Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ht4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 7.A N LEU 4.A O no hydrogen 2.931 N/A GLU 8.A N ASN 6.A O no hydrogen 2.387 N/A ILE 13.A N ILE 10.A O no hydrogen 2.891 N/A VAL 14.A N ILE 10.A O no hydrogen 3.290 N/A LYS 15.A N ALA 11.A O no hydrogen 3.116 N/A LYS 15.A NZ LYS 15.A O no hydrogen 2.912 N/A GLU 16.A N ILE 13.A O no hydrogen 3.047 N/A VAL 17.A N ILE 13.A O no hydrogen 2.691 N/A GLU 18.A N VAL 14.A O no hydrogen 2.839 N/A GLN 20.A N GLU 16.A O no hydrogen 3.178 N/A GLN 20.A N VAL 17.A O no hydrogen 2.633 N/A ILE 21.A N VAL 17.A O no hydrogen 3.020 N/A THR 22.A OG1 GLU 18.A O no hydrogen 2.757 N/A HIS 25.A N ILE 21.A O no hydrogen 3.001 N/A LYS 26.A N THR 22.A O no hydrogen 3.008 N/A ALA 28.A N VAL 24.A O no hydrogen 2.930 N/A ASP 29.A N HIS 25.A O no hydrogen 2.985 N/A GLU 30.A N ARG 27.A O no hydrogen 3.033 N/A VAL 31.A N ARG 27.A O no hydrogen 3.152 N/A ILE 32.A N ALA 28.A O no hydrogen 2.928 N/A GLU 33.A N ASP 29.A O no hydrogen 2.962 N/A SER 34.A N GLU 30.A O no hydrogen 2.665 N/A SER 34.A OG GLU 213.A OE1 no hydrogen 2.981 N/A ASN 35.A N VAL 31.A O no hydrogen 2.633 N/A ASN 35.A ND2 GLU 212.A O no hydrogen 3.310 N/A GLN 36.A N ILE 32.A O no hydrogen 2.776 N/A GLN 36.A NE2 PHE 279.A O no hydrogen 2.798 N/A PHE 37.A N GLU 33.A O no hydrogen 2.694 N/A PHE 37.A N SER 34.A O no hydrogen 2.870 N/A ARG 38.A N SER 34.A O no hydrogen 3.070 N/A VAL 39.A N ASN 35.A O no hydrogen 3.146 N/A LEU 40.A N GLN 36.A O no hydrogen 3.145 N/A GLU 41.A N PHE 37.A O no hydrogen 3.059 N/A SER 42.A N ARG 38.A O no hydrogen 3.077 N/A SER 42.A OG ASP 75.A OD2 no hydrogen 2.768 N/A PHE 43.A N VAL 39.A O no hydrogen 3.062 N/A GLY 44.A N LEU 40.A O no hydrogen 2.960 N/A LYS 45.A N GLU 41.A O no hydrogen 2.980 N/A HIS 46.A N SER 42.A O no hydrogen 3.109 N/A LYS 47.A N GLY 44.A O no hydrogen 3.050 N/A ILE 48.A N PHE 43.A O no hydrogen 3.360 N/A SER 49.A N HIS 52.A ND1 no hydrogen 2.661 N/A SER 49.A OG ASP 50.A OD1 no hydrogen 3.387 N/A SER 51.A N SER 49.A OG no hydrogen 3.193 N/A HIS 52.A N SER 49.A O no hydrogen 2.749 N/A HIS 52.A ND1 SER 49.A O no hydrogen 3.147 N/A PHE 53.A N ASP 50.A O no hydrogen 2.976 N/A THR 56.A N SER 268.A OG no hydrogen 3.190 N/A THR 56.A OG1 ASP 63.A OD2 no hydrogen 3.408 N/A GLY 60.A N THR 57.A O no hydrogen 3.188 N/A ARG 66.A N ASP 63.A OD1 no hydrogen 