Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qyi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ ASP 311.A O no hydrogen 3.018 N/A LYS 2.A N ASP 312.A O no hydrogen 2.731 N/A ILE 3.A N GLU 229.A O no hydrogen 2.965 N/A LEU 4.A N PHE 314.A O no hydrogen 2.841 N/A PHE 5.A N GLY 231.A O no hydrogen 2.706 N/A ASP 6.A N VAL 316.A O no hydrogen 3.057 N/A GLY 9.A N LEU 12.A O no hydrogen 2.872 N/A VAL 10.A N VAL 7.A O no hydrogen 3.138 N/A PHE 11.A N VAL 7.A O no hydrogen 2.953 N/A LEU 12.A N VAL 7.A O no hydrogen 3.237 N/A SER 13.A N ILE 208.A O no hydrogen 3.168 N/A SER 13.A OG ILE 208.A O no hydrogen 3.434 N/A ARG 16.A NE ASP 19.A OD2 no hydrogen 3.101 N/A ARG 16.A NH1 GLN 206.A O no hydrogen 3.080 N/A ARG 16.A NH2 ASP 19.A OD2 no hydrogen 2.902 N/A CYS 17.A N GLU 14.A O no hydrogen 2.823 N/A ASP 19.A N GLU 15.A O no hydrogen 2.953 N/A VAL 20.A N ARG 16.A O no hydrogen 2.723 N/A SER 21.A N CYS 17.A O no hydrogen 2.723 N/A ALA 22.A N PHE 18.A O no hydrogen 2.917 N/A LEU 23.A N ASP 19.A O no hydrogen 2.842 N/A THR 24.A N VAL 20.A O no hydrogen 2.777 N/A THR 24.A OG1 VAL 20.A O no hydrogen 2.940 N/A VAL 25.A N SER 21.A O no hydrogen 3.323 N/A TYR 26.A N ALA 22.A O no hydrogen 3.029 N/A GLU 27.A N LEU 23.A O no hydrogen 2.796 N/A LEU 28.A N THR 24.A O no hydrogen 2.939 N/A LEU 29.A N TYR 26.A O no hydrogen 2.963 N/A LYS 31.A NZ GLY 35.A O no hydrogen 2.920 N/A CYS 32.A N ASP 30.A OD1 no hydrogen 2.502 N/A TYR 33.A N ASP 30.A O no hydrogen 3.046 N/A LEU 36.A N LEU 29.A O no hydrogen 2.875 N/A HIS 37.A NE2 PHE 122.A O no hydrogen 2.958 N/A HIS 39.A ND1 ILE 40.A O no hydrogen 2.797 N/A TRP 42.A NE1 ASP 30.A OD2 no hydrogen 2.943 N/A GLU 43.A N ASP 41.A OD2 no hydrogen 3.441 N/A THR 44.A N ASP 41.A O no hydrogen 2.887 N/A THR 44.A OG1 ASP 41.A O no hydrogen 2.901 N/A LEU 45.A N TRP 42.A O no hydrogen 3.335 N/A THR 46.A N ASP 49.A OD2 no hydrogen 2.425 N/A THR 46.A OG1 ASN 48.A OD1 no hydrogen 3.258 N/A ASN 48.A N THR 46.A OG1 no hydrogen 2.965 N/A ASP 49.A N THR 46.A OG1 no hydrogen 2.993 N/A ILE 50.A N THR 46.A O no hydrogen 3.129 N/A GLN 51.A NE2 ASP 19.A OD1 no hydrogen 3.525 N/A ASP 52.A N ASN 48.A O no hydrogen 2.813 N/A ILE 53.A N ASP 49.A O no hydrogen 2.791 N/A ARG 54.A N ILE 50.A O no hydrogen 2.938 N/A ARG 54.A NE ASP 61.A OD1 no hydrogen 3.103 N/A ARG 54.A NH1 GLU 15.A OE1 no hydrogen 2.800 N/A ARG 54.A NH1 ASP 19.A OD1 no hydrogen 3.103 N/A ARG 54.A NH2 GLU 15.A OE1 no hydrogen 3.113 N/A ARG 54.A