Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1psi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N ASN 355.A O no hydrogen 2.444 N/A ASN 7.A ND2 ILE 4.A O no hydrogen 3.379 N/A LEU 8.A N ILE 4.A O no hydrogen 2.952 N/A ALA 9.A N THR 5.A O no hydrogen 2.723 N/A GLU 10.A N PRO 6.A O no hydrogen 3.190 N/A PHE 11.A N ASN 7.A O no hydrogen 3.280 N/A ALA 12.A N LEU 8.A O no hydrogen 2.830 N/A PHE 13.A N ALA 9.A O no hydrogen 2.921 N/A SER 14.A N GLU 10.A O no hydrogen 3.045 N/A LEU 15.A N PHE 11.A O no hydrogen 2.822 N/A TYR 16.A N PHE 13.A O no hydrogen 3.010 N/A TYR 16.A OH GLU 241.A OE2 no hydrogen 2.659 N/A ARG 17.A N PHE 13.A O no hydrogen 2.822 N/A ARG 17.A NE GLU 241.A O no hydrogen 3.242 N/A GLN 18.A N SER 14.A O no hydrogen 3.135 N/A GLN 18.A NE2 GLN 282.A OE1 no hydrogen 2.858 N/A LEU 19.A N LEU 15.A O no hydrogen 3.420 N/A ALA 20.A N TYR 16.A O no hydrogen 2.687 N/A HIS 21.A N ARG 17.A O no hydrogen 3.211 N/A HIS 21.A ND1 ARG 17.A O no hydrogen 3.167 N/A GLN 22.A N GLN 18.A O no hydrogen 3.388 N/A SER 23.A N LEU 19.A O no hydrogen 2.998 N/A ASN 27.A N GLN 370.A OE1 no hydrogen 3.065 N/A ASN 27.A ND2 ASN 367.A O no hydrogen 2.856 N/A ILE 28.A N LYS 364.A O no hydrogen 2.925 N/A LEU 29.A N TYR 274.A OH no hydrogen 2.970 N/A PHE 30.A N MET 362.A O no hydrogen 3.140 N/A SER 31.A N HIS 311.A NE2 no hydrogen 3.197 N/A SER 31.A OG LEU 360.A O no hydrogen 2.794 N/A SER 34.A N SER 31.A OG no hydrogen 2.945 N/A SER 34.A OG ASN 164.A OD1 no hydrogen 2.717 N/A ILE 35.A N SER 31.A O no hydrogen 3.210 N/A ALA 36.A N PRO 32.A O no hydrogen 3.236 N/A THR 37.A N VAL 33.A O no hydrogen 3.025 N/A THR 37.A OG1 VAL 33.A O no hydrogen 2.829 N/A ALA 38.A N SER 34.A O no hydrogen 3.203 N/A ALA 38.A N ILE 35.A O no hydrogen 3.021 N/A PHE 39.A N ILE 35.A O no hydrogen 3.033 N/A ALA 40.A N ALA 36.A O no hydrogen 2.699 N/A MET 41.A N THR 37.A O no hydrogen 3.007 N/A LEU 42.A N ALA 38.A O no hydrogen 3.042 N/A SER 43.A N PHE 39.A O no hydrogen 3.057 N/A SER 43.A OG ALA 40.A O no hydrogen 2.619 N/A LEU 44.A N MET 41.A O no hydrogen 3.359 N/A GLY 45.A N LEU 42.A O no hydrogen 2.919 N/A THR 46.A N SER 43.A O no hydrogen 3.009 N/A THR 46.A OG1 SER 43.A O no hydrogen 2.637 N/A LYS 47.A N ASP 294.A O no hydrogen 3.119 N/A HIS 51.A N LYS 47.A O no hydrogen 3.258 N/A HIS 51.A N ALA 48.A O no hydrogen 2.865 N/A HIS 51.A ND1 ASP 52.A OD1 no hydrogen 3.012 N/A ASP 52.A N ALA 48.A O no hydrogen 3.026 N/A GLU 53.A N ASP 49.A O no hydrogen 2.815 N/A ILE 54.A N HIS 51.A O no hydrogen 2.788 N/A LEU 55.A N HIS 51.A O no hydrogen 3.161 N/A GLU 56.A N ASP 52.A O no hydrogen 2.879 N/A GLY 57.A N GLU 53.A O no hydrogen 2.791 N/A LEU 58.A N ILE 54.A O no hydrogen 2.796 N/A LEU 58.A N LEU 55.A