Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4tnj_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N GLY 1.A O no hydrogen 3.241 N/A LEU 6.A N TRP 2.A O no hydrogen 2.606 N/A ASP 7.A N PHE 3.A O no hydrogen 2.630 N/A ASP 8.A N ASP 4.A O no hydrogen 2.916 N/A TRP 9.A N ILE 5.A O no hydrogen 3.185 N/A LEU 10.A N LEU 6.A O no hydrogen 3.091 N/A LYS 11.A N ASP 7.A O no hydrogen 2.852 N/A LYS 11.A NZ ASP 7.A OD2 no hydrogen 2.844 N/A ARG 12.A N TRP 9.A O no hydrogen 3.159 N/A ARG 14.A NH1 LEU 10.A O no hydrogen 2.834 N/A ARG 14.A NH2 TRP 9.A O no hydrogen 2.257 N/A GLY 19.A N LEU 10.A O no hydrogen 3.340 N/A TRP 20.A N GLU 119.A OE2 no hydrogen 2.922 N/A TRP 20.A NE1 ASP 7.A OD2 no hydrogen 3.260 N/A SER 21.A N GLU 119.A OE1 no hydrogen 3.121 N/A SER 21.A OG GLU 119.A OE1 no hydrogen 3.040 N/A ILE 23.A N TRP 20.A O no hydrogen 3.110 N/A LEU 24.A N SER 21.A O no hydrogen 2.846 N/A LEU 25.A N SER 21.A O no hydrogen 2.829 N/A PHE 26.A N GLY 22.A O no hydrogen 3.173 N/A CYS 28.A SG LEU 24.A O no hydrogen 3.421 N/A ALA 29.A N LEU 25.A O no hydrogen 2.823 N/A TYR 30.A N PHE 26.A O no hydrogen 3.129 N/A LEU 31.A N PRO 27.A O no hydrogen 3.145 N/A ALA 32.A N CYS 28.A O no hydrogen 2.742 N/A LEU 33.A N ALA 29.A O no hydrogen 3.186 N/A GLY 34.A N TYR 30.A O no hydrogen 2.745 N/A GLY 35.A N LEU 31.A O no hydrogen 2.608 N/A TRP 36.A N ALA 32.A O no hydrogen 3.139 N/A LEU 37.A N LEU 33.A O no hydrogen 3.059 N/A THR 38.A N GLY 34.A O no hydrogen 2.810 N/A THR 38.A OG1 GLY 34.A O no hydrogen 2.655 N/A GLY 39.A N GLY 35.A O no hydrogen 3.067 N/A THR 40.A N TRP 36.A O no hydrogen 2.738 N/A THR 40.A OG1 TRP 36.A O no hydrogen 2.364 N/A THR 41.A N THR 38.A O no hydrogen 3.059 N/A THR 41.A OG1 THR 38.A O no hydrogen 3.220 N/A PHE 42.A N THR 38.A O no hydrogen 2.983 N/A THR 44.A OG1 GLU 57.A OE1 no hydrogen 2.819 N/A THR 44.A OG1 GLU 57.A OE2 no hydrogen 2.884 N/A SER 45.A N LEU 51.A O no hydrogen 3.243 N/A SER 45.A OG SER 53.A OG no hydrogen 2.543 N/A SER 45.A OG SER 67.A OG no hydrogen 2.712 N/A TRP 46.A N THR 44.A OG1 no hydrogen 3.180 N/A THR 48.A OG1 THR 68.A O no hydrogen 3.080 N/A HIS 49.A N SER 45.A O no hydrogen 2.782 N/A GLY 50.A N TRP 46.A O no hydrogen 2.882 N/A LEU 51.A N SER 45.A O no hydrogen 3.126 N/A SER 53.A N GLU 57.A OE2 no hydrogen 3.020 N/A SER 53.A OG VAL 43.A O no hydrogen 3.541 N/A SER 