NH2 ASP 61.A OD2 no hydrogen 2.430 N/A ASN 55.A N GLN 51.A O no hydrogen 2.936 N/A ARG 56.A N ASP 52.A O no hydrogen 2.852 N/A ARG 56.A NH2 GLU 126.A OE1 no hydrogen 3.165 N/A ILE 57.A N ILE 53.A O no hydrogen 2.839 N/A PHE 58.A N ARG 54.A O no hydrogen 2.958 N/A GLN 59.A NE2 ARG 56.A O no hydrogen 2.690 N/A LYS 60.A N ASN 55.A O no hydrogen 3.248 N/A LYS 62.A N GLN 59.A O no hydrogen 3.092 N/A ILE 63.A N PHE 58.A O no hydrogen 2.995 N/A ASN 65.A N ASP 61.A O no hydrogen 2.792 N/A LYS 66.A N LYS 62.A O no hydrogen 3.055 N/A LEU 67.A N ILE 63.A O no hydrogen 3.212 N/A SER 69.A N ASN 65.A O no hydrogen 3.186 N/A SER 69.A OG LYS 66.A O no hydrogen 2.945 N/A LEU 70.A N LYS 66.A O no hydrogen 3.167 N/A GLY 71.A N LYS 68.A O no hydrogen 2.973 N/A LEU 72.A N LEU 67.A O no hydrogen 2.720 N/A PHE 79.A N TRP 76.A O no hydrogen 3.051 N/A ILE 80.A N ASP 77.A O no hydrogen 2.984 N/A PHE 82.A N LEU 78.A O no hydrogen 3.027 N/A SER 83.A N PHE 79.A O no hydrogen 2.924 N/A SER 83.A OG PHE 79.A O no hydrogen 3.077 N/A ILE 84.A N ILE 80.A O no hydrogen 3.154 N/A LEU 86.A N PHE 82.A O no hydrogen 2.994 N/A ILE 87.A N SER 83.A O no hydrogen 2.724 N/A ASP 88.A N ILE 84.A O no hydrogen 3.171 N/A ILE 89.A N HIS 85.A O no hydrogen 2.999 N/A LEU 90.A N LEU 86.A O no hydrogen 2.860 N/A LYS 91.A N ILE 87.A O no hydrogen 3.172 N/A LYS 91.A NZ GLU 154.A OE1 no hydrogen 2.734 N/A LYS 92.A N ILE 89.A O no hydrogen 3.209 N/A LEU 93.A N LEU 90.A O no hydrogen 3.484 N/A SER 94.A N GLU 97.A OE1 no hydrogen 2.810 N/A GLU 97.A N SER 94.A OG no hydrogen 3.150 N/A ILE 98.A N SER 94.A O no hydrogen 3.044 N/A GLU 99.A N HIS 95.A O no hydrogen 3.025 N/A ALA 100.A N ASP 96.A O no hydrogen 3.195 N/A ALA 100.A N GLU 97.A O no hydrogen 3.243 N/A PHE 101.A N GLU 97.A O no hydrogen 3.269 N/A GLN 103.A N ALA 100.A O no hydrogen 2.785 N/A GLN 103.A NE2 ALA 100.A O no hydrogen 3.451 N/A LEU 109.A N PRO 106.A O no hydrogen 2.868 N/A LYS 110.A N PRO 106.A O no hydrogen 2.932 N/A LYS 110.A NZ PHE 101.A O no hydrogen 2.610 N/A LYS 110.A NZ GLN 103.A O no hydrogen 3.002 N/A LEU 111.A N VAL 107.A O no hydrogen 2.823 N/A GLN 112.A N LEU 109.A O no hydrogen 3.199 N/A ASN 113.A N LYS 110.A O no hydrogen 3.349 N/A ASN 117.A N ILE 114.A O no hydrogen 3.064 N/A LEU 118.A N SER 115.A O no hydrogen 3.371 N/A CYS 121.A SG PHE 122.A O no hydrogen 3.853 N/A LEU 128.A N ASN 125.A O no hydrogen 3.137 N/A GLN 131.A N GLN 127.A O no hydrogen 2.993 N/A PHE 132.A N PRO 129.A O no hydrogen 