3.339 N/A ARG 66.A NH1 GLY 60.A O no hydrogen 3.093 N/A ARG 66.A NH2 GLY 60.A O no hydrogen 2.838 N/A ASP 67.A N ASP 63.A O no hydrogen 2.971 N/A THR 68.A N ILE 64.A O no hydrogen 3.041 N/A THR 68.A OG1 ILE 64.A O no hydrogen 2.402 N/A LEU 69.A N GLY 65.A O no hydrogen 3.145 N/A GLU 70.A N ARG 66.A O no hydrogen 3.026 N/A LYS 71.A N ASP 67.A O no hydrogen 3.052 N/A VAL 72.A N LEU 69.A O no hydrogen 3.108 N/A TYR 73.A N LEU 69.A O no hydrogen 2.935 N/A ALA 74.A N GLU 70.A O no hydrogen 3.095 N/A ASP 75.A N LYS 71.A O no hydrogen 3.310 N/A VAL 76.A N VAL 72.A O no hydrogen 3.050 N/A PHE 77.A N TYR 73.A O no hydrogen 2.856 N/A ALA 79.A N ALA 74.A O no hydrogen 2.751 N/A ALA 81.A N GLY 244.A O no hydrogen 2.961 N/A LEU 83.A N ILE 242.A O no hydrogen 2.425 N/A ARG 85.A NH1 ALA 263.A O no hydrogen 2.507 N/A GLN 87.A NE2 ALA 267.A O no hydrogen 3.541 N/A ILE 89.A N HIS 93.A ND1 no hydrogen 3.164 N/A ALA 94.A N SER 90.A O no hydrogen 3.478 N/A ILE 95.A N GLY 91.A O no hydrogen 3.378 N/A SER 96.A N THR 92.A O no hydrogen 3.239 N/A THR 97.A N HIS 93.A O no hydrogen 2.777 N/A THR 97.A OG1 HIS 93.A O no hydrogen 2.890 N/A ALA 98.A N ALA 94.A O no hydrogen 2.685 N/A LEU 99.A N ILE 95.A O no hydrogen 2.798 N/A PHE 100.A N SER 96.A O no hydrogen 2.964 N/A GLY 101.A N THR 97.A O no hydrogen 2.739 N/A ILE 102.A N LEU 99.A O no hydrogen 3.134 N/A LEU 103.A N LEU 99.A O no hydrogen 2.777 N/A ARG 104.A N ASP 107.A OD2 no hydrogen 2.855 N/A ARG 104.A NH1 LEU 103.A O no hydrogen 3.463 N/A GLY 106.A N ASN 138.A O no hydrogen 3.333 N/A ASP 107.A N ARG 104.A O no hydrogen 3.048 N/A GLU 108.A N ASN 164.A O no hydrogen 3.146 N/A LEU 109.A N GLY 140.A O no hydrogen 2.673 N/A TYR 111.A N ASN 142.A O no hydrogen 2.818 N/A ILE 112.A N GLY 168.A O no hydrogen 3.237 N/A TYR 117.A N GLN 170.A OE1 no hydrogen 3.346 N/A LEU 120.A N TYR 117.A O no hydrogen 3.284 N/A GLU 121.A N ASP 118.A O no hydrogen 3.023 N/A VAL 124.A N LEU 120.A O no hydrogen 2.818 N/A GLY 125.A N GLU 122.A O no hydrogen 3.045 N/A VAL 126.A N GLU 121.A O no hydrogen 3.040 N/A GLY 132.A N GLU 136.A OE1 no hydrogen 2.868 N/A PHE 134.A N ILE 123.A O no hydrogen 3.351 N/A TYR 137.A N PHE 134.A O no hydrogen 2.812 N/A ILE 139.A N PHE 134.A O no hydrogen 3.326 N/A GLY 140.A N ASP 107.A O no hydrogen 2.597 N/A ASN 142.A N LEU 109.A O no hydrogen 2.979 N/A VAL 144.A N TYR 111.A O no hydrogen 2.577 