O no hydrogen 3.098 N/A ASN 59.A N GLU 56.A O no hydrogen 3.138 N/A THR 63.A N ASN 61.A OD1 no hydrogen 3.248 N/A THR 63.A OG1 ASN 61.A OD1 no hydrogen 2.560 N/A GLU 64.A N ASN 61.A O no hydrogen 2.895 N/A ILE 65.A N ASN 61.A O no hydrogen 3.090 N/A GLN 69.A N PRO 66.A O no hydrogen 2.675 N/A ILE 70.A N PRO 66.A O no hydrogen 3.215 N/A HIS 71.A N GLU 67.A O no hydrogen 3.124 N/A HIS 71.A ND1 TYR 116.A OH no hydrogen 2.744 N/A GLU 72.A N ALA 68.A O no hydrogen 3.103 N/A GLY 73.A N GLN 69.A O no hydrogen 2.822 N/A PHE 74.A N ILE 70.A O no hydrogen 3.118 N/A GLN 75.A N HIS 71.A O no hydrogen 3.055 N/A GLU 76.A N GLU 72.A O no hydrogen 3.202 N/A LEU 77.A N GLY 73.A O no hydrogen 3.357 N/A LEU 78.A N PHE 74.A O no hydrogen 3.132 N/A ARG 79.A N GLN 75.A O no hydrogen 2.844 N/A THR 80.A N GLU 76.A O no hydrogen 3.090 N/A THR 80.A OG1 GLU 76.A O no hydrogen 3.184 N/A LEU 81.A N LEU 77.A O no hydrogen 2.826 N/A ASN 82.A N LEU 78.A O no hydrogen 2.714 N/A GLN 83.A N ARG 79.A O no hydrogen 3.447 N/A THR 91.A N PHE 167.A O no hydrogen 2.960 N/A GLY 93.A N TYR 165.A O no hydrogen 3.260 N/A ASN 94.A ND2 SER 118.A OG no hydrogen 3.373 N/A GLY 95.A N VAL 163.A O no hydrogen 2.922 N/A LEU 96.A N GLU 119.A O no hydrogen 2.838 N/A PHE 97.A N ALA 161.A O no hydrogen 2.757 N/A LEU 98.A N PHE 121.A O no hydrogen 2.776 N/A SER 99.A N VAL 159.A O no hydrogen 2.867 N/A SER 99.A OG GLU 100.A O no hydrogen 3.424 N/A GLU 100.A N VAL 123.A O no hydrogen 2.775 N/A LEU 102.A N SER 99.A O no hydrogen 3.276 N/A LEU 104.A N LEU 102.A O no hydrogen 2.924 N/A VAL 105.A N VAL 298.A O no hydrogen 2.766 N/A LEU 109.A N VAL 105.A O no hydrogen 3.324 N/A GLU 110.A N ASP 106.A O no hydrogen 2.863 N/A ASP 111.A N LYS 107.A O no hydrogen 2.936 N/A VAL 112.A N PHE 108.A O no hydrogen 2.816 N/A LYS 113.A N LEU 109.A O no hydrogen 3.121 N/A LYS 113.A NZ SER 118.A O no hydrogen 3.159 N/A LYS 114.A N GLU 110.A O no hydrogen 2.708 N/A LYS 114.A NZ GLU 110.A OE1 no hydrogen 3.212 N/A TYR 116.A N ASP 111.A O no hydrogen 2.825 N/A TYR 116.A OH HIS 71.A ND1 no hydrogen 2.744 N/A HIS 117.A ND1 LYS 113.A O no hydrogen 3.116 N/A SER 118.A N VAL 112.A O no hydrogen 2.830 N/A SER 118.A OG ASN 94.A O no hydrogen 2.615 N/A SER 118.A OG GLU 119.A O no hydrogen 3.394 N/A GLU 119.A N ASN 94.A O no hydrogen 2.852 N/A PHE 121.A N LEU 96.A O no hydrogen 2.642 N/A VAL 123.A N LEU 98.A O no hydrogen 2.804 N/A GLY 126.A N ASN 124.A OD1 no hydrogen 2.811 N/A ASP 127.A N ASN 124.A O no hydrogen 3.343 N/A ALA 131.A N ASP 127.A O no hydrogen 3.023 N/A LYS 132.A N THR 128.A O no hydrogen 3.206 N/A LYS 132.A NZ LYS 152.A O no hydrogen 2.869 N/A LYS 133.A N GLU 129.A O no hydrogen 3.061 N/A GLN 134.A N GLU 130.A O no hydrogen 2.736 N/A