3.029 N/A LEU 133.A N PRO 129.A O no hydrogen 3.235 N/A GLY 139.A N LEU 70.A O no hydrogen 2.636 N/A LYS 140.A NZ ASP 77.A OD2 no hydrogen 3.013 N/A ASN 142.A ND2 VAL 138.A O no hydrogen 2.669 N/A ILE 143.A N GLY 139.A O no hydrogen 2.802 N/A TYR 144.A N LYS 140.A O no hydrogen 2.990 N/A TYR 144.A OH ASP 77.A OD1 no hydrogen 2.759 N/A ALA 145.A N ASN 141.A O no hydrogen 3.149 N/A ALA 146.A N ASN 142.A O no hydrogen 3.059 N/A LEU 147.A N ILE 143.A O no hydrogen 3.081 N/A GLU 148.A N TYR 144.A O no hydrogen 3.102 N/A GLU 149.A N ALA 145.A O no hydrogen 2.998 N/A PHE 150.A N ALA 146.A O no hydrogen 2.891 N/A ALA 151.A N LEU 147.A O no hydrogen 3.219 N/A THR 152.A N GLU 148.A O no hydrogen 3.097 N/A THR 152.A OG1 GLU 149.A O no hydrogen 2.853 N/A THR 153.A N GLU 149.A O no hydrogen 3.025 N/A THR 153.A OG1 GLU 149.A O no hydrogen 3.076 N/A THR 153.A OG1 PHE 150.A O no hydrogen 3.175 N/A GLU 154.A N PHE 150.A O no hydrogen 2.887 N/A LEU 155.A N ALA 151.A O no hydrogen 2.824 N/A VAL 157.A N THR 152.A O no hydrogen 2.944 N/A THR 161.A N ASP 159.A OD2 no hydrogen 3.293 N/A THR 161.A OG1 ASP 159.A OD2 no hydrogen 2.618 N/A PHE 163.A N ALA 160.A O no hydrogen 3.446 N/A SER 164.A N THR 161.A O no hydrogen 3.180 N/A SER 164.A OG THR 161.A O no hydrogen 2.827 N/A GLY 167.A N SER 164.A O no hydrogen 3.027 N/A THR 171.A N GLY 167.A O no hydrogen 2.792 N/A THR 171.A OG1 GLY 167.A O no hydrogen 2.755 N/A LEU 172.A N ALA 168.A O no hydrogen 3.033 N/A ALA 173.A N LEU 169.A O no hydrogen 3.025 N/A GLN 174.A N TRP 170.A O no hydrogen 2.999 N/A GLU 175.A N THR 171.A O no hydrogen 2.926 N/A VAL 176.A N LEU 172.A O no hydrogen 2.994 N/A TYR 177.A N ALA 173.A O no hydrogen 3.171 N/A GLN 178.A N GLN 174.A O no hydrogen 3.127 N/A GLU 179.A N GLU 175.A O no hydrogen 3.083 N/A TRP 180.A N VAL 176.A O no hydrogen 3.128 N/A TYR 181.A N TYR 177.A O no hydrogen 2.770 N/A LEU 182.A N GLN 178.A O no hydrogen 2.722 N/A GLY 183.A N GLU 179.A O no hydrogen 2.754 N/A SER 184.A N LYS 200.A O no hydrogen 2.976 N/A SER 184.A OG GLU 179.A OE2 no hydrogen 3.049 N/A SER 184.A OG THR 197.A O no hydrogen 3.154 N/A TYR 187.A N GLY 183.A O no hydrogen 2.814 N/A GLU 188.A N SER 184.A O no hydrogen 3.149 N/A ASP 189.A N LYS 185.A O no hydrogen 3.352 N/A VAL 190.A N LEU 186.A O no hydrogen 2.842 N/A GLU 191.A N TYR 187.A O no hydrogen 2.674 N/A LYS 193.A NZ GLU 175.A OE2 no hydrogen 2.312 N/A ALA 195.A N GLU 188.A OE2 no hydrogen 2.687 N/A ARG 196.A N GLU 179.A