen 2.915 N/A ASN 277.A N LEU 274.A O no hydrogen 3.141 N/A ASN 277.A ND2 ILE 273.A O no hydrogen 2.683 N/A TYR 278.A N LEU 274.A O no hydrogen 2.856 N/A TYR 278.A OH LYS 254.A O no hydrogen 2.534 N/A GLY 279.A N ILE 250.A O no hydrogen 2.849 N/A GLU 282.A N GLU 282.A OE1 no hydrogen 3.092 N/A GLU 284.A N GLU 284.A OE1 no hydrogen 2.736 N/A LYS 285.A N GLU 282.A O no hydrogen 2.983 N/A VAL 286.A N GLU 282.A O no hydrogen 3.051 N/A ALA 287.A N ALA 283.A O no hydrogen 2.959 N/A ARG 288.A N.A GLU 284.A O no hydrogen 3.131 N/A ARG 288.A N.B GLU 284.A O no hydrogen 3.135 N/A VAL 289.A N LYS 285.A O no hydrogen 3.221 N/A LYS 290.A N VAL 286.A O no hydrogen 3.099 N/A ALA 291.A N ALA 287.A O no hydrogen 3.017 N/A LEU 292.A N ARG 288.A O.A no hydrogen 3.102 N/A LEU 292.A N ARG 288.A O.B no hydrogen 3.086 N/A TYR 293.A N VAL 289.A O no hydrogen 3.005 N/A GLU 294.A N LYS 290.A O no hydrogen 3.001 N/A GLU 295.A N ALA 291.A O no hydrogen 2.892 N/A LEU 296.A N LEU 292.A O no hydrogen 2.928 N/A ASP 297.A N GLU 294.A O no hydrogen 3.362 N/A LEU 298.A N TYR 293.A O no hydrogen 3.093 N/A VAL 301.A N ASP 297.A O no hydrogen 2.991 N/A PHE 302.A N LEU 298.A O no hydrogen 2.902 N/A LEU 303.A N PRO 299.A O no hydrogen 3.263 N/A GLN 304.A N ALA 300.A O no hydrogen 3.226 N/A GLN 304.A NE2 ASP 308.A OD1 no hydrogen 2.978 N/A TYR 305.A N VAL 301.A O no hydrogen 3.102 N/A GLU 306.A N PHE 302.A O no hydrogen 2.936 N/A GLU 307.A N LEU 303.A O no hydrogen 3.223 N/A ASP 308.A N GLN 304.A O no hydrogen 3.040 N/A SER 309.A N TYR 305.A O no hydrogen 2.854 N/A SER 309.A OG TYR 305.A OH no hydrogen 3.092 N/A TYR 310.A N GLU 306.A O no hydrogen 3.203 N/A SER 311.A N GLU 307.A O no hydrogen 3.216 N/A HIS 312.A N ASP 308.A O no hydrogen 3.194 N/A ILE 313.A N SER 309.A O no hydrogen 2.925 N/A MET 314.A N TYR 310.A O no hydrogen 3.040 N/A ALA 315.A N SER 311.A O no hydrogen 2.952 N/A LEU 316.A N HIS 312.A O no hydrogen 2.920 N/A ILE 317.A N ILE 313.A O no hydrogen 2.830 N/A GLU 318.A N MET 314.A O no hydrogen 3.107 N/A GLN 319.A N ALA 315.A O no hydrogen 3.036 N/A TYR 320.A N LEU 316.A O no hydrogen 2.826 N/A ALA 321.A N ILE 317.A O no hydrogen 2.771 N/A LEU 324.A N ALA 321.A O no hydrogen 2.911 N/A VAL 328.A N PRO 325.A O no hydrogen 3.023 N/A PHE 329.A N PRO 326.A O no hydrogen 3.013 N/A LEU 330.A N PRO 326.A O no hydrogen 2.911 N/A GLY 331.A N ALA 327.A O no hydrogen 2.885 N/A ALA 333.A N PHE 329.A O no hydrogen 3.036 N/A ARG 334.A N LEU 330.A O no hydrogen 2.940 N/A LYS 335.A N GLY 331.A O no hydrogen 3.086 N/A LYS 335.A NZ ASN 47.A OD1 no hydrogen 2.867 N/A ILE 336.A N LEU 332.A O no hydrogen 3.051 N/A ILE 336.A N ALA 333.A O no hydrogen 3.263 N/A TYR 337.A N ALA 333.A O no hydrogen 2.866 N/A LYS 338.A N GLU 306.A OE2 no hydrogen 3.123 N/A ARG 339.A N ILE 336.A O no hydrogen 3.209 N/A ARG 339.A NH2 PHE 227.A O no hydrogen 2.884 N/A