ILE 135.A N ALA 131.A O no hydrogen 2.697 N/A ASN 136.A N LYS 132.A O no hydrogen 2.710 N/A ASN 136.A ND2 VAL 151.A O no hydrogen 2.869 N/A ASP 137.A N LYS 133.A O no hydrogen 2.698 N/A VAL 139.A N ILE 135.A O no hydrogen 3.240 N/A GLU 140.A N ASN 136.A O no hydrogen 2.884 N/A LYS 141.A N ASP 137.A O no hydrogen 2.782 N/A GLY 142.A N TYR 138.A O no hydrogen 2.805 N/A THR 143.A N VAL 139.A O no hydrogen 2.647 N/A THR 143.A N GLU 140.A O no hydrogen 2.961 N/A THR 143.A OG1 VAL 139.A O no hydrogen 3.008 N/A THR 143.A OG1 GLU 140.A O no hydrogen 3.157 N/A GLN 144.A N LYS 141.A O no hydrogen 3.239 N/A GLY 145.A N GLU 140.A O no hydrogen 2.829 N/A LYS 146.A N THR 143.A O no hydrogen 3.081 N/A ILE 147.A N THR 143.A OG1 no hydrogen 2.925 N/A VAL 151.A N ASN 136.A OD1 no hydrogen 2.791 N/A THR 158.A OG1 ASP 155.A O no hydrogen 2.791 N/A ALA 161.A N PHE 97.A O no hydrogen 2.754 N/A LEU 162.A N LYS 308.A O no hydrogen 2.685 N/A VAL 163.A N GLY 95.A O no hydrogen 2.963 N/A ASN 164.A N VAL 310.A O no hydrogen 2.770 N/A ASN 164.A ND2 SER 34.A O no hydrogen 3.020 N/A ASN 164.A ND2 ASN 94.A OD1 no hydrogen 2.425 N/A TYR 165.A N GLY 93.A O no hydrogen 3.426 N/A ILE 166.A N LYS 312.A O no hydrogen 3.079 N/A PHE 167.A N THR 91.A O no hydrogen 2.840 N/A PHE 168.A N VAL 314.A O no hydrogen 2.849 N/A LYS 169.A NZ ASP 318.A OD2 no hydrogen 3.278 N/A TRP 172.A NE1 ASP 318.A O no hydrogen 2.765 N/A GLU 173.A N LYS 220.A O no hydrogen 3.283 N/A PHE 176.A N GLU 319.A O no hydrogen 2.826 N/A ASP 180.A N GLU 177.A O no hydrogen 2.927 N/A THR 181.A N VAL 178.A O no hydrogen 2.890 N/A THR 181.A OG1 VAL 178.A O no hydrogen 3.558 N/A THR 181.A OG1 GLU 319.A OE2 no hydrogen 2.537 N/A GLU 182.A N MET 198.A O no hydrogen 3.184 N/A GLU 184.A N VAL 196.A O no hydrogen 2.788 N/A HIS 187.A N ASN 344.A O no hydrogen 2.612 N/A HIS 187.A ND1 ASP 189.A O no hydrogen 2.726 N/A ASP 189.A N THR 192.A O no hydrogen 3.306 N/A VAL 194.A N PHE 186.A O no hydrogen 2.838 N/A VAL 196.A N GLU 184.A O no hydrogen 2.918 N/A MET 198.A N GLU 182.A O no hydrogen 2.685 N/A MET 199.A N LEU 265.A O no hydrogen 2.828 N/A LYS 200.A NZ ASP 180.A O no hydrogen 2.651 N/A LYS 200.A NZ GLU 184.A OE2 no hydrogen 3.302 N/A ARG 201.A N LEU 263.A O no hydrogen 2.908 N/A ARG 201.A NH1 GLU 331.A OE1 no hydrogen 3.349 N/A GLY 203.A N ALA 261.A O no hydrogen 3.059 N/A MET 204.A N GLU 331.A OE1 no hydrogen 2.833 N/A PHE 205.A N ARG 259.A O no hydrogen 2.795 N/A ASN 206.A ND2 ASN 255.A OD1 no hydrogen 3.077 N/A GLN 208.A N VAL 216.A O no hydrogen 3.000 N/A HIS 209.A NE2 ASP 233.A OD1 no hydrogen 2.828 N/A SER 213.A N LYS 210.A O no hydrogen 2.829 N/A SER 213.A OG LYS 210.A O no hydrogen 3.246 N/A SER 214.A OG LEU 212.A O no hydrogen 2.815 