53.A OG SER 45.A OG no hydrogen 2.543 N/A SER 54.A OG PHE 42.A O no hydrogen 3.526 N/A SER 54.A OG GLU 57.A OE2 no hydrogen 3.153 N/A TYR 55.A N THR 40.A O no hydrogen 3.156 N/A LEU 56.A N THR 41.A O no hydrogen 3.035 N/A GLU 57.A N SER 54.A O no hydrogen 3.059 N/A GLY 58.A N SER 54.A O no hydrogen 3.227 N/A GLY 58.A N TYR 55.A O no hydrogen 2.936 N/A CYS 59.A N SER 54.A O no hydrogen 2.980 N/A ASN 60.A N THR 63.A OG1 no hydrogen 2.866 N/A LEU 62.A N ASN 60.A OD1 no hydrogen 2.875 N/A THR 63.A N ASN 60.A OD1 no hydrogen 3.285 N/A THR 63.A OG1 ASN 60.A O no hydrogen 3.355 N/A VAL 64.A N ASN 60.A O no hydrogen 2.817 N/A ALA 65.A N SER 53.A O no hydrogen 3.129 N/A VAL 66.A N PHE 161.A O no hydrogen 2.673 N/A SER 67.A OG SER 45.A OG no hydrogen 2.712 N/A THR 68.A N SER 160.A OG no hydrogen 3.081 N/A THR 68.A OG1 HIS 49.A NE2 no hydrogen 2.935 N/A THR 68.A OG1 PHE 156.A O no hydrogen 2.901 N/A MET 73.A N ALA 70.A O no hydrogen 3.349 N/A GLY 74.A N ASN 71.A O no hydrogen 3.346 N/A HIS 75.A NE2 PRO 149.A O no hydrogen 2.709 N/A SER 76.A N MET 73.A O no hydrogen 3.464 N/A LEU 78.A N SER 76.A OG no hydrogen 2.971 N/A GLY 82.A N LEU 79.A O no hydrogen 2.876 N/A GLN 86.A N GLY 82.A O no hydrogen 2.708 N/A GLN 86.A NE2 PRO 83.A O no hydrogen 3.509 N/A GLY 87.A N LEU 80.A O no hydrogen 2.813 N/A ASP 88.A N ALA 85.A O no hydrogen 3.250 N/A ARG 91.A N ASP 88.A OD1 no hydrogen 2.758 N/A ARG 91.A NE GLN 94.A OE1 no hydrogen 2.532 N/A ARG 91.A NH2 GLN 94.A OE1 no hydrogen 3.017 N/A TRP 92.A NE1 LEU 78.A O no hydrogen 2.989 N/A CYS 93.A N PHE 89.A O no hydrogen 2.924 N/A CYS 93.A SG PHE 89.A O no hydrogen 3.415 N/A GLN 94.A N THR 90.A O no hydrogen 3.051 N/A LEU 95.A N ARG 91.A O no hydrogen 2.899 N/A GLY 96.A N CYS 93.A O no hydrogen 3.108 N/A GLY 97.A N TRP 92.A O no hydrogen 2.780 N/A TRP 99.A N GLY 96.A O no hydrogen 3.391 N/A THR 100.A OG1 LEU 77.A O no hydrogen 3.032 N/A THR 100.A OG1 GLY 97.A O no hydrogen 3.036 N/A PHE 101.A N GLY 97.A O no hydrogen 3.143 N/A ILE 102.A N LEU 98.A O no hydrogen 2.917 N/A ALA 103.A N TRP 99.A O no hydrogen 2.807 N/A LEU 104.A N THR 100.A O no hydrogen 3.065 N/A HIS 105.A N PHE 101.A O no hydrogen 3.051 N/A GLY 106.A N ILE 102.A O no hydrogen 2.794 N/A ALA 107.A N ALA 103.A O no hydrogen 2.804 N/A PHE 108.A N LEU 104.A O no hydrogen 3.226 N/A GLY 109.A N HIS 105.A O no hydrogen 