OE1 no hydrogen 2.771 N/A ARG 196.A NE GLU 108.A OE2 no hydrogen 2.733 N/A ARG 196.A NH1 GLU 175.A OE1 no hydrogen 3.020 N/A ARG 196.A NH2 GLU 108.A OE1 no hydrogen 3.131 N/A ARG 196.A NH2 GLU 175.A OE1 no hydrogen 3.021 N/A THR 197.A N GLU 179.A OE2 no hydrogen 3.014 N/A THR 197.A OG1 GLU 179.A OE2 no hydrogen 3.036 N/A LYS 200.A NZ GLU 27.A OE1 no hydrogen 2.710 N/A TYR 203.A N TRP 180.A O no hydrogen 3.337 N/A ILE 204.A N TYR 181.A O no hydrogen 3.158 N/A TYR 205.A N GLY 202.A O no hydrogen 3.007 N/A GLN 206.A N TYR 203.A O no hydrogen 3.214 N/A LEU 210.A N PHE 11.A O no hydrogen 3.078 N/A ARG 211.A NH1 GLU 215.A OE2 no hydrogen 3.392 N/A GLU 215.A N PRO 212.A O no hydrogen 2.965 N/A VAL 216.A N PRO 212.A O no hydrogen 3.182 N/A LYS 217.A N VAL 213.A O no hydrogen 2.757 N/A LYS 217.A NZ LEU 248.A O no hydrogen 3.412 N/A LEU 219.A N GLU 215.A O no hydrogen 3.373 N/A LEU 220.A N VAL 216.A O no hydrogen 2.827 N/A ASN 221.A N LYS 217.A O no hydrogen 3.334 N/A ASP 222.A N VAL 218.A O no hydrogen 2.962 N/A LEU 223.A N LEU 219.A O no hydrogen 2.904 N/A LYS 224.A N LEU 220.A O no hydrogen 3.031 N/A LYS 224.A NZ TYR 253.A O no hydrogen 3.307 N/A GLY 225.A N ASN 221.A O no hydrogen 2.908 N/A ALA 226.A N ASP 222.A O no hydrogen 2.868 N/A ALA 226.A N LEU 223.A O no hydrogen 3.287 N/A GLY 227.A N LYS 224.A O no hydrogen 2.914 N/A PHE 228.A N LEU 223.A O no hydrogen 3.099 N/A GLU 229.A N LYS 1.A O no hydrogen 2.989 N/A GLY 231.A N ILE 3.A O no hydrogen 3.144 N/A ILE 232.A N PHE 258.A O no hydrogen 2.915 N/A ALA 233.A N PHE 5.A O no hydrogen 2.940 N/A THR 234.A N ALA 260.A O no hydrogen 3.105 N/A ARG 236.A N THR 234.A OG1 no hydrogen 3.102 N/A ARG 236.A NE ASP 8.A OD1 no hydrogen 2.847 N/A ARG 236.A NE ASP 8.A OD2 no hydrogen 3.062 N/A ARG 236.A NH1 GLU 207.A OE1 no hydrogen 3.478 N/A ARG 236.A NH1 GLU 240.A O no hydrogen 2.856 N/A ARG 236.A NH2 ASP 8.A OD1 no hydrogen 2.660 N/A ARG 236.A NH2 GLU 207.A OE2 no hydrogen 3.261 N/A TYR 238.A N SER 263.A OG no hydrogen 3.044 N/A THR 241.A N TYR 238.A O no hydrogen 3.188 N/A THR 241.A OG1 PRO 237.A O no hydrogen 2.658 N/A VAL 242.A N TYR 238.A O no hydrogen 2.913 N/A VAL 243.A N THR 239.A O no hydrogen 3.081 N/A PHE 245.A N THR 241.A O no hydrogen 3.259 N/A GLU 246.A N VAL 242.A O no hydrogen 2.694 N/A ASN 247.A N VAL 243.A O no hydrogen 2.865 N/A LEU 248.A N PRO 244.A O no hydrogen 2.959 N/A GLY 249.A N PHE 245.A O no hydrogen 2.978 N/A GLY 249.A N GLU 246.A O no hydrogen 3.067 