N/A TRP 215.A N LEU 231.A O no hydrogen 2.944 N/A VAL 216.A N GLN 208.A O no hydrogen 2.760 N/A LEU 217.A N PHE 229.A O no hydrogen 2.996 N/A LEU 218.A N ASN 206.A O no hydrogen 3.152 N/A MET 219.A N ALA 227.A O no hydrogen 2.706 N/A TYR 221.A N ALA 225.A O no hydrogen 2.927 N/A LEU 222.A N LYS 171.A O no hydrogen 2.762 N/A ASN 224.A ND2 GLU 353.A OE2 no hydrogen 2.850 N/A THR 226.A N ILE 352.A O no hydrogen 2.704 N/A ALA 227.A N MET 219.A O no hydrogen 2.692 N/A ILE 228.A N LEU 350.A O no hydrogen 2.764 N/A PHE 229.A N LEU 217.A O no hydrogen 2.951 N/A PHE 230.A N VAL 348.A O no hydrogen 2.827 N/A LEU 231.A N TRP 215.A O no hydrogen 2.848 N/A ASP 233.A N SER 213.A O no hydrogen 2.770 N/A LYS 236.A N ASP 233.A O no hydrogen 3.112 N/A GLN 238.A NE2 HIS 21.A NE2 no hydrogen 3.614 N/A HIS 239.A NE2 LYS 211.A O no hydrogen 2.606 N/A LEU 240.A N LYS 236.A O no hydrogen 3.276 N/A GLU 241.A N LEU 237.A O no hydrogen 3.078 N/A ASN 242.A N GLN 238.A O no hydrogen 3.013 N/A GLU 243.A N HIS 239.A O no hydrogen 2.686 N/A LEU 244.A N LEU 240.A O no hydrogen 3.023 N/A ILE 248.A N THR 245.A OG1 no hydrogen 2.935 N/A ILE 249.A N THR 245.A O no hydrogen 3.029 N/A THR 250.A N HIS 246.A O no hydrogen 2.845 N/A THR 250.A OG1 HIS 246.A O no hydrogen 2.802 N/A LYS 251.A N ASP 247.A O no hydrogen 2.811 N/A PHE 252.A N ILE 248.A O no hydrogen 3.013 N/A LEU 253.A N ILE 249.A O no hydrogen 2.936 N/A GLU 254.A N THR 250.A O no hydrogen 2.901 N/A ASN 255.A N PHE 252.A O no hydrogen 2.809 N/A ASN 255.A ND2 ASP 257.A OD2 no hydrogen 2.941 N/A ARG 258.A NH1 MET 204.A O no hydrogen 3.388 N/A ARG 259.A N PHE 205.A O no hydrogen 2.937 N/A ALA 261.A N GLY 203.A O no hydrogen 2.911 N/A SER 262.A N PRO 339.A O no hydrogen 2.974 N/A LEU 263.A N ARG 201.A O no hydrogen 2.979 N/A HIS 264.A N VAL 341.A O no hydrogen 2.783 N/A LEU 265.A N MET 199.A O no hydrogen 2.939 N/A LYS 267.A N PRO 197.A O no hydrogen 2.871 N/A LYS 267.A NZ GLU 319.A OE1 no hydrogen 3.491 N/A LEU 268.A N ILE 317.A O no hydrogen 2.965 N/A THR 271.A OG1 LYS 371.A OXT no hydrogen 3.183 N/A GLY 272.A N ALA 313.A O no hydrogen 2.684 N/A TYR 274.A N HIS 311.A O no hydrogen 2.729 N/A LEU 276.A N ALA 309.A O no hydrogen 2.855 N/A LYS 277.A N ASP 275.A OD1 no hydrogen 3.146 N/A VAL 279.A N ASP 275.A O no hydrogen 2.878 N/A LEU 280.A N LEU 276.A O no hydrogen 2.783 N/A GLY 281.A N LYS 277.A O no hydrogen 3.095 N/A GLN 282.A N SER 278.A O no hydrogen 3.054 N/A GLN 282.A N VAL 279.A O no hydrogen 3.159 N/A LEU 283.A N LEU 280.A O no hydrogen 2.746 N/A GLY 284.A N GLY 281.A O no hydrogen 2.845 N/A ILE 285.A N LEU 280.A O no hydrogen 2.998 N/A THR 286.A N GLU 53.A OE1 no hydrogen 2.977 N/A LYS 287.A N GLU 53.A OE1 no hydrogen 2.855 N/A PHE 289.A