2.875 N/A LEU 110.A N GLY 106.A O no hydrogen 2.920 N/A LEU 110.A N ALA 107.A O no hydrogen 3.138 N/A ILE 111.A N ALA 107.A O no hydrogen 3.210 N/A GLY 112.A N PHE 108.A O no hydrogen 2.867 N/A PHE 113.A N GLY 109.A O no hydrogen 3.076 N/A MET 114.A N LEU 110.A O no hydrogen 3.325 N/A LEU 115.A N ILE 111.A O no hydrogen 3.039 N/A ARG 116.A N GLY 112.A O no hydrogen 2.771 N/A GLN 117.A N PHE 113.A O no hydrogen 3.057 N/A PHE 118.A N MET 114.A O no hydrogen 2.921 N/A GLU 119.A N LEU 115.A O no hydrogen 2.677 N/A ILE 120.A N ARG 116.A O no hydrogen 2.712 N/A ALA 121.A N GLN 117.A O no hydrogen 2.985 N/A ARG 122.A N PHE 118.A O no hydrogen 3.150 N/A ARG 122.A NE ARG 122.A O no hydrogen 3.215 N/A LEU 123.A N GLU 119.A O no hydrogen 3.189 N/A VAL 124.A N ILE 120.A O no hydrogen 2.908 N/A VAL 126.A N ALA 121.A O no hydrogen 2.863 N/A ALA 131.A N PRO 128.A O no hydrogen 3.113 N/A ILE 132.A N PRO 128.A O no hydrogen 3.276 N/A ALA 133.A N TYR 129.A O no hydrogen 3.413 N/A PHE 134.A N ASN 130.A O no hydrogen 3.373 N/A SER 135.A N ILE 132.A O no hydrogen 3.205 N/A SER 135.A OG ILE 132.A O no hydrogen 2.531 N/A ALA 136.A N ALA 133.A O no hydrogen 3.256 N/A ALA 139.A N SER 135.A O no hydrogen 2.964 N/A VAL 140.A N ALA 136.A O no hydrogen 3.262 N/A PHE 141.A N PRO 137.A O no hydrogen 3.220 N/A VAL 142.A N ILE 138.A O no hydrogen 2.828 N/A SER 143.A N ALA 139.A O no hydrogen 2.743 N/A SER 143.A OG ALA 139.A O no hydrogen 2.990 N/A SER 143.A OG VAL 140.A O no hydrogen 2.913 N/A VAL 144.A N VAL 140.A O no hydrogen 2.782 N/A PHE 145.A N PHE 141.A O no hydrogen 2.855 N/A LEU 146.A N VAL 142.A O no hydrogen 3.170 N/A ILE 147.A N VAL 142.A O no hydrogen 2.762 N/A TYR 148.A N SER 143.A O no hydrogen 2.755 N/A TYR 148.A OH HIS 177.A NE2 no hydrogen 2.809 N/A LEU 150.A N LEU 146.A O no hydrogen 3.097 N/A GLY 151.A N ILE 147.A O no hydrogen 3.182 N/A GLY 151.A N TYR 148.A O no hydrogen 3.009 N/A GLN 152.A N TYR 148.A O no hydrogen 3.231 N/A GLN 152.A N PRO 149.A O no hydrogen 3.136 N/A GLN 152.A NE2 ASN 280.A OD1 no hydrogen 2.916 N/A SER 153.A OG ASN 71.A OD1 no hydrogen 2.957 N/A SER 154.A OG ASN 71.A OD1 no hydrogen 2.537 N/A TRP 155.A N GLY 74.A O no hydrogen 3.211 N/A TRP 155.A NE1 SER 76.A O no hydrogen 2.737 N/A PHE 156.A N SER 154.A OG no hydrogen 3.287 N/A ALA 158.A N TRP 155.A O no hydrogen 2.895 N/A PHE 161.A N VAL 