N/A THR 147.A N LEU 151.A O no hydrogen 2.550 N/A THR 147.A OG1 LEU 151.A O no hydrogen 3.369 N/A GLU 148.A N GLU 148.A OE1 no hydrogen 2.755 N/A GLY 150.A N THR 147.A O no hydrogen 2.751 N/A ALA 156.A N ASP 153.A OD1 no hydrogen 3.077 N/A VAL 157.A N ASP 153.A O no hydrogen 2.926 N/A ALA 158.A N PHE 154.A O no hydrogen 3.244 N/A ALA 159.A N GLU 155.A O no hydrogen 3.059 N/A ALA 160.A N VAL 157.A O no hydrogen 2.964 N/A ILE 161.A N ALA 158.A O no hydrogen 3.326 N/A HIS 162.A NE2 GLU 108.A OE1 no hydrogen 2.596 N/A HIS 162.A NE2 GLU 108.A OE2 no hydrogen 2.764 N/A ASN 164.A ND2 GLY 106.A O no hydrogen 2.562 N/A ASN 164.A ND2 GLU 108.A OE2 no hydrogen 2.740 N/A THR 165.A N HIS 162.A O no hydrogen 2.901 N/A THR 165.A OG1 HIS 162.A O no hydrogen 3.234 N/A LYS 166.A N GLU 108.A O no hydrogen 3.178 N/A GLY 168.A N LEU 110.A O no hydrogen 2.544 N/A ILE 169.A N PHE 202.A O no hydrogen 2.883 N/A GLN 170.A N THR 113.A OG1 no hydrogen 2.894 N/A GLN 170.A NE2 SER 172.A O no hydrogen 3.546 N/A ARG 171.A N ASP 204.A O no hydrogen 3.402 N/A ARG 171.A NE THR 314.A OG1 no hydrogen 2.769 N/A ARG 171.A NH1 ASN 205.A OD1 no hydrogen 3.076 N/A ARG 171.A NH2 THR 314.A OG1 no hydrogen 2.525 N/A LYS 173.A N SER 180.A OG no hydrogen 2.816 N/A GLY 174.A N SER 172.A OG no hydrogen 3.261 N/A ALA 176.A N LYS 173.A O no hydrogen 2.999 N/A ARG 178.A N ALA 176.A O no hydrogen 2.901 N/A ARG 178.A NH1 GLN 170.A O no hydrogen 3.549 N/A ARG 178.A NH1 ARG 171.A O no hydrogen 3.531 N/A ARG 178.A NH1 PRO 179.A O no hydrogen 3.278 N/A ARG 178.A NH2 GLN 170.A O no hydrogen 3.188 N/A SER 180.A OG ASP 315.A OD1 no hydrogen 3.497 N/A SER 180.A OG ASP 315.A OD2 no hydrogen 2.565 N/A THR 182.A N GLN 185.A OE1 no hydrogen 2.892 N/A THR 182.A OG1 GLN 185.A OE1 no hydrogen 3.561 N/A ILE 183.A N GLU 212.A OE2 no hydrogen 2.922 N/A GLN 185.A N THR 182.A OG1 no hydrogen 2.731 N/A ILE 186.A N ILE 183.A O no hydrogen 2.880 N/A LYS 187.A N ILE 183.A O no hydrogen 2.560 N/A LYS 187.A N SER 184.A O no hydrogen 3.057 N/A GLU 188.A N SER 184.A O no hydrogen 3.175 N/A PHE 191.A N GLU 188.A O no hydrogen 3.274 N/A LYS 193.A N ILE 189.A O no hydrogen 3.008 N/A LYS 193.A NZ VAL 199.A O no hydrogen 3.025 N/A LYS 193.A NZ ASP 222.A OD2 no hydrogen 2.777 N/A GLU 194.A N PHE 191.A O no hydrogen 3.009 N/A LYS 196.A N VAL 192.A O no hydrogen 2.852 N/A LYS 196.A NZ THR 165.A O no hydrogen 2.705 