N/A LEU 250.A N PHE 245.A O no hydrogen 2.913 N/A LEU 251.A N PHE 245.A O no hydrogen 3.289 N/A TYR 253.A N LEU 250.A O no hydrogen 2.896 N/A PHE 254.A N LEU 251.A O no hydrogen 2.793 N/A PHE 258.A N GLU 255.A O no hydrogen 2.890 N/A ALA 260.A N ILE 232.A O no hydrogen 2.572 N/A THR 261.A N ASP 264.A OD2 no hydrogen 2.749 N/A THR 261.A OG1 ASP 264.A OD2 no hydrogen 3.556 N/A ALA 262.A N ARG 236.A O no hydrogen 2.971 N/A SER 263.A N THR 261.A OG1 no hydrogen 3.192 N/A VAL 265.A N THR 261.A O no hydrogen 3.367 N/A LEU 266.A N ALA 262.A O no hydrogen 3.068 N/A GLU 267.A N SER 263.A O no hydrogen 2.755 N/A ALA 268.A N ASP 264.A O no hydrogen 2.688 N/A GLU 269.A N VAL 265.A O no hydrogen 2.992 N/A ASN 270.A N LEU 266.A O no hydrogen 3.381 N/A ASN 270.A N GLU 267.A O no hydrogen 2.984 N/A ALA 274.A N TYR 271.A O no hydrogen 2.972 N/A LEU 277.A N GLU 269.A OE2 no hydrogen 2.926 N/A LYS 279.A NZ ASP 6.A OD1 no hydrogen 3.394 N/A LYS 279.A NZ ALA 233.A O no hydrogen 2.757 N/A LYS 279.A NZ ASP 322.A OD1 no hydrogen 3.002 N/A ASN 281.A N GLY 278.A O no hydrogen 2.726 N/A PHE 283.A N ASN 281.A OD1 no hydrogen 2.767 N/A ILE 286.A N PRO 282.A O no hydrogen 2.799 N/A ALA 287.A N PHE 283.A O no hydrogen 2.874 N/A ALA 288.A N SER 284.A O no hydrogen 2.958 N/A LEU 289.A N ILE 286.A O no hydrogen 3.363 N/A TYR 290.A N ILE 286.A O no hydrogen 3.120 N/A GLY 291.A N ALA 287.A O no hydrogen 3.051 N/A ASN 292.A N ASP 257.A O no hydrogen 2.769 N/A ASN 292.A ND2 ASP 264.A OD1 no hydrogen 3.072 N/A ASN 293.A ND2 ASP 295.A OD2 no hydrogen 3.161 N/A ARG 294.A NH1 GLU 267.A OE2 no hydrogen 3.116 N/A LYS 296.A N ASN 293.A O no hydrogen 2.740 N/A TYR 297.A N ARG 294.A O no hydrogen 3.188 N/A TYR 297.A OH ASN 292.A OD1 no hydrogen 2.864 N/A SER 299.A N LYS 296.A O no hydrogen 3.046 N/A SER 299.A OG LYS 296.A O no hydrogen 2.455 N/A TYR 300.A N LYS 296.A O no hydrogen 3.208 N/A TYR 300.A OH GLY 291.A O no hydrogen 2.505 N/A ILE 301.A N TYR 297.A O no hydrogen 3.099 N/A ILE 301.A N GLU 298.A O no hydrogen 3.243 N/A ASN 302.A N GLU 298.A O no hydrogen 3.093 N/A LYS 303.A N SER 299.A O no hydrogen 2.976 N/A ASN 306.A N LYS 328.A O no hydrogen 2.925 N/A VAL 308.A N ILE 329.A O no hydrogen 3.134 N/A ASN 309.A ND2 ASP 312.A OD2 no hydrogen 3.216 N/A LYS 310.A NZ ASP 355.A OD1 no hydrogen 2.635 N/A LYS 310.A NZ ASP 355.A OD2 no hydrogen 3.307 N/A ASP 312.A N ASN 309.A O no hydrogen 3.060 N/A PHE 314.A N LYS 2.A O no hydrogen 3.005 N/A ILE 315.A N THR 