66.A O no hydrogen 3.278 N/A ALA 164.A N LEU 62.A O no hydrogen 2.889 N/A ILE 166.A N VAL 163.A O no hydrogen 3.140 N/A PHE 167.A N VAL 163.A O no hydrogen 3.397 N/A ARG 168.A N ALA 164.A O no hydrogen 3.236 N/A LEU 170.A N ILE 166.A O no hydrogen 3.066 N/A LEU 171.A N PHE 167.A O no hydrogen 3.055 N/A PHE 172.A N ARG 168.A O no hydrogen 2.745 N/A PHE 173.A N PHE 169.A O no hydrogen 3.308 N/A GLN 174.A N LEU 170.A O no hydrogen 3.102 N/A GLN 174.A NE2 ASN 178.A OD1 no hydrogen 3.029 N/A GLN 174.A NE2 ASN 310.A OD1 no hydrogen 2.559 N/A GLY 175.A N LEU 171.A O no hydrogen 2.929 N/A PHE 176.A N PHE 172.A O no hydrogen 2.717 N/A HIS 177.A N PHE 173.A O no hydrogen 2.957 N/A HIS 177.A NE2 TYR 148.A OH no hydrogen 2.809 N/A ASN 178.A N GLN 174.A O no hydrogen 3.015 N/A ASN 178.A ND2 TYR 284.A O no hydrogen 2.934 N/A TRP 179.A N PHE 173.A O no hydrogen 3.039 N/A THR 180.A OG1 GLN 174.A OE1 no hydrogen 2.858 N/A LEU 181.A N ASN 178.A O no hydrogen 2.953 N/A ASN 182.A N TRP 179.A O no hydrogen 3.133 N/A PHE 184.A N ASN 182.A OD1 no hydrogen 2.907 N/A MET 186.A N ASN 182.A O no hydrogen 3.045 N/A MET 187.A N PRO 183.A O no hydrogen 3.095 N/A GLY 188.A N PHE 184.A O no hydrogen 3.112 N/A VAL 189.A N HIS 185.A O no hydrogen 3.049 N/A ALA 190.A N MET 186.A O no hydrogen 2.936 N/A GLY 191.A N MET 187.A O no hydrogen 2.925 N/A GLY 191.A N GLY 188.A O no hydrogen 2.996 N/A VAL 192.A N GLY 188.A O no hydrogen 2.987 N/A LEU 193.A N VAL 189.A O no hydrogen 2.598 N/A GLY 194.A N ALA 190.A O no hydrogen 3.016 N/A GLY 195.A N GLY 191.A O no hydrogen 2.648 N/A ALA 196.A N VAL 192.A O no hydrogen 2.795 N/A LEU 197.A N GLY 194.A O no hydrogen 3.300 N/A LEU 198.A N GLY 194.A O no hydrogen 3.100 N/A CYS 199.A N GLY 195.A O no hydrogen 3.094 N/A ILE 201.A N LEU 197.A O no hydrogen 2.690 N/A HIS 202.A N LEU 198.A O no hydrogen 2.999 N/A GLY 203.A N CYS 199.A O no hydrogen 3.358 N/A ALA 204.A N ALA 200.A O no hydrogen 3.097 N/A THR 205.A N ILE 201.A O no hydrogen 2.978 N/A THR 205.A OG1 ILE 201.A O no hydrogen 2.401 N/A VAL 206.A N HIS 202.A O no hydrogen 2.998 N/A GLU 207.A N GLY 203.A O no hydrogen 3.029 N/A ASN 208.A N ALA 204.A O no hydrogen 3.209 N/A ASN 208.A ND2 ALA 204.A O no hydrogen 2.336 N/A THR 209.A N VAL 206.A O no hydrogen 3.131 N/A THR 209.A OG1 SER 233.A O no hydrogen 3.063 N/A PHE 211.A N THR 231.A O no hydrogen 