N/A VAL 199.A N LYS 196.A O no hydrogen 2.885 N/A VAL 200.A N LYS 166.A O no hydrogen 3.130 N/A VAL 201.A N ASP 222.A OD2 no hydrogen 3.207 N/A PHE 202.A N ILE 167.A O no hydrogen 2.909 N/A VAL 203.A N LEU 223.A O no hydrogen 3.006 N/A ASP 204.A N ILE 169.A O no hydrogen 2.695 N/A ASN 205.A N ALA 224.A O no hydrogen 3.185 N/A ASN 205.A ND2 GLU 215.A OE1 no hydrogen 3.076 N/A GLY 208.A N ASN 205.A O no hydrogen 3.182 N/A PHE 210.A N GLU 215.A OE2 no hydrogen 3.045 N/A GLU 215.A N HIS 218.A ND1 no hydrogen 3.182 N/A HIS 218.A N GLU 215.A O no hydrogen 2.674 N/A VAL 219.A N PRO 216.A O no hydrogen 2.848 N/A ASP 222.A N VAL 201.A O no hydrogen 2.842 N/A LEU 227.A N GLY 239.A O no hydrogen 3.229 N/A LYS 229.A N SER 226.A O no hydrogen 3.291 N/A ASN 230.A ND2 GLU 209.A O no hydrogen 3.222 N/A GLY 232.A N LYS 229.A O no hydrogen 2.926 N/A GLY 233.A N ASN 230.A O no hydrogen 3.032 N/A ILE 235.A N GLY 232.A O no hydrogen 3.087 N/A LYS 237.A N GLU 274.A OE2 no hydrogen 3.383 N/A TYR 241.A OH GLU 209.A OE2 no hydrogen 2.283 N/A ILE 242.A N LEU 83.A O no hydrogen 2.914 N/A GLY 244.A N ALA 81.A O no hydrogen 2.891 N/A LYS 245.A N ASP 222.A O no hydrogen 3.321 N/A GLU 246.A N GLU 80.A OE1 no hydrogen 2.826 N/A GLN 247.A N GLN 247.A OE1 no hydrogen 3.007 N/A VAL 249.A N LYS 245.A O no hydrogen 3.213 N/A GLU 250.A N GLU 246.A O no hydrogen 3.224 N/A ALA 251.A N GLN 247.A O no hydrogen 3.150 N/A CYS 252.A N TYR 248.A O no hydrogen 3.065 N/A CYS 252.A SG ALA 98.A O no hydrogen 3.848 N/A CYS 252.A SG TYR 248.A O no hydrogen 3.400 N/A ALA 253.A N VAL 249.A O no hydrogen 2.850 N/A TYR 254.A N GLU 250.A O no hydrogen 3.114 N/A ARG 255.A N ALA 251.A O no hydrogen 3.156 N/A ARG 255.A NH1 ARG 255.A O no hydrogen 3.170 N/A LEU 256.A N CYS 252.A O no hydrogen 2.839 N/A THR 257.A N ALA 253.A O no hydrogen 2.971 N/A THR 257.A OG1 ALA 253.A O no hydrogen 3.258 N/A THR 257.A OG1 SER 258.A O no hydrogen 3.349 N/A THR 257.A OG1 GLY 262.A O no hydrogen 2.554 N/A SER 258.A N THR 257.A OG1 no hydrogen 2.466 N/A SER 258.A OG PRO 259.A O no hydrogen 2.983 N/A GLY 262.A N SER 258.A O no hydrogen 3.042 N/A GLY 266.A N TYR 59.A O no hydrogen 2.742 N/A SER 268.A N THR 56.A OG1 no hydrogen 3.112 N/A SER 268.A OG LEU 269.A O no hydrogen 2.392 N/A LEU 269.A N THR 56.A O no hydrogen 3.196 N/A SER 271.A OG GLU 274.A OE2 no hydrogen 3.319 N/A GLN 273.A NE2 GLN 276.A OE1 no