N THR 286.A O no hydrogen 3.170 N/A SER 290.A N LYS 287.A O no hydrogen 3.307 N/A ASN 291.A N SER 290.A OG no hydrogen 2.634 N/A ALA 293.A N SER 290.A O no hydrogen 2.916 N/A ASP 294.A N THR 50.A OG1 no hydrogen 3.076 N/A SER 296.A OG ASP 294.A OD1 no hydrogen 2.481 N/A GLY 297.A N GLY 45.A O no hydrogen 2.946 N/A VAL 298.A N LEU 295.A O no hydrogen 2.864 N/A THR 299.A N LEU 295.A O no hydrogen 2.974 N/A LYS 305.A NZ ASP 157.A OD2 no hydrogen 3.421 N/A LYS 305.A NZ ASN 291.A OD1 no hydrogen 2.600 N/A LEU 306.A N VAL 288.A O no hydrogen 2.789 N/A SER 307.A N PHE 160.A O no hydrogen 3.171 N/A LYS 308.A N PHE 160.A O no hydrogen 3.413 N/A LYS 308.A NZ GLU 153.A O no hydrogen 3.188 N/A VAL 310.A N LEU 162.A O no hydrogen 2.958 N/A HIS 311.A N TYR 274.A O no hydrogen 2.854 N/A HIS 311.A ND1 ASN 164.A OD1 no hydrogen 2.781 N/A LYS 312.A N ASN 164.A O no hydrogen 3.049 N/A LYS 312.A NZ THR 273.A OG1 no hydrogen 2.968 N/A ALA 313.A N GLY 272.A O no hydrogen 2.716 N/A VAL 314.A N ILE 166.A O no hydrogen 2.858 N/A LEU 315.A N ILE 270.A O no hydrogen 2.943 N/A THR 316.A N PHE 168.A O no hydrogen 2.898 N/A ILE 317.A N LEU 268.A O no hydrogen 2.699 N/A LYS 320.A NZ GLY 326.A O no hydrogen 3.219 N/A VAL 341.A N SER 262.A O no hydrogen 2.891 N/A PHE 343.A N HIS 264.A O no hydrogen 2.764 N/A LYS 345.A NZ PRO 232.A O no hydrogen 3.035 N/A PHE 347.A N VAL 365.A O no hydrogen 3.044 N/A VAL 348.A N PHE 230.A O no hydrogen 3.111 N/A PHE 349.A N GLY 363.A O no hydrogen 2.866 N/A LEU 350.A N ILE 228.A O no hydrogen 2.811 N/A MET 351.A N PHE 361.A O no hydrogen 2.840 N/A ILE 352.A N THR 226.A O no hydrogen 2.854 N/A GLU 353.A N SER 358.A O no hydrogen 3.281 N/A GLN 354.A N ASN 224.A O no hydrogen 2.631 N/A ASN 355.A N GLU 353.A OE2 no hydrogen 3.183 N/A ASN 355.A ND2 ASP 85.A OD2 no hydrogen 3.155 N/A ASN 355.A ND2 GLU 353.A OE2 no hydrogen 2.952 N/A THR 356.A N GLU 353.A OE1 no hydrogen 2.832 N/A THR 356.A OG1 GLU 353.A OE1 no hydrogen 2.967 N/A THR 356.A OG1 SER 358.A OG no hydrogen 2.798 N/A LYS 357.A N GLU 353.A O no hydrogen 2.685 N/A SER 358.A N THR 356.A OG1 no hydrogen 3.252 N/A SER 358.A OG THR 356.A OG1 no hydrogen 2.798 N/A LEU 360.A N MET 351.A O no hydrogen 2.705 N/A PHE 361.A N MET 351.A O no hydrogen 3.353 N/A MET 362.A N PHE 30.A O no hydrogen 3.001 N/A GLY 363.A N PHE 349.A O no hydrogen 3.025 N/A LYS 364.A N ILE 28.A O no hydrogen 3.186 N/A LYS 364.A NZ GLU 241.A OE2 no hydrogen 3.258 N/A VAL 365.A N PHE 347.A O no hydrogen 2.821 N/A VAL 366.A N ASN 27.A OD1 no hydrogen 2.816 N/A ASN 367.A N ASN 27.A OD1 no hydrogen 3.036 N/A THR 369.A N ASN 367.A OD1 no hydrogen 2.962 N/A THR 369.A OG1 ASN 367.A OD1 no hydrogen 2.984 N/A GLN 370.A N ASN 367.A O no hydrogen 2.925 N/A