3.205 N/A GLN 212.A NE2 GLY 214.A O no hydrogen 3.079 N/A ALA 222.A N THR 219.A O no hydrogen 3.244 N/A SER 233.A N THR 209.A O no hydrogen 2.822 N/A SER 233.A OG THR 236.A OG1 no hydrogen 2.791 N/A MET 234.A N GLU 230.A OE2 no hydrogen 3.207 N/A THR 236.A N SER 233.A OG no hydrogen 3.130 N/A THR 236.A OG1 SER 233.A OG no hydrogen 2.791 N/A ALA 237.A N SER 233.A O no hydrogen 3.141 N/A ASN 238.A N MET 234.A O no hydrogen 3.133 N/A ASN 238.A ND2 PHE 249.A O no hydrogen 2.799 N/A ARG 239.A N VAL 235.A O no hydrogen 3.374 N/A PHE 240.A N THR 236.A O no hydrogen 2.969 N/A TRP 241.A N ALA 237.A O no hydrogen 3.241 N/A TRP 241.A NE1 THR 205.A OG1 no hydrogen 3.110 N/A SER 242.A N ASN 238.A O no hydrogen 3.035 N/A SER 242.A OG ASN 238.A O no hydrogen 2.655 N/A GLN 243.A N PHE 240.A O no hydrogen 2.837 N/A ILE 244.A N PHE 240.A O no hydrogen 3.118 N/A PHE 245.A N TRP 241.A O no hydrogen 2.888 N/A GLY 246.A N TRP 241.A O no hydrogen 2.946 N/A TRP 254.A N ASN 251.A O no hydrogen 2.819 N/A TRP 254.A N ASN 251.A OD1 no hydrogen 3.205 N/A LEU 255.A N ASN 251.A O no hydrogen 2.972 N/A HIS 256.A N LYS 252.A O no hydrogen 3.102 N/A HIS 256.A ND1 LYS 252.A O no hydrogen 2.462 N/A PHE 257.A N ARG 253.A O no hydrogen 3.379 N/A PHE 258.A N TRP 254.A O no hydrogen 2.811 N/A MET 259.A N LEU 255.A O no hydrogen 3.217 N/A LEU 260.A N HIS 256.A O no hydrogen 3.195 N/A LEU 260.A N PHE 257.A O no hydrogen 2.858 N/A PHE 261.A N PHE 257.A O no hydrogen 2.763 N/A VAL 262.A N PHE 258.A O no hydrogen 3.136 N/A VAL 264.A N LEU 260.A O no hydrogen 3.398 N/A THR 265.A N PHE 261.A O no hydrogen 2.796 N/A THR 265.A OG1 PHE 261.A O no hydrogen 2.704 N/A GLY 266.A N VAL 262.A O no hydrogen 3.166 N/A LEU 267.A N PRO 263.A O no hydrogen 3.312 N/A TRP 268.A N VAL 264.A O no hydrogen 3.283 N/A TRP 268.A NE1 SER 135.A OG no hydrogen 3.197 N/A MET 269.A N THR 265.A O no hydrogen 3.062 N/A SER 270.A N GLY 266.A O no hydrogen 3.055 N/A SER 270.A OG LEU 267.A O no hydrogen 2.674 N/A ALA 271.A N LEU 267.A O no hydrogen 3.061 N/A ALA 271.A N TRP 268.A O no hydrogen 3.207 N/A ILE 272.A N TRP 268.A O no hydrogen 3.217 N/A GLY 273.A N MET 269.A O no hydrogen 3.220 N/A VAL 274.A N SER 270.A O no hydrogen 3.322 N/A VAL 275.A N ALA 271.A O no hydrogen 2.895 N/A GLY 276.A N ILE 272.A O no hydrogen 3.059 N/A GLY 276.A N GLY 273.A O no hydrogen 3.235 N/A