332.A O no hydrogen 2.846 N/A VAL 316.A N LEU 4.A O no hydrogen 2.733 N/A GLY 317.A N ILE 334.A O no hydrogen 3.368 N/A SER 319.A OG ASP 322.A OD2 no hydrogen 2.924 N/A ASP 322.A N SER 319.A O no hydrogen 3.304 N/A ASP 322.A N SER 319.A OG no hydrogen 3.305 N/A LEU 324.A N LEU 320.A O no hydrogen 3.131 N/A SER 325.A OG LYS 279.A O no hydrogen 3.090 N/A SER 325.A OG PRO 280.A O no hydrogen 2.868 N/A SER 325.A OG ALA 321.A O no hydrogen 3.098 N/A ALA 326.A N ASP 322.A O no hydrogen 3.103 N/A ALA 326.A N LEU 323.A O no hydrogen 3.146 N/A GLN 327.A N LEU 323.A O no hydrogen 2.955 N/A GLN 327.A NE2 HIS 352.A O no hydrogen 2.973 N/A LYS 328.A N LEU 324.A O no hydrogen 2.832 N/A ILE 329.A N SER 325.A O no hydrogen 3.264 N/A GLY 330.A N ALA 326.A O no hydrogen 2.898 N/A ALA 331.A N ALA 326.A O no hydrogen 2.871 N/A THR 332.A N VAL 313.A O no hydrogen 2.827 N/A THR 332.A OG1 LYS 310.A O no hydrogen 2.478 N/A PHE 333.A N ASP 355.A OD2 no hydrogen 2.488 N/A ILE 334.A N ILE 315.A O no hydrogen 2.956 N/A GLY 335.A N TYR 356.A O no hydrogen 2.911 N/A THR 336.A N GLY 317.A O no hydrogen 2.732 N/A THR 336.A OG1 GLY 317.A O no hydrogen 3.355 N/A LEU 337.A N ASN 359.A O no hydrogen 3.340 N/A THR 338.A OG1 GLY 9.A O no hydrogen 2.595 N/A GLY 342.A N GLY 339.A O no hydrogen 2.709 N/A ALA 346.A N LYS 343.A O no hydrogen 2.959 N/A LEU 349.A N ALA 345.A O no hydrogen 3.379 N/A GLU 350.A N ALA 346.A O no hydrogen 3.027 N/A ALA 351.A N GLY 347.A O no hydrogen 2.896 N/A HIS 352.A N LEU 349.A O no hydrogen 3.228 N/A HIS 353.A N GLU 350.A O no hydrogen 3.060 N/A ALA 354.A N LEU 349.A O no hydrogen 3.072 N/A TYR 356.A N PHE 333.A O no hydrogen 3.145 N/A TYR 356.A OH LEU 371.A O no hydrogen 2.699 N/A ILE 358.A N GLY 335.A O no hydrogen 2.684 N/A ASN 359.A N GLU 363.A OE1 no hydrogen 3.294 N/A ASN 359.A ND2 GLU 363.A OE1 no hydrogen 2.918 N/A ASN 359.A ND2 GLU 363.A OE2 no hydrogen 2.760 N/A GLY 362.A N HIS 360.A ND1 no hydrogen 3.048 N/A GLU 363.A N HIS 360.A O no hydrogen 2.958 N/A LEU 364.A N LEU 361.A O no hydrogen 3.318 N/A ARG 365.A NH2 ASP 222.A OD2 no hydrogen 2.567 N/A VAL 367.A N LEU 364.A O no hydrogen 3.241 N/A LEU 368.A N LEU 364.A O no hydrogen 3.320 N/A ASP 369.A N ARG 365.A O no hydrogen 2.917 N/A ASN 370.A N VAL 367.A O no hydrogen 3.455 N/A ASN 370.A ND2 GLY 366.A O no hydrogen 3.085 N/A GLU 373.A N GLU 373.A OE1 no hydrogen 2.586 N/A HIS 374.A N ASN 370.A O no hydrogen 2.832 N/A HIS 375.A N LEU 372.A O no hydrogen 3.066 N/A