hydrogen 2.902 N/A TYR 275.A OH GLY 65.A O no hydrogen 2.586 N/A GLN 276.A N GLN 273.A O no hydrogen 2.808 N/A GLY 277.A N GLU 274.A O no hydrogen 2.901 N/A PHE 279.A N TYR 275.A O no hydrogen 3.024 N/A LEU 280.A N GLN 276.A O no hydrogen 3.060 N/A ALA 281.A N PHE 278.A O no hydrogen 3.059 N/A HIS 283.A N LEU 280.A O no hydrogen 2.856 N/A VAL 284.A N LEU 280.A O no hydrogen 3.020 N/A ALA 285.A N ALA 281.A O no hydrogen 3.015 N/A GLN 287.A N HIS 283.A O no hydrogen 2.913 N/A GLN 287.A NE2 HIS 283.A O no hydrogen 3.532 N/A ALA 288.A N VAL 284.A O no hydrogen 3.277 N/A LEU 289.A N ALA 285.A O no hydrogen 2.721 N/A LYS 290.A N GLY 286.A O no hydrogen 3.020 N/A LYS 290.A NZ ASP 29.A OD1 no hydrogen 2.696 N/A LYS 290.A NZ ASP 29.A OD2 no hydrogen 3.208 N/A GLY 291.A N GLN 287.A O no hydrogen 3.074 N/A ALA 292.A N ALA 288.A O no hydrogen 3.254 N/A ILE 293.A N LEU 289.A O no hydrogen 3.340 N/A PHE 294.A N LYS 290.A O no hydrogen 2.931 N/A THR 295.A N GLY 291.A O no hydrogen 2.941 N/A THR 295.A OG1 GLY 291.A O no hydrogen 3.184 N/A ALA 296.A N ALA 292.A O no hydrogen 2.976 N/A ALA 297.A N ILE 293.A O no hydrogen 3.022 N/A PHE 298.A N PHE 294.A O no hydrogen 2.947 N/A LEU 299.A N THR 295.A O no hydrogen 3.175 N/A GLU 300.A N ALA 296.A O no hydrogen 3.377 N/A LYS 301.A N ALA 297.A O no hydrogen 3.141 N/A LYS 301.A NZ GLU 16.A OE1 no hydrogen 2.609 N/A LEU 302.A N PHE 298.A O no hydrogen 3.027 N/A GLY 303.A N LEU 299.A O no hydrogen 2.811 N/A THR 305.A OG1 ALA 296.A O no hydrogen 3.202 N/A THR 305.A OG1 GLU 300.A OE1 no hydrogen 3.562 N/A ALA 311.A N ALA 308.A O no hydrogen 2.997 N/A ARG 313.A NH1 ILE 317.A O no hydrogen 3.008 N/A ARG 313.A NH2 GLN 318.A OE1 no hydrogen 2.502 N/A THR 314.A OG1 PHE 181.A O no hydrogen 3.332 N/A THR 314.A OG1 GLU 212.A OE2 no hydrogen 2.584 N/A ILE 317.A N ASP 315.A OD1 no hydrogen 3.089 N/A GLN 318.A N GLN 386.A OE1 no hydrogen 3.419 N/A GLN 318.A NE2 PRO 307.A O no hydrogen 3.028 N/A GLN 318.A NE2 SER 319.A O no hydrogen 3.165 N/A SER 319.A N SER 306.A O no hydrogen 2.495 N/A SER 319.A OG SER 306.A O no hydrogen 3.176 N/A VAL 320.A N ALA 383.A O no hydrogen 3.245 N/A GLN 321.A N ASN 304.A O no hydrogen 2.699 N/A PHE 322.A N TYR 381.A O no hydrogen 3.178 N/A ARG 327.A N ASP 324.A OD1 no hydrogen 3.016 N/A ALA 329.A N ASP 326.A O no hydrogen 3.171 N/A PHE 330.A N ARG 327.A O no hydrogen 3.117 N/A GLN 332.A