LEU 277.A N GLY 273.A O no hydrogen 3.122 N/A ALA 278.A N VAL 274.A O no hydrogen 3.103 N/A ASN 280.A N LEU 277.A O no hydrogen 2.992 N/A LEU 281.A N GLY 276.A O no hydrogen 2.776 N/A ARG 282.A N ASN 280.A O no hydrogen 2.764 N/A ARG 282.A NH1 HIS 177.A ND1 no hydrogen 3.160 N/A SER 283.A OG LEU 181.A O no hydrogen 3.327 N/A PHE 286.A N TYR 303.A OH no hydrogen 2.878 N/A GLN 289.A N PHE 286.A O no hydrogen 2.948 N/A GLU 290.A N PHE 286.A O no hydrogen 3.156 N/A ILE 291.A N ILE 287.A O no hydrogen 3.138 N/A ALA 293.A N GLN 289.A O no hydrogen 2.951 N/A ALA 294.A N GLU 290.A O no hydrogen 2.878 N/A GLU 295.A N ILE 291.A O no hydrogen 3.354 N/A ASP 296.A N ARG 292.A O no hydrogen 2.707 N/A GLU 298.A N ASP 296.A OD1 no hydrogen 3.168 N/A PHE 299.A N ASP 296.A O no hydrogen 3.442 N/A THR 301.A OG1 GLN 289.A OE1 no hydrogen 3.404 N/A TYR 303.A N THR 301.A OG1 no hydrogen 3.206 N/A TYR 303.A OH GLU 290.A OE2 no hydrogen 2.454 N/A THR 304.A N THR 301.A OG1 no hydrogen 3.372 N/A THR 304.A OG1 THR 301.A O no hydrogen 2.837 N/A LYS 305.A N THR 301.A O no hydrogen 3.211 N/A ASN 306.A N PHE 302.A O no hydrogen 3.393 N/A LEU 307.A N TYR 303.A O no hydrogen 3.336 N/A LEU 308.A N THR 304.A O no hydrogen 3.357 N/A LEU 309.A N LYS 305.A O no hydrogen 3.298 N/A ASN 310.A N ASN 306.A O no hydrogen 2.971 N/A GLU 311.A N LEU 307.A O no hydrogen 3.034 N/A GLY 312.A N LEU 308.A O no hydrogen 3.258 N/A ILE 313.A N LEU 309.A O no hydrogen 2.984 N/A ARG 314.A N ASN 310.A O no hydrogen 2.874 N/A ARG 314.A NH1 GLY 175.A O no hydrogen 2.973 N/A ARG 314.A NH1 TYR 284.A OH no hydrogen 2.564 N/A ARG 314.A NH2 GLU 311.A OE2 no hydrogen 3.556 N/A ALA 315.A N GLU 311.A O no hydrogen 3.080 N/A TRP 316.A N GLY 312.A O no hydrogen 3.107 N/A MET 317.A N ILE 313.A O no hydrogen 3.121 N/A ALA 318.A N ARG 314.A O no hydrogen 3.096 N/A ASP 321.A N MET 317.A O no hydrogen 2.974 N/A ASP 321.A N ALA 318.A O no hydrogen 3.303 N/A GLN 322.A N ALA 318.A O no hydrogen 2.826 N/A GLU 325.A N GLN 322.A O no hydrogen 3.003 N/A ASN 326.A N PRO 323.A O no hydrogen 2.938 N/A VAL 333.A N PRO 330.A O no hydrogen 2.939 N/A LEU 334.A N GLU 331.A O no hydrogen 3.380 N/A ARG 336.A NE LEU 340.A OXT no hydrogen 3.355 N/A ARG 336.A NH2 LEU 340.A O no hydrogen 2.389 N/A ARG 336.A NH2 LEU 340.A OXT no hydrogen 3.252 N/A LEU 340.A N ASN 338.A O no hydrogen 2.495 N/A