N ILE 328.A O no hydrogen 2.886 N/A GLN 332.A NE2 PRO 346.A O no hydrogen 2.804 N/A ALA 333.A N ALA 329.A O no hydrogen 2.955 N/A ILE 334.A N PHE 330.A O no hydrogen 2.914 N/A GLN 335.A N CYS 331.A O no hydrogen 3.067 N/A GLN 335.A NE2 ASN 341.A O no hydrogen 3.072 N/A GLN 335.A NE2 ALA 360.A O no hydrogen 3.574 N/A TYR 336.A N GLN 332.A O no hydrogen 2.941 N/A ALA 337.A N ILE 334.A O no hydrogen 2.939 N/A SER 338.A OG ILE 334.A O no hydrogen 2.955 N/A SER 338.A OG GLN 335.A O no hydrogen 3.311 N/A HIS 343.A N HIS 343.A ND1 no hydrogen 2.717 N/A ASN 349.A N VAL 357.A O no hydrogen 2.906 N/A VAL 357.A N ASN 349.A O no hydrogen 3.074 N/A ILE 358.A N GLY 375.A O no hydrogen 3.357 N/A ALA 359.A N ALA 373.A O no hydrogen 2.540 N/A ALA 360.A N GLN 335.A OE1 no hydrogen 2.534 N/A PHE 363.A N GLU 370.A OE1 no hydrogen 2.571 N/A ILE 364.A N GLU 370.A OE2 no hydrogen 3.252 N/A GLU 370.A N ALA 367.A O no hydrogen 3.419 N/A SER 372.A N GLN 386.A O no hydrogen 3.287 N/A SER 372.A OG GLU 370.A O no hydrogen 3.088 N/A SER 372.A OG GLN 386.A O no hydrogen 3.391 N/A ALA 373.A N ALA 359.A O no hydrogen 3.072 N/A ASP 374.A N TYR 384.A O no hydrogen 3.244 N/A GLY 375.A N ILE 358.A O no hydrogen 3.226 N/A ILE 377.A N ASP 356.A O no hydrogen 2.871 N/A ARG 378.A NH1 ASP 355.A OD2 no hydrogen 3.403 N/A TYR 381.A N ARG 378.A O no hydrogen 2.841 N/A ALA 383.A N VAL 320.A O no hydrogen 3.261 N/A TYR 384.A N ASP 374.A O no hydrogen 2.644 N/A GLN 386.A N SER 372.A O no hydrogen 3.338 N/A GLY 388.A N ILE 369.A O no hydrogen 2.972 N/A TYR 391.A N GLN 287.A OE1 no hydrogen 3.395 N/A TYR 391.A OH GLU 18.A OE1 no hydrogen 2.851 N/A HIS 393.A N THR 390.A OG1 no hydrogen 3.362 N/A VAL 394.A N THR 390.A O no hydrogen 3.258 N/A LYS 395.A N TYR 391.A O no hydrogen 2.798 N/A ILE 396.A N SER 392.A O no hydrogen 2.623 N/A ALA 397.A N HIS 393.A O no hydrogen 2.814 N/A ILE 398.A N VAL 394.A O no hydrogen 2.955 N/A CYS 399.A N LYS 395.A O no hydrogen 3.110 N/A CYS 399.A SG LYS 395.A O no hydrogen 3.396 N/A SER 400.A N ILE 396.A O no hydrogen 2.891 N/A SER 400.A OG GLU 404.A OE2 no hydrogen 3.389 N/A ALA 401.A N ALA 397.A O no hydrogen 3.088 N/A ILE 402.A N ILE 398.A O no hydrogen 3.271 N/A ASP 403.A N CYS 399.A O no hydrogen 2.941 N/A GLU 404.A N SER 400.A O no hydrogen 2.944 N/A LEU 405.A N ILE 402.A O no hydrogen 2.906 N/A ILE 406.A N ASP 403.A O no hydrogen 2.856 N/A